smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ncc([N+](=O)[O-])c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626781 719073746 /nfs/dbraw/zinc/07/37/46/719073746.db2.gz PIORDQWIKYETBD-AEFFLSMTSA-N 1 1 353.426 2.794 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637565 719238930 /nfs/dbraw/zinc/23/89/30/719238930.db2.gz WKEHKSUGUMAWMA-BQBZGAKWSA-N 1 1 353.732 2.586 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637565 719238933 /nfs/dbraw/zinc/23/89/33/719238933.db2.gz WKEHKSUGUMAWMA-BQBZGAKWSA-N 1 1 353.732 2.586 20 5 FFBDMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncc(F)cc1[N+](=O)[O-])CC2 ZINC001164647874 719308346 /nfs/dbraw/zinc/30/83/46/719308346.db2.gz OCBVXGXBEVVGPH-UHFFFAOYSA-N 1 1 362.409 2.531 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723562 720350047 /nfs/dbraw/zinc/35/00/47/720350047.db2.gz HYBPQQIBCATRMQ-UONOGXRCSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785874 721404790 /nfs/dbraw/zinc/40/47/90/721404790.db2.gz NLMOEDNZLMATAC-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000152997450 728770235 /nfs/dbraw/zinc/77/02/35/728770235.db2.gz FPKZAGGLBAXCKK-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000152997450 728770237 /nfs/dbraw/zinc/77/02/37/728770237.db2.gz FPKZAGGLBAXCKK-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO CCOC(=O)C1([N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000154646157 728808865 /nfs/dbraw/zinc/80/88/65/728808865.db2.gz RQSMDJPIKRIVQV-MRXNPFEDSA-N 1 1 350.415 2.826 20 5 FFBDMO CCOC(=O)C1([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000154646157 728808870 /nfs/dbraw/zinc/80/88/70/728808870.db2.gz RQSMDJPIKRIVQV-MRXNPFEDSA-N 1 1 350.415 2.826 20 5 FFBDMO CC[N@@H+](CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C(C)C ZINC000110483201 728531954 /nfs/dbraw/zinc/53/19/54/728531954.db2.gz VZVYXTRJDFCERP-UHFFFAOYSA-N 1 1 365.402 2.733 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000112681453 728547451 /nfs/dbraw/zinc/54/74/51/728547451.db2.gz OYBNEORFIQHGOQ-CYBMUJFWSA-N 1 1 370.837 2.607 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000120308253 728609649 /nfs/dbraw/zinc/60/96/49/728609649.db2.gz IFHZWWMZUHARGS-VXGBXAGGSA-N 1 1 373.500 2.588 20 5 FFBDMO COc1cc(C[N@@H+](C)CC2(O)CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000152153785 728748779 /nfs/dbraw/zinc/74/87/79/728748779.db2.gz LWMRHHNMMASIHH-UHFFFAOYSA-N 1 1 360.357 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000174858470 729081502 /nfs/dbraw/zinc/08/15/02/729081502.db2.gz HOSGBHKBGAJQRZ-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000174858470 729081505 /nfs/dbraw/zinc/08/15/05/729081505.db2.gz HOSGBHKBGAJQRZ-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO C[C@H]1CN(c2cccc(Br)c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000856744104 730353339 /nfs/dbraw/zinc/35/33/39/730353339.db2.gz GUVJLAHDAZJVHY-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1[C@H](C)CC[C@H]1C ZINC000859567882 730459211 /nfs/dbraw/zinc/45/92/11/730459211.db2.gz WCEXGPNAKKHBCK-IJLUTSLNSA-N 1 1 352.362 2.721 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc1Cl ZINC000866205019 731040588 /nfs/dbraw/zinc/04/05/88/731040588.db2.gz IUDIKVAHRIGUDD-GXFFZTMASA-N 1 1 353.806 2.565 20 5 FFBDMO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1n[nH]cc1Br ZINC000866269944 731045251 /nfs/dbraw/zinc/04/52/51/731045251.db2.gz PCSZALFPHQUQIT-QMMMGPOBSA-N 1 1 357.183 2.940 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000874825155 732104005 /nfs/dbraw/zinc/10/40/05/732104005.db2.gz WZQRPJNHULKEAN-NWDGAFQWSA-N 1 1 368.231 2.666 20 5 FFBDMO CC(C)(C)S(=O)(=O)CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000877036592 732315804 /nfs/dbraw/zinc/31/58/04/732315804.db2.gz RFBMLOMYUYRFGS-UHFFFAOYSA-N 1 1 368.377 2.917 20 5 FFBDMO CC[N@H+]1CCN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000878297884 732511328 /nfs/dbraw/zinc/51/13/28/732511328.db2.gz BLPRISWPYGLCTN-NSHDSACASA-N 1 1 365.821 2.824 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC1(C)COC1 ZINC000879035759 732634593 /nfs/dbraw/zinc/63/45/93/732634593.db2.gz WRYNRRIWCDDESH-UHFFFAOYSA-N 1 1 352.778 2.767 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC1(C)COC1 ZINC000879035759 732634595 /nfs/dbraw/zinc/63/45/95/732634595.db2.gz WRYNRRIWCDDESH-UHFFFAOYSA-N 1 1 352.778 2.767 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560074 732723314 /nfs/dbraw/zinc/72/33/14/732723314.db2.gz FBLCDMGVUDYBIW-MNOVXSKESA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2CSC[C@@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560074 732723317 /nfs/dbraw/zinc/72/33/17/732723317.db2.gz FBLCDMGVUDYBIW-MNOVXSKESA-N 1 1 355.847 2.872 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000879563080 732724422 /nfs/dbraw/zinc/72/44/22/732724422.db2.gz QGCXSGGKWFGBFE-OLZOCXBDSA-N 1 1 363.439 2.578 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CCOCC1 ZINC000879710551 732756751 /nfs/dbraw/zinc/75/67/51/732756751.db2.gz BRUWWBJQERLLHP-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435029 732907521 /nfs/dbraw/zinc/90/75/21/732907521.db2.gz IDYISIWMSAMWBA-YPMHNXCESA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435029 732907522 /nfs/dbraw/zinc/90/75/22/732907522.db2.gz IDYISIWMSAMWBA-YPMHNXCESA-N 1 1 359.220 2.593 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]2COCC[C@@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000782510387 738728802 /nfs/dbraw/zinc/72/88/02/738728802.db2.gz HTLDPQVDFXYEGH-LRDDRELGSA-N 1 1 351.378 2.563 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000888834532 734103764 /nfs/dbraw/zinc/10/37/64/734103764.db2.gz KVGOKEPDGQTUND-CYBMUJFWSA-N 1 1 350.419 2.845 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000888834674 734103868 /nfs/dbraw/zinc/10/38/68/734103868.db2.gz NIEWIYQRLGJVBB-JSGCOSHPSA-N 1 1 350.419 2.940 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@H](C2OCCO2)C1 ZINC000718978861 734377178 /nfs/dbraw/zinc/37/71/78/734377178.db2.gz GBLOGJFBSUXQQW-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@H](C2OCCO2)C1 ZINC000718978861 734377181 /nfs/dbraw/zinc/37/71/81/734377181.db2.gz GBLOGJFBSUXQQW-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)CCS3(=O)=O)cc1Cl ZINC000783649969 738822856 /nfs/dbraw/zinc/82/28/56/738822856.db2.gz IOTYHTOSUJMXJM-UHFFFAOYSA-N 1 1 366.826 2.868 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678299 738826340 /nfs/dbraw/zinc/82/63/40/738826340.db2.gz ZBFBVNGXOPGCCK-OLZOCXBDSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678299 738826344 /nfs/dbraw/zinc/82/63/44/738826344.db2.gz ZBFBVNGXOPGCCK-OLZOCXBDSA-N 1 1 356.806 2.791 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000783923300 738849106 /nfs/dbraw/zinc/84/91/06/738849106.db2.gz IVIBMORPXGZHMO-INIZCTEOSA-N 1 1 354.378 2.570 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000783920752 738849218 /nfs/dbraw/zinc/84/92/18/738849218.db2.gz OJSVAZVDCJKTSZ-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@H]2C)cc1SC ZINC000742241193 735213988 /nfs/dbraw/zinc/21/39/88/735213988.db2.gz XTGOBQIQTWRCCI-LLVKDONJSA-N 1 1 353.444 2.539 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000755036488 736228215 /nfs/dbraw/zinc/22/82/15/736228215.db2.gz XMGCQWZOWKJFLO-SNVBAGLBSA-N 1 1 371.235 2.821 20 5 FFBDMO CN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@H+](C2CC2)C1 ZINC000757262649 736399386 /nfs/dbraw/zinc/39/93/86/736399386.db2.gz PHPMWWGUEZUGEF-AWEZNQCLSA-N 1 1 352.822 2.626 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000761051164 736690628 /nfs/dbraw/zinc/69/06/28/736690628.db2.gz UWJSSXRCHOGGDO-JTQLQIEISA-N 1 1 361.320 2.816 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C1 ZINC000910285296 737053335 /nfs/dbraw/zinc/05/33/35/737053335.db2.gz XDKHXKAAVPVQTK-NSHDSACASA-N 1 1 357.357 2.753 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000769305116 737515779 /nfs/dbraw/zinc/51/57/79/737515779.db2.gz IDDSWLFAKIWALK-LLVKDONJSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000769305116 737515780 /nfs/dbraw/zinc/51/57/80/737515780.db2.gz IDDSWLFAKIWALK-LLVKDONJSA-N 1 1 371.231 2.942 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000771756897 737752874 /nfs/dbraw/zinc/75/28/74/737752874.db2.gz SSPSDQGZUZGQHQ-ZDUSSCGKSA-N 1 1 373.450 2.585 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@@H+]1CCc2sccc2C1 ZINC000921161560 737949079 /nfs/dbraw/zinc/94/90/79/737949079.db2.gz JIRMUAHCCXONBV-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@H+]1CCc2sccc2C1 ZINC000921161560 737949083 /nfs/dbraw/zinc/94/90/83/737949083.db2.gz JIRMUAHCCXONBV-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000922226252 738108221 /nfs/dbraw/zinc/10/82/21/738108221.db2.gz USWXYTVQZPSAJK-NOZJJQNGSA-N 1 1 360.336 2.505 20 5 FFBDMO Cc1[nH]c2ccc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])cc2[nH+]1 ZINC000776795456 738233977 /nfs/dbraw/zinc/23/39/77/738233977.db2.gz UIFUOQGCVGUKBK-UHFFFAOYSA-N 1 1 360.395 2.764 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000923298434 738267323 /nfs/dbraw/zinc/26/73/23/738267323.db2.gz CKLLBHJYVLUOEE-YUTCNCBUSA-N 1 1 367.833 2.711 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931724389 739318140 /nfs/dbraw/zinc/31/81/40/739318140.db2.gz AOWLJYGAVQQNRH-BZPMIXESSA-N 1 1 366.849 2.744 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000791119952 739531460 /nfs/dbraw/zinc/53/14/60/739531460.db2.gz UMNSKZAYYSLEEG-OAHLLOKOSA-N 1 1 368.455 2.587 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](Cc2nccs2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000934331198 739766132 /nfs/dbraw/zinc/76/61/32/739766132.db2.gz ZANSBOJMPHEPKT-CYBMUJFWSA-N 1 1 360.439 2.945 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000935685974 739994253 /nfs/dbraw/zinc/99/42/53/739994253.db2.gz JBODGVCAQPCLOC-ZIAGYGMSSA-N 1 1 353.419 2.575 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000935685963 739994272 /nfs/dbraw/zinc/99/42/72/739994272.db2.gz JAVLKFWGYMUVKP-GDBMZVCRSA-N 1 1 369.824 2.826 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796163891 740110162 /nfs/dbraw/zinc/11/01/62/740110162.db2.gz REIUTKXXDBMXDU-OAHLLOKOSA-N 1 1 351.403 2.574 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000796165170 740110856 /nfs/dbraw/zinc/11/08/56/740110856.db2.gz PWIZLVYZTKJANS-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000796165170 740110857 /nfs/dbraw/zinc/11/08/57/740110857.db2.gz PWIZLVYZTKJANS-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](CCO)Cc2cccnc2Cl)cc1 ZINC000796561458 740154636 /nfs/dbraw/zinc/15/46/36/740154636.db2.gz LDZLBLDLMCLEPV-UHFFFAOYSA-N 1 1 365.817 2.907 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+](CCO)Cc2cccnc2Cl)cc1 ZINC000796561458 740154639 /nfs/dbraw/zinc/15/46/39/740154639.db2.gz LDZLBLDLMCLEPV-UHFFFAOYSA-N 1 1 365.817 2.907 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1CCCCC1 ZINC000801808278 740653498 /nfs/dbraw/zinc/65/34/98/740653498.db2.gz QYSQWPDKZVQNJV-UHFFFAOYSA-N 1 1 352.410 2.701 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000807748234 741153542 /nfs/dbraw/zinc/15/35/42/741153542.db2.gz QLWAWSRPDYQBHA-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000810121247 741389708 /nfs/dbraw/zinc/38/97/08/741389708.db2.gz TWQNTHRGHZWFGL-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000811445631 741522110 /nfs/dbraw/zinc/52/21/10/741522110.db2.gz UQKXXUUWZMGPEM-QGZVFWFLSA-N 1 1 352.362 2.533 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000811445631 741522112 /nfs/dbraw/zinc/52/21/12/741522112.db2.gz UQKXXUUWZMGPEM-QGZVFWFLSA-N 1 1 352.362 2.533 20 5 FFBDMO C[C@@H](C[N+](=O)[O-])OC(=O)c1ccccc1OCC[N@H+]1CCCC[C@H]1C ZINC000814045107 741787799 /nfs/dbraw/zinc/78/77/99/741787799.db2.gz MTIWIMDSXLCWFA-CABCVRRESA-N 1 1 350.415 2.762 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000815145233 741906938 /nfs/dbraw/zinc/90/69/38/741906938.db2.gz PUTUSNXMFFOGIK-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000823503490 742927853 /nfs/dbraw/zinc/92/78/53/742927853.db2.gz UGGZPJWUNDKVDP-AEFFLSMTSA-N 1 1 350.415 2.682 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCC2CCCCCC2)CC1 ZINC001045437696 743274928 /nfs/dbraw/zinc/27/49/28/743274928.db2.gz YZFJSEXMMWINOB-IAGOWNOFSA-N 1 1 351.491 2.983 20 5 FFBDMO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CS1(=O)=O ZINC000827163979 743523833 /nfs/dbraw/zinc/52/38/33/743523833.db2.gz ALWWTXKBLMVTBT-KCJUWKMLSA-N 1 1 367.254 2.957 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827286691 743548547 /nfs/dbraw/zinc/54/85/47/743548547.db2.gz HXMGZOPXZXTHMY-YPMHNXCESA-N 1 1 369.874 2.893 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000827588841 743607344 /nfs/dbraw/zinc/60/73/44/743607344.db2.gz PRKSPFPWQXUREL-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000827588841 743607346 /nfs/dbraw/zinc/60/73/46/743607346.db2.gz PRKSPFPWQXUREL-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1NC[C@H]1CCC[N@@H+]1CCCO ZINC000828420518 745064838 /nfs/dbraw/zinc/06/48/38/745064838.db2.gz CPYGIYNKLKKWRE-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000837478192 746455433 /nfs/dbraw/zinc/45/54/33/746455433.db2.gz XFOZIULXLLIZGQ-CYBMUJFWSA-N 1 1 354.378 2.919 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498328 746840837 /nfs/dbraw/zinc/84/08/37/746840837.db2.gz SDRUMQMHTUHIIQ-HUUCEWRRSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498328 746840844 /nfs/dbraw/zinc/84/08/44/746840844.db2.gz SDRUMQMHTUHIIQ-HUUCEWRRSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839537863 746850481 /nfs/dbraw/zinc/85/04/81/746850481.db2.gz WVFOODHYNZGTEZ-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839537863 746850487 /nfs/dbraw/zinc/85/04/87/746850487.db2.gz WVFOODHYNZGTEZ-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000846914171 748573452 /nfs/dbraw/zinc/57/34/52/748573452.db2.gz YEMRTFNXXMCTQH-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000846930021 748578006 /nfs/dbraw/zinc/57/80/06/748578006.db2.gz PQFLWNGSFMKQCB-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO COc1cc(CO[NH+]=C(N)[C@@H]2C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000848523085 748949410 /nfs/dbraw/zinc/94/94/10/748949410.db2.gz ZOPQIFZNHDPSLD-PSASIEDQSA-N 1 1 359.329 2.902 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)ccc1Cl ZINC000848930043 749037671 /nfs/dbraw/zinc/03/76/71/749037671.db2.gz MUVZDUJIIMPMEE-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)ccc1Cl ZINC000848930043 749037674 /nfs/dbraw/zinc/03/76/74/749037674.db2.gz MUVZDUJIIMPMEE-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO C[C@@H]1C[NH+](Cc2ccc(C(=O)OCC(C)(C)[N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000851130497 749514802 /nfs/dbraw/zinc/51/48/02/749514802.db2.gz XRKTZBABBVAVAJ-ZIAGYGMSSA-N 1 1 350.415 2.508 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000852707357 749930323 /nfs/dbraw/zinc/93/03/23/749930323.db2.gz GSDTVRMQQOCIRE-CQSZACIVSA-N 1 1 374.268 2.933 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-] ZINC000853747431 750151759 /nfs/dbraw/zinc/15/17/59/750151759.db2.gz RANMOSXGJPQIBS-GFCCVEGCSA-N 1 1 352.391 2.588 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000854569205 750330884 /nfs/dbraw/zinc/33/08/84/750330884.db2.gz IPCKVGOVNAYYPH-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000895987115 971132824 /nfs/dbraw/zinc/13/28/24/971132824.db2.gz AXYZWTIROXSSTD-UHFFFAOYSA-N 1 1 355.398 2.879 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000824414165 946699936 /nfs/dbraw/zinc/69/99/36/946699936.db2.gz VXWZSRUILTUQOR-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759904787 971931886 /nfs/dbraw/zinc/93/18/86/971931886.db2.gz FCKJLYOKHQKZAR-CYBMUJFWSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759904787 971931893 /nfs/dbraw/zinc/93/18/93/971931893.db2.gz FCKJLYOKHQKZAR-CYBMUJFWSA-N 1 1 370.384 2.767 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2csc(C)c2)CC1 ZINC001266386622 960195836 /nfs/dbraw/zinc/19/58/36/960195836.db2.gz LVDIYJVBZQMNAD-IAGOWNOFSA-N 1 1 365.499 2.925 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872274724 1013195706 /nfs/dbraw/zinc/19/57/06/1013195706.db2.gz APKZNZULFQRJTK-SJLPKXTDSA-N 1 1 364.442 2.758 20 5 FFBDMO O=C(CCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942893 960542818 /nfs/dbraw/zinc/54/28/18/960542818.db2.gz GEZRZMHTPNXOPD-CRAIPNDOSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942893 960542885 /nfs/dbraw/zinc/54/28/85/960542885.db2.gz GEZRZMHTPNXOPD-CRAIPNDOSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942893 960542897 /nfs/dbraw/zinc/54/28/97/960542897.db2.gz GEZRZMHTPNXOPD-CRAIPNDOSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](OC2CCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000872280603 1013198373 /nfs/dbraw/zinc/19/83/73/1013198373.db2.gz RYLIQYQUHPMEGT-SFHVURJKSA-N 1 1 373.453 2.908 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001174964779 1013355093 /nfs/dbraw/zinc/35/50/93/1013355093.db2.gz HOYHTNMAXQORLR-AWEZNQCLSA-N 1 1 358.398 2.527 20 5 FFBDMO CN(C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCC[N@@H+](C)C1 ZINC000894477400 965404774 /nfs/dbraw/zinc/40/47/74/965404774.db2.gz PYFSUVKYHMQBHT-CYBMUJFWSA-N 1 1 374.363 2.849 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001211531647 965606033 /nfs/dbraw/zinc/60/60/33/965606033.db2.gz YZARDEOMEJUYMZ-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO Cn1nc2c(c1C[N@H+]1CCC[C@H](c3ccc([N+](=O)[O-])cc3)C1)COCC2 ZINC000894719220 965630252 /nfs/dbraw/zinc/63/02/52/965630252.db2.gz NCDRBURTNROCSV-HNNXBMFYSA-N 1 1 356.426 2.781 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2CC[NH+](C/C=C\c3ccccc3)CC2)cc1 ZINC000033409504 966262364 /nfs/dbraw/zinc/26/23/64/966262364.db2.gz OPZYKJXPYQSPLO-PAKAJVGYSA-N 1 1 367.449 2.959 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCN(C/C=C\c3ccccc3)CC2)cc1 ZINC000033409504 966262370 /nfs/dbraw/zinc/26/23/70/966262370.db2.gz OPZYKJXPYQSPLO-PAKAJVGYSA-N 1 1 367.449 2.959 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2ccccc2c1 ZINC001029304633 967648698 /nfs/dbraw/zinc/64/86/98/967648698.db2.gz CVTKFDLLBOLAAA-IYWMVGAKSA-N 1 1 365.433 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2ccccc2c1 ZINC001029304633 967648705 /nfs/dbraw/zinc/64/87/05/967648705.db2.gz CVTKFDLLBOLAAA-IYWMVGAKSA-N 1 1 365.433 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2ccccc2c1 ZINC001029304633 967648709 /nfs/dbraw/zinc/64/87/09/967648709.db2.gz CVTKFDLLBOLAAA-IYWMVGAKSA-N 1 1 365.433 2.680 20 5 FFBDMO C[C@@H]1CCC[C@@H](CC[NH+](C)C)N1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000893011139 970495835 /nfs/dbraw/zinc/49/58/35/970495835.db2.gz CCLNHBAURYZXJZ-OLZOCXBDSA-N 1 1 359.430 2.806 20 5 FFBDMO CN(C)c1cc[nH+]c(CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])c1 ZINC000895471221 970650351 /nfs/dbraw/zinc/65/03/51/970650351.db2.gz LIXBQMHDKGFYLO-UHFFFAOYSA-N 1 1 371.441 2.500 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1 ZINC000875745073 1014070663 /nfs/dbraw/zinc/07/06/63/1014070663.db2.gz HRXTUZHZPANRSR-SJORKVTESA-N 1 1 371.441 2.565 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CC[N@@H+]1C1CCOCC1 ZINC000897228919 973479579 /nfs/dbraw/zinc/47/95/79/973479579.db2.gz OSKZHUHRXHZBHJ-HNNXBMFYSA-N 1 1 373.375 2.957 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000897228919 973479588 /nfs/dbraw/zinc/47/95/88/973479588.db2.gz OSKZHUHRXHZBHJ-HNNXBMFYSA-N 1 1 373.375 2.957 20 5 FFBDMO C[C@@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876468016 1014278878 /nfs/dbraw/zinc/27/88/78/1014278878.db2.gz BCITYVLUSRUNCJ-KBRIMQKVSA-N 1 1 372.425 2.668 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN(c3ccccc3F)CC2)cc1 ZINC000796577973 1014376716 /nfs/dbraw/zinc/37/67/16/1014376716.db2.gz JCGDSVLJNZGJHH-IBGZPJMESA-N 1 1 359.401 2.980 20 5 FFBDMO CNc1nccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001152053959 1032092396 /nfs/dbraw/zinc/09/23/96/1032092396.db2.gz ZFCSBAMVMSOLKL-CQSZACIVSA-N 1 1 361.446 2.558 20 5 FFBDMO CCOc1cc(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000910293307 981901354 /nfs/dbraw/zinc/90/13/54/981901354.db2.gz NXCNJWAIBISPGW-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC([N@H+]3CCCOCC3)CC2)c1C ZINC000910366853 981917826 /nfs/dbraw/zinc/91/78/26/981917826.db2.gz VWPLRAJAKRCJHP-UHFFFAOYSA-N 1 1 361.442 2.539 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1F ZINC000764045379 984254528 /nfs/dbraw/zinc/25/45/28/984254528.db2.gz YMOMHPJIFNJRMN-STQMWFEESA-N 1 1 367.421 2.660 20 5 FFBDMO CNC(=O)c1ccc(C[N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)cc1 ZINC000764863163 984745767 /nfs/dbraw/zinc/74/57/67/984745767.db2.gz BXHOPIALZXLXAX-UHFFFAOYSA-N 1 1 367.409 2.702 20 5 FFBDMO CNC(=O)c1ccc(C[N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)cc1 ZINC000764863163 984745771 /nfs/dbraw/zinc/74/57/71/984745771.db2.gz BXHOPIALZXLXAX-UHFFFAOYSA-N 1 1 367.409 2.702 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878603803 1015126101 /nfs/dbraw/zinc/12/61/01/1015126101.db2.gz IENPAEPCSHASIF-GPMVNZHBSA-N 1 1 356.382 2.500 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000172951496 985723457 /nfs/dbraw/zinc/72/34/57/985723457.db2.gz CRBMRZOKJOSDBU-OAHLLOKOSA-N 1 1 361.398 2.884 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000172951496 985723462 /nfs/dbraw/zinc/72/34/62/985723462.db2.gz CRBMRZOKJOSDBU-OAHLLOKOSA-N 1 1 361.398 2.884 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccc(C3CCC3)cc2)CC1 ZINC000997770991 985733875 /nfs/dbraw/zinc/73/38/75/985733875.db2.gz DYKDLFVQPXJOTL-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)CC1 ZINC000921844506 987224936 /nfs/dbraw/zinc/22/49/36/987224936.db2.gz BQUUJEURPCWOPA-UHFFFAOYSA-N 1 1 367.421 2.697 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000130260948 987478630 /nfs/dbraw/zinc/47/86/30/987478630.db2.gz YDFSXEQJJSTSQF-UHFFFAOYSA-N 1 1 374.397 2.810 20 5 FFBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000252480799 988116389 /nfs/dbraw/zinc/11/63/89/988116389.db2.gz FSMPWCOSJHILKC-VMGRFDJRSA-N 1 1 360.414 2.533 20 5 FFBDMO Cc1c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000915297407 988395162 /nfs/dbraw/zinc/39/51/62/988395162.db2.gz JCNRPYAPUTYWPG-VXGBXAGGSA-N 1 1 364.402 2.804 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000762474833 988395407 /nfs/dbraw/zinc/39/54/07/988395407.db2.gz YVWWQQGWMFQJPW-MRXNPFEDSA-N 1 1 371.397 2.798 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000762474833 988395418 /nfs/dbraw/zinc/39/54/18/988395418.db2.gz YVWWQQGWMFQJPW-MRXNPFEDSA-N 1 1 371.397 2.798 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000879214708 1015413297 /nfs/dbraw/zinc/41/32/97/1015413297.db2.gz VCXTWWCKLCRKKI-HNNXBMFYSA-N 1 1 369.425 2.631 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCCC1 ZINC000915793257 988917242 /nfs/dbraw/zinc/91/72/42/988917242.db2.gz LTXCEKVISIHCJQ-LJQANCHMSA-N 1 1 374.441 2.974 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000068964535 991554323 /nfs/dbraw/zinc/55/43/23/991554323.db2.gz WTGMSBILBVZYGG-HOCLYGCPSA-N 1 1 373.457 2.919 20 5 FFBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000880460804 1015840716 /nfs/dbraw/zinc/84/07/16/1015840716.db2.gz BZOXGCYZKKJBIP-KRWDZBQOSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000880460804 1015840720 /nfs/dbraw/zinc/84/07/20/1015840720.db2.gz BZOXGCYZKKJBIP-KRWDZBQOSA-N 1 1 357.410 2.897 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1 ZINC000808795331 994269780 /nfs/dbraw/zinc/26/97/80/994269780.db2.gz TYRQLRJHOUPSBY-VQTJNVASSA-N 1 1 374.412 2.694 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000812386813 995424289 /nfs/dbraw/zinc/42/42/89/995424289.db2.gz FNFUETPELJGIRH-LLVKDONJSA-N 1 1 366.418 2.970 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)C1CC[NH+](Cc2nccn2C)CC1 ZINC000813292776 995652573 /nfs/dbraw/zinc/65/25/73/995652573.db2.gz YUGUYBVKHJSXAC-UHFFFAOYSA-N 1 1 371.441 2.741 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C[C@H]1C1CC1 ZINC000844764553 998127521 /nfs/dbraw/zinc/12/75/21/998127521.db2.gz JZARIWRYISMPHA-ZWKOTPCHSA-N 1 1 370.409 2.547 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)[C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC000845125117 998368182 /nfs/dbraw/zinc/36/81/82/998368182.db2.gz XZIJYZHSMTZMDQ-FRRDWIJNSA-N 1 1 364.398 2.686 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000803858285 1016247410 /nfs/dbraw/zinc/24/74/10/1016247410.db2.gz NZTULOGXOHTYRE-CQSZACIVSA-N 1 1 374.397 2.953 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000822443963 998874716 /nfs/dbraw/zinc/87/47/16/998874716.db2.gz UBLSSAWWZPCRCB-SNVBAGLBSA-N 1 1 355.797 2.944 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H](C4OCCO4)C3)c2)cc1 ZINC000738147635 999621043 /nfs/dbraw/zinc/62/10/43/999621043.db2.gz FEIQXOWAGKWIOO-OAHLLOKOSA-N 1 1 358.398 2.501 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCCCC1 ZINC000741027668 999704718 /nfs/dbraw/zinc/70/47/18/999704718.db2.gz AXOJJNJOSTXYPI-KGLIPLIRSA-N 1 1 363.414 2.730 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153630 999761801 /nfs/dbraw/zinc/76/18/01/999761801.db2.gz RFNIHZPWTIBTSA-HZPDHXFCSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153630 999761802 /nfs/dbraw/zinc/76/18/02/999761802.db2.gz RFNIHZPWTIBTSA-HZPDHXFCSA-N 1 1 359.430 2.946 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000743717534 999829879 /nfs/dbraw/zinc/82/98/79/999829879.db2.gz HEFJDWOMXPYZKB-AWEZNQCLSA-N 1 1 364.402 2.758 20 5 FFBDMO CC(C)C[C@@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000744437105 999856349 /nfs/dbraw/zinc/85/63/49/999856349.db2.gz GUBSHIPGRUNEQI-IFXJQAMLSA-N 1 1 374.441 2.687 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000745943428 999938154 /nfs/dbraw/zinc/93/81/54/999938154.db2.gz DGTCXPAAKZAVDY-HNNXBMFYSA-N 1 1 365.430 2.915 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018474 1000017256 /nfs/dbraw/zinc/01/72/56/1000017256.db2.gz CNYAPEJHBNSURC-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018474 1000017257 /nfs/dbraw/zinc/01/72/57/1000017257.db2.gz CNYAPEJHBNSURC-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCn3cnc(COCc4ccco4)c3C2)C1 ZINC001169026241 1000018125 /nfs/dbraw/zinc/01/81/25/1000018125.db2.gz WJYYQCINDARRHS-JKSUJKDBSA-N 1 1 374.441 2.844 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-] ZINC000767442419 1000113521 /nfs/dbraw/zinc/11/35/21/1000113521.db2.gz SINDTIRLEFNYIF-UHFFFAOYSA-N 1 1 366.418 2.838 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001000673572 1016421248 /nfs/dbraw/zinc/42/12/48/1016421248.db2.gz GOCOCXZCZYASCK-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000673572 1016421256 /nfs/dbraw/zinc/42/12/56/1016421256.db2.gz GOCOCXZCZYASCK-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000673572 1016421266 /nfs/dbraw/zinc/42/12/66/1016421266.db2.gz GOCOCXZCZYASCK-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001146934745 1000793028 /nfs/dbraw/zinc/79/30/28/1000793028.db2.gz PCTHUVBRMCBZAE-VXGBXAGGSA-N 1 1 369.853 2.698 20 5 FFBDMO CCCCCC[C@@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000785862698 1001498349 /nfs/dbraw/zinc/49/83/49/1001498349.db2.gz CYXKBVCHIDEZHN-OAHLLOKOSA-N 1 1 365.478 2.903 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000786821099 1001632889 /nfs/dbraw/zinc/63/28/89/1001632889.db2.gz YIIUXHYSDUTOCI-DZGCQCFKSA-N 1 1 354.410 2.742 20 5 FFBDMO CN(CC(=O)OC[C@@H]1CCC[N@H+]1Cc1ccco1)c1ccccc1[N+](=O)[O-] ZINC000772691000 1001635569 /nfs/dbraw/zinc/63/55/69/1001635569.db2.gz NGPFMGZVZSJGKJ-HNNXBMFYSA-N 1 1 373.409 2.832 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])n1C ZINC000791974568 1002858380 /nfs/dbraw/zinc/85/83/80/1002858380.db2.gz VVTIKWDJNGQLHQ-HOCLYGCPSA-N 1 1 354.410 2.690 20 5 FFBDMO Cc1cc(F)cc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)c1[N+](=O)[O-] ZINC000791992471 1002873147 /nfs/dbraw/zinc/87/31/47/1002873147.db2.gz IGOJOXAPGIENTI-UHFFFAOYSA-N 1 1 367.421 2.615 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(c3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC001170336297 1003117706 /nfs/dbraw/zinc/11/77/06/1003117706.db2.gz WEJLIFNUGZVDID-HNNXBMFYSA-N 1 1 356.426 2.752 20 5 FFBDMO COC(=O)[C@@H]1C[C@H]2C[C@@H](C1)[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170353111 1003121214 /nfs/dbraw/zinc/12/12/14/1003121214.db2.gz VXFZRYKWLWLLJO-UGQVUOCMSA-N 1 1 362.426 2.808 20 5 FFBDMO CCCNC(=O)[C@@H]1CCCC[N@@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344663 1003131609 /nfs/dbraw/zinc/13/16/09/1003131609.db2.gz DUFBDLXZKYZBTR-PBHICJAKSA-N 1 1 363.458 2.915 20 5 FFBDMO CCCNC(=O)[C@@H]1CCCC[N@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344663 1003131614 /nfs/dbraw/zinc/13/16/14/1003131614.db2.gz DUFBDLXZKYZBTR-PBHICJAKSA-N 1 1 363.458 2.915 20 5 FFBDMO Cc1nn(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000772829092 1003311894 /nfs/dbraw/zinc/31/18/94/1003311894.db2.gz RESIOOOLWSYLKI-RDTXWAMCSA-N 1 1 370.457 2.554 20 5 FFBDMO CCOC1(C)CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000793546036 1003419337 /nfs/dbraw/zinc/41/93/37/1003419337.db2.gz JHRQXSOXVBRMDG-UHFFFAOYSA-N 1 1 362.430 2.685 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000775054944 1003473989 /nfs/dbraw/zinc/47/39/89/1003473989.db2.gz CHDCKJXVKYBSAL-ZDUSSCGKSA-N 1 1 365.386 2.914 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000775054944 1003473992 /nfs/dbraw/zinc/47/39/92/1003473992.db2.gz CHDCKJXVKYBSAL-ZDUSSCGKSA-N 1 1 365.386 2.914 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001398229 1016780351 /nfs/dbraw/zinc/78/03/51/1016780351.db2.gz AYFKUASYFIEDAG-RTBURBONSA-N 1 1 357.454 2.557 20 5 FFBDMO C[N@@H+](CCc1ccc2c(c1)OCO2)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001197836785 1004375491 /nfs/dbraw/zinc/37/54/91/1004375491.db2.gz FFMCBHMCYPCAOS-UHFFFAOYSA-N 1 1 359.338 2.906 20 5 FFBDMO CC[C@]1([NH2+]Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CCOC1 ZINC001194083881 1004648049 /nfs/dbraw/zinc/64/80/49/1004648049.db2.gz XXBGCZQRTBGLFF-HNNXBMFYSA-N 1 1 352.778 2.957 20 5 FFBDMO CCN1C[C@H](C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)Oc2ccccc21 ZINC000776277784 1005336540 /nfs/dbraw/zinc/33/65/40/1005336540.db2.gz SGYFBKCSWIFCGJ-HKUYNNGSSA-N 1 1 371.437 2.848 20 5 FFBDMO C[N@H+](Cc1ccccc1N1CCOCC1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276616 1005342694 /nfs/dbraw/zinc/34/26/94/1005342694.db2.gz OCXIIQLPLMMQDK-HXUWFJFHSA-N 1 1 371.437 2.597 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776277926 1005343149 /nfs/dbraw/zinc/34/31/49/1005343149.db2.gz QVOJRGINBPYYFT-GDBMZVCRSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776277926 1005343153 /nfs/dbraw/zinc/34/31/53/1005343153.db2.gz QVOJRGINBPYYFT-GDBMZVCRSA-N 1 1 365.430 2.617 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852306942 1005970004 /nfs/dbraw/zinc/97/00/04/1005970004.db2.gz NIGIFLISDSVKOQ-HNNXBMFYSA-N 1 1 367.446 2.863 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@H]3CCCO3)CC2)nc1-c1ccccn1 ZINC000853509022 1006420640 /nfs/dbraw/zinc/42/06/40/1006420640.db2.gz ULFYDOSXBDJINZ-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@@H](C3CCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000853590795 1006463608 /nfs/dbraw/zinc/46/36/08/1006463608.db2.gz UYSKQWJOEOFCFO-OAHLLOKOSA-N 1 1 372.425 2.833 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)CC2)[nH+]c1 ZINC000854496172 1006856063 /nfs/dbraw/zinc/85/60/63/1006856063.db2.gz AUBHWDUELHSZJN-UHFFFAOYSA-N 1 1 355.398 2.736 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000855811395 1007577309 /nfs/dbraw/zinc/57/73/09/1007577309.db2.gz MWCSPHOMIWEOFI-CQSZACIVSA-N 1 1 360.458 2.798 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000817490502 1007617598 /nfs/dbraw/zinc/61/75/98/1007617598.db2.gz FXGXRGZLUWGDBW-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ccc([N+](=O)[O-])cn3)C2)ccn1 ZINC000856535887 1007874374 /nfs/dbraw/zinc/87/43/74/1007874374.db2.gz IUDJICZNFXRQFJ-SFHVURJKSA-N 1 1 371.441 2.883 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000819015668 1008023888 /nfs/dbraw/zinc/02/38/88/1008023888.db2.gz MZCXRZIISUKCMA-WIYYLYMNSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000819015668 1008023893 /nfs/dbraw/zinc/02/38/93/1008023893.db2.gz MZCXRZIISUKCMA-WIYYLYMNSA-N 1 1 369.465 2.782 20 5 FFBDMO COc1ccc(CC[N@@H+](CC(C)C)Cn2nccc2[N+](=O)[O-])cc1OC ZINC000115513110 1008198322 /nfs/dbraw/zinc/19/83/22/1008198322.db2.gz GLDRPEAOGVNVAQ-UHFFFAOYSA-N 1 1 362.430 2.967 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1cccc([N+](=O)[O-])c1N ZINC000820009525 1008265422 /nfs/dbraw/zinc/26/54/22/1008265422.db2.gz KSYWSKGLCOVZRB-NVXWUHKLSA-N 1 1 366.421 2.934 20 5 FFBDMO O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000822088784 1008518301 /nfs/dbraw/zinc/51/83/01/1008518301.db2.gz GBRVKLPPMBCUSP-GUDVDZBRSA-N 1 1 351.406 2.871 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1)c1ccccc1 ZINC000886032269 1008520795 /nfs/dbraw/zinc/52/07/95/1008520795.db2.gz CHOHGMPVCYKNMI-OAHLLOKOSA-N 1 1 354.410 2.632 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)c1ccccc1 ZINC000886032269 1008520802 /nfs/dbraw/zinc/52/08/02/1008520802.db2.gz CHOHGMPVCYKNMI-OAHLLOKOSA-N 1 1 354.410 2.632 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137441178 1008609737 /nfs/dbraw/zinc/60/97/37/1008609737.db2.gz ACLZBQHOAQMMQK-CJNGLKHVSA-N 1 1 354.410 2.570 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H]3C[N@H+]4CCC[C@H]4CO3)o2)c1 ZINC001177749465 1008732658 /nfs/dbraw/zinc/73/26/58/1008732658.db2.gz VWRCNUQKZFQYOQ-WMZOPIPTSA-N 1 1 357.410 2.808 20 5 FFBDMO C[N@@H+](C[C@@](C)(O)c1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000823597796 1009135329 /nfs/dbraw/zinc/13/53/29/1009135329.db2.gz BLPUHQYQSWCAFB-UYAOXDASSA-N 1 1 369.421 2.540 20 5 FFBDMO C[C@@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402710 1009196408 /nfs/dbraw/zinc/19/64/08/1009196408.db2.gz HUIKLDGKUTWCDT-KXBFYZLASA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@@H](CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402710 1009196411 /nfs/dbraw/zinc/19/64/11/1009196411.db2.gz HUIKLDGKUTWCDT-KXBFYZLASA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000823967621 1009284003 /nfs/dbraw/zinc/28/40/03/1009284003.db2.gz FZWBNGGCQGGMGU-QWHCGFSZSA-N 1 1 361.446 2.952 20 5 FFBDMO Nc1ccc(NC(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000824008673 1009291391 /nfs/dbraw/zinc/29/13/91/1009291391.db2.gz SVHJBGUCHQJYHL-UHFFFAOYSA-N 1 1 369.425 2.917 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000861353163 1009372657 /nfs/dbraw/zinc/37/26/57/1009372657.db2.gz MIMAULZURQFLHR-KSSFIOAISA-N 1 1 366.414 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1C ZINC000887861643 1009656367 /nfs/dbraw/zinc/65/63/67/1009656367.db2.gz YDBIRHSUAQIYHS-KBPBESRZSA-N 1 1 363.458 2.829 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)C[C@]2(C)C1 ZINC000887938102 1009688639 /nfs/dbraw/zinc/68/86/39/1009688639.db2.gz ZWQFAPDTYXQNKA-QRWLVFNGSA-N 1 1 372.469 2.609 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865539666 1010809796 /nfs/dbraw/zinc/80/97/96/1010809796.db2.gz UHZQGNRHETWISC-ZDUSSCGKSA-N 1 1 360.389 2.504 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000865628644 1010830278 /nfs/dbraw/zinc/83/02/78/1010830278.db2.gz VNVYEKJZVTZKAK-GOSISDBHSA-N 1 1 367.409 2.827 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000866204231 1010950993 /nfs/dbraw/zinc/95/09/93/1010950993.db2.gz BGBWGBYTMIMUDX-NVXWUHKLSA-N 1 1 353.426 2.891 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866260619 1010964439 /nfs/dbraw/zinc/96/44/39/1010964439.db2.gz WCSFAAGORKIDIJ-HOTGVXAUSA-N 1 1 366.481 2.528 20 5 FFBDMO O=C1CCC[C@]2(CCC[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)N1 ZINC001172910551 1012123068 /nfs/dbraw/zinc/12/30/68/1012123068.db2.gz YWRLWKLMWMCXQE-YLJYHZDGSA-N 1 1 357.454 2.977 20 5 FFBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172911664 1012125588 /nfs/dbraw/zinc/12/55/88/1012125588.db2.gz UUKMKJCXNPSPBS-AEFFLSMTSA-N 1 1 374.437 2.686 20 5 FFBDMO C[C@H]1C[C@H](O)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018631 1012188537 /nfs/dbraw/zinc/18/85/37/1012188537.db2.gz XRZREGGGRIXDPZ-SMDDNHRTSA-N 1 1 355.385 2.687 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](CO)C2)c1F ZINC001173179408 1012322034 /nfs/dbraw/zinc/32/20/34/1012322034.db2.gz FMULNUFNLJJYQY-GHMZBOCLSA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1F ZINC001173179408 1012322051 /nfs/dbraw/zinc/32/20/51/1012322051.db2.gz FMULNUFNLJJYQY-GHMZBOCLSA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@H]3[C@H](C2)CCC[N@H+]3C)c1F ZINC001173192828 1012334325 /nfs/dbraw/zinc/33/43/25/1012334325.db2.gz NAZMMBDPILMNID-XEZPLFJOSA-N 1 1 351.422 2.700 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@@H]2COC ZINC001173222010 1012351252 /nfs/dbraw/zinc/35/12/52/1012351252.db2.gz OHHDORIDGHJYAG-GOEBONIOSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@@H]2COC ZINC001173222010 1012351267 /nfs/dbraw/zinc/35/12/67/1012351267.db2.gz OHHDORIDGHJYAG-GOEBONIOSA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CCN2c2ncccn2)C1 ZINC001173222939 1012353967 /nfs/dbraw/zinc/35/39/67/1012353967.db2.gz DQNYTBZKAOSCHU-BEFAXECRSA-N 1 1 353.426 2.671 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870863287 1012610629 /nfs/dbraw/zinc/61/06/29/1012610629.db2.gz XWKQVVODOXSQQC-IEBWSBKVSA-N 1 1 373.384 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)cc1 ZINC000801580567 1019138530 /nfs/dbraw/zinc/13/85/30/1019138530.db2.gz MZRAKPHZTQPLOD-PMACEKPBSA-N 1 1 356.422 2.654 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000929093087 1019270681 /nfs/dbraw/zinc/27/06/81/1019270681.db2.gz YPQMYWPPXTXSDK-CQSZACIVSA-N 1 1 362.430 2.799 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O)(Cc2ccccn2)CC1 ZINC000930983819 1020268376 /nfs/dbraw/zinc/26/83/76/1020268376.db2.gz VDBOQFQTYRIFSF-UHFFFAOYSA-N 1 1 357.410 2.568 20 5 FFBDMO Cc1cccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)c1 ZINC001048525499 1020275073 /nfs/dbraw/zinc/27/50/73/1020275073.db2.gz XMBOVWGDDCTLSL-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1cccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525499 1020275080 /nfs/dbraw/zinc/27/50/80/1020275080.db2.gz XMBOVWGDDCTLSL-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1cccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525499 1020275092 /nfs/dbraw/zinc/27/50/92/1020275092.db2.gz XMBOVWGDDCTLSL-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO CCOC(=O)CC[N@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1 ZINC000777955176 1020321109 /nfs/dbraw/zinc/32/11/09/1020321109.db2.gz VJNMLHZOSJMMCR-UHFFFAOYSA-N 1 1 358.398 2.833 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1 ZINC000777955176 1020321121 /nfs/dbraw/zinc/32/11/21/1020321121.db2.gz VJNMLHZOSJMMCR-UHFFFAOYSA-N 1 1 358.398 2.833 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000726186116 1020429350 /nfs/dbraw/zinc/42/93/50/1020429350.db2.gz PRIHGGBXJNLXPU-CQSZACIVSA-N 1 1 359.430 2.530 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000726186116 1020429356 /nfs/dbraw/zinc/42/93/56/1020429356.db2.gz PRIHGGBXJNLXPU-CQSZACIVSA-N 1 1 359.430 2.530 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1Cc2ccccc2OC2(CCOCC2)C1 ZINC000932036801 1020681318 /nfs/dbraw/zinc/68/13/18/1020681318.db2.gz IZADYKVWMIUUEU-UHFFFAOYSA-N 1 1 372.425 2.544 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)cc1 ZINC000749937665 1021146869 /nfs/dbraw/zinc/14/68/69/1021146869.db2.gz NHRLFDWTLPTGMW-UHFFFAOYSA-N 1 1 371.397 2.625 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)cc1 ZINC000749937665 1021146873 /nfs/dbraw/zinc/14/68/73/1021146873.db2.gz NHRLFDWTLPTGMW-UHFFFAOYSA-N 1 1 371.397 2.625 20 5 FFBDMO CCOc1cc(C[NH2+][C@H]2c3ccccc3OC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000934215462 1021167639 /nfs/dbraw/zinc/16/76/39/1021167639.db2.gz WGBXIRQRMUHJIN-AUUYWEPGSA-N 1 1 358.394 2.825 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)[nH+]c1 ZINC001116638153 1021322899 /nfs/dbraw/zinc/32/28/99/1021322899.db2.gz UTULGGHJUVHCJR-UHFFFAOYSA-N 1 1 355.398 2.826 20 5 FFBDMO O=c1oc2cc(O)ccc2c2oc3cc(OC[C@H]4C[NH2+]CCO4)ccc3c21 ZINC001218178718 1033033815 /nfs/dbraw/zinc/03/38/15/1033033815.db2.gz BWWRTVKAINMDML-CYBMUJFWSA-N 1 1 367.357 2.765 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000750569257 1022185326 /nfs/dbraw/zinc/18/53/26/1022185326.db2.gz ZNCZTBKQDPGUKB-AWEZNQCLSA-N 1 1 362.474 2.901 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001118844500 1022433594 /nfs/dbraw/zinc/43/35/94/1022433594.db2.gz IWCANJPJUDRHAJ-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001118844500 1022433599 /nfs/dbraw/zinc/43/35/99/1022433599.db2.gz IWCANJPJUDRHAJ-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCc2cc(F)c(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC001119318065 1022679357 /nfs/dbraw/zinc/67/93/57/1022679357.db2.gz RRKSAFUQZCTHJW-GOSISDBHSA-N 1 1 361.348 2.632 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000754219512 1023441787 /nfs/dbraw/zinc/44/17/87/1023441787.db2.gz SKSNIHCKQLBXRM-ZDUSSCGKSA-N 1 1 362.430 2.605 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000754219512 1023441789 /nfs/dbraw/zinc/44/17/89/1023441789.db2.gz SKSNIHCKQLBXRM-ZDUSSCGKSA-N 1 1 362.430 2.605 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@@H]1C ZINC000754222794 1023442201 /nfs/dbraw/zinc/44/22/01/1023442201.db2.gz DSEZVTLXDRNNRM-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@@H]1C ZINC000754222794 1023442207 /nfs/dbraw/zinc/44/22/07/1023442207.db2.gz DSEZVTLXDRNNRM-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC(c2c[nH+]cn2C)CC1 ZINC001121015565 1023570125 /nfs/dbraw/zinc/57/01/25/1023570125.db2.gz LVIMHHNLPLITSD-UHFFFAOYSA-N 1 1 358.398 2.807 20 5 FFBDMO C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000755891982 1023647519 /nfs/dbraw/zinc/64/75/19/1023647519.db2.gz YYSQSKLHASXCTN-WBVHZDCISA-N 1 1 372.425 2.635 20 5 FFBDMO C[C@@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000755891980 1023647538 /nfs/dbraw/zinc/64/75/38/1023647538.db2.gz YYSQSKLHASXCTN-NVXWUHKLSA-N 1 1 372.425 2.635 20 5 FFBDMO COc1ccc(OC)c([C@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000757168081 1023808377 /nfs/dbraw/zinc/80/83/77/1023808377.db2.gz SKBREIWOPVMFKH-GOSISDBHSA-N 1 1 358.394 2.704 20 5 FFBDMO COc1ccc(OC)c([C@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000757168081 1023808381 /nfs/dbraw/zinc/80/83/81/1023808381.db2.gz SKBREIWOPVMFKH-GOSISDBHSA-N 1 1 358.394 2.704 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000837136069 1025605738 /nfs/dbraw/zinc/60/57/38/1025605738.db2.gz XCRNKTWAOMBTBF-PEZBUJJGSA-N 1 1 374.485 2.530 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000837439073 1025808496 /nfs/dbraw/zinc/80/84/96/1025808496.db2.gz YZZFRZKAVDPQBT-KRWDZBQOSA-N 1 1 371.349 2.934 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC000246341843 1026031514 /nfs/dbraw/zinc/03/15/14/1026031514.db2.gz UTQRBYXHNWWZMI-HXUWFJFHSA-N 1 1 355.438 2.836 20 5 FFBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000838907441 1026531842 /nfs/dbraw/zinc/53/18/42/1026531842.db2.gz QVNOSCRGIYBBAC-TXEJJXNPSA-N 1 1 374.315 2.634 20 5 FFBDMO O=C1C[C@]2(CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643890 1026771921 /nfs/dbraw/zinc/77/19/21/1026771921.db2.gz MSYWOPXGQJDMFW-ICSRJNTNSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@]2(CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643890 1026771931 /nfs/dbraw/zinc/77/19/31/1026771931.db2.gz MSYWOPXGQJDMFW-ICSRJNTNSA-N 1 1 368.389 2.738 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3ccncn3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000840170551 1026995920 /nfs/dbraw/zinc/99/59/20/1026995920.db2.gz PVHHKQXDMCHBCK-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000840370565 1027063514 /nfs/dbraw/zinc/06/35/14/1027063514.db2.gz YLKJTUHQBJRDLF-OAHLLOKOSA-N 1 1 368.437 2.665 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@@H]2CCc3ccccc3[C@H]2O)ncc1[N+](=O)[O-] ZINC001158684176 1027094367 /nfs/dbraw/zinc/09/43/67/1027094367.db2.gz NGSBZRDIKPFMPX-LBDIVEORSA-N 1 1 354.410 2.982 20 5 FFBDMO C[N@@H+](C1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1)[C@H]1CCOC1 ZINC001158734319 1027116099 /nfs/dbraw/zinc/11/60/99/1027116099.db2.gz COFYYUSKPWKMPA-HNNXBMFYSA-N 1 1 372.400 2.705 20 5 FFBDMO COc1cccc2c1C[C@@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)CO2 ZINC001160133913 1027605497 /nfs/dbraw/zinc/60/54/97/1027605497.db2.gz ZPGXYXYORZTNSG-HSBSLETESA-N 1 1 370.409 2.946 20 5 FFBDMO Cc1nc(Cl)nc(NC2CC[NH+](CC(=O)C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC001161118419 1028019665 /nfs/dbraw/zinc/01/96/65/1028019665.db2.gz GYZLSASUMXGXML-UHFFFAOYSA-N 1 1 369.853 2.838 20 5 FFBDMO CCc1cc(N[C@@]2(C)CCC[N@@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001162338529 1028507290 /nfs/dbraw/zinc/50/72/90/1028507290.db2.gz BHYGDHIXMSWTJD-IBGZPJMESA-N 1 1 355.442 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)NCC[C@H]2CC[NH2+]CC2(F)F)nc1Cl ZINC001162809831 1028664926 /nfs/dbraw/zinc/66/49/26/1028664926.db2.gz FOWORRHCTNNNEL-MRVPVSSYSA-N 1 1 370.734 2.917 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCC[C@@H]2CCNCC2(F)F)ncc1[N+](=O)[O-] ZINC001162812551 1028666150 /nfs/dbraw/zinc/66/61/50/1028666150.db2.gz MTYAYRFRKAQUCT-LJLILKBBSA-N 1 1 355.389 2.569 20 5 FFBDMO CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC001162875604 1028689893 /nfs/dbraw/zinc/68/98/93/1028689893.db2.gz HXEZBEQRACXDAY-INIZCTEOSA-N 1 1 359.430 2.697 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[nH+]c1 ZINC001156470132 1029204211 /nfs/dbraw/zinc/20/42/11/1029204211.db2.gz MATNGDMTTGBNAQ-UHFFFAOYSA-N 1 1 366.324 2.742 20 5 FFBDMO COc1ncc([N+](=O)[O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164486404 1029294073 /nfs/dbraw/zinc/29/40/73/1029294073.db2.gz NXIBBNPFEFKSLE-ARFHVFGLSA-N 1 1 369.425 2.716 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001165083550 1029370927 /nfs/dbraw/zinc/37/09/27/1029370927.db2.gz GXWKUOUYSBUNLE-YOEHRIQHSA-N 1 1 369.381 2.609 20 5 FFBDMO COc1nc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001165090374 1029379979 /nfs/dbraw/zinc/37/99/79/1029379979.db2.gz YTJKYOBRZMZPII-DOTOQJQBSA-N 1 1 354.410 2.709 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cc(Cl)ncc2[N+](=O)[O-])CC1 ZINC001165107011 1029393313 /nfs/dbraw/zinc/39/33/13/1029393313.db2.gz CXWQEYGZRICOHQ-CYBMUJFWSA-N 1 1 354.838 2.723 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cnc3ccc([N+](=O)[O-])cc3n2)CC1 ZINC001165109300 1029396962 /nfs/dbraw/zinc/39/69/62/1029396962.db2.gz SQTBEYVHGORTPD-MRXNPFEDSA-N 1 1 371.441 2.618 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1cc(N)c([N+](=O)[O-])cn1 ZINC001165183085 1029438791 /nfs/dbraw/zinc/43/87/91/1029438791.db2.gz PXKGATLLTAGDDP-RDTXWAMCSA-N 1 1 355.442 2.919 20 5 FFBDMO [NH3+]Cc1ncn(-c2cc(Oc3ccnc(Cl)c3)c(F)cc2[N+](=O)[O-])n1 ZINC001157928293 1029686478 /nfs/dbraw/zinc/68/64/78/1029686478.db2.gz GJFBUVFQPVZECN-UHFFFAOYSA-N 1 1 364.724 2.614 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])c(N2CC[NH+](Cc3cccc(N)c3)CC2)n1 ZINC001158481229 1029837779 /nfs/dbraw/zinc/83/77/79/1029837779.db2.gz ZKRLXSKKGBFYSY-UHFFFAOYSA-N 1 1 361.833 2.856 20 5 FFBDMO C[C@H]1C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@@H]1c1ccccc1 ZINC000782860316 1029840077 /nfs/dbraw/zinc/84/00/77/1029840077.db2.gz FYPUMDGILVBQMZ-KDOFPFPSSA-N 1 1 369.425 2.605 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)Cn1nccn1 ZINC001142193772 1030132645 /nfs/dbraw/zinc/13/26/45/1030132645.db2.gz MSRBQMXPWLRIEP-UHFFFAOYSA-N 1 1 360.421 2.993 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)OCCO1 ZINC000784039758 1030435743 /nfs/dbraw/zinc/43/57/43/1030435743.db2.gz VBTMDHMULBWNTI-QGZVFWFLSA-N 1 1 372.425 2.891 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796706217 1030888310 /nfs/dbraw/zinc/88/83/10/1030888310.db2.gz IZUDGJOBPMQLCJ-DLBZAZTESA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](COC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000842833292 1030979898 /nfs/dbraw/zinc/97/98/98/1030979898.db2.gz KKOMLJVIWQMVFI-ZDUSSCGKSA-N 1 1 364.398 2.643 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000830213654 1033514979 /nfs/dbraw/zinc/51/49/79/1033514979.db2.gz METVVYAREMXNNU-MRXNPFEDSA-N 1 1 357.385 2.872 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ccc([N+](=O)[O-])nc3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001226712894 1034800662 /nfs/dbraw/zinc/80/06/62/1034800662.db2.gz RIRYEXRLZBWYMR-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(F)c(Cl)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001227157645 1034953629 /nfs/dbraw/zinc/95/36/29/1034953629.db2.gz NKUNZOCVBQOXTB-UOJCWERNSA-N 1 1 372.780 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c(F)c1F ZINC000834388860 1035374618 /nfs/dbraw/zinc/37/46/18/1035374618.db2.gz XBXZFCRGRSCNML-CQSZACIVSA-N 1 1 364.348 2.671 20 5 FFBDMO O=[N+]([O-])c1ccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c(F)c1F ZINC000834388859 1035374728 /nfs/dbraw/zinc/37/47/28/1035374728.db2.gz XBXZFCRGRSCNML-AWEZNQCLSA-N 1 1 364.348 2.671 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(O[C@H]3COCC[N@@H+](Cc4ccccc4)C3)nc2c1 ZINC001227742529 1035709275 /nfs/dbraw/zinc/70/92/75/1035709275.db2.gz AQJCLIXCHJJHPY-MRXNPFEDSA-N 1 1 368.393 2.751 20 5 FFBDMO CC(=O)Cc1c(F)c(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)ccc1[N+](=O)[O-] ZINC001230796014 1037361528 /nfs/dbraw/zinc/36/15/28/1037361528.db2.gz GGQSATHDZJVCOP-MCBXIFIFSA-N 1 1 350.390 2.975 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c(C)c1[N+](=O)[O-] ZINC001208040243 1037964392 /nfs/dbraw/zinc/96/43/92/1037964392.db2.gz FBUIIUOISPUNQA-CQSZACIVSA-N 1 1 369.487 2.754 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCC(=O)[C@@H](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093257 1038380723 /nfs/dbraw/zinc/38/07/23/1038380723.db2.gz IWVGGPLQZFXDJQ-AWEZNQCLSA-N 1 1 361.442 2.873 20 5 FFBDMO Nc1ccc(-c2nc3cc(N4CCOCC4)c(F)cc3[nH]2)cc1[N+](=O)[O-] ZINC001250953706 1038849718 /nfs/dbraw/zinc/84/97/18/1038849718.db2.gz LUJADWKCQVAZSC-UHFFFAOYSA-N 1 1 357.345 2.696 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc([C@@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@H](C)O1 ZINC001258090113 1039163666 /nfs/dbraw/zinc/16/36/66/1039163666.db2.gz CSNOMFQBRDQYNQ-OHUAYANFSA-N 1 1 372.385 2.816 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc([C@@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@H](C)O1 ZINC001258090113 1039163674 /nfs/dbraw/zinc/16/36/74/1039163674.db2.gz CSNOMFQBRDQYNQ-OHUAYANFSA-N 1 1 372.385 2.816 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1-c1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258145551 1039226729 /nfs/dbraw/zinc/22/67/29/1039226729.db2.gz IKBRNJBWCJYADW-OKILXGFUSA-N 1 1 360.414 2.913 20 5 FFBDMO Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC001537893703 1070285087 /nfs/dbraw/zinc/28/50/87/1070285087.db2.gz BGMLZCLXDRYDSX-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001254563214 1040802823 /nfs/dbraw/zinc/80/28/23/1040802823.db2.gz XXFQMYIQXKAHJO-YOEHRIQHSA-N 1 1 358.442 2.895 20 5 FFBDMO CC(C)[N@H+]1CCOC[C@@]2(CCCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822451 /nfs/dbraw/zinc/82/24/51/1040822451.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@@]2(CCC[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822460 /nfs/dbraw/zinc/82/24/60/1040822460.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592717 1040822468 /nfs/dbraw/zinc/82/24/68/1040822468.db2.gz GAANOPWFXBAFGJ-RTWAWAEBSA-N 1 1 373.497 2.885 20 5 FFBDMO Cc1noc([C@H]2CC[C@@H]3[C@@H](CC[N@H+]3[C@H]3Cc4ccc([N+](=O)[O-])cc4C3)O2)n1 ZINC001254595245 1040825112 /nfs/dbraw/zinc/82/51/12/1040825112.db2.gz HRULBHDSMMAXQC-BSDSXHPESA-N 1 1 370.409 2.748 20 5 FFBDMO COc1ccc(O[C@@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254612162 1040841307 /nfs/dbraw/zinc/84/13/07/1040841307.db2.gz VOQVWGVIPOALTC-SJLPKXTDSA-N 1 1 355.394 2.619 20 5 FFBDMO O=c1[nH]cc(-c2nnc([C@H]3CC[N@@H+](Cc4ccccc4)C3)o2)cc1[N+](=O)[O-] ZINC001255450451 1041343896 /nfs/dbraw/zinc/34/38/96/1041343896.db2.gz AWNCRCZFWAUFOR-ZDUSSCGKSA-N 1 1 367.365 2.735 20 5 FFBDMO O=c1[nH]cc([N+](=O)[O-])cc1-c1nnc([C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC001255457330 1041347359 /nfs/dbraw/zinc/34/73/59/1041347359.db2.gz ULPUJBFHXSXDMJ-CYBMUJFWSA-N 1 1 367.365 2.735 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001538310440 1070402849 /nfs/dbraw/zinc/40/28/49/1070402849.db2.gz XCXBWSIAZTXTPC-CQSZACIVSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001538310440 1070402852 /nfs/dbraw/zinc/40/28/52/1070402852.db2.gz XCXBWSIAZTXTPC-CQSZACIVSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001265845036 1042881966 /nfs/dbraw/zinc/88/19/66/1042881966.db2.gz BMDYGIAFRGWUDI-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001265845036 1042881968 /nfs/dbraw/zinc/88/19/68/1042881968.db2.gz BMDYGIAFRGWUDI-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001265845036 1042881969 /nfs/dbraw/zinc/88/19/69/1042881969.db2.gz BMDYGIAFRGWUDI-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO O=S(=O)(CC1CC[NH2+]CC1)Nc1cccc2nc3ccccc3nc21 ZINC001237700046 1043319494 /nfs/dbraw/zinc/31/94/94/1043319494.db2.gz XKSWEFQHDOMBMC-UHFFFAOYSA-N 1 1 356.451 2.524 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313368335 1044332229 /nfs/dbraw/zinc/33/22/29/1044332229.db2.gz DUWSDVNIYIFZJB-RDJZCZTQSA-N 1 1 360.458 2.968 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313368336 1044332413 /nfs/dbraw/zinc/33/24/13/1044332413.db2.gz DUWSDVNIYIFZJB-WBVHZDCISA-N 1 1 360.458 2.968 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001317540909 1045107014 /nfs/dbraw/zinc/10/70/14/1045107014.db2.gz RAWGDGXQZUFMNW-HZPDHXFCSA-N 1 1 361.467 2.895 20 5 FFBDMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001317540909 1045107021 /nfs/dbraw/zinc/10/70/21/1045107021.db2.gz RAWGDGXQZUFMNW-HZPDHXFCSA-N 1 1 361.467 2.895 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001317540909 1045107025 /nfs/dbraw/zinc/10/70/25/1045107025.db2.gz RAWGDGXQZUFMNW-HZPDHXFCSA-N 1 1 361.467 2.895 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2[nH]1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC001319493865 1045172537 /nfs/dbraw/zinc/17/25/37/1045172537.db2.gz ZIUHGAHNEQIEGY-QGZVFWFLSA-N 1 1 355.394 2.948 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@H](CCF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001328023012 1048140102 /nfs/dbraw/zinc/14/01/02/1048140102.db2.gz DYSRWLWONWGPOM-CQSZACIVSA-N 1 1 350.394 2.866 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H](CCF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001328023012 1048140106 /nfs/dbraw/zinc/14/01/06/1048140106.db2.gz DYSRWLWONWGPOM-CQSZACIVSA-N 1 1 350.394 2.866 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@@H+]1C ZINC001333100997 1048714365 /nfs/dbraw/zinc/71/43/65/1048714365.db2.gz QWZZMAWBGNIANZ-ZETCQYMHSA-N 1 1 350.177 2.817 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC001333100997 1048714377 /nfs/dbraw/zinc/71/43/77/1048714377.db2.gz QWZZMAWBGNIANZ-ZETCQYMHSA-N 1 1 350.177 2.817 20 5 FFBDMO CCc1ccc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1 ZINC001329819496 1048925749 /nfs/dbraw/zinc/92/57/49/1048925749.db2.gz YOJSRRYCDKYXES-QZTJIDSGSA-N 1 1 359.470 2.823 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(n3cc(Cl)cn3)CC2)c1[N+](=O)[O-] ZINC001333705423 1049065735 /nfs/dbraw/zinc/06/57/35/1049065735.db2.gz JCVZTCUYOLLGDJ-UHFFFAOYSA-N 1 1 366.805 2.996 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CCn1cc[nH+]c1C ZINC001292841180 1049413282 /nfs/dbraw/zinc/41/32/82/1049413282.db2.gz XXGNJYNEPKTKMR-UHFFFAOYSA-N 1 1 369.429 2.590 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001542185922 1071184364 /nfs/dbraw/zinc/18/43/64/1071184364.db2.gz GYZPPVRCXBLOHJ-AWEZNQCLSA-N 1 1 354.410 2.728 20 5 FFBDMO O=C(Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1)[C@@H]1CC[N@H+]1C1CCCC1 ZINC001306865127 1052205819 /nfs/dbraw/zinc/20/58/19/1052205819.db2.gz FODAXBUTTWUJRW-INIZCTEOSA-N 1 1 355.398 2.940 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001307986408 1052376354 /nfs/dbraw/zinc/37/63/54/1052376354.db2.gz GGPADQXMNNINOX-ZIAGYGMSSA-N 1 1 365.430 2.961 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1 ZINC001344369180 1052737908 /nfs/dbraw/zinc/73/79/08/1052737908.db2.gz UHBASTMHXQFWIU-CQSZACIVSA-N 1 1 366.439 2.727 20 5 FFBDMO COc1ccc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001336823425 1054259386 /nfs/dbraw/zinc/25/93/86/1054259386.db2.gz OFUNRICIHXUISX-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)[C@@H]2C1 ZINC001348312206 1054624619 /nfs/dbraw/zinc/62/46/19/1054624619.db2.gz VBRUWTNTGMZREC-IAOVAPTHSA-N 1 1 358.442 2.609 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001348361234 1054653179 /nfs/dbraw/zinc/65/31/79/1054653179.db2.gz CDDMLAZHDRTAMF-SJLPKXTDSA-N 1 1 370.409 2.623 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCc1nccc(C(F)(F)F)n1 ZINC001351758597 1054984156 /nfs/dbraw/zinc/98/41/56/1054984156.db2.gz IDCKFCFFCJGNFZ-UHFFFAOYSA-N 1 1 370.331 2.957 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC001351779765 1054996140 /nfs/dbraw/zinc/99/61/40/1054996140.db2.gz CFDFWHQRZXFSNA-JTQLQIEISA-N 1 1 372.351 2.540 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC001352451518 1055487531 /nfs/dbraw/zinc/48/75/31/1055487531.db2.gz CFFWZQBIJCIVIJ-STQMWFEESA-N 1 1 364.475 2.580 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001349833944 1055492490 /nfs/dbraw/zinc/49/24/90/1055492490.db2.gz NYGNNSDUIWXAQT-ZWKOTPCHSA-N 1 1 358.442 2.679 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001350370410 1055744955 /nfs/dbraw/zinc/74/49/55/1055744955.db2.gz APVUJBBBDSIUEM-ZDUSSCGKSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001350370410 1055744964 /nfs/dbraw/zinc/74/49/64/1055744964.db2.gz APVUJBBBDSIUEM-ZDUSSCGKSA-N 1 1 361.377 2.795 20 5 FFBDMO C[C@@H](Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12)[C@@H](C)[NH+]1CCOCC1 ZINC001350456333 1055783399 /nfs/dbraw/zinc/78/33/99/1055783399.db2.gz JUOUSPAEYQFFGL-GHMZBOCLSA-N 1 1 365.821 2.713 20 5 FFBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCCO1 ZINC001339476547 1056492300 /nfs/dbraw/zinc/49/23/00/1056492300.db2.gz YZOAATGQRPDKSE-ZIAGYGMSSA-N 1 1 359.220 2.641 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2cnn(C)c2)C1 ZINC000849483056 1056870065 /nfs/dbraw/zinc/87/00/65/1056870065.db2.gz VJAQJTAPKCBPTD-QZTJIDSGSA-N 1 1 371.441 2.781 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001443603144 1058224271 /nfs/dbraw/zinc/22/42/71/1058224271.db2.gz WFUQHSFTAQLLAE-UHFFFAOYSA-N 1 1 374.397 2.506 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001472057529 1058325091 /nfs/dbraw/zinc/32/50/91/1058325091.db2.gz RCIDWQDWOHUUAX-OAHLLOKOSA-N 1 1 369.849 2.864 20 5 FFBDMO O=C(Nc1cccc2c1C[N@H+](C1CC1)C2)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001447229769 1058610859 /nfs/dbraw/zinc/61/08/59/1058610859.db2.gz MYQXPCRQZZHVCF-SFHVURJKSA-N 1 1 353.378 2.745 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC1 ZINC001354417141 1058974171 /nfs/dbraw/zinc/97/41/71/1058974171.db2.gz XANFWAPJCRHJPM-UHFFFAOYSA-N 1 1 367.409 2.564 20 5 FFBDMO Cc1cc(C)c(C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1 ZINC001505811635 1059404060 /nfs/dbraw/zinc/40/40/60/1059404060.db2.gz OEOUCGBAMJDKQL-SJLPKXTDSA-N 1 1 361.486 2.851 20 5 FFBDMO O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001454337513 1059506523 /nfs/dbraw/zinc/50/65/23/1059506523.db2.gz JDPLIAANWNVFQC-HNNXBMFYSA-N 1 1 361.785 2.741 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000848350288 1059834447 /nfs/dbraw/zinc/83/44/47/1059834447.db2.gz PKPHJIKXXXAMEX-MJGOQNOKSA-N 1 1 372.469 2.942 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCc1nccc(C(F)(F)F)n1 ZINC001355085471 1059873149 /nfs/dbraw/zinc/87/31/49/1059873149.db2.gz REQUFPJTHZCMPU-UHFFFAOYSA-N 1 1 370.331 2.957 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848475181 1060091072 /nfs/dbraw/zinc/09/10/72/1060091072.db2.gz KQCOTSHZKDMANR-OAHLLOKOSA-N 1 1 358.398 2.833 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848475181 1060091094 /nfs/dbraw/zinc/09/10/94/1060091094.db2.gz KQCOTSHZKDMANR-OAHLLOKOSA-N 1 1 358.398 2.833 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1 ZINC000848581835 1060309121 /nfs/dbraw/zinc/30/91/21/1060309121.db2.gz CTTHUTLRSUEWLQ-UHFFFAOYSA-N 1 1 368.340 2.703 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001458135728 1060521602 /nfs/dbraw/zinc/52/16/02/1060521602.db2.gz XUCVCJLSLSYXSU-GFCCVEGCSA-N 1 1 359.386 2.617 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2C)C1 ZINC001458546971 1060619789 /nfs/dbraw/zinc/61/97/89/1060619789.db2.gz KGCNKGKIKYXGIE-SFHVURJKSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2C)C1 ZINC001458546971 1060619797 /nfs/dbraw/zinc/61/97/97/1060619797.db2.gz KGCNKGKIKYXGIE-SFHVURJKSA-N 1 1 356.426 2.920 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2[C@@H]2C[C@H]2C)C[C@@H]1C ZINC001547710941 1071990575 /nfs/dbraw/zinc/99/05/75/1071990575.db2.gz QINNQVQIPAHICD-JKIFEVAISA-N 1 1 370.457 2.965 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848783796 1060687633 /nfs/dbraw/zinc/68/76/33/1060687633.db2.gz CYSGIBPJPMTPNY-ZWKOTPCHSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C1[C@H]([N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460925364 1061152355 /nfs/dbraw/zinc/15/23/55/1061152355.db2.gz SUKCCOSTYJWICJ-TXPKVOOTSA-N 1 1 373.453 2.839 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC001522551314 1062208749 /nfs/dbraw/zinc/20/87/49/1062208749.db2.gz PHWQDWQERHOZRK-NOLJZWGESA-N 1 1 351.834 2.637 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccc(C)cc2)CC1 ZINC001479993919 1063023409 /nfs/dbraw/zinc/02/34/09/1063023409.db2.gz WEZFOWIIRBMOIN-RTBURBONSA-N 1 1 359.470 2.863 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001465619772 1063156510 /nfs/dbraw/zinc/15/65/10/1063156510.db2.gz AAQULNOJVCOACW-GOEBONIOSA-N 1 1 368.437 2.960 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC001439893213 1063229978 /nfs/dbraw/zinc/22/99/78/1063229978.db2.gz XFVRJEQDXLFUNF-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001495518113 1063502668 /nfs/dbraw/zinc/50/26/68/1063502668.db2.gz WTGXQMCARRJVEK-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001468974480 1064067641 /nfs/dbraw/zinc/06/76/41/1064067641.db2.gz LMLLOKNAABXWHM-CQSZACIVSA-N 1 1 359.430 2.983 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001470781685 1064449528 /nfs/dbraw/zinc/44/95/28/1064449528.db2.gz XYPKRKSYSRHBEO-LIRRHRJNSA-N 1 1 368.437 2.817 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@H](CCO)C2)o1 ZINC001473150023 1065209102 /nfs/dbraw/zinc/20/91/02/1065209102.db2.gz CLNQUXIAUAVOOZ-LLVKDONJSA-N 1 1 366.805 2.893 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@H](CCO)C2)o1 ZINC001473150023 1065209108 /nfs/dbraw/zinc/20/91/08/1065209108.db2.gz CLNQUXIAUAVOOZ-LLVKDONJSA-N 1 1 366.805 2.893 20 5 FFBDMO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1nc(Cc2ccccc2)no1 ZINC001474496246 1065537078 /nfs/dbraw/zinc/53/70/78/1065537078.db2.gz IDSJSWAPSOYXHF-LRVUVFPRSA-N 1 1 368.397 2.819 20 5 FFBDMO COc1c(F)cc(F)cc1NC(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001579134878 1078573667 /nfs/dbraw/zinc/57/36/67/1078573667.db2.gz RPPIAXYSMFZFSF-MRXNPFEDSA-N 1 1 351.309 2.694 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC001584213314 1079323504 /nfs/dbraw/zinc/32/35/04/1079323504.db2.gz QHXAVNSUJQHEIW-DNVCBOLYSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC001584213314 1079323507 /nfs/dbraw/zinc/32/35/07/1079323507.db2.gz QHXAVNSUJQHEIW-DNVCBOLYSA-N 1 1 369.421 2.673 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001585629528 1079482171 /nfs/dbraw/zinc/48/21/71/1079482171.db2.gz XCSLMYUZUBDOIK-KBPBESRZSA-N 1 1 354.410 2.687 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001558528256 1076025352 /nfs/dbraw/zinc/02/53/52/1076025352.db2.gz UVPSSIYXAFJTLA-ZDUSSCGKSA-N 1 1 370.247 2.817 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)cc1F ZINC001559079085 1076123931 /nfs/dbraw/zinc/12/39/31/1076123931.db2.gz IMIIHRDIICFKFF-UHFFFAOYSA-N 1 1 369.356 2.939 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCN(Cc3cn(C)nc3[N+](=O)[O-])CC2)cc1 ZINC001559857107 1076196628 /nfs/dbraw/zinc/19/66/28/1076196628.db2.gz YCSBJHKXPMTQQE-UHFFFAOYSA-N 1 1 357.458 2.770 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3ncccn3)CC2)cccc1[N+](=O)[O-] ZINC001560157450 1076238429 /nfs/dbraw/zinc/23/84/29/1076238429.db2.gz AFBWPPDQHIMHLU-CQSZACIVSA-N 1 1 369.425 2.900 20 5 FFBDMO CCCC[N@H+](Cc1c(C)oc(C)c1C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC001560164175 1076239488 /nfs/dbraw/zinc/23/94/88/1076239488.db2.gz NYJQEPXKMJXDKD-KRWDZBQOSA-N 1 1 364.446 2.973 20 5 FFBDMO COC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1cccc(OC)c1 ZINC001560921156 1076309762 /nfs/dbraw/zinc/30/97/62/1076309762.db2.gz COZXGAMYQULSKR-HNNXBMFYSA-N 1 1 362.382 2.795 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC001561617614 1076399028 /nfs/dbraw/zinc/39/90/28/1076399028.db2.gz PUHFHMNDVWNMBO-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1c(CNC(=O)NC[C@H]2c3ccccc3C[N@H+]2C)cccc1[N+](=O)[O-] ZINC001564555349 1076644105 /nfs/dbraw/zinc/64/41/05/1076644105.db2.gz QXPTUNDJMKMQQA-SFHVURJKSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1c(CNC(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)cccc1[N+](=O)[O-] ZINC001564555349 1076644107 /nfs/dbraw/zinc/64/41/07/1076644107.db2.gz QXPTUNDJMKMQQA-SFHVURJKSA-N 1 1 354.410 2.889 20 5 FFBDMO CCC1([NH2+]Cc2ccc(CF)cc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570255334 1077193339 /nfs/dbraw/zinc/19/33/39/1077193339.db2.gz ZVBMBVAFRZDLJM-IAGOWNOFSA-N 1 1 363.433 2.682 20 5 FFBDMO CC[N@@H+](CC=C(Cl)Cl)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001570501307 1077210953 /nfs/dbraw/zinc/21/09/53/1077210953.db2.gz IZVJWQIJEKXRKG-CHWSQXEVSA-N 1 1 364.273 2.531 20 5 FFBDMO CC[N@H+](CC=C(Cl)Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570501307 1077210958 /nfs/dbraw/zinc/21/09/58/1077210958.db2.gz IZVJWQIJEKXRKG-CHWSQXEVSA-N 1 1 364.273 2.531 20 5 FFBDMO CC[N@@H+](CC=C(Cl)Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570501307 1077210961 /nfs/dbraw/zinc/21/09/61/1077210961.db2.gz IZVJWQIJEKXRKG-CHWSQXEVSA-N 1 1 364.273 2.531 20 5 FFBDMO CCC[N@H+]1CCC[C@@H](C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001586524875 1079645369 /nfs/dbraw/zinc/64/53/69/1079645369.db2.gz LXFKZLXEWVPULY-MRXNPFEDSA-N 1 1 362.474 2.943 20 5 FFBDMO CC(C)([NH2+]Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc(F)c1 ZINC001589321627 1080481735 /nfs/dbraw/zinc/48/17/35/1080481735.db2.gz HHSQQXQFXYYSRD-UHFFFAOYSA-N 1 1 356.361 2.939 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590187258 1081077746 /nfs/dbraw/zinc/07/77/46/1081077746.db2.gz IHVISSFLQRRTMA-FRRDWIJNSA-N 1 1 359.434 2.553 20 5 FFBDMO C[N@@H+]1CCc2[nH]c(=NC(=O)c3ccc([N+](=O)[O-])cc3Cl)sc2C1 ZINC000024152335 539726477 /nfs/dbraw/zinc/72/64/77/539726477.db2.gz ZZYJBXKCCLHJDE-UHFFFAOYSA-N 1 1 352.803 2.945 20 5 FFBDMO C[N@H+]1CCc2[nH]c(=NC(=O)c3ccc([N+](=O)[O-])cc3Cl)sc2C1 ZINC000024152335 539726481 /nfs/dbraw/zinc/72/64/81/539726481.db2.gz ZZYJBXKCCLHJDE-UHFFFAOYSA-N 1 1 352.803 2.945 20 5 FFBDMO Cc1nsc(N2CCC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000093716711 250041376 /nfs/dbraw/zinc/04/13/76/250041376.db2.gz LYPKSHDFFYFOFH-QPJJXVBHSA-N 1 1 359.455 2.980 20 5 FFBDMO Cc1nsc(N2CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000093716711 250041379 /nfs/dbraw/zinc/04/13/79/250041379.db2.gz LYPKSHDFFYFOFH-QPJJXVBHSA-N 1 1 359.455 2.980 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008393 251037261 /nfs/dbraw/zinc/03/72/61/251037261.db2.gz MYQHJKAQTKZQEM-MLGOLLRUSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008393 251037265 /nfs/dbraw/zinc/03/72/65/251037265.db2.gz MYQHJKAQTKZQEM-MLGOLLRUSA-N 1 1 364.833 2.927 20 5 FFBDMO COCC[N@H+](C)[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000267386427 251341847 /nfs/dbraw/zinc/34/18/47/251341847.db2.gz BQBZLZIKTWVZTH-NSHDSACASA-N 1 1 364.427 2.624 20 5 FFBDMO COCC[N@@H+](C)[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000267386427 251341850 /nfs/dbraw/zinc/34/18/50/251341850.db2.gz BQBZLZIKTWVZTH-NSHDSACASA-N 1 1 364.427 2.624 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)[C@H]2C1 ZINC000272383862 252024241 /nfs/dbraw/zinc/02/42/41/252024241.db2.gz CCDKXXOIKPULTE-LRDDRELGSA-N 1 1 372.450 2.885 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@H]2C1 ZINC000272415062 252032384 /nfs/dbraw/zinc/03/23/84/252032384.db2.gz GAXDPHAGXPFEKE-YGRLFVJLSA-N 1 1 357.332 2.780 20 5 FFBDMO COc1ccccc1[C@@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272978417 252181717 /nfs/dbraw/zinc/18/17/17/252181717.db2.gz XMARACWZIFLFIJ-CYBMUJFWSA-N 1 1 364.423 2.728 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000273055986 252202939 /nfs/dbraw/zinc/20/29/39/252202939.db2.gz RUNRSVFKWCJLLH-JXFKEZNVSA-N 1 1 372.421 2.580 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](N3CCCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000285706837 257000764 /nfs/dbraw/zinc/00/07/64/257000764.db2.gz WENXHQLBWCYLER-GDBMZVCRSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](N3CCCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000285706837 257000765 /nfs/dbraw/zinc/00/07/65/257000765.db2.gz WENXHQLBWCYLER-GDBMZVCRSA-N 1 1 360.458 2.790 20 5 FFBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000276321324 256090005 /nfs/dbraw/zinc/09/00/05/256090005.db2.gz YWDCUSAQWDWDJM-RISCZKNCSA-N 1 1 362.348 2.997 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCCO1 ZINC000277741393 256233921 /nfs/dbraw/zinc/23/39/21/256233921.db2.gz YCYWFUPCNGAWDP-CYBMUJFWSA-N 1 1 361.398 2.572 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278485920 256317638 /nfs/dbraw/zinc/31/76/38/256317638.db2.gz SNKCGSATBZLCRU-LBPRGKRZSA-N 1 1 360.336 2.507 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000278690698 256338653 /nfs/dbraw/zinc/33/86/53/256338653.db2.gz HOXFEFRFSQVENI-LBPRGKRZSA-N 1 1 371.384 2.886 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CNC3CC[NH+](Cc4ccccn4)CC3)nc2c1 ZINC000278698631 256339036 /nfs/dbraw/zinc/33/90/36/256339036.db2.gz NLOWFZQJGOCHRH-UHFFFAOYSA-N 1 1 366.425 2.620 20 5 FFBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936525 257012214 /nfs/dbraw/zinc/01/22/14/257012214.db2.gz LZFVDNGBBGPDGH-KDOFPFPSSA-N 1 1 372.425 2.545 20 5 FFBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936525 257012215 /nfs/dbraw/zinc/01/22/15/257012215.db2.gz LZFVDNGBBGPDGH-KDOFPFPSSA-N 1 1 372.425 2.545 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@@H]2C1 ZINC000286492270 257039881 /nfs/dbraw/zinc/03/98/81/257039881.db2.gz TXFMIZAAQNCUHW-RHSMWYFYSA-N 1 1 366.421 2.823 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000286624825 257046331 /nfs/dbraw/zinc/04/63/31/257046331.db2.gz WCQSGDPQUYVWSI-UHFFFAOYSA-N 1 1 350.463 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](OCc4ccncc4)C3)nc2c1 ZINC000287848849 257121032 /nfs/dbraw/zinc/12/10/32/257121032.db2.gz RAQBJJRQQXTGOL-HNNXBMFYSA-N 1 1 354.366 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](OCc4ccncc4)C3)nc2c1 ZINC000287848849 257121033 /nfs/dbraw/zinc/12/10/33/257121033.db2.gz RAQBJJRQQXTGOL-HNNXBMFYSA-N 1 1 354.366 2.922 20 5 FFBDMO CN1CCN(CCC[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000289388348 257277941 /nfs/dbraw/zinc/27/79/41/257277941.db2.gz DLGWVMSFEKFCPY-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO CN1CCN(CCC[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000289388348 257277942 /nfs/dbraw/zinc/27/79/42/257277942.db2.gz DLGWVMSFEKFCPY-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)[C@@H](C)C1 ZINC000289875178 257303940 /nfs/dbraw/zinc/30/39/40/257303940.db2.gz NYSWEUUKDGENEO-XJKSGUPXSA-N 1 1 358.446 2.557 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301186430 258032558 /nfs/dbraw/zinc/03/25/58/258032558.db2.gz KGFSBBWGEWGJNR-GOSISDBHSA-N 1 1 369.469 2.749 20 5 FFBDMO CC(C)c1nc(C2CC[NH+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)no1 ZINC000299606454 258009524 /nfs/dbraw/zinc/00/95/24/258009524.db2.gz GAOAMJCNKLQCCX-UHFFFAOYSA-N 1 1 373.413 2.580 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C3CC3)CC2)nc1OCc1ccccc1 ZINC000302184512 258093702 /nfs/dbraw/zinc/09/37/02/258093702.db2.gz SQKARYSHWDPUOM-UHFFFAOYSA-N 1 1 354.410 2.853 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1 ZINC000302215304 258095819 /nfs/dbraw/zinc/09/58/19/258095819.db2.gz ZXSGSHCDUOKBLV-ZDUSSCGKSA-N 1 1 358.398 2.574 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000302754113 258109753 /nfs/dbraw/zinc/10/97/53/258109753.db2.gz IANAVANBXGVGQX-CJNGLKHVSA-N 1 1 370.409 2.709 20 5 FFBDMO COC(=O)c1cnc(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000302784771 258110793 /nfs/dbraw/zinc/11/07/93/258110793.db2.gz UZJICVUEICXLSL-GFCCVEGCSA-N 1 1 350.419 2.699 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000301544564 258054798 /nfs/dbraw/zinc/05/47/98/258054798.db2.gz WHBFKASPGNNBGQ-UHFFFAOYSA-N 1 1 352.803 2.667 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301630895 258059852 /nfs/dbraw/zinc/05/98/52/258059852.db2.gz BLMONRGBNUKFBH-ZDUSSCGKSA-N 1 1 362.430 2.992 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000301873846 258072271 /nfs/dbraw/zinc/07/22/71/258072271.db2.gz HZAVMJPFMIGKIX-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000301873846 258072273 /nfs/dbraw/zinc/07/22/73/258072273.db2.gz HZAVMJPFMIGKIX-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[C@H]1[NH+]1CCOCC1 ZINC000301884155 258072656 /nfs/dbraw/zinc/07/26/56/258072656.db2.gz YNMILGVVSDEXPU-CRAIPNDOSA-N 1 1 368.437 2.814 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000331212510 258179856 /nfs/dbraw/zinc/17/98/56/258179856.db2.gz KFKYEFNLAOQMJN-XQQFMLRXSA-N 1 1 351.451 2.538 20 5 FFBDMO Cc1c(NC(=O)CCN2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000332008720 258210018 /nfs/dbraw/zinc/21/00/18/258210018.db2.gz JSUQEZANNSMVID-GOEBONIOSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000332264133 258222177 /nfs/dbraw/zinc/22/21/77/258222177.db2.gz ODOMQPFAVLOSNW-ZIAGYGMSSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000332525090 258233639 /nfs/dbraw/zinc/23/36/39/258233639.db2.gz ROIPDVWFJFFMAN-GFCCVEGCSA-N 1 1 355.341 2.507 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000332525090 258233640 /nfs/dbraw/zinc/23/36/40/258233640.db2.gz ROIPDVWFJFFMAN-GFCCVEGCSA-N 1 1 355.341 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000026729774 136153214 /nfs/dbraw/zinc/15/32/14/136153214.db2.gz DORLHJRBQQINGE-UHFFFAOYSA-N 1 1 372.381 2.704 20 5 FFBDMO Cc1nn(C)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1Br ZINC000231885668 509446029 /nfs/dbraw/zinc/44/60/29/509446029.db2.gz PINATCGZOITTHQ-UHFFFAOYSA-N 1 1 353.220 2.997 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](c2ccccc2)C1 ZINC000032313887 506242088 /nfs/dbraw/zinc/24/20/88/506242088.db2.gz RZSNWLFJHUURRB-QGZVFWFLSA-N 1 1 365.393 2.600 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](c2ccccc2)C1 ZINC000032313887 506242094 /nfs/dbraw/zinc/24/20/94/506242094.db2.gz RZSNWLFJHUURRB-QGZVFWFLSA-N 1 1 365.393 2.600 20 5 FFBDMO C[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000053016585 506295524 /nfs/dbraw/zinc/29/55/24/506295524.db2.gz DIVBLSLKQXQGFA-CQSZACIVSA-N 1 1 374.466 2.597 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3nccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261356 512190946 /nfs/dbraw/zinc/19/09/46/512190946.db2.gz INWAVLJILUPPLD-CQSZACIVSA-N 1 1 360.414 2.595 20 5 FFBDMO CNC(=O)[C@H](CC(C)C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602579137 521420796 /nfs/dbraw/zinc/42/07/96/521420796.db2.gz ATDLTHBLZIKINS-JTQLQIEISA-N 1 1 364.265 2.669 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CCOc1ccccc1 ZINC000007419100 506562271 /nfs/dbraw/zinc/56/22/71/506562271.db2.gz BFLDIZNZEQDPTL-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCOc1ccccc1 ZINC000007419100 506562277 /nfs/dbraw/zinc/56/22/77/506562277.db2.gz BFLDIZNZEQDPTL-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NCC[N@H+]1CCc2ccccc2C1 ZINC000055181329 506694377 /nfs/dbraw/zinc/69/43/77/506694377.db2.gz CUSOSQDLHMJTEV-UHFFFAOYSA-N 1 1 369.421 2.538 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043346381 506737655 /nfs/dbraw/zinc/73/76/55/506737655.db2.gz OBZGBYLTKFNQDL-UPJWGTAASA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043346381 506737658 /nfs/dbraw/zinc/73/76/58/506737658.db2.gz OBZGBYLTKFNQDL-UPJWGTAASA-N 1 1 350.419 2.522 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)[NH+](C)C ZINC000067130344 506765262 /nfs/dbraw/zinc/76/52/62/506765262.db2.gz SXGYPOIHJZESBO-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000067175171 506781832 /nfs/dbraw/zinc/78/18/32/506781832.db2.gz WAVGXSKQDONKIM-UHFFFAOYSA-N 1 1 371.441 2.611 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000067175171 506781843 /nfs/dbraw/zinc/78/18/43/506781843.db2.gz WAVGXSKQDONKIM-UHFFFAOYSA-N 1 1 371.441 2.611 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000067175171 506781851 /nfs/dbraw/zinc/78/18/51/506781851.db2.gz WAVGXSKQDONKIM-UHFFFAOYSA-N 1 1 371.441 2.611 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000367026223 512301289 /nfs/dbraw/zinc/30/12/89/512301289.db2.gz KSXPQPGINKIDEV-LJQANCHMSA-N 1 1 368.437 2.655 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000367026223 512301294 /nfs/dbraw/zinc/30/12/94/512301294.db2.gz KSXPQPGINKIDEV-LJQANCHMSA-N 1 1 368.437 2.655 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000056039451 506916558 /nfs/dbraw/zinc/91/65/58/506916558.db2.gz GKZFZRYJCZPNCS-UHFFFAOYSA-N 1 1 369.421 2.651 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000045313595 506949171 /nfs/dbraw/zinc/94/91/71/506949171.db2.gz FJCVWORFKYHYDT-GOSISDBHSA-N 1 1 356.426 2.736 20 5 FFBDMO COc1ccc(CC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067793059 507011410 /nfs/dbraw/zinc/01/14/10/507011410.db2.gz HDSPZYBRXJEEFI-KRWDZBQOSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCOc1ccc(C)cc1 ZINC000015102554 507020219 /nfs/dbraw/zinc/02/02/19/507020219.db2.gz JJRBVVKOLFSGKI-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCOc1ccc(C)cc1 ZINC000015102554 507020223 /nfs/dbraw/zinc/02/02/23/507020223.db2.gz JJRBVVKOLFSGKI-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N2CCCCC2)CC1 ZINC000015297646 507028771 /nfs/dbraw/zinc/02/87/71/507028771.db2.gz UXZPRFJOGDTPSG-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1OC ZINC000375414793 512313893 /nfs/dbraw/zinc/31/38/93/512313893.db2.gz NGOYYIWWHSSORA-LBPRGKRZSA-N 1 1 374.397 2.862 20 5 FFBDMO COc1ccc(CC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000067907334 507047701 /nfs/dbraw/zinc/04/77/01/507047701.db2.gz JRIXWOFNCBBARI-HNNXBMFYSA-N 1 1 363.458 2.917 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000057005756 507144388 /nfs/dbraw/zinc/14/43/88/507144388.db2.gz NAZTUTRPUGGVJE-QGZVFWFLSA-N 1 1 354.410 2.669 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941796 507151517 /nfs/dbraw/zinc/15/15/17/507151517.db2.gz MMNOEDHYMDKCBI-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941796 507151521 /nfs/dbraw/zinc/15/15/21/507151521.db2.gz MMNOEDHYMDKCBI-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000023700533 507367210 /nfs/dbraw/zinc/36/72/10/507367210.db2.gz KWFHKSFLLZLHGQ-UHFFFAOYSA-N 1 1 357.366 2.784 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000023700533 507367216 /nfs/dbraw/zinc/36/72/16/507367216.db2.gz KWFHKSFLLZLHGQ-UHFFFAOYSA-N 1 1 357.366 2.784 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@H](C)O1 ZINC000048317212 507501612 /nfs/dbraw/zinc/50/16/12/507501612.db2.gz SUDFZIOHDBNYTM-STQMWFEESA-N 1 1 374.441 2.694 20 5 FFBDMO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026209033 507567183 /nfs/dbraw/zinc/56/71/83/507567183.db2.gz SXNWZHHSMDOSLZ-ZDUSSCGKSA-N 1 1 371.393 2.840 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026209033 507567187 /nfs/dbraw/zinc/56/71/87/507567187.db2.gz SXNWZHHSMDOSLZ-ZDUSSCGKSA-N 1 1 371.393 2.840 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000070711228 507622014 /nfs/dbraw/zinc/62/20/14/507622014.db2.gz IXMVKPUUDMSHFH-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3cccc(Cl)c3)CC2)cn1 ZINC000027231156 507640375 /nfs/dbraw/zinc/64/03/75/507640375.db2.gz VFXLEBCSYUBXKW-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Cc1cccc(OCC[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000027703671 507678765 /nfs/dbraw/zinc/67/87/65/507678765.db2.gz WIAZLAMMYGQVHN-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000027703671 507678770 /nfs/dbraw/zinc/67/87/70/507678770.db2.gz WIAZLAMMYGQVHN-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000050784462 507713071 /nfs/dbraw/zinc/71/30/71/507713071.db2.gz FOPUZZQNUVAORP-KRWDZBQOSA-N 1 1 353.378 2.667 20 5 FFBDMO Cc1ccccc1C[N@H+](C)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000050784462 507713074 /nfs/dbraw/zinc/71/30/74/507713074.db2.gz FOPUZZQNUVAORP-KRWDZBQOSA-N 1 1 353.378 2.667 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncc([N+](=O)[O-])c(N)n1 ZINC000071954947 507728526 /nfs/dbraw/zinc/72/85/26/507728526.db2.gz OKSPTSIMRLAMCQ-ZDUSSCGKSA-N 1 1 356.430 2.954 20 5 FFBDMO CC[N@H+](Cc1ccc(OC)cc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051406163 507768722 /nfs/dbraw/zinc/76/87/22/507768722.db2.gz VBDWORKFHITATA-QGZVFWFLSA-N 1 1 360.410 2.865 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccc(F)cc3[N+](=O)[O-])cc2)CC1 ZINC000052241820 507803756 /nfs/dbraw/zinc/80/37/56/507803756.db2.gz XCBCZZKDSKNCIE-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072725332 507847792 /nfs/dbraw/zinc/84/77/92/507847792.db2.gz OFANTYOTYCZJFT-ZDUSSCGKSA-N 1 1 368.865 2.993 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644388 507853457 /nfs/dbraw/zinc/85/34/57/507853457.db2.gz IQSAFIQKFWUUFE-RBUKOAKNSA-N 1 1 371.437 2.789 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000072976709 507879708 /nfs/dbraw/zinc/87/97/08/507879708.db2.gz AUMLHAJMZWKLSE-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000078641660 507892183 /nfs/dbraw/zinc/89/21/83/507892183.db2.gz JLWAWXSFOYOZQZ-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)c1 ZINC000073305162 507912329 /nfs/dbraw/zinc/91/23/29/507912329.db2.gz MVSLHZUBVPWHKX-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O)CCC2 ZINC000090559552 507927486 /nfs/dbraw/zinc/92/74/86/507927486.db2.gz IYCDEAWVUOVRDJ-CQSZACIVSA-N 1 1 362.455 2.785 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000090588977 507929298 /nfs/dbraw/zinc/92/92/98/507929298.db2.gz YLRBYHALKKGBMM-CQSZACIVSA-N 1 1 363.801 2.563 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](Oc2ccccc2Cl)C1 ZINC000090588977 507929300 /nfs/dbraw/zinc/92/93/00/507929300.db2.gz YLRBYHALKKGBMM-CQSZACIVSA-N 1 1 363.801 2.563 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000109428645 507962171 /nfs/dbraw/zinc/96/21/71/507962171.db2.gz HDCYOCDKSKWROS-UHFFFAOYSA-N 1 1 351.451 2.655 20 5 FFBDMO CCOCC[NH+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000110560049 508033803 /nfs/dbraw/zinc/03/38/03/508033803.db2.gz OZMBBWRHDYHKFA-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@@H](C)[NH+]2CCOCC2)cc1 ZINC000110722478 508043118 /nfs/dbraw/zinc/04/31/18/508043118.db2.gz HTFRDEJIDAKASF-CQSZACIVSA-N 1 1 370.409 2.944 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000110815713 508049633 /nfs/dbraw/zinc/04/96/33/508049633.db2.gz FRUDSLLSCNFXLQ-UHFFFAOYSA-N 1 1 374.485 2.999 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000075109131 508083372 /nfs/dbraw/zinc/08/33/72/508083372.db2.gz BHFOLNSCBNSCAF-GOSISDBHSA-N 1 1 368.437 2.711 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](CO)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000092764913 508100500 /nfs/dbraw/zinc/10/05/00/508100500.db2.gz HHUYBVRPIQOPNP-KRWDZBQOSA-N 1 1 372.421 2.997 20 5 FFBDMO CCOc1cc(N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000080788477 508103311 /nfs/dbraw/zinc/10/33/11/508103311.db2.gz JAOCFEXNMOGLOU-KRWDZBQOSA-N 1 1 362.474 2.600 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000075748517 508132481 /nfs/dbraw/zinc/13/24/81/508132481.db2.gz XDTRIYZMYGWOTC-CQSZACIVSA-N 1 1 354.410 2.577 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093360496 508142200 /nfs/dbraw/zinc/14/22/00/508142200.db2.gz OQHJKPRNHYNJAQ-ZDUSSCGKSA-N 1 1 360.439 2.676 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093360496 508142202 /nfs/dbraw/zinc/14/22/02/508142202.db2.gz OQHJKPRNHYNJAQ-ZDUSSCGKSA-N 1 1 360.439 2.676 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415947 508203881 /nfs/dbraw/zinc/20/38/81/508203881.db2.gz UDTMTBJPTVVJQQ-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415947 508203883 /nfs/dbraw/zinc/20/38/83/508203883.db2.gz UDTMTBJPTVVJQQ-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1cc(C(=O)NC2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)no1 ZINC000371411149 512383957 /nfs/dbraw/zinc/38/39/57/512383957.db2.gz LVXUCISRPINDQG-UHFFFAOYSA-N 1 1 358.398 2.594 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OC[C@@H]4CCCO4)CC3)nc2c1 ZINC000083412512 508244297 /nfs/dbraw/zinc/24/42/97/508244297.db2.gz VWQYUQVYPZGIAZ-HNNXBMFYSA-N 1 1 361.398 2.896 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000085636700 508315218 /nfs/dbraw/zinc/31/52/18/508315218.db2.gz JFKRPTYPGVXYOD-HNNXBMFYSA-N 1 1 362.430 2.540 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000114459515 508316168 /nfs/dbraw/zinc/31/61/68/508316168.db2.gz RCNQARJNFKIDOW-HZPDHXFCSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152289670 508416139 /nfs/dbraw/zinc/41/61/39/508416139.db2.gz MAWCOWWGLXPZCS-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152289670 508416143 /nfs/dbraw/zinc/41/61/43/508416143.db2.gz MAWCOWWGLXPZCS-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152289670 508416147 /nfs/dbraw/zinc/41/61/47/508416147.db2.gz MAWCOWWGLXPZCS-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115640206 508420054 /nfs/dbraw/zinc/42/00/54/508420054.db2.gz OQWYIBLHSJJRCO-RHSMWYFYSA-N 1 1 364.446 2.853 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000156549880 508437613 /nfs/dbraw/zinc/43/76/13/508437613.db2.gz NWVSPQGBOSIXDL-ZBFHGGJFSA-N 1 1 350.415 2.682 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000156550014 508437862 /nfs/dbraw/zinc/43/78/62/508437862.db2.gz NWVSPQGBOSIXDL-HOCLYGCPSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)CCOc2ccccc2[N+](=O)[O-])c1 ZINC000156680940 508461609 /nfs/dbraw/zinc/46/16/09/508461609.db2.gz WANQFWKCTRISDF-UHFFFAOYSA-N 1 1 367.365 2.892 20 5 FFBDMO C[C@H](O)C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668388 508490785 /nfs/dbraw/zinc/49/07/85/508490785.db2.gz NGVQRVTYZJITOK-SRVKXCTJSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668388 508490790 /nfs/dbraw/zinc/49/07/90/508490790.db2.gz NGVQRVTYZJITOK-SRVKXCTJSA-N 1 1 355.822 2.811 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000116280311 508494971 /nfs/dbraw/zinc/49/49/71/508494971.db2.gz HAFSVFRVXGOBBF-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000116280311 508494974 /nfs/dbraw/zinc/49/49/74/508494974.db2.gz HAFSVFRVXGOBBF-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414808 508531475 /nfs/dbraw/zinc/53/14/75/508531475.db2.gz QSLYPOMPHPUGCX-CRAIPNDOSA-N 1 1 365.474 2.830 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000116727797 508552079 /nfs/dbraw/zinc/55/20/79/508552079.db2.gz YZIZYSNIDCUPIP-ZDUSSCGKSA-N 1 1 369.849 2.865 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000122991701 508619042 /nfs/dbraw/zinc/61/90/42/508619042.db2.gz FTPKLWBZWDUEAG-MRXNPFEDSA-N 1 1 356.382 2.631 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(C2CCOCC2)CC1 ZINC000153679574 508624366 /nfs/dbraw/zinc/62/43/66/508624366.db2.gz BQQIZQFZKZQQEZ-UHFFFAOYSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc(NC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000153741366 508639418 /nfs/dbraw/zinc/63/94/18/508639418.db2.gz KJYBBXUPBUFLCR-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000153750013 508641404 /nfs/dbraw/zinc/64/14/04/508641404.db2.gz GHDNRFVBNOVTJL-LJQANCHMSA-N 1 1 374.485 2.610 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000153893628 508672206 /nfs/dbraw/zinc/67/22/06/508672206.db2.gz MNGYZXQYSGAADZ-CXAGYDPISA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(CNC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)C1 ZINC000136245293 508681556 /nfs/dbraw/zinc/68/15/56/508681556.db2.gz NEPSVVIANQUMRX-ZIAGYGMSSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C[N@H+]1C1CC1 ZINC000123435919 508686655 /nfs/dbraw/zinc/68/66/55/508686655.db2.gz DCBZCEJZKQHZFA-ZFWWWQNUSA-N 1 1 358.442 2.894 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@H]1CO)Nc1cc([N+](=O)[O-])ccc1F ZINC000129125017 508687482 /nfs/dbraw/zinc/68/74/82/508687482.db2.gz FSKMHCMNNNVTMB-GOSISDBHSA-N 1 1 373.384 2.654 20 5 FFBDMO Cc1sc(S(=O)(=O)N(CC[NH+](C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000123462502 508690808 /nfs/dbraw/zinc/69/08/08/508690808.db2.gz RCRHYRYAFUEHEJ-UHFFFAOYSA-N 1 1 369.468 2.722 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000153986761 508692804 /nfs/dbraw/zinc/69/28/04/508692804.db2.gz SOYVFAPHNQNDCS-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000129183249 508695423 /nfs/dbraw/zinc/69/54/23/508695423.db2.gz JRMUEUOWXNDUTD-PWSUYJOCSA-N 1 1 355.236 2.673 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000123608894 508714299 /nfs/dbraw/zinc/71/42/99/508714299.db2.gz WTLALWKYFVIFAQ-UHFFFAOYSA-N 1 1 366.381 2.559 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137455876 508756180 /nfs/dbraw/zinc/75/61/80/508756180.db2.gz WDRKRUHYXLLZEF-DOTOQJQBSA-N 1 1 369.421 2.753 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119264978 508760327 /nfs/dbraw/zinc/76/03/27/508760327.db2.gz SRCAKTHEOBXRNR-LLVKDONJSA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119264978 508760331 /nfs/dbraw/zinc/76/03/31/508760331.db2.gz SRCAKTHEOBXRNR-LLVKDONJSA-N 1 1 362.411 2.524 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154381344 508772492 /nfs/dbraw/zinc/77/24/92/508772492.db2.gz PHDULBHXQUKSFR-CVEARBPZSA-N 1 1 365.430 2.617 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1)[NH+](C)C ZINC000159085536 508790742 /nfs/dbraw/zinc/79/07/42/508790742.db2.gz MMDXOFCPGQHIEI-INIZCTEOSA-N 1 1 373.409 2.645 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124204553 508796259 /nfs/dbraw/zinc/79/62/59/508796259.db2.gz MYSXDQZPZHVDGJ-MRXNPFEDSA-N 1 1 360.458 2.927 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000159131865 508797008 /nfs/dbraw/zinc/79/70/08/508797008.db2.gz SEENJAHVIIGCKP-ZIAGYGMSSA-N 1 1 358.442 2.855 20 5 FFBDMO Cc1c([C@H](C)[NH2+]Cc2ccnc(N3CCN(C)CC3)c2)cccc1[N+](=O)[O-] ZINC000159165757 508802029 /nfs/dbraw/zinc/80/20/29/508802029.db2.gz ARQUTBXCAIKOHX-INIZCTEOSA-N 1 1 369.469 2.901 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000159172782 508803664 /nfs/dbraw/zinc/80/36/64/508803664.db2.gz JBWYUADEZRALJY-LJQANCHMSA-N 1 1 369.469 2.983 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NCCc2cccc([N+](=O)[O-])c2)[nH+]c1 ZINC000119642010 508834649 /nfs/dbraw/zinc/83/46/49/508834649.db2.gz IJLFKGQKVCOGDG-UHFFFAOYSA-N 1 1 357.414 2.642 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000124497658 508841490 /nfs/dbraw/zinc/84/14/90/508841490.db2.gz BLKMIDUPIAFTAG-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150804701 508896741 /nfs/dbraw/zinc/89/67/41/508896741.db2.gz VNAWACPNCUUOTC-INIZCTEOSA-N 1 1 360.458 2.650 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]2N1C1CC1 ZINC000120162432 508941411 /nfs/dbraw/zinc/94/14/11/508941411.db2.gz NHYOTLHCQRVBOG-WBMJQRKESA-N 1 1 370.409 2.711 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]2N1C1CC1 ZINC000120162432 508941415 /nfs/dbraw/zinc/94/14/15/508941415.db2.gz NHYOTLHCQRVBOG-WBMJQRKESA-N 1 1 370.409 2.711 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000120183853 508945559 /nfs/dbraw/zinc/94/55/59/508945559.db2.gz ZLDTYAQPNUYWQE-HNNXBMFYSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ncc(Br)cc1[N+](=O)[O-] ZINC000120236948 508955828 /nfs/dbraw/zinc/95/58/28/508955828.db2.gz PVGYJBQZRWRQDU-UHFFFAOYSA-N 1 1 354.208 2.784 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000160270972 508963331 /nfs/dbraw/zinc/96/33/31/508963331.db2.gz NOHNTHXBNOOJPK-INIZCTEOSA-N 1 1 362.474 2.949 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccco1 ZINC000120416844 508991747 /nfs/dbraw/zinc/99/17/47/508991747.db2.gz ODHDEHNUZUBDCL-HNNXBMFYSA-N 1 1 354.366 2.769 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCC1CCOCC1 ZINC000120705712 509049430 /nfs/dbraw/zinc/04/94/30/509049430.db2.gz DCCMGANZWWDCDP-CYBMUJFWSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1C ZINC000121014056 509110364 /nfs/dbraw/zinc/11/03/64/509110364.db2.gz UQZRBGISGDPFKV-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000121200865 509149121 /nfs/dbraw/zinc/14/91/21/509149121.db2.gz HLURCGZLGJDZSG-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc([N+](=O)[O-])c1C ZINC000188634473 509184301 /nfs/dbraw/zinc/18/43/01/509184301.db2.gz HBJFISSETCPDQW-CVEARBPZSA-N 1 1 361.442 2.999 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182378956 509202217 /nfs/dbraw/zinc/20/22/17/509202217.db2.gz UDQOIRWJLIDZDC-LBPRGKRZSA-N 1 1 371.384 2.904 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000172752129 509213057 /nfs/dbraw/zinc/21/30/57/509213057.db2.gz UEPLVYLCSIRPOJ-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000248124616 509238729 /nfs/dbraw/zinc/23/87/29/509238729.db2.gz VEOXTEQXXPKOMN-SCLBCKFNSA-N 1 1 356.426 2.561 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@H]21 ZINC000248144183 509246372 /nfs/dbraw/zinc/24/63/72/509246372.db2.gz ZEDGMNHWNUPXDM-SCLBCKFNSA-N 1 1 356.426 2.561 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163834 509251537 /nfs/dbraw/zinc/25/15/37/509251537.db2.gz SPPLINHUNNJSBU-GDBMZVCRSA-N 1 1 357.414 2.561 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2c([N+](=O)[O-])cnn2C)c1 ZINC000162557413 509252122 /nfs/dbraw/zinc/25/21/22/509252122.db2.gz QUJVOZNUPDFYSF-UHFFFAOYSA-N 1 1 368.397 2.949 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000172843327 509268076 /nfs/dbraw/zinc/26/80/76/509268076.db2.gz XLHIKKINBIUTAT-MRXNPFEDSA-N 1 1 371.441 2.727 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000179111075 509269721 /nfs/dbraw/zinc/26/97/21/509269721.db2.gz GEVKTJXBAXACDR-WMZOPIPTSA-N 1 1 354.410 2.839 20 5 FFBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248478861 509338949 /nfs/dbraw/zinc/33/89/49/509338949.db2.gz ZMNKOMKOODNARP-NVXWUHKLSA-N 1 1 359.426 2.900 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000163320711 509363063 /nfs/dbraw/zinc/36/30/63/509363063.db2.gz UAQJYEJWDHPSGZ-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000163320711 509363068 /nfs/dbraw/zinc/36/30/68/509363068.db2.gz UAQJYEJWDHPSGZ-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO CC(C)c1ccnc(N2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000185848844 509386147 /nfs/dbraw/zinc/38/61/47/509386147.db2.gz CMFFTMNTAVROQR-UHFFFAOYSA-N 1 1 371.441 2.709 20 5 FFBDMO C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182821084 509442347 /nfs/dbraw/zinc/44/23/47/509442347.db2.gz OIFKCTLTOJQDGH-GJZGRUSLSA-N 1 1 360.458 2.776 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@H](C)C1 ZINC000183022736 509551945 /nfs/dbraw/zinc/55/19/45/509551945.db2.gz HZJOUWBORSDOGD-BXUZGUMPSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCN(C)CC1 ZINC000192648118 509582547 /nfs/dbraw/zinc/58/25/47/509582547.db2.gz HNBCFBYCLBTZPZ-VQTJNVASSA-N 1 1 360.502 2.834 20 5 FFBDMO CC[NH+]1CCN(CCCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192666045 509589664 /nfs/dbraw/zinc/58/96/64/509589664.db2.gz UVMXMDIULIDOBC-FQEVSTJZSA-N 1 1 360.502 2.980 20 5 FFBDMO COc1cc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000267670808 509590692 /nfs/dbraw/zinc/59/06/92/509590692.db2.gz OBYZXTYVIXESKL-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO CCC(CC)C[NH+]1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000179741244 509599179 /nfs/dbraw/zinc/59/91/79/509599179.db2.gz UCALSZHEROLKSS-UHFFFAOYSA-N 1 1 369.487 2.557 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@H]1CO ZINC000192757956 509630195 /nfs/dbraw/zinc/63/01/95/509630195.db2.gz HHEGDZJKFPFUFO-KRWDZBQOSA-N 1 1 373.457 2.688 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cc1SC ZINC000268171635 509793857 /nfs/dbraw/zinc/79/38/57/509793857.db2.gz FBNBPGSMWDDZRT-MFKMUULPSA-N 1 1 365.455 2.538 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N)cc2)CC1 ZINC000189902532 509818818 /nfs/dbraw/zinc/81/88/18/509818818.db2.gz YYZYODMFJSSHGL-UHFFFAOYSA-N 1 1 369.425 2.571 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[C@H](C[NH+]3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000189913878 509826475 /nfs/dbraw/zinc/82/64/75/509826475.db2.gz ZSGZBQNKXXKBHY-OAHLLOKOSA-N 1 1 361.442 2.513 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000268231958 509827081 /nfs/dbraw/zinc/82/70/81/509827081.db2.gz SIUUPBGPXHSAJX-NOZJJQNGSA-N 1 1 368.231 2.570 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC000173928940 509860419 /nfs/dbraw/zinc/86/04/19/509860419.db2.gz FURMZUAJEFQFMG-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000268325488 509871030 /nfs/dbraw/zinc/87/10/30/509871030.db2.gz CYJRBWPMICGMLE-OAHLLOKOSA-N 1 1 358.442 2.644 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000183591422 509876218 /nfs/dbraw/zinc/87/62/18/509876218.db2.gz ZYTVXMIZWPSFHW-ZDUSSCGKSA-N 1 1 355.398 2.558 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000190018636 509888507 /nfs/dbraw/zinc/88/85/07/509888507.db2.gz IVPPTDOXWHWLJU-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO Cn1c(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000177194637 509930218 /nfs/dbraw/zinc/93/02/18/509930218.db2.gz PYCGTFCEESFRFA-UHFFFAOYSA-N 1 1 367.409 2.942 20 5 FFBDMO Cn1c(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000177194637 509930223 /nfs/dbraw/zinc/93/02/23/509930223.db2.gz PYCGTFCEESFRFA-UHFFFAOYSA-N 1 1 367.409 2.942 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445772 509939129 /nfs/dbraw/zinc/93/91/29/509939129.db2.gz KQDCVRBBWVQABV-ZIAGYGMSSA-N 1 1 359.430 2.979 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000174122787 509957999 /nfs/dbraw/zinc/95/79/99/509957999.db2.gz RSZJRYMSBPBTPS-CYBMUJFWSA-N 1 1 350.419 2.942 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CCc2sccc2C1 ZINC000171167834 509983324 /nfs/dbraw/zinc/98/33/24/509983324.db2.gz ZDKPIDXWCXHMFO-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCc2sccc2C1 ZINC000171167834 509983333 /nfs/dbraw/zinc/98/33/33/509983333.db2.gz ZDKPIDXWCXHMFO-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)OCCO1 ZINC000183881090 510020834 /nfs/dbraw/zinc/02/08/34/510020834.db2.gz XCHGQKALCSWLNP-AWEZNQCLSA-N 1 1 374.397 2.620 20 5 FFBDMO C[C@@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000171235664 510026520 /nfs/dbraw/zinc/02/65/20/510026520.db2.gz QMVYGVSLYOPTKB-XHSDSOJGSA-N 1 1 360.458 2.505 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](C)c1nccs1 ZINC000183930808 510044599 /nfs/dbraw/zinc/04/45/99/510044599.db2.gz UKKPZJXKASHAPS-LLVKDONJSA-N 1 1 364.427 2.734 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](C)c1nccs1 ZINC000183930808 510044604 /nfs/dbraw/zinc/04/46/04/510044604.db2.gz UKKPZJXKASHAPS-LLVKDONJSA-N 1 1 364.427 2.734 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193816653 510084881 /nfs/dbraw/zinc/08/48/81/510084881.db2.gz CTUHDZJUCFALGC-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000194058816 510196741 /nfs/dbraw/zinc/19/67/41/510196741.db2.gz LPQZJRQZYQAHPG-CHWSQXEVSA-N 1 1 368.393 2.619 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)[NH2+]Cc2ccccc21 ZINC000262296014 510234799 /nfs/dbraw/zinc/23/47/99/510234799.db2.gz WUIUEWFUZPZLOK-GFCCVEGCSA-N 1 1 361.423 2.590 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000184361187 510285157 /nfs/dbraw/zinc/28/51/57/510285157.db2.gz WTIXWSOKBXSSFG-QGZVFWFLSA-N 1 1 371.441 2.657 20 5 FFBDMO CCOc1cc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000190691653 510288135 /nfs/dbraw/zinc/28/81/35/510288135.db2.gz GBUYECYXWOBFMH-KRWDZBQOSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOC(=O)[C@H](C)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000190838221 510366662 /nfs/dbraw/zinc/36/66/62/510366662.db2.gz MVNOYGXIRZMZSD-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000190838221 510366669 /nfs/dbraw/zinc/36/66/69/510366669.db2.gz MVNOYGXIRZMZSD-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269453544 510415197 /nfs/dbraw/zinc/41/51/97/510415197.db2.gz GPTPDBXYTJCBLT-DZGCQCFKSA-N 1 1 371.441 2.834 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000269488637 510431991 /nfs/dbraw/zinc/43/19/91/510431991.db2.gz XGATWPGETUQAFG-CYBMUJFWSA-N 1 1 359.430 2.692 20 5 FFBDMO C[C@@H](C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000194670653 510472298 /nfs/dbraw/zinc/47/22/98/510472298.db2.gz CTFCMQPENOWTST-XHSDSOJGSA-N 1 1 360.458 2.505 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000266241888 510478608 /nfs/dbraw/zinc/47/86/08/510478608.db2.gz XNXLYPFCGZMXQL-CQSZACIVSA-N 1 1 362.430 2.720 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731738 510488985 /nfs/dbraw/zinc/48/89/85/510488985.db2.gz CMSASHSHISKQKJ-CQSZACIVSA-N 1 1 374.441 2.800 20 5 FFBDMO C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181664736 510529499 /nfs/dbraw/zinc/52/94/99/510529499.db2.gz WZQCCOGTNQAXCM-GJZGRUSLSA-N 1 1 361.442 2.743 20 5 FFBDMO C[C@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000188009270 510547473 /nfs/dbraw/zinc/54/74/73/510547473.db2.gz QUNZQBPLYFRETG-ZBEGNZNMSA-N 1 1 355.822 2.670 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3nc(C)ccc3[N+](=O)[O-])CC2)c1 ZINC000178357779 510564219 /nfs/dbraw/zinc/56/42/19/510564219.db2.gz ISHBBTYEZUVTRY-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000246743300 510648365 /nfs/dbraw/zinc/64/83/65/510648365.db2.gz HAJOZZWQRQTNLP-YOEHRIQHSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000172359961 510688536 /nfs/dbraw/zinc/68/85/36/510688536.db2.gz GTUKITGXJCLLRB-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000172359961 510688543 /nfs/dbraw/zinc/68/85/43/510688543.db2.gz GTUKITGXJCLLRB-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000270357902 510775337 /nfs/dbraw/zinc/77/53/37/510775337.db2.gz JLMMAEPZLFMTHA-NSHDSACASA-N 1 1 357.252 2.920 20 5 FFBDMO CCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000191709122 510795577 /nfs/dbraw/zinc/79/55/77/510795577.db2.gz XHQXGVVZCDFBLE-MRXNPFEDSA-N 1 1 371.441 2.548 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000178865189 510811071 /nfs/dbraw/zinc/81/10/71/510811071.db2.gz TZGBHDXNICAWOI-HOTGVXAUSA-N 1 1 365.430 2.569 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000247111237 510836481 /nfs/dbraw/zinc/83/64/81/510836481.db2.gz LOAVKESDIAXOQD-XJKSGUPXSA-N 1 1 351.834 2.733 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1 ZINC000247556772 510865506 /nfs/dbraw/zinc/86/55/06/510865506.db2.gz ZGTMBFDYOXXZMA-KSSFIOAISA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000360305648 510894156 /nfs/dbraw/zinc/89/41/56/510894156.db2.gz LBSMDANBLVZWNG-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)C2)C1 ZINC000293918377 510898906 /nfs/dbraw/zinc/89/89/06/510898906.db2.gz IHERPCIZHLPBGO-LJQANCHMSA-N 1 1 354.410 2.701 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000364527092 510916101 /nfs/dbraw/zinc/91/61/01/510916101.db2.gz JTKUQFOLHOCPEZ-BJZITVGISA-N 1 1 357.410 2.813 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC1=CC[N@@H+](C)CC1 ZINC000285488666 510927774 /nfs/dbraw/zinc/92/77/74/510927774.db2.gz DMASJCRZXNBVJM-UHFFFAOYSA-N 1 1 368.231 2.657 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000270620326 510928384 /nfs/dbraw/zinc/92/83/84/510928384.db2.gz OUBBKSFSPWSOSU-UHFFFAOYSA-N 1 1 358.398 2.598 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@@H](O)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000294071594 510946755 /nfs/dbraw/zinc/94/67/55/510946755.db2.gz YLUHNWAUBUCDEY-INIZCTEOSA-N 1 1 360.410 2.647 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000294071594 510946757 /nfs/dbraw/zinc/94/67/57/510946757.db2.gz YLUHNWAUBUCDEY-INIZCTEOSA-N 1 1 360.410 2.647 20 5 FFBDMO COCC[N@@H+]1CC[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277684186 510968509 /nfs/dbraw/zinc/96/85/09/510968509.db2.gz IXBLRBUQGGRYQJ-AWEZNQCLSA-N 1 1 365.433 2.544 20 5 FFBDMO COCC[N@H+]1CC[C@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277684186 510968513 /nfs/dbraw/zinc/96/85/13/510968513.db2.gz IXBLRBUQGGRYQJ-AWEZNQCLSA-N 1 1 365.433 2.544 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC000285590815 510969047 /nfs/dbraw/zinc/96/90/47/510969047.db2.gz VYOZLTRMJIZMIR-UHFFFAOYSA-N 1 1 365.405 2.954 20 5 FFBDMO COCc1ccc(CNC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282437493 510977570 /nfs/dbraw/zinc/97/75/70/510977570.db2.gz KRIOLCLJVCVKHW-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1ccc(CNC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282437493 510977572 /nfs/dbraw/zinc/97/75/72/510977572.db2.gz KRIOLCLJVCVKHW-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCCC[N@@H+](C)CCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000278077428 510980740 /nfs/dbraw/zinc/98/07/40/510980740.db2.gz GXKKIHATEUMYAY-UHFFFAOYSA-N 1 1 367.449 2.792 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1 ZINC000282478879 510993274 /nfs/dbraw/zinc/99/32/74/510993274.db2.gz LMFNXSRCCSLQGD-YOEHRIQHSA-N 1 1 353.438 2.961 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000361204180 511012650 /nfs/dbraw/zinc/01/26/50/511012650.db2.gz NCJBCYLTIILBQF-HKUYNNGSSA-N 1 1 357.385 2.838 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000279272581 511025665 /nfs/dbraw/zinc/02/56/65/511025665.db2.gz WJJGWWOOMVRALG-UHFFFAOYSA-N 1 1 363.393 2.515 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000282643557 511057829 /nfs/dbraw/zinc/05/78/29/511057829.db2.gz LLTQQUAQVCJOAT-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000294492551 511081997 /nfs/dbraw/zinc/08/19/97/511081997.db2.gz UUUOCQLUUDUCGD-UHFFFAOYSA-N 1 1 373.384 2.531 20 5 FFBDMO COc1cc(C(=O)NCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000294492551 511081998 /nfs/dbraw/zinc/08/19/98/511081998.db2.gz UUUOCQLUUDUCGD-UHFFFAOYSA-N 1 1 373.384 2.531 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294596795 511114770 /nfs/dbraw/zinc/11/47/70/511114770.db2.gz USMIWNPTJFFRPA-RYUDHWBXSA-N 1 1 353.394 2.593 20 5 FFBDMO C[C@@H]1CCCC[N@@H+]1CCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271298663 511154524 /nfs/dbraw/zinc/15/45/24/511154524.db2.gz QKCZVWMMXKKEHW-LLVKDONJSA-N 1 1 361.489 2.736 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271298663 511154528 /nfs/dbraw/zinc/15/45/28/511154528.db2.gz QKCZVWMMXKKEHW-LLVKDONJSA-N 1 1 361.489 2.736 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000362792370 511239154 /nfs/dbraw/zinc/23/91/54/511239154.db2.gz QNBOJHFHBDTJGW-WBVHZDCISA-N 1 1 358.442 2.896 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000295042122 511261392 /nfs/dbraw/zinc/26/13/92/511261392.db2.gz OWFNWOFUIYVHBJ-KRWDZBQOSA-N 1 1 356.426 2.725 20 5 FFBDMO C[C@H](CO)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000280293277 511410151 /nfs/dbraw/zinc/41/01/51/511410151.db2.gz FGSMWDBQUIJGLK-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCN2CCO[C@H]1C2 ZINC000295508540 511428054 /nfs/dbraw/zinc/42/80/54/511428054.db2.gz TUNLQNPIRMQYBC-CABCVRRESA-N 1 1 359.348 2.519 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@](C)(OC)CC1 ZINC000280349715 511431516 /nfs/dbraw/zinc/43/15/16/511431516.db2.gz IWKZVPXITLVMID-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000272258742 511482179 /nfs/dbraw/zinc/48/21/79/511482179.db2.gz MMANXTPZYACIRC-GJZGRUSLSA-N 1 1 360.458 2.785 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280558374 511511174 /nfs/dbraw/zinc/51/11/74/511511174.db2.gz UTOULCANDSLATP-IAQYHMDHSA-N 1 1 369.824 2.873 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292404049 511585792 /nfs/dbraw/zinc/58/57/92/511585792.db2.gz TZXFJGRHCBTETJ-CABCVRRESA-N 1 1 360.458 2.728 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc(F)c1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365845327 511683096 /nfs/dbraw/zinc/68/30/96/511683096.db2.gz IPULAKQVOAPSGW-LBPRGKRZSA-N 1 1 361.377 2.595 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000281064357 511707457 /nfs/dbraw/zinc/70/74/57/511707457.db2.gz SHAWSGCGRRAHLW-KSSFIOAISA-N 1 1 370.409 2.608 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000281064357 511707463 /nfs/dbraw/zinc/70/74/63/511707463.db2.gz SHAWSGCGRRAHLW-KSSFIOAISA-N 1 1 370.409 2.608 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCO[C@@H](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000274160936 511738920 /nfs/dbraw/zinc/73/89/20/511738920.db2.gz AKIIVISDTOGSGF-KBAYOESNSA-N 1 1 356.426 2.965 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883168 511757463 /nfs/dbraw/zinc/75/74/63/511757463.db2.gz FEGAFLSFWOHIEW-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292965101 511789076 /nfs/dbraw/zinc/78/90/76/511789076.db2.gz LUCLEQFNZNAGCJ-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO CC(C)(CCC(=O)NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)[N+](=O)[O-] ZINC000296590635 511809657 /nfs/dbraw/zinc/80/96/57/511809657.db2.gz FLPRUHGULRHLLT-MRXNPFEDSA-N 1 1 365.499 2.556 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000293042146 511818180 /nfs/dbraw/zinc/81/81/80/511818180.db2.gz HCXVEFMWNQGFMO-KRWDZBQOSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293094483 511837134 /nfs/dbraw/zinc/83/71/34/511837134.db2.gz PSPCZOZMTFWXMN-LJQANCHMSA-N 1 1 363.458 2.962 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000293185358 511873530 /nfs/dbraw/zinc/87/35/30/511873530.db2.gz WESCWDRIGROMSO-GOSISDBHSA-N 1 1 360.414 2.875 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000293185358 511873536 /nfs/dbraw/zinc/87/35/36/511873536.db2.gz WESCWDRIGROMSO-GOSISDBHSA-N 1 1 360.414 2.875 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N(C)C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C ZINC000284822632 511885742 /nfs/dbraw/zinc/88/57/42/511885742.db2.gz JRXOWTMFFXDCEO-WMLDXEAASA-N 1 1 358.446 2.551 20 5 FFBDMO O=C(Nc1ccccc1C[NH+]1CCC(O)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000274743014 511928322 /nfs/dbraw/zinc/92/83/22/511928322.db2.gz DFRBMNXYNNKGHT-UHFFFAOYSA-N 1 1 371.393 2.509 20 5 FFBDMO COCc1cccc(CNC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285305706 512070976 /nfs/dbraw/zinc/07/09/76/512070976.db2.gz LREMWGBBVGAMDP-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1cccc(CNC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285305706 512070982 /nfs/dbraw/zinc/07/09/82/512070982.db2.gz LREMWGBBVGAMDP-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518178 512539120 /nfs/dbraw/zinc/53/91/20/512539120.db2.gz MIPNRYWVKZOYNF-ZDUSSCGKSA-N 1 1 370.400 2.777 20 5 FFBDMO C[NH+]1CCC(N2CC[C@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518178 512539121 /nfs/dbraw/zinc/53/91/21/512539121.db2.gz MIPNRYWVKZOYNF-ZDUSSCGKSA-N 1 1 370.400 2.777 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000374028778 512630360 /nfs/dbraw/zinc/63/03/60/512630360.db2.gz STDQRVLSKWVZOQ-RKVPGOIHSA-N 1 1 350.415 2.632 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4nnc5n4CCC5)CC3)nc2c1 ZINC000370235799 512834802 /nfs/dbraw/zinc/83/48/02/512834802.db2.gz IHPLQMVPCWOIKH-UHFFFAOYSA-N 1 1 368.397 2.653 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@](C(N)=O)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000411975218 512898651 /nfs/dbraw/zinc/89/86/51/512898651.db2.gz ZVWYFRBRQJORBP-HXUWFJFHSA-N 1 1 369.421 2.623 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](N3CCCC3=O)CC2)ccc1[N+](=O)[O-] ZINC000412057587 512935465 /nfs/dbraw/zinc/93/54/65/512935465.db2.gz RPEFPYOGZCNHCA-INIZCTEOSA-N 1 1 361.442 2.970 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2ccncn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000372599286 512963379 /nfs/dbraw/zinc/96/33/79/512963379.db2.gz KFEUOGOFHWMIMT-ZDUSSCGKSA-N 1 1 373.388 2.732 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1F ZINC000412143288 512976524 /nfs/dbraw/zinc/97/65/24/512976524.db2.gz IQYINYLEOBGSEW-ZDUSSCGKSA-N 1 1 367.421 2.618 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC000408003328 512982774 /nfs/dbraw/zinc/98/27/74/512982774.db2.gz DZSIQOLWKVYIFY-VHSXEESVSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000408003328 512982778 /nfs/dbraw/zinc/98/27/78/512982778.db2.gz DZSIQOLWKVYIFY-VHSXEESVSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000376909428 513043757 /nfs/dbraw/zinc/04/37/57/513043757.db2.gz DDCQLCXSIZCHON-UHFFFAOYSA-N 1 1 357.414 2.765 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374873676 513049868 /nfs/dbraw/zinc/04/98/68/513049868.db2.gz DPKFPQUHKVTALC-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374873676 513049872 /nfs/dbraw/zinc/04/98/72/513049872.db2.gz DPKFPQUHKVTALC-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000370827328 513114658 /nfs/dbraw/zinc/11/46/58/513114658.db2.gz RXEMTLIWGAXAMB-ZDUSSCGKSA-N 1 1 357.332 2.924 20 5 FFBDMO CCOC1(C)CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000428745171 513180118 /nfs/dbraw/zinc/18/01/18/513180118.db2.gz AEMTUTCVTCLBGB-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C ZINC000439888179 513203376 /nfs/dbraw/zinc/20/33/76/513203376.db2.gz NBDQLZCZLAPOSL-OLZOCXBDSA-N 1 1 350.419 2.940 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412692212 513226929 /nfs/dbraw/zinc/22/69/29/513226929.db2.gz CXSRJMZPPNGBNR-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412692212 513226931 /nfs/dbraw/zinc/22/69/31/513226931.db2.gz CXSRJMZPPNGBNR-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000412697962 513230818 /nfs/dbraw/zinc/23/08/18/513230818.db2.gz MYPLRAZGXNDWND-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000412697962 513230824 /nfs/dbraw/zinc/23/08/24/513230824.db2.gz MYPLRAZGXNDWND-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](O)CO ZINC000421410933 513253594 /nfs/dbraw/zinc/25/35/94/513253594.db2.gz PVXUERLSTPGZDF-HNNXBMFYSA-N 1 1 350.440 2.887 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044417 513266247 /nfs/dbraw/zinc/26/62/47/513266247.db2.gz UHWNZPVDCTYUHB-ZRGWGRIASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044417 513266258 /nfs/dbraw/zinc/26/62/58/513266258.db2.gz UHWNZPVDCTYUHB-ZRGWGRIASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044417 513266263 /nfs/dbraw/zinc/26/62/63/513266263.db2.gz UHWNZPVDCTYUHB-ZRGWGRIASA-N 1 1 374.485 2.894 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000429140476 513289134 /nfs/dbraw/zinc/28/91/34/513289134.db2.gz ZLRRLQCJKISWIF-GOEBONIOSA-N 1 1 358.394 2.618 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccccc3N3CCOCC3)nc2c1 ZINC000446825752 513345888 /nfs/dbraw/zinc/34/58/88/513345888.db2.gz DMKGGBKGOWFVBL-UHFFFAOYSA-N 1 1 367.409 2.598 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNc3ncc([N+](=O)[O-])cc3F)c2)CCO1 ZINC000413068242 513422260 /nfs/dbraw/zinc/42/22/60/513422260.db2.gz GATSKAKJTAHYDB-CYBMUJFWSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNc3ncc([N+](=O)[O-])cc3F)c2)CCO1 ZINC000413068242 513422265 /nfs/dbraw/zinc/42/22/65/513422265.db2.gz GATSKAKJTAHYDB-CYBMUJFWSA-N 1 1 360.389 2.962 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194867 513509544 /nfs/dbraw/zinc/50/95/44/513509544.db2.gz JTKFSDLXOZZRIG-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194867 513509550 /nfs/dbraw/zinc/50/95/50/513509550.db2.gz JTKFSDLXOZZRIG-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000441252909 513521862 /nfs/dbraw/zinc/52/18/62/513521862.db2.gz CAFPYXLKGWKYPZ-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000441271716 513525976 /nfs/dbraw/zinc/52/59/76/513525976.db2.gz ROZLKTNBWCTNNI-UONOGXRCSA-N 1 1 366.849 2.759 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](c4nnc[nH]4)C3)cs2)c1 ZINC000425361058 513528063 /nfs/dbraw/zinc/52/80/63/513528063.db2.gz XBYVGYJOMWTDCW-LBPRGKRZSA-N 1 1 356.411 2.826 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)cs2)c1 ZINC000425361058 513528070 /nfs/dbraw/zinc/52/80/70/513528070.db2.gz XBYVGYJOMWTDCW-LBPRGKRZSA-N 1 1 356.411 2.826 20 5 FFBDMO C[C@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@H+]1CCc2sccc2C1 ZINC000447670913 513537017 /nfs/dbraw/zinc/53/70/17/513537017.db2.gz OPXGEOVELSJEFZ-LLVKDONJSA-N 1 1 357.439 2.813 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425394556 513541279 /nfs/dbraw/zinc/54/12/79/513541279.db2.gz LEBWONAVPOLZQW-LBPRGKRZSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425394556 513541288 /nfs/dbraw/zinc/54/12/88/513541288.db2.gz LEBWONAVPOLZQW-LBPRGKRZSA-N 1 1 356.220 2.587 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413263593 513555431 /nfs/dbraw/zinc/55/54/31/513555431.db2.gz ILBKNWLGPPYCPR-UHFFFAOYSA-N 1 1 362.352 2.556 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413263593 513555436 /nfs/dbraw/zinc/55/54/36/513555436.db2.gz ILBKNWLGPPYCPR-UHFFFAOYSA-N 1 1 362.352 2.556 20 5 FFBDMO C[N@@H+]1CCCC(C)(C)[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000447813519 513577546 /nfs/dbraw/zinc/57/75/46/513577546.db2.gz WIOIQOYKMKAOAI-HNNXBMFYSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000447813519 513577553 /nfs/dbraw/zinc/57/75/53/513577553.db2.gz WIOIQOYKMKAOAI-HNNXBMFYSA-N 1 1 355.460 2.531 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000447813616 513578455 /nfs/dbraw/zinc/57/84/55/513578455.db2.gz SRJBCVFRMJYBIU-SFHVURJKSA-N 1 1 374.485 2.856 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CC(=O)N(C)C)c1ccccc1 ZINC000430198461 513587379 /nfs/dbraw/zinc/58/73/79/513587379.db2.gz YNTVJHCCZHYZPX-QGZVFWFLSA-N 1 1 357.410 2.913 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000425477457 513588707 /nfs/dbraw/zinc/58/87/07/513588707.db2.gz OCTMZXSUWYWSFP-CQSZACIVSA-N 1 1 352.435 2.768 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000418993582 513709849 /nfs/dbraw/zinc/70/98/49/513709849.db2.gz HCHVNPXWVHKTED-ZIAGYGMSSA-N 1 1 374.416 2.687 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000451428944 513746256 /nfs/dbraw/zinc/74/62/56/513746256.db2.gz WVRSOEDPENAZCP-LBTBCDHLSA-N 1 1 361.442 2.856 20 5 FFBDMO COc1cc(CCNc2[nH+]c3ccc(F)cc3n2C)c([N+](=O)[O-])cc1OC ZINC000431028025 513808946 /nfs/dbraw/zinc/80/89/46/513808946.db2.gz MBCYAVVLTXEXEU-UHFFFAOYSA-N 1 1 374.372 2.714 20 5 FFBDMO Cc1c(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000436268097 513814279 /nfs/dbraw/zinc/81/42/79/513814279.db2.gz SEKSCPMVCJUFPR-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO Cc1c(C[N@@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000436268097 513814287 /nfs/dbraw/zinc/81/42/87/513814287.db2.gz SEKSCPMVCJUFPR-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451540412 513819096 /nfs/dbraw/zinc/81/90/96/513819096.db2.gz KWARWSLLMSQAOD-XJKSGUPXSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000413959660 513901670 /nfs/dbraw/zinc/90/16/70/513901670.db2.gz SYJAEPZKSDAJFH-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000413959660 513901679 /nfs/dbraw/zinc/90/16/79/513901679.db2.gz SYJAEPZKSDAJFH-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)n2)cc1 ZINC000451693427 513916011 /nfs/dbraw/zinc/91/60/11/513916011.db2.gz IDGSTGGVZILEOE-FMKPAKJESA-N 1 1 358.398 2.628 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000451697803 513918050 /nfs/dbraw/zinc/91/80/50/513918050.db2.gz ROXAARLVRRTFOP-VYDXJSESSA-N 1 1 361.442 2.715 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1 ZINC000451700293 513921590 /nfs/dbraw/zinc/92/15/90/513921590.db2.gz XFOMSUUMSISDSV-VYDXJSESSA-N 1 1 361.442 2.715 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC([NH+]2CCCC2)CC1 ZINC000448886347 513953052 /nfs/dbraw/zinc/95/30/52/513953052.db2.gz OUCDCMOHLDMQPW-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2nccc(C(F)(F)F)n2)n1 ZINC000414239682 514018145 /nfs/dbraw/zinc/01/81/45/514018145.db2.gz LGLDBJPDBVWQCZ-MNOVXSKESA-N 1 1 370.335 2.874 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1c1ccccc1 ZINC000451995122 514120713 /nfs/dbraw/zinc/12/07/13/514120713.db2.gz MYZKLHVLLYCHNQ-MSOLQXFVSA-N 1 1 370.405 2.992 20 5 FFBDMO Cn1cc(C[N@@H+]2CCCc3c(cnn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414474784 514141609 /nfs/dbraw/zinc/14/16/09/514141609.db2.gz SZWOWCDIOVEZRY-UHFFFAOYSA-N 1 1 366.425 2.677 20 5 FFBDMO Cn1cc(C[N@H+]2CCCc3c(cnn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414474784 514141610 /nfs/dbraw/zinc/14/16/10/514141610.db2.gz SZWOWCDIOVEZRY-UHFFFAOYSA-N 1 1 366.425 2.677 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH2+]Cc3c(C)cccc32)cc1[N+](=O)[O-] ZINC000420462764 514157384 /nfs/dbraw/zinc/15/73/84/514157384.db2.gz QVXZPZZCPNFYTQ-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432319860 514158185 /nfs/dbraw/zinc/15/81/85/514158185.db2.gz JLNFEFOZHVXNJB-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO COc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422712 514205983 /nfs/dbraw/zinc/20/59/83/514205983.db2.gz NHOPBVPXGKQRMN-QFBILLFUSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422712 514205984 /nfs/dbraw/zinc/20/59/84/514205984.db2.gz NHOPBVPXGKQRMN-QFBILLFUSA-N 1 1 360.385 2.903 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](CCCO)C1 ZINC000452130252 514211447 /nfs/dbraw/zinc/21/14/47/514211447.db2.gz NQDUMQMZATVCNM-NEPJUHHUSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](CCCO)C1 ZINC000452130252 514211453 /nfs/dbraw/zinc/21/14/53/514211453.db2.gz NQDUMQMZATVCNM-NEPJUHHUSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)CC23CCOCC3)cn1 ZINC000449464184 514220203 /nfs/dbraw/zinc/22/02/03/514220203.db2.gz XXFGMCVRJLFQBH-OAHLLOKOSA-N 1 1 362.455 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](CCO)[C@@H]3CCc4ccccc43)nc2c1 ZINC000444652356 514284754 /nfs/dbraw/zinc/28/47/54/514284754.db2.gz RNNSZKZSLZUGPR-GOSISDBHSA-N 1 1 352.394 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](CCO)[C@@H]3CCc4ccccc43)nc2c1 ZINC000444652356 514284759 /nfs/dbraw/zinc/28/47/59/514284759.db2.gz RNNSZKZSLZUGPR-GOSISDBHSA-N 1 1 352.394 2.953 20 5 FFBDMO CCC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000444778430 514329064 /nfs/dbraw/zinc/32/90/64/514329064.db2.gz UYSVDFNWTXMEKF-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000444778430 514329072 /nfs/dbraw/zinc/32/90/72/514329072.db2.gz UYSVDFNWTXMEKF-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2CCCO[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000433069157 514370698 /nfs/dbraw/zinc/37/06/98/514370698.db2.gz BZGKXUTZYOSOBJ-CQSZACIVSA-N 1 1 350.419 2.526 20 5 FFBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCSC1 ZINC000433201650 514420269 /nfs/dbraw/zinc/42/02/69/514420269.db2.gz MVPWFIYKPHDPDR-OAHLLOKOSA-N 1 1 368.455 2.805 20 5 FFBDMO O=C1C[C@H]([N@H+]2CCCC3(CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000445480710 514486149 /nfs/dbraw/zinc/48/61/49/514486149.db2.gz ISWVCRREBFMLAR-INIZCTEOSA-N 1 1 357.410 2.883 20 5 FFBDMO CC[C@H](C)[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079624 514489949 /nfs/dbraw/zinc/48/99/49/514489949.db2.gz UVZPLHGMJJZMRQ-YOEHRIQHSA-N 1 1 372.473 2.769 20 5 FFBDMO CC[C@H](C)[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079624 514489956 /nfs/dbraw/zinc/48/99/56/514489956.db2.gz UVZPLHGMJJZMRQ-YOEHRIQHSA-N 1 1 372.473 2.769 20 5 FFBDMO Cc1cc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc([N+](=O)[O-])c1 ZINC000428535103 514492114 /nfs/dbraw/zinc/49/21/14/514492114.db2.gz JGBDVPJEGFZKDD-SFHVURJKSA-N 1 1 355.394 2.722 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000433598345 514525625 /nfs/dbraw/zinc/52/56/25/514525625.db2.gz FBHGQZPBZPGMTE-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000433598345 514525635 /nfs/dbraw/zinc/52/56/35/514525635.db2.gz FBHGQZPBZPGMTE-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000470615180 514550125 /nfs/dbraw/zinc/55/01/25/514550125.db2.gz USRMEGASIZINGR-ZNMIVQPWSA-N 1 1 369.487 2.548 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000439474915 514560292 /nfs/dbraw/zinc/56/02/92/514560292.db2.gz XVLOCNLZUAEBPU-KSSFIOAISA-N 1 1 350.415 2.948 20 5 FFBDMO CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475315400 514616388 /nfs/dbraw/zinc/61/63/88/514616388.db2.gz XBYYLFOAOAOFBX-IBGZPJMESA-N 1 1 353.422 2.870 20 5 FFBDMO Cn1ccnc1[C@H](NCCCC[N@@H+](C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000453387063 514618299 /nfs/dbraw/zinc/61/82/99/514618299.db2.gz ATUDIZWPNXCLGL-GOSISDBHSA-N 1 1 357.458 2.882 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(N2CCCCC2)C1 ZINC000475564001 514715782 /nfs/dbraw/zinc/71/57/82/514715782.db2.gz RYBQTMQQJMXYSX-NXVRBGIVSA-N 1 1 360.458 2.918 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC1CC([NH+]2CCCCC2)C1 ZINC000475564001 514715788 /nfs/dbraw/zinc/71/57/88/514715788.db2.gz RYBQTMQQJMXYSX-NXVRBGIVSA-N 1 1 360.458 2.918 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000484642770 514726007 /nfs/dbraw/zinc/72/60/07/514726007.db2.gz VRBSXXNQACPRGS-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCCC[C@@H](SC)C2)cc1[N+](=O)[O-] ZINC000475707023 514770661 /nfs/dbraw/zinc/77/06/61/514770661.db2.gz XOMYWZSVFOGZOD-CQSZACIVSA-N 1 1 368.455 2.864 20 5 FFBDMO COc1cc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc([N+](=O)[O-])c1C ZINC000480175083 514864099 /nfs/dbraw/zinc/86/40/99/514864099.db2.gz UWKWVHYTLPZODB-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000467132029 514910204 /nfs/dbraw/zinc/91/02/04/514910204.db2.gz PWPOICJJIAUYER-LBPRGKRZSA-N 1 1 373.413 2.533 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000467194275 514935353 /nfs/dbraw/zinc/93/53/53/514935353.db2.gz IZNUWIDEBDFFIF-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000467194275 514935362 /nfs/dbraw/zinc/93/53/62/514935362.db2.gz IZNUWIDEBDFFIF-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000467222030 514944604 /nfs/dbraw/zinc/94/46/04/514944604.db2.gz GMIDNMPSLNUMNG-RYUDHWBXSA-N 1 1 354.838 2.872 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000467321792 514978170 /nfs/dbraw/zinc/97/81/70/514978170.db2.gz PMYNXCCUMJALGZ-AWEZNQCLSA-N 1 1 363.414 2.641 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)c21 ZINC000480506439 514981187 /nfs/dbraw/zinc/98/11/87/514981187.db2.gz OJQUMCSISVCBOB-MRXNPFEDSA-N 1 1 363.421 2.894 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H](C)[NH+]1CCOCC1 ZINC000485419491 515033393 /nfs/dbraw/zinc/03/33/93/515033393.db2.gz TZOWTUUBEIWACY-KGLIPLIRSA-N 1 1 374.416 2.739 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000467550444 515046190 /nfs/dbraw/zinc/04/61/90/515046190.db2.gz KKANYAXBAPSRSZ-MBNRZODZSA-N 1 1 362.426 2.900 20 5 FFBDMO Cc1c([C@H]2OCC[C@@H]2[NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)cnn1C ZINC000509152631 515048506 /nfs/dbraw/zinc/04/85/06/515048506.db2.gz NMKTWNZYKAQEEL-JKSUJKDBSA-N 1 1 352.341 2.535 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000476474785 515063296 /nfs/dbraw/zinc/06/32/96/515063296.db2.gz ZWGNJUUNZLUDNM-NVXWUHKLSA-N 1 1 355.394 2.779 20 5 FFBDMO COc1cc(NC[C@H](CC(C)C)[NH+]2CCOCC2)c([N+](=O)[O-])cc1F ZINC000467717503 515093916 /nfs/dbraw/zinc/09/39/16/515093916.db2.gz CQOXMVHYNAHRFT-ZDUSSCGKSA-N 1 1 355.410 2.901 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000456335118 515101725 /nfs/dbraw/zinc/10/17/25/515101725.db2.gz AFAIENKKTFKOMR-KRWDZBQOSA-N 1 1 374.485 2.754 20 5 FFBDMO CNc1c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000462912270 515295824 /nfs/dbraw/zinc/29/58/24/515295824.db2.gz MYCVOLGXJVDOIR-OAHLLOKOSA-N 1 1 358.398 2.796 20 5 FFBDMO COc1ccc(C[NH2+]Cc2cnnn2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000490767721 515301185 /nfs/dbraw/zinc/30/11/85/515301185.db2.gz HEOIRCPSCJTZDK-UHFFFAOYSA-N 1 1 353.382 2.533 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000468468298 515371871 /nfs/dbraw/zinc/37/18/71/515371871.db2.gz QAINQNCICTYZPL-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000499724389 515428415 /nfs/dbraw/zinc/42/84/15/515428415.db2.gz RLDXMNBQZNKADM-MRXNPFEDSA-N 1 1 371.441 2.775 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736172 515446867 /nfs/dbraw/zinc/44/68/67/515446867.db2.gz MYFBBDAKYXLZOL-CVEARBPZSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736172 515446878 /nfs/dbraw/zinc/44/68/78/515446878.db2.gz MYFBBDAKYXLZOL-CVEARBPZSA-N 1 1 366.414 2.536 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C[C@@H](C)OC ZINC000463426500 515488448 /nfs/dbraw/zinc/48/84/48/515488448.db2.gz AVBMVUXMNPOXNZ-SNVBAGLBSA-N 1 1 374.235 2.653 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C[C@@H](C)OC ZINC000463426500 515488461 /nfs/dbraw/zinc/48/84/61/515488461.db2.gz AVBMVUXMNPOXNZ-SNVBAGLBSA-N 1 1 374.235 2.653 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)CC[N@H+]2C2CC2)c1 ZINC000481941350 515521063 /nfs/dbraw/zinc/52/10/63/515521063.db2.gz HPVRDGKCELLSKB-FUHWJXTLSA-N 1 1 370.409 2.639 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[NH+]3CCC3)cc2[N+](=O)[O-])C1 ZINC000505424862 515531227 /nfs/dbraw/zinc/53/12/27/515531227.db2.gz HGRBCHUAHVUIFG-GJZGRUSLSA-N 1 1 360.458 2.513 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000510443604 515542793 /nfs/dbraw/zinc/54/27/93/515542793.db2.gz OQVWYEKAOYPNME-CABZTGNLSA-N 1 1 370.247 2.878 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC000454520632 515550390 /nfs/dbraw/zinc/55/03/90/515550390.db2.gz CDUBRWXKUSDTIU-AWEZNQCLSA-N 1 1 357.414 2.583 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456998014 515574251 /nfs/dbraw/zinc/57/42/51/515574251.db2.gz RHPYCUQSNCHLQE-IBGZPJMESA-N 1 1 368.437 2.960 20 5 FFBDMO Cc1cc(N2CC[C@H]3CC[N@H+](C)C[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000486670461 515588185 /nfs/dbraw/zinc/58/81/85/515588185.db2.gz KLWVJWZQFLADNW-PBHICJAKSA-N 1 1 353.426 2.891 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000500103103 515590549 /nfs/dbraw/zinc/59/05/49/515590549.db2.gz QMGUTZWQAWCWCI-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO COc1cc(CN2C[C@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505627286 515614713 /nfs/dbraw/zinc/61/47/13/515614713.db2.gz BXKANRXTAPVJIS-RYUDHWBXSA-N 1 1 373.400 2.772 20 5 FFBDMO Cc1cc(N2CCC[N@@H+]([C@H](C)CO)CC2)c(Br)cc1[N+](=O)[O-] ZINC000473515278 515644003 /nfs/dbraw/zinc/64/40/03/515644003.db2.gz WUDXXZHYSJATLO-GFCCVEGCSA-N 1 1 372.263 2.559 20 5 FFBDMO Cc1cc(N2CCC[N@H+]([C@H](C)CO)CC2)c(Br)cc1[N+](=O)[O-] ZINC000473515278 515644007 /nfs/dbraw/zinc/64/40/07/515644007.db2.gz WUDXXZHYSJATLO-GFCCVEGCSA-N 1 1 372.263 2.559 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457116059 515662077 /nfs/dbraw/zinc/66/20/77/515662077.db2.gz LERVPYZZXYSYLH-OCCSQVGLSA-N 1 1 369.849 2.957 20 5 FFBDMO COc1cccc(CN(CC[NH+](C)C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)c1 ZINC000482414347 515670084 /nfs/dbraw/zinc/67/00/84/515670084.db2.gz YJXMFWJUUCOAMN-UHFFFAOYSA-N 1 1 373.409 2.513 20 5 FFBDMO COC(=O)c1cnc(NCc2ccccc2-n2cc[nH+]c2C)c([N+](=O)[O-])c1 ZINC000478267390 515758351 /nfs/dbraw/zinc/75/83/51/515758351.db2.gz DRKGNJCVHYOLAY-UHFFFAOYSA-N 1 1 367.365 2.883 20 5 FFBDMO CO[C@@H]1C[C@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000459730610 515775936 /nfs/dbraw/zinc/77/59/36/515775936.db2.gz DYHFFCNYEURXOC-GVDBMIGSSA-N 1 1 356.426 2.965 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459812634 515823951 /nfs/dbraw/zinc/82/39/51/515823951.db2.gz RZHREPVHYGZXIU-QWHCGFSZSA-N 1 1 365.430 2.831 20 5 FFBDMO CCc1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000478457096 515830486 /nfs/dbraw/zinc/83/04/86/515830486.db2.gz IQWXTQIZCYNAHW-QZTJIDSGSA-N 1 1 353.422 2.985 20 5 FFBDMO Cc1c(CNC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478456914 515830586 /nfs/dbraw/zinc/83/05/86/515830586.db2.gz IZPZFAAFQDTHJS-SFHVURJKSA-N 1 1 368.437 2.977 20 5 FFBDMO CC[C@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000482874600 515831894 /nfs/dbraw/zinc/83/18/94/515831894.db2.gz ORSFXRXNEOEISX-SFHVURJKSA-N 1 1 362.474 2.578 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C3(CC3)C2)cc1OC ZINC000494683636 515923660 /nfs/dbraw/zinc/92/36/60/515923660.db2.gz WHLQXCYGDIJTOW-UGSOOPFHSA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C3(CC3)C2)cc1OC ZINC000494683636 515923668 /nfs/dbraw/zinc/92/36/68/515923668.db2.gz WHLQXCYGDIJTOW-UGSOOPFHSA-N 1 1 364.442 2.985 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000494696288 515930199 /nfs/dbraw/zinc/93/01/99/515930199.db2.gz GPMBCBWWIJXOCD-GFCCVEGCSA-N 1 1 371.384 2.574 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000494696288 515930208 /nfs/dbraw/zinc/93/02/08/515930208.db2.gz GPMBCBWWIJXOCD-GFCCVEGCSA-N 1 1 371.384 2.574 20 5 FFBDMO Cc1c(CNC(=O)NCC[N@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000478808563 515971342 /nfs/dbraw/zinc/97/13/42/515971342.db2.gz AJTZCXXJAMCKEG-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506784230 515985205 /nfs/dbraw/zinc/98/52/05/515985205.db2.gz ZWRGRDQKIPBHOB-MRXNPFEDSA-N 1 1 355.394 2.695 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506784230 515985217 /nfs/dbraw/zinc/98/52/17/515985217.db2.gz ZWRGRDQKIPBHOB-MRXNPFEDSA-N 1 1 355.394 2.695 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@@H](C)[N@@H+](CC)C[C@H]1C ZINC000460215059 516070090 /nfs/dbraw/zinc/07/00/90/516070090.db2.gz PXTNQDGXPKFQNH-ZIAGYGMSSA-N 1 1 358.446 2.792 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000511901076 516073930 /nfs/dbraw/zinc/07/39/30/516073930.db2.gz FZDSUKWQMMFINP-SFHVURJKSA-N 1 1 360.458 2.796 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000470152531 516147536 /nfs/dbraw/zinc/14/75/36/516147536.db2.gz NJMZDIUJHQDUSU-WRSAYESZSA-N 1 1 355.394 2.941 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](CCC(F)(F)F)C[C@H](O)CO ZINC000470182135 516165934 /nfs/dbraw/zinc/16/59/34/516165934.db2.gz IWNXXVSXZIYLHR-BLMSOEDDSA-N 1 1 362.348 2.606 20 5 FFBDMO C[C@@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000512147835 516173479 /nfs/dbraw/zinc/17/34/79/516173479.db2.gz VJSLXMYJUPBDTD-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000488475659 516234566 /nfs/dbraw/zinc/23/45/66/516234566.db2.gz JRGBBCHHLSPYIU-GOEBONIOSA-N 1 1 356.426 2.574 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](N2CCOCC2)C[C@@H]1C ZINC000512439115 516280083 /nfs/dbraw/zinc/28/00/83/516280083.db2.gz NTIMEZYYMDBPQC-YJBOKZPZSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](N2CCOCC2)C[C@@H]1C ZINC000512439115 516280087 /nfs/dbraw/zinc/28/00/87/516280087.db2.gz NTIMEZYYMDBPQC-YJBOKZPZSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[N@H+]([C@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000488716165 516293251 /nfs/dbraw/zinc/29/32/51/516293251.db2.gz QYQXYXXDHYYAHS-RKVPGOIHSA-N 1 1 374.485 2.900 20 5 FFBDMO C[C@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135243 516302487 /nfs/dbraw/zinc/30/24/87/516302487.db2.gz QXUMMAZSEFIAAK-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135243 516302493 /nfs/dbraw/zinc/30/24/93/516302493.db2.gz QXUMMAZSEFIAAK-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO C[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000557741860 516413679 /nfs/dbraw/zinc/41/36/79/516413679.db2.gz VXDYDXIJIDHLPU-CQSZACIVSA-N 1 1 357.439 2.667 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1c(F)cccc1[N+](=O)[O-] ZINC000561229100 516466035 /nfs/dbraw/zinc/46/60/35/516466035.db2.gz GYEYJJCXKRTFET-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(OC(F)F)cc3)CC2)cn1 ZINC000518374218 516633466 /nfs/dbraw/zinc/63/34/66/516633466.db2.gz YYELEXMJJWSQNV-UHFFFAOYSA-N 1 1 364.352 2.913 20 5 FFBDMO CC[C@H](C(=O)OC)N1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000554869124 516672951 /nfs/dbraw/zinc/67/29/51/516672951.db2.gz PQBSOKWAXIDXEV-WTQUMQLASA-N 1 1 361.442 2.567 20 5 FFBDMO CCN(CC)C(=O)CCC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513713617 516729232 /nfs/dbraw/zinc/72/92/32/516729232.db2.gz QSCVVGHZOJWCRZ-GOSISDBHSA-N 1 1 373.457 2.656 20 5 FFBDMO C[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@@H+](C)Cc1ccccc1 ZINC000544395651 516740960 /nfs/dbraw/zinc/74/09/60/516740960.db2.gz GXILYSQMTYGYGR-AWEZNQCLSA-N 1 1 351.410 2.892 20 5 FFBDMO C[C@@H]1CCC[C@@](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000518810957 516784579 /nfs/dbraw/zinc/78/45/79/516784579.db2.gz IRZJEPYJEUGTHS-KZULUSFZSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(C2CCC2)CC1 ZINC000532204727 516857060 /nfs/dbraw/zinc/85/70/60/516857060.db2.gz RPJOEDGNBAGAEJ-AWEZNQCLSA-N 1 1 360.458 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000551791800 516873028 /nfs/dbraw/zinc/87/30/28/516873028.db2.gz UTWIDAIRUGDGRJ-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000551791800 516873032 /nfs/dbraw/zinc/87/30/32/516873032.db2.gz UTWIDAIRUGDGRJ-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000551794908 516875519 /nfs/dbraw/zinc/87/55/19/516875519.db2.gz ATLQSDNWVICGJV-GOSISDBHSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000551794908 516875528 /nfs/dbraw/zinc/87/55/28/516875528.db2.gz ATLQSDNWVICGJV-GOSISDBHSA-N 1 1 357.385 2.733 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCCC[C@@H]1C ZINC000519098925 516884176 /nfs/dbraw/zinc/88/41/76/516884176.db2.gz AMUZZHSQNJOKRY-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000514225987 516912423 /nfs/dbraw/zinc/91/24/23/516912423.db2.gz FYDRUIHQMZTTBT-GFCCVEGCSA-N 1 1 355.341 2.505 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@@H](C)C1 ZINC000514755592 517040620 /nfs/dbraw/zinc/04/06/20/517040620.db2.gz WJARRPYTVWNYDP-IYBDPMFKSA-N 1 1 374.485 2.752 20 5 FFBDMO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2nnc(-c3ccco3)o2)cc1[N+](=O)[O-] ZINC000537176853 517069342 /nfs/dbraw/zinc/06/93/42/517069342.db2.gz APGBPMYXPKGKAD-LLVKDONJSA-N 1 1 371.353 2.836 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444486 517112475 /nfs/dbraw/zinc/11/24/75/517112475.db2.gz RSHCLIMNMKTWTG-UKRRQHHQSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444486 517112488 /nfs/dbraw/zinc/11/24/88/517112488.db2.gz RSHCLIMNMKTWTG-UKRRQHHQSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000525804402 517172039 /nfs/dbraw/zinc/17/20/39/517172039.db2.gz VMKHHAGHWVMBTC-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294725 517388779 /nfs/dbraw/zinc/38/87/79/517388779.db2.gz CUCHQRBMBQNDPW-IAGOWNOFSA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294725 517388784 /nfs/dbraw/zinc/38/87/84/517388784.db2.gz CUCHQRBMBQNDPW-IAGOWNOFSA-N 1 1 361.442 2.619 20 5 FFBDMO C[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000552973325 517460341 /nfs/dbraw/zinc/46/03/41/517460341.db2.gz RNWGMLUQKCKGEJ-NSHDSACASA-N 1 1 360.439 2.614 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000556521443 517476678 /nfs/dbraw/zinc/47/66/78/517476678.db2.gz WVKAUKSAYNDZNK-HOCLYGCPSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542404963 517543395 /nfs/dbraw/zinc/54/33/95/517543395.db2.gz CQCAWXXSPBUPSW-MFKMUULPSA-N 1 1 369.874 2.939 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)[NH+]1CCC(OC)CC1 ZINC000520974005 517565822 /nfs/dbraw/zinc/56/58/22/517565822.db2.gz MSYGBEABVWUQSS-UHFFFAOYSA-N 1 1 365.474 2.973 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC1 ZINC000553287556 517626209 /nfs/dbraw/zinc/62/62/09/517626209.db2.gz VXJNZBNFIFRETF-UHFFFAOYSA-N 1 1 359.430 2.800 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000533833745 517632397 /nfs/dbraw/zinc/63/23/97/517632397.db2.gz YXMZQICTTJRXQL-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000533833745 517632408 /nfs/dbraw/zinc/63/24/08/517632408.db2.gz YXMZQICTTJRXQL-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] ZINC000553351868 517661942 /nfs/dbraw/zinc/66/19/42/517661942.db2.gz GNENTJTZXIMANG-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708888 517666512 /nfs/dbraw/zinc/66/65/12/517666512.db2.gz GKYNFAORANJAMT-WFASDCNBSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708888 517666519 /nfs/dbraw/zinc/66/65/19/517666519.db2.gz GKYNFAORANJAMT-WFASDCNBSA-N 1 1 373.375 2.909 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C[C@H]2C)cc1OC ZINC000530361343 517729384 /nfs/dbraw/zinc/72/93/84/517729384.db2.gz VNASMJWGDKDPJW-GZBFAFLISA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C[C@H]2C)cc1OC ZINC000530361343 517729398 /nfs/dbraw/zinc/72/93/98/517729398.db2.gz VNASMJWGDKDPJW-GZBFAFLISA-N 1 1 352.431 2.983 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000516623379 517774085 /nfs/dbraw/zinc/77/40/85/517774085.db2.gz LMBOFUVLFJHPMG-SWLSCSKDSA-N 1 1 372.400 2.881 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542852608 517782196 /nfs/dbraw/zinc/78/21/96/517782196.db2.gz MCQDGQWDBBCHGQ-LBPRGKRZSA-N 1 1 371.384 2.904 20 5 FFBDMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000534261766 517811893 /nfs/dbraw/zinc/81/18/93/517811893.db2.gz OQDMLZSOCOPNAH-ZDUSSCGKSA-N 1 1 363.805 2.538 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2CO)cc1OC ZINC000542916529 517814979 /nfs/dbraw/zinc/81/49/79/517814979.db2.gz XNVYETBKFRGALE-DZGCQCFKSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2CO)cc1OC ZINC000542916529 517814986 /nfs/dbraw/zinc/81/49/86/517814986.db2.gz XNVYETBKFRGALE-DZGCQCFKSA-N 1 1 352.431 2.985 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000542962142 517839232 /nfs/dbraw/zinc/83/92/32/517839232.db2.gz OFYQIUGISBLUBJ-MRXNPFEDSA-N 1 1 370.409 2.999 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000553783338 517901303 /nfs/dbraw/zinc/90/13/03/517901303.db2.gz OZMWPIGUTHHVIB-KSMMKXTCSA-N 1 1 370.453 2.807 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534559880 517941486 /nfs/dbraw/zinc/94/14/86/517941486.db2.gz QEHXTPPJUYGJPJ-SFHVURJKSA-N 1 1 366.421 2.849 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534559880 517941495 /nfs/dbraw/zinc/94/14/95/517941495.db2.gz QEHXTPPJUYGJPJ-SFHVURJKSA-N 1 1 366.421 2.849 20 5 FFBDMO C[C@H]1COc2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543188372 517955767 /nfs/dbraw/zinc/95/57/67/517955767.db2.gz YWZRDLKIFJWYCW-GOEBONIOSA-N 1 1 358.394 2.618 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1[C@@H](C)C[NH+](C)C[C@@H]1C ZINC000550317247 517992085 /nfs/dbraw/zinc/99/20/85/517992085.db2.gz IZYTWFAQMLLBIZ-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(CCNc3cc[nH+]c(N4CCCCC4)n3)c2c1 ZINC000563651089 518046558 /nfs/dbraw/zinc/04/65/58/518046558.db2.gz NOYUPQPFBKFVLG-UHFFFAOYSA-N 1 1 366.425 2.933 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)c1 ZINC000560833924 518052003 /nfs/dbraw/zinc/05/20/03/518052003.db2.gz FFUVGBPGEJVTCE-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1 ZINC000560833924 518052013 /nfs/dbraw/zinc/05/20/13/518052013.db2.gz FFUVGBPGEJVTCE-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@H](C3CCCCC3)C2)c1 ZINC000543585129 518146178 /nfs/dbraw/zinc/14/61/78/518146178.db2.gz IEMWIDHXNWXJLH-HKUYNNGSSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@H](C3CCCCC3)C2)c1 ZINC000543585129 518146185 /nfs/dbraw/zinc/14/61/85/518146185.db2.gz IEMWIDHXNWXJLH-HKUYNNGSSA-N 1 1 364.442 2.616 20 5 FFBDMO CCC[C@@H]1CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000563849027 518147177 /nfs/dbraw/zinc/14/71/77/518147177.db2.gz HPARUKZBKHDBRX-CRAIPNDOSA-N 1 1 363.458 2.658 20 5 FFBDMO CC(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C1CCSCC1 ZINC000578527005 518252464 /nfs/dbraw/zinc/25/24/64/518252464.db2.gz NIZMBNIYAOLBRP-UHFFFAOYSA-N 1 1 351.472 2.737 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(CN3CCOCC3)c1)C2 ZINC000566908229 518259376 /nfs/dbraw/zinc/25/93/76/518259376.db2.gz KAFYOGKGPVPRLV-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(CN3CCOCC3)c1)C2 ZINC000566908229 518259381 /nfs/dbraw/zinc/25/93/81/518259381.db2.gz KAFYOGKGPVPRLV-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C2(CCCCC2)C1 ZINC000581437317 518285999 /nfs/dbraw/zinc/28/59/99/518285999.db2.gz IPUWMJOIJKONAL-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO COc1c(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000584414210 518330520 /nfs/dbraw/zinc/33/05/20/518330520.db2.gz LWHICYBXWDGCCB-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO COC(=O)c1cc(NC(=O)N[C@@H](C)C[N@@H+](C)C(C)C)c(C)c([N+](=O)[O-])c1 ZINC000570247439 518513706 /nfs/dbraw/zinc/51/37/06/518513706.db2.gz GXWAKUCCXJIYRC-NSHDSACASA-N 1 1 366.418 2.540 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000570267150 518524901 /nfs/dbraw/zinc/52/49/01/518524901.db2.gz IUOKIMWHBGJRGY-HNNXBMFYSA-N 1 1 374.441 2.969 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000582859446 518957683 /nfs/dbraw/zinc/95/76/83/518957683.db2.gz LPHKWEDSXWVGKW-LBPRGKRZSA-N 1 1 359.348 2.914 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C2(CCCCC2)C1 ZINC000580089958 519003263 /nfs/dbraw/zinc/00/32/63/519003263.db2.gz GANIOAQDBWNSCE-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@H]2CC[N@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000577389888 519057241 /nfs/dbraw/zinc/05/72/41/519057241.db2.gz BXWSELGHVYGDNJ-CJNGLKHVSA-N 1 1 369.487 2.508 20 5 FFBDMO Cc1cc(OCC(=O)N2CCC(C[N@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000574350763 519113287 /nfs/dbraw/zinc/11/32/87/519113287.db2.gz VLHZPWYONDLHPB-UHFFFAOYSA-N 1 1 363.458 2.861 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000590390354 519212159 /nfs/dbraw/zinc/21/21/59/519212159.db2.gz YJELZTQGNQOZQT-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000577898266 519312924 /nfs/dbraw/zinc/31/29/24/519312924.db2.gz DEPPOSCJRJMPBR-QZTJIDSGSA-N 1 1 374.441 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1CN(c3ccccc3)CCO1)CC2 ZINC000574819728 519349614 /nfs/dbraw/zinc/34/96/14/519349614.db2.gz JDTCCJYBPWNYCK-HXUWFJFHSA-N 1 1 353.422 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1CN(c3ccccc3)CCO1)CC2 ZINC000574819728 519349626 /nfs/dbraw/zinc/34/96/26/519349626.db2.gz JDTCCJYBPWNYCK-HXUWFJFHSA-N 1 1 353.422 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC[C@@H]3CCS(=O)(=O)C3)C2)cc1 ZINC000590757600 519353230 /nfs/dbraw/zinc/35/32/30/519353230.db2.gz CHVBIQPNVKTPNP-GDBMZVCRSA-N 1 1 352.456 2.599 20 5 FFBDMO C[C@@]1(NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000566320212 519430140 /nfs/dbraw/zinc/43/01/40/519430140.db2.gz ZTCXVRKPOIKDDP-HXUWFJFHSA-N 1 1 369.421 2.754 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590926384 519437210 /nfs/dbraw/zinc/43/72/10/519437210.db2.gz OGIPBPXYRCMRHV-WMZOPIPTSA-N 1 1 360.458 2.968 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000580979939 519457618 /nfs/dbraw/zinc/45/76/18/519457618.db2.gz QGRXAGPSNKACJA-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO CC(C)[C@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)CC[N@H+]1C ZINC000566383198 519464985 /nfs/dbraw/zinc/46/49/85/519464985.db2.gz ALRKKBITRPQKHY-QGZVFWFLSA-N 1 1 370.457 2.965 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2cccnc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000602855036 519925861 /nfs/dbraw/zinc/92/58/61/519925861.db2.gz OPTLYQALNYFUEN-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2cccnc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000602855036 519925871 /nfs/dbraw/zinc/92/58/71/519925871.db2.gz OPTLYQALNYFUEN-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO COC(=O)c1cnc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000616176880 519933504 /nfs/dbraw/zinc/93/35/04/519933504.db2.gz MVIRGVRMXSMVPF-VNHYZAJKSA-N 1 1 362.430 2.618 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(SC)CC2)c([N+](=O)[O-])c1 ZINC000602922203 519974585 /nfs/dbraw/zinc/97/45/85/519974585.db2.gz DCFNQTZEULUUET-NSHDSACASA-N 1 1 353.444 2.758 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594484872 519994779 /nfs/dbraw/zinc/99/47/79/519994779.db2.gz WLDZUALZSZYCNI-CHWSQXEVSA-N 1 1 373.862 2.543 20 5 FFBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600007478 519998101 /nfs/dbraw/zinc/99/81/01/519998101.db2.gz UJVRKTVODFCAGQ-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000594547610 520021336 /nfs/dbraw/zinc/02/13/36/520021336.db2.gz UQAFBXPXLCPQEK-CQSZACIVSA-N 1 1 366.437 2.713 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC([C@@H]3CCC[NH2+]C3)CC1)OCCO2 ZINC000594735199 520123170 /nfs/dbraw/zinc/12/31/70/520123170.db2.gz HOATVDBLOOZZAW-OAHLLOKOSA-N 1 1 361.442 2.578 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000600252610 520159811 /nfs/dbraw/zinc/15/98/11/520159811.db2.gz KKVTXLKOMDCGBS-GOSISDBHSA-N 1 1 370.453 2.916 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600313176 520198740 /nfs/dbraw/zinc/19/87/40/520198740.db2.gz IIQCBUPARITMRQ-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000609138485 520203213 /nfs/dbraw/zinc/20/32/13/520203213.db2.gz PGHGTWDDWTVGJG-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO O=c1ccccn1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131217 520207935 /nfs/dbraw/zinc/20/79/35/520207935.db2.gz UDNTWDWZESKCRQ-IYARVYRRSA-N 1 1 371.437 2.562 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000592183631 520250294 /nfs/dbraw/zinc/25/02/94/520250294.db2.gz FHVFLXWGEWTYJU-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000592183631 520250302 /nfs/dbraw/zinc/25/03/02/520250302.db2.gz FHVFLXWGEWTYJU-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO COc1ccc(CNC(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595004562 520253079 /nfs/dbraw/zinc/25/30/79/520253079.db2.gz BGQVGVSYYMCGTR-CYBMUJFWSA-N 1 1 373.409 2.579 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(S(C)(=O)=O)c1 ZINC000595042638 520267232 /nfs/dbraw/zinc/26/72/32/520267232.db2.gz UENRWCWVKDIANG-GFCCVEGCSA-N 1 1 364.423 2.858 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000600469591 520278147 /nfs/dbraw/zinc/27/81/47/520278147.db2.gz CKVQCKBUGLSIKI-CYBMUJFWSA-N 1 1 369.368 2.943 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1SC ZINC000597857674 520285885 /nfs/dbraw/zinc/28/58/85/520285885.db2.gz ITDKEPVDIJKNTR-LLVKDONJSA-N 1 1 367.471 2.928 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000609346921 520289320 /nfs/dbraw/zinc/28/93/20/520289320.db2.gz WBHBNMZSCYGXGT-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000609346501 520289689 /nfs/dbraw/zinc/28/96/89/520289689.db2.gz INJPEQSSEOKAPK-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])s3)c2)C1 ZINC000609384202 520300263 /nfs/dbraw/zinc/30/02/63/520300263.db2.gz UYQJFMUPPOPZJA-OAHLLOKOSA-N 1 1 374.466 2.966 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609546637 520353562 /nfs/dbraw/zinc/35/35/62/520353562.db2.gz GPLPPBLIXZTAFC-CYBMUJFWSA-N 1 1 374.363 2.626 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000603854335 520378980 /nfs/dbraw/zinc/37/89/80/520378980.db2.gz WACWAVKHZJNGQC-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000603854335 520378988 /nfs/dbraw/zinc/37/89/88/520378988.db2.gz WACWAVKHZJNGQC-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000609620417 520382513 /nfs/dbraw/zinc/38/25/13/520382513.db2.gz DZRUDBYKQNLRTH-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000609620417 520382517 /nfs/dbraw/zinc/38/25/17/520382517.db2.gz DZRUDBYKQNLRTH-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592493963 520416642 /nfs/dbraw/zinc/41/66/42/520416642.db2.gz XYYBOBQYTZPRSZ-GVDBMIGSSA-N 1 1 374.485 2.942 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@H]2C)n1 ZINC000617408086 520479839 /nfs/dbraw/zinc/47/98/39/520479839.db2.gz ZAKFFWFAPVCHIR-OAHLLOKOSA-N 1 1 371.441 2.548 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595470077 520493799 /nfs/dbraw/zinc/49/37/99/520493799.db2.gz LYCHXGOKKRUZPT-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595470077 520493791 /nfs/dbraw/zinc/49/37/91/520493791.db2.gz LYCHXGOKKRUZPT-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C[NH+]1CCOCC1 ZINC000609996797 520499817 /nfs/dbraw/zinc/49/98/17/520499817.db2.gz NACCGPBCMPOTAJ-AWEZNQCLSA-N 1 1 363.458 2.590 20 5 FFBDMO Cn1cc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C2(CO)CCC2)cn1 ZINC000595492931 520505721 /nfs/dbraw/zinc/50/57/21/520505721.db2.gz HTRGOCVYNGHLMV-INIZCTEOSA-N 1 1 364.833 2.975 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](c1cccnc1)C(C)(C)CO ZINC000595498950 520510542 /nfs/dbraw/zinc/51/05/42/520510542.db2.gz ICHMGUMLIAACGJ-SFHVURJKSA-N 1 1 372.425 2.586 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595535654 520532450 /nfs/dbraw/zinc/53/24/50/520532450.db2.gz IUWOMFAXBVIOCY-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](Cn3ccnn3)C2)c1 ZINC000595608734 520590647 /nfs/dbraw/zinc/59/06/47/520590647.db2.gz UWVVUKUDSXVREF-NSHDSACASA-N 1 1 355.320 2.727 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc21 ZINC000595613117 520592840 /nfs/dbraw/zinc/59/28/40/520592840.db2.gz HOFNAXBCYFVUQB-MRXNPFEDSA-N 1 1 372.425 2.732 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc21 ZINC000595613117 520592847 /nfs/dbraw/zinc/59/28/47/520592847.db2.gz HOFNAXBCYFVUQB-MRXNPFEDSA-N 1 1 372.425 2.732 20 5 FFBDMO Cc1cccn2cc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)nc12 ZINC000610391472 520664083 /nfs/dbraw/zinc/66/40/83/520664083.db2.gz UWPWOIZACAJZRL-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1cccn2cc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)nc12 ZINC000610391472 520664091 /nfs/dbraw/zinc/66/40/91/520664091.db2.gz UWPWOIZACAJZRL-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000598508525 520666041 /nfs/dbraw/zinc/66/60/41/520666041.db2.gz CILYIJMVGXPTMZ-AWEZNQCLSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000598508525 520666052 /nfs/dbraw/zinc/66/60/52/520666052.db2.gz CILYIJMVGXPTMZ-AWEZNQCLSA-N 1 1 373.384 2.747 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCc3nc(-c4ccccc4)sc3C2)c1 ZINC000595715306 520667987 /nfs/dbraw/zinc/66/79/87/520667987.db2.gz XQJFYYZDJHKNSH-UHFFFAOYSA-N 1 1 355.423 2.973 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCc3nc(-c4ccccc4)sc3C2)c1 ZINC000595715306 520667988 /nfs/dbraw/zinc/66/79/88/520667988.db2.gz XQJFYYZDJHKNSH-UHFFFAOYSA-N 1 1 355.423 2.973 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)c1 ZINC000593021817 520688908 /nfs/dbraw/zinc/68/89/08/520688908.db2.gz XDBXLUCPQWEHEH-INIZCTEOSA-N 1 1 360.414 2.992 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000610446089 520691318 /nfs/dbraw/zinc/69/13/18/520691318.db2.gz PHMWBNBEKBTTFT-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@]3(O)C[C@H]3C2)cc1OC ZINC000595759513 520704528 /nfs/dbraw/zinc/70/45/28/520704528.db2.gz WDOXDPVTFGWVMT-FRIZHTMISA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(O)C[C@H]3C2)cc1OC ZINC000595759513 520704532 /nfs/dbraw/zinc/70/45/32/520704532.db2.gz WDOXDPVTFGWVMT-FRIZHTMISA-N 1 1 364.442 2.985 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c(C)c1[N+](=O)[O-] ZINC000598614151 520743835 /nfs/dbraw/zinc/74/38/35/520743835.db2.gz JJHPMTKDTRHMQR-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593118341 520757494 /nfs/dbraw/zinc/75/74/94/520757494.db2.gz QLCQWFUDLZQEON-HNNXBMFYSA-N 1 1 353.325 2.624 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(F)cc2C(N)=O)CC1 ZINC000598648999 520761234 /nfs/dbraw/zinc/76/12/34/520761234.db2.gz UKPRBLMCIBKMRG-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900786 520808029 /nfs/dbraw/zinc/80/80/29/520808029.db2.gz LFQWOIBPDUZOLK-GOEBONIOSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901290 520808381 /nfs/dbraw/zinc/80/83/81/520808381.db2.gz UUEAVHDNCMVHTI-GOEBONIOSA-N 1 1 360.458 2.633 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC000595916025 520822018 /nfs/dbraw/zinc/82/20/18/520822018.db2.gz KTXZGVAFIVZSCA-YVEFUNNKSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC000595916025 520822025 /nfs/dbraw/zinc/82/20/25/520822025.db2.gz KTXZGVAFIVZSCA-YVEFUNNKSA-N 1 1 371.384 2.976 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601561022 520842206 /nfs/dbraw/zinc/84/22/06/520842206.db2.gz WIFQKZWGGUIXEG-UHFFFAOYSA-N 1 1 354.410 2.866 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596123944 520926969 /nfs/dbraw/zinc/92/69/69/520926969.db2.gz SZCMKPFUIUUJMM-NSHDSACASA-N 1 1 353.806 2.708 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000596168168 520948186 /nfs/dbraw/zinc/94/81/86/520948186.db2.gz LVELVCSLTTZFKY-VXGBXAGGSA-N 1 1 367.833 2.955 20 5 FFBDMO CCn1nncc1C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000598987412 520962465 /nfs/dbraw/zinc/96/24/65/520962465.db2.gz ULEIDBHQQCBKCZ-UHFFFAOYSA-N 1 1 357.370 2.765 20 5 FFBDMO CC[C@H](C)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CC1 ZINC000596259216 520997643 /nfs/dbraw/zinc/99/76/43/520997643.db2.gz UWDLONQMLPKVTP-NSHDSACASA-N 1 1 355.822 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(CN3CC[NH+](C[C@H]4CCCO4)CC3)co2)cc1 ZINC000611169840 521021802 /nfs/dbraw/zinc/02/18/02/521021802.db2.gz UBDBCEKVQBTPGV-GOSISDBHSA-N 1 1 372.425 2.546 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000599139830 521051682 /nfs/dbraw/zinc/05/16/82/521051682.db2.gz QQKDTCBJQNFBSK-MOPGFXCFSA-N 1 1 353.422 2.599 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274781 521075258 /nfs/dbraw/zinc/07/52/58/521075258.db2.gz HXWFVFIULSOGOG-HNNXBMFYSA-N 1 1 361.442 2.530 20 5 FFBDMO CCc1nn(C)c(N2CC[NH+](Cc3cc(C)ccc3OC)CC2)c1[N+](=O)[O-] ZINC000611280645 521078177 /nfs/dbraw/zinc/07/81/77/521078177.db2.gz NUDPXWYCEXPLIU-UHFFFAOYSA-N 1 1 373.457 2.530 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)nc1-c1ccccc1 ZINC000596537365 521122318 /nfs/dbraw/zinc/12/23/18/521122318.db2.gz DJEOCDRWBUJRNY-QGZVFWFLSA-N 1 1 368.437 2.692 20 5 FFBDMO COc1ccc(OCC[N@H+]2Cc3c[nH]nc3CC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000596599411 521156514 /nfs/dbraw/zinc/15/65/14/521156514.db2.gz SQOBDEKZROBLAW-UHFFFAOYSA-N 1 1 360.414 2.790 20 5 FFBDMO C[N@@H+](CCNC(=O)c1c(Br)cccc1[N+](=O)[O-])C1CCCC1 ZINC000599346137 521166482 /nfs/dbraw/zinc/16/64/82/521166482.db2.gz ZEBIFMHZUGOCFT-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)cccc1[N+](=O)[O-] ZINC000596634885 521180177 /nfs/dbraw/zinc/18/01/77/521180177.db2.gz FUFRTPOHMRIRMA-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO CC(=O)Nc1ccc(-c2ccccc2C[NH+]2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000596638719 521182840 /nfs/dbraw/zinc/18/28/40/521182840.db2.gz BMBFALSQNIYVNJ-UHFFFAOYSA-N 1 1 368.437 2.968 20 5 FFBDMO COc1ccc(C[N@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000599397187 521197262 /nfs/dbraw/zinc/19/72/62/521197262.db2.gz HLYRGFPJLJGJTH-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000599397187 521197274 /nfs/dbraw/zinc/19/72/74/521197274.db2.gz HLYRGFPJLJGJTH-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1 ZINC000599395762 521197911 /nfs/dbraw/zinc/19/79/11/521197911.db2.gz JVEKQQHBQCYZQA-FQEVSTJZSA-N 1 1 372.421 2.627 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000611560714 521219085 /nfs/dbraw/zinc/21/90/85/521219085.db2.gz AIQWYZTVTYMOGW-QGZVFWFLSA-N 1 1 358.442 2.950 20 5 FFBDMO C[C@@H]1C[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H](C)C1(F)F ZINC000599512743 521270567 /nfs/dbraw/zinc/27/05/67/521270567.db2.gz MEESXMCCPWORFG-JMSVASOKSA-N 1 1 353.369 2.923 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000611705693 521289452 /nfs/dbraw/zinc/28/94/52/521289452.db2.gz GVHIGJLCMLQRQD-CQSZACIVSA-N 1 1 364.409 2.816 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)n[nH]1 ZINC000611796949 521336327 /nfs/dbraw/zinc/33/63/27/521336327.db2.gz RPXLGUUFJZZOQB-SFHVURJKSA-N 1 1 369.425 2.611 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)[nH]n1 ZINC000611796949 521336336 /nfs/dbraw/zinc/33/63/36/521336336.db2.gz RPXLGUUFJZZOQB-SFHVURJKSA-N 1 1 369.425 2.611 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000602474185 521364672 /nfs/dbraw/zinc/36/46/72/521364672.db2.gz ITBGCFHEKCPFKH-ZDUSSCGKSA-N 1 1 373.375 2.768 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000602474185 521364675 /nfs/dbraw/zinc/36/46/75/521364675.db2.gz ITBGCFHEKCPFKH-ZDUSSCGKSA-N 1 1 373.375 2.768 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602509997 521386929 /nfs/dbraw/zinc/38/69/29/521386929.db2.gz JBWXKDBQZJFZJT-UHFFFAOYSA-N 1 1 374.407 2.729 20 5 FFBDMO C/C=C\C[C@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690294 521406099 /nfs/dbraw/zinc/40/60/99/521406099.db2.gz NCVDAMHDZIGTGG-ZRMMWKCHSA-N 1 1 361.398 2.940 20 5 FFBDMO C/C=C\C[C@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690294 521406109 /nfs/dbraw/zinc/40/61/09/521406109.db2.gz NCVDAMHDZIGTGG-ZRMMWKCHSA-N 1 1 361.398 2.940 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000599831171 521499674 /nfs/dbraw/zinc/49/96/74/521499674.db2.gz OXRQKZZJQGANMF-WBVHZDCISA-N 1 1 355.398 2.891 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)c1ccco1 ZINC000597094140 521500038 /nfs/dbraw/zinc/50/00/38/521500038.db2.gz LOLOBKNFSIEZSM-LBPRGKRZSA-N 1 1 367.793 2.848 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](Cc2ccccc2)CC[C@H]1C ZINC000602784135 521531419 /nfs/dbraw/zinc/53/14/19/521531419.db2.gz QCBMQMHUSBAUSY-MRXNPFEDSA-N 1 1 357.458 2.696 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@@H]2N1 ZINC000597207819 521575130 /nfs/dbraw/zinc/57/51/30/521575130.db2.gz VTRRKYDXDPBJHP-YOEHRIQHSA-N 1 1 355.394 2.955 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000619566921 521773185 /nfs/dbraw/zinc/77/31/85/521773185.db2.gz AFNYMYGTIBNPIP-QGZVFWFLSA-N 1 1 374.485 2.754 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(-c2nn[nH]n2)c1 ZINC000821427612 606158137 /nfs/dbraw/zinc/15/81/37/606158137.db2.gz WXUZEMCNFLEWSZ-UHFFFAOYSA-N 1 1 368.397 2.806 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(-c2nn[nH]n2)c1 ZINC000821427612 606158140 /nfs/dbraw/zinc/15/81/40/606158140.db2.gz WXUZEMCNFLEWSZ-UHFFFAOYSA-N 1 1 368.397 2.806 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000826169968 608553758 /nfs/dbraw/zinc/55/37/58/608553758.db2.gz KRZFFRLMWJXCKO-LBPRGKRZSA-N 1 1 368.397 2.943 20 5 FFBDMO Cc1c(C)c(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)ncc1[N+](=O)[O-] ZINC001164729002 720396144 /nfs/dbraw/zinc/39/61/44/720396144.db2.gz UQTKTTMJIOJYQB-IRXDYDNUSA-N 1 1 353.426 2.855 20 5 FFBDMO Cc1nc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC001164858490 720924953 /nfs/dbraw/zinc/92/49/53/720924953.db2.gz NNQMQDZRRWUMPW-AWEZNQCLSA-N 1 1 358.446 2.916 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164786808 721390339 /nfs/dbraw/zinc/39/03/39/721390339.db2.gz PFFSAVIXJFMZLF-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164786808 721390341 /nfs/dbraw/zinc/39/03/41/721390341.db2.gz PFFSAVIXJFMZLF-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000744345423 735350915 /nfs/dbraw/zinc/35/09/15/735350915.db2.gz OIKCLZVCMDAGBE-GFCCVEGCSA-N 1 1 360.439 2.932 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000043331372 727969027 /nfs/dbraw/zinc/96/90/27/727969027.db2.gz WNDKRKMYZGXEEE-TXEJJXNPSA-N 1 1 370.837 2.869 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000066139806 728166912 /nfs/dbraw/zinc/16/69/12/728166912.db2.gz GFAYXVLANPXFLG-SNVBAGLBSA-N 1 1 352.391 2.580 20 5 FFBDMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccco1 ZINC000119661692 728598245 /nfs/dbraw/zinc/59/82/45/728598245.db2.gz HBNBPHBSYWRHBC-GFCCVEGCSA-N 1 1 373.456 2.611 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000127170245 728705680 /nfs/dbraw/zinc/70/56/80/728705680.db2.gz JGDLQRSBUHXIER-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000152157909 728748847 /nfs/dbraw/zinc/74/88/47/728748847.db2.gz ZHLOFLJBJBKUIZ-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000172175822 729021128 /nfs/dbraw/zinc/02/11/28/729021128.db2.gz OKAPNEZBENBSTM-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000172175822 729021131 /nfs/dbraw/zinc/02/11/31/729021131.db2.gz OKAPNEZBENBSTM-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO CC(C)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](O)c1ccc(F)cc1 ZINC000174867062 729081681 /nfs/dbraw/zinc/08/16/81/729081681.db2.gz UYWMNGYDZDPGGT-KRWDZBQOSA-N 1 1 350.394 2.622 20 5 FFBDMO Cn1cc([C@H]2CSCC[N@@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000191161972 729414785 /nfs/dbraw/zinc/41/47/85/729414785.db2.gz RDADNEOXYJGGIE-QGZVFWFLSA-N 1 1 362.455 2.887 20 5 FFBDMO Cn1cc([C@H]2CSCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000191161972 729414786 /nfs/dbraw/zinc/41/47/86/729414786.db2.gz RDADNEOXYJGGIE-QGZVFWFLSA-N 1 1 362.455 2.887 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000906201145 736469421 /nfs/dbraw/zinc/46/94/21/736469421.db2.gz WDHAYHSLORBKRU-HOTGVXAUSA-N 1 1 351.834 2.924 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])ncc1Br ZINC000856281721 730321093 /nfs/dbraw/zinc/32/10/93/730321093.db2.gz IKWXQZJPNLEVAT-UHFFFAOYSA-N 1 1 373.251 2.603 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000925139035 738481200 /nfs/dbraw/zinc/48/12/00/738481200.db2.gz JDIPKXYXUQBFHD-HIFRSBDPSA-N 1 1 350.444 2.605 20 5 FFBDMO C[N@@H+](CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)C1CCC1 ZINC000863926171 730816117 /nfs/dbraw/zinc/81/61/17/730816117.db2.gz SMLDIOJXTYOTOA-CQSZACIVSA-N 1 1 363.311 2.938 20 5 FFBDMO C[C@H]([NH2+]C[C@@H]1CS(=O)(=O)c2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872075889 731727293 /nfs/dbraw/zinc/72/72/93/731727293.db2.gz VJLABBMOAUMLHD-NWDGAFQWSA-N 1 1 364.398 2.956 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000874825157 732104141 /nfs/dbraw/zinc/10/41/41/732104141.db2.gz WZQRPJNHULKEAN-VXGBXAGGSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000874834509 732105608 /nfs/dbraw/zinc/10/56/08/732105608.db2.gz SFXIXUGLQUEWHR-UONOGXRCSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000874838223 732106330 /nfs/dbraw/zinc/10/63/30/732106330.db2.gz OJLIFQPRFAEFHP-KBPBESRZSA-N 1 1 368.231 2.666 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000877436625 732361985 /nfs/dbraw/zinc/36/19/85/732361985.db2.gz VCGDEFSSAAIYQS-GFCCVEGCSA-N 1 1 359.348 2.712 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cc(Br)c([N+](=O)[O-])s3)CC[C@H]21 ZINC000877741004 732421712 /nfs/dbraw/zinc/42/17/12/732421712.db2.gz MAAWBRCYEAPWDU-BXKDBHETSA-N 1 1 360.277 2.945 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cccc([N+](=O)[O-])c3Br)CC[C@H]21 ZINC000879579078 732728609 /nfs/dbraw/zinc/72/86/09/732728609.db2.gz JOGUXXVIHKTPHR-WCQYABFASA-N 1 1 354.248 2.883 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000880437536 732908219 /nfs/dbraw/zinc/90/82/19/732908219.db2.gz MMQLHCIJCCPMNS-OCCSQVGLSA-N 1 1 359.220 2.593 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000886319846 733773102 /nfs/dbraw/zinc/77/31/02/733773102.db2.gz QTGLHVLEYSCGME-KBPBESRZSA-N 1 1 355.316 2.614 20 5 FFBDMO CSc1cccc(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)c1[N+](=O)[O-] ZINC000928089013 738819705 /nfs/dbraw/zinc/81/97/05/738819705.db2.gz IPOJDDUCFQSPTL-OLZOCXBDSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1cccc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-] ZINC000928089013 738819706 /nfs/dbraw/zinc/81/97/06/738819706.db2.gz IPOJDDUCFQSPTL-OLZOCXBDSA-N 1 1 367.496 2.626 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095120 738821690 /nfs/dbraw/zinc/82/16/90/738821690.db2.gz MXWARXGLFCHIQZ-STQMWFEESA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095120 738821694 /nfs/dbraw/zinc/82/16/94/738821694.db2.gz MXWARXGLFCHIQZ-STQMWFEESA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(N3CCOCC3)n2)cc1Cl ZINC000783680515 738826211 /nfs/dbraw/zinc/82/62/11/738826211.db2.gz ZNUALOPADMQLLR-UHFFFAOYSA-N 1 1 362.817 2.770 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000733894196 734856805 /nfs/dbraw/zinc/85/68/05/734856805.db2.gz ZDJSKSQSCYCQRZ-HNNXBMFYSA-N 1 1 352.866 2.853 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000733894196 734856809 /nfs/dbraw/zinc/85/68/09/734856809.db2.gz ZDJSKSQSCYCQRZ-HNNXBMFYSA-N 1 1 352.866 2.853 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N[C@H]1Cc2c[nH+]cn2C1 ZINC000894995990 734949639 /nfs/dbraw/zinc/94/96/39/734949639.db2.gz IEDLOVNEXUDGHX-ZETCQYMHSA-N 1 1 363.246 2.877 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000894999359 734950111 /nfs/dbraw/zinc/95/01/11/734950111.db2.gz BOTZPBLYVLGAHA-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO ZINC000897220407 735208002 /nfs/dbraw/zinc/20/80/02/735208002.db2.gz ASLDRYCVEADEEZ-QWHCGFSZSA-N 1 1 359.348 2.649 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc(S(C)(=O)=O)s2)cc([N+](=O)[O-])c1 ZINC000903157995 736044329 /nfs/dbraw/zinc/04/43/29/736044329.db2.gz PZBPSBHFKDTTDC-SNVBAGLBSA-N 1 1 370.452 2.919 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000756902168 736371709 /nfs/dbraw/zinc/37/17/09/736371709.db2.gz QMQHQNMSBBBVJB-RISCZKNCSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000756944183 736375624 /nfs/dbraw/zinc/37/56/24/736375624.db2.gz YXFIBRGWGFPXDJ-ZDUSSCGKSA-N 1 1 352.822 2.532 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)CC2 ZINC000907206831 736597014 /nfs/dbraw/zinc/59/70/14/736597014.db2.gz PCGAYAAZHPSIAY-UHFFFAOYSA-N 1 1 352.822 2.531 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000908362013 736764198 /nfs/dbraw/zinc/76/41/98/736764198.db2.gz GTDJVWPMQZOIGY-QGZVFWFLSA-N 1 1 351.834 2.735 20 5 FFBDMO COc1cc(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000766926630 737276272 /nfs/dbraw/zinc/27/62/72/737276272.db2.gz LVUXIBBCRXMCQN-BETUJISGSA-N 1 1 353.419 2.523 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1F ZINC000913276684 737390240 /nfs/dbraw/zinc/39/02/40/737390240.db2.gz KTPIHWGXXKYUJM-CALCHBBNSA-N 1 1 353.369 2.595 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769188036 737505230 /nfs/dbraw/zinc/50/52/30/737505230.db2.gz DZFQSYQWVRTCKK-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769188036 737505233 /nfs/dbraw/zinc/50/52/33/737505233.db2.gz DZFQSYQWVRTCKK-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCCn1cc[nH+]c1C ZINC000772033935 737778527 /nfs/dbraw/zinc/77/85/27/737778527.db2.gz AMTWLQRIMCFEJV-UHFFFAOYSA-N 1 1 365.411 2.695 20 5 FFBDMO CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000774739900 738020493 /nfs/dbraw/zinc/02/04/93/738020493.db2.gz QHKPJAUJXFQWBB-KRWDZBQOSA-N 1 1 366.893 2.849 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388932 738135592 /nfs/dbraw/zinc/13/55/92/738135592.db2.gz RZBIUCSXAJRUKU-TVFCKZIOSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388932 738135594 /nfs/dbraw/zinc/13/55/94/738135594.db2.gz RZBIUCSXAJRUKU-TVFCKZIOSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388932 738135597 /nfs/dbraw/zinc/13/55/97/738135597.db2.gz RZBIUCSXAJRUKU-TVFCKZIOSA-N 1 1 367.877 2.818 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)C1CCCCC1 ZINC000778243356 738366414 /nfs/dbraw/zinc/36/64/14/738366414.db2.gz KKHHRMPOBRLFPL-UHFFFAOYSA-N 1 1 363.443 2.594 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000930368683 739095237 /nfs/dbraw/zinc/09/52/37/739095237.db2.gz NMZLXUULBWWSMI-GFCCVEGCSA-N 1 1 351.834 2.781 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932024288 739375303 /nfs/dbraw/zinc/37/53/03/739375303.db2.gz IEMTYIBALDGTQC-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO Cn1cc([C@@H]2CSCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000933977133 739713434 /nfs/dbraw/zinc/71/34/34/739713434.db2.gz ZBLHOOCWULDPGF-DLBZAZTESA-N 1 1 362.455 2.542 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334722 739767417 /nfs/dbraw/zinc/76/74/17/739767417.db2.gz FSIZCLPIOXMAJD-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334722 739767421 /nfs/dbraw/zinc/76/74/21/739767421.db2.gz FSIZCLPIOXMAJD-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000934492831 739792345 /nfs/dbraw/zinc/79/23/45/739792345.db2.gz HJLHASWLGHLGHL-HNNXBMFYSA-N 1 1 366.215 2.750 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801554916 740630019 /nfs/dbraw/zinc/63/00/19/740630019.db2.gz AKASMGLHXUOPQK-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1C[N@@H+](C(C)C)CCO1 ZINC000802131523 740675580 /nfs/dbraw/zinc/67/55/80/740675580.db2.gz DUSFVDOOCAYODU-CQSZACIVSA-N 1 1 368.455 2.973 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1C[N@H+](C(C)C)CCO1 ZINC000802131523 740675584 /nfs/dbraw/zinc/67/55/84/740675584.db2.gz DUSFVDOOCAYODU-CQSZACIVSA-N 1 1 368.455 2.973 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000808353828 741218618 /nfs/dbraw/zinc/21/86/18/741218618.db2.gz GBHKAEWJUGJLQF-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000811445630 741521922 /nfs/dbraw/zinc/52/19/22/741521922.db2.gz UQKXXUUWZMGPEM-KRWDZBQOSA-N 1 1 352.362 2.533 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000811445630 741521925 /nfs/dbraw/zinc/52/19/25/741521925.db2.gz UQKXXUUWZMGPEM-KRWDZBQOSA-N 1 1 352.362 2.533 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000816835906 742064865 /nfs/dbraw/zinc/06/48/65/742064865.db2.gz XSTGPTPJQRMBDY-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2c(F)cc(F)cc2F)c1 ZINC000819332991 742375987 /nfs/dbraw/zinc/37/59/87/742375987.db2.gz DNCQXJMHIFCLNC-GFCCVEGCSA-N 1 1 356.300 2.542 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000822138806 742701887 /nfs/dbraw/zinc/70/18/87/742701887.db2.gz LKPCOTZBDRNDFP-LLVKDONJSA-N 1 1 371.235 2.963 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000822654791 742764542 /nfs/dbraw/zinc/76/45/42/742764542.db2.gz SHVBUPKHCPBIAG-LBPRGKRZSA-N 1 1 350.419 2.845 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC[C@H]21 ZINC000827300398 743551440 /nfs/dbraw/zinc/55/14/40/743551440.db2.gz MQXLNXZWLBHPBT-QMTHXVAHSA-N 1 1 368.231 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCN2CCOCC2)CC2CC2)cc1Cl ZINC000827518687 743593045 /nfs/dbraw/zinc/59/30/45/743593045.db2.gz CAIYUQWRKGHVAR-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)N[C@H](C)C[N@H+](C)C(C)C ZINC000832907966 745766114 /nfs/dbraw/zinc/76/61/14/745766114.db2.gz CWRGWLMWCYZMGB-SNVBAGLBSA-N 1 1 370.837 2.665 20 5 FFBDMO COc1cc(C(=O)OCCCCn2cc[nH+]c2C)c([N+](=O)[O-])cc1F ZINC000838053766 746566495 /nfs/dbraw/zinc/56/64/95/746566495.db2.gz JMKGNEWULBOIEY-UHFFFAOYSA-N 1 1 351.334 2.885 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cccc([N+](=O)[O-])c1Br)C1CC1 ZINC000839440038 746828511 /nfs/dbraw/zinc/82/85/11/746828511.db2.gz ZSRTWJCXNHSZIU-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839497599 746840424 /nfs/dbraw/zinc/84/04/24/746840424.db2.gz IRNPCAHHLASVSD-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839497599 746840432 /nfs/dbraw/zinc/84/04/32/746840432.db2.gz IRNPCAHHLASVSD-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO CCC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839584243 746863197 /nfs/dbraw/zinc/86/31/97/746863197.db2.gz RWTLVEKAWLIINE-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839584243 746863199 /nfs/dbraw/zinc/86/31/99/746863199.db2.gz RWTLVEKAWLIINE-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCCC[N@H+](C)CC(C)C)c1[N+](=O)[O-] ZINC000845582562 748286246 /nfs/dbraw/zinc/28/62/46/748286246.db2.gz IDDISYQSOAKDCJ-UHFFFAOYSA-N 1 1 354.407 2.694 20 5 FFBDMO Cc1noc(C[N@@H+](C)C2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000851796585 749679112 /nfs/dbraw/zinc/67/91/12/749679112.db2.gz HXYMFUAFQYVHNW-UHFFFAOYSA-N 1 1 354.407 2.723 20 5 FFBDMO Cc1noc(C[N@H+](C)C2CCN(C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000851796585 749679119 /nfs/dbraw/zinc/67/91/19/749679119.db2.gz HXYMFUAFQYVHNW-UHFFFAOYSA-N 1 1 354.407 2.723 20 5 FFBDMO CCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@@H+](CC)C1 ZINC000853848382 750181382 /nfs/dbraw/zinc/18/13/82/750181382.db2.gz XTTJUFCKDGOTRT-AWEZNQCLSA-N 1 1 354.838 2.874 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1F ZINC000855054891 750419040 /nfs/dbraw/zinc/41/90/40/750419040.db2.gz AOYPOZQOFDDIPU-VXGBXAGGSA-N 1 1 353.369 2.928 20 5 FFBDMO C[C@]1(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000312505810 971503017 /nfs/dbraw/zinc/50/30/17/971503017.db2.gz RIXGULDFJREROR-HXUWFJFHSA-N 1 1 368.437 2.819 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2c(sc(N)c2-c2nn[nH]n2)C1 ZINC001575516582 949210690 /nfs/dbraw/zinc/21/06/90/949210690.db2.gz PYUJVGFTLWZITL-VIFPVBQESA-N 1 1 371.426 2.538 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2c(sc(N)c2-c2nn[nH]n2)C1 ZINC001575516582 949210714 /nfs/dbraw/zinc/21/07/14/949210714.db2.gz PYUJVGFTLWZITL-VIFPVBQESA-N 1 1 371.426 2.538 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759892733 971907259 /nfs/dbraw/zinc/90/72/59/971907259.db2.gz BPRLFOSMYLOLFD-INIZCTEOSA-N 1 1 352.394 2.628 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134940094 960559666 /nfs/dbraw/zinc/55/96/66/960559666.db2.gz FTDYDGGAQKIUSB-MAUKXSAKSA-N 1 1 353.422 2.917 20 5 FFBDMO CC(C)n1ncc2cc(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)cnc21 ZINC001175322753 1013444874 /nfs/dbraw/zinc/44/48/74/1013444874.db2.gz FLTHAAQKFGZJRX-IBGZPJMESA-N 1 1 369.425 2.918 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2ccccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001270111726 964698859 /nfs/dbraw/zinc/69/88/59/964698859.db2.gz UOSJWVRCUDIKPJ-NVXWUHKLSA-N 1 1 365.861 2.724 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001211531646 965606247 /nfs/dbraw/zinc/60/62/47/965606247.db2.gz YZARDEOMEJUYMZ-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccnn1C ZINC001176517364 1013721022 /nfs/dbraw/zinc/72/10/22/1013721022.db2.gz VSXPZVIDYOWYIA-INIZCTEOSA-N 1 1 373.413 2.503 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c1[N+](=O)[O-] ZINC000895091330 967532229 /nfs/dbraw/zinc/53/22/29/967532229.db2.gz UTVJGXWZEJWALJ-IBGZPJMESA-N 1 1 358.394 2.575 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[N@H+]1C1CC1 ZINC000177132628 969061077 /nfs/dbraw/zinc/06/10/77/969061077.db2.gz DIXHNCBAMZVSOI-CABCVRRESA-N 1 1 372.469 2.940 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000874827008 1013910618 /nfs/dbraw/zinc/91/06/18/1013910618.db2.gz AGCGJLCENFUWCS-UXHICEINSA-N 1 1 361.445 2.990 20 5 FFBDMO Cc1cc(N2CCC[C@@H](OC(=O)c3ccc([N+](=O)[O-])cc3)C2)nc(C)[nH+]1 ZINC000066732261 970101185 /nfs/dbraw/zinc/10/11/85/970101185.db2.gz GAZBYUSFWSMTEJ-MRXNPFEDSA-N 1 1 356.382 2.827 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103458165 970401708 /nfs/dbraw/zinc/40/17/08/970401708.db2.gz OZJSAFVLCIHBAA-MRXNPFEDSA-N 1 1 371.441 2.654 20 5 FFBDMO CC[C@H](C(=O)[O-])[N@@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001603498505 973456772 /nfs/dbraw/zinc/45/67/72/973456772.db2.gz JEGSCXDIOUUGIZ-GOSISDBHSA-N 1 1 363.458 2.644 20 5 FFBDMO CCOC(=O)Cc1ccc(N(C)CCCn2cc[nH+]c2C)c([N+](=O)[O-])c1 ZINC000825858960 1014193614 /nfs/dbraw/zinc/19/36/14/1014193614.db2.gz NDTROATUPABZRB-UHFFFAOYSA-N 1 1 360.414 2.732 20 5 FFBDMO C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)CN1CCCC1 ZINC000842170500 976693040 /nfs/dbraw/zinc/69/30/40/976693040.db2.gz HJGUXNDHIGWOKY-UHFFFAOYSA-N 1 1 366.437 2.869 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)CN1CCCC1 ZINC000842170500 976693045 /nfs/dbraw/zinc/69/30/45/976693045.db2.gz HJGUXNDHIGWOKY-UHFFFAOYSA-N 1 1 366.437 2.869 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)cc1C ZINC000982278392 977375952 /nfs/dbraw/zinc/37/59/52/977375952.db2.gz ANUHMFDITDZVMM-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)cc1C ZINC000982278392 977375956 /nfs/dbraw/zinc/37/59/56/977375956.db2.gz ANUHMFDITDZVMM-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)cc1C ZINC000982278392 977375961 /nfs/dbraw/zinc/37/59/61/977375961.db2.gz ANUHMFDITDZVMM-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO C[C@]1(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CCN(Cc2ccccc2)C1 ZINC000877496419 1014600048 /nfs/dbraw/zinc/60/00/48/1014600048.db2.gz SGUCWOKIOXIVLM-AFMYVXGZSA-N 1 1 369.469 2.997 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC000908251008 981399818 /nfs/dbraw/zinc/39/98/18/981399818.db2.gz UALMZBBQAJDFGQ-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3cnc4n3CCOC4)o2)c1 ZINC000898269894 982663091 /nfs/dbraw/zinc/66/30/91/982663091.db2.gz CTLZAJNDBGHPQE-UHFFFAOYSA-N 1 1 354.366 2.871 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878259043 1014952859 /nfs/dbraw/zinc/95/28/59/1014952859.db2.gz XYNQIUFVOSGHPH-DZGCQCFKSA-N 1 1 359.430 2.807 20 5 FFBDMO C[N@H+](CCOCc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000151394011 984277218 /nfs/dbraw/zinc/27/72/18/984277218.db2.gz MQNVMJCCGDYUQH-UHFFFAOYSA-N 1 1 367.409 2.959 20 5 FFBDMO C[N@@H+](CCOCc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000151394011 984277224 /nfs/dbraw/zinc/27/72/24/984277224.db2.gz MQNVMJCCGDYUQH-UHFFFAOYSA-N 1 1 367.409 2.959 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)c1 ZINC000913684972 986838074 /nfs/dbraw/zinc/83/80/74/986838074.db2.gz VIAGDMRYYPZOGP-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1 ZINC000913684972 986838088 /nfs/dbraw/zinc/83/80/88/986838088.db2.gz VIAGDMRYYPZOGP-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000151753652 986843949 /nfs/dbraw/zinc/84/39/49/986843949.db2.gz QQENBAVBCRWJEO-OKILXGFUSA-N 1 1 367.421 2.662 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCN1C1CCOCC1 ZINC000451552140 987441145 /nfs/dbraw/zinc/44/11/45/987441145.db2.gz VSWOYOLTRWQJAF-LPHOPBHVSA-N 1 1 373.453 2.554 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243639 1015435313 /nfs/dbraw/zinc/43/53/13/1015435313.db2.gz KKXLPCJTLYYPIA-HKUYNNGSSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243639 1015435322 /nfs/dbraw/zinc/43/53/22/1015435322.db2.gz KKXLPCJTLYYPIA-HKUYNNGSSA-N 1 1 355.394 2.731 20 5 FFBDMO Cn1cc(N2CC[NH+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC2)cn1 ZINC000126082036 989069791 /nfs/dbraw/zinc/06/97/91/989069791.db2.gz XBSUDMOECUTFJH-UHFFFAOYSA-N 1 1 367.409 2.911 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153819422 989735595 /nfs/dbraw/zinc/73/55/95/989735595.db2.gz JPRPNCLNPBVWPI-OAHLLOKOSA-N 1 1 364.402 2.532 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153819422 989735599 /nfs/dbraw/zinc/73/55/99/989735599.db2.gz JPRPNCLNPBVWPI-OAHLLOKOSA-N 1 1 364.402 2.532 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154229743 990068366 /nfs/dbraw/zinc/06/83/66/990068366.db2.gz QYNKGWKWXNQMIG-UZLBHIALSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000154313007 990171509 /nfs/dbraw/zinc/17/15/09/990171509.db2.gz TUPNRGCUVIFZGM-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000154313007 990171515 /nfs/dbraw/zinc/17/15/15/990171515.db2.gz TUPNRGCUVIFZGM-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174847718 990247500 /nfs/dbraw/zinc/24/75/00/990247500.db2.gz ZJDQTTRAEGYMOV-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]C/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001484394820 991561254 /nfs/dbraw/zinc/56/12/54/991561254.db2.gz RMBSNHXPIBIREW-ILAPHIRHSA-N 1 1 371.481 2.877 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC001124711438 992675645 /nfs/dbraw/zinc/67/56/45/992675645.db2.gz NGWBRKULCGYZEH-KBPBESRZSA-N 1 1 363.458 2.829 20 5 FFBDMO Nc1ccc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1[N+](=O)[O-] ZINC000809994747 994660677 /nfs/dbraw/zinc/66/06/77/994660677.db2.gz FVWRZHVFOKOFKG-KRWDZBQOSA-N 1 1 357.410 2.847 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2COC(=O)NC2CC2)ccc1[N+](=O)[O-] ZINC000810036453 994683082 /nfs/dbraw/zinc/68/30/82/994683082.db2.gz GKRPRXDQGCRFAW-OAHLLOKOSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2COC(=O)NC2CC2)ccc1[N+](=O)[O-] ZINC000810036453 994683089 /nfs/dbraw/zinc/68/30/89/994683089.db2.gz GKRPRXDQGCRFAW-OAHLLOKOSA-N 1 1 363.414 2.847 20 5 FFBDMO C[N@H+](CCc1nnnn1-c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000747668292 994996980 /nfs/dbraw/zinc/99/69/80/994996980.db2.gz AUEXATLNUQPEJP-UHFFFAOYSA-N 1 1 372.816 2.898 20 5 FFBDMO C[N@@H+](CCc1nnnn1-c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000747668292 994996992 /nfs/dbraw/zinc/99/69/92/994996992.db2.gz AUEXATLNUQPEJP-UHFFFAOYSA-N 1 1 372.816 2.898 20 5 FFBDMO COc1cc([N+](=O)[O-])cnc1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001132747132 995102166 /nfs/dbraw/zinc/10/21/66/995102166.db2.gz AOYHJUPRKLVLSX-OAHLLOKOSA-N 1 1 370.409 2.849 20 5 FFBDMO C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@@H]1C[N@H+](C)CCO1 ZINC000880709491 1015951786 /nfs/dbraw/zinc/95/17/86/1015951786.db2.gz NVOBHUWRGXKXNA-WBMJQRKESA-N 1 1 364.446 2.733 20 5 FFBDMO C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@@H]1C[N@@H+](C)CCO1 ZINC000880709491 1015951795 /nfs/dbraw/zinc/95/17/95/1015951795.db2.gz NVOBHUWRGXKXNA-WBMJQRKESA-N 1 1 364.446 2.733 20 5 FFBDMO CC[C@H]1C[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173880 995633194 /nfs/dbraw/zinc/63/31/94/995633194.db2.gz LCKLJUSHWIALSG-SZMVWBNQSA-N 1 1 362.426 2.918 20 5 FFBDMO CC[C@H]1C[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173880 995633199 /nfs/dbraw/zinc/63/31/99/995633199.db2.gz LCKLJUSHWIALSG-SZMVWBNQSA-N 1 1 362.426 2.918 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000823972906 996770153 /nfs/dbraw/zinc/77/01/53/996770153.db2.gz BEFQSXRBSWAFPD-LRDDRELGSA-N 1 1 359.430 2.658 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000843904665 997504384 /nfs/dbraw/zinc/50/43/84/997504384.db2.gz ZHSCLGBNZXRBGK-OAHLLOKOSA-N 1 1 370.365 2.598 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000731864012 998310375 /nfs/dbraw/zinc/31/03/75/998310375.db2.gz LJDUMDRBASTIAN-UHFFFAOYSA-N 1 1 362.474 2.756 20 5 FFBDMO C[C@H]1CCCCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000734001237 999170529 /nfs/dbraw/zinc/17/05/29/999170529.db2.gz NYBCGDBOIHHITA-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC000741030449 999701307 /nfs/dbraw/zinc/70/13/07/999701307.db2.gz VZRACIWUZGHFFN-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741027669 999704840 /nfs/dbraw/zinc/70/48/40/999704840.db2.gz AXOJJNJOSTXYPI-UONOGXRCSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000744400123 999855194 /nfs/dbraw/zinc/85/51/94/999855194.db2.gz HUCPFUPIXZOJNC-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@@H]2C[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010287 1000015441 /nfs/dbraw/zinc/01/54/41/1000015441.db2.gz CFLZMLIHLKPAHY-FZKCQIBNSA-N 1 1 353.463 2.763 20 5 FFBDMO COc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169019016 1000017427 /nfs/dbraw/zinc/01/74/27/1000017427.db2.gz GBCSMECDRHFJBD-WRWLIDTKSA-N 1 1 373.453 2.569 20 5 FFBDMO Cc1cccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)c1 ZINC001169020011 1000017621 /nfs/dbraw/zinc/01/76/21/1000017621.db2.gz HMWCLFIDEQDHFD-SQGPQFPESA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1([NH+]2CCOCC2)CCCCC1 ZINC000804324682 1000048101 /nfs/dbraw/zinc/04/81/01/1000048101.db2.gz VNRSODPVJHNYPG-UHFFFAOYSA-N 1 1 364.402 2.950 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ccn(C)n1 ZINC001147351771 1000879233 /nfs/dbraw/zinc/87/92/33/1000879233.db2.gz BWAJORFLUGEXQV-UHFFFAOYSA-N 1 1 361.405 2.677 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000786787014 1001626890 /nfs/dbraw/zinc/62/68/90/1001626890.db2.gz JMYQMUCYPCWWCM-CQSZACIVSA-N 1 1 373.409 2.939 20 5 FFBDMO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493285 1002094541 /nfs/dbraw/zinc/09/45/41/1002094541.db2.gz GCXWMAJEWIYCAL-KUHUBIRLSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493285 1002094549 /nfs/dbraw/zinc/09/45/49/1002094549.db2.gz GCXWMAJEWIYCAL-KUHUBIRLSA-N 1 1 359.401 2.978 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])cc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001170333726 1003117797 /nfs/dbraw/zinc/11/77/97/1003117797.db2.gz UZHWREMFUDDAGT-OSYLJGHBSA-N 1 1 354.410 2.836 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352680 1003120971 /nfs/dbraw/zinc/12/09/71/1003120971.db2.gz QCYBNLMULHDCTR-KGLIPLIRSA-N 1 1 350.415 2.810 20 5 FFBDMO COC(=O)[C@H]1C[C@H]2C[C@@H](C1)[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170353110 1003121338 /nfs/dbraw/zinc/12/13/38/1003121338.db2.gz VXFZRYKWLWLLJO-SDADXPQNSA-N 1 1 362.426 2.808 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170354650 1003121727 /nfs/dbraw/zinc/12/17/27/1003121727.db2.gz NMDSRKDFAOHRGN-RHSMWYFYSA-N 1 1 363.458 2.866 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCC[N@@H+]2CC=CCC2)CC1 ZINC000794120239 1003569675 /nfs/dbraw/zinc/56/96/75/1003569675.db2.gz XXRBOXJQGGYEMY-UHFFFAOYSA-N 1 1 372.469 2.823 20 5 FFBDMO CC(=O)Nc1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000101543186 1004860819 /nfs/dbraw/zinc/86/08/19/1004860819.db2.gz ISWAJNVURRZRED-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCCCC1 ZINC001050244090 1016929144 /nfs/dbraw/zinc/92/91/44/1016929144.db2.gz KFLZQCHHERIBDO-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO C[N@@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCC1 ZINC001050244090 1016929157 /nfs/dbraw/zinc/92/91/57/1016929157.db2.gz KFLZQCHHERIBDO-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCC1 ZINC001050244090 1016929169 /nfs/dbraw/zinc/92/91/69/1016929169.db2.gz KFLZQCHHERIBDO-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC000776274117 1005341100 /nfs/dbraw/zinc/34/11/00/1005341100.db2.gz GEWYUKWEYJWUKB-HXUWFJFHSA-N 1 1 355.438 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCN(Cc3ccccc3)CC2)cc1 ZINC000776274117 1005341103 /nfs/dbraw/zinc/34/11/03/1005341103.db2.gz GEWYUKWEYJWUKB-HXUWFJFHSA-N 1 1 355.438 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCN(Cc3ccccc3)CC2)cc1 ZINC000776274117 1005341107 /nfs/dbraw/zinc/34/11/07/1005341107.db2.gz GEWYUKWEYJWUKB-HXUWFJFHSA-N 1 1 355.438 2.836 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001050325587 1016968604 /nfs/dbraw/zinc/96/86/04/1016968604.db2.gz IVPZVSUOOVCHDQ-BNEJOLLZSA-N 1 1 363.433 2.564 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCO1 ZINC000851035708 1005858081 /nfs/dbraw/zinc/85/80/81/1005858081.db2.gz WILNYIBUWIKHOO-JCGIZDLHSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCO1 ZINC000851035708 1005858082 /nfs/dbraw/zinc/85/80/82/1005858082.db2.gz WILNYIBUWIKHOO-JCGIZDLHSA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1nn(CCC(=O)OC[C@H]2CC[N@H+]2Cc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000851467546 1005889934 /nfs/dbraw/zinc/88/99/34/1005889934.db2.gz YLTVVWJLOAJQMX-QGZVFWFLSA-N 1 1 372.425 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4cccc(F)n4)CC3)nc2c1 ZINC000851936255 1005924407 /nfs/dbraw/zinc/92/44/07/1005924407.db2.gz YOKNRKJDCYTMHD-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000776594199 1006009082 /nfs/dbraw/zinc/00/90/82/1006009082.db2.gz YIVGBAOCERKHGZ-WOJBJXKFSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000776594199 1006009093 /nfs/dbraw/zinc/00/90/93/1006009093.db2.gz YIVGBAOCERKHGZ-WOJBJXKFSA-N 1 1 354.406 2.802 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776592684 1006010118 /nfs/dbraw/zinc/01/01/18/1006010118.db2.gz SFBRWOHOVBEPHH-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO CC(C)[C@H]1CN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001187361076 1006034584 /nfs/dbraw/zinc/03/45/84/1006034584.db2.gz DZXCJGLBZSNNCE-MRXNPFEDSA-N 1 1 359.386 2.828 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+](Cc3ccccc3C)CCO2)n1 ZINC001187362331 1006036631 /nfs/dbraw/zinc/03/66/31/1006036631.db2.gz VYDAVBZUFOXJGQ-QGZVFWFLSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](Cc3ccccc3C)CCO2)n1 ZINC001187362331 1006036645 /nfs/dbraw/zinc/03/66/45/1006036645.db2.gz VYDAVBZUFOXJGQ-QGZVFWFLSA-N 1 1 356.426 2.920 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]12 ZINC000852496929 1006055764 /nfs/dbraw/zinc/05/57/64/1006055764.db2.gz SKSKMGHBXRSDAI-MLHJIOFPSA-N 1 1 362.426 2.682 20 5 FFBDMO CC(C)(CCC(=O)Nc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1)[N+](=O)[O-] ZINC000882398114 1006385983 /nfs/dbraw/zinc/38/59/83/1006385983.db2.gz YUZHNMXECKNHQD-KRWDZBQOSA-N 1 1 360.458 2.745 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171106 1032168694 /nfs/dbraw/zinc/16/86/94/1032168694.db2.gz OLSJDBSXFDNCBQ-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171106 1032168700 /nfs/dbraw/zinc/16/87/00/1032168700.db2.gz OLSJDBSXFDNCBQ-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]3C3CCOCC3)n2)cc1 ZINC000776770291 1007062016 /nfs/dbraw/zinc/06/20/16/1007062016.db2.gz SBPVIEYFZACPMM-KRWDZBQOSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858018416 1008278913 /nfs/dbraw/zinc/27/89/13/1008278913.db2.gz ATQCHFHRHPOZJQ-KRWDZBQOSA-N 1 1 357.414 2.607 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(NC[C@@H]3CC[N@H+]3C3CCCCC3)cc2N1 ZINC000858683670 1008403896 /nfs/dbraw/zinc/40/38/96/1008403896.db2.gz VWZUXSZYULCOOQ-ZDUSSCGKSA-N 1 1 360.414 2.745 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC1 ZINC001136447634 1008464130 /nfs/dbraw/zinc/46/41/30/1008464130.db2.gz CFZNOSNMOUVGDG-UHFFFAOYSA-N 1 1 354.838 2.777 20 5 FFBDMO O=C(Nc1cccc(F)c1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886059800 1008527213 /nfs/dbraw/zinc/52/72/13/1008527213.db2.gz MABZZEKCFAZIJP-UHFFFAOYSA-N 1 1 358.373 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859590136 1008581435 /nfs/dbraw/zinc/58/14/35/1008581435.db2.gz XUGLCTGSKTTZRG-SFHVURJKSA-N 1 1 357.366 2.987 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859590136 1008581457 /nfs/dbraw/zinc/58/14/57/1008581457.db2.gz XUGLCTGSKTTZRG-SFHVURJKSA-N 1 1 357.366 2.987 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000859697695 1008624592 /nfs/dbraw/zinc/62/45/92/1008624592.db2.gz FVKYIYWGHFLSNO-KRWDZBQOSA-N 1 1 370.352 2.672 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000859697695 1008624597 /nfs/dbraw/zinc/62/45/97/1008624597.db2.gz FVKYIYWGHFLSNO-KRWDZBQOSA-N 1 1 370.352 2.672 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000859697696 1008625121 /nfs/dbraw/zinc/62/51/21/1008625121.db2.gz FVKYIYWGHFLSNO-QGZVFWFLSA-N 1 1 370.352 2.672 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000859697696 1008625129 /nfs/dbraw/zinc/62/51/29/1008625129.db2.gz FVKYIYWGHFLSNO-QGZVFWFLSA-N 1 1 370.352 2.672 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)CC2)[nH+]c1C ZINC001178042913 1008857378 /nfs/dbraw/zinc/85/73/78/1008857378.db2.gz NLFUPBVMEFPWAC-UHFFFAOYSA-N 1 1 368.397 2.831 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc2c(c1)CCC2)[C@@H]1CC1[N+](=O)[O-] ZINC001178458611 1008995623 /nfs/dbraw/zinc/99/56/23/1008995623.db2.gz OFYTTZXFJYPIQV-RTBURBONSA-N 1 1 359.470 2.607 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCCCC1CCOCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178463695 1008996511 /nfs/dbraw/zinc/99/65/11/1008996511.db2.gz ILLQOIGMBQTXGO-QZTJIDSGSA-N 1 1 369.506 2.515 20 5 FFBDMO Cc1ccc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1F ZINC001178463281 1008997619 /nfs/dbraw/zinc/99/76/19/1008997619.db2.gz CTXOZARDTSARGA-NVXWUHKLSA-N 1 1 351.422 2.566 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)C1CCCC1 ZINC001136716350 1009052976 /nfs/dbraw/zinc/05/29/76/1009052976.db2.gz WEVXIXFPQRZOJU-UHFFFAOYSA-N 1 1 358.801 2.574 20 5 FFBDMO CCc1ncc(CNC(=O)c2c(Br)cccc2[N+](=O)[O-])[nH]1 ZINC001178669606 1009074633 /nfs/dbraw/zinc/07/46/33/1009074633.db2.gz KQJSNBGTUFWVMJ-UHFFFAOYSA-N 1 1 353.176 2.573 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c1 ZINC000823481617 1009084930 /nfs/dbraw/zinc/08/49/30/1009084930.db2.gz KMJIAHZTLLHAGP-CEWLAPEOSA-N 1 1 367.449 2.835 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@](C)(O)c1ccccc1 ZINC000823584068 1009120555 /nfs/dbraw/zinc/12/05/55/1009120555.db2.gz BPMITYVBLMVXST-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@](C)(O)c1ccccc1 ZINC000823584068 1009120559 /nfs/dbraw/zinc/12/05/59/1009120559.db2.gz BPMITYVBLMVXST-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598300 1009134812 /nfs/dbraw/zinc/13/48/12/1009134812.db2.gz HNWUSXPUXNHABF-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598300 1009134819 /nfs/dbraw/zinc/13/48/19/1009134819.db2.gz HNWUSXPUXNHABF-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598933 1009136995 /nfs/dbraw/zinc/13/69/95/1009136995.db2.gz OMCAXWGHXOIAKU-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598933 1009137004 /nfs/dbraw/zinc/13/70/04/1009137004.db2.gz OMCAXWGHXOIAKU-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000823765504 1009218991 /nfs/dbraw/zinc/21/89/91/1009218991.db2.gz NPLPMJKXOCUFAC-AEFFLSMTSA-N 1 1 373.409 2.565 20 5 FFBDMO Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000126434629 1009229159 /nfs/dbraw/zinc/22/91/59/1009229159.db2.gz XQYUQPDFDBSYET-CZUORRHYSA-N 1 1 358.442 2.574 20 5 FFBDMO Nc1ccc(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000824008623 1009291454 /nfs/dbraw/zinc/29/14/54/1009291454.db2.gz RVEQCEHWIDXWPG-HNNXBMFYSA-N 1 1 355.398 2.573 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC(OC2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867953209 1011129894 /nfs/dbraw/zinc/12/98/94/1011129894.db2.gz PVLRYANWZUYHNG-LJQANCHMSA-N 1 1 361.442 2.719 20 5 FFBDMO C[C@H](C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000870087700 1012116273 /nfs/dbraw/zinc/11/62/73/1012116273.db2.gz UALLBCNGCRRYKR-KPZWWZAWSA-N 1 1 373.384 2.716 20 5 FFBDMO C[C@@H](C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870087303 1012116726 /nfs/dbraw/zinc/11/67/26/1012116726.db2.gz BYCRXBQKUHZVTG-ACJLOTCBSA-N 1 1 355.394 2.577 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]Cc3ncccc3O)CC2)c(F)c1 ZINC001173006963 1012175868 /nfs/dbraw/zinc/17/58/68/1012175868.db2.gz DQUJGZMJZWKXEF-UHFFFAOYSA-N 1 1 364.352 2.732 20 5 FFBDMO Cn1cc(C[N@@H+](C)C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)cn1 ZINC001173014073 1012183943 /nfs/dbraw/zinc/18/39/43/1012183943.db2.gz JSCCDBULAGMAOC-UHFFFAOYSA-N 1 1 365.384 2.707 20 5 FFBDMO CCN1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H]1C ZINC001173015663 1012186941 /nfs/dbraw/zinc/18/69/41/1012186941.db2.gz GESWTCATDQLBOD-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO CC[N@@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H]1C ZINC001173015663 1012186953 /nfs/dbraw/zinc/18/69/53/1012186953.db2.gz GESWTCATDQLBOD-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO CC[N@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H]1C ZINC001173015663 1012186964 /nfs/dbraw/zinc/18/69/64/1012186964.db2.gz GESWTCATDQLBOD-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2NC(=O)c3ccccc32)c1F ZINC001173184243 1012328086 /nfs/dbraw/zinc/32/80/86/1012328086.db2.gz PELISYKERYTOLS-DYZYQPBXSA-N 1 1 359.357 2.705 20 5 FFBDMO COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC12CC2 ZINC001173191623 1012331232 /nfs/dbraw/zinc/33/12/32/1012331232.db2.gz DVVJDUONKJPEBD-WCQYABFASA-N 1 1 366.389 2.559 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC12CC2 ZINC001173191624 1012332260 /nfs/dbraw/zinc/33/22/60/1012332260.db2.gz DVVJDUONKJPEBD-YPMHNXCESA-N 1 1 366.389 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c1F ZINC001173193633 1012335311 /nfs/dbraw/zinc/33/53/11/1012335311.db2.gz UUKXOQOHLAZBSF-QWHCGFSZSA-N 1 1 368.405 2.901 20 5 FFBDMO Cc1ccn(C[C@H](C)C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000870378179 1012341450 /nfs/dbraw/zinc/34/14/50/1012341450.db2.gz RWLKGMNIHYDFSO-KSSFIOAISA-N 1 1 372.425 2.554 20 5 FFBDMO Cc1ccn(C[C@H](C)C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000870378179 1012341465 /nfs/dbraw/zinc/34/14/65/1012341465.db2.gz RWLKGMNIHYDFSO-KSSFIOAISA-N 1 1 372.425 2.554 20 5 FFBDMO CCN(C)c1ncnc2c1CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173222383 1012355582 /nfs/dbraw/zinc/35/55/82/1012355582.db2.gz BDQOLHZKZKROFP-OAHLLOKOSA-N 1 1 369.469 2.873 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccccn2)CC1 ZINC001173228350 1012364114 /nfs/dbraw/zinc/36/41/14/1012364114.db2.gz VBZUNBVJCRLYIR-QGZVFWFLSA-N 1 1 354.454 2.781 20 5 FFBDMO CC[NH+](CC)CCCN1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173232899 1012364214 /nfs/dbraw/zinc/36/42/14/1012364214.db2.gz JCAOECYSCUZLOQ-SFHVURJKSA-N 1 1 362.518 2.875 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)c2ccc(O)cc2)CC1 ZINC001173231838 1012364721 /nfs/dbraw/zinc/36/47/21/1012364721.db2.gz NPBRBWMUYGNHHY-OAHLLOKOSA-N 1 1 369.421 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](C3OCCO3)C2)c(Br)c1 ZINC000718981031 1012536073 /nfs/dbraw/zinc/53/60/73/1012536073.db2.gz SAAQWHPHGHPQRN-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000748844526 1017703335 /nfs/dbraw/zinc/70/33/35/1017703335.db2.gz RNIXDWOWKWHWMM-ZDUSSCGKSA-N 1 1 364.402 2.580 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000801581071 1019140201 /nfs/dbraw/zinc/14/02/01/1019140201.db2.gz ZKDRURBHKUPHMW-HXUWFJFHSA-N 1 1 356.422 3.000 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000801903453 1019499600 /nfs/dbraw/zinc/49/96/00/1019499600.db2.gz DMPUIJSMTNWVKM-CQSZACIVSA-N 1 1 372.400 2.711 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)c(C)c1 ZINC001048525286 1020275692 /nfs/dbraw/zinc/27/56/92/1020275692.db2.gz SBBLZGXOGYNGHO-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c(C)c1 ZINC001048525286 1020275701 /nfs/dbraw/zinc/27/57/01/1020275701.db2.gz SBBLZGXOGYNGHO-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c(C)c1 ZINC001048525286 1020275707 /nfs/dbraw/zinc/27/57/07/1020275707.db2.gz SBBLZGXOGYNGHO-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO O=C(Nc1c[nH+]ccc1-n1cccn1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000777986669 1020412621 /nfs/dbraw/zinc/41/26/21/1020412621.db2.gz IUJGYRDDPFXTDE-UHFFFAOYSA-N 1 1 359.292 2.906 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1 ZINC000931433700 1020463637 /nfs/dbraw/zinc/46/36/37/1020463637.db2.gz FKXZWEJUYCRKSA-VHDGCEQUSA-N 1 1 357.414 2.589 20 5 FFBDMO CC(C)C[C@H]1CCC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726588441 1020489979 /nfs/dbraw/zinc/48/99/79/1020489979.db2.gz KDCZIDGHBMVRLS-CQSZACIVSA-N 1 1 360.414 2.831 20 5 FFBDMO COCCO[C@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000800850226 1020594538 /nfs/dbraw/zinc/59/45/38/1020594538.db2.gz NYKDFEHZKZZREE-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000800850226 1020594541 /nfs/dbraw/zinc/59/45/41/1020594541.db2.gz NYKDFEHZKZZREE-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000803119718 1020627821 /nfs/dbraw/zinc/62/78/21/1020627821.db2.gz DVNRRGJXZDKXLD-UHFFFAOYSA-N 1 1 364.421 2.724 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)COC(=O)N1 ZINC000932016180 1020667174 /nfs/dbraw/zinc/66/71/74/1020667174.db2.gz JJYNESCJPRKCDK-RDTXWAMCSA-N 1 1 363.414 2.574 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000933777476 1021089173 /nfs/dbraw/zinc/08/91/73/1021089173.db2.gz SLWPNXRJGAMXTR-SFHVURJKSA-N 1 1 361.442 2.837 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000934836652 1021421358 /nfs/dbraw/zinc/42/13/58/1021421358.db2.gz DVHAJHVNDJPWSD-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001116886167 1021471354 /nfs/dbraw/zinc/47/13/54/1021471354.db2.gz HGTDXTKQULVHSW-KGLIPLIRSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001116886167 1021471361 /nfs/dbraw/zinc/47/13/61/1021471361.db2.gz HGTDXTKQULVHSW-KGLIPLIRSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001116886165 1021471708 /nfs/dbraw/zinc/47/17/08/1021471708.db2.gz HGTDXTKQULVHSW-KBPBESRZSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001116886165 1021471713 /nfs/dbraw/zinc/47/17/13/1021471713.db2.gz HGTDXTKQULVHSW-KBPBESRZSA-N 1 1 358.398 2.881 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC4(CC[NH2+]CC4)C3)n2)c1 ZINC001118198122 1022112747 /nfs/dbraw/zinc/11/27/47/1022112747.db2.gz HMWBZCASSCNBQU-UHFFFAOYSA-N 1 1 357.414 2.610 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCCC4(CC[NH2+]CC4)C3)n2)c1 ZINC001118198122 1022112753 /nfs/dbraw/zinc/11/27/53/1022112753.db2.gz HMWBZCASSCNBQU-UHFFFAOYSA-N 1 1 357.414 2.610 20 5 FFBDMO CN1C[C@@H]2CC[C@H](CC1=O)[N@@H+]2Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC001119337102 1022698763 /nfs/dbraw/zinc/69/87/63/1022698763.db2.gz HLSQVKQDXZOFSQ-PWSUYJOCSA-N 1 1 362.411 2.525 20 5 FFBDMO CN1C[C@@H]2CC[C@H](CC1=O)[N@H+]2Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC001119337102 1022698767 /nfs/dbraw/zinc/69/87/67/1022698767.db2.gz HLSQVKQDXZOFSQ-PWSUYJOCSA-N 1 1 362.411 2.525 20 5 FFBDMO C/C(=C/C(=O)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000751690051 1022911618 /nfs/dbraw/zinc/91/16/18/1022911618.db2.gz YEDWAWLCUWRYNG-VDUFWMCCSA-N 1 1 373.453 2.711 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000075005596 1022988317 /nfs/dbraw/zinc/98/83/17/1022988317.db2.gz UCVSVSLHMPNIGH-CQSZACIVSA-N 1 1 365.430 2.915 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350129 1033111040 /nfs/dbraw/zinc/11/10/40/1033111040.db2.gz MKGGOCKOIWNFMA-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350129 1033111051 /nfs/dbraw/zinc/11/10/51/1033111051.db2.gz MKGGOCKOIWNFMA-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CCc2ccccc21 ZINC000829359099 1033118351 /nfs/dbraw/zinc/11/83/51/1033118351.db2.gz WPTZGXFVVCNVCU-FQEVSTJZSA-N 1 1 369.421 2.689 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001122957993 1023573896 /nfs/dbraw/zinc/57/38/96/1023573896.db2.gz LBOKDAYSAUWKOT-RHSMWYFYSA-N 1 1 372.425 2.554 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]CC/C=C/c1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001121087630 1023599097 /nfs/dbraw/zinc/59/90/97/1023599097.db2.gz QRMICJWJSRSQKB-WIIDURDBSA-N 1 1 369.465 2.772 20 5 FFBDMO CCC1(CC)CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000755930059 1023652371 /nfs/dbraw/zinc/65/23/71/1023652371.db2.gz GLPGKLCEDKKEPQ-SFHVURJKSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@H](c1nnc(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)n1C)[N+](=O)[O-] ZINC001121389506 1023744526 /nfs/dbraw/zinc/74/45/26/1023744526.db2.gz UBBJCOHAJMZBON-OAHLLOKOSA-N 1 1 372.473 2.501 20 5 FFBDMO C[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1ccnc1 ZINC000246635784 1026304031 /nfs/dbraw/zinc/30/40/31/1026304031.db2.gz OOZXQPLWAAWOJO-WMLDXEAASA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1ccnc1 ZINC000246635784 1026304043 /nfs/dbraw/zinc/30/40/43/1026304043.db2.gz OOZXQPLWAAWOJO-WMLDXEAASA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1C[C@@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000957131227 1027693652 /nfs/dbraw/zinc/69/36/52/1027693652.db2.gz CLBRRVMJZLLGMK-KGLIPLIRSA-N 1 1 359.430 2.551 20 5 FFBDMO COc1nc(N[C@H]2CC[N@H+](Cc3cccc(Cl)c3)C2)ncc1[N+](=O)[O-] ZINC001161181729 1028054317 /nfs/dbraw/zinc/05/43/17/1028054317.db2.gz FKVUCXOONGNGBP-ZDUSSCGKSA-N 1 1 363.805 2.733 20 5 FFBDMO COc1nc(N[C@H]2CC[N@@H+](Cc3cccc(Cl)c3)C2)ncc1[N+](=O)[O-] ZINC001161181729 1028054336 /nfs/dbraw/zinc/05/43/36/1028054336.db2.gz FKVUCXOONGNGBP-ZDUSSCGKSA-N 1 1 363.805 2.733 20 5 FFBDMO COc1cc2ncnc(NCC[C@H]3CC[NH2+]CC3(F)F)c2cc1[N+](=O)[O-] ZINC001162812520 1028666534 /nfs/dbraw/zinc/66/65/34/1028666534.db2.gz MEJDXZZSFDJFFM-SNVBAGLBSA-N 1 1 367.356 2.593 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N(C)[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC001156342150 1029157606 /nfs/dbraw/zinc/15/76/06/1029157606.db2.gz YXBPZAUIUWRLPA-KXBFYZLASA-N 1 1 370.453 2.883 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1F ZINC001164486910 1029295402 /nfs/dbraw/zinc/29/54/02/1029295402.db2.gz SLRVCGFQLLCNQW-HRCADAONSA-N 1 1 372.400 2.690 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cc(F)ccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490184 1029295578 /nfs/dbraw/zinc/29/55/78/1029295578.db2.gz BIOZSIIQDIFEAR-UKRRQHHQSA-N 1 1 369.824 2.520 20 5 FFBDMO O=C(NCCC1(C[NH2+]CC/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494880 1029297103 /nfs/dbraw/zinc/29/71/03/1029297103.db2.gz XDSAOYOCYDHSLZ-JKPUVNEQSA-N 1 1 357.454 2.631 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000781614246 1029306237 /nfs/dbraw/zinc/30/62/37/1029306237.db2.gz LEHZKXLQLLXJAT-UHFFFAOYSA-N 1 1 368.340 2.946 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC001165109355 1029397458 /nfs/dbraw/zinc/39/74/58/1029397458.db2.gz UOVUQINSPUKOBH-CYBMUJFWSA-N 1 1 354.838 2.723 20 5 FFBDMO Cc1ccc(-c2ccc(N3C[C@H]4CCC[N@H+](C)[C@H]4C3)nn2)cc1[N+](=O)[O-] ZINC001157269207 1029529992 /nfs/dbraw/zinc/52/99/92/1029529992.db2.gz ASLXSVVQUDUPGZ-QAPCUYQASA-N 1 1 353.426 2.891 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1O ZINC000782531058 1029733891 /nfs/dbraw/zinc/73/38/91/1029733891.db2.gz LGLXVEGCKHWEER-XJKSGUPXSA-N 1 1 367.421 2.791 20 5 FFBDMO Cc1[nH+]cc2n1CCN(c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-])C2 ZINC001165385964 1029963053 /nfs/dbraw/zinc/96/30/53/1029963053.db2.gz ZEISNCWBGGKATQ-UHFFFAOYSA-N 1 1 362.699 2.582 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)C1=O ZINC000842616759 1030828172 /nfs/dbraw/zinc/82/81/72/1030828172.db2.gz NIKPGBKIXBGMTO-AXHNFQJDSA-N 1 1 372.425 2.584 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](COC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000842835094 1030985338 /nfs/dbraw/zinc/98/53/38/1030985338.db2.gz DEFWBKVDNMDNCP-CQSZACIVSA-N 1 1 360.414 2.608 20 5 FFBDMO COCC[C@@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001204471216 1031303747 /nfs/dbraw/zinc/30/37/47/1031303747.db2.gz DXTHCYWFHMIQRM-HNNXBMFYSA-N 1 1 367.446 2.956 20 5 FFBDMO COCC[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001204471216 1031303766 /nfs/dbraw/zinc/30/37/66/1031303766.db2.gz DXTHCYWFHMIQRM-HNNXBMFYSA-N 1 1 367.446 2.956 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccccc2Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530638 1031787591 /nfs/dbraw/zinc/78/75/91/1031787591.db2.gz IRCMLEIKDBCCIM-GDBMZVCRSA-N 1 1 365.861 2.914 20 5 FFBDMO C[C@@H]1C[C@H]2CC[C@H](C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C[N@H+]2C1 ZINC001150828044 1031790309 /nfs/dbraw/zinc/79/03/09/1031790309.db2.gz WEGAMYCAMSUKQV-MBNYWOFBSA-N 1 1 351.834 2.985 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2CCCC[N@H+]2Cc2ccccc2)n1 ZINC000799632782 1031846518 /nfs/dbraw/zinc/84/65/18/1031846518.db2.gz PNIKHNCHYNPJRB-HNNXBMFYSA-N 1 1 358.398 2.540 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830183758 1033498267 /nfs/dbraw/zinc/49/82/67/1033498267.db2.gz XLWKJYSKOMIASN-BFHYXJOUSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830183758 1033498275 /nfs/dbraw/zinc/49/82/75/1033498275.db2.gz XLWKJYSKOMIASN-BFHYXJOUSA-N 1 1 367.450 2.510 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])cc1O[C@@H]1CC[N@H+]([C@H](C)c2ccccn2)C1 ZINC001225450447 1034258420 /nfs/dbraw/zinc/25/84/20/1034258420.db2.gz ICLIMGWLYDCTEU-UKRRQHHQSA-N 1 1 371.393 2.991 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3cccnc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001225633446 1034344448 /nfs/dbraw/zinc/34/44/48/1034344448.db2.gz RVQKYKVAAXMVJG-YXJHDRRASA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3cccnc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225633446 1034344458 /nfs/dbraw/zinc/34/44/58/1034344458.db2.gz RVQKYKVAAXMVJG-YXJHDRRASA-N 1 1 353.378 2.743 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3Cl)C[C@H]1[N@H+]2C ZINC001225788192 1034406643 /nfs/dbraw/zinc/40/66/43/1034406643.db2.gz KJFALQNLMSIGJX-MEDZGJRSSA-N 1 1 354.790 2.794 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001226131753 1034537945 /nfs/dbraw/zinc/53/79/45/1034537945.db2.gz QFEUIPPHCHGXOP-OAHLLOKOSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001226131753 1034537951 /nfs/dbraw/zinc/53/79/51/1034537951.db2.gz QFEUIPPHCHGXOP-OAHLLOKOSA-N 1 1 363.801 2.923 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000832659928 1034898711 /nfs/dbraw/zinc/89/87/11/1034898711.db2.gz NHLJGKJMYYVUJI-LJQANCHMSA-N 1 1 360.410 2.521 20 5 FFBDMO Cc1ccc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])n1 ZINC001227221518 1034973782 /nfs/dbraw/zinc/97/37/82/1034973782.db2.gz AYYFUHBBGUIHEK-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO CC(C)[NH+]1CC(Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227514918 1035592981 /nfs/dbraw/zinc/59/29/81/1035592981.db2.gz DXLMJMUEPCMLJV-UHFFFAOYSA-N 1 1 362.411 2.775 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000835396340 1035744736 /nfs/dbraw/zinc/74/47/36/1035744736.db2.gz MFGJSKNLEAEVKH-CABCVRRESA-N 1 1 356.382 2.564 20 5 FFBDMO C[C@@H](Oc1ccccn1)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456242 1035777615 /nfs/dbraw/zinc/77/76/15/1035777615.db2.gz AMDRAUJHQZLPAX-PBHICJAKSA-N 1 1 371.393 2.575 20 5 FFBDMO C[C@@H](Oc1ccccn1)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456242 1035777629 /nfs/dbraw/zinc/77/76/29/1035777629.db2.gz AMDRAUJHQZLPAX-PBHICJAKSA-N 1 1 371.393 2.575 20 5 FFBDMO O=c1[n-]c(C2CC2)nc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606284 1036200110 /nfs/dbraw/zinc/20/01/10/1036200110.db2.gz OHELFRXAJZBXRH-AWEZNQCLSA-N 1 1 356.382 2.621 20 5 FFBDMO O=c1[nH]c(C2CC2)nc(O[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606284 1036200130 /nfs/dbraw/zinc/20/01/30/1036200130.db2.gz OHELFRXAJZBXRH-AWEZNQCLSA-N 1 1 356.382 2.621 20 5 FFBDMO O=c1[nH]c(C2CC2)nc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606284 1036200140 /nfs/dbraw/zinc/20/01/40/1036200140.db2.gz OHELFRXAJZBXRH-AWEZNQCLSA-N 1 1 356.382 2.621 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001229380733 1036644115 /nfs/dbraw/zinc/64/41/15/1036644115.db2.gz NWJIJAHQSHHGKS-BCUIYNNISA-N 1 1 354.790 2.794 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc(C(=O)OC(C)(C)C)ccc2[N+](=O)[O-])C1 ZINC001233530117 1036671282 /nfs/dbraw/zinc/67/12/82/1036671282.db2.gz FVWWCYDYMOFCEM-CQSZACIVSA-N 1 1 366.414 2.650 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc(C(=O)OC(C)(C)C)cc2[N+](=O)[O-])C1 ZINC001234405983 1037021712 /nfs/dbraw/zinc/02/17/12/1037021712.db2.gz FIIZWYPCAVXTGF-CQSZACIVSA-N 1 1 366.414 2.650 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H]2CC[C@@H](SC)C2)cc1[N+](=O)[O-] ZINC001255648839 1038100250 /nfs/dbraw/zinc/10/02/50/1038100250.db2.gz KNKDZHRVQCSYPC-ZIAGYGMSSA-N 1 1 368.455 2.863 20 5 FFBDMO COc1cc(N2CCC([NH2+][C@H]3CCCN(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256087131 1038372787 /nfs/dbraw/zinc/37/27/87/1038372787.db2.gz PDVLIEMMWFSAQG-HNNXBMFYSA-N 1 1 362.474 2.646 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCC(=O)[C@@H](F)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093398 1038380218 /nfs/dbraw/zinc/38/02/18/1038380218.db2.gz KYNFJXNIECNRCI-HNNXBMFYSA-N 1 1 365.405 2.575 20 5 FFBDMO COc1cc(N2CCC([NH+]3CCN(CC4CC4)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256099833 1038384307 /nfs/dbraw/zinc/38/43/07/1038384307.db2.gz YDEJTHHPVLDRBY-UHFFFAOYSA-N 1 1 374.485 2.600 20 5 FFBDMO COc1cc(N2CCC(N3CCC([NH+]4CCC4)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256103817 1038388121 /nfs/dbraw/zinc/38/81/21/1038388121.db2.gz PGRROHVKOZMNAE-UHFFFAOYSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H](C)CC[C@H]3CN)CC2)ccc1[N+](=O)[O-] ZINC001246555916 1039396669 /nfs/dbraw/zinc/39/66/69/1039396669.db2.gz INGQHGQDNATJBQ-YOEHRIQHSA-N 1 1 362.474 2.631 20 5 FFBDMO COc1cc(N2CCC(N3C[C@@H](C)CC[C@H]3C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001246555916 1039396688 /nfs/dbraw/zinc/39/66/88/1039396688.db2.gz INGQHGQDNATJBQ-YOEHRIQHSA-N 1 1 362.474 2.631 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480399 1040748344 /nfs/dbraw/zinc/74/83/44/1040748344.db2.gz FOMNERXSVRBTRY-HNNXBMFYSA-N 1 1 361.442 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](Oc4cnccn4)C3)CC2)cc1 ZINC001254482069 1040749905 /nfs/dbraw/zinc/74/99/05/1040749905.db2.gz HQOUESHRHCIKGQ-SFHVURJKSA-N 1 1 369.425 2.507 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(NC(=O)C(F)(F)F)CC1 ZINC001254560265 1040797381 /nfs/dbraw/zinc/79/73/81/1040797381.db2.gz QUFGMNLUFVKXGO-NSHDSACASA-N 1 1 359.348 2.669 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cnn(C)c21 ZINC001254560675 1040797535 /nfs/dbraw/zinc/79/75/35/1040797535.db2.gz HAQHAFPOKAPWLS-YOEHRIQHSA-N 1 1 358.442 2.895 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254562213 1040798741 /nfs/dbraw/zinc/79/87/41/1040798741.db2.gz PKEIBMREPOFLGQ-WMLDXEAASA-N 1 1 358.442 2.988 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cnn(CC)c21 ZINC001254594262 1040821934 /nfs/dbraw/zinc/82/19/34/1040821934.db2.gz CQTRVZGFUAQVAC-MJGOQNOKSA-N 1 1 370.453 2.914 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]1Cc1cnn(C)c1 ZINC001254596952 1040827699 /nfs/dbraw/zinc/82/76/99/1040827699.db2.gz SWCQFRRVLKMEHO-UFYCRDLUSA-N 1 1 370.453 2.518 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1c1ccccc1 ZINC001254605361 1040835170 /nfs/dbraw/zinc/83/51/70/1040835170.db2.gz BMOMYFNJIKNFGO-HSALFYBXSA-N 1 1 366.417 2.951 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001538376447 1070421685 /nfs/dbraw/zinc/42/16/85/1070421685.db2.gz KXZYGBRTFCIRFD-OAHLLOKOSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001538376447 1070421688 /nfs/dbraw/zinc/42/16/88/1070421688.db2.gz KXZYGBRTFCIRFD-OAHLLOKOSA-N 1 1 354.410 2.645 20 5 FFBDMO CCOc1cc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC001309999360 1043621725 /nfs/dbraw/zinc/62/17/25/1043621725.db2.gz BIEXEXYXHKCTRY-NWDGAFQWSA-N 1 1 366.418 2.606 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001310265026 1043659832 /nfs/dbraw/zinc/65/98/32/1043659832.db2.gz ZXARSYAFBUZUIB-OCCSQVGLSA-N 1 1 370.862 2.950 20 5 FFBDMO O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001318960255 1044959719 /nfs/dbraw/zinc/95/97/19/1044959719.db2.gz VHHDLWHWGZZLJN-GFCCVEGCSA-N 1 1 368.231 2.668 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2C(=O)OCCn2cc([N+](=O)[O-])cn2)c1 ZINC001319351904 1045120074 /nfs/dbraw/zinc/12/00/74/1045120074.db2.gz VPZCNQNDJOEZHZ-GOSISDBHSA-N 1 1 372.425 2.698 20 5 FFBDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2C(=O)OCCn2cc([N+](=O)[O-])cn2)c1 ZINC001319351904 1045120079 /nfs/dbraw/zinc/12/00/79/1045120079.db2.gz VPZCNQNDJOEZHZ-GOSISDBHSA-N 1 1 372.425 2.698 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001319704736 1045245364 /nfs/dbraw/zinc/24/53/64/1045245364.db2.gz QSRBXEHWMYAWFQ-UKRRQHHQSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001319704736 1045245377 /nfs/dbraw/zinc/24/53/77/1045245377.db2.gz QSRBXEHWMYAWFQ-UKRRQHHQSA-N 1 1 358.398 2.881 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001282295092 1045483606 /nfs/dbraw/zinc/48/36/06/1045483606.db2.gz NUGHNEQYWUXVKZ-QZTJIDSGSA-N 1 1 359.470 2.803 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001741 1046303651 /nfs/dbraw/zinc/30/36/51/1046303651.db2.gz AGISPAYCDKQONJ-AEFFLSMTSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001741 1046303666 /nfs/dbraw/zinc/30/36/66/1046303666.db2.gz AGISPAYCDKQONJ-AEFFLSMTSA-N 1 1 372.400 2.951 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001328689378 1048421136 /nfs/dbraw/zinc/42/11/36/1048421136.db2.gz PYIDAZVQZKSJFK-NSHDSACASA-N 1 1 365.821 2.714 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001329555896 1048774659 /nfs/dbraw/zinc/77/46/59/1048774659.db2.gz MTCQIGIGIBTMBF-QGZVFWFLSA-N 1 1 354.410 2.944 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc3c(c2)CCC3)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001329818654 1048925193 /nfs/dbraw/zinc/92/51/93/1048925193.db2.gz NMGHGMORBWZKGA-RTBURBONSA-N 1 1 371.481 2.749 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccccc2C)C1 ZINC001330272460 1049113122 /nfs/dbraw/zinc/11/31/22/1049113122.db2.gz AGWSLRSVPHAMTE-SFHVURJKSA-N 1 1 354.410 2.732 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)cc1Cl ZINC001297271771 1050136715 /nfs/dbraw/zinc/13/67/15/1050136715.db2.gz KVSGVPYQCDVQMS-UHFFFAOYSA-N 1 1 358.185 2.939 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C)[nH+]1 ZINC001303890824 1051467180 /nfs/dbraw/zinc/46/71/80/1051467180.db2.gz HLTAXHUTGCRGRE-UHFFFAOYSA-N 1 1 372.303 2.806 20 5 FFBDMO C[C@@H](CNC(=O)[C@H]1[NH2+]CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC001341429232 1051784487 /nfs/dbraw/zinc/78/44/87/1051784487.db2.gz QNTOVKUUYDZQKH-UGSOOPFHSA-N 1 1 355.394 2.538 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)C)n2)C1 ZINC001306919208 1052221015 /nfs/dbraw/zinc/22/10/15/1052221015.db2.gz ZONFNBSYEDQTAF-CQSZACIVSA-N 1 1 352.435 2.546 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@@H+](Cc2ccccc2)[C@H](C(C)C)C1 ZINC001307930981 1052368451 /nfs/dbraw/zinc/36/84/51/1052368451.db2.gz NBGFQPRUQSJEMP-IBGZPJMESA-N 1 1 371.485 2.942 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC001308067295 1052398406 /nfs/dbraw/zinc/39/84/06/1052398406.db2.gz AOWLJYGAVQQNRH-MBNYWOFBSA-N 1 1 366.849 2.744 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001308152611 1052418273 /nfs/dbraw/zinc/41/82/73/1052418273.db2.gz GHSSKWBBLFJQMN-CYBMUJFWSA-N 1 1 358.398 2.986 20 5 FFBDMO O=C(CC[NH2+][C@H](CO)c1cc(F)ccc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC001308158692 1052420573 /nfs/dbraw/zinc/42/05/73/1052420573.db2.gz RHYVARLDPTXIFT-MRXNPFEDSA-N 1 1 365.336 2.525 20 5 FFBDMO CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001347610070 1054153146 /nfs/dbraw/zinc/15/31/46/1054153146.db2.gz BHIVUDHBCUJJDH-AWEZNQCLSA-N 1 1 352.483 2.582 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)c1ccco1 ZINC001350753296 1055923478 /nfs/dbraw/zinc/92/34/78/1055923478.db2.gz KBJLWZSLPXFNER-OAHLLOKOSA-N 1 1 368.393 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3C[N@H+]4CCC[C@H]4CO3)o2)cc1 ZINC001200267440 1056189399 /nfs/dbraw/zinc/18/93/99/1056189399.db2.gz FYBIJGJDIHRLNH-WMZOPIPTSA-N 1 1 357.410 2.808 20 5 FFBDMO Cc1ccnc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000609669339 1056422008 /nfs/dbraw/zinc/42/20/08/1056422008.db2.gz MDONLOYLYKEBDW-UHFFFAOYSA-N 1 1 369.469 2.918 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC1 ZINC001444850737 1058340512 /nfs/dbraw/zinc/34/05/12/1058340512.db2.gz VOJUFZLZPQXPIJ-HNNXBMFYSA-N 1 1 357.414 2.535 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 ZINC001444850737 1058340528 /nfs/dbraw/zinc/34/05/28/1058340528.db2.gz VOJUFZLZPQXPIJ-HNNXBMFYSA-N 1 1 357.414 2.535 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C[NH+]2CCCC2)on1 ZINC001450711257 1059045616 /nfs/dbraw/zinc/04/56/16/1059045616.db2.gz JBLASSFIZITFHB-UHFFFAOYSA-N 1 1 360.370 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1 ZINC001456222377 1060055250 /nfs/dbraw/zinc/05/52/50/1060055250.db2.gz REPLSXUBWRSALB-INIZCTEOSA-N 1 1 363.458 2.861 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481052 1060111771 /nfs/dbraw/zinc/11/17/71/1060111771.db2.gz VQNAJGRWCPLDFI-VQIMIIECSA-N 1 1 374.485 2.532 20 5 FFBDMO CO[C@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488116 1060135904 /nfs/dbraw/zinc/13/59/04/1060135904.db2.gz GIRWRFGDTGPHFP-SJORKVTESA-N 1 1 361.442 2.615 20 5 FFBDMO CO[C@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488116 1060135906 /nfs/dbraw/zinc/13/59/06/1060135906.db2.gz GIRWRFGDTGPHFP-SJORKVTESA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1O[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1C1CC1 ZINC000848576624 1060304531 /nfs/dbraw/zinc/30/45/31/1060304531.db2.gz ACMVPBLDLISQFQ-HNNXBMFYSA-N 1 1 374.422 2.791 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)Nc2cc(C)[nH+]c(C)c2)c1 ZINC001521112757 1060402289 /nfs/dbraw/zinc/40/22/89/1060402289.db2.gz QXENIEBFODDKLD-UHFFFAOYSA-N 1 1 365.393 2.834 20 5 FFBDMO Cc1nnc(N(C)CCc2ccccc2[N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1C ZINC001511792688 1060413776 /nfs/dbraw/zinc/41/37/76/1060413776.db2.gz DOXGNTPHNCAQFC-OAHLLOKOSA-N 1 1 372.473 2.658 20 5 FFBDMO COCC[N@@H+](C)CCCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001458100718 1060514285 /nfs/dbraw/zinc/51/42/85/1060514285.db2.gz KYRRWQAGEQFSRM-UHFFFAOYSA-N 1 1 352.822 2.599 20 5 FFBDMO CCN(CC)C(=O)C[NH+]1CCC(Nc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001458455385 1060595082 /nfs/dbraw/zinc/59/50/82/1060595082.db2.gz QIWJQOUJLFODEI-UHFFFAOYSA-N 1 1 370.400 2.618 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCc3nc[nH]c3C23CCC3)cccc1[N+](=O)[O-] ZINC001460717541 1061074449 /nfs/dbraw/zinc/07/44/49/1061074449.db2.gz OGBJWKOGNYCOJR-UHFFFAOYSA-N 1 1 369.425 2.892 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3nc[nH]c3C23CCC3)cccc1[N+](=O)[O-] ZINC001460717541 1061074463 /nfs/dbraw/zinc/07/44/63/1061074463.db2.gz OGBJWKOGNYCOJR-UHFFFAOYSA-N 1 1 369.425 2.892 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001462123345 1061509244 /nfs/dbraw/zinc/50/92/44/1061509244.db2.gz OFZXLWWROVHHNW-WMLDXEAASA-N 1 1 368.437 2.796 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNc3cccc(C[N@@H+]4CC[C@H](O)C4)c3)nc2c1 ZINC001462277370 1061566275 /nfs/dbraw/zinc/56/62/75/1061566275.db2.gz VIWNOMWYHGQMJX-INIZCTEOSA-N 1 1 368.393 2.915 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001438843565 1063052911 /nfs/dbraw/zinc/05/29/11/1063052911.db2.gz RULPCWZTZGOARV-GFCCVEGCSA-N 1 1 374.363 2.626 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@@H]1C ZINC001466104119 1063327486 /nfs/dbraw/zinc/32/74/86/1063327486.db2.gz VAGHXYMPEHMTSO-AWEZNQCLSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@@H]1C ZINC001466104119 1063327504 /nfs/dbraw/zinc/32/75/04/1063327504.db2.gz VAGHXYMPEHMTSO-AWEZNQCLSA-N 1 1 354.410 2.823 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001470781683 1064448338 /nfs/dbraw/zinc/44/83/38/1064448338.db2.gz XYPKRKSYSRHBEO-IFXJQAMLSA-N 1 1 368.437 2.817 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001472648879 1065120472 /nfs/dbraw/zinc/12/04/72/1065120472.db2.gz OGOBGBXGQMATJX-AWEZNQCLSA-N 1 1 360.389 2.583 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H]1CN(c2ccccc2)C(=O)O1 ZINC001473767929 1065353413 /nfs/dbraw/zinc/35/34/13/1065353413.db2.gz PWJYBKWMINKABT-MRXNPFEDSA-N 1 1 371.393 2.931 20 5 FFBDMO C[N@@H+](CCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])Cc1ccccc1 ZINC001579128121 1078572234 /nfs/dbraw/zinc/57/22/34/1078572234.db2.gz MBGPLVJHIMSPQC-UHFFFAOYSA-N 1 1 373.442 2.770 20 5 FFBDMO COc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC001579300634 1078613603 /nfs/dbraw/zinc/61/36/03/1078613603.db2.gz BEJMEKIYGAWMEE-QGZVFWFLSA-N 1 1 352.350 2.790 20 5 FFBDMO COc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC001579300633 1078613305 /nfs/dbraw/zinc/61/33/05/1078613305.db2.gz BEJMEKIYGAWMEE-KRWDZBQOSA-N 1 1 352.350 2.790 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)ccc1Cl ZINC001556388404 1075735982 /nfs/dbraw/zinc/73/59/82/1075735982.db2.gz DVNUFPLOTUTESC-UHFFFAOYSA-N 1 1 358.185 2.939 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC001557740130 1075882930 /nfs/dbraw/zinc/88/29/30/1075882930.db2.gz DIGIGJPETBVUMM-XWIAVFTESA-N 1 1 363.483 2.876 20 5 FFBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559751938 1076187969 /nfs/dbraw/zinc/18/79/69/1076187969.db2.gz OVYXPFHFHOPEAB-VQIMIIECSA-N 1 1 374.485 2.754 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090372 1076224869 /nfs/dbraw/zinc/22/48/69/1076224869.db2.gz RJRGRXNMCQNGHW-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090372 1076224873 /nfs/dbraw/zinc/22/48/73/1076224873.db2.gz RJRGRXNMCQNGHW-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO COc1cc(CNC[C@@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC001561035643 1076323320 /nfs/dbraw/zinc/32/33/20/1076323320.db2.gz DVHRPQVRBPJOHG-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO COc1cc(CNC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC001561035643 1076323325 /nfs/dbraw/zinc/32/33/25/1076323325.db2.gz DVHRPQVRBPJOHG-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001586353334 1079608680 /nfs/dbraw/zinc/60/86/80/1079608680.db2.gz FEWGCADQAJBMNC-OAHLLOKOSA-N 1 1 361.785 2.741 20 5 FFBDMO C[C@@H](Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978296 1080917753 /nfs/dbraw/zinc/91/77/53/1080917753.db2.gz MCVLCTFSSBJPEB-TZMCWYRMSA-N 1 1 371.445 2.840 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000022474521 206335506 /nfs/dbraw/zinc/33/55/06/206335506.db2.gz CUCQXUZRMGOXFM-STQMWFEESA-N 1 1 350.419 2.604 20 5 FFBDMO CN(C)C(=O)C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089882825 249870803 /nfs/dbraw/zinc/87/08/03/249870803.db2.gz WLSISXABPRQMMS-UHFFFAOYSA-N 1 1 358.398 2.550 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](CCO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000103140590 250136315 /nfs/dbraw/zinc/13/63/15/250136315.db2.gz KVERNGQLGSVZED-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153334909 251125757 /nfs/dbraw/zinc/12/57/57/251125757.db2.gz MUWAPVRAXUHACS-DOTOQJQBSA-N 1 1 373.453 2.839 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398028 251346098 /nfs/dbraw/zinc/34/60/98/251346098.db2.gz FHHSJYSHPAQTLG-KBPBESRZSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398028 251346104 /nfs/dbraw/zinc/34/61/04/251346104.db2.gz FHHSJYSHPAQTLG-KBPBESRZSA-N 1 1 357.414 2.833 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CO)c2ccc(Cl)cc2)c2c(c1)COCO2 ZINC000271443129 251794468 /nfs/dbraw/zinc/79/44/68/251794468.db2.gz CVXPJBHYWKLVCE-INIZCTEOSA-N 1 1 364.785 2.938 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000366649104 512122360 /nfs/dbraw/zinc/12/23/60/512122360.db2.gz CGNREDMQFOLABG-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272401421 252029526 /nfs/dbraw/zinc/02/95/26/252029526.db2.gz VHRQUNXBDCUDPU-ZDUSSCGKSA-N 1 1 355.385 2.877 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272551353 252065801 /nfs/dbraw/zinc/06/58/01/252065801.db2.gz RIVYAZDWBLASMF-MSOLQXFVSA-N 1 1 358.442 2.949 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272584331 252074561 /nfs/dbraw/zinc/07/45/61/252074561.db2.gz YRAWSUXZBQFIFI-MSOLQXFVSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1ccc(OCC[NH+]2CCC(c3cc(C)[nH]n3)CC2)c([N+](=O)[O-])c1 ZINC000272935276 252169235 /nfs/dbraw/zinc/16/92/35/252169235.db2.gz KNAQHXVUQADOMT-UHFFFAOYSA-N 1 1 360.414 2.893 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCC[C@H](C)C1 ZINC000276125747 256074329 /nfs/dbraw/zinc/07/43/29/256074329.db2.gz ZQFDCJFJUMTMNU-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCC[C@H](C)C1 ZINC000276125747 256074330 /nfs/dbraw/zinc/07/43/30/256074330.db2.gz ZQFDCJFJUMTMNU-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000277154380 256166472 /nfs/dbraw/zinc/16/64/72/256166472.db2.gz CTQAXQZVHGSMPR-OAHLLOKOSA-N 1 1 359.382 2.763 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCCCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000278871300 256356369 /nfs/dbraw/zinc/35/63/69/256356369.db2.gz MFEGKHKGTGGABO-UHFFFAOYSA-N 1 1 362.373 2.842 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccncc2OC[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000288499176 257196983 /nfs/dbraw/zinc/19/69/83/257196983.db2.gz RTTCMHFDWLZOGP-HNNXBMFYSA-N 1 1 373.409 2.704 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000289944436 257307788 /nfs/dbraw/zinc/30/77/88/257307788.db2.gz VQNGXYQNMCMPRL-CABCVRRESA-N 1 1 352.431 2.614 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC[C@H](CNC(=O)C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000291002281 257372198 /nfs/dbraw/zinc/37/21/98/257372198.db2.gz AXTSXOWPYCYTLZ-CYBMUJFWSA-N 1 1 359.348 2.794 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)CC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000295133495 257617871 /nfs/dbraw/zinc/61/78/71/257617871.db2.gz KBKZKCATMYKDAD-UHFFFAOYSA-N 1 1 358.398 2.686 20 5 FFBDMO C[C@H](CNc1ccc(Br)cc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000301387171 258047013 /nfs/dbraw/zinc/04/70/13/258047013.db2.gz WKXRNNAWZXNLQH-LLVKDONJSA-N 1 1 358.236 2.738 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H](Cc3[nH+]ccn3C)C2)c1 ZINC000302215303 258095758 /nfs/dbraw/zinc/09/57/58/258095758.db2.gz ZXSGSHCDUOKBLV-CYBMUJFWSA-N 1 1 358.398 2.574 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc3ncc([N+](=O)[O-])n3n2)cc1F ZINC000301830950 258070075 /nfs/dbraw/zinc/07/00/75/258070075.db2.gz HXVVIIBJSZEPJO-UHFFFAOYSA-N 1 1 367.344 2.883 20 5 FFBDMO CC[C@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O ZINC000302022636 258082745 /nfs/dbraw/zinc/08/27/45/258082745.db2.gz ORBSVYMQNHZYLG-CABCVRRESA-N 1 1 358.442 2.733 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000332264131 258222290 /nfs/dbraw/zinc/22/22/90/258222290.db2.gz ODOMQPFAVLOSNW-UONOGXRCSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000366653808 512124977 /nfs/dbraw/zinc/12/49/77/512124977.db2.gz NSQFDURTQVRRIK-JHJVBQTASA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000366653808 512124980 /nfs/dbraw/zinc/12/49/80/512124980.db2.gz NSQFDURTQVRRIK-JHJVBQTASA-N 1 1 367.833 2.934 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000373058578 512152071 /nfs/dbraw/zinc/15/20/71/512152071.db2.gz NZNWMSKUJOOSFB-OAHLLOKOSA-N 1 1 371.441 2.851 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCCOc2ccc(F)cc2)CC1 ZINC000003775120 506350058 /nfs/dbraw/zinc/35/00/58/506350058.db2.gz RFYCULFHBOWXOX-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCCC[C@@H]1C ZINC000065733064 506353498 /nfs/dbraw/zinc/35/34/98/506353498.db2.gz LCVDQMPWFRYJEE-LSDHHAIUSA-N 1 1 358.442 2.929 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000377434649 512267393 /nfs/dbraw/zinc/26/73/93/512267393.db2.gz YETDDZSTTMEAGS-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)CNc2ccccc2[N+](=O)[O-])c1 ZINC000065881109 506385251 /nfs/dbraw/zinc/38/52/51/506385251.db2.gz WCXKPOUHKQPLJD-UHFFFAOYSA-N 1 1 356.426 2.775 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@@H](C)O1 ZINC000041865252 506560919 /nfs/dbraw/zinc/56/09/19/506560919.db2.gz KEEMMTXRWUEQJR-CHWSQXEVSA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000055407754 506745133 /nfs/dbraw/zinc/74/51/33/506745133.db2.gz QWLLNOZHKWMIGO-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000367019999 512300062 /nfs/dbraw/zinc/30/00/62/512300062.db2.gz KURRFUNJGPHZHA-HIFRSBDPSA-N 1 1 357.414 2.616 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000014340147 506986826 /nfs/dbraw/zinc/98/68/26/506986826.db2.gz XKOROVXRGNTPIJ-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000014340147 506986830 /nfs/dbraw/zinc/98/68/30/506986830.db2.gz XKOROVXRGNTPIJ-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000047624129 507366512 /nfs/dbraw/zinc/36/65/12/507366512.db2.gz YEPXQZXYYCUYDZ-SFHVURJKSA-N 1 1 369.421 2.879 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000047624129 507366517 /nfs/dbraw/zinc/36/65/17/507366517.db2.gz YEPXQZXYYCUYDZ-SFHVURJKSA-N 1 1 369.421 2.879 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051051071 507728378 /nfs/dbraw/zinc/72/83/78/507728378.db2.gz YRLXKXFDNLTPGN-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])c(N)n2)C1 ZINC000071954876 507728654 /nfs/dbraw/zinc/72/86/54/507728654.db2.gz OAFIFUJXPITLBL-CYBMUJFWSA-N 1 1 356.430 2.811 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(CC[NH+](C)C)c1ccccc1 ZINC000072054819 507740764 /nfs/dbraw/zinc/74/07/64/507740764.db2.gz CVYPZFUNQZBFGC-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000052241593 507804004 /nfs/dbraw/zinc/80/40/04/507804004.db2.gz DMNBPCGSYTUOTD-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000078146617 507839661 /nfs/dbraw/zinc/83/96/61/507839661.db2.gz FKXCPKKHNPNBKS-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000078146617 507839664 /nfs/dbraw/zinc/83/96/64/507839664.db2.gz FKXCPKKHNPNBKS-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000078146618 507839815 /nfs/dbraw/zinc/83/98/15/507839815.db2.gz FKXCPKKHNPNBKS-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000078146618 507839817 /nfs/dbraw/zinc/83/98/17/507839817.db2.gz FKXCPKKHNPNBKS-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1S(C)(=O)=O ZINC000089512708 507844245 /nfs/dbraw/zinc/84/42/45/507844245.db2.gz NOAGUJXZVOUGRB-LBPRGKRZSA-N 1 1 364.423 2.858 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000089644371 507853610 /nfs/dbraw/zinc/85/36/10/507853610.db2.gz MOLBNUYVIDEWEC-HIFRSBDPSA-N 1 1 362.817 2.691 20 5 FFBDMO CCCO[C@H]1CCC[N@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000108398571 507892615 /nfs/dbraw/zinc/89/26/15/507892615.db2.gz HKHJLUZDCLDBRN-AWEZNQCLSA-N 1 1 365.430 2.823 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000108398571 507892620 /nfs/dbraw/zinc/89/26/20/507892620.db2.gz HKHJLUZDCLDBRN-AWEZNQCLSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000078828822 507912142 /nfs/dbraw/zinc/91/21/42/507912142.db2.gz FLOISUOEZKIKOB-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000078828822 507912143 /nfs/dbraw/zinc/91/21/43/507912143.db2.gz FLOISUOEZKIKOB-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO Cc1c(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000073305681 507912570 /nfs/dbraw/zinc/91/25/70/507912570.db2.gz FIONIYSWHBAGLA-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)c1 ZINC000079832571 508004853 /nfs/dbraw/zinc/00/48/53/508004853.db2.gz HXPUKIQADQUGHM-UHFFFAOYSA-N 1 1 355.394 2.688 20 5 FFBDMO O=C1NC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000091864622 508020294 /nfs/dbraw/zinc/02/02/94/508020294.db2.gz BKEHHVQEKWCKPF-GFCCVEGCSA-N 1 1 358.423 2.533 20 5 FFBDMO O=C1NC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000091864622 508020295 /nfs/dbraw/zinc/02/02/95/508020295.db2.gz BKEHHVQEKWCKPF-GFCCVEGCSA-N 1 1 358.423 2.533 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000080255405 508057760 /nfs/dbraw/zinc/05/77/60/508057760.db2.gz GNMDIUIWAKWZHN-ZDUSSCGKSA-N 1 1 368.397 2.553 20 5 FFBDMO CC[NH+](CC)CCOC1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000075007438 508076823 /nfs/dbraw/zinc/07/68/23/508076823.db2.gz DYJJGFBHGPZCNG-UHFFFAOYSA-N 1 1 365.474 2.926 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000111239337 508080832 /nfs/dbraw/zinc/08/08/32/508080832.db2.gz GXZZUNAYIQDSQO-ZDUSSCGKSA-N 1 1 355.394 2.883 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000111239337 508080836 /nfs/dbraw/zinc/08/08/36/508080836.db2.gz GXZZUNAYIQDSQO-ZDUSSCGKSA-N 1 1 355.394 2.883 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000092612725 508086706 /nfs/dbraw/zinc/08/67/06/508086706.db2.gz HUPKSBOMOGDOMQ-CYBMUJFWSA-N 1 1 372.416 2.882 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)C1CCCCC1 ZINC000111303759 508088499 /nfs/dbraw/zinc/08/84/99/508088499.db2.gz SOPIFUYVARKUJT-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO CCCC[N@H+](Cc1ccccc1F)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075674752 508126840 /nfs/dbraw/zinc/12/68/40/508126840.db2.gz XJVXNWDWHVTEAQ-MRXNPFEDSA-N 1 1 350.394 2.594 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000093360914 508142357 /nfs/dbraw/zinc/14/23/57/508142357.db2.gz KIVSVJYDWSRQQQ-CYBMUJFWSA-N 1 1 373.409 2.821 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CCN2C(=O)c3ccccc3C2=O)cc1[N+](=O)[O-] ZINC000093837796 508156973 /nfs/dbraw/zinc/15/69/73/508156973.db2.gz LRFWRSZKJOEMJC-UHFFFAOYSA-N 1 1 353.378 2.631 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)CC12CCCCC2 ZINC000081598577 508194989 /nfs/dbraw/zinc/19/49/89/508194989.db2.gz FAYCPMRPPDCTFY-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO C[N@H+](CC1CC1)C[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081636305 508199771 /nfs/dbraw/zinc/19/97/71/508199771.db2.gz CDTUNQPMRPFHAI-MRXNPFEDSA-N 1 1 360.458 2.587 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081636305 508199772 /nfs/dbraw/zinc/19/97/72/508199772.db2.gz CDTUNQPMRPFHAI-MRXNPFEDSA-N 1 1 360.458 2.587 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081635794 508200072 /nfs/dbraw/zinc/20/00/72/508200072.db2.gz LBYGMCYYAKFNHB-MRXNPFEDSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1cc(C(=O)NC2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)no1 ZINC000371411350 512383621 /nfs/dbraw/zinc/38/36/21/512383621.db2.gz NGWNRGBMCLXFQP-GQCTYLIASA-N 1 1 370.409 2.799 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169852 508238298 /nfs/dbraw/zinc/23/82/98/508238298.db2.gz IMACFAWJDMOWQX-ZDUSSCGKSA-N 1 1 360.414 2.864 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169852 508238300 /nfs/dbraw/zinc/23/83/00/508238300.db2.gz IMACFAWJDMOWQX-ZDUSSCGKSA-N 1 1 360.414 2.864 20 5 FFBDMO COc1ccc([C@@H](CO)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083172719 508239174 /nfs/dbraw/zinc/23/91/74/508239174.db2.gz LAHULAGNRPZMCR-MRXNPFEDSA-N 1 1 357.366 2.910 20 5 FFBDMO COc1ccc([C@@H](CO)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083172719 508239176 /nfs/dbraw/zinc/23/91/76/508239176.db2.gz LAHULAGNRPZMCR-MRXNPFEDSA-N 1 1 357.366 2.910 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645148 508333457 /nfs/dbraw/zinc/33/34/57/508333457.db2.gz IRVUOZIOKBUIOW-SFHVURJKSA-N 1 1 369.421 2.754 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114643276 508333534 /nfs/dbraw/zinc/33/35/34/508333534.db2.gz BHPXKJJIEZMVNR-SFHVURJKSA-N 1 1 353.422 2.918 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000114645317 508333732 /nfs/dbraw/zinc/33/37/32/508333732.db2.gz VHZUZFXXGXXVBO-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104680561 508340972 /nfs/dbraw/zinc/34/09/72/508340972.db2.gz SPSVRTGYOYKSLR-OAHLLOKOSA-N 1 1 372.425 2.783 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@H](C)C1 ZINC000115274197 508380583 /nfs/dbraw/zinc/38/05/83/508380583.db2.gz RZXXLUITEWCKIC-WBVHZDCISA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(C[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000133782817 508448967 /nfs/dbraw/zinc/44/89/67/508448967.db2.gz HWNBVACYQXXQMS-INIZCTEOSA-N 1 1 373.384 2.633 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@@H]1[NH+]1CCOCC1 ZINC000152595095 508476431 /nfs/dbraw/zinc/47/64/31/508476431.db2.gz XFIMHDKBQOWPTD-YOEHRIQHSA-N 1 1 363.458 2.929 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COc1cccc3[nH]ccc31)C2 ZINC000153268487 508565835 /nfs/dbraw/zinc/56/58/35/508565835.db2.gz TWUGOXNTKRMWSM-HNNXBMFYSA-N 1 1 367.405 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COc1cccc3[nH]ccc31)C2 ZINC000153268487 508565838 /nfs/dbraw/zinc/56/58/38/508565838.db2.gz TWUGOXNTKRMWSM-HNNXBMFYSA-N 1 1 367.405 2.874 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CCC[N@@H+](C)C1 ZINC000153410718 508580733 /nfs/dbraw/zinc/58/07/33/508580733.db2.gz PGAASCZHSOQAEH-AAEUAGOBSA-N 1 1 355.822 2.568 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128645306 508623338 /nfs/dbraw/zinc/62/33/38/508623338.db2.gz WOBIERHCDFMCNP-CYBMUJFWSA-N 1 1 353.394 2.811 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000136314490 508686075 /nfs/dbraw/zinc/68/60/75/508686075.db2.gz SIKVQYHYUYJXCJ-KBPBESRZSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000129644282 508749936 /nfs/dbraw/zinc/74/99/36/508749936.db2.gz KFVXFDXRVZACLI-OKILXGFUSA-N 1 1 350.419 2.606 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[NH+](CC2CC2)CC1 ZINC000119323147 508773277 /nfs/dbraw/zinc/77/32/77/508773277.db2.gz UTOBPXAJWCYDRL-UHFFFAOYSA-N 1 1 368.231 2.525 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000139668224 508793240 /nfs/dbraw/zinc/79/32/40/508793240.db2.gz XQHFDSRRHJPQME-VBQJREDUSA-N 1 1 362.430 2.700 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000139668224 508793242 /nfs/dbraw/zinc/79/32/42/508793242.db2.gz XQHFDSRRHJPQME-VBQJREDUSA-N 1 1 362.430 2.700 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000159131990 508796835 /nfs/dbraw/zinc/79/68/35/508796835.db2.gz SEENJAHVIIGCKP-UONOGXRCSA-N 1 1 358.442 2.855 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914363 508797173 /nfs/dbraw/zinc/79/71/73/508797173.db2.gz FFFILKRZSWGHFJ-HDMKZQKVSA-N 1 1 360.458 2.646 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000150875142 508913017 /nfs/dbraw/zinc/91/30/17/508913017.db2.gz GBUPJJGYBUDRDG-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000150875142 508913020 /nfs/dbraw/zinc/91/30/20/508913020.db2.gz GBUPJJGYBUDRDG-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[C@@H]1C[C@@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102524 508956727 /nfs/dbraw/zinc/95/67/27/508956727.db2.gz XPMHSOLAZYVRFZ-CZUORRHYSA-N 1 1 355.442 2.710 20 5 FFBDMO C[C@@H]1C[C@@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102524 508956731 /nfs/dbraw/zinc/95/67/31/508956731.db2.gz XPMHSOLAZYVRFZ-CZUORRHYSA-N 1 1 355.442 2.710 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515143 509011634 /nfs/dbraw/zinc/01/16/34/509011634.db2.gz IARRHHKZARUBIN-JKSUJKDBSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515143 509011638 /nfs/dbraw/zinc/01/16/38/509011638.db2.gz IARRHHKZARUBIN-JKSUJKDBSA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCOCC1 ZINC000155729854 509060023 /nfs/dbraw/zinc/06/00/23/509060023.db2.gz OQVWQTWUOAVYNA-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO Cn1cc(N2CC[NH+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)cn1 ZINC000126070042 509060237 /nfs/dbraw/zinc/06/02/37/509060237.db2.gz UTQJFGHGPNDGMO-UHFFFAOYSA-N 1 1 367.409 2.911 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1C[C@@H](C)O ZINC000120835717 509073900 /nfs/dbraw/zinc/07/39/00/509073900.db2.gz GTESIBBZRWAMNC-UKRRQHHQSA-N 1 1 364.446 2.521 20 5 FFBDMO O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126554072 509094725 /nfs/dbraw/zinc/09/47/25/509094725.db2.gz VGGAHBQSHMIICP-SJKOYZFVSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126554072 509094729 /nfs/dbraw/zinc/09/47/29/509094729.db2.gz VGGAHBQSHMIICP-SJKOYZFVSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126554072 509094735 /nfs/dbraw/zinc/09/47/35/509094735.db2.gz VGGAHBQSHMIICP-SJKOYZFVSA-N 1 1 369.425 2.560 20 5 FFBDMO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000120992323 509104919 /nfs/dbraw/zinc/10/49/19/509104919.db2.gz ZWGOUKXEPLBBLX-JSGCOSHPSA-N 1 1 367.475 2.734 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000121138373 509136475 /nfs/dbraw/zinc/13/64/75/509136475.db2.gz ZVRQBJYBQGZHHC-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000263848893 509184705 /nfs/dbraw/zinc/18/47/05/509184705.db2.gz YDGCJQRNUDRFET-GASCZTMLSA-N 1 1 361.442 2.556 20 5 FFBDMO O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[NH+](CC2CC2)CC1 ZINC000162267842 509186292 /nfs/dbraw/zinc/18/62/92/509186292.db2.gz HWGYNHMJIJMXLE-UHFFFAOYSA-N 1 1 368.231 2.525 20 5 FFBDMO C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185480229 509197134 /nfs/dbraw/zinc/19/71/34/509197134.db2.gz WWIBQHSQARPZAN-AWEZNQCLSA-N 1 1 353.382 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185492782 509203847 /nfs/dbraw/zinc/20/38/47/509203847.db2.gz XOKCCZAPMMDGKS-OAHLLOKOSA-N 1 1 369.421 2.905 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1OC)[NH+](C)C ZINC000248010281 509216723 /nfs/dbraw/zinc/21/67/23/509216723.db2.gz PELFUNWILZJUJU-MRXNPFEDSA-N 1 1 373.409 2.645 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1c(C)noc1C ZINC000182423104 509231290 /nfs/dbraw/zinc/23/12/90/509231290.db2.gz VYLWFZCHDFPQFN-CYBMUJFWSA-N 1 1 362.386 2.888 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@@H]21 ZINC000182476658 509258314 /nfs/dbraw/zinc/25/83/14/509258314.db2.gz WDZDIJRSIPTQOP-RISCZKNCSA-N 1 1 369.368 2.753 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000248279767 509267395 /nfs/dbraw/zinc/26/73/95/509267395.db2.gz URQFUOCXNHXYGA-KBAYOESNSA-N 1 1 364.442 2.614 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000217214720 509268859 /nfs/dbraw/zinc/26/88/59/509268859.db2.gz BPKRHJBPGNVKRD-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)C2([NH+]3CCOCC3)CCCC2)cccc1[N+](=O)[O-] ZINC000173184543 509442240 /nfs/dbraw/zinc/44/22/40/509442240.db2.gz GOTMHIBELMOIEQ-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO Cc1cc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000182824548 509443591 /nfs/dbraw/zinc/44/35/91/509443591.db2.gz MUCGNTFPBISQLZ-ZIAGYGMSSA-N 1 1 360.458 2.868 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208573 509456405 /nfs/dbraw/zinc/45/64/05/509456405.db2.gz OTOWWDXUAJTQMA-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208573 509456414 /nfs/dbraw/zinc/45/64/14/509456414.db2.gz OTOWWDXUAJTQMA-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208573 509456419 /nfs/dbraw/zinc/45/64/19/509456419.db2.gz OTOWWDXUAJTQMA-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000248880550 509525012 /nfs/dbraw/zinc/52/50/12/509525012.db2.gz FDXQCXFTKCLNTQ-CXAGYDPISA-N 1 1 372.425 2.626 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000248880609 509525439 /nfs/dbraw/zinc/52/54/39/509525439.db2.gz RPWNZFGHIWXNIO-KBXCAEBGSA-N 1 1 369.421 2.854 20 5 FFBDMO CC[N@@H+]1CCC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236930104 509536139 /nfs/dbraw/zinc/53/61/39/509536139.db2.gz LEBOESTVORFBOG-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236930104 509536150 /nfs/dbraw/zinc/53/61/50/509536150.db2.gz LEBOESTVORFBOG-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000165697373 509580742 /nfs/dbraw/zinc/58/07/42/509580742.db2.gz BNWQWHDMJDSECA-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cc(F)cc4c3OCOC4)C2)nc1 ZINC000173465882 509617765 /nfs/dbraw/zinc/61/77/65/509617765.db2.gz DMZKRNICHDCWOG-HNNXBMFYSA-N 1 1 374.372 2.682 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cc(F)cc4c3OCOC4)C2)nc1 ZINC000173465882 509617774 /nfs/dbraw/zinc/61/77/74/509617774.db2.gz DMZKRNICHDCWOG-HNNXBMFYSA-N 1 1 374.372 2.682 20 5 FFBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657737 509686556 /nfs/dbraw/zinc/68/65/56/509686556.db2.gz ABYNXKHOKKJAJM-PXAZEXFGSA-N 1 1 353.394 2.545 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000170647279 509696106 /nfs/dbraw/zinc/69/61/06/509696106.db2.gz YEKQDMSPDQAGDY-AWEZNQCLSA-N 1 1 365.430 2.820 20 5 FFBDMO Cn1cc(C[NH2+]Cc2cn3ccccc3n2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237782927 509733441 /nfs/dbraw/zinc/73/34/41/509733441.db2.gz RTGLLWIHMOMTDA-UHFFFAOYSA-N 1 1 362.393 2.933 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180095500 509749209 /nfs/dbraw/zinc/74/92/09/509749209.db2.gz TUSHOFXSYZWVLP-IRXDYDNUSA-N 1 1 370.365 2.678 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1 ZINC000180098611 509750576 /nfs/dbraw/zinc/75/05/76/509750576.db2.gz QALPSCAZVBXVPE-AEFFLSMTSA-N 1 1 355.394 2.779 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(Cc3cscn3)CC2)cc1[N+](=O)[O-] ZINC000170778691 509773260 /nfs/dbraw/zinc/77/32/60/509773260.db2.gz ASGMGOYTIVUAKZ-UHFFFAOYSA-N 1 1 362.455 2.768 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(Cc3cscn3)CC2)cc1[N+](=O)[O-] ZINC000170778691 509773268 /nfs/dbraw/zinc/77/32/68/509773268.db2.gz ASGMGOYTIVUAKZ-UHFFFAOYSA-N 1 1 362.455 2.768 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180147601 509779254 /nfs/dbraw/zinc/77/92/54/509779254.db2.gz DATCJQJKDKYAPW-UZLBHIALSA-N 1 1 369.421 2.925 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H](O)CN3CCCC3)s2)cc1 ZINC000238064765 509813072 /nfs/dbraw/zinc/81/30/72/509813072.db2.gz BZMRZXZQLNMLKH-INIZCTEOSA-N 1 1 361.467 2.870 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000252735596 509859396 /nfs/dbraw/zinc/85/93/96/509859396.db2.gz NGTIWDHIHAYULL-KBPBESRZSA-N 1 1 356.426 2.993 20 5 FFBDMO O=C1CCCCN1CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177082274 509860042 /nfs/dbraw/zinc/86/00/42/509860042.db2.gz VTTICYJOSPJRKZ-UHFFFAOYSA-N 1 1 372.425 2.961 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000190043630 509904535 /nfs/dbraw/zinc/90/45/35/509904535.db2.gz IQWVIMZWOJRYLA-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[N@H+]1C1CC1 ZINC000177154095 509905137 /nfs/dbraw/zinc/90/51/37/509905137.db2.gz OPHPKQDLLZYTGE-GDBMZVCRSA-N 1 1 372.469 2.553 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019719 509906574 /nfs/dbraw/zinc/90/65/74/509906574.db2.gz ACQRXGPNAJCHMI-QAPCUYQASA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019719 509906581 /nfs/dbraw/zinc/90/65/81/509906581.db2.gz ACQRXGPNAJCHMI-QAPCUYQASA-N 1 1 365.430 2.677 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177201328 509933983 /nfs/dbraw/zinc/93/39/83/509933983.db2.gz RTEGVVDQIVDMAI-DLBZAZTESA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@@H]2CCCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177201328 509933987 /nfs/dbraw/zinc/93/39/87/509933987.db2.gz RTEGVVDQIVDMAI-DLBZAZTESA-N 1 1 361.467 2.844 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)CC2 ZINC000245492563 509961282 /nfs/dbraw/zinc/96/12/82/509961282.db2.gz JSHNOFUARYZLDS-KYJSFNMBSA-N 1 1 360.458 2.869 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCCOC1 ZINC000174150287 509970445 /nfs/dbraw/zinc/97/04/45/509970445.db2.gz APCCRGCVCAKUSD-NEPJUHHUSA-N 1 1 355.822 2.934 20 5 FFBDMO COC(=O)c1cnc(NCCCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190168059 509982252 /nfs/dbraw/zinc/98/22/52/509982252.db2.gz MVARUVADTVZCBT-CYBMUJFWSA-N 1 1 350.419 2.700 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000180647531 510033011 /nfs/dbraw/zinc/03/30/11/510033011.db2.gz AOIDQTSOUFAEQG-HNNXBMFYSA-N 1 1 354.410 2.571 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180848489 510142834 /nfs/dbraw/zinc/14/28/34/510142834.db2.gz LSQILKSERRLOMD-ZBFHGGJFSA-N 1 1 368.437 2.960 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184195270 510186785 /nfs/dbraw/zinc/18/67/85/510186785.db2.gz CODCYHPTMMWWMK-ZDUSSCGKSA-N 1 1 367.421 2.727 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184195270 510186787 /nfs/dbraw/zinc/18/67/87/510186787.db2.gz CODCYHPTMMWWMK-ZDUSSCGKSA-N 1 1 367.421 2.727 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258571 510222737 /nfs/dbraw/zinc/22/27/37/510222737.db2.gz JLJCKLSZWJQJQL-ZDUSSCGKSA-N 1 1 367.421 2.871 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258571 510222740 /nfs/dbraw/zinc/22/27/40/510222740.db2.gz JLJCKLSZWJQJQL-ZDUSSCGKSA-N 1 1 367.421 2.871 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)cc1SC ZINC000174665869 510239823 /nfs/dbraw/zinc/23/98/23/510239823.db2.gz DNVWKTLOJCAROT-NWDGAFQWSA-N 1 1 365.455 2.634 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)C1CC1 ZINC000187463331 510280313 /nfs/dbraw/zinc/28/03/13/510280313.db2.gz SVBKINLVPCTFNJ-GOSISDBHSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1nn(C)c2ncc(C[NH+]3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc12 ZINC000194277649 510290225 /nfs/dbraw/zinc/29/02/25/510290225.db2.gz OTNQFAIJENNGNI-UHFFFAOYSA-N 1 1 366.425 2.507 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc(C)cs1 ZINC000184382807 510296076 /nfs/dbraw/zinc/29/60/76/510296076.db2.gz FCURIBHTHBEJKB-CQSZACIVSA-N 1 1 360.439 2.990 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269277071 510321321 /nfs/dbraw/zinc/32/13/21/510321321.db2.gz PJLPGUGMZCPURH-UHFFFAOYSA-N 1 1 357.414 2.864 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279325 510321886 /nfs/dbraw/zinc/32/18/86/510321886.db2.gz OBEMGRMNQIMBLR-BLLLJJGKSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279325 510321890 /nfs/dbraw/zinc/32/18/90/510321890.db2.gz OBEMGRMNQIMBLR-BLLLJJGKSA-N 1 1 364.833 2.927 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000194351408 510324117 /nfs/dbraw/zinc/32/41/17/510324117.db2.gz ULYRXURHXAHXKK-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000171805896 510380728 /nfs/dbraw/zinc/38/07/28/510380728.db2.gz DYMHCVIVQDQURA-OAHLLOKOSA-N 1 1 371.441 2.665 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000181429148 510404381 /nfs/dbraw/zinc/40/43/81/510404381.db2.gz FQLCXQZGVLRJNF-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000181429148 510404385 /nfs/dbraw/zinc/40/43/85/510404385.db2.gz FQLCXQZGVLRJNF-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000178167908 510468478 /nfs/dbraw/zinc/46/84/78/510468478.db2.gz ZNBPVHZAMJDRFT-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184739981 510492754 /nfs/dbraw/zinc/49/27/54/510492754.db2.gz OCDRJGBDNUCJJZ-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000181637567 510514757 /nfs/dbraw/zinc/51/47/57/510514757.db2.gz KMYNKVWDHHODII-KBPBESRZSA-N 1 1 361.442 2.986 20 5 FFBDMO C[N@@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccccc2)C1 ZINC000181637913 510515009 /nfs/dbraw/zinc/51/50/09/510515009.db2.gz XHJSQFSICXSLNS-IBGZPJMESA-N 1 1 369.421 2.950 20 5 FFBDMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccccc2)C1 ZINC000181637913 510515015 /nfs/dbraw/zinc/51/50/15/510515015.db2.gz XHJSQFSICXSLNS-IBGZPJMESA-N 1 1 369.421 2.950 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000246700374 510623172 /nfs/dbraw/zinc/62/31/72/510623172.db2.gz QWEJTTXHBFTWSO-BBRMVZONSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000246700374 510623176 /nfs/dbraw/zinc/62/31/76/510623176.db2.gz QWEJTTXHBFTWSO-BBRMVZONSA-N 1 1 351.472 2.874 20 5 FFBDMO CCS[C@@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181871939 510634515 /nfs/dbraw/zinc/63/45/15/510634515.db2.gz ULFBDGUNVNPSGX-OAHLLOKOSA-N 1 1 372.512 2.976 20 5 FFBDMO CCS[C@@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181871939 510634520 /nfs/dbraw/zinc/63/45/20/510634520.db2.gz ULFBDGUNVNPSGX-OAHLLOKOSA-N 1 1 372.512 2.976 20 5 FFBDMO Cc1c(CN(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694478 /nfs/dbraw/zinc/69/44/78/510694478.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1c(C[N@@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694484 /nfs/dbraw/zinc/69/44/84/510694484.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1c(C[N@H+](C)C[C@@]2(O)CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294266 510694490 /nfs/dbraw/zinc/69/44/90/510694490.db2.gz FBRXSKNKJVNYTK-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2nc3sccn3c2[N+](=O)[O-])[C@@H](C)C1 ZINC000246829975 510699024 /nfs/dbraw/zinc/69/90/24/510699024.db2.gz PGQQUFPRUIGPID-QWHCGFSZSA-N 1 1 367.475 2.853 20 5 FFBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000182028863 510718530 /nfs/dbraw/zinc/71/85/30/510718530.db2.gz WAMOLBFHFJLFSY-RDJZCZTQSA-N 1 1 357.410 2.875 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000246870358 510719290 /nfs/dbraw/zinc/71/92/90/510719290.db2.gz SIQAKKVFOIKCFY-YOEHRIQHSA-N 1 1 363.458 2.770 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172420996 510719467 /nfs/dbraw/zinc/71/94/67/510719467.db2.gz WDRTWDLTAPBNNW-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000182131976 510773557 /nfs/dbraw/zinc/77/35/57/510773557.db2.gz RLNFINMMLXNPOY-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247645663 510867588 /nfs/dbraw/zinc/86/75/88/510867588.db2.gz UIGBNJQJUQRWTH-QRVBRYPASA-N 1 1 358.442 2.810 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297354298 510914627 /nfs/dbraw/zinc/91/46/27/510914627.db2.gz BRYJFFCKROFKSX-WBVHZDCISA-N 1 1 373.453 2.763 20 5 FFBDMO CN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285531520 510944783 /nfs/dbraw/zinc/94/47/83/510944783.db2.gz PBZDVXVVLXWBRL-ONXXMXGDSA-N 1 1 366.849 2.744 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270857517 511006435 /nfs/dbraw/zinc/00/64/35/511006435.db2.gz YVMYPUZVFGGTOT-UGSOOPFHSA-N 1 1 358.442 2.752 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000361193020 511011560 /nfs/dbraw/zinc/01/15/60/511011560.db2.gz YQPWDRRWOQPJFS-QFBILLFUSA-N 1 1 357.385 2.838 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000361193020 511011564 /nfs/dbraw/zinc/01/15/64/511011564.db2.gz YQPWDRRWOQPJFS-QFBILLFUSA-N 1 1 357.385 2.838 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000270965431 511039861 /nfs/dbraw/zinc/03/98/61/511039861.db2.gz VMMLJEFNFCVYMQ-UHFFFAOYSA-N 1 1 364.465 2.724 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000271167774 511105988 /nfs/dbraw/zinc/10/59/88/511105988.db2.gz CTQABFPTAWAHNR-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](c2n[nH]cc2NC(C)=O)C1 ZINC000364878010 511129682 /nfs/dbraw/zinc/12/96/82/511129682.db2.gz GYHGXQDNIPJANE-ZDUSSCGKSA-N 1 1 373.413 2.665 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2n[nH]cc2NC(C)=O)C1 ZINC000364878010 511129686 /nfs/dbraw/zinc/12/96/86/511129686.db2.gz GYHGXQDNIPJANE-ZDUSSCGKSA-N 1 1 373.413 2.665 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000282869934 511141314 /nfs/dbraw/zinc/14/13/14/511141314.db2.gz WBECQPCVJIQEIU-ALOPSCKCSA-N 1 1 360.458 2.794 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC23CCOCC3)cn1 ZINC000295176317 511310641 /nfs/dbraw/zinc/31/06/41/511310641.db2.gz QWHXPYOTQBAQTA-IBGZPJMESA-N 1 1 370.453 2.767 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271772692 511318812 /nfs/dbraw/zinc/31/88/12/511318812.db2.gz QUZHHFSATUCDFA-CQSZACIVSA-N 1 1 357.410 2.913 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000363095640 511350518 /nfs/dbraw/zinc/35/05/18/511350518.db2.gz MHBNXFXIJFTHIW-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000291858921 511368259 /nfs/dbraw/zinc/36/82/59/511368259.db2.gz HCFUNNGDXORXPW-UHFFFAOYSA-N 1 1 370.409 2.983 20 5 FFBDMO O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC[N@H+]1CC=CCC1 ZINC000280380000 511443848 /nfs/dbraw/zinc/44/38/48/511443848.db2.gz ZSUZMJUVIWLWAA-UHFFFAOYSA-N 1 1 361.445 2.533 20 5 FFBDMO O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC[N@@H+]1CC=CCC1 ZINC000280380000 511443855 /nfs/dbraw/zinc/44/38/55/511443855.db2.gz ZSUZMJUVIWLWAA-UHFFFAOYSA-N 1 1 361.445 2.533 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCOC[C@H](C4CCC4)C3)o2)cc1 ZINC000292045537 511444338 /nfs/dbraw/zinc/44/43/38/511444338.db2.gz BAVGCLSYMRIHBV-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCOC[C@H](C4CCC4)C3)o2)cc1 ZINC000292045537 511444339 /nfs/dbraw/zinc/44/43/39/511444339.db2.gz BAVGCLSYMRIHBV-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000365490733 511483637 /nfs/dbraw/zinc/48/36/37/511483637.db2.gz XWTSSCWBIKPRSU-GFCCVEGCSA-N 1 1 370.356 2.898 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O ZINC000272267487 511485087 /nfs/dbraw/zinc/48/50/87/511485087.db2.gz AOUOGGRNOMSNKD-JKSUJKDBSA-N 1 1 350.415 2.690 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O ZINC000272267487 511485090 /nfs/dbraw/zinc/48/50/90/511485090.db2.gz AOUOGGRNOMSNKD-JKSUJKDBSA-N 1 1 350.415 2.690 20 5 FFBDMO C[C@H]1CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)CC[N@H+](C2CCC2)C1 ZINC000295839685 511532227 /nfs/dbraw/zinc/53/22/27/511532227.db2.gz DHKZHGAUOXUPLQ-CQSZACIVSA-N 1 1 370.457 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292300133 511542785 /nfs/dbraw/zinc/54/27/85/511542785.db2.gz MRZLQBOALJXTLI-CABCVRRESA-N 1 1 360.458 2.728 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(Br)c([N+](=O)[O-])c3)C2)C1 ZINC000292470867 511608927 /nfs/dbraw/zinc/60/89/27/511608927.db2.gz ZSOHWRQJFCTFSM-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000296215945 511659193 /nfs/dbraw/zinc/65/91/93/511659193.db2.gz CXJXRUGELZTOEC-NVXWUHKLSA-N 1 1 359.426 2.500 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc(F)cc4c3OCOC4)CC2)n1 ZINC000365845790 511683404 /nfs/dbraw/zinc/68/34/04/511683404.db2.gz JPCLWSBJNSSWMG-UHFFFAOYSA-N 1 1 362.361 2.634 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)C2)C1 ZINC000292699113 511690839 /nfs/dbraw/zinc/69/08/39/511690839.db2.gz QQINZVSRLSAMFZ-MRXNPFEDSA-N 1 1 370.356 2.756 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](OCc2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000281043389 511699694 /nfs/dbraw/zinc/69/96/94/511699694.db2.gz QEYIEJWWPNPIKL-INIZCTEOSA-N 1 1 370.409 2.610 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000301709663 511701221 /nfs/dbraw/zinc/70/12/21/511701221.db2.gz XAJPUIQJXMCKSN-CYBMUJFWSA-N 1 1 362.430 2.850 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000312178385 511782307 /nfs/dbraw/zinc/78/23/07/511782307.db2.gz PWQIHRGIWJOSGY-OAHLLOKOSA-N 1 1 370.409 2.853 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000292980141 511794393 /nfs/dbraw/zinc/79/43/93/511794393.db2.gz HGUAIDSQIRRRBH-SFHVURJKSA-N 1 1 350.415 2.692 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696807 511859024 /nfs/dbraw/zinc/85/90/24/511859024.db2.gz KNPFAUCKJDUSMX-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN(C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696807 511859029 /nfs/dbraw/zinc/85/90/29/511859029.db2.gz KNPFAUCKJDUSMX-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696807 511859032 /nfs/dbraw/zinc/85/90/32/511859032.db2.gz KNPFAUCKJDUSMX-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)C[C@@H]21 ZINC000284797605 511873820 /nfs/dbraw/zinc/87/38/20/511873820.db2.gz OITJSTREGISUNN-RBUKOAKNSA-N 1 1 364.445 2.851 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000274579490 511879817 /nfs/dbraw/zinc/87/98/17/511879817.db2.gz SGIOJASEKYRLAE-HNNXBMFYSA-N 1 1 359.430 2.513 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285292153 512066842 /nfs/dbraw/zinc/06/68/42/512066842.db2.gz GNIYZHQOQUKCRM-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000285292153 512066847 /nfs/dbraw/zinc/06/68/47/512066847.db2.gz GNIYZHQOQUKCRM-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)O1 ZINC000364410173 512107340 /nfs/dbraw/zinc/10/73/40/512107340.db2.gz AUQMELSEKPGYKE-GASCZTMLSA-N 1 1 361.442 2.556 20 5 FFBDMO O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000367478708 512522151 /nfs/dbraw/zinc/52/21/51/512522151.db2.gz MTXDWRGNSYHHAO-INIZCTEOSA-N 1 1 370.409 2.844 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000375830523 512528819 /nfs/dbraw/zinc/52/88/19/512528819.db2.gz KLRVPZBMJABWGJ-CVEARBPZSA-N 1 1 361.442 2.696 20 5 FFBDMO O=C(CC[N@H+](CCO)[C@H]1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1 ZINC000411339357 512587798 /nfs/dbraw/zinc/58/77/98/512587798.db2.gz YUDJNXRRGHBEKT-IBGZPJMESA-N 1 1 369.421 2.905 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ncc(Br)cc1[N+](=O)[O-])CC2 ZINC000367646570 512598362 /nfs/dbraw/zinc/59/83/62/512598362.db2.gz SGFCZVOJHUNRQD-UHFFFAOYSA-N 1 1 355.236 2.817 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000378240559 512653676 /nfs/dbraw/zinc/65/36/76/512653676.db2.gz AKIRNHKCUDOVMD-NSHDSACASA-N 1 1 359.361 2.988 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000378240559 512653678 /nfs/dbraw/zinc/65/36/78/512653678.db2.gz AKIRNHKCUDOVMD-NSHDSACASA-N 1 1 359.361 2.988 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1ccc([N+](=O)[O-])c3cccnc13)CC2 ZINC000368187192 512837704 /nfs/dbraw/zinc/83/77/04/512837704.db2.gz DJZZPWUPIFYOBQ-UHFFFAOYSA-N 1 1 354.410 2.843 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)c1 ZINC000374531873 512876401 /nfs/dbraw/zinc/87/64/01/512876401.db2.gz SXXDQKHSZOELGS-PMACEKPBSA-N 1 1 356.422 2.654 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)c1 ZINC000374531876 512876590 /nfs/dbraw/zinc/87/65/90/512876590.db2.gz SXXDQKHSZOELGS-WOJBJXKFSA-N 1 1 356.422 2.654 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000389952303 512903604 /nfs/dbraw/zinc/90/36/04/512903604.db2.gz SNMINEUWGIKXND-KBXCAEBGSA-N 1 1 368.437 2.887 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](Cc3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368486964 512970540 /nfs/dbraw/zinc/97/05/40/512970540.db2.gz QQBVPLKRRPHBGG-VQIMIIECSA-N 1 1 366.421 2.660 20 5 FFBDMO COCC[C@H]1CCCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000368676578 513056567 /nfs/dbraw/zinc/05/65/67/513056567.db2.gz OGASOCODAGSTQM-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COCC[C@H]1CCCC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000368678320 513058025 /nfs/dbraw/zinc/05/80/25/513058025.db2.gz UUBOBUJEWRPRPG-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2NCCCCn1cc[nH+]c1C ZINC000450352764 513155093 /nfs/dbraw/zinc/15/50/93/513155093.db2.gz ZMWHFWOCCNIXQY-UHFFFAOYSA-N 1 1 355.398 2.971 20 5 FFBDMO Cc1nc(NCC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450401269 513178747 /nfs/dbraw/zinc/17/87/47/513178747.db2.gz HXUZEFSPXKPWHD-PBHICJAKSA-N 1 1 355.442 2.828 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@]3(CCCc4ccccc43)C2)c1 ZINC000440326301 513293574 /nfs/dbraw/zinc/29/35/74/513293574.db2.gz MGKIUGDNHLQJON-QUCCMNQESA-N 1 1 370.453 2.522 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC[C@H](S(C)(=O)=O)C1 ZINC000446850460 513348679 /nfs/dbraw/zinc/34/86/79/513348679.db2.gz ZNWVMMIWJOFLPM-SHRNQRGKSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC[C@H](S(C)(=O)=O)C1 ZINC000446850460 513348684 /nfs/dbraw/zinc/34/86/84/513348684.db2.gz ZNWVMMIWJOFLPM-SHRNQRGKSA-N 1 1 352.456 2.897 20 5 FFBDMO CCc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000450810650 513351275 /nfs/dbraw/zinc/35/12/75/513351275.db2.gz MTAMIPYWULCHSA-HNNXBMFYSA-N 1 1 357.458 2.849 20 5 FFBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434622513 513370495 /nfs/dbraw/zinc/37/04/95/513370495.db2.gz FLGCVAHFCWFMNS-IAGOWNOFSA-N 1 1 350.394 2.620 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)[C@@H]2C1 ZINC000425055283 513392746 /nfs/dbraw/zinc/39/27/46/513392746.db2.gz HFFLNZZPVMKDCK-XJKSGUPXSA-N 1 1 372.450 2.885 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@H]1C ZINC000450994359 513446645 /nfs/dbraw/zinc/44/66/45/513446645.db2.gz CHHGGETVZDHPRK-CHWSQXEVSA-N 1 1 354.410 2.751 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000441186291 513508329 /nfs/dbraw/zinc/50/83/29/513508329.db2.gz WNDSXDZADQZSLF-HUUCEWRRSA-N 1 1 350.415 2.731 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294423 513532606 /nfs/dbraw/zinc/53/26/06/513532606.db2.gz HKRZARUVOZMENS-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294423 513532609 /nfs/dbraw/zinc/53/26/09/513532609.db2.gz HKRZARUVOZMENS-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(=NC[C@@H]3CC[N@@H+](CCc4ccccc4)C3)[nH]c2c1 ZINC000447695227 513544520 /nfs/dbraw/zinc/54/45/20/513544520.db2.gz VYFFXTLTBVSKIO-INIZCTEOSA-N 1 1 365.437 2.870 20 5 FFBDMO C[NH+](C)[C@H]1CCOc2c(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cccc21 ZINC000447727707 513553873 /nfs/dbraw/zinc/55/38/73/513553873.db2.gz KFFDHHGVLBCEEC-INIZCTEOSA-N 1 1 357.366 2.938 20 5 FFBDMO C[N@H+](CCc1cnccn1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425458630 513577331 /nfs/dbraw/zinc/57/73/31/513577331.db2.gz MRGGVIHFMLHLTF-UHFFFAOYSA-N 1 1 351.204 2.822 20 5 FFBDMO C[N@@H+](CCc1cnccn1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425458630 513577337 /nfs/dbraw/zinc/57/73/37/513577337.db2.gz MRGGVIHFMLHLTF-UHFFFAOYSA-N 1 1 351.204 2.822 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000442093140 513666114 /nfs/dbraw/zinc/66/61/14/513666114.db2.gz GZTSQHUJQJBKFJ-GUTXKFCHSA-N 1 1 369.487 2.548 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451343680 513689634 /nfs/dbraw/zinc/68/96/34/513689634.db2.gz OSIQADPCXAQWBR-MANSERQUSA-N 1 1 373.453 2.716 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000413620309 513740050 /nfs/dbraw/zinc/74/00/50/513740050.db2.gz AASQFCLTQGYJIX-HZPDHXFCSA-N 1 1 361.442 2.938 20 5 FFBDMO CO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1(C)C ZINC000451558516 513833336 /nfs/dbraw/zinc/83/33/36/513833336.db2.gz DCBBYPIQJBVNGJ-INIZCTEOSA-N 1 1 363.414 2.640 20 5 FFBDMO C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000448697169 513851036 /nfs/dbraw/zinc/85/10/36/513851036.db2.gz LFKBBLCFFQQHBF-GJZGRUSLSA-N 1 1 361.442 2.937 20 5 FFBDMO CCCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCCC[C@H]1OC ZINC000451653217 513890179 /nfs/dbraw/zinc/89/01/79/513890179.db2.gz RMKHDYOHGNTBJP-IAGOWNOFSA-N 1 1 351.447 2.816 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448780726 513896079 /nfs/dbraw/zinc/89/60/79/513896079.db2.gz KWJHYYACJWRNQQ-CABCVRRESA-N 1 1 361.442 2.794 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1 ZINC000451697802 513916854 /nfs/dbraw/zinc/91/68/54/513916854.db2.gz ROXAARLVRRTFOP-INMHGKMJSA-N 1 1 361.442 2.715 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451730339 513944820 /nfs/dbraw/zinc/94/48/20/513944820.db2.gz OMXYQJBAPSJQKH-CYBMUJFWSA-N 1 1 354.838 2.603 20 5 FFBDMO Cc1cc(OCC(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431713668 513977050 /nfs/dbraw/zinc/97/70/50/513977050.db2.gz DLIFMEDKYCXDLN-GASCZTMLSA-N 1 1 363.458 2.766 20 5 FFBDMO Cc1cc(OCC(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431835953 514014767 /nfs/dbraw/zinc/01/47/67/514014767.db2.gz XIODRUFGUVKTQO-AWEZNQCLSA-N 1 1 363.458 2.909 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCCC[C@@H]2O)CC1 ZINC000449183344 514104047 /nfs/dbraw/zinc/10/40/47/514104047.db2.gz FQWYKWQCZFJELI-YSGRDPCXSA-N 1 1 361.486 2.883 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000432197217 514123392 /nfs/dbraw/zinc/12/33/92/514123392.db2.gz WUGCKPYXLHYLQJ-XLIONFOSSA-N 1 1 369.421 2.844 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@H](O)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559716 514180215 /nfs/dbraw/zinc/18/02/15/514180215.db2.gz PLAGVGZQYPHOBL-JXFKEZNVSA-N 1 1 371.437 2.538 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](O)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559716 514180218 /nfs/dbraw/zinc/18/02/18/514180218.db2.gz PLAGVGZQYPHOBL-JXFKEZNVSA-N 1 1 371.437 2.538 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000420632041 514208209 /nfs/dbraw/zinc/20/82/09/514208209.db2.gz WELGOAHPLQMDFA-UHFFFAOYSA-N 1 1 350.438 2.730 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000420632041 514208216 /nfs/dbraw/zinc/20/82/16/514208216.db2.gz WELGOAHPLQMDFA-UHFFFAOYSA-N 1 1 350.438 2.730 20 5 FFBDMO C[C@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000420639511 514211232 /nfs/dbraw/zinc/21/12/32/514211232.db2.gz QNGIJNANFGFNFG-OAHLLOKOSA-N 1 1 368.437 2.652 20 5 FFBDMO CCOC(=O)c1nn(C)cc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504888 514232463 /nfs/dbraw/zinc/23/24/63/514232463.db2.gz WMSFBPUMTRFJFG-OAHLLOKOSA-N 1 1 372.425 2.885 20 5 FFBDMO CCOC(=O)c1nn(C)cc1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504888 514232468 /nfs/dbraw/zinc/23/24/68/514232468.db2.gz WMSFBPUMTRFJFG-OAHLLOKOSA-N 1 1 372.425 2.885 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000437834319 514247372 /nfs/dbraw/zinc/24/73/72/514247372.db2.gz NGMPDMDJMBQJIA-QGZVFWFLSA-N 1 1 351.406 2.801 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000437834319 514247380 /nfs/dbraw/zinc/24/73/80/514247380.db2.gz NGMPDMDJMBQJIA-QGZVFWFLSA-N 1 1 351.406 2.801 20 5 FFBDMO COC(=O)c1cc([C@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)oc1C ZINC000432778557 514282382 /nfs/dbraw/zinc/28/23/82/514282382.db2.gz DXXKEQGTZTXPPL-WCQYABFASA-N 1 1 374.397 2.925 20 5 FFBDMO CCOC(=O)c1cc(NCCC[N@H+]2CCCO[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000432861961 514304614 /nfs/dbraw/zinc/30/46/14/514304614.db2.gz CQQCAABJCBIMFE-AWEZNQCLSA-N 1 1 365.430 2.684 20 5 FFBDMO Cc1c([C@H](C)Nc2ccc3c(c2)C[N@@H+](CC(N)=O)CC3)cccc1[N+](=O)[O-] ZINC000433059157 514366565 /nfs/dbraw/zinc/36/65/65/514366565.db2.gz MNUHEKUFAHJCFF-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1c([C@H](C)Nc2ccc3c(c2)C[N@H+](CC(N)=O)CC3)cccc1[N+](=O)[O-] ZINC000433059157 514366570 /nfs/dbraw/zinc/36/65/70/514366570.db2.gz MNUHEKUFAHJCFF-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415132451 514459912 /nfs/dbraw/zinc/45/99/12/514459912.db2.gz UGJKMBHYPBPFJM-MJGOQNOKSA-N 1 1 363.458 2.712 20 5 FFBDMO CCOc1ccc2c(c1)CC[N@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C2 ZINC000433449685 514495424 /nfs/dbraw/zinc/49/54/24/514495424.db2.gz IALNQCJJBAJRGO-SFHVURJKSA-N 1 1 372.421 2.792 20 5 FFBDMO Cc1nc(NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000450257609 514568281 /nfs/dbraw/zinc/56/82/81/514568281.db2.gz WQJHHSOREOKOPS-AWEZNQCLSA-N 1 1 355.442 2.959 20 5 FFBDMO CCC[C@@H]1CN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000466199519 514573818 /nfs/dbraw/zinc/57/38/18/514573818.db2.gz DTXJJFMJHWJQHV-OAHLLOKOSA-N 1 1 369.437 2.675 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000466222076 514581646 /nfs/dbraw/zinc/58/16/46/514581646.db2.gz GBOPXCMKXKDAAD-HUUCEWRRSA-N 1 1 352.822 2.674 20 5 FFBDMO O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CC[NH+]2CCC1CC2 ZINC000507872402 514590279 /nfs/dbraw/zinc/59/02/79/514590279.db2.gz JIORXSZZBYADAK-UHFFFAOYSA-N 1 1 365.408 2.741 20 5 FFBDMO Cc1ccc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)nc1 ZINC000453442104 514642595 /nfs/dbraw/zinc/64/25/95/514642595.db2.gz XXKCZSCXEYFHSJ-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO COC(=O)c1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(F)c1 ZINC000470873602 514653833 /nfs/dbraw/zinc/65/38/33/514653833.db2.gz KVXXQWWWNYFXBJ-UHFFFAOYSA-N 1 1 362.361 2.554 20 5 FFBDMO CS[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N1CCCC1 ZINC000484633171 514719956 /nfs/dbraw/zinc/71/99/56/514719956.db2.gz CRPBGFCFONKGCN-QZTJIDSGSA-N 1 1 365.499 2.875 20 5 FFBDMO CS[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N1CCCC1 ZINC000484633171 514719964 /nfs/dbraw/zinc/71/99/64/514719964.db2.gz CRPBGFCFONKGCN-QZTJIDSGSA-N 1 1 365.499 2.875 20 5 FFBDMO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000471058817 514735239 /nfs/dbraw/zinc/73/52/39/514735239.db2.gz GPHDLCKQNQTDLW-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CC[C@H](C)C1 ZINC000484890431 514833078 /nfs/dbraw/zinc/83/30/78/514833078.db2.gz FJMQPTAUFUPJGB-GOEBONIOSA-N 1 1 361.442 2.621 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000480699839 515049638 /nfs/dbraw/zinc/04/96/38/515049638.db2.gz PJLIRYHJBRACAJ-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000509354590 515138566 /nfs/dbraw/zinc/13/85/66/515138566.db2.gz KTCNFVBSCLQRKL-KRWDZBQOSA-N 1 1 356.426 2.953 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000481009007 515171894 /nfs/dbraw/zinc/17/18/94/515171894.db2.gz FRIGKNOAGPTEJA-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(Nc1ccccc1)[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000472436756 515269905 /nfs/dbraw/zinc/26/99/05/515269905.db2.gz WKWRCTPPTZRUNO-GOSISDBHSA-N 1 1 365.393 2.761 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491061871 515368299 /nfs/dbraw/zinc/36/82/99/515368299.db2.gz TYDXZYGYAPIKAH-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO CCN1CCC[C@H]1C[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491061871 515368311 /nfs/dbraw/zinc/36/83/11/515368311.db2.gz TYDXZYGYAPIKAH-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCCC[C@H]1C ZINC000468710786 515481289 /nfs/dbraw/zinc/48/12/89/515481289.db2.gz IHXNCVXCMSCVOL-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCCC[C@H]1C ZINC000468710786 515481296 /nfs/dbraw/zinc/48/12/96/515481296.db2.gz IHXNCVXCMSCVOL-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO CN(CC(=O)NCCC[N@@H+](C)Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000463446232 515502401 /nfs/dbraw/zinc/50/24/01/515502401.db2.gz GVERYGGWXAMZRI-UHFFFAOYSA-N 1 1 370.453 2.669 20 5 FFBDMO CCOC(=O)c1cc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000481973133 515533502 /nfs/dbraw/zinc/53/35/02/515533502.db2.gz YXRQLOUXVKEZHA-CQSZACIVSA-N 1 1 372.425 2.964 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC000505498747 515559410 /nfs/dbraw/zinc/55/94/10/515559410.db2.gz NJJICHGJZZOHBC-MRXNPFEDSA-N 1 1 354.410 2.526 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)ccc1[N+](=O)[O-] ZINC000492784581 515563247 /nfs/dbraw/zinc/56/32/47/515563247.db2.gz PWSPYDIGIGEIHR-CQSZACIVSA-N 1 1 357.414 2.979 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505517447 515566443 /nfs/dbraw/zinc/56/64/43/515566443.db2.gz TYPPMSRWUDLXQI-LJQANCHMSA-N 1 1 369.421 2.709 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@@H]21 ZINC000493507337 515639493 /nfs/dbraw/zinc/63/94/93/515639493.db2.gz UQEMXWJKXGWXAU-ZOWXZIJZSA-N 1 1 367.833 2.568 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000459550122 515640981 /nfs/dbraw/zinc/64/09/81/515640981.db2.gz SUBJFKSZYSEUOP-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2c(F)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000505798192 515674779 /nfs/dbraw/zinc/67/47/79/515674779.db2.gz ZDLGUHFMKKJSDC-ZNMIVQPWSA-N 1 1 351.422 2.808 20 5 FFBDMO CN(C)c1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc[nH+]1 ZINC000500421056 515703149 /nfs/dbraw/zinc/70/31/49/515703149.db2.gz GOBLOXWWLRWELE-UHFFFAOYSA-N 1 1 355.398 2.908 20 5 FFBDMO CCC[C@H](NCCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000482569754 515723007 /nfs/dbraw/zinc/72/30/07/515723007.db2.gz QFLZIPXNGUPZHW-AEFFLSMTSA-N 1 1 362.474 2.613 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000459682965 515740123 /nfs/dbraw/zinc/74/01/23/515740123.db2.gz TZMAFDBMZGQSEO-LLVKDONJSA-N 1 1 360.418 2.517 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676367 515765978 /nfs/dbraw/zinc/76/59/78/515765978.db2.gz JJCXKYOHQNLQCR-KBPBESRZSA-N 1 1 373.457 2.988 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676367 515765982 /nfs/dbraw/zinc/76/59/82/515765982.db2.gz JJCXKYOHQNLQCR-KBPBESRZSA-N 1 1 373.457 2.988 20 5 FFBDMO CCC1(CC)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000464589557 515885540 /nfs/dbraw/zinc/88/55/40/515885540.db2.gz YSGPKSIITGIMNK-OAHLLOKOSA-N 1 1 354.472 2.942 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000506755498 515975337 /nfs/dbraw/zinc/97/53/37/515975337.db2.gz VOFCBUNPYJPVMV-HNNXBMFYSA-N 1 1 354.838 2.603 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000487819718 515992013 /nfs/dbraw/zinc/99/20/13/515992013.db2.gz QCAGYOWAQVDGCG-SMDDNHRTSA-N 1 1 366.849 2.715 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@@H+]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000469849918 515995876 /nfs/dbraw/zinc/99/58/76/515995876.db2.gz TVWBMPKCFWOOHI-SFHVURJKSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@H+]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000469849918 515995884 /nfs/dbraw/zinc/99/58/84/515995884.db2.gz TVWBMPKCFWOOHI-SFHVURJKSA-N 1 1 371.462 2.942 20 5 FFBDMO COc1cc(C[N@@H+]2CC(C)(C)O[C@]3(CCCOC3)C2)ccc1[N+](=O)[O-] ZINC000483348493 516044509 /nfs/dbraw/zinc/04/45/09/516044509.db2.gz XGVSEVHZSVCNQG-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc(C[N@H+]2CC(C)(C)O[C@]3(CCCOC3)C2)ccc1[N+](=O)[O-] ZINC000483348493 516044518 /nfs/dbraw/zinc/04/45/18/516044518.db2.gz XGVSEVHZSVCNQG-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCC[C@H]1C ZINC000487998523 516072442 /nfs/dbraw/zinc/07/24/42/516072442.db2.gz IGARPZFQQOKSCD-CZUORRHYSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)CC[N@@H+](C)C1CC1 ZINC000474568726 516096512 /nfs/dbraw/zinc/09/65/12/516096512.db2.gz RWKQYDSCIWUHLV-LLVKDONJSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000455408291 516183644 /nfs/dbraw/zinc/18/36/44/516183644.db2.gz YGNAPWRXRKLGAS-AOOOYVTPSA-N 1 1 371.235 2.914 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@H]1C ZINC000497558321 516326356 /nfs/dbraw/zinc/32/63/56/516326356.db2.gz NZNYULTUHCWNQF-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000535383503 516335226 /nfs/dbraw/zinc/33/52/26/516335226.db2.gz CJWIJJGCCGTMPC-ZFWWWQNUSA-N 1 1 358.442 2.950 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000535695188 516452106 /nfs/dbraw/zinc/45/21/06/516452106.db2.gz ZYHOSYGISKLYON-AWEZNQCLSA-N 1 1 356.426 2.880 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000531427057 516458839 /nfs/dbraw/zinc/45/88/39/516458839.db2.gz IZSBLQISTHMBRC-LLVKDONJSA-N 1 1 370.247 2.817 20 5 FFBDMO C[C@@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000513204143 516520939 /nfs/dbraw/zinc/52/09/39/516520939.db2.gz OOSCLQBVIOVAJD-TXEJJXNPSA-N 1 1 355.822 2.568 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000547799410 516570499 /nfs/dbraw/zinc/57/04/99/516570499.db2.gz ZDQRYPLGPMFSEF-INIZCTEOSA-N 1 1 371.441 2.727 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2nccn2C)C1 ZINC000536068647 516617036 /nfs/dbraw/zinc/61/70/36/516617036.db2.gz JUBXDXLFSWZBIR-GXTWGEPZSA-N 1 1 368.397 2.929 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000554834177 516656084 /nfs/dbraw/zinc/65/60/84/516656084.db2.gz DGCZSKSVAXYRIR-UHFFFAOYSA-N 1 1 372.812 2.931 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000551583043 516772618 /nfs/dbraw/zinc/77/26/18/516772618.db2.gz JEKBYPQWYZFOPG-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@H+]1CCCNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000548116694 516773471 /nfs/dbraw/zinc/77/34/71/516773471.db2.gz TZKIGTSUBSMVJP-LBPRGKRZSA-N 1 1 361.229 2.653 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000544655998 516858173 /nfs/dbraw/zinc/85/81/73/516858173.db2.gz VGEJWRDABHVNSO-ZFWWWQNUSA-N 1 1 369.487 2.705 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3c[nH]nc3-c3ccccc3)CC2)cn1 ZINC000536638593 516867018 /nfs/dbraw/zinc/86/70/18/516867018.db2.gz VKOKXODDUGPFCQ-UHFFFAOYSA-N 1 1 364.409 2.702 20 5 FFBDMO CN(Cc1ccc(F)cc1)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558738957 516923231 /nfs/dbraw/zinc/92/32/31/516923231.db2.gz AEFBXJCYXOIGEV-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO CN(Cc1ccc(F)cc1)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558738957 516923237 /nfs/dbraw/zinc/92/32/37/516923237.db2.gz AEFBXJCYXOIGEV-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558742083 516924527 /nfs/dbraw/zinc/92/45/27/516924527.db2.gz WGVXQMJQQUIBQN-UHFFFAOYSA-N 1 1 358.394 2.935 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)CC2)c1 ZINC000532517074 517016957 /nfs/dbraw/zinc/01/69/57/517016957.db2.gz AWUSCLMPLXBGMP-UHFFFAOYSA-N 1 1 365.393 2.742 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969806 517228906 /nfs/dbraw/zinc/22/89/06/517228906.db2.gz BBXUUNWRKRCZMK-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969806 517228917 /nfs/dbraw/zinc/22/89/17/517228917.db2.gz BBXUUNWRKRCZMK-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000537616859 517263373 /nfs/dbraw/zinc/26/33/73/517263373.db2.gz XVCZFGWXGKAQKC-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000537616859 517263384 /nfs/dbraw/zinc/26/33/84/517263384.db2.gz XVCZFGWXGKAQKC-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000556133957 517282705 /nfs/dbraw/zinc/28/27/05/517282705.db2.gz HHBJHTVOZLXFKC-UHFFFAOYSA-N 1 1 361.442 2.891 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000556187825 517308783 /nfs/dbraw/zinc/30/87/83/517308783.db2.gz RKEJYJQMXNSDGE-JTQLQIEISA-N 1 1 358.345 2.754 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+](C)C1 ZINC000559570116 517319079 /nfs/dbraw/zinc/31/90/79/517319079.db2.gz QCJVXMLENBYCHJ-NSHDSACASA-N 1 1 370.247 2.737 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)cc1C ZINC000520268196 517324579 /nfs/dbraw/zinc/32/45/79/517324579.db2.gz APCVRZIWMHUGTE-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000542030231 517346664 /nfs/dbraw/zinc/34/66/64/517346664.db2.gz RGKFLFWBTVVKQR-STQMWFEESA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000520379808 517370040 /nfs/dbraw/zinc/37/00/40/517370040.db2.gz QBVUTBJIDSUSKF-HNNXBMFYSA-N 1 1 368.437 2.570 20 5 FFBDMO C[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000520379808 517370050 /nfs/dbraw/zinc/37/00/50/517370050.db2.gz QBVUTBJIDSUSKF-HNNXBMFYSA-N 1 1 368.437 2.570 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000552984700 517465424 /nfs/dbraw/zinc/46/54/24/517465424.db2.gz AWWFMQJXGKSHOA-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000552984700 517465431 /nfs/dbraw/zinc/46/54/31/517465431.db2.gz AWWFMQJXGKSHOA-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000520898536 517545543 /nfs/dbraw/zinc/54/55/43/517545543.db2.gz CAHKXFJFQOFKJT-KGLIPLIRSA-N 1 1 369.487 2.698 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(CCC)CC[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000553152356 517545607 /nfs/dbraw/zinc/54/56/07/517545607.db2.gz MOXDZSDOVCUWBD-UHFFFAOYSA-N 1 1 351.451 2.609 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cc(-n4ccnc4)cs3)C2)nc1 ZINC000542466686 517581994 /nfs/dbraw/zinc/58/19/94/517581994.db2.gz QIBUAGYWNZXSDF-ZDUSSCGKSA-N 1 1 370.438 2.923 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)[C@@H]2CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496328 517594995 /nfs/dbraw/zinc/59/49/95/517594995.db2.gz KXDRLEYQNHKQKO-LSBZLQRGSA-N 1 1 360.410 2.827 20 5 FFBDMO CC[N@@H+](CCOC)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000521119815 517620559 /nfs/dbraw/zinc/62/05/59/517620559.db2.gz YYEWEDWUWNXPTD-UHFFFAOYSA-N 1 1 364.183 2.668 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000533821148 517628080 /nfs/dbraw/zinc/62/80/80/517628080.db2.gz XPTDVLKFGOKWCV-MRXNPFEDSA-N 1 1 351.366 2.842 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000533821148 517628088 /nfs/dbraw/zinc/62/80/88/517628088.db2.gz XPTDVLKFGOKWCV-MRXNPFEDSA-N 1 1 351.366 2.842 20 5 FFBDMO CCc1[nH]nc(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)c1[N+](=O)[O-] ZINC000553424257 517707102 /nfs/dbraw/zinc/70/71/02/517707102.db2.gz TXAQORIUMDVSTN-UHFFFAOYSA-N 1 1 357.414 2.769 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000534020778 517709568 /nfs/dbraw/zinc/70/95/68/517709568.db2.gz SSKZULORQKJTJW-FUHWJXTLSA-N 1 1 354.410 2.812 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556874433 517721033 /nfs/dbraw/zinc/72/10/33/517721033.db2.gz JUNQNMJRQSMPFS-QAPCUYQASA-N 1 1 357.458 2.882 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000549813502 517723206 /nfs/dbraw/zinc/72/32/06/517723206.db2.gz OZIGVOJUDQLXLP-HUUCEWRRSA-N 1 1 360.385 2.963 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000538709845 517739616 /nfs/dbraw/zinc/73/96/16/517739616.db2.gz XCCNTKKZBXZYOZ-CYBMUJFWSA-N 1 1 368.865 2.820 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000553510882 517755142 /nfs/dbraw/zinc/75/51/42/517755142.db2.gz LVWINVKHUDYBKW-UHFFFAOYSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542921256 517816420 /nfs/dbraw/zinc/81/64/20/517816420.db2.gz ZNHLQSOUVSMXCS-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCCn1ccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000560514373 517864340 /nfs/dbraw/zinc/86/43/40/517864340.db2.gz KLFRRYRJTKYNHZ-QGZVFWFLSA-N 1 1 354.414 2.684 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000534690262 518002172 /nfs/dbraw/zinc/00/21/72/518002172.db2.gz FUWRNLVIYNKVEC-GOSISDBHSA-N 1 1 368.437 2.711 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c21 ZINC000543435060 518089060 /nfs/dbraw/zinc/08/90/60/518089060.db2.gz CTVYKKKYZQINBC-CJNGLKHVSA-N 1 1 353.426 2.991 20 5 FFBDMO Cc1nn(CCC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000522474509 518115343 /nfs/dbraw/zinc/11/53/43/518115343.db2.gz YQBYWRDWFBFJRP-CQSZACIVSA-N 1 1 365.478 2.569 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000566863615 518238471 /nfs/dbraw/zinc/23/84/71/518238471.db2.gz DLMVDXJSMCCYEA-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO C[C@@]1(NC(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000569725658 518260463 /nfs/dbraw/zinc/26/04/63/518260463.db2.gz CYYQUGNPKKSNIS-HXUWFJFHSA-N 1 1 353.422 2.918 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000584416157 518331550 /nfs/dbraw/zinc/33/15/50/518331550.db2.gz OZTYHYORNJXNDO-BETUJISGSA-N 1 1 369.849 2.958 20 5 FFBDMO Cn1c(C(=O)NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000576079158 518417649 /nfs/dbraw/zinc/41/76/49/518417649.db2.gz CIMFXBVEXDLLAI-QGZVFWFLSA-N 1 1 370.453 2.965 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)ccc1[N+](=O)[O-] ZINC000579070720 518503496 /nfs/dbraw/zinc/50/34/96/518503496.db2.gz JNCGATMVDYGCTL-CVEARBPZSA-N 1 1 361.442 2.756 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C[C@@H]21 ZINC000585781917 518595655 /nfs/dbraw/zinc/59/56/55/518595655.db2.gz CXXAPYLQXGSABT-DLBZAZTESA-N 1 1 372.400 2.705 20 5 FFBDMO COC(=O)c1cc(C)nc(NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000587121308 518676221 /nfs/dbraw/zinc/67/62/21/518676221.db2.gz LIGKBCXKTVGIFQ-UHFFFAOYSA-N 1 1 364.446 2.573 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NC[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000570653539 518713101 /nfs/dbraw/zinc/71/31/01/518713101.db2.gz ZALFDOCXMKLFSU-CVEARBPZSA-N 1 1 357.410 2.651 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000565183720 518830145 /nfs/dbraw/zinc/83/01/45/518830145.db2.gz XIGKNLNQYLFXIW-QGZVFWFLSA-N 1 1 369.421 2.742 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CN(c3ccccc3)CCO1)C2 ZINC000582674765 518868675 /nfs/dbraw/zinc/86/86/75/518868675.db2.gz XEPDGDLXPOPIGM-SFHVURJKSA-N 1 1 353.422 2.858 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CN(c3ccccc3)CCO1)C2 ZINC000582674765 518868682 /nfs/dbraw/zinc/86/86/82/518868682.db2.gz XEPDGDLXPOPIGM-SFHVURJKSA-N 1 1 353.422 2.858 20 5 FFBDMO CC(C)(C)c1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000577271010 518999118 /nfs/dbraw/zinc/99/91/18/518999118.db2.gz MYNCIIAZDMWKCH-AWEZNQCLSA-N 1 1 356.430 2.764 20 5 FFBDMO CC(C)(C)c1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000577271010 518999123 /nfs/dbraw/zinc/99/91/23/518999123.db2.gz MYNCIIAZDMWKCH-AWEZNQCLSA-N 1 1 356.430 2.764 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC(CCC[NH+](C)C)CC2)c1 ZINC000589503508 519020532 /nfs/dbraw/zinc/02/05/32/519020532.db2.gz URLVJCMTSMUUMD-UHFFFAOYSA-N 1 1 363.458 2.935 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000589509553 519021473 /nfs/dbraw/zinc/02/14/73/519021473.db2.gz YGVNQMXWQBBIGB-ZBFHGGJFSA-N 1 1 350.415 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000589509553 519021478 /nfs/dbraw/zinc/02/14/78/519021478.db2.gz YGVNQMXWQBBIGB-ZBFHGGJFSA-N 1 1 350.415 2.610 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000577578152 519146889 /nfs/dbraw/zinc/14/68/89/519146889.db2.gz XIPZSBRWXGJKGQ-MRXNPFEDSA-N 1 1 371.441 2.727 20 5 FFBDMO CC1(C)C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000577591026 519156047 /nfs/dbraw/zinc/15/60/47/519156047.db2.gz DNMPZTIBBYRFKU-JKSUJKDBSA-N 1 1 352.456 2.879 20 5 FFBDMO CC1(C)C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000577591026 519156053 /nfs/dbraw/zinc/15/60/53/519156053.db2.gz DNMPZTIBBYRFKU-JKSUJKDBSA-N 1 1 352.456 2.879 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC000590169113 519165502 /nfs/dbraw/zinc/16/55/02/519165502.db2.gz JKOFBQZDBLIYEZ-AWEZNQCLSA-N 1 1 359.348 2.520 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[C@@H]4C[N@@H+](C)C[C@H]43)cc2[N+](=O)[O-])CC1 ZINC000590446587 519235868 /nfs/dbraw/zinc/23/58/68/519235868.db2.gz UWQQAOQUKZOFNY-VQIMIIECSA-N 1 1 372.469 2.607 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000580656755 519288722 /nfs/dbraw/zinc/28/87/22/519288722.db2.gz FFVOGGAYXMPJKW-WBVHZDCISA-N 1 1 357.410 2.527 20 5 FFBDMO COc1cc(C(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000590625439 519293507 /nfs/dbraw/zinc/29/35/07/519293507.db2.gz BEZPOTGJGUFLGF-UHFFFAOYSA-N 1 1 367.421 2.935 20 5 FFBDMO CC1(C)CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC[N@H+]1CCO ZINC000590698678 519322526 /nfs/dbraw/zinc/32/25/26/519322526.db2.gz LMXGSFXXAMXSNQ-UHFFFAOYSA-N 1 1 362.455 2.611 20 5 FFBDMO Cc1ccc(-c2noc(C[NH+]3CCC(n4ccc([N+](=O)[O-])n4)CC3)n2)cc1 ZINC000578003268 519364679 /nfs/dbraw/zinc/36/46/79/519364679.db2.gz IOMMGJAJJCMHMF-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213714 519372266 /nfs/dbraw/zinc/37/22/66/519372266.db2.gz BZBIQCMSNKNVSG-RISCZKNCSA-N 1 1 364.427 2.770 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213714 519372269 /nfs/dbraw/zinc/37/22/69/519372269.db2.gz BZBIQCMSNKNVSG-RISCZKNCSA-N 1 1 364.427 2.770 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC[C@H](C)C1 ZINC000578030768 519381610 /nfs/dbraw/zinc/38/16/10/519381610.db2.gz PTXDBFLVOWLZIB-JTQLQIEISA-N 1 1 370.247 2.737 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000574967514 519428030 /nfs/dbraw/zinc/42/80/30/519428030.db2.gz MXGLFMKUKRYLNJ-AWEZNQCLSA-N 1 1 354.838 2.526 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3ccncn3)CC2)c1 ZINC000591261368 519563819 /nfs/dbraw/zinc/56/38/19/519563819.db2.gz WOLYXAPMFWYETL-UHFFFAOYSA-N 1 1 356.382 2.551 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594418462 519954489 /nfs/dbraw/zinc/95/44/89/519954489.db2.gz JFHOKYFIEFUCNC-ROUUACIJSA-N 1 1 360.458 2.920 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H](C)[N@H+]1C ZINC000599975125 519981287 /nfs/dbraw/zinc/98/12/87/519981287.db2.gz JUOCYQOPDOYDFQ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000599975125 519981296 /nfs/dbraw/zinc/98/12/96/519981296.db2.gz JUOCYQOPDOYDFQ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612528997 520005343 /nfs/dbraw/zinc/00/53/43/520005343.db2.gz YKFHWQRAIJKLBZ-GHMZBOCLSA-N 1 1 357.332 2.970 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC2CC2)C[C@@H]1C ZINC000597407061 520006264 /nfs/dbraw/zinc/00/62/64/520006264.db2.gz QVTXGDQGAAYCRF-AWEZNQCLSA-N 1 1 370.457 2.794 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000602997444 520012875 /nfs/dbraw/zinc/01/28/75/520012875.db2.gz JXRUGUZBSPVZQT-SZMVWBNQSA-N 1 1 361.442 2.857 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N(C)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000594575567 520036371 /nfs/dbraw/zinc/03/63/71/520036371.db2.gz KMEQARLHSVAUNL-HXUWFJFHSA-N 1 1 371.437 2.677 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000600182406 520106985 /nfs/dbraw/zinc/10/69/85/520106985.db2.gz BICPVEZLZLWWJH-VXGBXAGGSA-N 1 1 372.368 2.870 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597575938 520113844 /nfs/dbraw/zinc/11/38/44/520113844.db2.gz AIKIZBPSPAOAGU-STQMWFEESA-N 1 1 355.797 2.815 20 5 FFBDMO CSc1cccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)c1[N+](=O)[O-] ZINC000597580445 520118109 /nfs/dbraw/zinc/11/81/09/520118109.db2.gz OSDJVPXOVUOLIA-CHWSQXEVSA-N 1 1 353.419 2.575 20 5 FFBDMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597584909 520120102 /nfs/dbraw/zinc/12/01/02/520120102.db2.gz YKQRPVAZFUSQAI-HOTGVXAUSA-N 1 1 367.396 2.656 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000597604755 520130840 /nfs/dbraw/zinc/13/08/40/520130840.db2.gz KFIKXRAZOPWMJQ-CYBMUJFWSA-N 1 1 370.247 2.914 20 5 FFBDMO CN(CC(=O)NC[C@H]1CC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000600229083 520139885 /nfs/dbraw/zinc/13/98/85/520139885.db2.gz OPKRSBYJJYMMPS-MRXNPFEDSA-N 1 1 360.458 2.554 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000600299248 520188547 /nfs/dbraw/zinc/18/85/47/520188547.db2.gz RQWNQWVTYIIPDE-KRWDZBQOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000600299248 520188554 /nfs/dbraw/zinc/18/85/54/520188554.db2.gz RQWNQWVTYIIPDE-KRWDZBQOSA-N 1 1 355.394 2.608 20 5 FFBDMO O=C([C@H]1CCc2[nH]cnc2C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597723652 520197433 /nfs/dbraw/zinc/19/74/33/520197433.db2.gz MDJIZNAOWZUZBK-LSDHHAIUSA-N 1 1 354.410 2.829 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC1(N2CCCC2)CCOCC1 ZINC000595012861 520256377 /nfs/dbraw/zinc/25/63/77/520256377.db2.gz PJDILMGHFUKASL-HNNXBMFYSA-N 1 1 363.458 2.899 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)N(C)C ZINC000595015381 520256773 /nfs/dbraw/zinc/25/67/73/520256773.db2.gz DEXNOHVNCOFEHD-KDOFPFPSSA-N 1 1 371.437 2.954 20 5 FFBDMO Cn1ccnc1[C@@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056502 520272280 /nfs/dbraw/zinc/27/22/80/520272280.db2.gz KAFKUOFDGUBJCL-RDJZCZTQSA-N 1 1 357.458 2.880 20 5 FFBDMO CCOc1cccc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000609314355 520273894 /nfs/dbraw/zinc/27/38/94/520273894.db2.gz PLJJRLRLIAUPGU-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000597853496 520282357 /nfs/dbraw/zinc/28/23/57/520282357.db2.gz BDVOGGDRINHQKZ-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1ccnc(C[NH2+][C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1F ZINC000595081617 520284136 /nfs/dbraw/zinc/28/41/36/520284136.db2.gz SULMVTPAOJLOTQ-NSHDSACASA-N 1 1 362.361 2.644 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1 ZINC000603612274 520328180 /nfs/dbraw/zinc/32/81/80/520328180.db2.gz ZDMKBJLIYVQGJN-UHFFFAOYSA-N 1 1 356.426 2.590 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N2CC[NH+](CCOc3ccccc3)CC2)c1 ZINC000609494846 520333726 /nfs/dbraw/zinc/33/37/26/520333726.db2.gz MYGXKHFUMQHLLS-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO COc1ccc(CC(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000609506094 520337189 /nfs/dbraw/zinc/33/71/89/520337189.db2.gz CHDQDYDJJSWXSD-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287698 520386410 /nfs/dbraw/zinc/38/64/10/520386410.db2.gz VIXHHURGLCPYJH-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287698 520386420 /nfs/dbraw/zinc/38/64/20/520386420.db2.gz VIXHHURGLCPYJH-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC000609668961 520401366 /nfs/dbraw/zinc/40/13/66/520401366.db2.gz HWEWMQSVHGBPJN-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO COCC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000609766399 520425764 /nfs/dbraw/zinc/42/57/64/520425764.db2.gz HOFDZMPVUOJVGF-UHFFFAOYSA-N 1 1 363.414 2.784 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3COCC[NH2+]3)o2)c(Cl)c1 ZINC000600777629 520462409 /nfs/dbraw/zinc/46/24/09/520462409.db2.gz VNGQIABLTOZGIC-NSHDSACASA-N 1 1 351.790 2.586 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439689 520471613 /nfs/dbraw/zinc/47/16/13/520471613.db2.gz KCMCNHWRIFMGTP-RHSMWYFYSA-N 1 1 353.438 2.961 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000595439688 520472032 /nfs/dbraw/zinc/47/20/32/520472032.db2.gz KCMCNHWRIFMGTP-PBHICJAKSA-N 1 1 353.438 2.961 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@@H]2C)n1 ZINC000617408085 520480210 /nfs/dbraw/zinc/48/02/10/520480210.db2.gz ZAKFFWFAPVCHIR-HNNXBMFYSA-N 1 1 371.441 2.548 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000598195847 520486782 /nfs/dbraw/zinc/48/67/82/520486782.db2.gz UPDPVYQBEMYTOM-QGZVFWFLSA-N 1 1 353.422 2.984 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000598220478 520501344 /nfs/dbraw/zinc/50/13/44/520501344.db2.gz PSRPJZQBFHDQMI-GFCCVEGCSA-N 1 1 357.414 2.608 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000598220478 520501353 /nfs/dbraw/zinc/50/13/53/520501353.db2.gz PSRPJZQBFHDQMI-GFCCVEGCSA-N 1 1 357.414 2.608 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000598220478 520501359 /nfs/dbraw/zinc/50/13/59/520501359.db2.gz PSRPJZQBFHDQMI-GFCCVEGCSA-N 1 1 357.414 2.608 20 5 FFBDMO O=C(NCC[NH+]1Cc2ccccc2C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000604481340 520573803 /nfs/dbraw/zinc/57/38/03/520573803.db2.gz GZAXSZRVQSVXHV-UHFFFAOYSA-N 1 1 350.378 2.822 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000592880352 520631007 /nfs/dbraw/zinc/63/10/07/520631007.db2.gz HCGGRBROGJUCLL-QAPCUYQASA-N 1 1 369.421 2.679 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507407 520664488 /nfs/dbraw/zinc/66/44/88/520664488.db2.gz ANQKLZMYKWDNSH-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507407 520664493 /nfs/dbraw/zinc/66/44/93/520664493.db2.gz ANQKLZMYKWDNSH-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO C[C@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422074 520675606 /nfs/dbraw/zinc/67/56/06/520675606.db2.gz UQBGJHKCKVKUQR-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422074 520675620 /nfs/dbraw/zinc/67/56/20/520675620.db2.gz UQBGJHKCKVKUQR-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000601183151 520675693 /nfs/dbraw/zinc/67/56/93/520675693.db2.gz AGGBSJPQMMNTLM-UKRRQHHQSA-N 1 1 367.421 2.601 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000601185701 520677005 /nfs/dbraw/zinc/67/70/05/520677005.db2.gz ZFGXYKVHGFLLBY-LLVKDONJSA-N 1 1 350.806 2.715 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000593015286 520686484 /nfs/dbraw/zinc/68/64/84/520686484.db2.gz QICCAKZMGRFUOI-GOSISDBHSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000593015286 520686493 /nfs/dbraw/zinc/68/64/93/520686493.db2.gz QICCAKZMGRFUOI-GOSISDBHSA-N 1 1 357.385 2.792 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598561396 520706986 /nfs/dbraw/zinc/70/69/86/520706986.db2.gz QLPNDVMVEIXGPN-INIZCTEOSA-N 1 1 370.453 2.788 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC(c3[nH]cc[nH+]3)CC2)c(Br)c1 ZINC000610512430 520721954 /nfs/dbraw/zinc/72/19/54/520721954.db2.gz INMFQOCUOSGCNH-UHFFFAOYSA-N 1 1 352.192 2.859 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595789781 520727976 /nfs/dbraw/zinc/72/79/76/520727976.db2.gz OHLNPJXXKVBKFV-QFBILLFUSA-N 1 1 373.453 2.765 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598595252 520731798 /nfs/dbraw/zinc/73/17/98/520731798.db2.gz HGYSOLPWSYFZIK-ZDUSSCGKSA-N 1 1 358.398 2.709 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000595801029 520735073 /nfs/dbraw/zinc/73/50/73/520735073.db2.gz VPZARTFIKBNQEY-IAGOWNOFSA-N 1 1 360.458 2.968 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000598612512 520742325 /nfs/dbraw/zinc/74/23/25/520742325.db2.gz QABNONDTEPFOBP-UKRRQHHQSA-N 1 1 369.487 2.562 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000598627701 520751314 /nfs/dbraw/zinc/75/13/14/520751314.db2.gz XQUMAXHIDPYDHV-BBRMVZONSA-N 1 1 370.409 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1 ZINC000595864299 520776995 /nfs/dbraw/zinc/77/69/95/520776995.db2.gz SEQNYZGNVSXFJL-OAHLLOKOSA-N 1 1 373.375 2.645 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595875153 520782506 /nfs/dbraw/zinc/78/25/06/520782506.db2.gz PUUKXAOPVDVDSO-HWPZZCPQSA-N 1 1 360.357 2.655 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601446711 520790710 /nfs/dbraw/zinc/79/07/10/520790710.db2.gz AQPFDIILWLMOTE-XJKSGUPXSA-N 1 1 357.385 2.984 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3cccnc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000610677926 520793658 /nfs/dbraw/zinc/79/36/58/520793658.db2.gz HYEALHORXLTWLO-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO CCOc1ccc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)nn1 ZINC000595890481 520797641 /nfs/dbraw/zinc/79/76/41/520797641.db2.gz HNAWQWJDUDJKAI-HNNXBMFYSA-N 1 1 371.441 2.975 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907679 520813616 /nfs/dbraw/zinc/81/36/16/520813616.db2.gz CUNIGEZLBXIQDI-ZOCIIQOWSA-N 1 1 359.426 2.814 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCOC(C)(C)C ZINC000610859928 520877188 /nfs/dbraw/zinc/87/71/88/520877188.db2.gz WAOCHTDMQQXTSZ-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593320602 520907760 /nfs/dbraw/zinc/90/77/60/520907760.db2.gz UKQNFIGHSHNRSN-SFHVURJKSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593320602 520907772 /nfs/dbraw/zinc/90/77/72/520907772.db2.gz UKQNFIGHSHNRSN-SFHVURJKSA-N 1 1 371.412 2.662 20 5 FFBDMO O=c1[nH]ccc(N2CCC[N@@H+](CCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000596108447 520917841 /nfs/dbraw/zinc/91/78/41/520917841.db2.gz CETREHZMPVHVMW-UHFFFAOYSA-N 1 1 356.426 2.840 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)C[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000596129087 520929626 /nfs/dbraw/zinc/92/96/26/520929626.db2.gz MGLYRKODWIUGPM-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596144620 520936273 /nfs/dbraw/zinc/93/62/73/520936273.db2.gz MEJPZYZSYBAUTH-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000596178582 520954557 /nfs/dbraw/zinc/95/45/57/520954557.db2.gz HUUJSIVOFSTACI-UHFFFAOYSA-N 1 1 352.435 2.523 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000593387992 520958936 /nfs/dbraw/zinc/95/89/36/520958936.db2.gz YFSQOZNEXAQYTQ-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000611087788 520979947 /nfs/dbraw/zinc/97/99/47/520979947.db2.gz KJNFATZNNOXLOM-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000611087788 520979955 /nfs/dbraw/zinc/97/99/55/520979955.db2.gz KJNFATZNNOXLOM-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000611092341 520981140 /nfs/dbraw/zinc/98/11/40/520981140.db2.gz QNELBSOAYFUYCL-LLVKDONJSA-N 1 1 359.373 2.731 20 5 FFBDMO O=[N+]([O-])c1cc2c(nc1N1CCC([N@H+]3CCCOCC3)CC1)CCCC2 ZINC000596268586 521001783 /nfs/dbraw/zinc/00/17/83/521001783.db2.gz MSSQODBLMGMISR-UHFFFAOYSA-N 1 1 360.458 2.560 20 5 FFBDMO Cc1cn2c([nH+]1)C[C@H](c1nc(CCNc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000599129543 521044972 /nfs/dbraw/zinc/04/49/72/521044972.db2.gz DIXYBRBCQKNZIU-CYBMUJFWSA-N 1 1 368.397 2.867 20 5 FFBDMO CCc1nn(C)c(N2CC[C@H]([N@@H+](C)CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596462833 521085540 /nfs/dbraw/zinc/08/55/40/521085540.db2.gz UVICJZPARVXYHO-INIZCTEOSA-N 1 1 357.458 2.644 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000611442873 521161181 /nfs/dbraw/zinc/16/11/81/521161181.db2.gz ZITQYCVBNICZRM-UHFFFAOYSA-N 1 1 363.849 2.571 20 5 FFBDMO Cc1ncc(-c2ccc(OCCN3CCN(C)CC3)cc2)cc1[N+](=O)[O-] ZINC000596628382 521174937 /nfs/dbraw/zinc/17/49/37/521174937.db2.gz ONDBOTBALQCEIM-UHFFFAOYSA-N 1 1 356.426 2.591 20 5 FFBDMO Cc1ncc(-c2ccc(OCC[NH+]3CCN(C)CC3)cc2)cc1[N+](=O)[O-] ZINC000596628382 521174947 /nfs/dbraw/zinc/17/49/47/521174947.db2.gz ONDBOTBALQCEIM-UHFFFAOYSA-N 1 1 356.426 2.591 20 5 FFBDMO COc1cc(C[N@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)ccc1[N+](=O)[O-] ZINC000599396257 521198348 /nfs/dbraw/zinc/19/83/48/521198348.db2.gz SJIHPLUEYBKFBP-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1cc(C[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)ccc1[N+](=O)[O-] ZINC000599396257 521198358 /nfs/dbraw/zinc/19/83/58/521198358.db2.gz SJIHPLUEYBKFBP-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000618898224 521283158 /nfs/dbraw/zinc/28/31/58/521283158.db2.gz KMFPHHBQQVOIQX-UHFFFAOYSA-N 1 1 371.393 2.575 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000596833063 521318858 /nfs/dbraw/zinc/31/88/58/521318858.db2.gz VJPPDEJIJVBHEC-GFCCVEGCSA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cn1 ZINC000593970321 521320835 /nfs/dbraw/zinc/32/08/35/521320835.db2.gz QSVDTDIMRLMIMP-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO CCOCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCc2ccccc21 ZINC000599624389 521340276 /nfs/dbraw/zinc/34/02/76/521340276.db2.gz DJLZDMJXDPWWMT-LJQANCHMSA-N 1 1 371.437 2.783 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2c(O)cccc2C1 ZINC000599646935 521356578 /nfs/dbraw/zinc/35/65/78/521356578.db2.gz NAQBVHZAJAXBEG-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[NH+](CCCF)CC1 ZINC000599666676 521379265 /nfs/dbraw/zinc/37/92/65/521379265.db2.gz AXHJUIBGVQRGMT-CYBMUJFWSA-N 1 1 363.393 2.683 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599668511 521381812 /nfs/dbraw/zinc/38/18/12/521381812.db2.gz GPMIEKQWFLUZBP-UHFFFAOYSA-N 1 1 363.458 2.550 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594198138 521465255 /nfs/dbraw/zinc/46/52/55/521465255.db2.gz SJRNZFFUGYKQCH-HOTGVXAUSA-N 1 1 351.834 2.924 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(Cc3cc(Br)c([N+](=O)[O-])s3)C2)C1 ZINC000602670638 521472021 /nfs/dbraw/zinc/47/20/21/521472021.db2.gz AXUBEWUDUXNMMI-CYBMUJFWSA-N 1 1 360.277 2.946 20 5 FFBDMO CC[C@@H](C)C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(=O)OC ZINC000602702037 521485981 /nfs/dbraw/zinc/48/59/81/521485981.db2.gz MWLMKTQSKWJVTF-CZUORRHYSA-N 1 1 364.446 2.526 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597089476 521493822 /nfs/dbraw/zinc/49/38/22/521493822.db2.gz BJEJODVUNXJKAX-LLVKDONJSA-N 1 1 355.826 2.778 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000599831193 521500114 /nfs/dbraw/zinc/50/01/14/521500114.db2.gz PQNDBQBVFYTTCI-OLZOCXBDSA-N 1 1 355.398 2.891 20 5 FFBDMO O=C1[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CCN1C1CCC1 ZINC000602732141 521501390 /nfs/dbraw/zinc/50/13/90/521501390.db2.gz ZQYWWHSDZAFORP-LLVKDONJSA-N 1 1 374.260 2.662 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000602786782 521531095 /nfs/dbraw/zinc/53/10/95/521531095.db2.gz YAWOOOLJMFGSFG-DTORHVGOSA-N 1 1 360.258 2.772 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000602786782 521531099 /nfs/dbraw/zinc/53/10/99/521531099.db2.gz YAWOOOLJMFGSFG-DTORHVGOSA-N 1 1 360.258 2.772 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000615835650 521552569 /nfs/dbraw/zinc/55/25/69/521552569.db2.gz XVAUGACNKLJICN-MBGNVJMVSA-N 1 1 358.486 2.710 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000615835653 521552615 /nfs/dbraw/zinc/55/26/15/521552615.db2.gz XVAUGACNKLJICN-XMJIKXADSA-N 1 1 358.486 2.710 20 5 FFBDMO COc1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000619440574 521568433 /nfs/dbraw/zinc/56/84/33/521568433.db2.gz HPWOAFFYUJKXSC-CJNGLKHVSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)[C@@H](CNc1nc2ccccc2cc1[N+](=O)[O-])N1CC[NH+](C)CC1 ZINC000473512898 561051592 /nfs/dbraw/zinc/05/15/92/561051592.db2.gz JLGTUKYYRPFGHN-GOSISDBHSA-N 1 1 357.458 2.827 20 5 FFBDMO C[C@H](c1ccc(-c2nn[nH]n2)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000824764547 607942715 /nfs/dbraw/zinc/94/27/15/607942715.db2.gz XFWOLUUOBSIMEG-GFCCVEGCSA-N 1 1 350.382 2.894 20 5 FFBDMO C[C@H](c1ccc(-c2nn[nH]n2)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000824764547 607942716 /nfs/dbraw/zinc/94/27/16/607942716.db2.gz XFWOLUUOBSIMEG-GFCCVEGCSA-N 1 1 350.382 2.894 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1-c1nn[nH]n1 ZINC000826202919 608132995 /nfs/dbraw/zinc/13/29/95/608132995.db2.gz SMSDFCLNTRESPG-UHFFFAOYSA-N 1 1 374.788 2.727 20 5 FFBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(-c2nn[nH]n2)c1 ZINC000824633266 608487423 /nfs/dbraw/zinc/48/74/23/608487423.db2.gz JLPFBHFHNVNIDA-JTQLQIEISA-N 1 1 365.353 2.767 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164722050 720394774 /nfs/dbraw/zinc/39/47/74/720394774.db2.gz BTWYRVZYWUBDOB-IRXDYDNUSA-N 1 1 353.426 2.855 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932512 721855081 /nfs/dbraw/zinc/85/50/81/721855081.db2.gz YNOSJQLJNVGIQI-RBUKOAKNSA-N 1 1 369.469 2.666 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932512 721855083 /nfs/dbraw/zinc/85/50/83/721855083.db2.gz YNOSJQLJNVGIQI-RBUKOAKNSA-N 1 1 369.469 2.666 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[NH+](CCOc3ccccc3)CC2)n1 ZINC001165045598 721955326 /nfs/dbraw/zinc/95/53/26/721955326.db2.gz XFEPJSUBYNFZAB-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Nc1cc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ncc1[N+](=O)[O-] ZINC001164997329 722202938 /nfs/dbraw/zinc/20/29/38/722202938.db2.gz ZOISBROKBCEKJJ-IBGZPJMESA-N 1 1 371.416 2.956 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000073194660 728218553 /nfs/dbraw/zinc/21/85/53/728218553.db2.gz MJJLWXFZQZPSAM-ZDUSSCGKSA-N 1 1 356.806 2.762 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188165 728558979 /nfs/dbraw/zinc/55/89/79/728558979.db2.gz BZTHEOWJCCDCKK-DZGCQCFKSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188165 728558982 /nfs/dbraw/zinc/55/89/82/728558982.db2.gz BZTHEOWJCCDCKK-DZGCQCFKSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000127170424 728705632 /nfs/dbraw/zinc/70/56/32/728705632.db2.gz JGDLQRSBUHXIER-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@H](O)c3ccccc3Cl)C2)nc1 ZINC000173470860 729048093 /nfs/dbraw/zinc/04/80/93/729048093.db2.gz ZKVQGLNERAVNEA-LRDDRELGSA-N 1 1 362.817 2.863 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000174864252 729081569 /nfs/dbraw/zinc/08/15/69/729081569.db2.gz NNYUZMXWPYUWLB-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000174864252 729081572 /nfs/dbraw/zinc/08/15/72/729081572.db2.gz NNYUZMXWPYUWLB-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000178007579 729151996 /nfs/dbraw/zinc/15/19/96/729151996.db2.gz NFDWZWPIYVCVNC-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000860097549 730476056 /nfs/dbraw/zinc/47/60/56/730476056.db2.gz PMPRABNXDOIWDL-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000860097549 730476057 /nfs/dbraw/zinc/47/60/57/730476057.db2.gz PMPRABNXDOIWDL-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000861786955 730641589 /nfs/dbraw/zinc/64/15/89/730641589.db2.gz WBAZALGNFUXAHC-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000862529477 730706951 /nfs/dbraw/zinc/70/69/51/730706951.db2.gz SYAMWBLYTFQDIH-XHDPSFHLSA-N 1 1 355.232 2.952 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000862529477 730706953 /nfs/dbraw/zinc/70/69/53/730706953.db2.gz SYAMWBLYTFQDIH-XHDPSFHLSA-N 1 1 355.232 2.952 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNc2cc(F)c([N+](=O)[O-])cc2CO)C[C@H](C)O1 ZINC000865426048 730953188 /nfs/dbraw/zinc/95/31/88/730953188.db2.gz ZNGDRJPVDBMGPP-TXEJJXNPSA-N 1 1 355.410 2.526 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2cc(F)c([N+](=O)[O-])cc2CO)C[C@H](C)O1 ZINC000865426048 730953189 /nfs/dbraw/zinc/95/31/89/730953189.db2.gz ZNGDRJPVDBMGPP-TXEJJXNPSA-N 1 1 355.410 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)N1CCN(C)CC1 ZINC000872033406 731722458 /nfs/dbraw/zinc/72/24/58/731722458.db2.gz GRCLEUJSUHOTJM-KGLIPLIRSA-N 1 1 352.504 2.603 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000874830731 732104778 /nfs/dbraw/zinc/10/47/78/732104778.db2.gz SSOOZDBWODIGQO-KGLIPLIRSA-N 1 1 355.797 2.625 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000874831656 732105216 /nfs/dbraw/zinc/10/52/16/732105216.db2.gz ADNZDQMANBLELV-VXGBXAGGSA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000874839248 732106368 /nfs/dbraw/zinc/10/63/68/732106368.db2.gz UPBQAJVRTYQZAX-KGLIPLIRSA-N 1 1 367.833 2.712 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000878174958 732493567 /nfs/dbraw/zinc/49/35/67/732493567.db2.gz VPFNSNXRVBUXTM-UONOGXRCSA-N 1 1 350.444 2.749 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000879560717 732723248 /nfs/dbraw/zinc/72/32/48/732723248.db2.gz IFHZXQDTTFTUMD-STQMWFEESA-N 1 1 365.455 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C2CCOCC2)cc1Cl ZINC000885889162 733726542 /nfs/dbraw/zinc/72/65/42/733726542.db2.gz YFJVOXCYXOIXPX-CYBMUJFWSA-N 1 1 367.833 2.540 20 5 FFBDMO CCCN(C(=O)Nc1ccc([N+](=O)[O-])c(OCC)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000888831333 734103489 /nfs/dbraw/zinc/10/34/89/734103489.db2.gz JCGFAXFGKMWVCM-CQSZACIVSA-N 1 1 350.419 2.942 20 5 FFBDMO CN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000894047149 734792603 /nfs/dbraw/zinc/79/26/03/734792603.db2.gz HOZDJJAQPZSHNS-AWEZNQCLSA-N 1 1 354.838 2.526 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000895888346 735070528 /nfs/dbraw/zinc/07/05/28/735070528.db2.gz SUTYLFQGBNMEHO-SSDOTTSWSA-N 1 1 350.177 2.865 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000749561902 735731477 /nfs/dbraw/zinc/73/14/77/735731477.db2.gz QOYJDUBXPUOMQY-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(NC(=S)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1 ZINC000763129420 736904421 /nfs/dbraw/zinc/90/44/21/736904421.db2.gz MGYMMSNZKMLIEF-JKSUJKDBSA-N 1 1 364.471 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc(NC(=S)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1 ZINC000763129411 736904472 /nfs/dbraw/zinc/90/44/72/736904472.db2.gz MGYMMSNZKMLIEF-HOTGVXAUSA-N 1 1 364.471 2.525 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000801864686 740659433 /nfs/dbraw/zinc/65/94/33/740659433.db2.gz PXWXJTUOAKZUHH-GFCCVEGCSA-N 1 1 352.410 2.701 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@H](C)C1 ZINC000910285295 737052825 /nfs/dbraw/zinc/05/28/25/737052825.db2.gz XDKHXKAAVPVQTK-LLVKDONJSA-N 1 1 357.357 2.753 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC000766557949 737242117 /nfs/dbraw/zinc/24/21/17/737242117.db2.gz WYPLRSMUTRQNOJ-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2[C@@H](C)CCC[C@H]2CC[NH+](C)C)c1[N+](=O)[O-] ZINC000912650115 737327574 /nfs/dbraw/zinc/32/75/74/737327574.db2.gz IENIDKPWAODAPC-STQMWFEESA-N 1 1 351.451 2.776 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913384826 737396658 /nfs/dbraw/zinc/39/66/58/737396658.db2.gz HRUKDKNXVPUQAC-UHFFFAOYSA-N 1 1 373.812 2.506 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001881 737589216 /nfs/dbraw/zinc/58/92/16/737589216.db2.gz MQTAYPIYWVVYJP-FUHWJXTLSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001881 737589219 /nfs/dbraw/zinc/58/92/19/737589219.db2.gz MQTAYPIYWVVYJP-FUHWJXTLSA-N 1 1 350.415 2.826 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000770103065 737596823 /nfs/dbraw/zinc/59/68/23/737596823.db2.gz NIMJNCWYFVNSSY-AWEZNQCLSA-N 1 1 352.866 2.773 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000771762312 737753395 /nfs/dbraw/zinc/75/33/95/737753395.db2.gz OCSOSCYBOWEZPE-QWHCGFSZSA-N 1 1 373.450 2.536 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000772001740 737774766 /nfs/dbraw/zinc/77/47/66/737774766.db2.gz OFVGHNHZXXPVRR-UHFFFAOYSA-N 1 1 368.187 2.648 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)o1)c1cccc([N+](=O)[O-])c1 ZINC000775537558 738100363 /nfs/dbraw/zinc/10/03/63/738100363.db2.gz ABLNKFWBXCCISA-OAHLLOKOSA-N 1 1 367.427 2.679 20 5 FFBDMO CC(C)[C@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385382 738134900 /nfs/dbraw/zinc/13/49/00/738134900.db2.gz ASZDZKJNAYTHMH-TVFCKZIOSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385382 738134903 /nfs/dbraw/zinc/13/49/03/738134903.db2.gz ASZDZKJNAYTHMH-TVFCKZIOSA-N 1 1 367.877 2.818 20 5 FFBDMO C[C@@H](CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000778237135 738365615 /nfs/dbraw/zinc/36/56/15/738365615.db2.gz SWUMTKQWJZSJRH-MNOVXSKESA-N 1 1 363.443 2.592 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)c1 ZINC000929494357 738992662 /nfs/dbraw/zinc/99/26/62/738992662.db2.gz LBNGNHXMEWUFEV-LLVKDONJSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c1 ZINC000929494357 738992666 /nfs/dbraw/zinc/99/26/66/738992666.db2.gz LBNGNHXMEWUFEV-LLVKDONJSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CC[C@H](C(F)(F)F)O3)C2)nc1 ZINC000929986649 739045629 /nfs/dbraw/zinc/04/56/29/739045629.db2.gz IDLZNCHOFBODIA-RAIGVLPGSA-N 1 1 360.336 2.586 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@H]1C ZINC000787238112 739117355 /nfs/dbraw/zinc/11/73/55/739117355.db2.gz ITSRSBZRTNAZQA-GXSJLCMTSA-N 1 1 351.384 2.713 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@H]1C ZINC000787238112 739117357 /nfs/dbraw/zinc/11/73/57/739117357.db2.gz ITSRSBZRTNAZQA-GXSJLCMTSA-N 1 1 351.384 2.713 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000931118485 739214673 /nfs/dbraw/zinc/21/46/73/739214673.db2.gz UJTCMQQDTUJFLB-AWEZNQCLSA-N 1 1 351.422 2.903 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000931296889 739239921 /nfs/dbraw/zinc/23/99/21/739239921.db2.gz CNUAPDRCVYHAMQ-LBPRGKRZSA-N 1 1 368.821 2.623 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000790912662 739512444 /nfs/dbraw/zinc/51/24/44/739512444.db2.gz XXEXAOOPHYJDFG-WDEREUQCSA-N 1 1 357.813 2.871 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000933247629 739588723 /nfs/dbraw/zinc/58/87/23/739588723.db2.gz HKPIZSBISULGHU-AWEZNQCLSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@H](C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000791930077 739617438 /nfs/dbraw/zinc/61/74/38/739617438.db2.gz KEAGSTRFHGXCRN-GRYCIOLGSA-N 1 1 351.359 2.808 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933436614 739624762 /nfs/dbraw/zinc/62/47/62/739624762.db2.gz USEFGVWPLFOPOW-DOMZBBRYSA-N 1 1 353.850 2.979 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCSC[C@@H]1C1CC1 ZINC000933913389 739704026 /nfs/dbraw/zinc/70/40/26/739704026.db2.gz BUXXPFXRIBICBI-GDBMZVCRSA-N 1 1 352.456 2.552 20 5 FFBDMO O=C1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)CCCCCN1 ZINC000934156062 739737332 /nfs/dbraw/zinc/73/73/32/739737332.db2.gz IVEQRJBPPCARDL-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000934951152 739870911 /nfs/dbraw/zinc/87/09/11/739870911.db2.gz NNUXRNIYRCPGHQ-CABZTGNLSA-N 1 1 370.812 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000935685972 739994204 /nfs/dbraw/zinc/99/42/04/739994204.db2.gz JBODGVCAQPCLOC-KGLIPLIRSA-N 1 1 353.419 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H](N2CCOCC2)C(F)(F)F)c1 ZINC000796517392 740149495 /nfs/dbraw/zinc/14/94/95/740149495.db2.gz WFFSGUJJRGXGNG-ZDUSSCGKSA-N 1 1 367.755 2.601 20 5 FFBDMO CN(C)C(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796548520 740152059 /nfs/dbraw/zinc/15/20/59/740152059.db2.gz NIDAUGKSAYPPHU-OAHLLOKOSA-N 1 1 351.403 2.526 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C ZINC000803496163 740804395 /nfs/dbraw/zinc/80/43/95/740804395.db2.gz XOWFEBUHLMWUTH-YGRLFVJLSA-N 1 1 371.821 2.705 20 5 FFBDMO Cc1ccc(N2CC[NH+]([C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br ZINC000804561641 740884348 /nfs/dbraw/zinc/88/43/48/740884348.db2.gz NJWJGHAHXHNPBE-GFCCVEGCSA-N 1 1 370.247 2.577 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000809920537 741360985 /nfs/dbraw/zinc/36/09/85/741360985.db2.gz VLTBHROCQCWOEV-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000809920537 741360986 /nfs/dbraw/zinc/36/09/86/741360986.db2.gz VLTBHROCQCWOEV-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000809982021 741369220 /nfs/dbraw/zinc/36/92/20/741369220.db2.gz FOBHJCXRQWGUNY-MNOVXSKESA-N 1 1 362.257 2.789 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCSC1 ZINC000813171143 741684584 /nfs/dbraw/zinc/68/45/84/741684584.db2.gz DOZPYWZZKFFNND-ZBFHGGJFSA-N 1 1 350.440 2.856 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCSC1 ZINC000813171143 741684585 /nfs/dbraw/zinc/68/45/85/741684585.db2.gz DOZPYWZZKFFNND-ZBFHGGJFSA-N 1 1 350.440 2.856 20 5 FFBDMO CC1(C)CCC(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001001400015 742118666 /nfs/dbraw/zinc/11/86/66/742118666.db2.gz PIGPVRNAMBVUNO-IAGOWNOFSA-N 1 1 351.491 2.696 20 5 FFBDMO C[C@H]1CC2(CN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000818340940 742265167 /nfs/dbraw/zinc/26/51/67/742265167.db2.gz SSDSKMAZBYPKSC-LBPRGKRZSA-N 1 1 366.849 2.651 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000830589550 745389423 /nfs/dbraw/zinc/38/94/23/745389423.db2.gz LQIJTUXGAKFVQJ-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000830589550 745389428 /nfs/dbraw/zinc/38/94/28/745389428.db2.gz LQIJTUXGAKFVQJ-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000831159553 745492539 /nfs/dbraw/zinc/49/25/39/745492539.db2.gz WTGLYMFSMYURSH-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000832745344 745748910 /nfs/dbraw/zinc/74/89/10/745748910.db2.gz JAAQSOJQVGINOZ-ZDUSSCGKSA-N 1 1 353.394 2.811 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccc([N+](=O)[O-])c(F)c1F ZINC000834388038 745829336 /nfs/dbraw/zinc/82/93/36/745829336.db2.gz ODUCPGSHIWVAQD-CYBMUJFWSA-N 1 1 352.337 2.745 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000838148714 746584406 /nfs/dbraw/zinc/58/44/06/746584406.db2.gz KGRFDDSWTYJSGN-LLVKDONJSA-N 1 1 357.813 2.778 20 5 FFBDMO Cc1nn(C)c(Cl)c1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000839583812 746862829 /nfs/dbraw/zinc/86/28/29/746862829.db2.gz AGBQZJMECBJJBH-UHFFFAOYSA-N 1 1 365.821 2.751 20 5 FFBDMO Cc1nn(C)c(Cl)c1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000839583812 746862836 /nfs/dbraw/zinc/86/28/36/746862836.db2.gz AGBQZJMECBJJBH-UHFFFAOYSA-N 1 1 365.821 2.751 20 5 FFBDMO O=C(C[N@H+]1CCCCC[C@@H]1CCO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839596314 746866709 /nfs/dbraw/zinc/86/67/09/746866709.db2.gz VQOQVYJDYYUSHF-CYBMUJFWSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@@H]1CCO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839596314 746866713 /nfs/dbraw/zinc/86/67/13/746866713.db2.gz VQOQVYJDYYUSHF-CYBMUJFWSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000843981676 747945007 /nfs/dbraw/zinc/94/50/07/747945007.db2.gz ORFXIKSHJVJTRS-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO CC[C@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000844383904 748017927 /nfs/dbraw/zinc/01/79/27/748017927.db2.gz AOVGXKMLCBVAOQ-LBPRGKRZSA-N 1 1 353.394 2.952 20 5 FFBDMO COc1cc(C(=O)OC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000845739278 748318135 /nfs/dbraw/zinc/31/81/35/748318135.db2.gz QQMXMZPCYCBOIG-NSHDSACASA-N 1 1 352.387 2.642 20 5 FFBDMO CCOc1cc(C(=O)OCC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC ZINC000847828100 748791799 /nfs/dbraw/zinc/79/17/99/748791799.db2.gz LQONYAFTGMKACM-GFCCVEGCSA-N 1 1 352.387 2.501 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848490619 748940145 /nfs/dbraw/zinc/94/01/45/748940145.db2.gz QAHFZGYLBWFKRG-RHSMWYFYSA-N 1 1 363.483 2.943 20 5 FFBDMO Cn1cc([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C2(CO)CCC2)cn1 ZINC000852073148 749767646 /nfs/dbraw/zinc/76/76/46/749767646.db2.gz BSVDOAWPVQYWRV-INIZCTEOSA-N 1 1 364.833 2.975 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000852198873 749800036 /nfs/dbraw/zinc/80/00/36/749800036.db2.gz BXKSXUFOOYQEOG-LBPRGKRZSA-N 1 1 354.838 2.920 20 5 FFBDMO Cc1nc(Cl)nc(N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC000706822045 963544409 /nfs/dbraw/zinc/54/44/09/963544409.db2.gz OHEDCNYPCUSUMG-UHFFFAOYSA-N 1 1 359.817 2.669 20 5 FFBDMO CC(C)Oc1nc(N2CC[NH+](CCc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000894845941 965893744 /nfs/dbraw/zinc/89/37/44/965893744.db2.gz LWQUSYIEZXNTEN-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134902465 965943403 /nfs/dbraw/zinc/94/34/03/965943403.db2.gz VMHXCINQZRTMNV-WBVHZDCISA-N 1 1 372.469 2.790 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cnn(CC4CCC4)c3)C2)nc1 ZINC000892077891 965944904 /nfs/dbraw/zinc/94/49/04/965944904.db2.gz BQLIKTSMFKLMGU-INIZCTEOSA-N 1 1 356.430 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cnn(CC4CCC4)c3)C2)nc1 ZINC000892077891 965944908 /nfs/dbraw/zinc/94/49/08/965944908.db2.gz BQLIKTSMFKLMGU-INIZCTEOSA-N 1 1 356.430 2.673 20 5 FFBDMO COc1cc(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])sn1 ZINC001176475124 1013711544 /nfs/dbraw/zinc/71/15/44/1013711544.db2.gz ZUURZSHVLGSUEO-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])sn1 ZINC001176475124 1013711547 /nfs/dbraw/zinc/71/15/47/1013711547.db2.gz ZUURZSHVLGSUEO-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2ncccn2)C1 ZINC001176524916 1013721563 /nfs/dbraw/zinc/72/15/63/1013721563.db2.gz VVIWNGRPXZNIKM-OCCSQVGLSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2ncccn2)C1 ZINC001176524916 1013721571 /nfs/dbraw/zinc/72/15/71/1013721571.db2.gz VVIWNGRPXZNIKM-OCCSQVGLSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000708701185 968879293 /nfs/dbraw/zinc/87/92/93/968879293.db2.gz HHHJWDYSWRLAOF-GDBMZVCRSA-N 1 1 368.437 2.675 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000708701193 968879480 /nfs/dbraw/zinc/87/94/80/968879480.db2.gz HHHJWDYSWRLAOF-ZBFHGGJFSA-N 1 1 368.437 2.675 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000874850091 1013917703 /nfs/dbraw/zinc/91/77/03/1013917703.db2.gz NVRIIWQFORTVQY-NVXWUHKLSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000311652738 970098319 /nfs/dbraw/zinc/09/83/19/970098319.db2.gz UNZVYTPBQZCPSV-SCLBCKFNSA-N 1 1 354.410 2.570 20 5 FFBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n[nH]1 ZINC000897064645 973215167 /nfs/dbraw/zinc/21/51/67/973215167.db2.gz KUXJMHFTOZCAAJ-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n[nH]1 ZINC000897064645 973215176 /nfs/dbraw/zinc/21/51/76/973215176.db2.gz KUXJMHFTOZCAAJ-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO Nc1ccc2c(c1)C[N@@H+]([C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CCO2 ZINC000925755796 975336498 /nfs/dbraw/zinc/33/64/98/975336498.db2.gz YMVREPUAXFRCSZ-CVEARBPZSA-N 1 1 357.414 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cnc4c(F)cccc4c3)CC2)cn1 ZINC000876576865 1014310334 /nfs/dbraw/zinc/31/03/34/1014310334.db2.gz SJTLKKDBQLTUFP-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN(c3ccccc3F)CC2)c1 ZINC000796579782 1014403309 /nfs/dbraw/zinc/40/33/09/1014403309.db2.gz VTVCKJJHRIKUCU-LJQANCHMSA-N 1 1 359.401 2.980 20 5 FFBDMO O=c1oc2ccc(C[NH+]3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc2o1 ZINC000893876554 977578220 /nfs/dbraw/zinc/57/82/20/977578220.db2.gz AIGBNSQLMOOKHY-UHFFFAOYSA-N 1 1 355.350 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000152204546 979133183 /nfs/dbraw/zinc/13/31/83/979133183.db2.gz DQUGJYCLARFOGL-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000152204546 979133190 /nfs/dbraw/zinc/13/31/90/979133190.db2.gz DQUGJYCLARFOGL-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000152204546 979133196 /nfs/dbraw/zinc/13/31/96/979133196.db2.gz DQUGJYCLARFOGL-CQSZACIVSA-N 1 1 357.414 2.849 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000190952025 980344662 /nfs/dbraw/zinc/34/46/62/980344662.db2.gz XKWYFVTYXCTOJY-MRXNPFEDSA-N 1 1 364.442 2.758 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000190980171 980358752 /nfs/dbraw/zinc/35/87/52/980358752.db2.gz DGIWMBCPQFGDQY-OAHLLOKOSA-N 1 1 364.442 2.758 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877742594 1014703301 /nfs/dbraw/zinc/70/33/01/1014703301.db2.gz FMBCPXUUWJFOHF-CRAIPNDOSA-N 1 1 355.442 2.521 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC000913294071 984234479 /nfs/dbraw/zinc/23/44/79/984234479.db2.gz HZCOIQKLRNYCIT-BGYRXZFFSA-N 1 1 372.469 2.609 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547144 985878882 /nfs/dbraw/zinc/87/88/82/985878882.db2.gz VDODDESSZBNWOG-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547144 985878896 /nfs/dbraw/zinc/87/88/96/985878896.db2.gz VDODDESSZBNWOG-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(C)cc1 ZINC000173832178 985999262 /nfs/dbraw/zinc/99/92/62/985999262.db2.gz KZIKQXNLPOGQIC-LJQANCHMSA-N 1 1 371.437 2.922 20 5 FFBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(C)cc1 ZINC000173832178 985999271 /nfs/dbraw/zinc/99/92/71/985999271.db2.gz KZIKQXNLPOGQIC-LJQANCHMSA-N 1 1 371.437 2.922 20 5 FFBDMO Cc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000843828885 988437179 /nfs/dbraw/zinc/43/71/79/988437179.db2.gz WNMOYXQIFUNMSB-MRXNPFEDSA-N 1 1 368.437 2.832 20 5 FFBDMO CC[N@@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@@H]1C(C)C ZINC000922392707 988552261 /nfs/dbraw/zinc/55/22/61/988552261.db2.gz GOGRAJNCOPJJOR-AKHDSKFASA-N 1 1 365.449 2.693 20 5 FFBDMO CC[N@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@@H]1C(C)C ZINC000922392707 988552273 /nfs/dbraw/zinc/55/22/73/988552273.db2.gz GOGRAJNCOPJJOR-AKHDSKFASA-N 1 1 365.449 2.693 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000879237710 1015429532 /nfs/dbraw/zinc/42/95/32/1015429532.db2.gz OEANZSDOKDIJDH-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034644338 990149045 /nfs/dbraw/zinc/14/90/45/990149045.db2.gz DVHKPXIHCYMLEE-PSBWJHGTSA-N 1 1 357.454 2.746 20 5 FFBDMO Cc1cc(C)c(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c(C)c1 ZINC001035704104 990528455 /nfs/dbraw/zinc/52/84/55/990528455.db2.gz DMWSAFWKMVPRIR-IEBWSBKVSA-N 1 1 371.481 2.701 20 5 FFBDMO CC[N@@H+](C/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001485031276 991821299 /nfs/dbraw/zinc/82/12/99/991821299.db2.gz KMTJLRLIEMSIAS-WOPDUGCTSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@H+](C/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031276 991821304 /nfs/dbraw/zinc/82/13/04/991821304.db2.gz KMTJLRLIEMSIAS-WOPDUGCTSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@@H+](C/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031276 991821311 /nfs/dbraw/zinc/82/13/11/991821311.db2.gz KMTJLRLIEMSIAS-WOPDUGCTSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC001127682972 992006688 /nfs/dbraw/zinc/00/66/88/992006688.db2.gz GWBOTSRWJSZEOG-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC001127682972 992006697 /nfs/dbraw/zinc/00/66/97/992006697.db2.gz GWBOTSRWJSZEOG-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1nc(C)c(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)o1 ZINC000809977044 994655646 /nfs/dbraw/zinc/65/56/46/994655646.db2.gz OKZHZBRRPXLBCI-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO O=C(NC1CC1)OC[C@@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000810039272 994687484 /nfs/dbraw/zinc/68/74/84/994687484.db2.gz USBFIOUZBNRKIR-INIZCTEOSA-N 1 1 363.414 2.717 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000810619215 994841839 /nfs/dbraw/zinc/84/18/39/994841839.db2.gz YZWSPMJZWNUIRS-LLVKDONJSA-N 1 1 362.342 2.572 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000811445848 995148236 /nfs/dbraw/zinc/14/82/36/995148236.db2.gz WRMUGSNPRODSPS-INIZCTEOSA-N 1 1 369.349 2.759 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)n2)c1 ZINC000747823584 995554177 /nfs/dbraw/zinc/55/41/77/995554177.db2.gz HEYTZARVOLHIPZ-HZPDHXFCSA-N 1 1 357.414 2.559 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812853530 995555716 /nfs/dbraw/zinc/55/57/16/995555716.db2.gz RMXSKMQXOFANBL-QSFXBCCZSA-N 1 1 374.437 2.779 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000747839432 995622223 /nfs/dbraw/zinc/62/22/23/995622223.db2.gz GOPBSBWAUQKXTO-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000747839432 995622228 /nfs/dbraw/zinc/62/22/28/995622228.db2.gz GOPBSBWAUQKXTO-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])n1C ZINC000824417403 996949887 /nfs/dbraw/zinc/94/98/87/996949887.db2.gz VVTIKWDJNGQLHQ-ZBFHGGJFSA-N 1 1 354.410 2.690 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000803731865 1016113413 /nfs/dbraw/zinc/11/34/13/1016113413.db2.gz SGTBEDXHWYBWKT-DBBZSVRUSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000803731865 1016113419 /nfs/dbraw/zinc/11/34/19/1016113419.db2.gz SGTBEDXHWYBWKT-DBBZSVRUSA-N 1 1 365.433 2.993 20 5 FFBDMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)[C@@H]1CCCO1 ZINC001119856254 998356553 /nfs/dbraw/zinc/35/65/53/998356553.db2.gz PGVSTCNUTUTPOY-KBPBESRZSA-N 1 1 359.220 2.641 20 5 FFBDMO CC(C)[C@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000741010509 999699715 /nfs/dbraw/zinc/69/97/15/999699715.db2.gz GNBPMMKJVSZFNW-QGZVFWFLSA-N 1 1 363.414 2.587 20 5 FFBDMO COc1ccc([C@@H]2[C@@H](COC(=O)c3cc([N+](=O)[O-])cn3C)CC[N@H+]2C)cc1 ZINC000741120635 999709749 /nfs/dbraw/zinc/70/97/49/999709749.db2.gz JFJQTYCFIOZLFU-RDTXWAMCSA-N 1 1 373.409 2.792 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742149326 999761570 /nfs/dbraw/zinc/76/15/70/999761570.db2.gz IBPBQDUHYLTHEB-UHFFFAOYSA-N 1 1 372.473 2.863 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011812 1000015665 /nfs/dbraw/zinc/01/56/65/1000015665.db2.gz MLGMBZGUDFVQEU-IIDMSEBBSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169036019 1000016793 /nfs/dbraw/zinc/01/67/93/1000016793.db2.gz FCQMIMYBBKZDQW-RBGFHDKUSA-N 1 1 353.463 2.667 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCn3cnc(COc4cccnc4)c3C2)C1 ZINC001169018388 1000017209 /nfs/dbraw/zinc/01/72/09/1000017209.db2.gz AYLRYSOYPLOASX-CVEARBPZSA-N 1 1 371.441 2.508 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCO[C@@]3(CCCN(c4ccccc4)C3)C2)C1 ZINC001169023982 1000017844 /nfs/dbraw/zinc/01/78/44/1000017844.db2.gz WHIDRJRIFODCBI-YZGWKJHDSA-N 1 1 359.470 2.803 20 5 FFBDMO CCn1cc(C[N@@H+](Cc2c(C)nn(C)c2C)[C@H]2CC[C@H](C[N+](=O)[O-])C2)cn1 ZINC001169026338 1000018267 /nfs/dbraw/zinc/01/82/67/1000018267.db2.gz KYJPNWYJRCLXOU-WMZOPIPTSA-N 1 1 374.489 2.701 20 5 FFBDMO O=C(c1ccc(Cl)cc1)N1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049644 1000018642 /nfs/dbraw/zinc/01/86/42/1000018642.db2.gz XENIIFWDLLEVAN-WMLDXEAASA-N 1 1 365.861 2.933 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2cc([N+](=O)[O-])c(C)cn2)c2ccccc12 ZINC001169115836 1000026464 /nfs/dbraw/zinc/02/64/64/1000026464.db2.gz USUOLPIHMZWMMB-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767122801 1000100205 /nfs/dbraw/zinc/10/02/05/1000100205.db2.gz ISOCEGXNDOEINH-HNNXBMFYSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767122801 1000100207 /nfs/dbraw/zinc/10/02/07/1000100207.db2.gz ISOCEGXNDOEINH-HNNXBMFYSA-N 1 1 367.421 2.615 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCOC4(CCOCC4)CC3)c2)c1 ZINC000768910736 1000384187 /nfs/dbraw/zinc/38/41/87/1000384187.db2.gz AZRWSEUJNVGPET-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCOC4(CCOCC4)CC3)c2)c1 ZINC000768910736 1000384193 /nfs/dbraw/zinc/38/41/93/1000384193.db2.gz AZRWSEUJNVGPET-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000785733138 1001473035 /nfs/dbraw/zinc/47/30/35/1001473035.db2.gz PNMJAQCNPCETMQ-VXGBXAGGSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCC[C@H](C)C1 ZINC000791207743 1002618038 /nfs/dbraw/zinc/61/80/38/1002618038.db2.gz CQZJGEUIYDIDHM-STQMWFEESA-N 1 1 366.437 2.650 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000791325889 1002654068 /nfs/dbraw/zinc/65/40/68/1002654068.db2.gz VHFVHHIOLSNFCN-AWEZNQCLSA-N 1 1 372.400 2.711 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+]2CCc3ccc(=O)[nH]c3CC2)c([N+](=O)[O-])c1 ZINC001170353420 1003121506 /nfs/dbraw/zinc/12/15/06/1003121506.db2.gz XZJBKCFPHLDEKP-ZDUSSCGKSA-N 1 1 357.410 2.736 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352679 1003121850 /nfs/dbraw/zinc/12/18/50/1003121850.db2.gz QCYBNLMULHDCTR-KBPBESRZSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCc3cnc(OC)cc3C2)c([N+](=O)[O-])c1 ZINC001170356074 1003123462 /nfs/dbraw/zinc/12/34/62/1003123462.db2.gz WFQQJNSFWKIRMM-CYBMUJFWSA-N 1 1 357.410 2.996 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345425 1003131563 /nfs/dbraw/zinc/13/15/63/1003131563.db2.gz KIIIUASYEWWOGH-GZBFAFLISA-N 1 1 350.415 2.665 20 5 FFBDMO CCCc1ccc(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001001400975 1016783042 /nfs/dbraw/zinc/78/30/42/1016783042.db2.gz WRCMTALVFIUHRG-RTBURBONSA-N 1 1 359.470 2.633 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000804497773 1003704311 /nfs/dbraw/zinc/70/43/11/1003704311.db2.gz IEELJUZJEGJGAQ-SFHVURJKSA-N 1 1 372.381 2.552 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001198148091 1004509166 /nfs/dbraw/zinc/50/91/66/1004509166.db2.gz VRIHBPVZOJHJLU-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001198148091 1004509175 /nfs/dbraw/zinc/50/91/75/1004509175.db2.gz VRIHBPVZOJHJLU-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001198584209 1004683724 /nfs/dbraw/zinc/68/37/24/1004683724.db2.gz TUYHCJGRSDDDQN-NSHDSACASA-N 1 1 358.345 2.754 20 5 FFBDMO COCCC[N@@H+](Cc1ccncc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000106855895 1005364620 /nfs/dbraw/zinc/36/46/20/1005364620.db2.gz YNQRBQUZQCBTRU-UHFFFAOYSA-N 1 1 355.398 2.836 20 5 FFBDMO COCCC[N@H+](Cc1ccncc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000106855895 1005364623 /nfs/dbraw/zinc/36/46/23/1005364623.db2.gz YNQRBQUZQCBTRU-UHFFFAOYSA-N 1 1 355.398 2.836 20 5 FFBDMO CC[C@@H](C)C[N@@H+](CC)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748263745 1017006613 /nfs/dbraw/zinc/00/66/13/1017006613.db2.gz XPSWQEBPCFPYAY-FZKQIMNGSA-N 1 1 362.430 2.687 20 5 FFBDMO COc1ccc([C@@H](O)C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000852071319 1005939006 /nfs/dbraw/zinc/93/90/06/1005939006.db2.gz MOCSEJYANUQWIX-GOSISDBHSA-N 1 1 361.398 2.845 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cccc(OC)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579342 1005960013 /nfs/dbraw/zinc/96/00/13/1005960013.db2.gz NLENJAJCVYNAJJ-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cccc(OC)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579342 1005960014 /nfs/dbraw/zinc/96/00/14/1005960014.db2.gz NLENJAJCVYNAJJ-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)cc1 ZINC000776590370 1006002597 /nfs/dbraw/zinc/00/25/97/1006002597.db2.gz DBYIJSHMEOJQNN-PMACEKPBSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1 ZINC000852520673 1006063583 /nfs/dbraw/zinc/06/35/83/1006063583.db2.gz MKZYNTKKABROQY-DFQSSKMNSA-N 1 1 356.422 2.726 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[C@H](N3CC[NH+](CC4CC4)CC3)CC2)nc1 ZINC001170714417 1006070048 /nfs/dbraw/zinc/07/00/48/1006070048.db2.gz DGTWMPBVNCYMBC-QAQDUYKDSA-N 1 1 359.474 2.741 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)nc1-c1ccccn1 ZINC000853517711 1006424813 /nfs/dbraw/zinc/42/48/13/1006424813.db2.gz BUMWRRKLBAJKBQ-ZBFHGGJFSA-N 1 1 357.414 2.702 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1Cn1cc([N+](=O)[O-])c(-c3ccccn3)n1)CCOCC2 ZINC000853518564 1006425525 /nfs/dbraw/zinc/42/55/25/1006425525.db2.gz KBGWKHRSXUCRTH-AWEZNQCLSA-N 1 1 357.414 2.702 20 5 FFBDMO COc1cc(F)c([N+](=O)[O-])c(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1 ZINC000853913604 1006581667 /nfs/dbraw/zinc/58/16/67/1006581667.db2.gz VXXFWXNHMAHAOX-HZPDHXFCSA-N 1 1 365.405 2.798 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000885891687 1007823883 /nfs/dbraw/zinc/82/38/83/1007823883.db2.gz WULWOSADQFOESA-MRXNPFEDSA-N 1 1 369.421 2.731 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000856677255 1007944183 /nfs/dbraw/zinc/94/41/83/1007944183.db2.gz NCTHIZYSVVPLQS-AUUYWEPGSA-N 1 1 374.441 2.979 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000858871544 1008442916 /nfs/dbraw/zinc/44/29/16/1008442916.db2.gz IUFQSNYEEPFPIE-MRXNPFEDSA-N 1 1 358.442 2.679 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 ZINC000886067199 1008529905 /nfs/dbraw/zinc/52/99/05/1008529905.db2.gz IJOLZYYTMVHVKT-UHFFFAOYSA-N 1 1 354.410 2.726 20 5 FFBDMO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000886106963 1008564522 /nfs/dbraw/zinc/56/45/22/1008564522.db2.gz HKNDSYPJCNCSNR-INIZCTEOSA-N 1 1 372.425 2.698 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@](O)(c3ccccc3)C2)c1 ZINC000859588740 1008581694 /nfs/dbraw/zinc/58/16/94/1008581694.db2.gz JMXNTQRDVNZUJQ-HXUWFJFHSA-N 1 1 370.405 2.865 20 5 FFBDMO C[C@@H](C[N+](=O)[O-])OC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1c1ccncc1 ZINC000860787422 1009150849 /nfs/dbraw/zinc/15/08/49/1009150849.db2.gz LYPFLUVREZXIJX-ZYSHUDEJSA-N 1 1 369.421 2.506 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126476221 1009231998 /nfs/dbraw/zinc/23/19/98/1009231998.db2.gz ZVKWAYUNOHOWNL-SJCJKPOMSA-N 1 1 374.397 2.592 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823962326 1009281121 /nfs/dbraw/zinc/28/11/21/1009281121.db2.gz RLVWQKSMMFTGQX-DYVFJYSZSA-N 1 1 369.425 2.819 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC001180176000 1009571260 /nfs/dbraw/zinc/57/12/60/1009571260.db2.gz ZXJBPXCFCYUAKX-UHFFFAOYSA-N 1 1 373.409 2.606 20 5 FFBDMO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])CCO2 ZINC001180586150 1009762511 /nfs/dbraw/zinc/76/25/11/1009762511.db2.gz QXUHEHPKVKQKIK-CQSZACIVSA-N 1 1 360.366 2.931 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(NC[C@@H]3CC[N@H+]3Cc3ccccc3)cc2N1 ZINC000715740697 1010406324 /nfs/dbraw/zinc/40/63/24/1010406324.db2.gz OTPJWXOKLDONJP-AWEZNQCLSA-N 1 1 368.393 2.612 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635167 1010449830 /nfs/dbraw/zinc/44/98/30/1010449830.db2.gz UGBPWXYHRLXNRY-LSDHHAIUSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635167 1010449835 /nfs/dbraw/zinc/44/98/35/1010449835.db2.gz UGBPWXYHRLXNRY-LSDHHAIUSA-N 1 1 363.414 2.986 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+](CC1CC1)CC1CCC1 ZINC000794715844 1010565149 /nfs/dbraw/zinc/56/51/49/1010565149.db2.gz YNXGHTNLLNAIJC-UHFFFAOYSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+](CC1CC1)CC1CCC1 ZINC000794715844 1010565156 /nfs/dbraw/zinc/56/51/56/1010565156.db2.gz YNXGHTNLLNAIJC-UHFFFAOYSA-N 1 1 358.398 2.881 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000794768906 1010581032 /nfs/dbraw/zinc/58/10/32/1010581032.db2.gz WUMQLMKRLGJHAA-GOSISDBHSA-N 1 1 373.384 2.531 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000794768906 1010581041 /nfs/dbraw/zinc/58/10/41/1010581041.db2.gz WUMQLMKRLGJHAA-GOSISDBHSA-N 1 1 373.384 2.531 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H](C[C@H]4CCOC4)C3)n2)cc1 ZINC000773267716 1011005741 /nfs/dbraw/zinc/00/57/41/1011005741.db2.gz VFCMKUPLRCLRQM-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H]2c3ccccc3C[N@H+]2C)cc1[N+](=O)[O-] ZINC000868081645 1011160807 /nfs/dbraw/zinc/16/08/07/1011160807.db2.gz ZXDITTZHOGMIQH-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)cc1[N+](=O)[O-] ZINC000868081645 1011160812 /nfs/dbraw/zinc/16/08/12/1011160812.db2.gz ZXDITTZHOGMIQH-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO COC[C@@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906362 1012078635 /nfs/dbraw/zinc/07/86/35/1012078635.db2.gz HAMOYVYXMYEGPE-DLBZAZTESA-N 1 1 370.453 2.822 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906362 1012078644 /nfs/dbraw/zinc/07/86/44/1012078644.db2.gz HAMOYVYXMYEGPE-DLBZAZTESA-N 1 1 370.453 2.822 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870092955 1012125115 /nfs/dbraw/zinc/12/51/15/1012125115.db2.gz OCNBHFSAAZKDBM-KRWDZBQOSA-N 1 1 355.394 2.704 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870093631 1012127705 /nfs/dbraw/zinc/12/77/05/1012127705.db2.gz WPXIJUCFQSQFCF-HNNXBMFYSA-N 1 1 359.357 2.535 20 5 FFBDMO C[C@@]1(O)CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1F ZINC001173010240 1012179918 /nfs/dbraw/zinc/17/99/18/1012179918.db2.gz ORMZNOLSBPVMLU-DOTOQJQBSA-N 1 1 373.375 2.637 20 5 FFBDMO CC[N@@H+](CCCC(=O)OC)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173182310 1012325785 /nfs/dbraw/zinc/32/57/85/1012325785.db2.gz RFAQTMSHDGHVKG-LBPRGKRZSA-N 1 1 356.394 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c1F ZINC001173184068 1012326953 /nfs/dbraw/zinc/32/69/53/1012326953.db2.gz CQNRFNKTAIDFOX-MCIONIFRSA-N 1 1 351.422 2.557 20 5 FFBDMO COC(=O)[C@H]1CC[C@@H](C)[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173189576 1012332901 /nfs/dbraw/zinc/33/29/01/1012332901.db2.gz KZVXTUDAZFPCSF-UPJWGTAASA-N 1 1 368.405 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](n3cncn3)C2)c1F ZINC001173197304 1012339983 /nfs/dbraw/zinc/33/99/83/1012339983.db2.gz SNYUXSOBIQAYQX-QWHCGFSZSA-N 1 1 363.393 2.602 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)C[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197243 1012340758 /nfs/dbraw/zinc/34/07/58/1012340758.db2.gz RUPYHRRAZLPIBU-FRRDWIJNSA-N 1 1 368.405 2.805 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@H](c3nc(C)no3)C2)c1F ZINC001173197576 1012342165 /nfs/dbraw/zinc/34/21/65/1012342165.db2.gz UPZIWBKKIMTOLF-PWSUYJOCSA-N 1 1 364.377 2.854 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1 ZINC001173228529 1012365120 /nfs/dbraw/zinc/36/51/20/1012365120.db2.gz YVFYSBMWCUNEOL-QRQLOZEOSA-N 1 1 366.465 2.985 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC([C@H]2CCCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870955440 1012649536 /nfs/dbraw/zinc/64/95/36/1012649536.db2.gz XEOUPOPRYXGRAW-IEBWSBKVSA-N 1 1 361.442 2.576 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@@H]([C@@H]2CCCCO2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870955486 1012650132 /nfs/dbraw/zinc/65/01/32/1012650132.db2.gz YLTRSEMUOHINBG-DKSSEZFCSA-N 1 1 361.442 2.576 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347355 1017119798 /nfs/dbraw/zinc/11/97/98/1017119798.db2.gz VEZTZISNDZXGGM-OWCLPIDISA-N 1 1 374.485 2.853 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347355 1017119810 /nfs/dbraw/zinc/11/98/10/1017119810.db2.gz VEZTZISNDZXGGM-OWCLPIDISA-N 1 1 374.485 2.853 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC[C@H]21 ZINC000827330623 1017640791 /nfs/dbraw/zinc/64/07/91/1017640791.db2.gz QBULSIVHDZNGPY-CZUORRHYSA-N 1 1 372.450 2.885 20 5 FFBDMO C[C@@]1(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000406048466 1032844043 /nfs/dbraw/zinc/84/40/43/1032844043.db2.gz XCACOWCCZUQMNO-LJQANCHMSA-N 1 1 354.410 2.571 20 5 FFBDMO CCCc1ccc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001045437257 1019964784 /nfs/dbraw/zinc/96/47/84/1019964784.db2.gz JVIIRXPHSGFGQJ-QZTJIDSGSA-N 1 1 359.470 2.775 20 5 FFBDMO Cc1cccc(CCC[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001045437456 1019966806 /nfs/dbraw/zinc/96/68/06/1019966806.db2.gz RXAMLGGRLPPIAP-QZTJIDSGSA-N 1 1 359.470 2.564 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C\c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525092 1020275331 /nfs/dbraw/zinc/27/53/31/1020275331.db2.gz KRXNECZUUGADBP-DCZRNNARSA-N 1 1 369.465 2.724 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C\c1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525092 1020275343 /nfs/dbraw/zinc/27/53/43/1020275343.db2.gz KRXNECZUUGADBP-DCZRNNARSA-N 1 1 369.465 2.724 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C\c1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525092 1020275352 /nfs/dbraw/zinc/27/53/52/1020275352.db2.gz KRXNECZUUGADBP-DCZRNNARSA-N 1 1 369.465 2.724 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC2(CCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525290 1020275654 /nfs/dbraw/zinc/27/56/54/1020275654.db2.gz SJXSWRAJNCWRCC-REEYDVFISA-N 1 1 361.486 2.591 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC2(CCC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525290 1020275658 /nfs/dbraw/zinc/27/56/58/1020275658.db2.gz SJXSWRAJNCWRCC-REEYDVFISA-N 1 1 361.486 2.591 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC2(CCC2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525290 1020275664 /nfs/dbraw/zinc/27/56/64/1020275664.db2.gz SJXSWRAJNCWRCC-REEYDVFISA-N 1 1 361.486 2.591 20 5 FFBDMO CCCNC(=O)C1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777950176 1020278014 /nfs/dbraw/zinc/27/80/14/1020278014.db2.gz AJMLNTOWNZDJJI-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C1CCCN1C1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777956272 1020329798 /nfs/dbraw/zinc/32/97/98/1020329798.db2.gz ITPIJGBWKWUIAA-UHFFFAOYSA-N 1 1 369.425 2.503 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000931308087 1020414233 /nfs/dbraw/zinc/41/42/33/1020414233.db2.gz RCMAMRDEEGNNET-ZOCIIQOWSA-N 1 1 360.458 2.504 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1 ZINC000931492431 1020488708 /nfs/dbraw/zinc/48/87/08/1020488708.db2.gz XNFYSNQNHZPLDO-UFYCRDLUSA-N 1 1 353.422 2.587 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)cc1 ZINC000931906276 1020628135 /nfs/dbraw/zinc/62/81/35/1020628135.db2.gz RTPVPQGQDUJYQJ-HOJAQTOUSA-N 1 1 354.406 2.528 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2cccnc2N2CCOCC2)cc([N+](=O)[O-])c1 ZINC000903065101 1020659437 /nfs/dbraw/zinc/65/94/37/1020659437.db2.gz GOSUVWVDCXCNOA-CQSZACIVSA-N 1 1 372.425 2.686 20 5 FFBDMO COc1cc([C@H](C)NC2CC[NH+](C[C@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096357 1020674594 /nfs/dbraw/zinc/67/45/94/1020674594.db2.gz BSSKFJZWTWLEJT-KBXCAEBGSA-N 1 1 363.458 2.897 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc([N+](=O)[O-])c1 ZINC000903123905 1020689551 /nfs/dbraw/zinc/68/95/51/1020689551.db2.gz CTPURCUYXAYGLV-BKTGTZMESA-N 1 1 363.458 2.632 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCn2nc(C3CC3)cc2C1 ZINC000932605924 1020846699 /nfs/dbraw/zinc/84/66/99/1020846699.db2.gz RKXJAEFPEIQZMM-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCn2nc(C3CC3)cc2C1 ZINC000932605924 1020846705 /nfs/dbraw/zinc/84/67/05/1020846705.db2.gz RKXJAEFPEIQZMM-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000932647168 1020862371 /nfs/dbraw/zinc/86/23/71/1020862371.db2.gz MYIKFHBKRXILMI-JTQLQIEISA-N 1 1 374.340 2.590 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000932647168 1020862380 /nfs/dbraw/zinc/86/23/80/1020862380.db2.gz MYIKFHBKRXILMI-JTQLQIEISA-N 1 1 374.340 2.590 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001116331451 1021169249 /nfs/dbraw/zinc/16/92/49/1021169249.db2.gz QDWCLFVZAMLKFT-UGSOOPFHSA-N 1 1 358.442 2.725 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116397856 1021197432 /nfs/dbraw/zinc/19/74/32/1021197432.db2.gz DXEWJTSTVNKAKH-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116397856 1021197437 /nfs/dbraw/zinc/19/74/37/1021197437.db2.gz DXEWJTSTVNKAKH-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3F)CC2)nc(C)[nH+]1 ZINC000750208436 1021530744 /nfs/dbraw/zinc/53/07/44/1021530744.db2.gz PCZPFZORIZAIOC-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@H+]2CC[C@@H](O)[C@H](CO)C2)o1 ZINC001118013600 1022019891 /nfs/dbraw/zinc/01/98/91/1022019891.db2.gz ZQPLRMJHPIGTQV-MEDUHNTESA-N 1 1 366.801 2.683 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@]1(O)CCc2ccccc21 ZINC000829319738 1033100407 /nfs/dbraw/zinc/10/04/07/1033100407.db2.gz SSLVHUGNRVXHKC-FQEVSTJZSA-N 1 1 370.405 2.727 20 5 FFBDMO CCc1nc2c(c(OC3CCN(c4ccccc4[N+](=O)[O-])CC3)n1)C[NH2+]C2 ZINC001218384377 1033130637 /nfs/dbraw/zinc/13/06/37/1033130637.db2.gz VVNHKANPCLHQLQ-UHFFFAOYSA-N 1 1 369.425 2.598 20 5 FFBDMO COC(=O)C[C@H]([NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754515850 1023481133 /nfs/dbraw/zinc/48/11/33/1023481133.db2.gz BSBPCXAGMGBBSU-HZMBPMFUSA-N 1 1 360.370 2.637 20 5 FFBDMO COC(=O)C[C@@H]([NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754515852 1023481146 /nfs/dbraw/zinc/48/11/46/1023481146.db2.gz BSBPCXAGMGBBSU-IINYFYTJSA-N 1 1 360.370 2.637 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2CN2CCCC2=O)ccc1[N+](=O)[O-] ZINC000755001878 1023552472 /nfs/dbraw/zinc/55/24/72/1023552472.db2.gz MTKXLJOBNHEUIZ-MRXNPFEDSA-N 1 1 361.442 2.970 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000756980332 1023776576 /nfs/dbraw/zinc/77/65/76/1023776576.db2.gz PCTFKRMKNMTIKN-CYBMUJFWSA-N 1 1 366.418 2.694 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)cn1 ZINC000758338122 1024052749 /nfs/dbraw/zinc/05/27/49/1024052749.db2.gz JWGPCJRUBXSQCV-UHFFFAOYSA-N 1 1 370.344 2.945 20 5 FFBDMO CN(C(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000795221546 1025360437 /nfs/dbraw/zinc/36/04/37/1025360437.db2.gz PEVBJVYPTUEZAO-UHFFFAOYSA-N 1 1 372.381 2.991 20 5 FFBDMO C[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1ccnc1 ZINC000246444088 1026144726 /nfs/dbraw/zinc/14/47/26/1026144726.db2.gz DWCHIVFCZPOTDP-RHSMWYFYSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1ccnc1 ZINC000246444088 1026144735 /nfs/dbraw/zinc/14/47/35/1026144735.db2.gz DWCHIVFCZPOTDP-RHSMWYFYSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1nnc2ccccn21 ZINC001154813998 1028466642 /nfs/dbraw/zinc/46/66/42/1028466642.db2.gz BBUZYPIOGTYXMR-CRALRDPISA-N 1 1 353.386 2.738 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[N@H+]4CCc5ccccc5[C@H]4C3)c2c1 ZINC001155093162 1028576672 /nfs/dbraw/zinc/57/66/72/1028576672.db2.gz YYYNCEMQPQFAIU-LJQANCHMSA-N 1 1 361.405 2.957 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000780764281 1028799075 /nfs/dbraw/zinc/79/90/75/1028799075.db2.gz JLBRHAZZYOKAOU-AZUAARDMSA-N 1 1 366.421 2.915 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC001163371324 1028907468 /nfs/dbraw/zinc/90/74/68/1028907468.db2.gz ONXQOCOZUPGKEB-TZMCWYRMSA-N 1 1 350.419 2.697 20 5 FFBDMO Cc1cccc(N2CCN(c3nc(Cl)nc(Cl)c3[N+](=O)[O-])CC2)[nH+]1 ZINC001163660124 1029011491 /nfs/dbraw/zinc/01/14/91/1029011491.db2.gz MWTKMLHCSMAIQV-UHFFFAOYSA-N 1 1 369.212 2.722 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)nc1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC001165086685 1029374713 /nfs/dbraw/zinc/37/47/13/1029374713.db2.gz OAJMABLYWAEDDP-DZGCQCFKSA-N 1 1 359.817 2.749 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCCC[C@H]1C ZINC001156928914 1029408343 /nfs/dbraw/zinc/40/83/43/1029408343.db2.gz QXBXIGOOSTVOPJ-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO CCOC(=O)c1ccnc(N(C)CC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC001157556656 1029617567 /nfs/dbraw/zinc/61/75/67/1029617567.db2.gz MRADLAKCWQJDDZ-UHFFFAOYSA-N 1 1 372.425 2.735 20 5 FFBDMO O=C(NCCC[NH2+]Cc1ccccc1Oc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001157775082 1029661055 /nfs/dbraw/zinc/66/10/55/1029661055.db2.gz LJIMYJKRJHRQEJ-QZTJIDSGSA-N 1 1 369.421 2.740 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1O ZINC000782531055 1029734887 /nfs/dbraw/zinc/73/48/87/1029734887.db2.gz LGLXVEGCKHWEER-BBRMVZONSA-N 1 1 367.421 2.791 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2ncc([N+](=O)[O-])cc2C)c2ccccc12 ZINC001158236830 1029766313 /nfs/dbraw/zinc/76/63/13/1029766313.db2.gz QPQPHIUBUKEJPJ-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2ncc([N+](=O)[O-])cc2F)c2ccccc12 ZINC001158238090 1029767123 /nfs/dbraw/zinc/76/71/23/1029767123.db2.gz WKVRKHXPOZZORU-SFHVURJKSA-N 1 1 372.356 2.506 20 5 FFBDMO C[N@@H+](C1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1)[C@@H]1CCOC1 ZINC001165205977 1029893482 /nfs/dbraw/zinc/89/34/82/1029893482.db2.gz CGMRWQVHEMHUNI-OAHLLOKOSA-N 1 1 354.410 2.566 20 5 FFBDMO Cc1cc(Cl)nc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)c1[N+](=O)[O-] ZINC001166032545 1030214636 /nfs/dbraw/zinc/21/46/36/1030214636.db2.gz PAJANIBJVAYWFO-UHFFFAOYSA-N 1 1 353.810 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC([C@@H]4CCOC4)CC3)n2)cc1 ZINC000784008393 1030411239 /nfs/dbraw/zinc/41/12/39/1030411239.db2.gz ROUXWIVTRXJYCK-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1CN1CCN(c3ccccc3[N+](=O)[O-])C1=O)CCOCC2 ZINC000842638382 1030865234 /nfs/dbraw/zinc/86/52/34/1030865234.db2.gz KLOYJDHCHBVKNP-HNNXBMFYSA-N 1 1 374.441 2.685 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCC2CCCCCC2)CC1 ZINC001205229552 1031613247 /nfs/dbraw/zinc/61/32/47/1031613247.db2.gz DXBFKIVLHZDIPP-QZTJIDSGSA-N 1 1 351.491 2.840 20 5 FFBDMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001149922569 1031618723 /nfs/dbraw/zinc/61/87/23/1031618723.db2.gz DNGVTBIALLCFCV-SFHVURJKSA-N 1 1 366.377 2.568 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000799153842 1031669707 /nfs/dbraw/zinc/66/97/07/1031669707.db2.gz AXONWFPFLWTVEB-DUOKCRBOSA-N 1 1 373.457 2.867 20 5 FFBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)[C@H]1CC[C@@H]1[NH3+] ZINC001219005240 1033455837 /nfs/dbraw/zinc/45/58/37/1033455837.db2.gz HYEIIRNUMWXTIY-BBRMVZONSA-N 1 1 350.422 2.632 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)OCCC[NH+]1CCN(C(C)C)CC1 ZINC000830369578 1033589522 /nfs/dbraw/zinc/58/95/22/1033589522.db2.gz MXHYVYBPHAYJGP-UHFFFAOYSA-N 1 1 367.421 2.615 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC(NC(=O)OC(C)(C)C)C1 ZINC000831237286 1034005339 /nfs/dbraw/zinc/00/53/39/1034005339.db2.gz PEOBDHJTIVZPQI-AVVWSFFYSA-N 1 1 365.430 2.616 20 5 FFBDMO O=C(CO[C@@H]1CC[N@@H+](Cc2ccccc2)C1)OCc1ccc([N+](=O)[O-])cc1 ZINC001224985965 1034081171 /nfs/dbraw/zinc/08/11/71/1034081171.db2.gz BTDLQHXNUMBYBP-LJQANCHMSA-N 1 1 370.405 2.929 20 5 FFBDMO COC(=O)c1cccc([N+](=O)[O-])c1O[C@@H]1CC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC001227123810 1034939891 /nfs/dbraw/zinc/93/98/91/1034939891.db2.gz HHCRRWAUPFAIKH-UONOGXRCSA-N 1 1 371.393 2.991 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(C[NH+]3CCN(c4ccncn4)CC3)nc12 ZINC001232226241 1035505873 /nfs/dbraw/zinc/50/58/73/1035505873.db2.gz TUEZYTJUWACFMF-UHFFFAOYSA-N 1 1 356.433 2.895 20 5 FFBDMO [NH2+]=C(NO)c1ccc(O[C@H]2CCN(c3ccccc3[N+](=O)[O-])C2)cc1F ZINC001229081803 1036490275 /nfs/dbraw/zinc/49/02/75/1036490275.db2.gz WJYJVNIOJDHOMZ-LBPRGKRZSA-N 1 1 360.345 2.696 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001536567954 1070008467 /nfs/dbraw/zinc/00/84/67/1070008467.db2.gz MUMULDYDLUBSKX-CYBMUJFWSA-N 1 1 370.247 2.846 20 5 FFBDMO COC(=O)c1cnc(OC2CCN(c3cc(C)cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC001233867597 1036796346 /nfs/dbraw/zinc/79/63/46/1036796346.db2.gz VOCURDYBNYTRCC-UHFFFAOYSA-N 1 1 372.381 2.528 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cnc4ccc(=O)n5c6ccccc6c3c45)[C@H]1CC(=O)C2 ZINC001234710499 1037150906 /nfs/dbraw/zinc/15/09/06/1037150906.db2.gz JHXGDWKIBCQBHQ-JBBXEZCESA-N 1 1 373.412 2.622 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2c3nccc4c5ccccc5n(c43)c(=O)c2OC)C1 ZINC001234718997 1037155035 /nfs/dbraw/zinc/15/50/35/1037155035.db2.gz WOZCBZIVTRBZQH-CYBMUJFWSA-N 1 1 363.417 2.920 20 5 FFBDMO O=[N+]([O-])c1cc2c[nH]nc2cc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001230600918 1037317326 /nfs/dbraw/zinc/31/73/26/1037317326.db2.gz KAUBCFCASJIDTE-MRXNPFEDSA-N 1 1 368.393 2.751 20 5 FFBDMO CCCCCC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1 ZINC001230763168 1037348949 /nfs/dbraw/zinc/34/89/49/1037348949.db2.gz SOXAUSZBPBILDB-QZTJIDSGSA-N 1 1 362.474 2.635 20 5 FFBDMO CCCCCC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1 ZINC001230763168 1037348967 /nfs/dbraw/zinc/34/89/67/1037348967.db2.gz SOXAUSZBPBILDB-QZTJIDSGSA-N 1 1 362.474 2.635 20 5 FFBDMO CCCCCC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1 ZINC001230763168 1037348988 /nfs/dbraw/zinc/34/89/88/1037348988.db2.gz SOXAUSZBPBILDB-QZTJIDSGSA-N 1 1 362.474 2.635 20 5 FFBDMO NC(=O)[C@H]1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCN1 ZINC001235754831 1037724175 /nfs/dbraw/zinc/72/41/75/1037724175.db2.gz TUHUNYMUEQCBPZ-GOSISDBHSA-N 1 1 353.853 2.906 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](C)[C@@](C)(O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093091 1038379992 /nfs/dbraw/zinc/37/99/92/1038379992.db2.gz GGMMVOQKXNNIPI-KUHUBIRLSA-N 1 1 363.458 2.665 20 5 FFBDMO CC[C@@H]1CNCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246805163 1039486529 /nfs/dbraw/zinc/48/65/29/1039486529.db2.gz RGGJKODJIFCPBA-GFCCVEGCSA-N 1 1 354.401 2.526 20 5 FFBDMO CC[C@@H]1CNCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246805163 1039486534 /nfs/dbraw/zinc/48/65/34/1039486534.db2.gz RGGJKODJIFCPBA-GFCCVEGCSA-N 1 1 354.401 2.526 20 5 FFBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2ccc3c(c2)OCO3)no1 ZINC001247667736 1039874538 /nfs/dbraw/zinc/87/45/38/1039874538.db2.gz ZUJONVNRRORDLZ-LBPRGKRZSA-N 1 1 354.322 2.616 20 5 FFBDMO CN(C)c1ccc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)cc1 ZINC001248208952 1040172310 /nfs/dbraw/zinc/17/23/10/1040172310.db2.gz OGSRSKWJIKMCAK-MRXNPFEDSA-N 1 1 353.382 2.953 20 5 FFBDMO CN(C)c1ccccc1-c1noc([C@@H]([NH3+])Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001248209914 1040173932 /nfs/dbraw/zinc/17/39/32/1040173932.db2.gz DIONLVFQVPZZJY-HNNXBMFYSA-N 1 1 353.382 2.953 20 5 FFBDMO Cc1noc(C[C@H]2C[C@H]3C[N@H+]([C@@H](C)Cc4ccccc4[N+](=O)[O-])C[C@H]3O2)n1 ZINC001254559478 1040796399 /nfs/dbraw/zinc/79/63/99/1040796399.db2.gz YCZIQSSZCPURCD-BWUSGFMJSA-N 1 1 372.425 2.549 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596889 1040824989 /nfs/dbraw/zinc/82/49/89/1040824989.db2.gz QRRCHSZXAQXTGV-AEFFLSMTSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596889 1040824999 /nfs/dbraw/zinc/82/49/99/1040824999.db2.gz QRRCHSZXAQXTGV-AEFFLSMTSA-N 1 1 370.453 2.914 20 5 FFBDMO CC(C)C(=O)N1CCC[C@@]12CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599053 1040829854 /nfs/dbraw/zinc/82/98/54/1040829854.db2.gz JWXGCJJTWCCQJH-ICSRJNTNSA-N 1 1 357.454 2.785 20 5 FFBDMO COc1cccnc1O[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611010 1040838655 /nfs/dbraw/zinc/83/86/55/1040838655.db2.gz NVCCHTVFNWVVKD-IRXDYDNUSA-N 1 1 355.394 2.619 20 5 FFBDMO O=[N+]([O-])c1cncc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)c1 ZINC001213823822 1040958624 /nfs/dbraw/zinc/95/86/24/1040958624.db2.gz NCASKVXSFOAMER-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCCc2ccsc2)CC1 ZINC001278607892 1041406136 /nfs/dbraw/zinc/40/61/36/1041406136.db2.gz RUOXMEBDUMGZJM-HZPDHXFCSA-N 1 1 365.499 2.564 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001262652525 1041776411 /nfs/dbraw/zinc/77/64/11/1041776411.db2.gz ISXNBCQMDFCIPY-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO C[C@H](CNC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1ccccc1[N+](=O)[O-] ZINC001311346231 1043898864 /nfs/dbraw/zinc/89/88/64/1043898864.db2.gz ZBZRHDBHOBDOFC-CZUORRHYSA-N 1 1 360.414 2.893 20 5 FFBDMO c1nn(CC[NH+]2CCOCC2)cc1-c1cc2cccnc2c2ncccc12 ZINC001240543020 1044380675 /nfs/dbraw/zinc/38/06/75/1044380675.db2.gz DOHQLHZLPVADLT-UHFFFAOYSA-N 1 1 359.433 2.979 20 5 FFBDMO CCCC1CC[NH+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC001318891365 1044925286 /nfs/dbraw/zinc/92/52/86/1044925286.db2.gz HNDSGZLISLUYIW-IBGZPJMESA-N 1 1 374.441 2.831 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001319041986 1044999488 /nfs/dbraw/zinc/99/94/88/1044999488.db2.gz RXEHFDMHEASDDK-HNNXBMFYSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001319041986 1044999502 /nfs/dbraw/zinc/99/95/02/1044999502.db2.gz RXEHFDMHEASDDK-HNNXBMFYSA-N 1 1 363.414 2.649 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001319704737 1045246828 /nfs/dbraw/zinc/24/68/28/1045246828.db2.gz QSRBXEHWMYAWFQ-ZFWWWQNUSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001319704737 1045246838 /nfs/dbraw/zinc/24/68/38/1045246838.db2.gz QSRBXEHWMYAWFQ-ZFWWWQNUSA-N 1 1 358.398 2.881 20 5 FFBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1c[nH]nc1[N+](=O)[O-] ZINC001324439523 1046031007 /nfs/dbraw/zinc/03/10/07/1046031007.db2.gz DXTVPSJLWMAELT-MQVJKMGUSA-N 1 1 369.425 2.633 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002987 1046302734 /nfs/dbraw/zinc/30/27/34/1046302734.db2.gz IDOBFSIUZPKMAH-CRAIPNDOSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002987 1046302750 /nfs/dbraw/zinc/30/27/50/1046302750.db2.gz IDOBFSIUZPKMAH-CRAIPNDOSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cc(OCC(=O)N2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)ccc1[N+](=O)[O-] ZINC001540111268 1070767981 /nfs/dbraw/zinc/76/79/81/1070767981.db2.gz BCWVDFYUAWNBMN-BGYRXZFFSA-N 1 1 373.453 2.616 20 5 FFBDMO C[N@@H+](CCc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001326449884 1046938174 /nfs/dbraw/zinc/93/81/74/1046938174.db2.gz RPBVOBLKMBQLSV-WOJBJXKFSA-N 1 1 367.449 2.643 20 5 FFBDMO C[N@H+](CCc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449884 1046938182 /nfs/dbraw/zinc/93/81/82/1046938182.db2.gz RPBVOBLKMBQLSV-WOJBJXKFSA-N 1 1 367.449 2.643 20 5 FFBDMO C[N@@H+](CCc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449884 1046938190 /nfs/dbraw/zinc/93/81/90/1046938190.db2.gz RPBVOBLKMBQLSV-WOJBJXKFSA-N 1 1 367.449 2.643 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001331329576 1047868650 /nfs/dbraw/zinc/86/86/50/1047868650.db2.gz JMHKTJCOOVIVFX-SWLSCSKDSA-N 1 1 368.865 2.849 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cn3)CC2)cc1 ZINC001333113689 1048719707 /nfs/dbraw/zinc/71/97/07/1048719707.db2.gz VEBLRETVQIYVOG-UHFFFAOYSA-N 1 1 354.410 2.646 20 5 FFBDMO Cc1c(C(=O)OCc2cc(F)ccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001341775034 1050390518 /nfs/dbraw/zinc/39/05/18/1050390518.db2.gz GIQWIAFDHQIDAM-UHFFFAOYSA-N 1 1 356.313 2.980 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001542075474 1071164338 /nfs/dbraw/zinc/16/43/38/1071164338.db2.gz OMZGCVWXQSDFMP-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001340458560 1050852335 /nfs/dbraw/zinc/85/23/35/1050852335.db2.gz MXEMXZQQVABNIC-INIZCTEOSA-N 1 1 372.473 2.694 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001340876876 1051208859 /nfs/dbraw/zinc/20/88/59/1051208859.db2.gz AXMBHAZAMUBKAE-RDJZCZTQSA-N 1 1 372.473 2.737 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001341035324 1051372832 /nfs/dbraw/zinc/37/28/32/1051372832.db2.gz IWEIDFQNHAAFLT-INIZCTEOSA-N 1 1 356.430 2.536 20 5 FFBDMO CCn1c([C@@H]2CCC[N@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001341035324 1051372840 /nfs/dbraw/zinc/37/28/40/1051372840.db2.gz IWEIDFQNHAAFLT-INIZCTEOSA-N 1 1 356.430 2.536 20 5 FFBDMO CC(C)Cn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001342989090 1051605133 /nfs/dbraw/zinc/60/51/33/1051605133.db2.gz VPVVEIQODFYXKR-UONOGXRCSA-N 1 1 374.445 2.633 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC001307577642 1052323337 /nfs/dbraw/zinc/32/33/37/1052323337.db2.gz PDGWRBQYPNDRAU-UHFFFAOYSA-N 1 1 358.442 2.907 20 5 FFBDMO C[C@@H]1CCC[C@H](C[N@@H+](C)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001307851203 1052357015 /nfs/dbraw/zinc/35/70/15/1052357015.db2.gz MKCMRTSWOQVGEZ-CABCVRRESA-N 1 1 369.487 2.631 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ncccn2)CC1 ZINC001308090923 1052404348 /nfs/dbraw/zinc/40/43/48/1052404348.db2.gz NQZDQBPDTVPFBQ-CYBMUJFWSA-N 1 1 355.398 2.591 20 5 FFBDMO O=C1N[C@H](C2CC[NH+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)CO1 ZINC001308126201 1052412865 /nfs/dbraw/zinc/41/28/65/1052412865.db2.gz UUIFMVMJIQGDMN-INIZCTEOSA-N 1 1 372.381 2.570 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308123581 1052412897 /nfs/dbraw/zinc/41/28/97/1052412897.db2.gz BJBAAKUPIRSGMJ-LBPRGKRZSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308123581 1052412902 /nfs/dbraw/zinc/41/29/02/1052412902.db2.gz BJBAAKUPIRSGMJ-LBPRGKRZSA-N 1 1 354.407 2.628 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283580 1052441626 /nfs/dbraw/zinc/44/16/26/1052441626.db2.gz ZIFKFDVGXSQFAR-ICSRJNTNSA-N 1 1 355.438 2.567 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283580 1052441633 /nfs/dbraw/zinc/44/16/33/1052441633.db2.gz ZIFKFDVGXSQFAR-ICSRJNTNSA-N 1 1 355.438 2.567 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c(C(F)(F)F)c1 ZINC001335565338 1053439112 /nfs/dbraw/zinc/43/91/12/1053439112.db2.gz HYZISUMGJLTTMR-GJZGRUSLSA-N 1 1 359.348 2.649 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2[C@H](C1)C2(F)F ZINC001473295218 1055974593 /nfs/dbraw/zinc/97/45/93/1055974593.db2.gz YAPFNCVYZDGQNT-NEPJUHHUSA-N 1 1 355.341 2.519 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC(Oc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC001353085515 1056065259 /nfs/dbraw/zinc/06/52/59/1056065259.db2.gz JVAGQZQVGXCRHZ-FQEVSTJZSA-N 1 1 369.421 2.839 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]C/C=C\c2ccc(Cl)cc2)CC1 ZINC001200471096 1058298193 /nfs/dbraw/zinc/29/81/93/1058298193.db2.gz DIIDKMQQPMKQRQ-YTHBIGJYSA-N 1 1 363.845 2.599 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC001518643019 1058449384 /nfs/dbraw/zinc/44/93/84/1058449384.db2.gz PFGIARDXZYANQE-GOEBONIOSA-N 1 1 354.410 2.864 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC)CC[NH2+]2)cc1 ZINC001448451019 1058776508 /nfs/dbraw/zinc/77/65/08/1058776508.db2.gz NKUPUSGKBFDEJC-GOSISDBHSA-N 1 1 369.421 2.953 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3cc(C)cc([N+](=O)[O-])c3)n2C)C1 ZINC001519957323 1059244867 /nfs/dbraw/zinc/24/48/67/1059244867.db2.gz PBRXCWGZRUGODT-HNNXBMFYSA-N 1 1 372.473 2.867 20 5 FFBDMO CCC[N@H+]1CC[C@@H](Cn2c(C)nnc2N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001547168158 1071928470 /nfs/dbraw/zinc/92/84/70/1071928470.db2.gz JHSIBPAXUKHJJZ-MRXNPFEDSA-N 1 1 372.473 2.863 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848477208 1060097305 /nfs/dbraw/zinc/09/73/05/1060097305.db2.gz NFXOQSSBWJRKNU-HNNXBMFYSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000848484339 1060123722 /nfs/dbraw/zinc/12/37/22/1060123722.db2.gz ZAQKVUIIKRBZNG-MOPGFXCFSA-N 1 1 373.453 2.759 20 5 FFBDMO COCCO[C@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848487892 1060136530 /nfs/dbraw/zinc/13/65/30/1060136530.db2.gz ZWKLXKMSMZXQOE-INIZCTEOSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848487892 1060136538 /nfs/dbraw/zinc/13/65/38/1060136538.db2.gz ZWKLXKMSMZXQOE-INIZCTEOSA-N 1 1 360.414 2.543 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000848490366 1060145448 /nfs/dbraw/zinc/14/54/48/1060145448.db2.gz ZZLOHHNZLUQQRG-YTQUADARSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C(OC[C@@H]1CC[N@H+]1C1CCOCC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001517121114 1060355584 /nfs/dbraw/zinc/35/55/84/1060355584.db2.gz CSAFCRRHCJXIDI-SFHVURJKSA-N 1 1 374.437 2.813 20 5 FFBDMO CC(C)(C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC001517124896 1060355845 /nfs/dbraw/zinc/35/58/45/1060355845.db2.gz PVLALCZWYAFWRV-KRWDZBQOSA-N 1 1 362.426 2.669 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC001517276309 1060432595 /nfs/dbraw/zinc/43/25/95/1060432595.db2.gz OVHPTTVVOUUTLA-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC001517276309 1060432603 /nfs/dbraw/zinc/43/26/03/1060432603.db2.gz OVHPTTVVOUUTLA-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC001458044275 1060500124 /nfs/dbraw/zinc/50/01/24/1060500124.db2.gz HWOHIKHIITYPRW-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001355719039 1060529605 /nfs/dbraw/zinc/52/96/05/1060529605.db2.gz URVVMTQQMNMTCO-HNNXBMFYSA-N 1 1 370.457 2.702 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NCc1c[nH+]c2n1CCC2 ZINC001458601786 1060632795 /nfs/dbraw/zinc/63/27/95/1060632795.db2.gz IIYARPKAKZSFJR-UHFFFAOYSA-N 1 1 350.762 2.790 20 5 FFBDMO C[C@H](Cc1cccs1)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001459628811 1060784186 /nfs/dbraw/zinc/78/41/86/1060784186.db2.gz PZTDBXJDOIFXPI-CYBMUJFWSA-N 1 1 368.480 2.993 20 5 FFBDMO C[C@H](Cc1cccs1)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001459628811 1060784203 /nfs/dbraw/zinc/78/42/03/1060784203.db2.gz PZTDBXJDOIFXPI-CYBMUJFWSA-N 1 1 368.480 2.993 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)c1cc(C(=O)OC)[nH]c1C)c1cccc([N+](=O)[O-])c1 ZINC001459864229 1060835050 /nfs/dbraw/zinc/83/50/50/1060835050.db2.gz VYVJKVWBVUFQFG-HNNXBMFYSA-N 1 1 359.382 2.942 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC001459980528 1060864381 /nfs/dbraw/zinc/86/43/81/1060864381.db2.gz TYSYLIKYCXHSLT-UHFFFAOYSA-N 1 1 374.393 2.657 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001526057866 1060988618 /nfs/dbraw/zinc/98/86/18/1060988618.db2.gz MXZIUHSMMOCNIB-MJGOQNOKSA-N 1 1 351.406 2.941 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001546208132 1061310207 /nfs/dbraw/zinc/31/02/07/1061310207.db2.gz GMCQQGRNPUGWEX-GOEBONIOSA-N 1 1 368.437 2.817 20 5 FFBDMO Cn1nc(C(=O)OC(C)(C)C)cc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001462151931 1061518557 /nfs/dbraw/zinc/51/85/57/1061518557.db2.gz UKTLSTUMUMBERA-UHFFFAOYSA-N 1 1 374.441 2.958 20 5 FFBDMO Cn1nc(C(=O)OC(C)(C)C)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001462151931 1061518574 /nfs/dbraw/zinc/51/85/74/1061518574.db2.gz UKTLSTUMUMBERA-UHFFFAOYSA-N 1 1 374.441 2.958 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC001530919680 1062664180 /nfs/dbraw/zinc/66/41/80/1062664180.db2.gz WECKVMXMABBESE-JTPHSUOKSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC001530919680 1062664184 /nfs/dbraw/zinc/66/41/84/1062664184.db2.gz WECKVMXMABBESE-JTPHSUOKSA-N 1 1 365.433 2.993 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001471234203 1064607582 /nfs/dbraw/zinc/60/75/82/1064607582.db2.gz CZBMXIDGRRTLMB-CQSZACIVSA-N 1 1 363.462 2.968 20 5 FFBDMO C[C@H](CNC(=O)c1cc(C[NH+]2CCCC2)on1)c1ccccc1[N+](=O)[O-] ZINC001472149442 1064955473 /nfs/dbraw/zinc/95/54/73/1064955473.db2.gz QNJIBKDGGWRDBT-CYBMUJFWSA-N 1 1 358.398 2.712 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC001472844147 1065155593 /nfs/dbraw/zinc/15/55/93/1065155593.db2.gz GKMNKPWRYDBPIS-OAHLLOKOSA-N 1 1 370.409 2.771 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)C(=O)OCC ZINC001473442218 1065263568 /nfs/dbraw/zinc/26/35/68/1065263568.db2.gz ZCZSSSPUKFXCLJ-CQSZACIVSA-N 1 1 365.430 2.895 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2ncccn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC001473804699 1065370420 /nfs/dbraw/zinc/37/04/20/1065370420.db2.gz IOAPOTKQUYJWTG-CYBMUJFWSA-N 1 1 373.388 2.732 20 5 FFBDMO C[C@@H]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H]1CCC[NH3+] ZINC001579421012 1078627479 /nfs/dbraw/zinc/62/74/79/1078627479.db2.gz UBUXUACERGRTRJ-FZKQIMNGSA-N 1 1 371.441 2.965 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001585427191 1079462603 /nfs/dbraw/zinc/46/26/03/1079462603.db2.gz CQGMAVCKTPFNFQ-UHFFFAOYSA-N 1 1 350.806 2.927 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2C[N@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC001557984937 1075922445 /nfs/dbraw/zinc/92/24/45/1075922445.db2.gz HWBAHZZULUMVKI-MSOLQXFVSA-N 1 1 353.422 2.865 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(Nc2ccc3[nH+]ccn3c2)c([N+](=O)[O-])c1 ZINC001559243230 1076138652 /nfs/dbraw/zinc/13/86/52/1076138652.db2.gz VHBJCZWJXWRILK-UHFFFAOYSA-N 1 1 362.349 2.951 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N[C@H]3CCC[N@H+]4CCSC[C@H]34)c2c1 ZINC001559277866 1076144796 /nfs/dbraw/zinc/14/47/96/1076144796.db2.gz FTONSZGELDINQS-DOTOQJQBSA-N 1 1 374.466 2.565 20 5 FFBDMO COC(=O)c1cc(C(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)[nH]1 ZINC001559686461 1076182676 /nfs/dbraw/zinc/18/26/76/1076182676.db2.gz CRQDUDVSHATYOO-NSHDSACASA-N 1 1 359.382 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2cc(O)ccc2C1 ZINC001560240716 1076255068 /nfs/dbraw/zinc/25/50/68/1076255068.db2.gz UYBLMLHGLPDFNM-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO CN1CCN(c2ccc(CC[NH2+]CCc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC001561055574 1076326468 /nfs/dbraw/zinc/32/64/68/1076326468.db2.gz PUKDIZQATIEOPH-UHFFFAOYSA-N 1 1 368.481 2.721 20 5 FFBDMO C[C@H](CNC(=O)NCc1c[nH+]c2n1CCCC2)c1ccccc1[N+](=O)[O-] ZINC001564732824 1076656645 /nfs/dbraw/zinc/65/66/45/1076656645.db2.gz QSMOKPLWTAIGME-CYBMUJFWSA-N 1 1 357.414 2.731 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccccc2Cl)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001567998128 1077065246 /nfs/dbraw/zinc/06/52/46/1077065246.db2.gz BHVJXZIWSOUUST-UKRRQHHQSA-N 1 1 351.834 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C(C)(C)C ZINC001570910763 1077242163 /nfs/dbraw/zinc/24/21/63/1077242163.db2.gz RIFCDKCJULAGCF-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876087 1080823479 /nfs/dbraw/zinc/82/34/79/1080823479.db2.gz NSNMLOZCANJMOS-NSHDSACASA-N 1 1 373.442 2.769 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590049063 1080977889 /nfs/dbraw/zinc/97/78/89/1080977889.db2.gz CXIAYYRRVQREOX-NSHDSACASA-N 1 1 354.370 2.674 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590049063 1080977893 /nfs/dbraw/zinc/97/78/93/1080977893.db2.gz CXIAYYRRVQREOX-NSHDSACASA-N 1 1 354.370 2.674 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008776 251036748 /nfs/dbraw/zinc/03/67/48/251036748.db2.gz MYQHJKAQTKZQEM-BLLLJJGKSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008776 251036752 /nfs/dbraw/zinc/03/67/52/251036752.db2.gz MYQHJKAQTKZQEM-BLLLJJGKSA-N 1 1 364.833 2.927 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000173521241 251198952 /nfs/dbraw/zinc/19/89/52/251198952.db2.gz XQQALWDAKZBORE-LJQANCHMSA-N 1 1 367.449 2.818 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000272484268 252049585 /nfs/dbraw/zinc/04/95/85/252049585.db2.gz VKYKVTTUPGSIOZ-LBPRGKRZSA-N 1 1 366.849 2.574 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000273055987 252203300 /nfs/dbraw/zinc/20/33/00/252203300.db2.gz RUNRSVFKWCJLLH-OXJNMPFZSA-N 1 1 372.421 2.580 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000278254997 256292453 /nfs/dbraw/zinc/29/24/53/256292453.db2.gz HAPTYGNBCNVGTN-UHFFFAOYSA-N 1 1 355.394 2.911 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000279039890 256374960 /nfs/dbraw/zinc/37/49/60/256374960.db2.gz ADMKHVLUIDGCMW-NSHDSACASA-N 1 1 357.813 2.730 20 5 FFBDMO CCn1nccc1C1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000279053215 256376429 /nfs/dbraw/zinc/37/64/29/256376429.db2.gz KSUCNGPOYJYSEG-UHFFFAOYSA-N 1 1 371.441 2.938 20 5 FFBDMO Cc1c(C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000286113097 257020891 /nfs/dbraw/zinc/02/08/91/257020891.db2.gz GDWOBZCUHVJGRY-FUNVUKJBSA-N 1 1 362.386 2.509 20 5 FFBDMO O=c1[nH]c(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000286290894 257029848 /nfs/dbraw/zinc/02/98/48/257029848.db2.gz RXPLBPGCTVARNC-SJCJKPOMSA-N 1 1 369.425 2.697 20 5 FFBDMO O=c1[nH]c(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000286290910 257029851 /nfs/dbraw/zinc/02/98/51/257029851.db2.gz RXPLBPGCTVARNC-YVEFUNNKSA-N 1 1 369.425 2.697 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000287075847 257070681 /nfs/dbraw/zinc/07/06/81/257070681.db2.gz NYPDJCSPSWZMES-INIZCTEOSA-N 1 1 362.474 2.757 20 5 FFBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000286377254 257034181 /nfs/dbraw/zinc/03/41/81/257034181.db2.gz IFRJUFMMXBJZSK-AWEZNQCLSA-N 1 1 373.413 2.526 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705301 257294770 /nfs/dbraw/zinc/29/47/70/257294770.db2.gz CBNIGHRQBPPQOM-CABCVRRESA-N 1 1 357.414 2.682 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705301 257294771 /nfs/dbraw/zinc/29/47/71/257294771.db2.gz CBNIGHRQBPPQOM-CABCVRRESA-N 1 1 357.414 2.682 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000289889421 257304814 /nfs/dbraw/zinc/30/48/14/257304814.db2.gz RVWXQYINTWCUKC-HZPDHXFCSA-N 1 1 352.431 2.614 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])C2 ZINC000289939925 257307707 /nfs/dbraw/zinc/30/77/07/257307707.db2.gz CKEJNRBBBLNABC-HNNXBMFYSA-N 1 1 371.441 2.589 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000291265556 257394822 /nfs/dbraw/zinc/39/48/22/257394822.db2.gz NGTXNSIXVVULPS-FQEVSTJZSA-N 1 1 372.421 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(NC[C@@]3([NH+]4CCOCC4)CCSC3)ccc2c1 ZINC000301126717 258027611 /nfs/dbraw/zinc/02/76/11/258027611.db2.gz WVUHMWQCDTYINO-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO CNC(=O)c1ccc(Nc2cccc(C[NH+]3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000301152988 258029169 /nfs/dbraw/zinc/02/91/69/258029169.db2.gz PYAXIHWJXXCIOA-UHFFFAOYSA-N 1 1 370.409 2.530 20 5 FFBDMO Nc1nc(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000302200701 258094410 /nfs/dbraw/zinc/09/44/10/258094410.db2.gz ZDZNDCPBRWHGEL-OWCLPIDISA-N 1 1 368.441 2.680 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000301647506 258060842 /nfs/dbraw/zinc/06/08/42/258060842.db2.gz DLXZBHMWZIKYNN-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000301875636 258071962 /nfs/dbraw/zinc/07/19/62/258071962.db2.gz MOLBNUYVIDEWEC-ZFWWWQNUSA-N 1 1 362.817 2.691 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000064995696 506248509 /nfs/dbraw/zinc/24/85/09/506248509.db2.gz HQVBYLSIAWHTOD-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])[NH+](C)C ZINC000032695090 506280929 /nfs/dbraw/zinc/28/09/29/506280929.db2.gz ALVXZVRXFZZLEG-MRXNPFEDSA-N 1 1 357.410 2.945 20 5 FFBDMO CC(C)(C(=O)NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1F ZINC000375302475 512257569 /nfs/dbraw/zinc/25/75/69/512257569.db2.gz KOIXCHMZAITQMK-UHFFFAOYSA-N 1 1 360.389 2.861 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccco1 ZINC000066041919 506413951 /nfs/dbraw/zinc/41/39/51/506413951.db2.gz GKWVVGPOXQOIEY-MRXNPFEDSA-N 1 1 356.382 2.562 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)CC1 ZINC000066468228 506528416 /nfs/dbraw/zinc/52/84/16/506528416.db2.gz MVLOWSBXYNPTIL-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000054645397 506594105 /nfs/dbraw/zinc/59/41/05/506594105.db2.gz CRAITIWBGJXJTH-UHFFFAOYSA-N 1 1 370.453 2.959 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000042108534 506597613 /nfs/dbraw/zinc/59/76/13/506597613.db2.gz AIOBMWXKIGVGCW-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO O=C(NC1CC1)[C@H]([NH2+]CCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000010172947 506730208 /nfs/dbraw/zinc/73/02/08/506730208.db2.gz FKOODXVCTDTBQU-GOSISDBHSA-N 1 1 372.400 2.755 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000055407752 506745204 /nfs/dbraw/zinc/74/52/04/506745204.db2.gz QWLLNOZHKWMIGO-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO Cc1ccc([C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[NH+](C)C)cc1 ZINC000067267892 506810392 /nfs/dbraw/zinc/81/03/92/506810392.db2.gz YEBSMIBSVDLASX-QGZVFWFLSA-N 1 1 367.409 2.812 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1[C@@H]1CNC(=O)C1 ZINC000367027751 512302439 /nfs/dbraw/zinc/30/24/39/512302439.db2.gz GURUJLDDOZSQFH-YOEHRIQHSA-N 1 1 361.442 2.873 20 5 FFBDMO C[N@H+](Cc1ccc2c(c1)OCO2)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375175 506850456 /nfs/dbraw/zinc/85/04/56/506850456.db2.gz BHECPCZSQNQLRH-INIZCTEOSA-N 1 1 369.377 2.561 20 5 FFBDMO C[N@@H+](Cc1ccc2c(c1)OCO2)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375175 506850466 /nfs/dbraw/zinc/85/04/66/506850466.db2.gz BHECPCZSQNQLRH-INIZCTEOSA-N 1 1 369.377 2.561 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1csc([N+](=O)[O-])c1 ZINC000056040247 506916036 /nfs/dbraw/zinc/91/60/36/506916036.db2.gz ZCZNVRJHPNIXFE-UHFFFAOYSA-N 1 1 361.423 2.783 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000045623078 506993130 /nfs/dbraw/zinc/99/31/30/506993130.db2.gz NOOZOTSIOAUBTM-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000045623078 506993138 /nfs/dbraw/zinc/99/31/38/506993138.db2.gz NOOZOTSIOAUBTM-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000067778537 507006378 /nfs/dbraw/zinc/00/63/78/507006378.db2.gz XOINLYAGDQNNIJ-QGZVFWFLSA-N 1 1 373.409 2.645 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000056460080 507018022 /nfs/dbraw/zinc/01/80/22/507018022.db2.gz DPXNEBDZKUDZIL-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000067961856 507069042 /nfs/dbraw/zinc/06/90/42/507069042.db2.gz NROZYBNPVVPMHR-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000067961856 507069049 /nfs/dbraw/zinc/06/90/49/507069049.db2.gz NROZYBNPVVPMHR-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541982 507179131 /nfs/dbraw/zinc/17/91/31/507179131.db2.gz ZOYBJUSBXPRABE-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541982 507179133 /nfs/dbraw/zinc/17/91/33/507179133.db2.gz ZOYBJUSBXPRABE-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH+](Cc3cccc(C)c3)CC2)cc1[N+](=O)[O-] ZINC000021926449 507273539 /nfs/dbraw/zinc/27/35/39/507273539.db2.gz SDPYHJHQNPKHLD-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000068935825 507365690 /nfs/dbraw/zinc/36/56/90/507365690.db2.gz WASDLXFSMVWUSB-ZIAGYGMSSA-N 1 1 351.472 2.922 20 5 FFBDMO O=[N+]([O-])c1c(NCc2ccccc2C[NH+]2CCOCC2)nc2sccn21 ZINC000058304114 507403521 /nfs/dbraw/zinc/40/35/21/507403521.db2.gz GJHITHGHLDQFCL-UHFFFAOYSA-N 1 1 373.438 2.748 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000060064773 507511906 /nfs/dbraw/zinc/51/19/06/507511906.db2.gz GEWOYVQTNOQMGB-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000060064773 507511913 /nfs/dbraw/zinc/51/19/13/507511913.db2.gz GEWOYVQTNOQMGB-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1C ZINC000060443101 507543747 /nfs/dbraw/zinc/54/37/47/507543747.db2.gz QKUJXNSXZFCGQP-HUUCEWRRSA-N 1 1 369.487 2.753 20 5 FFBDMO COC(=O)c1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026209037 507568767 /nfs/dbraw/zinc/56/87/67/507568767.db2.gz SXNWZHHSMDOSLZ-CYBMUJFWSA-N 1 1 371.393 2.840 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026209037 507568776 /nfs/dbraw/zinc/56/87/76/507568776.db2.gz SXNWZHHSMDOSLZ-CYBMUJFWSA-N 1 1 371.393 2.840 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CCc2ccccc21 ZINC000026915682 507620532 /nfs/dbraw/zinc/62/05/32/507620532.db2.gz IYYVDXBOSQZJIJ-HNNXBMFYSA-N 1 1 369.377 2.881 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CCc2ccccc21 ZINC000026915682 507620534 /nfs/dbraw/zinc/62/05/34/507620534.db2.gz IYYVDXBOSQZJIJ-HNNXBMFYSA-N 1 1 369.377 2.881 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000063723589 507763949 /nfs/dbraw/zinc/76/39/49/507763949.db2.gz IZEFVHNRJFAXBW-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000063821890 507773599 /nfs/dbraw/zinc/77/35/99/507773599.db2.gz MGBQCYABPWEEAI-LBPRGKRZSA-N 1 1 352.410 2.701 20 5 FFBDMO Cc1nn(C)c(NCc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000051956969 507790391 /nfs/dbraw/zinc/79/03/91/507790391.db2.gz KPKKTHLRSXMCIZ-OKILXGFUSA-N 1 1 373.457 2.858 20 5 FFBDMO CCOC(=O)c1ccnc(N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000077994909 507825308 /nfs/dbraw/zinc/82/53/08/507825308.db2.gz BFHSRVBFGDVSFP-UHFFFAOYSA-N 1 1 362.430 2.621 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000089307126 507828606 /nfs/dbraw/zinc/82/86/06/507828606.db2.gz HWNQONKBUFVCRY-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO O=C(CCN1CC[C@@H](C[NH+]2CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000072720096 507847390 /nfs/dbraw/zinc/84/73/90/507847390.db2.gz CLODKSJNMAWUAP-INIZCTEOSA-N 1 1 360.458 2.731 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000072760392 507850514 /nfs/dbraw/zinc/85/05/14/507850514.db2.gz UIFXGQJETFQOFN-MRXNPFEDSA-N 1 1 369.421 2.732 20 5 FFBDMO CNC(=O)CC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089907626 507882114 /nfs/dbraw/zinc/88/21/14/507882114.db2.gz UWRYDDBYJJKFQD-UHFFFAOYSA-N 1 1 358.398 2.598 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108300930 507885056 /nfs/dbraw/zinc/88/50/56/507885056.db2.gz AXRNLILVZLCVSU-AWEZNQCLSA-N 1 1 372.450 2.932 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000089929003 507885565 /nfs/dbraw/zinc/88/55/65/507885565.db2.gz BTCMQATTYUVRMA-WDEREUQCSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCCO)CC(C)(C)C ZINC000109747646 507984306 /nfs/dbraw/zinc/98/43/06/507984306.db2.gz HVVAFWRQWCYBQB-UHFFFAOYSA-N 1 1 367.446 2.663 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)c1 ZINC000091457126 507987541 /nfs/dbraw/zinc/98/75/41/507987541.db2.gz XOJXFZRJHNVXKH-UHFFFAOYSA-N 1 1 370.409 2.990 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC ZINC000091832700 508017294 /nfs/dbraw/zinc/01/72/94/508017294.db2.gz AOXJJCSINCNKCD-LBPRGKRZSA-N 1 1 362.386 2.683 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC ZINC000091832700 508017296 /nfs/dbraw/zinc/01/72/96/508017296.db2.gz AOXJJCSINCNKCD-LBPRGKRZSA-N 1 1 362.386 2.683 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000110996804 508064277 /nfs/dbraw/zinc/06/42/77/508064277.db2.gz JPGAVELYMIISRF-INIZCTEOSA-N 1 1 371.441 2.600 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000092456421 508072324 /nfs/dbraw/zinc/07/23/24/508072324.db2.gz AXSDPRIGJFCDJE-HNNXBMFYSA-N 1 1 372.425 2.770 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@H]1CO)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111415234 508096820 /nfs/dbraw/zinc/09/68/20/508096820.db2.gz RVKACDKDOPWEHP-ZDUSSCGKSA-N 1 1 370.837 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)n2)cc1 ZINC000080961723 508117778 /nfs/dbraw/zinc/11/77/78/508117778.db2.gz MQSDZVDUQVIURO-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)n2)cc1 ZINC000080961723 508117781 /nfs/dbraw/zinc/11/77/81/508117781.db2.gz MQSDZVDUQVIURO-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000075896385 508142040 /nfs/dbraw/zinc/14/20/40/508142040.db2.gz KQKPZJQNADDTID-QAPCUYQASA-N 1 1 374.437 2.906 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093360495 508142323 /nfs/dbraw/zinc/14/23/23/508142323.db2.gz OQHJKPRNHYNJAQ-CYBMUJFWSA-N 1 1 360.439 2.676 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093360495 508142325 /nfs/dbraw/zinc/14/23/25/508142325.db2.gz OQHJKPRNHYNJAQ-CYBMUJFWSA-N 1 1 360.439 2.676 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC(C)(CO)CO ZINC000093502687 508146389 /nfs/dbraw/zinc/14/63/89/508146389.db2.gz IUFNPYQEHAOICD-UHFFFAOYSA-N 1 1 350.440 2.746 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC(C)(CO)CO ZINC000093502564 508146857 /nfs/dbraw/zinc/14/68/57/508146857.db2.gz DMUVXEDZRFKTBZ-UHFFFAOYSA-N 1 1 350.440 2.746 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081293431 508157528 /nfs/dbraw/zinc/15/75/28/508157528.db2.gz XQXDFOIRTYHXGF-MRXNPFEDSA-N 1 1 361.442 2.744 20 5 FFBDMO CCCC[N@@H+](C)CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000112333579 508175715 /nfs/dbraw/zinc/17/57/15/508175715.db2.gz MEYAEHKXTHMMBD-UHFFFAOYSA-N 1 1 359.430 2.703 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081534130 508187354 /nfs/dbraw/zinc/18/73/54/508187354.db2.gz YABSQSOXKZQYKL-QGZVFWFLSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415914 508203832 /nfs/dbraw/zinc/20/38/32/508203832.db2.gz RAMKJMZGQFEYFI-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415914 508203833 /nfs/dbraw/zinc/20/38/33/508203833.db2.gz RAMKJMZGQFEYFI-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO CCN(CC)C(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000083169742 508238199 /nfs/dbraw/zinc/23/81/99/508238199.db2.gz JGWLUMKNRONMMX-UHFFFAOYSA-N 1 1 360.414 2.816 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@H]2[C@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460663 508317180 /nfs/dbraw/zinc/31/71/80/508317180.db2.gz CUJHIZRBXHTJSG-DOTOQJQBSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@H]2[C@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460663 508317182 /nfs/dbraw/zinc/31/71/82/508317182.db2.gz CUJHIZRBXHTJSG-DOTOQJQBSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000133600346 508422730 /nfs/dbraw/zinc/42/27/30/508422730.db2.gz NUKJZUSNAXNDJH-WBMJQRKESA-N 1 1 365.405 2.831 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000122202622 508497939 /nfs/dbraw/zinc/49/79/39/508497939.db2.gz YBTPALGNNHIFDW-HNNXBMFYSA-N 1 1 358.373 2.888 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134710229 508561180 /nfs/dbraw/zinc/56/11/80/508561180.db2.gz FWJIVHNCHAKLTL-HNNXBMFYSA-N 1 1 358.442 2.999 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000123350442 508673896 /nfs/dbraw/zinc/67/38/96/508673896.db2.gz ZCGNFKRNIRLLIY-OLZOCXBDSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cccc2[nH+]c(Cn3cc(Br)cc([N+](=O)[O-])c3=O)cn21 ZINC000158270755 508681201 /nfs/dbraw/zinc/68/12/01/508681201.db2.gz AFXUEANHVAKQFP-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](c2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000123408608 508682148 /nfs/dbraw/zinc/68/21/48/508682148.db2.gz GJBOIUFRPABKMG-KRWDZBQOSA-N 1 1 351.406 2.973 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968754 508688788 /nfs/dbraw/zinc/68/87/88/508688788.db2.gz OXZJUFYRMICVNM-QZTJIDSGSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968754 508688789 /nfs/dbraw/zinc/68/87/89/508688789.db2.gz OXZJUFYRMICVNM-QZTJIDSGSA-N 1 1 373.453 2.763 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123492839 508695094 /nfs/dbraw/zinc/69/50/94/508695094.db2.gz UWPVULNMSRNPJZ-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123651587 508720671 /nfs/dbraw/zinc/72/06/71/508720671.db2.gz VSMYRLNAXWWUJV-HUUCEWRRSA-N 1 1 371.441 2.610 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593604 508725962 /nfs/dbraw/zinc/72/59/62/508725962.db2.gz SPPLINHUNNJSBU-ZBFHGGJFSA-N 1 1 357.414 2.561 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137527494 508759481 /nfs/dbraw/zinc/75/94/81/508759481.db2.gz AGYDHZJKODIEMD-CRAIPNDOSA-N 1 1 353.422 2.917 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC2(CCCC2)C1 ZINC000139782934 508795077 /nfs/dbraw/zinc/79/50/77/508795077.db2.gz CKNQOVCDOKTKMY-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO Cc1c(NC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000119490718 508806695 /nfs/dbraw/zinc/80/66/95/508806695.db2.gz YBGQBWKSDZPPFZ-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000369458944 512419774 /nfs/dbraw/zinc/41/97/74/512419774.db2.gz SNGWOXXRYFTORW-UONOGXRCSA-N 1 1 367.833 2.760 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000144838347 508841041 /nfs/dbraw/zinc/84/10/41/508841041.db2.gz HQVBYLSIAWHTOD-HZPDHXFCSA-N 1 1 363.458 2.990 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000119749546 508855592 /nfs/dbraw/zinc/85/55/92/508855592.db2.gz MAABMHMPKPHZLZ-YJBOKZPZSA-N 1 1 353.422 2.774 20 5 FFBDMO CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccco1 ZINC000130923269 508866170 /nfs/dbraw/zinc/86/61/70/508866170.db2.gz XPEDCJGGGKKFOL-NSHDSACASA-N 1 1 373.456 2.611 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000159763021 508887274 /nfs/dbraw/zinc/88/72/74/508887274.db2.gz LKPBFNSDQBWSIU-OAHLLOKOSA-N 1 1 365.455 2.744 20 5 FFBDMO Cc1ccc([C@@H]2CSCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159830981 508897848 /nfs/dbraw/zinc/89/78/48/508897848.db2.gz JSBPYIVAPSJATJ-KRWDZBQOSA-N 1 1 359.451 2.855 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000159855819 508901860 /nfs/dbraw/zinc/90/18/60/508901860.db2.gz BDDREKZQTNJVLV-HNNXBMFYSA-N 1 1 359.451 2.871 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000160317344 508969149 /nfs/dbraw/zinc/96/91/49/508969149.db2.gz CHYRZXDIOUGGBO-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000120366970 508981803 /nfs/dbraw/zinc/98/18/03/508981803.db2.gz GLSJGDKHDNTIKG-IUODEOHRSA-N 1 1 350.419 2.797 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120535783 509016372 /nfs/dbraw/zinc/01/63/72/509016372.db2.gz HREQYWKQKJOAMS-SNVBAGLBSA-N 1 1 358.236 2.817 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000151703465 509070050 /nfs/dbraw/zinc/07/00/50/509070050.db2.gz KKPFGRXNODKAOL-IRXDYDNUSA-N 1 1 373.409 2.739 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000151703465 509070053 /nfs/dbraw/zinc/07/00/53/509070053.db2.gz KKPFGRXNODKAOL-IRXDYDNUSA-N 1 1 373.409 2.739 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000121077373 509122994 /nfs/dbraw/zinc/12/29/94/509122994.db2.gz KEDBWUQDOLQKTC-CQSZACIVSA-N 1 1 358.442 2.855 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1 ZINC000121083068 509123724 /nfs/dbraw/zinc/12/37/24/509123724.db2.gz DSYZUHQUTXZMBY-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121396972 509171850 /nfs/dbraw/zinc/17/18/50/509171850.db2.gz AYFIWKKHHFHISS-GOSISDBHSA-N 1 1 372.469 2.927 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000247920489 509191310 /nfs/dbraw/zinc/19/13/10/509191310.db2.gz BDTHXDIYRLQRGG-IAGOWNOFSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCC[C@H](C)C1 ZINC000248003558 509214582 /nfs/dbraw/zinc/21/45/82/509214582.db2.gz OQDCHXWRUJVNLF-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000172843003 509266775 /nfs/dbraw/zinc/26/67/75/509266775.db2.gz MQXRSTMSANVOCH-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000248454444 509329675 /nfs/dbraw/zinc/32/96/75/509329675.db2.gz KKHSEBDEYDQSSC-ZWKOTPCHSA-N 1 1 371.437 2.911 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000173071959 509378392 /nfs/dbraw/zinc/37/83/92/509378392.db2.gz DRANNEUEUOWPJR-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000173076838 509381371 /nfs/dbraw/zinc/38/13/71/509381371.db2.gz YAHSBLFIPXHWHH-GOSISDBHSA-N 1 1 353.422 2.918 20 5 FFBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000192171259 509385940 /nfs/dbraw/zinc/38/59/40/509385940.db2.gz WXYQPMPGNMEHJH-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000163885118 509437332 /nfs/dbraw/zinc/43/73/32/509437332.db2.gz MUHUECGMMKKNGI-OAHLLOKOSA-N 1 1 358.442 2.753 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000173182625 509442219 /nfs/dbraw/zinc/44/22/19/509442219.db2.gz FUKFESZYGHGUFD-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CC[N@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000165725625 509581052 /nfs/dbraw/zinc/58/10/52/509581052.db2.gz DSXQRHVWWVXTQY-SNVBAGLBSA-N 1 1 355.236 2.957 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](N2CCCCC2)C1 ZINC000264582389 509612794 /nfs/dbraw/zinc/61/27/94/509612794.db2.gz JUJMCXDODQNXSV-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](N2CCCCC2)C1 ZINC000264582389 509612801 /nfs/dbraw/zinc/61/28/01/509612801.db2.gz JUJMCXDODQNXSV-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000249284622 509647008 /nfs/dbraw/zinc/64/70/08/509647008.db2.gz OWVLWDARAPYHQQ-BLLLJJGKSA-N 1 1 351.378 2.563 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179868580 509654745 /nfs/dbraw/zinc/65/47/45/509654745.db2.gz CAFPSTSZBPOKLX-LBPRGKRZSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179868580 509654749 /nfs/dbraw/zinc/65/47/49/509654749.db2.gz CAFPSTSZBPOKLX-LBPRGKRZSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@H](C)O)C1CCCCC1 ZINC000170691607 509724863 /nfs/dbraw/zinc/72/48/63/509724863.db2.gz VRPMPGWKKMKMPP-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO COC(=O)c1cc(NC(=O)c2sccc2C[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000268120417 509767850 /nfs/dbraw/zinc/76/78/50/509767850.db2.gz NNGASYCIDJTEPN-UHFFFAOYSA-N 1 1 363.395 2.757 20 5 FFBDMO CC(C)[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000249811692 509768443 /nfs/dbraw/zinc/76/84/43/509768443.db2.gz IGWGVXRPYUPZED-IIDMSEBBSA-N 1 1 363.458 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H](O)CN3CCCC3)s2)cc1 ZINC000237964358 509788142 /nfs/dbraw/zinc/78/81/42/509788142.db2.gz BZMRZXZQLNMLKH-MRXNPFEDSA-N 1 1 361.467 2.870 20 5 FFBDMO C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000176980057 509796473 /nfs/dbraw/zinc/79/64/73/509796473.db2.gz DTHBXCQCVUDCRT-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000193164832 509802537 /nfs/dbraw/zinc/80/25/37/509802537.db2.gz HTCIUUGXPLAFLV-INIZCTEOSA-N 1 1 354.410 2.693 20 5 FFBDMO C[C@@H]1CN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1CC(C)(C)O ZINC000189884856 509809379 /nfs/dbraw/zinc/80/93/79/509809379.db2.gz RSHDFRWAJUWUHD-CQSZACIVSA-N 1 1 374.441 2.527 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173846926 509814122 /nfs/dbraw/zinc/81/41/22/509814122.db2.gz FLFIPAZUHCIZTH-ZBFHGGJFSA-N 1 1 367.471 2.539 20 5 FFBDMO CCOC(=O)c1cc(NC[C@H](C(C)C)[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000177049152 509839724 /nfs/dbraw/zinc/83/97/24/509839724.db2.gz ZAWISYKRUWLYEV-QGZVFWFLSA-N 1 1 365.430 2.540 20 5 FFBDMO C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000189953821 509850206 /nfs/dbraw/zinc/85/02/06/509850206.db2.gz DWFVBNFXFMBOIX-HOTGVXAUSA-N 1 1 357.458 2.538 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000183585858 509873332 /nfs/dbraw/zinc/87/33/32/509873332.db2.gz GBURDIOQKXCHKJ-DZGCQCFKSA-N 1 1 355.398 2.774 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000183601830 509880745 /nfs/dbraw/zinc/88/07/45/509880745.db2.gz PHUSGXXKWHKKIQ-UHFFFAOYSA-N 1 1 355.398 2.730 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O ZINC000190043601 509904479 /nfs/dbraw/zinc/90/44/79/509904479.db2.gz LEGIXEOTHLARCP-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO CCc1cc(NCC[N@@H+](C)CCOC)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171070386 509923568 /nfs/dbraw/zinc/92/35/68/509923568.db2.gz ABVXQQXPWVRVAH-UHFFFAOYSA-N 1 1 359.430 2.604 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000255346240 509924410 /nfs/dbraw/zinc/92/44/10/509924410.db2.gz NCQMMKBHDKALIM-OCCSQVGLSA-N 1 1 373.413 2.554 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000255346240 509924416 /nfs/dbraw/zinc/92/44/16/509924416.db2.gz NCQMMKBHDKALIM-OCCSQVGLSA-N 1 1 373.413 2.554 20 5 FFBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000245457951 509946576 /nfs/dbraw/zinc/94/65/76/509946576.db2.gz CJCZLGBGKHJRLS-GDZNZVCISA-N 1 1 366.849 2.930 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000180487426 509951557 /nfs/dbraw/zinc/95/15/57/509951557.db2.gz LRKIEYBQTOLETB-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265284415 509966662 /nfs/dbraw/zinc/96/66/62/509966662.db2.gz JFMLLZICXQPKNK-KGLIPLIRSA-N 1 1 351.472 2.876 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177279586 509976295 /nfs/dbraw/zinc/97/62/95/509976295.db2.gz IAEYUEQUJBXOGC-GFCCVEGCSA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000174344551 510069366 /nfs/dbraw/zinc/06/93/66/510069366.db2.gz JPBTZHVVUBAOGU-JKSUJKDBSA-N 1 1 363.461 2.915 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000174344551 510069374 /nfs/dbraw/zinc/06/93/74/510069374.db2.gz JPBTZHVVUBAOGU-JKSUJKDBSA-N 1 1 363.461 2.915 20 5 FFBDMO CC[C@@H]1CN(c2ccccc2)CC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000184007776 510083773 /nfs/dbraw/zinc/08/37/73/510083773.db2.gz UQRICZVUYSYEGH-QGZVFWFLSA-N 1 1 368.437 2.795 20 5 FFBDMO CC[C@@H]1CN(c2ccccc2)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000184007776 510083780 /nfs/dbraw/zinc/08/37/80/510083780.db2.gz UQRICZVUYSYEGH-QGZVFWFLSA-N 1 1 368.437 2.795 20 5 FFBDMO CC[C@@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000184006512 510084173 /nfs/dbraw/zinc/08/41/73/510084173.db2.gz ATSAMWYYNCNAHR-QGZVFWFLSA-N 1 1 368.437 2.795 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000261938303 510122105 /nfs/dbraw/zinc/12/21/05/510122105.db2.gz KGOSQWLRBBTENV-QGZVFWFLSA-N 1 1 373.384 2.676 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000261983038 510137456 /nfs/dbraw/zinc/13/74/56/510137456.db2.gz OFYZCZUTTBVTCB-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000180901310 510172030 /nfs/dbraw/zinc/17/20/30/510172030.db2.gz WANDDPSJVCAKDR-LBPRGKRZSA-N 1 1 363.414 2.564 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184195384 510186569 /nfs/dbraw/zinc/18/65/69/510186569.db2.gz NXWABUISGFEDER-ZDUSSCGKSA-N 1 1 367.421 2.871 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184195384 510186577 /nfs/dbraw/zinc/18/65/77/510186577.db2.gz NXWABUISGFEDER-ZDUSSCGKSA-N 1 1 367.421 2.871 20 5 FFBDMO COc1cc(C[N@H+](CCC(N)=O)Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000184239751 510211653 /nfs/dbraw/zinc/21/16/53/510211653.db2.gz XAQNEKHCZQKDNR-UHFFFAOYSA-N 1 1 361.373 2.620 20 5 FFBDMO COc1cc(C[N@@H+](CCC(N)=O)Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000184239751 510211656 /nfs/dbraw/zinc/21/16/56/510211656.db2.gz XAQNEKHCZQKDNR-UHFFFAOYSA-N 1 1 361.373 2.620 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@@H](C)C1 ZINC000266007669 510355808 /nfs/dbraw/zinc/35/58/08/510355808.db2.gz RPEBHYPAAMJZLQ-WMLDXEAASA-N 1 1 358.442 2.738 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cccc([N+](=O)[O-])c3C)CC2)nc(C)[nH+]1 ZINC000174882622 510363082 /nfs/dbraw/zinc/36/30/82/510363082.db2.gz BJJABKNDCMQOBI-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1nccs1 ZINC000175061611 510465241 /nfs/dbraw/zinc/46/52/41/510465241.db2.gz ZDLJIWSUDDOUSG-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1nccs1 ZINC000175061611 510465247 /nfs/dbraw/zinc/46/52/47/510465247.db2.gz ZDLJIWSUDDOUSG-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266298928 510504330 /nfs/dbraw/zinc/50/43/30/510504330.db2.gz KNZKPXSRJATNRI-ZYHUDNBSSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000172043616 510514336 /nfs/dbraw/zinc/51/43/36/510514336.db2.gz DODJAQDOKQXHKZ-ILMGOGQSSA-N 1 1 358.398 2.799 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[N@H+]1C1CC1 ZINC000184856909 510550276 /nfs/dbraw/zinc/55/02/76/510550276.db2.gz HUZIPDDPOCZUAB-UWVGGRQHSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000182071820 510741884 /nfs/dbraw/zinc/74/18/84/510741884.db2.gz HFKIGJYYMDJUPF-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000188416073 510755026 /nfs/dbraw/zinc/75/50/26/510755026.db2.gz OOCUUPJPTUFRLH-MRXNPFEDSA-N 1 1 361.442 2.906 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc([N+](=O)[O-])c1C ZINC000188416096 510755040 /nfs/dbraw/zinc/75/50/40/510755040.db2.gz OOCUUPJPTUFRLH-INIZCTEOSA-N 1 1 361.442 2.906 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000191649705 510773134 /nfs/dbraw/zinc/77/31/34/510773134.db2.gz LFEXALHLCURRTL-INIZCTEOSA-N 1 1 371.441 2.548 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000247110280 510837167 /nfs/dbraw/zinc/83/71/67/510837167.db2.gz DWXKROFEJHXYPI-PWSUYJOCSA-N 1 1 370.356 2.897 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247241034 510853808 /nfs/dbraw/zinc/85/38/08/510853808.db2.gz OQWYIBLHSJJRCO-YOEHRIQHSA-N 1 1 364.446 2.853 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000247496848 510863313 /nfs/dbraw/zinc/86/33/13/510863313.db2.gz UQPCNJFDTCBWLH-QWHCGFSZSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285356102 510874221 /nfs/dbraw/zinc/87/42/21/510874221.db2.gz PYQPSGNIKWUUEF-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285356102 510874226 /nfs/dbraw/zinc/87/42/26/510874226.db2.gz PYQPSGNIKWUUEF-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000360436526 510907906 /nfs/dbraw/zinc/90/79/06/510907906.db2.gz LUEWAWKRRNBAQU-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000360451088 510909557 /nfs/dbraw/zinc/90/95/57/510909557.db2.gz ZMUXVERWISPYNM-LJQANCHMSA-N 1 1 374.368 2.694 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000360451088 510909560 /nfs/dbraw/zinc/90/95/60/510909560.db2.gz ZMUXVERWISPYNM-LJQANCHMSA-N 1 1 374.368 2.694 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC1(C)C ZINC000330553694 510999280 /nfs/dbraw/zinc/99/92/80/510999280.db2.gz GHDJTXUXBLAVBG-NSHDSACASA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCN(C)CC1 ZINC000271024212 511061254 /nfs/dbraw/zinc/06/12/54/511061254.db2.gz AYHQGVKDHWTBTM-JKSUJKDBSA-N 1 1 366.531 2.691 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000271177412 511109517 /nfs/dbraw/zinc/10/95/17/511109517.db2.gz GDPXAPCMWLFODJ-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000279716833 511188490 /nfs/dbraw/zinc/18/84/90/511188490.db2.gz INFUBNLXAWDBFO-STQMWFEESA-N 1 1 353.394 2.688 20 5 FFBDMO COCCCOCC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000271472906 511216520 /nfs/dbraw/zinc/21/65/20/511216520.db2.gz DCSWCRAVVHOUKU-UHFFFAOYSA-N 1 1 363.414 2.777 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000362792367 511239034 /nfs/dbraw/zinc/23/90/34/511239034.db2.gz QNBOJHFHBDTJGW-DOTOQJQBSA-N 1 1 358.442 2.896 20 5 FFBDMO C[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000271569679 511248795 /nfs/dbraw/zinc/24/87/95/511248795.db2.gz BNRCLNZIYDDQGT-NSHDSACASA-N 1 1 361.489 2.594 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCN2CCO[C@H]1C2 ZINC000295081150 511275345 /nfs/dbraw/zinc/27/53/45/511275345.db2.gz IFTSOZQSFIEDBR-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCN2CCO[C@H]1C2 ZINC000295101738 511282603 /nfs/dbraw/zinc/28/26/03/511282603.db2.gz KLNMESFNNVAIFN-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@H]1CO)Nc1ccccc1[N+](=O)[O-] ZINC000283457183 511373516 /nfs/dbraw/zinc/37/35/16/511373516.db2.gz YOMXRMLPRUVNOG-GOSISDBHSA-N 1 1 355.394 2.515 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291908839 511386588 /nfs/dbraw/zinc/38/65/88/511386588.db2.gz RQJZYRDWGOFRBF-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291908839 511386594 /nfs/dbraw/zinc/38/65/94/511386594.db2.gz RQJZYRDWGOFRBF-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+](C2CCC2)C1 ZINC000292077876 511456593 /nfs/dbraw/zinc/45/65/93/511456593.db2.gz DBMJHAIKDLJJRG-AWEZNQCLSA-N 1 1 371.441 2.951 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H](C2CCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000292157526 511487303 /nfs/dbraw/zinc/48/73/03/511487303.db2.gz OFUIDWOUBKMORZ-AWEZNQCLSA-N 1 1 365.405 2.811 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280623677 511536558 /nfs/dbraw/zinc/53/65/58/511536558.db2.gz WTFWPQARHCNWFZ-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280623677 511536562 /nfs/dbraw/zinc/53/65/62/511536562.db2.gz WTFWPQARHCNWFZ-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587673 511546030 /nfs/dbraw/zinc/54/60/30/511546030.db2.gz QWYPPTKQJXNJKX-KUHUBIRLSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587673 511546033 /nfs/dbraw/zinc/54/60/33/511546033.db2.gz QWYPPTKQJXNJKX-KUHUBIRLSA-N 1 1 366.421 2.962 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299195016 511547360 /nfs/dbraw/zinc/54/73/60/511547360.db2.gz MLHMHMCTCVKFCJ-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299195016 511547362 /nfs/dbraw/zinc/54/73/62/511547362.db2.gz MLHMHMCTCVKFCJ-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc(NCCCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[nH+]c1 ZINC000295924010 511556915 /nfs/dbraw/zinc/55/69/15/511556915.db2.gz SAYUTAUQZWFDHP-UHFFFAOYSA-N 1 1 370.409 2.880 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1c1ccc(O)cc1 ZINC000296040314 511599081 /nfs/dbraw/zinc/59/90/81/511599081.db2.gz NZFXXZYFJSBAGX-LSDHHAIUSA-N 1 1 362.407 2.751 20 5 FFBDMO COCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000299383601 511616888 /nfs/dbraw/zinc/61/68/88/511616888.db2.gz HVLOTKUTMBTRKZ-CQSZACIVSA-N 1 1 357.410 2.903 20 5 FFBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000299383601 511616897 /nfs/dbraw/zinc/61/68/97/511616897.db2.gz HVLOTKUTMBTRKZ-CQSZACIVSA-N 1 1 357.410 2.903 20 5 FFBDMO C[C@H](CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000280987834 511679127 /nfs/dbraw/zinc/67/91/27/511679127.db2.gz QCJBWLBTPUCELU-CYBMUJFWSA-N 1 1 354.410 2.869 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1cnccn1 ZINC000365886019 511709932 /nfs/dbraw/zinc/70/99/32/511709932.db2.gz PJMIZNXKRLQFNW-KRWDZBQOSA-N 1 1 372.816 2.956 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccc(Cl)cc1)c1cnccn1 ZINC000365886019 511709936 /nfs/dbraw/zinc/70/99/36/511709936.db2.gz PJMIZNXKRLQFNW-KRWDZBQOSA-N 1 1 372.816 2.956 20 5 FFBDMO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000281072521 511710946 /nfs/dbraw/zinc/71/09/46/511710946.db2.gz INIQSPQSFCCCRA-KRWDZBQOSA-N 1 1 360.439 2.676 20 5 FFBDMO C[C@@H](c1ccc(N)c([N+](=O)[O-])c1)[N@@H+]1C[C@H]2C[C@H](Cn3c2cccc3=O)C1 ZINC000296399725 511728304 /nfs/dbraw/zinc/72/83/04/511728304.db2.gz KKQHSWASCULCNG-KCQAQPDRSA-N 1 1 354.410 2.519 20 5 FFBDMO Cc1cc(OCc2nc([C@@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348704 511786627 /nfs/dbraw/zinc/78/66/27/511786627.db2.gz GWZNFBDUFZDXNI-MAUKXSAKSA-N 1 1 374.397 2.791 20 5 FFBDMO Cc1cc(OCc2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348704 511786634 /nfs/dbraw/zinc/78/66/34/511786634.db2.gz GWZNFBDUFZDXNI-MAUKXSAKSA-N 1 1 374.397 2.791 20 5 FFBDMO COC(=O)c1cn([C@@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)nn1 ZINC000363904817 511841430 /nfs/dbraw/zinc/84/14/30/511841430.db2.gz AZWFKIXBXOFBTM-CQSZACIVSA-N 1 1 373.413 2.543 20 5 FFBDMO COC(=O)c1cn([C@@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)nn1 ZINC000363904817 511841436 /nfs/dbraw/zinc/84/14/36/511841436.db2.gz AZWFKIXBXOFBTM-CQSZACIVSA-N 1 1 373.413 2.543 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000284772675 511862971 /nfs/dbraw/zinc/86/29/71/511862971.db2.gz MVCYTIAMIUGJID-AWEZNQCLSA-N 1 1 373.413 2.526 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000293336673 511928775 /nfs/dbraw/zinc/92/87/75/511928775.db2.gz YMCNZIDTIDEJKZ-KRWDZBQOSA-N 1 1 365.430 2.679 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)[C@H]2C1 ZINC000293394086 511948228 /nfs/dbraw/zinc/94/82/28/511948228.db2.gz XJGJWNQOPYEODD-ZWKOTPCHSA-N 1 1 372.425 2.545 20 5 FFBDMO COCCn1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000281831650 511982632 /nfs/dbraw/zinc/98/26/32/511982632.db2.gz ABFINKLSUPGVCT-UHFFFAOYSA-N 1 1 356.382 2.988 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293743980 512070375 /nfs/dbraw/zinc/07/03/75/512070375.db2.gz HYETYVSFICVFRR-SNVBAGLBSA-N 1 1 357.332 2.828 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000285339233 512080978 /nfs/dbraw/zinc/08/09/78/512080978.db2.gz OQGIWEASJIZFEP-UHFFFAOYSA-N 1 1 372.381 2.640 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1 ZINC000285339233 512080982 /nfs/dbraw/zinc/08/09/82/512080982.db2.gz OQGIWEASJIZFEP-UHFFFAOYSA-N 1 1 372.381 2.640 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917710 512511266 /nfs/dbraw/zinc/51/12/66/512511266.db2.gz RXYCEAYCDONAJL-STQMWFEESA-N 1 1 373.413 2.533 20 5 FFBDMO COC(=O)c1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000411378112 512607368 /nfs/dbraw/zinc/60/73/68/512607368.db2.gz YNANWYDZWNCXNJ-LBPRGKRZSA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000411378112 512607374 /nfs/dbraw/zinc/60/73/74/512607374.db2.gz YNANWYDZWNCXNJ-LBPRGKRZSA-N 1 1 362.411 2.524 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1 ZINC000374005031 512616464 /nfs/dbraw/zinc/61/64/64/512616464.db2.gz BUNRCJFHRQUCBA-UHFFFAOYSA-N 1 1 361.442 2.759 20 5 FFBDMO C[NH+]1CCC2(CCCN([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)CC1 ZINC000374075226 512650363 /nfs/dbraw/zinc/65/03/63/512650363.db2.gz RBAROOAJMQOLIW-GOSISDBHSA-N 1 1 372.469 2.508 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@]2(CO)CCCc3ccccc32)c2c(c1)COCO2 ZINC000374149694 512678670 /nfs/dbraw/zinc/67/86/70/512678670.db2.gz UECLJPULJXGXHN-FQEVSTJZSA-N 1 1 370.405 2.775 20 5 FFBDMO Cc1ccnc(C2CC[NH+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000370375621 512900997 /nfs/dbraw/zinc/90/09/97/512900997.db2.gz WEPWEVNOAVTPON-AWEZNQCLSA-N 1 1 369.425 2.900 20 5 FFBDMO COCC[C@@H]1CCCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000368655871 513044474 /nfs/dbraw/zinc/04/44/74/513044474.db2.gz QEZGMIDBFFAJIW-HNNXBMFYSA-N 1 1 361.442 2.623 20 5 FFBDMO COCC[C@@H]1CCCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000368676573 513056418 /nfs/dbraw/zinc/05/64/18/513056418.db2.gz OGASOCODAGSTQM-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO Cc1cc(-c2noc([C@@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)ccc1F ZINC000370708089 513064564 /nfs/dbraw/zinc/06/45/64/513064564.db2.gz IIKGYONQPRLRPF-LLVKDONJSA-N 1 1 360.349 2.640 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](CCc2cccs2)CC1 ZINC000446101876 513186489 /nfs/dbraw/zinc/18/64/89/513186489.db2.gz WVALLNVVSPNLEY-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000428773784 513187072 /nfs/dbraw/zinc/18/70/72/513187072.db2.gz RWPSTUDKABUTLM-FQEVSTJZSA-N 1 1 370.405 2.790 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428997143 513246104 /nfs/dbraw/zinc/24/61/04/513246104.db2.gz RYVYKWQUXBKSLB-ATNYBXOESA-N 1 1 360.458 2.584 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000415507711 513301426 /nfs/dbraw/zinc/30/14/26/513301426.db2.gz TWGQOURBKFDEKL-INIZCTEOSA-N 1 1 356.382 2.782 20 5 FFBDMO Cc1c(C[N@@H+]2CC[C@](C)(NCC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000440519193 513344320 /nfs/dbraw/zinc/34/43/20/513344320.db2.gz SSXBOTDOUXDKEN-IBGZPJMESA-N 1 1 363.458 2.799 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@](C)(NCC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000440519193 513344334 /nfs/dbraw/zinc/34/43/34/513344334.db2.gz SSXBOTDOUXDKEN-IBGZPJMESA-N 1 1 363.458 2.799 20 5 FFBDMO C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000429409198 513369462 /nfs/dbraw/zinc/36/94/62/513369462.db2.gz OHFTYDAKPQCQPU-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000421703971 513377195 /nfs/dbraw/zinc/37/71/95/513377195.db2.gz NQNIORNVKZKPPQ-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000421709104 513380853 /nfs/dbraw/zinc/38/08/53/513380853.db2.gz CNOXTDNWQKVOHO-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@@H]2C1 ZINC000425067524 513399834 /nfs/dbraw/zinc/39/98/34/513399834.db2.gz RQDJRZFOFHEDEZ-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO CC(C)[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[NH+]1CCOCC1 ZINC000413046289 513405883 /nfs/dbraw/zinc/40/58/83/513405883.db2.gz RYHUSRFZXNHFOC-CYBMUJFWSA-N 1 1 362.352 2.777 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCC[N@H+]2CCCC2(C)C)c([N+](=O)[O-])c1 ZINC000450952997 513422418 /nfs/dbraw/zinc/42/24/18/513422418.db2.gz WBYGZYXEGQXGNB-UHFFFAOYSA-N 1 1 371.441 2.846 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425272639 513486465 /nfs/dbraw/zinc/48/64/65/513486465.db2.gz HDQQUJFYRPGEMV-DLBZAZTESA-N 1 1 355.442 2.830 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1S[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425285112 513491316 /nfs/dbraw/zinc/49/13/16/513491316.db2.gz SAYUJTPBZIACGS-OAHLLOKOSA-N 1 1 372.450 2.845 20 5 FFBDMO CCC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccccc1OC ZINC000441289774 513531272 /nfs/dbraw/zinc/53/12/72/513531272.db2.gz VHFJHCXESKTZDD-HOCLYGCPSA-N 1 1 362.430 2.634 20 5 FFBDMO C[NH+](C)[C@@H]1CCOc2c(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cccc21 ZINC000447727708 513554526 /nfs/dbraw/zinc/55/45/26/513554526.db2.gz KFFDHHGVLBCEEC-MRXNPFEDSA-N 1 1 357.366 2.938 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000451339694 513685777 /nfs/dbraw/zinc/68/57/77/513685777.db2.gz IWEKXYVQTYSJTD-JZXOWHBKSA-N 1 1 364.442 2.998 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451340830 513686909 /nfs/dbraw/zinc/68/69/09/513686909.db2.gz KJIZTYLGQCPKFA-QGPMSJSTSA-N 1 1 361.442 2.939 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436068810 513750380 /nfs/dbraw/zinc/75/03/80/513750380.db2.gz QHOAGHWLCJTKBO-GFCCVEGCSA-N 1 1 353.397 2.502 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1 ZINC000448419313 513753493 /nfs/dbraw/zinc/75/34/93/513753493.db2.gz VQIGTTRZBFWOBZ-CYBMUJFWSA-N 1 1 351.451 2.539 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436272814 513813430 /nfs/dbraw/zinc/81/34/30/513813430.db2.gz IDMSGVPFYXLDIV-NSHDSACASA-N 1 1 362.352 2.777 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cnc4ccc(Cl)cn34)CC2)n1 ZINC000425998342 513821607 /nfs/dbraw/zinc/82/16/07/513821607.db2.gz HZUSODXOLAHILO-UHFFFAOYSA-N 1 1 360.805 2.930 20 5 FFBDMO C[C@@H](C(=O)Nc1ncccn1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548442 513825115 /nfs/dbraw/zinc/82/51/15/513825115.db2.gz NFPGBFMTLHIIGW-ZFWWWQNUSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@@H](C(=O)Nc1ncccn1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548442 513825122 /nfs/dbraw/zinc/82/51/22/513825122.db2.gz NFPGBFMTLHIIGW-ZFWWWQNUSA-N 1 1 355.398 2.591 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000448825086 513916551 /nfs/dbraw/zinc/91/65/51/513916551.db2.gz UWGSMTDHKHMHDD-OAHLLOKOSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000427018796 514093082 /nfs/dbraw/zinc/09/30/82/514093082.db2.gz CWSZJGHFBXHKNP-AEFFLSMTSA-N 1 1 355.394 2.779 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3ccnc4c3cccc4[N+](=O)[O-])CC2)CCO1 ZINC000432315797 514156662 /nfs/dbraw/zinc/15/66/62/514156662.db2.gz SKGMZRBYOBXFMB-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097503 514188488 /nfs/dbraw/zinc/18/84/88/514188488.db2.gz ZQJGFAPCGWDQDY-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO COC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097503 514188494 /nfs/dbraw/zinc/18/84/94/514188494.db2.gz ZQJGFAPCGWDQDY-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000420620216 514203911 /nfs/dbraw/zinc/20/39/11/514203911.db2.gz ZUSKVANZZQUXEY-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437987921 514283218 /nfs/dbraw/zinc/28/32/18/514283218.db2.gz RMXSVURGFNEJAY-CXAGYDPISA-N 1 1 358.442 2.752 20 5 FFBDMO C[C@H]1CN(CCO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788679 514353139 /nfs/dbraw/zinc/35/31/39/514353139.db2.gz YLCVBJZNTUWHOG-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1C[N@H+](CCO)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788679 514353157 /nfs/dbraw/zinc/35/31/57/514353157.db2.gz YLCVBJZNTUWHOG-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788679 514353160 /nfs/dbraw/zinc/35/31/60/514353160.db2.gz YLCVBJZNTUWHOG-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1CN(CCO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787950 514353248 /nfs/dbraw/zinc/35/32/48/514353248.db2.gz WWDGXOMLTKCTEV-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1C[N@H+](CCO)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787950 514353262 /nfs/dbraw/zinc/35/32/62/514353262.db2.gz WWDGXOMLTKCTEV-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787950 514353269 /nfs/dbraw/zinc/35/32/69/514353269.db2.gz WWDGXOMLTKCTEV-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H](Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000433093594 514377022 /nfs/dbraw/zinc/37/70/22/514377022.db2.gz RNXVZUHYGRDKKN-ZDUSSCGKSA-N 1 1 354.410 2.611 20 5 FFBDMO C[C@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000433093594 514377028 /nfs/dbraw/zinc/37/70/28/514377028.db2.gz RNXVZUHYGRDKKN-ZDUSSCGKSA-N 1 1 354.410 2.611 20 5 FFBDMO CC[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H](CC)O1 ZINC000420946429 514395529 /nfs/dbraw/zinc/39/55/29/514395529.db2.gz BSYWNVSLVMEVTQ-GASCZTMLSA-N 1 1 365.430 2.821 20 5 FFBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCSC1 ZINC000433185649 514410558 /nfs/dbraw/zinc/41/05/58/514410558.db2.gz FTSBZIMEFBASEB-CYBMUJFWSA-N 1 1 350.444 2.815 20 5 FFBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCSC1 ZINC000433185649 514410563 /nfs/dbraw/zinc/41/05/63/514410563.db2.gz FTSBZIMEFBASEB-CYBMUJFWSA-N 1 1 350.444 2.815 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000438865464 514454964 /nfs/dbraw/zinc/45/49/64/514454964.db2.gz GRJWTIQUYGFHFQ-GOSISDBHSA-N 1 1 362.474 2.947 20 5 FFBDMO C[C@H]1C[NH+](Cc2ccccc2NCc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1 ZINC000470524956 514514044 /nfs/dbraw/zinc/51/40/44/514514044.db2.gz BREFCOLHTZESTD-KBPBESRZSA-N 1 1 359.430 2.550 20 5 FFBDMO C[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[N@@H+](C)Cc1ccccc1 ZINC000461391855 514589756 /nfs/dbraw/zinc/58/97/56/514589756.db2.gz CMTACOUEORDWFT-HNNXBMFYSA-N 1 1 369.421 2.836 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000458166556 514594944 /nfs/dbraw/zinc/59/49/44/514594944.db2.gz CHOFEZSYDNDZAW-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO COc1cccc(NCCCN2CCN(c3cc[nH+]cc3)CC2)c1[N+](=O)[O-] ZINC000475355668 514633235 /nfs/dbraw/zinc/63/32/35/514633235.db2.gz XACAAHHCCMQRIK-UHFFFAOYSA-N 1 1 371.441 2.623 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000458222275 514639917 /nfs/dbraw/zinc/63/99/17/514639917.db2.gz QLNRQVCUHCXMCR-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO Cc1c(CNC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000479687261 514689860 /nfs/dbraw/zinc/68/98/60/514689860.db2.gz HBZJNXVLKHRFHZ-UHFFFAOYSA-N 1 1 374.416 2.974 20 5 FFBDMO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000471058819 514736400 /nfs/dbraw/zinc/73/64/00/514736400.db2.gz GPHDLCKQNQTDLW-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000502713892 514749843 /nfs/dbraw/zinc/74/98/43/514749843.db2.gz UBODHGIHWNEDSC-OAHLLOKOSA-N 1 1 369.487 2.836 20 5 FFBDMO CC[N@H+](Cc1ccncc1)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000502732841 514755903 /nfs/dbraw/zinc/75/59/03/514755903.db2.gz OJJKMAZTXCVZJU-CYBMUJFWSA-N 1 1 358.398 2.848 20 5 FFBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000502732841 514755914 /nfs/dbraw/zinc/75/59/14/514755914.db2.gz OJJKMAZTXCVZJU-CYBMUJFWSA-N 1 1 358.398 2.848 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@]2(CO)CC(C)C)c([N+](=O)[O-])c1 ZINC000475714854 514774684 /nfs/dbraw/zinc/77/46/84/514774684.db2.gz LBPDDTLRJVFTKJ-GOSISDBHSA-N 1 1 352.431 2.855 20 5 FFBDMO Cc1cc(N[C@H](C)C[NH+]2CCN(C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461935082 514794762 /nfs/dbraw/zinc/79/47/62/514794762.db2.gz JERJGMQNQHCXHK-GFCCVEGCSA-N 1 1 360.380 2.970 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CC[C@H](C)C1 ZINC000484852100 514814773 /nfs/dbraw/zinc/81/47/73/514814773.db2.gz BBFYMDWTSMAWLC-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CC[C@@H](C)C1 ZINC000484890428 514832790 /nfs/dbraw/zinc/83/27/90/514832790.db2.gz FJMQPTAUFUPJGB-GDBMZVCRSA-N 1 1 361.442 2.621 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@H](C)C1 ZINC000480202537 514877391 /nfs/dbraw/zinc/87/73/91/514877391.db2.gz YKWMZEATXDKHEY-ZIAGYGMSSA-N 1 1 351.447 2.663 20 5 FFBDMO C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1=CC[N@@H+](C)CC1 ZINC000467218880 514943787 /nfs/dbraw/zinc/94/37/87/514943787.db2.gz RFUHTSLNJAMYJP-NSHDSACASA-N 1 1 352.822 2.698 20 5 FFBDMO COc1c(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000476249535 514966827 /nfs/dbraw/zinc/96/68/27/514966827.db2.gz FZYDUGYNBNUFKF-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000458658059 514994120 /nfs/dbraw/zinc/99/41/20/514994120.db2.gz UTXVIFYPXAGZIN-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO COc1c(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476310136 514994030 /nfs/dbraw/zinc/99/40/30/514994030.db2.gz UKMBMLZRWHSLAG-GDBMZVCRSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476334807 515006740 /nfs/dbraw/zinc/00/67/40/515006740.db2.gz GDILTRBPXWVRIN-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000498723684 515040726 /nfs/dbraw/zinc/04/07/26/515040726.db2.gz YPFIOEYPQCKUPG-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000480731674 515060996 /nfs/dbraw/zinc/06/09/96/515060996.db2.gz QPOCWKCKKNNETQ-INIZCTEOSA-N 1 1 369.469 2.983 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000490628876 515266152 /nfs/dbraw/zinc/26/61/52/515266152.db2.gz HMFHQEGNSQCYQJ-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000490628876 515266160 /nfs/dbraw/zinc/26/61/60/515266160.db2.gz HMFHQEGNSQCYQJ-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCc1cc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000462885091 515282551 /nfs/dbraw/zinc/28/25/51/515282551.db2.gz TWJLISKVLYLTLJ-XJKSGUPXSA-N 1 1 355.442 2.931 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+](Cc2ccccc2Cl)CC2CC2)c1 ZINC000510224781 515473897 /nfs/dbraw/zinc/47/38/97/515473897.db2.gz VKVCBJBVTVQNTG-INIZCTEOSA-N 1 1 364.833 2.718 20 5 FFBDMO COc1ccccc1[C@@H]1CC[C@H](C)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000510258616 515487044 /nfs/dbraw/zinc/48/70/44/515487044.db2.gz ZXOFNIBEKBOKLL-LESCRADOSA-N 1 1 374.441 2.634 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCOCC1 ZINC000505471720 515546514 /nfs/dbraw/zinc/54/65/14/515546514.db2.gz MKRPJQMBQPRQEW-UHFFFAOYSA-N 1 1 367.471 2.549 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456998016 515575090 /nfs/dbraw/zinc/57/50/90/515575090.db2.gz RHPYCUQSNCHLQE-LJQANCHMSA-N 1 1 368.437 2.960 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505572322 515589467 /nfs/dbraw/zinc/58/94/67/515589467.db2.gz JADKNMMEMBBTOF-OAHLLOKOSA-N 1 1 371.441 2.790 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000500109340 515592644 /nfs/dbraw/zinc/59/26/44/515592644.db2.gz BOAADLOSVQQJQH-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCOc2cccc(Cl)c2)CC1 ZINC000459495393 515593281 /nfs/dbraw/zinc/59/32/81/515593281.db2.gz MHBPINUCISWCPE-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)cc1OC ZINC000500124132 515601182 /nfs/dbraw/zinc/60/11/82/515601182.db2.gz UTFVEKWHFGEIJZ-OLZOCXBDSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000493341247 515623405 /nfs/dbraw/zinc/62/34/05/515623405.db2.gz YMXHYWZVWQMXOL-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO NC(=O)CC1C[NH+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000459619200 515699436 /nfs/dbraw/zinc/69/94/36/515699436.db2.gz FFIHZTHSHRALIS-UHFFFAOYSA-N 1 1 359.357 2.833 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000505862652 515702447 /nfs/dbraw/zinc/70/24/47/515702447.db2.gz NCGKPQCJXMYJOF-UHFFFAOYSA-N 1 1 364.421 2.724 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694412 515772224 /nfs/dbraw/zinc/77/22/24/515772224.db2.gz WGOBDFGNOQNPAH-ZIAGYGMSSA-N 1 1 373.457 2.988 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694412 515772234 /nfs/dbraw/zinc/77/22/34/515772234.db2.gz WGOBDFGNOQNPAH-ZIAGYGMSSA-N 1 1 373.457 2.988 20 5 FFBDMO CCc1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000478457100 515829863 /nfs/dbraw/zinc/82/98/63/515829863.db2.gz IQWXTQIZCYNAHW-ZWKOTPCHSA-N 1 1 353.422 2.985 20 5 FFBDMO COCCN1CCC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000494528739 515872720 /nfs/dbraw/zinc/87/27/20/515872720.db2.gz SWGBQJHXPUDVBA-UHFFFAOYSA-N 1 1 361.364 2.814 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000501087495 515973481 /nfs/dbraw/zinc/97/34/81/515973481.db2.gz UQWQGTDFMDRWST-MWLCHTKSSA-N 1 1 371.235 2.962 20 5 FFBDMO C[C@H](CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@@H+](C)C1CC1 ZINC000494877566 515994232 /nfs/dbraw/zinc/99/42/32/515994232.db2.gz IFRCMLQRDKFDHS-SNVBAGLBSA-N 1 1 374.363 2.896 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+]Cc2nc(C)c(C)s2)cc1[N+](=O)[O-] ZINC000474349491 516005251 /nfs/dbraw/zinc/00/52/51/516005251.db2.gz INFYZTOPODROTH-UHFFFAOYSA-N 1 1 365.411 2.510 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCCOC2)O1 ZINC000483358993 516049310 /nfs/dbraw/zinc/04/93/10/516049310.db2.gz RUFVTDIWRLKTDX-GOSISDBHSA-N 1 1 350.415 2.634 20 5 FFBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCCOC2)O1 ZINC000483368867 516052697 /nfs/dbraw/zinc/05/26/97/516052697.db2.gz CLGLUPQRQLKDRO-YJBOKZPZSA-N 1 1 350.415 2.634 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1C ZINC000487986265 516066112 /nfs/dbraw/zinc/06/61/12/516066112.db2.gz GYTVZQYMEMIGRZ-RHSMWYFYSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1C ZINC000487986265 516066118 /nfs/dbraw/zinc/06/61/18/516066118.db2.gz GYTVZQYMEMIGRZ-RHSMWYFYSA-N 1 1 370.471 2.506 20 5 FFBDMO CCC1CCC([N@@H+](CCO)C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000488160832 516139735 /nfs/dbraw/zinc/13/97/35/516139735.db2.gz UDICUQOYULUFRT-JCYILVPMSA-N 1 1 366.458 2.598 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2F)c2ccccc2)CC1 ZINC000483702425 516179744 /nfs/dbraw/zinc/17/97/44/516179744.db2.gz UNUALKRIXTWZMZ-GOSISDBHSA-N 1 1 372.400 2.661 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507382300 516196366 /nfs/dbraw/zinc/19/63/66/516196366.db2.gz QBRICBYJXQOJSY-KRWDZBQOSA-N 1 1 362.474 2.949 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000496074213 516233908 /nfs/dbraw/zinc/23/39/08/516233908.db2.gz UOMMIJLHDPJLAG-CYBMUJFWSA-N 1 1 358.402 2.583 20 5 FFBDMO C[N@@H+]1CCCC[C@@H]1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000496074213 516233916 /nfs/dbraw/zinc/23/39/16/516233916.db2.gz UOMMIJLHDPJLAG-CYBMUJFWSA-N 1 1 358.402 2.583 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000496074213 516233922 /nfs/dbraw/zinc/23/39/22/516233922.db2.gz UOMMIJLHDPJLAG-CYBMUJFWSA-N 1 1 358.402 2.583 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2c(F)cccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000501842163 516239929 /nfs/dbraw/zinc/23/99/29/516239929.db2.gz LKUZTETVOIZPNC-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2c(F)cccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000501842163 516239936 /nfs/dbraw/zinc/23/99/36/516239936.db2.gz LKUZTETVOIZPNC-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000465735799 516242741 /nfs/dbraw/zinc/24/27/41/516242741.db2.gz BLSFRBFHUHRNJU-OWCLPIDISA-N 1 1 362.474 2.803 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000512420956 516271799 /nfs/dbraw/zinc/27/17/99/516271799.db2.gz ORAWUNPIHFCYSA-GJZGRUSLSA-N 1 1 352.431 2.998 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCN4C(=O)CC[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000512433322 516277132 /nfs/dbraw/zinc/27/71/32/516277132.db2.gz LAJXTYOPPWHTIE-ZDUSSCGKSA-N 1 1 371.393 2.670 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCN4C(=O)CC[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000512433322 516277137 /nfs/dbraw/zinc/27/71/37/516277137.db2.gz LAJXTYOPPWHTIE-ZDUSSCGKSA-N 1 1 371.393 2.670 20 5 FFBDMO Cc1cc(-c2nnc(C[NH+]3CCC(n4ccc([N+](=O)[O-])n4)CC3)o2)c(C)o1 ZINC000488766422 516304779 /nfs/dbraw/zinc/30/47/79/516304779.db2.gz JBDMPUPRNQGSAW-UHFFFAOYSA-N 1 1 372.385 2.888 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000550729244 516399390 /nfs/dbraw/zinc/39/93/90/516399390.db2.gz AMKOSXLKVPPFFT-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021362 516403157 /nfs/dbraw/zinc/40/31/57/516403157.db2.gz POZUSESLYGQYFS-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021362 516403167 /nfs/dbraw/zinc/40/31/67/516403167.db2.gz POZUSESLYGQYFS-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000557772934 516430974 /nfs/dbraw/zinc/43/09/74/516430974.db2.gz UOURHDSECRYAMP-UHFFFAOYSA-N 1 1 360.414 2.580 20 5 FFBDMO COc1ccc(NC(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000543886131 516480578 /nfs/dbraw/zinc/48/05/78/516480578.db2.gz WIEMIONISRPART-UHFFFAOYSA-N 1 1 371.397 2.661 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000554544976 516500251 /nfs/dbraw/zinc/50/02/51/516500251.db2.gz XXHUPJMVKXXFRI-OAHLLOKOSA-N 1 1 357.410 2.806 20 5 FFBDMO CCCN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000547758231 516545558 /nfs/dbraw/zinc/54/55/58/516545558.db2.gz XBXZSNMJEVYIIT-MRXNPFEDSA-N 1 1 371.441 2.835 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCO[C@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000540427534 516551782 /nfs/dbraw/zinc/55/17/82/516551782.db2.gz VJDJLAIFTWCTRS-VKJFTORMSA-N 1 1 363.458 2.957 20 5 FFBDMO Cc1c(Br)c(N(C)C[C@H]2CCC[N@@H+](C)C2)ncc1[N+](=O)[O-] ZINC000554847937 516661844 /nfs/dbraw/zinc/66/18/44/516661844.db2.gz CGUDGVQAYBAVLQ-NSHDSACASA-N 1 1 357.252 2.839 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000561641297 516694831 /nfs/dbraw/zinc/69/48/31/516694831.db2.gz KGURSTGSZWHCFF-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)C1CCCCC1 ZINC000548064506 516735810 /nfs/dbraw/zinc/73/58/10/516735810.db2.gz QVQBTEADGQOPOL-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)C1 ZINC000561749736 516746816 /nfs/dbraw/zinc/74/68/16/516746816.db2.gz ZARHAHARDYIDOX-DEYYWGMASA-N 1 1 368.437 2.945 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000524721344 516802281 /nfs/dbraw/zinc/80/22/81/516802281.db2.gz QPSOOTMGPGGGCO-CVEARBPZSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@@H]1C[NH+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2)C[C@@H](C)O1 ZINC000532139251 516821627 /nfs/dbraw/zinc/82/16/27/516821627.db2.gz YIUHIKDHRICZKJ-ZIAGYGMSSA-N 1 1 370.409 2.851 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000541035869 516840455 /nfs/dbraw/zinc/84/04/55/516840455.db2.gz GOKPNXKBKJJDBF-DGCLKSJQSA-N 1 1 371.384 2.999 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(O)CC2)cc1OC ZINC000541056337 516851110 /nfs/dbraw/zinc/85/11/10/516851110.db2.gz IYWSWJQMTIXTMW-CYBMUJFWSA-N 1 1 352.431 2.985 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551796413 516874359 /nfs/dbraw/zinc/87/43/59/516874359.db2.gz ZPDRAHVXSVXHJI-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551796413 516874372 /nfs/dbraw/zinc/87/43/72/516874372.db2.gz ZPDRAHVXSVXHJI-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO Cn1c(C(=O)NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000525040929 516900426 /nfs/dbraw/zinc/90/04/26/516900426.db2.gz VIQGSLLLMHTHOU-MLGOLLRUSA-N 1 1 362.455 2.808 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CC[N@H+](CC)[C@H](C)C1 ZINC000525385638 517024222 /nfs/dbraw/zinc/02/42/22/517024222.db2.gz FCQCQYPGIBKAQG-UKRRQHHQSA-N 1 1 369.487 2.651 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1nnc(-c2ccco2)o1)c1cccc([N+](=O)[O-])c1 ZINC000537077774 517031187 /nfs/dbraw/zinc/03/11/87/517031187.db2.gz HVCMICMSBTZIJN-JTQLQIEISA-N 1 1 357.326 2.527 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000525544409 517071714 /nfs/dbraw/zinc/07/17/14/517071714.db2.gz BZUZIZVFVOFGNC-SGMGOOAPSA-N 1 1 369.849 2.957 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000541785065 517214681 /nfs/dbraw/zinc/21/46/81/517214681.db2.gz FAKTVGCWEAIOKS-AWEZNQCLSA-N 1 1 368.409 2.699 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000520058906 517267624 /nfs/dbraw/zinc/26/76/24/517267624.db2.gz NBHGCPFDAMNIAN-INIZCTEOSA-N 1 1 356.426 2.718 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000548979762 517336872 /nfs/dbraw/zinc/33/68/72/517336872.db2.gz ZHCIBCYBDLGGHL-SFHVURJKSA-N 1 1 370.453 2.964 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000537825508 517363271 /nfs/dbraw/zinc/36/32/71/517363271.db2.gz USPXUNHUTAEPOP-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000552874043 517423007 /nfs/dbraw/zinc/42/30/07/517423007.db2.gz DXQPJLCSIDCAAZ-IBGZPJMESA-N 1 1 369.421 2.797 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000552874043 517423014 /nfs/dbraw/zinc/42/30/14/517423014.db2.gz DXQPJLCSIDCAAZ-IBGZPJMESA-N 1 1 369.421 2.797 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCc4[nH+]ccn4C3)n2)c2c1NCCC2 ZINC000556450499 517436748 /nfs/dbraw/zinc/43/67/48/517436748.db2.gz VHTJBLYEHGJLDG-LLVKDONJSA-N 1 1 366.381 2.929 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000546036101 517505003 /nfs/dbraw/zinc/50/50/03/517505003.db2.gz YGSLIDRAXMOMRA-NVXWUHKLSA-N 1 1 362.430 2.668 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000542520332 517607188 /nfs/dbraw/zinc/60/71/88/517607188.db2.gz BZWNONOKJMXMAO-NSHDSACASA-N 1 1 357.252 2.626 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Oc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000563068092 517630818 /nfs/dbraw/zinc/63/08/18/517630818.db2.gz KBWBKOVABZZULZ-SFHVURJKSA-N 1 1 367.405 2.637 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Oc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000563068092 517630826 /nfs/dbraw/zinc/63/08/26/517630826.db2.gz KBWBKOVABZZULZ-SFHVURJKSA-N 1 1 367.405 2.637 20 5 FFBDMO C[NH+]1CCN(c2ccc(-c3noc(-c4ccc([N+](=O)[O-])s4)n3)cn2)CC1 ZINC000546315220 517637755 /nfs/dbraw/zinc/63/77/55/517637755.db2.gz REWZSGSUDFVKIP-UHFFFAOYSA-N 1 1 372.410 2.520 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000560250900 517657958 /nfs/dbraw/zinc/65/79/58/517657958.db2.gz QVAZZKHLMCOXIY-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000560250900 517657965 /nfs/dbraw/zinc/65/79/65/517657965.db2.gz QVAZZKHLMCOXIY-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708885 517666038 /nfs/dbraw/zinc/66/60/38/517666038.db2.gz GKYNFAORANJAMT-DOMZBBRYSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708885 517666043 /nfs/dbraw/zinc/66/60/43/517666043.db2.gz GKYNFAORANJAMT-DOMZBBRYSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556874434 517720151 /nfs/dbraw/zinc/72/01/51/517720151.db2.gz JUNQNMJRQSMPFS-YJBOKZPZSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000538953271 517861599 /nfs/dbraw/zinc/86/15/99/517861599.db2.gz LLPOWUZHYXZLGN-WDEREUQCSA-N 1 1 359.373 2.729 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000553785599 517903335 /nfs/dbraw/zinc/90/33/35/517903335.db2.gz GXIBDXRTQQWTOC-SUNYJGFJSA-N 1 1 372.469 2.971 20 5 FFBDMO COc1cccc(NC(=O)CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000534511644 517920014 /nfs/dbraw/zinc/92/00/14/517920014.db2.gz HIGAWFODRLMLJW-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CC[N@H+](C)[C@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000560615206 517933250 /nfs/dbraw/zinc/93/32/50/517933250.db2.gz LCOPNTXGECJANJ-INIZCTEOSA-N 1 1 353.382 2.525 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000560615206 517933258 /nfs/dbraw/zinc/93/32/58/517933258.db2.gz LCOPNTXGECJANJ-INIZCTEOSA-N 1 1 353.382 2.525 20 5 FFBDMO COc1ccccc1CCNC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000539379149 518017766 /nfs/dbraw/zinc/01/77/66/518017766.db2.gz NNBGYAYTIGWGLN-CQSZACIVSA-N 1 1 357.410 2.613 20 5 FFBDMO CCC[N@@H+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 ZINC000560968029 518101479 /nfs/dbraw/zinc/10/14/79/518101479.db2.gz ADBTUKDNICDSRF-CQSZACIVSA-N 1 1 365.821 2.784 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000578761889 518362498 /nfs/dbraw/zinc/36/24/98/518362498.db2.gz SQKVVZWBNNHTFR-INIZCTEOSA-N 1 1 366.421 2.677 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000578761889 518362505 /nfs/dbraw/zinc/36/25/05/518362505.db2.gz SQKVVZWBNNHTFR-INIZCTEOSA-N 1 1 366.421 2.677 20 5 FFBDMO C[N@H+]1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCCCC2 ZINC000584538669 518389297 /nfs/dbraw/zinc/38/92/97/518389297.db2.gz XJCUOWROEDXMIN-SFHVURJKSA-N 1 1 372.469 2.650 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000570014869 518399057 /nfs/dbraw/zinc/39/90/57/518399057.db2.gz MDCZMRYOZOWBSC-MRXNPFEDSA-N 1 1 364.490 2.959 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430135 518518209 /nfs/dbraw/zinc/51/82/09/518518209.db2.gz LKKBNSFZWQDLHP-UKRRQHHQSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430135 518518212 /nfs/dbraw/zinc/51/82/12/518518212.db2.gz LKKBNSFZWQDLHP-UKRRQHHQSA-N 1 1 352.431 2.841 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCCC[C@H]2CCO)c([N+](=O)[O-])c1 ZINC000585754875 518587400 /nfs/dbraw/zinc/58/74/00/518587400.db2.gz JPVWRHTUYPBDPG-AWEZNQCLSA-N 1 1 365.430 2.559 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCCC[C@H]2CCO)c([N+](=O)[O-])c1 ZINC000585754875 518587405 /nfs/dbraw/zinc/58/74/05/518587405.db2.gz JPVWRHTUYPBDPG-AWEZNQCLSA-N 1 1 365.430 2.559 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2ccc3cn[nH]c3c2)n1 ZINC000585765421 518589697 /nfs/dbraw/zinc/58/96/97/518589697.db2.gz BRHHNNBAWBSKIS-WBVHZDCISA-N 1 1 354.414 2.984 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)n1 ZINC000585789503 518599246 /nfs/dbraw/zinc/59/92/46/518599246.db2.gz BZTDPWBDRJQZJS-WMLDXEAASA-N 1 1 358.446 2.835 20 5 FFBDMO Cc1c(Cl)cc(S(=O)(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000573367455 518632167 /nfs/dbraw/zinc/63/21/67/518632167.db2.gz AIDPMGGDDJGDAL-JTQLQIEISA-N 1 1 363.867 2.564 20 5 FFBDMO CC(C)[C@H](O)C1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000586791523 518644710 /nfs/dbraw/zinc/64/47/10/518644710.db2.gz RYHACIBZQBXGBO-IRXDYDNUSA-N 1 1 358.442 2.804 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N[C@H](C)C[NH+]1CCN(c2ccccn2)CC1 ZINC000573623989 518757100 /nfs/dbraw/zinc/75/71/00/518757100.db2.gz HFOYOHBOVCQLNR-OAHLLOKOSA-N 1 1 371.441 2.621 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000576986123 518861848 /nfs/dbraw/zinc/86/18/48/518861848.db2.gz OEOBXALYWNBPMY-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000576986123 518861852 /nfs/dbraw/zinc/86/18/52/518861852.db2.gz OEOBXALYWNBPMY-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000573889415 518883057 /nfs/dbraw/zinc/88/30/57/518883057.db2.gz NKFMSPYWPOVYMF-UONOGXRCSA-N 1 1 363.414 2.518 20 5 FFBDMO C[C@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000573976412 518928729 /nfs/dbraw/zinc/92/87/29/518928729.db2.gz AOHZYNZDTWCOTE-IBGZPJMESA-N 1 1 355.394 2.695 20 5 FFBDMO C[C@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000573976412 518928732 /nfs/dbraw/zinc/92/87/32/518928732.db2.gz AOHZYNZDTWCOTE-IBGZPJMESA-N 1 1 355.394 2.695 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000589493738 519017059 /nfs/dbraw/zinc/01/70/59/519017059.db2.gz XYDBENOMKYWPJB-UHFFFAOYSA-N 1 1 369.421 2.699 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccc(OC)cc3CC2)c1 ZINC000589513657 519022424 /nfs/dbraw/zinc/02/24/24/519022424.db2.gz NLWWKPRNBLCYSR-UHFFFAOYSA-N 1 1 370.405 2.991 20 5 FFBDMO C[C@@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000577493339 519108846 /nfs/dbraw/zinc/10/88/46/519108846.db2.gz DMZKBZOHPBUMBC-ABAIWWIYSA-N 1 1 363.801 2.898 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@@H]4C[N@@H+](C)C[C@@H]43)cc2[N+](=O)[O-])C1 ZINC000590447604 519236038 /nfs/dbraw/zinc/23/60/38/519236038.db2.gz ZLQTZWLYMKXIPQ-OGWOLHLISA-N 1 1 372.469 2.607 20 5 FFBDMO CC1(C)CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000571787236 519274771 /nfs/dbraw/zinc/27/47/71/519274771.db2.gz OXWVIPNLSPTOFO-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO [NH3+]Cc1noc(C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 ZINC000583498929 519280584 /nfs/dbraw/zinc/28/05/84/519280584.db2.gz DHNNQDJSBZATBH-UHFFFAOYSA-N 1 1 371.319 2.839 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590600928 519283553 /nfs/dbraw/zinc/28/35/53/519283553.db2.gz PIAKMJAOXMTCEC-OAHLLOKOSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590600928 519283557 /nfs/dbraw/zinc/28/35/57/519283557.db2.gz PIAKMJAOXMTCEC-OAHLLOKOSA-N 1 1 354.410 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[NH+]([C@@H]4CCOC4)CC3)n2)cc1 ZINC000590694691 519321143 /nfs/dbraw/zinc/32/11/43/519321143.db2.gz ZDWBFXVFJJWHNT-OAHLLOKOSA-N 1 1 360.439 2.629 20 5 FFBDMO C[C@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000590723432 519333631 /nfs/dbraw/zinc/33/36/31/519333631.db2.gz ZSXFHDXZUGPIGU-OAHLLOKOSA-N 1 1 370.453 2.628 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC[C@H]3CCS(=O)(=O)C3)C2)cc1 ZINC000590757602 519352863 /nfs/dbraw/zinc/35/28/63/519352863.db2.gz CHVBIQPNVKTPNP-HOCLYGCPSA-N 1 1 352.456 2.599 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1 ZINC000583722168 519397483 /nfs/dbraw/zinc/39/74/83/519397483.db2.gz KUVKKBOEOORSRA-AEFFLSMTSA-N 1 1 359.426 2.957 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N[C@@H](C)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000569165978 519409565 /nfs/dbraw/zinc/40/95/65/519409565.db2.gz ZCDIFCFKDBSPBY-HNNXBMFYSA-N 1 1 365.478 2.733 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@@]3(CCSC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000578132955 519435707 /nfs/dbraw/zinc/43/57/07/519435707.db2.gz LHNNPIWMLZGQKK-SFHVURJKSA-N 1 1 374.466 2.703 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@@]3(CCSC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000578132955 519435716 /nfs/dbraw/zinc/43/57/16/519435716.db2.gz LHNNPIWMLZGQKK-SFHVURJKSA-N 1 1 374.466 2.703 20 5 FFBDMO CO[C@@H](CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000569249017 519454202 /nfs/dbraw/zinc/45/42/02/519454202.db2.gz FXGIAPOCGGPFBA-UONOGXRCSA-N 1 1 372.347 2.975 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(C(F)(F)F)c1 ZINC000591138782 519527310 /nfs/dbraw/zinc/52/73/10/519527310.db2.gz RPWZYPJMPUPHBZ-CYBMUJFWSA-N 1 1 374.363 2.700 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461771 519972817 /nfs/dbraw/zinc/97/28/17/519972817.db2.gz VYABRAXCKXGQTC-GXSJLCMTSA-N 1 1 362.386 2.886 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(SC)CC2)c([N+](=O)[O-])c1 ZINC000602922002 519972874 /nfs/dbraw/zinc/97/28/74/519972874.db2.gz DCFNQTZEULUUET-LLVKDONJSA-N 1 1 353.444 2.758 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594485146 519994333 /nfs/dbraw/zinc/99/43/33/519994333.db2.gz XJZYGDVAOOVVMP-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000602997805 520014693 /nfs/dbraw/zinc/01/46/93/520014693.db2.gz RCABYIWXZAOPDW-WBAXXEDZSA-N 1 1 361.442 2.857 20 5 FFBDMO CC1=CC[N@@H+](CCNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)CC1 ZINC000594571141 520033255 /nfs/dbraw/zinc/03/32/55/520033255.db2.gz JQYKRZBSBDVKJF-UHFFFAOYSA-N 1 1 364.421 2.634 20 5 FFBDMO COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000600193897 520114224 /nfs/dbraw/zinc/11/42/24/520114224.db2.gz YLABPQZLOFHXAB-GOSISDBHSA-N 1 1 360.366 2.619 20 5 FFBDMO CSc1cccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)c1[N+](=O)[O-] ZINC000597581035 520118330 /nfs/dbraw/zinc/11/83/30/520118330.db2.gz OSDJVPXOVUOLIA-OLZOCXBDSA-N 1 1 353.419 2.575 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000597676266 520170010 /nfs/dbraw/zinc/17/00/10/520170010.db2.gz HCOPRHDNJIKEAW-HNNXBMFYSA-N 1 1 361.442 2.537 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)n[nH]1)C2 ZINC000597710870 520190091 /nfs/dbraw/zinc/19/00/91/520190091.db2.gz PPFGAEXPYMVJFH-LJQANCHMSA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)C2 ZINC000597710870 520190098 /nfs/dbraw/zinc/19/00/98/520190098.db2.gz PPFGAEXPYMVJFH-LJQANCHMSA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)C2 ZINC000597710870 520190103 /nfs/dbraw/zinc/19/01/03/520190103.db2.gz PPFGAEXPYMVJFH-LJQANCHMSA-N 1 1 369.425 2.543 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000600314174 520201594 /nfs/dbraw/zinc/20/15/94/520201594.db2.gz MFOBVCBHZZHDFA-STQMWFEESA-N 1 1 369.849 2.864 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)n2)cc1 ZINC000609157409 520213270 /nfs/dbraw/zinc/21/32/70/520213270.db2.gz KJYWXYPRTMNBHZ-OAHLLOKOSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](n4ccnc4)C3)n2)cc1 ZINC000609157409 520213277 /nfs/dbraw/zinc/21/32/77/520213277.db2.gz KJYWXYPRTMNBHZ-OAHLLOKOSA-N 1 1 354.370 2.678 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155873 520232977 /nfs/dbraw/zinc/23/29/77/520232977.db2.gz SMDBOKALXSKZBW-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC3(C[C@H]2C)CCOCC3)c([N+](=O)[O-])c1 ZINC000592181532 520248961 /nfs/dbraw/zinc/24/89/61/520248961.db2.gz HHSHWOMVIVNISV-CQSZACIVSA-N 1 1 350.415 2.873 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC000592188899 520253918 /nfs/dbraw/zinc/25/39/18/520253918.db2.gz UWPQXAWUOYXXKM-ZWKOTPCHSA-N 1 1 354.410 2.546 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)C(=O)NCC2 ZINC000595034547 520264017 /nfs/dbraw/zinc/26/40/17/520264017.db2.gz XURRHHONKQJOTJ-LBPRGKRZSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000600472230 520278269 /nfs/dbraw/zinc/27/82/69/520278269.db2.gz NJTCQVRCHYNDJU-GOSISDBHSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000597855056 520283900 /nfs/dbraw/zinc/28/39/00/520283900.db2.gz QBWUGUIKJIRZIY-CYBMUJFWSA-N 1 1 351.472 2.924 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000597854306 520284002 /nfs/dbraw/zinc/28/40/02/520284002.db2.gz FXPFOVSXLHHFSK-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000597856803 520284872 /nfs/dbraw/zinc/28/48/72/520284872.db2.gz AJQKETSZHIJBRW-ZDUSSCGKSA-N 1 1 372.425 2.511 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000597860548 520288669 /nfs/dbraw/zinc/28/86/69/520288669.db2.gz OHXLKGUOHDBTAV-NSHDSACASA-N 1 1 353.394 2.593 20 5 FFBDMO CC(C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(=O)Nc1ccccc1 ZINC000609392994 520302448 /nfs/dbraw/zinc/30/24/48/520302448.db2.gz OJLFGUIDSZITDW-UHFFFAOYSA-N 1 1 371.393 2.968 20 5 FFBDMO C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[N@H+]1CCCC[C@H]1C ZINC000603743031 520352316 /nfs/dbraw/zinc/35/23/16/520352316.db2.gz RHYXEHMYWZMXIX-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000609547917 520352827 /nfs/dbraw/zinc/35/28/27/520352827.db2.gz OATOXVCNTBQZHY-CQSZACIVSA-N 1 1 369.421 2.666 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000609547917 520352835 /nfs/dbraw/zinc/35/28/35/520352835.db2.gz OATOXVCNTBQZHY-CQSZACIVSA-N 1 1 369.421 2.666 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598040183 520389387 /nfs/dbraw/zinc/38/93/87/520389387.db2.gz DKBRTWDPAMMACX-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000592528493 520441375 /nfs/dbraw/zinc/44/13/75/520441375.db2.gz SAROHBWPPXYCGT-VOKGJARPSA-N 1 1 357.332 2.608 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000592528495 520441796 /nfs/dbraw/zinc/44/17/96/520441796.db2.gz SAROHBWPPXYCGT-ZDTYVGOBSA-N 1 1 357.332 2.608 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595465021 520489743 /nfs/dbraw/zinc/48/97/43/520489743.db2.gz LOJDFURNZRGLCW-KRWDZBQOSA-N 1 1 360.458 2.559 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996197 520500230 /nfs/dbraw/zinc/50/02/30/520500230.db2.gz XPVFFKARRNVCCO-XJKSGUPXSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996197 520500238 /nfs/dbraw/zinc/50/02/38/520500238.db2.gz XPVFFKARRNVCCO-XJKSGUPXSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996197 520500242 /nfs/dbraw/zinc/50/02/42/520500242.db2.gz XPVFFKARRNVCCO-XJKSGUPXSA-N 1 1 371.441 2.751 20 5 FFBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CCN1CCN(c2ccccc2)CC1 ZINC000610004154 520502703 /nfs/dbraw/zinc/50/27/03/520502703.db2.gz AMJBXCIAPBUKPR-UHFFFAOYSA-N 1 1 368.481 2.891 20 5 FFBDMO Cn1cc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C2(CO)CCC2)cn1 ZINC000595492932 520505430 /nfs/dbraw/zinc/50/54/30/520505430.db2.gz HTRGOCVYNGHLMV-MRXNPFEDSA-N 1 1 364.833 2.975 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000610125933 520550267 /nfs/dbraw/zinc/55/02/67/520550267.db2.gz ZCPQSERXIKGIHJ-GOEBONIOSA-N 1 1 358.442 2.881 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000604446362 520565478 /nfs/dbraw/zinc/56/54/78/520565478.db2.gz ZAWOIBHAQGLHCH-IACUBPJLSA-N 1 1 367.833 2.759 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000598343879 520565905 /nfs/dbraw/zinc/56/59/05/520565905.db2.gz XMQVTSSIYHXORA-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000598343878 520566503 /nfs/dbraw/zinc/56/65/03/520566503.db2.gz XMQVTSSIYHXORA-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO CCCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000592833218 520608717 /nfs/dbraw/zinc/60/87/17/520608717.db2.gz WRSXGMPYCOWGCC-OCCSQVGLSA-N 1 1 369.849 2.958 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000595635910 520613589 /nfs/dbraw/zinc/61/35/89/520613589.db2.gz OOBSNOVTJSRJRT-SCDSUCTJSA-N 1 1 355.232 2.950 20 5 FFBDMO CC1(C)C[C@H]([N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2ccccc2)CO1 ZINC000595639373 520615387 /nfs/dbraw/zinc/61/53/87/520615387.db2.gz WVMHJUFSGUUXHT-SFHVURJKSA-N 1 1 371.437 2.826 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1 ZINC000610298513 520627834 /nfs/dbraw/zinc/62/78/34/520627834.db2.gz WYDHZXGSHSQAEN-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000601148821 520659372 /nfs/dbraw/zinc/65/93/72/520659372.db2.gz GTFHMPWIKOTABC-FQEVSTJZSA-N 1 1 366.421 2.837 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601150000 520662340 /nfs/dbraw/zinc/66/23/40/520662340.db2.gz RRNLUZOBESUSNN-NVXWUHKLSA-N 1 1 363.439 2.900 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H]3CCC4(CCOCC4)[C@@H]3O)c2c1 ZINC000601161862 520666469 /nfs/dbraw/zinc/66/64/69/520666469.db2.gz VKQXLQKELVJWLK-SCLBCKFNSA-N 1 1 357.410 2.545 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000601198909 520682778 /nfs/dbraw/zinc/68/27/78/520682778.db2.gz JMRXMHHMJNOBTN-NSHDSACASA-N 1 1 361.368 2.881 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557152 520702750 /nfs/dbraw/zinc/70/27/50/520702750.db2.gz BQRBWEPJVAPLNJ-OAHLLOKOSA-N 1 1 361.442 2.845 20 5 FFBDMO CC[C@@H]1COC(C)(C)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000593058751 520716218 /nfs/dbraw/zinc/71/62/18/520716218.db2.gz NRBPGDCDCXQXNU-CYBMUJFWSA-N 1 1 363.414 2.782 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000598612513 520741943 /nfs/dbraw/zinc/74/19/43/520741943.db2.gz QABNONDTEPFOBP-ZFWWWQNUSA-N 1 1 369.487 2.562 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598613959 520744441 /nfs/dbraw/zinc/74/44/41/520744441.db2.gz ZYUOWPVQFKBJDM-ZFWWWQNUSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581035 520747871 /nfs/dbraw/zinc/74/78/71/520747871.db2.gz ZHPOFMSOOYJRTK-IJEWVQPXSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581035 520747880 /nfs/dbraw/zinc/74/78/80/520747880.db2.gz ZHPOFMSOOYJRTK-IJEWVQPXSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581035 520747888 /nfs/dbraw/zinc/74/78/88/520747888.db2.gz ZHPOFMSOOYJRTK-IJEWVQPXSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581035 520747901 /nfs/dbraw/zinc/74/79/01/520747901.db2.gz ZHPOFMSOOYJRTK-IJEWVQPXSA-N 1 1 374.441 2.810 20 5 FFBDMO CC(C)C[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000598647795 520759978 /nfs/dbraw/zinc/75/99/78/520759978.db2.gz JDBKJBOWPJIULK-QGZVFWFLSA-N 1 1 366.849 2.964 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000595916877 520824131 /nfs/dbraw/zinc/82/41/31/520824131.db2.gz MDCSPPCXOWPOMG-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000595916877 520824135 /nfs/dbraw/zinc/82/41/35/520824135.db2.gz MDCSPPCXOWPOMG-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC000595916876 520824213 /nfs/dbraw/zinc/82/42/13/520824213.db2.gz MDCSPPCXOWPOMG-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC000595916876 520824217 /nfs/dbraw/zinc/82/42/17/520824217.db2.gz MDCSPPCXOWPOMG-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO COc1cc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596078617 520898682 /nfs/dbraw/zinc/89/86/82/520898682.db2.gz XWPQVJZPSFSFSP-CYBMUJFWSA-N 1 1 369.849 2.948 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596088646 520906103 /nfs/dbraw/zinc/90/61/03/520906103.db2.gz MUMLGSQUTRKNOV-CJNGLKHVSA-N 1 1 354.410 2.941 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000598916624 520914917 /nfs/dbraw/zinc/91/49/17/520914917.db2.gz HICOGKHWKOJRGT-OAHLLOKOSA-N 1 1 361.789 2.822 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596127022 520928327 /nfs/dbraw/zinc/92/83/27/520928327.db2.gz SOULVUBANZLBNL-HUUCEWRRSA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593418501 520981394 /nfs/dbraw/zinc/98/13/94/520981394.db2.gz ICGUZENGXWPFEC-ZDUSSCGKSA-N 1 1 351.422 2.903 20 5 FFBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596231493 520984872 /nfs/dbraw/zinc/98/48/72/520984872.db2.gz JVQKNRLEXYFJHQ-WCQYABFASA-N 1 1 359.348 2.913 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1 ZINC000601849881 520985766 /nfs/dbraw/zinc/98/57/66/520985766.db2.gz LLBCPPOIHSDNEY-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000596242777 520989568 /nfs/dbraw/zinc/98/95/68/520989568.db2.gz YLDSKDXIOFCMCU-INIZCTEOSA-N 1 1 353.806 2.567 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@H+](C)Cc1ccccc1 ZINC000611150017 521010992 /nfs/dbraw/zinc/01/09/92/521010992.db2.gz QXMIWXTUKXUHAA-QGZVFWFLSA-N 1 1 358.394 2.669 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599066016 521011341 /nfs/dbraw/zinc/01/13/41/521011341.db2.gz NCRPIAIXEJOOEM-JENIJYKNSA-N 1 1 360.410 2.969 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc2oc(=O)n(C)c2c1 ZINC000599081388 521020626 /nfs/dbraw/zinc/02/06/26/521020626.db2.gz JTAPUBLISADLIE-LLVKDONJSA-N 1 1 357.366 2.899 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCn4cc(C)[nH+]c4C3)n2)c1 ZINC000599154486 521057608 /nfs/dbraw/zinc/05/76/08/521057608.db2.gz ZYUKHGLGLANKDK-GFCCVEGCSA-N 1 1 369.381 2.812 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611255439 521060745 /nfs/dbraw/zinc/06/07/45/521060745.db2.gz BVLXKWQPCCPKGN-UHFFFAOYSA-N 1 1 364.398 2.531 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1ccnc1 ZINC000611286001 521081452 /nfs/dbraw/zinc/08/14/52/521081452.db2.gz QJANZDUEWRHXPM-CJNGLKHVSA-N 1 1 358.398 2.646 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1ccnc1 ZINC000611286001 521081463 /nfs/dbraw/zinc/08/14/63/521081463.db2.gz QJANZDUEWRHXPM-CJNGLKHVSA-N 1 1 358.398 2.646 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287364 521081504 /nfs/dbraw/zinc/08/15/04/521081504.db2.gz ZUDJVJXEWWGKGD-PBHICJAKSA-N 1 1 373.453 2.815 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000611512579 521194636 /nfs/dbraw/zinc/19/46/36/521194636.db2.gz HYBCRFQEDNDHCB-OAHLLOKOSA-N 1 1 366.849 2.574 20 5 FFBDMO C[N@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000611557599 521219546 /nfs/dbraw/zinc/21/95/46/521219546.db2.gz GPHSMYFLUWTVJO-MRXNPFEDSA-N 1 1 355.394 2.647 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000611557599 521219555 /nfs/dbraw/zinc/21/95/55/521219555.db2.gz GPHSMYFLUWTVJO-MRXNPFEDSA-N 1 1 355.394 2.647 20 5 FFBDMO Cc1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611572092 521225274 /nfs/dbraw/zinc/22/52/74/521225274.db2.gz CWDYOXIVTGLKEE-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO Cc1ccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000611582236 521236696 /nfs/dbraw/zinc/23/66/96/521236696.db2.gz MDKYEDVYTMVBMZ-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c(C)cc1[N+](=O)[O-] ZINC000599464517 521239956 /nfs/dbraw/zinc/23/99/56/521239956.db2.gz NAHGDEJMKATVJF-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCCc2cc(-c3cccc(F)c3)n[nH]2)c([N+](=O)[O-])n1 ZINC000602450134 521353218 /nfs/dbraw/zinc/35/32/18/521353218.db2.gz UJNUULFIFGOIOJ-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3c(O)cccc3C2)c([N+](=O)[O-])c1 ZINC000599645160 521356079 /nfs/dbraw/zinc/35/60/79/521356079.db2.gz DEUGTQZADWUJHF-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594057371 521378700 /nfs/dbraw/zinc/37/87/00/521378700.db2.gz ZLSLGLABRXBIRJ-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594057371 521378710 /nfs/dbraw/zinc/37/87/10/521378710.db2.gz ZLSLGLABRXBIRJ-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098838 521403224 /nfs/dbraw/zinc/40/32/24/521403224.db2.gz WYPPQVOMXJFRFT-KFWWJZLASA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098838 521403229 /nfs/dbraw/zinc/40/32/29/521403229.db2.gz WYPPQVOMXJFRFT-KFWWJZLASA-N 1 1 364.446 2.831 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000599697170 521408602 /nfs/dbraw/zinc/40/86/02/521408602.db2.gz WGADGKYMJHECGR-KRWDZBQOSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000599697170 521408608 /nfs/dbraw/zinc/40/86/08/521408608.db2.gz WGADGKYMJHECGR-KRWDZBQOSA-N 1 1 370.409 2.999 20 5 FFBDMO COC(=O)C1C[C@H](C)[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000599706239 521415809 /nfs/dbraw/zinc/41/58/09/521415809.db2.gz JSKHEVPSZNMEGL-RYUDHWBXSA-N 1 1 364.398 2.623 20 5 FFBDMO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597015784 521446880 /nfs/dbraw/zinc/44/68/80/521446880.db2.gz XVVLGIXTWJJGIO-AWEZNQCLSA-N 1 1 356.430 2.677 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000594198652 521463943 /nfs/dbraw/zinc/46/39/43/521463943.db2.gz UIHDLABNHTWJSU-OLZOCXBDSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594198142 521464221 /nfs/dbraw/zinc/46/42/21/521464221.db2.gz SJRNZFFUGYKQCH-JKSUJKDBSA-N 1 1 351.834 2.924 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000597102537 521507269 /nfs/dbraw/zinc/50/72/69/521507269.db2.gz XUCAYUCKMYLIEO-GWCFXTLKSA-N 1 1 367.837 2.778 20 5 FFBDMO COCCSc1ccc([C@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC000602807510 521544336 /nfs/dbraw/zinc/54/43/36/521544336.db2.gz VHSPMLQOYOEQND-LBPRGKRZSA-N 1 1 350.444 2.918 20 5 FFBDMO Cn1cc(C[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])n1 ZINC000602833891 521560093 /nfs/dbraw/zinc/56/00/93/521560093.db2.gz XDPWBYKNSXPKNU-ZDUSSCGKSA-N 1 1 359.213 2.848 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000619863435 521909909 /nfs/dbraw/zinc/90/99/09/521909909.db2.gz FUDKKTIACPVLER-APWZRJJASA-N 1 1 374.441 2.625 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)Cc1ccccc1 ZINC000736026169 598676423 /nfs/dbraw/zinc/67/64/23/598676423.db2.gz LUMBTWZFWKPCGL-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cccc([N+](=O)[O-])n3)CC[C@@H]21 ZINC001164832952 720519775 /nfs/dbraw/zinc/51/97/75/720519775.db2.gz CCNMASFKISGJEX-ULQDDVLXSA-N 1 1 370.457 2.564 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932510 721855353 /nfs/dbraw/zinc/85/53/53/721855353.db2.gz YNOSJQLJNVGIQI-MOPGFXCFSA-N 1 1 369.469 2.666 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@@H]2CCN3CC[NH+](C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932510 721855354 /nfs/dbraw/zinc/85/53/54/721855354.db2.gz YNOSJQLJNVGIQI-MOPGFXCFSA-N 1 1 369.469 2.666 20 5 FFBDMO CCc1nn(C)c(Cl)c1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534247 728476370 /nfs/dbraw/zinc/47/63/70/728476370.db2.gz RXYZGKOXRUIOMM-NSHDSACASA-N 1 1 364.837 2.626 20 5 FFBDMO CCc1nn(C)c(Cl)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534247 728476371 /nfs/dbraw/zinc/47/63/71/728476371.db2.gz RXYZGKOXRUIOMM-NSHDSACASA-N 1 1 364.837 2.626 20 5 FFBDMO CC(C)(C)C[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109747574 728529109 /nfs/dbraw/zinc/52/91/09/728529109.db2.gz BBEDBYYEYKVLND-UHFFFAOYSA-N 1 1 357.838 2.917 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000129902634 728713924 /nfs/dbraw/zinc/71/39/24/728713924.db2.gz LGPJCMGGNGOFPZ-UHFFFAOYSA-N 1 1 350.806 2.892 20 5 FFBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131397266 728722171 /nfs/dbraw/zinc/72/21/71/728722171.db2.gz CSNSJAPKSWRURF-NSHDSACASA-N 1 1 369.468 2.757 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000152106589 728747990 /nfs/dbraw/zinc/74/79/90/728747990.db2.gz SERIEVZGQQGRQP-CQSZACIVSA-N 1 1 369.487 2.525 20 5 FFBDMO CC(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@H](O)c1ccc(F)cc1 ZINC000176248197 729113110 /nfs/dbraw/zinc/11/31/10/729113110.db2.gz GQRZCDXWLXJXSM-MRXNPFEDSA-N 1 1 350.394 2.622 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000249830685 729621588 /nfs/dbraw/zinc/62/15/88/729621588.db2.gz TWZNDYJOLZGYOG-CKEIUWERSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000249830685 729621590 /nfs/dbraw/zinc/62/15/90/729621590.db2.gz TWZNDYJOLZGYOG-CKEIUWERSA-N 1 1 351.422 2.808 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000861352741 730603352 /nfs/dbraw/zinc/60/33/52/730603352.db2.gz KBLBWDUJCDIMMU-UGSOOPFHSA-N 1 1 350.415 2.525 20 5 FFBDMO C[N@@H+](CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)C1CCC1 ZINC000863926169 730816021 /nfs/dbraw/zinc/81/60/21/730816021.db2.gz SMLDIOJXTYOTOA-AWEZNQCLSA-N 1 1 363.311 2.938 20 5 FFBDMO CCS[C@@H]1CC[C@@H](N(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867962440 731246175 /nfs/dbraw/zinc/24/61/75/731246175.db2.gz BJGZQVZKZWSLTJ-FRFSOERESA-N 1 1 351.472 2.901 20 5 FFBDMO Cc1ccc(COC(=O)[C@@H]([NH2+]C2CCOCC2)C(C)C)cc1[N+](=O)[O-] ZINC000869421569 731397871 /nfs/dbraw/zinc/39/78/71/731397871.db2.gz USTFGJODVIYKPJ-KRWDZBQOSA-N 1 1 350.415 2.740 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H]1CS(=O)(=O)c2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872075891 731727347 /nfs/dbraw/zinc/72/73/47/731727347.db2.gz VJLABBMOAUMLHD-VXGBXAGGSA-N 1 1 364.398 2.956 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CC[N@H+](CC(C)(C)O)C1 ZINC000872090316 731728665 /nfs/dbraw/zinc/72/86/65/731728665.db2.gz AORQSICNSQBRMN-OLZOCXBDSA-N 1 1 353.488 2.813 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CC[N@@H+](CC(C)(C)O)C1 ZINC000872090316 731728668 /nfs/dbraw/zinc/72/86/68/731728668.db2.gz AORQSICNSQBRMN-OLZOCXBDSA-N 1 1 353.488 2.813 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000780768250 738575190 /nfs/dbraw/zinc/57/51/90/738575190.db2.gz QJPKWDDLHWLWGH-CABCVRRESA-N 1 1 364.496 2.856 20 5 FFBDMO CC[N@@H+](CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl)C(C)C ZINC000780856250 738582011 /nfs/dbraw/zinc/58/20/11/738582011.db2.gz NUSMMKVTWKKMCS-UHFFFAOYSA-N 1 1 363.867 2.565 20 5 FFBDMO C[C@]12COC[C@H]1C[N@@H+](Cc1nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o1)C2 ZINC000878949128 732620440 /nfs/dbraw/zinc/62/04/40/732620440.db2.gz IXLUSQSQGCQURP-HWPZZCPQSA-N 1 1 364.789 2.767 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1ccnc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000879270869 732676480 /nfs/dbraw/zinc/67/64/80/732676480.db2.gz BNRUNGPFOXJAAV-HNNXBMFYSA-N 1 1 366.215 2.750 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000879557765 732721659 /nfs/dbraw/zinc/72/16/59/732721659.db2.gz FLOHMRJPGPSRCO-RWMBFGLXSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000879557765 732721666 /nfs/dbraw/zinc/72/16/66/732721666.db2.gz FLOHMRJPGPSRCO-RWMBFGLXSA-N 1 1 365.455 2.615 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008765 732818883 /nfs/dbraw/zinc/81/88/83/732818883.db2.gz HDKAYOSQULOXOA-ZIAGYGMSSA-N 1 1 363.439 2.589 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO ZINC000880072976 732842208 /nfs/dbraw/zinc/84/22/08/732842208.db2.gz NXABWEINXPPLHD-QWHCGFSZSA-N 1 1 360.241 2.543 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880145543 732855550 /nfs/dbraw/zinc/85/55/50/732855550.db2.gz NXGYNJICFJDGNS-MNOVXSKESA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880145543 732855554 /nfs/dbraw/zinc/85/55/54/732855554.db2.gz NXGYNJICFJDGNS-MNOVXSKESA-N 1 1 355.822 2.668 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCN1 ZINC000880168613 732858754 /nfs/dbraw/zinc/85/87/54/732858754.db2.gz RRQZEBSOFPWHBE-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCN1 ZINC000880168613 732858758 /nfs/dbraw/zinc/85/87/58/732858758.db2.gz RRQZEBSOFPWHBE-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827880 733845701 /nfs/dbraw/zinc/84/57/01/733845701.db2.gz SXXJBGPEVSLQMP-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827880 733845704 /nfs/dbraw/zinc/84/57/04/733845704.db2.gz SXXJBGPEVSLQMP-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO COC1CCC(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CC1 ZINC000891713802 734465761 /nfs/dbraw/zinc/46/57/61/734465761.db2.gz GAPZYLAHXMTXDE-UHFFFAOYSA-N 1 1 367.471 2.619 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102353 738824714 /nfs/dbraw/zinc/82/47/14/738824714.db2.gz HTSSBSKXVNLSKS-DGCLKSJQSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102353 738824717 /nfs/dbraw/zinc/82/47/17/738824717.db2.gz HTSSBSKXVNLSKS-DGCLKSJQSA-N 1 1 355.847 2.558 20 5 FFBDMO CC(C)C[N@@H+]1CCO[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731205826 734670770 /nfs/dbraw/zinc/67/07/70/734670770.db2.gz MWFOGFMBCLFNJZ-ZDUSSCGKSA-N 1 1 350.444 2.973 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731205826 734670773 /nfs/dbraw/zinc/67/07/73/734670773.db2.gz MWFOGFMBCLFNJZ-ZDUSSCGKSA-N 1 1 350.444 2.973 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000732050624 734714622 /nfs/dbraw/zinc/71/46/22/734714622.db2.gz XVLWOVVDPSKBSL-SECBINFHSA-N 1 1 366.771 2.925 20 5 FFBDMO COC(=O)c1cnc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000894420669 734854722 /nfs/dbraw/zinc/85/47/22/734854722.db2.gz PLYAMRNOEBNQHU-UHFFFAOYSA-N 1 1 355.803 2.824 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H]1c1ccccc1 ZINC000895005885 734950810 /nfs/dbraw/zinc/95/08/10/734950810.db2.gz BKVJAVGQUWABEQ-LSDHHAIUSA-N 1 1 359.813 2.949 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@@H]2C)cc1SC ZINC000742241196 735214202 /nfs/dbraw/zinc/21/42/02/735214202.db2.gz XTGOBQIQTWRCCI-NSHDSACASA-N 1 1 353.444 2.539 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932760 735937034 /nfs/dbraw/zinc/93/70/34/735937034.db2.gz FQHSWAFJBJFSSY-GWCFXTLKSA-N 1 1 361.240 2.647 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932760 735937037 /nfs/dbraw/zinc/93/70/37/735937037.db2.gz FQHSWAFJBJFSSY-GWCFXTLKSA-N 1 1 361.240 2.647 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000906791354 736544104 /nfs/dbraw/zinc/54/41/04/736544104.db2.gz LCGAMOLJBKMBBK-GXFFZTMASA-N 1 1 354.838 2.633 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CCCO1 ZINC000907756786 736664027 /nfs/dbraw/zinc/66/40/27/736664027.db2.gz SKXRCFURRLBTEV-LLVKDONJSA-N 1 1 373.812 2.618 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000907793137 736668183 /nfs/dbraw/zinc/66/81/83/736668183.db2.gz JSJZNTLAPYNPAF-JKSUJKDBSA-N 1 1 369.824 2.826 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000763275357 736921995 /nfs/dbraw/zinc/92/19/95/736921995.db2.gz GLRFIKIPYDRJCM-ZDUSSCGKSA-N 1 1 357.863 2.644 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](C3CC3)C2)cc1Cl ZINC000765470278 737121533 /nfs/dbraw/zinc/12/15/33/737121533.db2.gz YBDDUFJYLRGVBD-SNVBAGLBSA-N 1 1 353.806 2.931 20 5 FFBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCN(CC(F)(F)F)C1=O ZINC000769410924 737525694 /nfs/dbraw/zinc/52/56/94/737525694.db2.gz FJDTZPUPSPWTRC-SDQPKGBYSA-N 1 1 357.332 2.703 20 5 FFBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCN(CC(F)(F)F)C1=O ZINC000769410924 737525697 /nfs/dbraw/zinc/52/56/97/737525697.db2.gz FJDTZPUPSPWTRC-SDQPKGBYSA-N 1 1 357.332 2.703 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769484967 737534531 /nfs/dbraw/zinc/53/45/31/737534531.db2.gz YADFYGVFHUYSLQ-SNVBAGLBSA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769484967 737534535 /nfs/dbraw/zinc/53/45/35/737534535.db2.gz YADFYGVFHUYSLQ-SNVBAGLBSA-N 1 1 357.204 2.885 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000922226258 738108209 /nfs/dbraw/zinc/10/82/09/738108209.db2.gz USWXYTVQZPSAJK-ZANVPECISA-N 1 1 360.336 2.505 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000930156674 739066680 /nfs/dbraw/zinc/06/66/80/739066680.db2.gz BEWFXCHBAJJQFU-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)COC(=O)N1 ZINC000932095952 739385954 /nfs/dbraw/zinc/38/59/54/739385954.db2.gz IJGREWZRORAOKL-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000790269595 739431052 /nfs/dbraw/zinc/43/10/52/739431052.db2.gz BTSTVIGNUDKCGJ-IAQYHMDHSA-N 1 1 367.833 2.955 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000932662933 739486904 /nfs/dbraw/zinc/48/69/04/739486904.db2.gz KYLRIKWGLMENRU-CYBMUJFWSA-N 1 1 361.423 2.870 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000796162023 740110171 /nfs/dbraw/zinc/11/01/71/740110171.db2.gz XLOJLPFCXLLKBZ-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000796162023 740110174 /nfs/dbraw/zinc/11/01/74/740110174.db2.gz XLOJLPFCXLLKBZ-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO O=C(CC[N@@H+]1CCC=C(Br)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000799328613 740409422 /nfs/dbraw/zinc/40/94/22/740409422.db2.gz QACKLGVZOQFLAB-UHFFFAOYSA-N 1 1 354.204 2.908 20 5 FFBDMO O=C(CC[N@H+]1CCC=C(Br)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000799328613 740409423 /nfs/dbraw/zinc/40/94/23/740409423.db2.gz QACKLGVZOQFLAB-UHFFFAOYSA-N 1 1 354.204 2.908 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804443000 740874496 /nfs/dbraw/zinc/87/44/96/740874496.db2.gz UDZBHZFUEUAGDU-HNNXBMFYSA-N 1 1 352.866 2.855 20 5 FFBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804809213 740906659 /nfs/dbraw/zinc/90/66/59/740906659.db2.gz SCVQLIBBOYLZSN-AAEUAGOBSA-N 1 1 359.348 2.913 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)cc1F)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985432160 741395247 /nfs/dbraw/zinc/39/52/47/741395247.db2.gz WTGIXFXEXPBWTH-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432160 741395251 /nfs/dbraw/zinc/39/52/51/741395251.db2.gz WTGIXFXEXPBWTH-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)cc1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432160 741395256 /nfs/dbraw/zinc/39/52/56/741395256.db2.gz WTGIXFXEXPBWTH-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO COCC[N@@H+](C)CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811474162 741527097 /nfs/dbraw/zinc/52/70/97/741527097.db2.gz VVSQQMYBVSIDIX-UHFFFAOYSA-N 1 1 350.246 2.960 20 5 FFBDMO CCCCO[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173799 741685211 /nfs/dbraw/zinc/68/52/11/741685211.db2.gz JRBDPOIXHHUQJE-YOEHRIQHSA-N 1 1 350.415 2.918 20 5 FFBDMO CCCCO[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173799 741685215 /nfs/dbraw/zinc/68/52/15/741685215.db2.gz JRBDPOIXHHUQJE-YOEHRIQHSA-N 1 1 350.415 2.918 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@@H+]1CCOC ZINC000816957105 742077437 /nfs/dbraw/zinc/07/74/37/742077437.db2.gz GCHDPYAXNRSQQE-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1CCOC ZINC000816957105 742077442 /nfs/dbraw/zinc/07/74/42/742077442.db2.gz GCHDPYAXNRSQQE-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO O=C(NC1CC[NH+](C/C=C/c2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002786459 742173600 /nfs/dbraw/zinc/17/36/00/742173600.db2.gz AXJOPULMRTYXSK-KBXQFXQKSA-N 1 1 363.845 2.599 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1c(F)cc(F)cc1F ZINC000819332644 742375910 /nfs/dbraw/zinc/37/59/10/742375910.db2.gz AMSGMGFYPDYENF-LLVKDONJSA-N 1 1 356.300 2.542 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)C2)C1 ZINC000820610083 742524061 /nfs/dbraw/zinc/52/40/61/742524061.db2.gz VCEMGWRCNRTGEN-INIZCTEOSA-N 1 1 370.812 2.527 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000828509655 745077832 /nfs/dbraw/zinc/07/78/32/745077832.db2.gz FMOATODEBMSSTM-SWLSCSKDSA-N 1 1 351.834 2.733 20 5 FFBDMO C[C@H]1C[N@H+](CCO)CCN1c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000829578192 745227713 /nfs/dbraw/zinc/22/77/13/745227713.db2.gz WPQWOKULKPDGSW-VIFPVBQESA-N 1 1 367.755 2.770 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)CCN1c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000829578192 745227717 /nfs/dbraw/zinc/22/77/17/745227717.db2.gz WPQWOKULKPDGSW-VIFPVBQESA-N 1 1 367.755 2.770 20 5 FFBDMO COc1ccc(CC(=O)OC[C@@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000837499605 746461330 /nfs/dbraw/zinc/46/13/30/746461330.db2.gz LZQPTOMCUZVTPU-HNNXBMFYSA-N 1 1 350.415 2.952 20 5 FFBDMO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(=O)N1CCCC1 ZINC000839588347 746864692 /nfs/dbraw/zinc/86/46/92/746864692.db2.gz AKZIPMLBHYWXRN-UHFFFAOYSA-N 1 1 370.247 2.848 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000844903121 748132568 /nfs/dbraw/zinc/13/25/68/748132568.db2.gz SRMUBSFWYXBIAS-VBQJREDUSA-N 1 1 353.850 2.967 20 5 FFBDMO CN(C)C(=O)CCC[N@H+]1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000846895577 748569254 /nfs/dbraw/zinc/56/92/54/748569254.db2.gz PJNRWMXFTCALTN-UHFFFAOYSA-N 1 1 370.247 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848510497 748946496 /nfs/dbraw/zinc/94/64/96/748946496.db2.gz TXEPIJRAFUUAEN-STQMWFEESA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@]1(C2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)COC(=O)N1 ZINC000895615836 970789277 /nfs/dbraw/zinc/78/92/77/970789277.db2.gz GWKHOZIQGDPGQY-GOSISDBHSA-N 1 1 356.382 2.858 20 5 FFBDMO C[C@H]([NH2+]C[C@H]1CN(Cc2ccncc2)CCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090227 1013142736 /nfs/dbraw/zinc/14/27/36/1013142736.db2.gz NYSMEUVJDHUWHE-HOCLYGCPSA-N 1 1 374.416 2.681 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000134883641 960091875 /nfs/dbraw/zinc/09/18/75/960091875.db2.gz LOJGNWBUKQNTKH-MAUKXSAKSA-N 1 1 353.422 2.917 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000023802653 963257542 /nfs/dbraw/zinc/25/75/42/963257542.db2.gz OPCDEDAWQMRZDR-YVMONPNESA-N 1 1 372.450 2.892 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000023802653 963257552 /nfs/dbraw/zinc/25/75/52/963257552.db2.gz OPCDEDAWQMRZDR-YVMONPNESA-N 1 1 372.450 2.892 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(-c3ccsc3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269411833 964134646 /nfs/dbraw/zinc/13/46/46/964134646.db2.gz VFADVUJBIXHUQX-IAGOWNOFSA-N 1 1 371.462 2.819 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]Cc2ccccc2C2CC2)CC1 ZINC001269858726 964373285 /nfs/dbraw/zinc/37/32/85/964373285.db2.gz BTIHMUKPYZDVRC-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC001175651732 1013522817 /nfs/dbraw/zinc/52/28/17/1013522817.db2.gz OFKFNYPBORHODP-FHLIZLRMSA-N 1 1 358.442 2.809 20 5 FFBDMO COc1c(O)ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000892235109 966349147 /nfs/dbraw/zinc/34/91/47/966349147.db2.gz KURCJILEVCUBLG-CZUORRHYSA-N 1 1 361.442 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H](Cc4ccccc4)[C@H](O)C3)nc2c1 ZINC000934438526 966456531 /nfs/dbraw/zinc/45/65/31/966456531.db2.gz MLOPIQSMECHTBV-RDTXWAMCSA-N 1 1 352.394 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H](Cc4ccccc4)[C@H](O)C3)nc2c1 ZINC000934438526 966456540 /nfs/dbraw/zinc/45/65/40/966456540.db2.gz MLOPIQSMECHTBV-RDTXWAMCSA-N 1 1 352.394 2.507 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2ccccc21 ZINC001029305034 967649730 /nfs/dbraw/zinc/64/97/30/967649730.db2.gz ROIBRRRHOYVKNH-PIKOESSRSA-N 1 1 365.433 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc2ccccc21 ZINC001029305034 967649736 /nfs/dbraw/zinc/64/97/36/967649736.db2.gz ROIBRRRHOYVKNH-PIKOESSRSA-N 1 1 365.433 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc2ccccc21 ZINC001029305034 967649741 /nfs/dbraw/zinc/64/97/41/967649741.db2.gz ROIBRRRHOYVKNH-PIKOESSRSA-N 1 1 365.433 2.680 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001267590856 969689643 /nfs/dbraw/zinc/68/96/43/969689643.db2.gz LGSSUGDVDBNSHU-SCLBCKFNSA-N 1 1 354.410 2.549 20 5 FFBDMO Cc1cc(N2CCC[C@@H](OC(=O)c3ccccc3[N+](=O)[O-])C2)nc(C)[nH+]1 ZINC000066730872 970099439 /nfs/dbraw/zinc/09/94/39/970099439.db2.gz ANKIFNZLCAMAGV-CQSZACIVSA-N 1 1 356.382 2.827 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103457488 970403421 /nfs/dbraw/zinc/40/34/21/970403421.db2.gz DYUMLKFEODDUTQ-OAHLLOKOSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103457488 970403423 /nfs/dbraw/zinc/40/34/23/970403423.db2.gz DYUMLKFEODDUTQ-OAHLLOKOSA-N 1 1 358.398 2.691 20 5 FFBDMO C[N@@H+](CCCCC(F)(F)F)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001267730470 970742196 /nfs/dbraw/zinc/74/21/96/970742196.db2.gz XJIWKRYWKMMGMS-ZIAGYGMSSA-N 1 1 365.396 2.555 20 5 FFBDMO C[N@H+](CCCCC(F)(F)F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001267730470 970742202 /nfs/dbraw/zinc/74/22/02/970742202.db2.gz XJIWKRYWKMMGMS-ZIAGYGMSSA-N 1 1 365.396 2.555 20 5 FFBDMO C[N@@H+](CCCCC(F)(F)F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001267730470 970742209 /nfs/dbraw/zinc/74/22/09/970742209.db2.gz XJIWKRYWKMMGMS-ZIAGYGMSSA-N 1 1 365.396 2.555 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985433163 974070171 /nfs/dbraw/zinc/07/01/71/974070171.db2.gz IVUAAJRIVZETMR-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)c1ccccc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985433163 974070181 /nfs/dbraw/zinc/07/01/81/974070181.db2.gz IVUAAJRIVZETMR-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985433163 974070186 /nfs/dbraw/zinc/07/01/86/974070186.db2.gz IVUAAJRIVZETMR-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000877560264 1014627862 /nfs/dbraw/zinc/62/78/62/1014627862.db2.gz LVMNUFIXXFGHEV-JKSUJKDBSA-N 1 1 353.422 2.993 20 5 FFBDMO C[N@@H+](C[C@@H]1CC=CCC1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000784014745 980497785 /nfs/dbraw/zinc/49/77/85/980497785.db2.gz NSZWZVNQDJVIBY-CQSZACIVSA-N 1 1 358.398 2.609 20 5 FFBDMO C[C@@H]1CC2(CC([NH2+][C@H](c3nccn3C)c3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000897778408 982513387 /nfs/dbraw/zinc/51/33/87/982513387.db2.gz GSJXFPMHBITBAI-OHNPGISMSA-N 1 1 356.426 2.965 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC[N@@H+]1C ZINC000764400383 984479712 /nfs/dbraw/zinc/47/97/12/984479712.db2.gz AVDXUQGNXHICJD-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC[N@H+]1C ZINC000764400383 984479715 /nfs/dbraw/zinc/47/97/15/984479715.db2.gz AVDXUQGNXHICJD-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO CCC1(CC)[C@H]([N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@@H]1OC ZINC000765123191 984969042 /nfs/dbraw/zinc/96/90/42/984969042.db2.gz HLDMTKPPCNBRGJ-CVEARBPZSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H]([N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@@H]1OC ZINC000765123191 984969050 /nfs/dbraw/zinc/96/90/50/984969050.db2.gz HLDMTKPPCNBRGJ-CVEARBPZSA-N 1 1 363.414 2.986 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000879057628 1015343762 /nfs/dbraw/zinc/34/37/62/1015343762.db2.gz RCRCHXKVLDIGFP-MRXNPFEDSA-N 1 1 357.414 2.525 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000762638099 988543709 /nfs/dbraw/zinc/54/37/09/988543709.db2.gz AIQXIRNYLWIISA-AEFFLSMTSA-N 1 1 361.398 2.524 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000763112455 989045264 /nfs/dbraw/zinc/04/52/64/989045264.db2.gz SKULMFNGQCUHTR-UHFFFAOYSA-N 1 1 358.398 2.947 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC001128617293 989550718 /nfs/dbraw/zinc/55/07/18/989550718.db2.gz UMBVMFNQPFYKIR-UHFFFAOYSA-N 1 1 353.176 2.809 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CC4(CCC4)C3)C2)CC1 ZINC001035186932 990410232 /nfs/dbraw/zinc/41/02/32/990410232.db2.gz LYRGUJFYGCSMKT-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CC3CC4(CCC4)C3)C2)CC1 ZINC001035186932 990410235 /nfs/dbraw/zinc/41/02/35/990410235.db2.gz LYRGUJFYGCSMKT-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CC4(CCC4)C3)C2)CC1 ZINC001035186932 990410236 /nfs/dbraw/zinc/41/02/36/990410236.db2.gz LYRGUJFYGCSMKT-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO COc1cccc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000194844390 990591262 /nfs/dbraw/zinc/59/12/62/990591262.db2.gz FODHMQFWOKRBOQ-KGLIPLIRSA-N 1 1 361.442 2.986 20 5 FFBDMO CCC(CC)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000920409483 990845031 /nfs/dbraw/zinc/84/50/31/990845031.db2.gz CALGVXPDBRYOQR-UHFFFAOYSA-N 1 1 374.485 2.896 20 5 FFBDMO O=C(NCC1C[NH+](Cc2ccc(C3CCCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031660947 990850783 /nfs/dbraw/zinc/85/07/83/990850783.db2.gz XZARWGIHRFOCCW-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008563 1015731211 /nfs/dbraw/zinc/73/12/11/1015731211.db2.gz FOYNLBVNAIGZKF-XJKSGUPXSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008563 1015731220 /nfs/dbraw/zinc/73/12/20/1015731220.db2.gz FOYNLBVNAIGZKF-XJKSGUPXSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)c1F ZINC000803458187 1015877819 /nfs/dbraw/zinc/87/78/19/1015877819.db2.gz HQMFOZAQMBBISG-UHFFFAOYSA-N 1 1 367.421 2.615 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000823998061 996774546 /nfs/dbraw/zinc/77/45/46/996774546.db2.gz KIPHSSUWFCEJGY-UHFFFAOYSA-N 1 1 357.414 2.950 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C(C)(C)C ZINC001144024570 997944261 /nfs/dbraw/zinc/94/42/61/997944261.db2.gz MBALMKPPVICTEP-HNNXBMFYSA-N 1 1 353.850 2.979 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@H]1C(C)(C)C ZINC001144023931 997945210 /nfs/dbraw/zinc/94/52/10/997945210.db2.gz CZCXGJAVMMGTCL-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000845727351 998639715 /nfs/dbraw/zinc/63/97/15/998639715.db2.gz BJMWGHRZLSVBPG-CQSZACIVSA-N 1 1 358.398 2.810 20 5 FFBDMO O=C(NC1(C2CC[NH+](CC3CC4(CCC4)C3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000152260 1016247737 /nfs/dbraw/zinc/24/77/37/1016247737.db2.gz CFOTWPUWNYNUAG-IAGOWNOFSA-N 1 1 361.486 2.593 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000732963752 998832781 /nfs/dbraw/zinc/83/27/81/998832781.db2.gz OJAYRZHDOBNKBO-UHFFFAOYSA-N 1 1 371.441 2.945 20 5 FFBDMO C[C@@H]1CCCCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000734001238 999170308 /nfs/dbraw/zinc/17/03/08/999170308.db2.gz NYBCGDBOIHHITA-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO CC[C@@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000738252816 999623384 /nfs/dbraw/zinc/62/33/84/999623384.db2.gz CANVAJFKXRALLR-KUHUBIRLSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741024155 999704169 /nfs/dbraw/zinc/70/41/69/999704169.db2.gz RCXHVFNRGVRNSB-UPJWGTAASA-N 1 1 374.397 2.949 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)C1 ZINC001169030391 1000016088 /nfs/dbraw/zinc/01/60/88/1000016088.db2.gz ZKMNCYJJLSMMCP-DODZYUBVSA-N 1 1 361.442 2.529 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036852 1000016680 /nfs/dbraw/zinc/01/66/80/1000016680.db2.gz QIJDEHQFRWOMBH-GVRJEKJASA-N 1 1 353.463 2.952 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019808 1000017549 /nfs/dbraw/zinc/01/75/49/1000017549.db2.gz JSYGEFBUXICUAU-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019808 1000017551 /nfs/dbraw/zinc/01/75/51/1000017551.db2.gz JSYGEFBUXICUAU-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)s1 ZINC001169020114 1000017681 /nfs/dbraw/zinc/01/76/81/1000017681.db2.gz IHYJSKMSQPNCNN-RLFYNMQTSA-N 1 1 363.483 2.931 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](Oc3cc(C(F)(F)F)ncn3)C2)C1 ZINC001169053585 1000018962 /nfs/dbraw/zinc/01/89/62/1000018962.db2.gz JCZJIHQAQVXYIL-AGIUHOORSA-N 1 1 374.363 2.784 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000767641790 1000131354 /nfs/dbraw/zinc/13/13/54/1000131354.db2.gz OKKNOTOSDNPRPB-UHFFFAOYSA-N 1 1 356.338 2.601 20 5 FFBDMO C[N@@H+]1CCc2c(NC3(CO)Cc4ccccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001171212537 1000204714 /nfs/dbraw/zinc/20/47/14/1000204714.db2.gz ZKJMGVXFZJBBLD-UHFFFAOYSA-N 1 1 353.422 2.525 20 5 FFBDMO C[N@H+]1CCc2c(NC3(CO)Cc4ccccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001171212537 1000204715 /nfs/dbraw/zinc/20/47/15/1000204715.db2.gz ZKJMGVXFZJBBLD-UHFFFAOYSA-N 1 1 353.422 2.525 20 5 FFBDMO COc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1[N+](=O)[O-] ZINC000785862687 1001498338 /nfs/dbraw/zinc/49/83/38/1001498338.db2.gz CMXCOSDJNYZCOX-UHFFFAOYSA-N 1 1 361.358 2.545 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2c3cc(Cl)ccc3ncc2[N+](=O)[O-])n1C ZINC001185272821 1002894306 /nfs/dbraw/zinc/89/43/06/1002894306.db2.gz KCVNQZSTOGZLGT-UHFFFAOYSA-N 1 1 360.805 2.630 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH2+]Cc2nccc(OC(C)C)n2)c([N+](=O)[O-])c1 ZINC001170328670 1003114884 /nfs/dbraw/zinc/11/48/84/1003114884.db2.gz LDZHUSOSMZFLTJ-CYBMUJFWSA-N 1 1 360.414 2.901 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CCNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170329754 1003115810 /nfs/dbraw/zinc/11/58/10/1003115810.db2.gz TWBJSLPLYGXOLT-CYBMUJFWSA-N 1 1 367.446 2.991 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@](CO)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334073 1003117988 /nfs/dbraw/zinc/11/79/88/1003117988.db2.gz AQDHMWNORGSYOC-NHYWBVRUSA-N 1 1 362.348 2.781 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@]3(CCCC(=O)N3)C2)c([N+](=O)[O-])c1 ZINC001170341084 1003130269 /nfs/dbraw/zinc/13/02/69/1003130269.db2.gz NEEDQVBKEIKCFU-KUHUBIRLSA-N 1 1 361.442 2.669 20 5 FFBDMO Cc1nn(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000772829087 1003311156 /nfs/dbraw/zinc/31/11/56/1003311156.db2.gz RESIOOOLWSYLKI-KBXCAEBGSA-N 1 1 370.457 2.554 20 5 FFBDMO Cc1ccc(N2CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)c([N+](=O)[O-])c1 ZINC000747204173 1003764464 /nfs/dbraw/zinc/76/44/64/1003764464.db2.gz RXRKUNTZYPUXFJ-UHFFFAOYSA-N 1 1 369.421 2.997 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](CCCc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001273755525 1004415409 /nfs/dbraw/zinc/41/54/09/1004415409.db2.gz FRWJMNBUOYJFKA-VAMGGRTRSA-N 1 1 373.497 2.843 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](CCCc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273755525 1004415413 /nfs/dbraw/zinc/41/54/13/1004415413.db2.gz FRWJMNBUOYJFKA-VAMGGRTRSA-N 1 1 373.497 2.843 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](CCCc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273755525 1004415419 /nfs/dbraw/zinc/41/54/19/1004415419.db2.gz FRWJMNBUOYJFKA-VAMGGRTRSA-N 1 1 373.497 2.843 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776277930 1005343039 /nfs/dbraw/zinc/34/30/39/1005343039.db2.gz QVOJRGINBPYYFT-ZBFHGGJFSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776277930 1005343041 /nfs/dbraw/zinc/34/30/41/1005343041.db2.gz QVOJRGINBPYYFT-ZBFHGGJFSA-N 1 1 365.430 2.617 20 5 FFBDMO CCc1ccccc1C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001050326286 1016971617 /nfs/dbraw/zinc/97/16/17/1016971617.db2.gz VZITWRRHYISCSY-UTRMSSBJSA-N 1 1 359.470 2.679 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cccc(OC)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579341 1005959853 /nfs/dbraw/zinc/95/98/53/1005959853.db2.gz NLENJAJCVYNAJJ-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cccc(OC)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579341 1005959856 /nfs/dbraw/zinc/95/98/56/1005959856.db2.gz NLENJAJCVYNAJJ-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO CN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000776592652 1006009969 /nfs/dbraw/zinc/00/99/69/1006009969.db2.gz WWXJIJYCXOXDBF-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000776592652 1006009979 /nfs/dbraw/zinc/00/99/79/1006009979.db2.gz WWXJIJYCXOXDBF-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000776592652 1006009988 /nfs/dbraw/zinc/00/99/88/1006009988.db2.gz WWXJIJYCXOXDBF-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1ccc(CCC[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1 ZINC001050517421 1017034725 /nfs/dbraw/zinc/03/47/25/1017034725.db2.gz SXCMCUBUQJDVJO-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000747958771 1006352151 /nfs/dbraw/zinc/35/21/51/1006352151.db2.gz DCUPAQWZJPIDEX-KBPBESRZSA-N 1 1 367.450 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCOC[C@H](C3CCC3)C2)nc1-c1ccccn1 ZINC000853513650 1006421185 /nfs/dbraw/zinc/42/11/85/1006421185.db2.gz GTWGWUAAJFPBEN-OAHLLOKOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCOC[C@H](C3CCC3)C2)nc1-c1ccccn1 ZINC000853513650 1006421192 /nfs/dbraw/zinc/42/11/92/1006421192.db2.gz GTWGWUAAJFPBEN-OAHLLOKOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1F ZINC000882685336 1006471958 /nfs/dbraw/zinc/47/19/58/1006471958.db2.gz LJNNBJQBTIWDDZ-HOTGVXAUSA-N 1 1 357.385 2.689 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000853912650 1006581949 /nfs/dbraw/zinc/58/19/49/1006581949.db2.gz NKVQZVIQNRTXON-HUUCEWRRSA-N 1 1 362.386 2.558 20 5 FFBDMO CC1(c2nnc(C3CCOCC3)o2)C[NH+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000854075301 1006662699 /nfs/dbraw/zinc/66/26/99/1006662699.db2.gz MNZIAPZIQOSKPM-UHFFFAOYSA-N 1 1 372.425 2.688 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)C[C@H]1Cc1ccccc1 ZINC000854395969 1006810467 /nfs/dbraw/zinc/81/04/67/1006810467.db2.gz YGMRASSQWZOXFM-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)C[C@H]1Cc1ccccc1 ZINC000854395969 1006810486 /nfs/dbraw/zinc/81/04/86/1006810486.db2.gz YGMRASSQWZOXFM-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1)[C@]1(O)CCC[N@@H+](Cc2ccccc2)C1 ZINC001135504711 1006982271 /nfs/dbraw/zinc/98/22/71/1006982271.db2.gz QQLKHHDBBSJTOW-IBGZPJMESA-N 1 1 355.394 2.560 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H]2C2CCOCC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000776768839 1007059474 /nfs/dbraw/zinc/05/94/74/1007059474.db2.gz NWOXVJUMCMEHMB-MRXNPFEDSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2C2CCOCC2)nc1-c1ccncc1 ZINC000776769745 1007059847 /nfs/dbraw/zinc/05/98/47/1007059847.db2.gz HREKCMHVWDZTGZ-MRXNPFEDSA-N 1 1 357.414 2.702 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C ZINC000818165189 1007874928 /nfs/dbraw/zinc/87/49/28/1007874928.db2.gz QITKQRYFMXIDFF-CZUORRHYSA-N 1 1 367.446 2.815 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000822507476 1008657626 /nfs/dbraw/zinc/65/76/26/1008657626.db2.gz XEYNOMPRBQWANP-CQSZACIVSA-N 1 1 361.442 2.537 20 5 FFBDMO Cc1noc(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000886647778 1008792440 /nfs/dbraw/zinc/79/24/40/1008792440.db2.gz BTFGXQIUOWGIPA-DLBZAZTESA-N 1 1 356.426 2.845 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1F ZINC000823079718 1008910638 /nfs/dbraw/zinc/91/06/38/1008910638.db2.gz NPDCYSDFLIGARN-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(F)c(Cl)c1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458470 1008995438 /nfs/dbraw/zinc/99/54/38/1008995438.db2.gz IMPLVRPUBXIRAT-CZUORRHYSA-N 1 1 371.840 2.911 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(Cl)c(F)c1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458424 1008995571 /nfs/dbraw/zinc/99/55/71/1008995571.db2.gz GURAEZZPAYEOHR-CZUORRHYSA-N 1 1 371.840 2.911 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cccc(F)c1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178463706 1008996150 /nfs/dbraw/zinc/99/61/50/1008996150.db2.gz IYTLMMVULRVVIZ-UKRRQHHQSA-N 1 1 371.840 2.911 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000823286713 1009007207 /nfs/dbraw/zinc/00/72/07/1009007207.db2.gz QZURCHBZXOBBEV-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780625 1009149188 /nfs/dbraw/zinc/14/91/88/1009149188.db2.gz MLKMWHZAOFGVNA-NNXQTKTDSA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780625 1009149199 /nfs/dbraw/zinc/14/91/99/1009149199.db2.gz MLKMWHZAOFGVNA-NNXQTKTDSA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823962323 1009281087 /nfs/dbraw/zinc/28/10/87/1009281087.db2.gz RLVWQKSMMFTGQX-CXAGYDPISA-N 1 1 369.425 2.819 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])cc2ccccc21)C(C)(C)C[NH+]1CCOCC1 ZINC000862003347 1009656456 /nfs/dbraw/zinc/65/64/56/1009656456.db2.gz AGWMPIZXXBVQQU-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO C[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)[C@H]1CCC(C)(C)C1 ZINC000794683251 1010469745 /nfs/dbraw/zinc/46/97/45/1010469745.db2.gz CQYDBBZIQYTKJW-HNNXBMFYSA-N 1 1 360.414 2.831 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000866204230 1010950601 /nfs/dbraw/zinc/95/06/01/1010950601.db2.gz BGBWGBYTMIMUDX-DOTOQJQBSA-N 1 1 353.426 2.891 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000866226190 1010955204 /nfs/dbraw/zinc/95/52/04/1010955204.db2.gz HCLLTTOKXJVHMZ-KXBFYZLASA-N 1 1 366.481 2.527 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000868318534 1011245978 /nfs/dbraw/zinc/24/59/78/1011245978.db2.gz FPFRNIZCZTYHLH-UHFFFAOYSA-N 1 1 363.389 2.850 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870078839 1012108932 /nfs/dbraw/zinc/10/89/32/1012108932.db2.gz LOYRVBUPCAYEND-KRWDZBQOSA-N 1 1 373.434 2.566 20 5 FFBDMO CC(C)(C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000870090783 1012123248 /nfs/dbraw/zinc/12/32/48/1012123248.db2.gz SGORJEOVPMCLJU-KRWDZBQOSA-N 1 1 369.421 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1C[C@@H]3C[N@H+](CC4CC4)C[C@H](C1)O3)CC2 ZINC001172910823 1012123763 /nfs/dbraw/zinc/12/37/63/1012123763.db2.gz OJDHGOKGHNZUAR-SESVDKBCSA-N 1 1 371.481 2.637 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@]1(C)O ZINC001173009473 1012178640 /nfs/dbraw/zinc/17/86/40/1012178640.db2.gz CTHHQKCZNAUCJM-KZULUSFZSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@]1(C)O ZINC001173009474 1012179466 /nfs/dbraw/zinc/17/94/66/1012179466.db2.gz CTHHQKCZNAUCJM-XIKOKIGWSA-N 1 1 369.412 2.935 20 5 FFBDMO CN(C)[C@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173013813 1012183767 /nfs/dbraw/zinc/18/37/67/1012183767.db2.gz YEZXTQJCAUDHGY-AWEZNQCLSA-N 1 1 368.428 2.868 20 5 FFBDMO CN(C)[C@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173013813 1012183779 /nfs/dbraw/zinc/18/37/79/1012183779.db2.gz YEZXTQJCAUDHGY-AWEZNQCLSA-N 1 1 368.428 2.868 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N3CC[N@H+]4CCC[C@@H]4C3)CC2)c(F)c1 ZINC001173013395 1012184788 /nfs/dbraw/zinc/18/47/88/1012184788.db2.gz RSZTTZUQVRJJBP-CQSZACIVSA-N 1 1 366.412 2.622 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC[NH2+]2)cc1 ZINC000870139248 1012187245 /nfs/dbraw/zinc/18/72/45/1012187245.db2.gz NXUWAVHTAHQWLB-GOSISDBHSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC[NH2+]2)cc1 ZINC000870140864 1012190574 /nfs/dbraw/zinc/19/05/74/1012190574.db2.gz NWUHSRJIOUKGGQ-SFHVURJKSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[N@H+]3CCC[C@@H]3C2)c1F ZINC001173190522 1012332625 /nfs/dbraw/zinc/33/26/25/1012332625.db2.gz UUFJUGKNZLRXQW-UONOGXRCSA-N 1 1 351.422 2.844 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H]3COC[C@H](C2)C3(F)F)c1F ZINC001173196020 1012338860 /nfs/dbraw/zinc/33/88/60/1012338860.db2.gz LACQNJNCLABUOT-SDDRHHMPSA-N 1 1 374.359 2.887 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)Cc2ccccc2)CC1 ZINC001173233381 1012365065 /nfs/dbraw/zinc/36/50/65/1012365065.db2.gz VZXMAPRBYMKWLX-QGZVFWFLSA-N 1 1 367.449 2.913 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)Cc2ccsc2)CC1 ZINC001173237771 1012386879 /nfs/dbraw/zinc/38/68/79/1012386879.db2.gz MIHCFTPPEPUZCC-OAHLLOKOSA-N 1 1 373.478 2.974 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CCC1CCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291069 1017270291 /nfs/dbraw/zinc/27/02/91/1017270291.db2.gz JCBCUJLZSBIGRE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](CCC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291069 1017270305 /nfs/dbraw/zinc/27/03/05/1017270305.db2.gz JCBCUJLZSBIGRE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CCC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291069 1017270319 /nfs/dbraw/zinc/27/03/19/1017270319.db2.gz JCBCUJLZSBIGRE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]21 ZINC000827331025 1017640488 /nfs/dbraw/zinc/64/04/88/1017640488.db2.gz VDEQQFDTMWLZEJ-BBRMVZONSA-N 1 1 372.450 2.885 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c2ccccc2N1 ZINC000801541948 1019099237 /nfs/dbraw/zinc/09/92/37/1019099237.db2.gz WCXSOCXCQBEDCL-AWEZNQCLSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c2ccccc2N1 ZINC000801541948 1019099255 /nfs/dbraw/zinc/09/92/55/1019099255.db2.gz WCXSOCXCQBEDCL-AWEZNQCLSA-N 1 1 370.384 2.767 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)CC[C@H](O)c1ccccc1 ZINC000930353087 1019992380 /nfs/dbraw/zinc/99/23/80/1019992380.db2.gz GUUZMJKYGOZIGJ-UXHICEINSA-N 1 1 358.438 2.944 20 5 FFBDMO CC(C)[C@@H](C)NC(=O)C1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000725785092 1020257444 /nfs/dbraw/zinc/25/74/44/1020257444.db2.gz NGFMMCUPXLVSCZ-CQSZACIVSA-N 1 1 373.457 2.775 20 5 FFBDMO Cc1ccc(CC[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)cc1 ZINC001048525612 1020275967 /nfs/dbraw/zinc/27/59/67/1020275967.db2.gz ZXJMMJSFFVWANB-USYVTKNRSA-N 1 1 371.481 2.562 20 5 FFBDMO Cc1ccc(CC[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525612 1020275974 /nfs/dbraw/zinc/27/59/74/1020275974.db2.gz ZXJMMJSFFVWANB-USYVTKNRSA-N 1 1 371.481 2.562 20 5 FFBDMO Cc1ccc(CC[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525612 1020275981 /nfs/dbraw/zinc/27/59/81/1020275981.db2.gz ZXJMMJSFFVWANB-USYVTKNRSA-N 1 1 371.481 2.562 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(n4ccnc4)CC3)c2)c1 ZINC000777955298 1020318975 /nfs/dbraw/zinc/31/89/75/1020318975.db2.gz KGLLPXWEPLPLDK-UHFFFAOYSA-N 1 1 352.398 2.949 20 5 FFBDMO CCOCCO[C@H]1CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958244 1020331363 /nfs/dbraw/zinc/33/13/63/1020331363.db2.gz NLRIEGTWSQKSKQ-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO CCOCCO[C@H]1CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777958244 1020331373 /nfs/dbraw/zinc/33/13/73/1020331373.db2.gz NLRIEGTWSQKSKQ-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO CC1CCC([N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000726585764 1020488643 /nfs/dbraw/zinc/48/86/43/1020488643.db2.gz NFMHJZFXCYPLFS-UHFFFAOYSA-N 1 1 360.414 2.831 20 5 FFBDMO C[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[NH+]1CCCCC1 ZINC000726607454 1020492816 /nfs/dbraw/zinc/49/28/16/1020492816.db2.gz WJVQXLYYSKEBSF-HNNXBMFYSA-N 1 1 357.458 2.959 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CCc2ccncc2)CC1 ZINC000902988755 1020613488 /nfs/dbraw/zinc/61/34/88/1020613488.db2.gz UKOYCHSFSXEQLT-UHFFFAOYSA-N 1 1 373.388 2.521 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3ccn(C)n3)CC2)cccc1[N+](=O)[O-] ZINC000932143084 1020721838 /nfs/dbraw/zinc/72/18/38/1020721838.db2.gz KXYPIUBSPKJEME-CQSZACIVSA-N 1 1 371.441 2.843 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932142645 1020721883 /nfs/dbraw/zinc/72/18/83/1020721883.db2.gz GZSVSJVSWWGODQ-ZDUSSCGKSA-N 1 1 357.414 2.535 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(N3CCCOC3=O)CC2)ccc1[N+](=O)[O-] ZINC000933616193 1021046357 /nfs/dbraw/zinc/04/63/57/1021046357.db2.gz BPMLCXXKIMQLPZ-UHFFFAOYSA-N 1 1 363.414 2.800 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(C=Cc3ccccc3O2)C1 ZINC000933657092 1021062237 /nfs/dbraw/zinc/06/22/37/1021062237.db2.gz PTHLRPCDBZCHBJ-FQEVSTJZSA-N 1 1 367.405 2.697 20 5 FFBDMO Cc1c(C(=O)OCCOc2cccc([N+](=O)[O-])c2)cnn1-c1cc[nH+]cc1 ZINC001116473156 1021234274 /nfs/dbraw/zinc/23/42/74/1021234274.db2.gz MFEIJKRQHDZPAH-UHFFFAOYSA-N 1 1 368.349 2.720 20 5 FFBDMO CC[NH+]1CCN(CCCCNC(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000752355753 1023127139 /nfs/dbraw/zinc/12/71/39/1023127139.db2.gz RUMAUHZLJYFEHC-WUKNDPDISA-N 1 1 374.485 2.532 20 5 FFBDMO COC1CCC([N@@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000752790691 1023205403 /nfs/dbraw/zinc/20/54/03/1023205403.db2.gz AMUHJSDJQHKXAD-UHFFFAOYSA-N 1 1 362.430 2.684 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)Cc4cccc(F)c4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001120756650 1023453298 /nfs/dbraw/zinc/45/32/98/1023453298.db2.gz UACLMSFNHYAFEM-KDURUIRLSA-N 1 1 361.417 2.611 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000757790929 1023859728 /nfs/dbraw/zinc/85/97/28/1023859728.db2.gz SVCVSRODCJIYGX-NOZJJQNGSA-N 1 1 370.356 2.800 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2CC)C1 ZINC001121791962 1024027981 /nfs/dbraw/zinc/02/79/81/1024027981.db2.gz PAUXPWDGTHNYMC-CYBMUJFWSA-N 1 1 362.434 2.634 20 5 FFBDMO O=C(O[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000837439076 1025807761 /nfs/dbraw/zinc/80/77/61/1025807761.db2.gz YZZFRZKAVDPQBT-QGZVFWFLSA-N 1 1 371.349 2.934 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000837700107 1025971204 /nfs/dbraw/zinc/97/12/04/1025971204.db2.gz RTUCJJKDNLRVHW-CQSZACIVSA-N 1 1 358.398 2.873 20 5 FFBDMO C[C@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1ccnc1 ZINC000246444093 1026143646 /nfs/dbraw/zinc/14/36/46/1026143646.db2.gz DWCHIVFCZPOTDP-WMLDXEAASA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1n1ccnc1 ZINC000246444093 1026143659 /nfs/dbraw/zinc/14/36/59/1026143659.db2.gz DWCHIVFCZPOTDP-WMLDXEAASA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000839646345 1026773827 /nfs/dbraw/zinc/77/38/27/1026773827.db2.gz IGNVDPJUTZBBEK-JXFKEZNVSA-N 1 1 355.438 2.835 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1)C(N)=O ZINC000840106860 1026957426 /nfs/dbraw/zinc/95/74/26/1026957426.db2.gz CKLYEGZFTJQJLI-CYBMUJFWSA-N 1 1 359.430 2.516 20 5 FFBDMO CO[C@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144132 1026983189 /nfs/dbraw/zinc/98/31/89/1026983189.db2.gz YBMMCERSHIOICV-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144132 1026983192 /nfs/dbraw/zinc/98/31/92/1026983192.db2.gz YBMMCERSHIOICV-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[C@@H](C)C1 ZINC001141860918 1027058628 /nfs/dbraw/zinc/05/86/28/1027058628.db2.gz LMBUIVQOXJQCES-ZDUSSCGKSA-N 1 1 356.426 2.887 20 5 FFBDMO C[N@@H+](C1CN(c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)C1)[C@H]1CCOC1 ZINC001158735769 1027118044 /nfs/dbraw/zinc/11/80/44/1027118044.db2.gz FZSPYPLHDHECGQ-LBPRGKRZSA-N 1 1 362.817 2.706 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000247702805 1027220065 /nfs/dbraw/zinc/22/00/65/1027220065.db2.gz YGYMKAHTQQLIGX-UYAOXDASSA-N 1 1 374.437 2.698 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c(OC)n3)C2)c1 ZINC001161188176 1028057806 /nfs/dbraw/zinc/05/78/06/1028057806.db2.gz RXOLHCNYLMZFPR-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)c(C(F)(F)NCC[C@H]2CC[NH2+]CC2(F)F)c1 ZINC001162810208 1028665034 /nfs/dbraw/zinc/66/50/34/1028665034.db2.gz JGFJJKXDWSVONJ-MRVPVSSYSA-N 1 1 370.734 2.917 20 5 FFBDMO CN(C)C1(CNc2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC001156182153 1029078466 /nfs/dbraw/zinc/07/84/66/1029078466.db2.gz PITOANLAJYGRKI-UHFFFAOYSA-N 1 1 362.261 2.735 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CCC[N@@H+](Cc4ccncc4)CC3)c21 ZINC001163829106 1029083854 /nfs/dbraw/zinc/08/38/54/1029083854.db2.gz XUAKHTFRQJQYTA-UHFFFAOYSA-N 1 1 364.409 2.645 20 5 FFBDMO COc1nc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001156314329 1029139551 /nfs/dbraw/zinc/13/95/51/1029139551.db2.gz FWWKPOVBHCCGQM-HRCADAONSA-N 1 1 369.425 2.716 20 5 FFBDMO C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000888092492 1029618400 /nfs/dbraw/zinc/61/84/00/1029618400.db2.gz XFOCXZYYRGKCKJ-SJCJKPOMSA-N 1 1 366.801 2.826 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3cc([N+](=O)[O-])cc4c(Cl)ncnc43)C[C@H]2C1 ZINC001157698122 1029647576 /nfs/dbraw/zinc/64/75/76/1029647576.db2.gz CIILRQUKGZDCML-TXEJJXNPSA-N 1 1 361.833 2.969 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1C[C@H](C)[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001165202300 1029887836 /nfs/dbraw/zinc/88/78/36/1029887836.db2.gz MHVVUUQMGARVTF-GJZGRUSLSA-N 1 1 356.426 2.636 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000842616040 1030829542 /nfs/dbraw/zinc/82/95/42/1030829542.db2.gz DDSLRXSQUCLOKP-INIZCTEOSA-N 1 1 353.382 2.759 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000842616040 1030829559 /nfs/dbraw/zinc/82/95/59/1030829559.db2.gz DDSLRXSQUCLOKP-INIZCTEOSA-N 1 1 353.382 2.759 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842620100 1030832938 /nfs/dbraw/zinc/83/29/38/1030832938.db2.gz YRTATGJDMZCBII-HOTGVXAUSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](c4cccnc4)C3)n2)c1 ZINC000842622479 1030839330 /nfs/dbraw/zinc/83/93/30/1030839330.db2.gz PKYNOOKBRCXUEE-MRXNPFEDSA-N 1 1 350.382 2.695 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000797338982 1031073719 /nfs/dbraw/zinc/07/37/19/1031073719.db2.gz GUAFQNPSOBSALF-INIZCTEOSA-N 1 1 372.425 2.635 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@]1(O)CCc2ccccc21 ZINC000843423113 1031393781 /nfs/dbraw/zinc/39/37/81/1031393781.db2.gz ZVGOGRZSQXVMDI-FQEVSTJZSA-N 1 1 370.405 2.632 20 5 FFBDMO O=c1[nH]c2cccc(C[NH+]3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c2o1 ZINC001205116220 1031536149 /nfs/dbraw/zinc/53/61/49/1031536149.db2.gz YXPCQJDJDYRWJA-UHFFFAOYSA-N 1 1 354.366 2.764 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC001149840501 1031605226 /nfs/dbraw/zinc/60/52/26/1031605226.db2.gz YEHCRRSJKMZUCT-QGZVFWFLSA-N 1 1 368.437 2.949 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](c4ccccn4)C3)n2)cc1 ZINC000799155908 1031671040 /nfs/dbraw/zinc/67/10/40/1031671040.db2.gz PPXPUCCAVAWLCP-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c(C)c1 ZINC001115530589 1031787499 /nfs/dbraw/zinc/78/74/99/1031787499.db2.gz GCOAPVKNQFOKHD-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO Cc1c(C(=O)N2CC[NH+](C(C)(C)C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC001115929274 1032019170 /nfs/dbraw/zinc/01/91/70/1032019170.db2.gz MCOLMPJBXZGVIN-UHFFFAOYSA-N 1 1 364.402 2.676 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCOCC2 ZINC000830603655 1033706608 /nfs/dbraw/zinc/70/66/08/1033706608.db2.gz YYIRKTRZHUTGAH-CYBMUJFWSA-N 1 1 365.405 2.954 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc(Br)c([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001225504675 1034281743 /nfs/dbraw/zinc/28/17/43/1034281743.db2.gz YQXTTXATNGUYNO-MCCGJVOXSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3ccc(Br)c([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001225504675 1034281753 /nfs/dbraw/zinc/28/17/53/1034281753.db2.gz YQXTTXATNGUYNO-MCCGJVOXSA-N 1 1 355.188 2.540 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1 ZINC001226171620 1034559372 /nfs/dbraw/zinc/55/93/72/1034559372.db2.gz DPLJFUHAKADGJU-HIFRSBDPSA-N 1 1 370.409 2.693 20 5 FFBDMO C[N@@H+]1CC[C@@H](CNC(=O)[C@@H](N)Cc2c3ccccc3cc3ccccc32)C1 ZINC001221254787 1034629133 /nfs/dbraw/zinc/62/91/33/1034629133.db2.gz SZLDODUQGFHMDJ-AOMKIAJQSA-N 1 1 361.489 2.931 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)[C@@H](N)Cc2c3ccccc3cc3ccccc32)C1 ZINC001221254787 1034629140 /nfs/dbraw/zinc/62/91/40/1034629140.db2.gz SZLDODUQGFHMDJ-AOMKIAJQSA-N 1 1 361.489 2.931 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc(F)c(Cl)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001227157640 1034953901 /nfs/dbraw/zinc/95/39/01/1034953901.db2.gz NKUNZOCVBQOXTB-ACGQPVHCSA-N 1 1 372.780 2.933 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC001536197710 1069933875 /nfs/dbraw/zinc/93/38/75/1069933875.db2.gz WANAGTZQLUZKKQ-ZDUSSCGKSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC001536197710 1069933881 /nfs/dbraw/zinc/93/38/81/1069933881.db2.gz WANAGTZQLUZKKQ-ZDUSSCGKSA-N 1 1 371.384 2.999 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001227702261 1035684283 /nfs/dbraw/zinc/68/42/83/1035684283.db2.gz TVAUMQJBWDCSOU-MRXNPFEDSA-N 1 1 358.394 2.883 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001227702261 1035684291 /nfs/dbraw/zinc/68/42/91/1035684291.db2.gz TVAUMQJBWDCSOU-MRXNPFEDSA-N 1 1 358.394 2.883 20 5 FFBDMO O=C(COCC1CCCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456910 1035776987 /nfs/dbraw/zinc/77/69/87/1035776987.db2.gz FXBQXPJBLNGMBB-SFHVURJKSA-N 1 1 362.426 2.919 20 5 FFBDMO O=C(COCC1CCCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456910 1035777004 /nfs/dbraw/zinc/77/70/04/1035777004.db2.gz FXBQXPJBLNGMBB-SFHVURJKSA-N 1 1 362.426 2.919 20 5 FFBDMO C[C@H](Oc1ccccn1)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456243 1035777210 /nfs/dbraw/zinc/77/72/10/1035777210.db2.gz AMDRAUJHQZLPAX-YOEHRIQHSA-N 1 1 371.393 2.575 20 5 FFBDMO C[C@H](Oc1ccccn1)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000835456243 1035777224 /nfs/dbraw/zinc/77/72/24/1035777224.db2.gz AMDRAUJHQZLPAX-YOEHRIQHSA-N 1 1 371.393 2.575 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685329 1036253793 /nfs/dbraw/zinc/25/37/93/1036253793.db2.gz GDLIYDQQSTUJQT-PBHICJAKSA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685329 1036253810 /nfs/dbraw/zinc/25/38/10/1036253810.db2.gz GDLIYDQQSTUJQT-PBHICJAKSA-N 1 1 373.409 2.672 20 5 FFBDMO C[C@H](NC(=O)NCC[NH+]1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000836258993 1036366909 /nfs/dbraw/zinc/36/69/09/1036366909.db2.gz CZWGRIRNZVHLIX-AWEZNQCLSA-N 1 1 354.410 2.971 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001536537166 1069999976 /nfs/dbraw/zinc/99/99/76/1069999976.db2.gz DXVGXYKPDGQAGA-UHFFFAOYSA-N 1 1 356.382 2.998 20 5 FFBDMO O=c1[nH]nc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2c1cccc2[N+](=O)[O-] ZINC001229374607 1036637938 /nfs/dbraw/zinc/63/79/38/1036637938.db2.gz PPFOHBMLRWFUOQ-CQSZACIVSA-N 1 1 366.377 2.897 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3c4ccccc4c([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001229424971 1036667656 /nfs/dbraw/zinc/66/76/56/1036667656.db2.gz UNJOTWQCECSWJK-FGDXXIHYSA-N 1 1 371.349 2.839 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3c4ccccc4c([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001229424971 1036667665 /nfs/dbraw/zinc/66/76/65/1036667665.db2.gz UNJOTWQCECSWJK-FGDXXIHYSA-N 1 1 371.349 2.839 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cnc4c(cccc4[N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001231156962 1037485850 /nfs/dbraw/zinc/48/58/50/1037485850.db2.gz VWYCCRZYETVHIY-ZZCKCESHSA-N 1 1 371.393 2.689 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC001208345693 1038236444 /nfs/dbraw/zinc/23/64/44/1038236444.db2.gz YGPXURCCNYRSCE-JSGCOSHPSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(N2CCC([NH2+]Cc3nc(C4CC4)no3)CC2)ccc1[N+](=O)[O-] ZINC001256087514 1038373095 /nfs/dbraw/zinc/37/30/95/1038373095.db2.gz DKESMBJJQIVQMQ-UHFFFAOYSA-N 1 1 373.413 2.622 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc4cccc([N+](=O)[O-])c4[nH]3)o2)C[C@H](C)O1 ZINC001258027124 1039124304 /nfs/dbraw/zinc/12/43/04/1039124304.db2.gz JFQYRZBSCGKJFP-TXEJJXNPSA-N 1 1 371.397 2.778 20 5 FFBDMO Cc1c(Cc2nnc(CC[NH+]3C[C@@H](C)O[C@H](C)C3)o2)cccc1[N+](=O)[O-] ZINC001258070586 1039154008 /nfs/dbraw/zinc/15/40/08/1039154008.db2.gz HJYGGCUKBXJXEK-CHWSQXEVSA-N 1 1 360.414 2.529 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc(C(C)(C)c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258091309 1039163902 /nfs/dbraw/zinc/16/39/02/1039163902.db2.gz LIFHFKMKVIIQIB-OKILXGFUSA-N 1 1 374.441 2.955 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(C(C)(C)c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258091309 1039163909 /nfs/dbraw/zinc/16/39/09/1039163909.db2.gz LIFHFKMKVIIQIB-OKILXGFUSA-N 1 1 374.441 2.955 20 5 FFBDMO Cn1ncc2cc(-c3noc([C@H]([NH3+])Cc4cccc([N+](=O)[O-])c4)n3)ccc21 ZINC001248207213 1040171879 /nfs/dbraw/zinc/17/18/79/1040171879.db2.gz BGTHTCWKPDNWQU-OAHLLOKOSA-N 1 1 364.365 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCC[C@@](O)(CF)CC3)CC2)cc1 ZINC001254473980 1040740804 /nfs/dbraw/zinc/74/08/04/1040740804.db2.gz KKHRWABCWPJHDS-SFHVURJKSA-N 1 1 351.422 2.750 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC(N3CCN(c4cc[nH+]cc4)CC3)CC2)cc1 ZINC001254475688 1040743894 /nfs/dbraw/zinc/74/38/94/1040743894.db2.gz GUFBITNCGKZGJL-UHFFFAOYSA-N 1 1 367.453 2.781 20 5 FFBDMO COC(=O)[C@H]1[C@@H]2CC[C@@H](C2)[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254483022 1040749755 /nfs/dbraw/zinc/74/97/55/1040749755.db2.gz OYZHNCCWXMAVMW-JEBQAFNWSA-N 1 1 359.426 2.590 20 5 FFBDMO COc1cc(C)nc(O[C@@H]2CC[N@H+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254568509 1040804852 /nfs/dbraw/zinc/80/48/52/1040804852.db2.gz GKHPSJPTXJXPQF-GOEBONIOSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1ccnc(N2CC[NH+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC001254571447 1040808475 /nfs/dbraw/zinc/80/84/75/1040808475.db2.gz VTYUWPTXRMQXCZ-HNNXBMFYSA-N 1 1 356.426 2.752 20 5 FFBDMO CN1c2ccccc2[C@@]2(CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1=O ZINC001254594673 1040821705 /nfs/dbraw/zinc/82/17/05/1040821705.db2.gz HADLFLYZPCGMGA-UTKZUKDTSA-N 1 1 363.417 2.682 20 5 FFBDMO Cc1noc([C@@H]2C[C@@H]3CC[N@H+]([C@H]4Cc5ccc([N+](=O)[O-])cc5C4)C[C@H]3O2)n1 ZINC001254593346 1040823191 /nfs/dbraw/zinc/82/31/91/1040823191.db2.gz LFLMSARBWCJEAI-XDKFSHSGSA-N 1 1 370.409 2.606 20 5 FFBDMO CC[C@@H]1[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCC[C@]12CCC(=O)N2C ZINC001254596875 1040826842 /nfs/dbraw/zinc/82/68/42/1040826842.db2.gz SIVPAEZXBGFSHX-BJLQDIEVSA-N 1 1 357.454 2.927 20 5 FFBDMO O=C([C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)N1CCCCC1 ZINC001254601383 1040831466 /nfs/dbraw/zinc/83/14/66/1040831466.db2.gz ZATBEAMGWYOION-LPHOPBHVSA-N 1 1 357.454 2.787 20 5 FFBDMO Cc1cnc(O[C@@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605329 1040834412 /nfs/dbraw/zinc/83/44/12/1040834412.db2.gz BERONEIKSAGBBT-ZWKOTPCHSA-N 1 1 354.410 2.704 20 5 FFBDMO C[NH+](C)Cc1ccc2nc(-c3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])[nH]c2c1 ZINC001250693539 1041306602 /nfs/dbraw/zinc/30/66/02/1041306602.db2.gz LVNPJFLCMLUSMF-UHFFFAOYSA-N 1 1 374.422 2.603 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC001262826550 1041880888 /nfs/dbraw/zinc/88/08/88/1041880888.db2.gz MCTONCAHEVUKKL-ZWKOPEQDSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1cccc(NCCNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)[nH+]1 ZINC001311046475 1043788814 /nfs/dbraw/zinc/78/88/14/1043788814.db2.gz UZHVOIVECNLMNW-UHFFFAOYSA-N 1 1 364.793 2.767 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC001318786155 1044877507 /nfs/dbraw/zinc/87/75/07/1044877507.db2.gz ZLQQKPFIQURQHX-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC001318786155 1044877529 /nfs/dbraw/zinc/87/75/29/1044877529.db2.gz ZLQQKPFIQURQHX-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890845 1044925659 /nfs/dbraw/zinc/92/56/59/1044925659.db2.gz RVWYOFUEBNJFLN-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890845 1044925675 /nfs/dbraw/zinc/92/56/75/1044925675.db2.gz RVWYOFUEBNJFLN-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)cc1Cl ZINC001317540218 1045106864 /nfs/dbraw/zinc/10/68/64/1045106864.db2.gz GYJDHYUDOMQHKB-GDBMZVCRSA-N 1 1 353.850 2.642 20 5 FFBDMO Cc1cc(N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001319503946 1045175675 /nfs/dbraw/zinc/17/56/75/1045175675.db2.gz BAMCOCMZSBXSQV-SJKOYZFVSA-N 1 1 353.426 2.677 20 5 FFBDMO CO[C@@H]1C[N@@H+](Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1O ZINC001324439512 1046032082 /nfs/dbraw/zinc/03/20/82/1046032082.db2.gz WTFIWBNDRVPCNO-GDBMZVCRSA-N 1 1 352.774 2.700 20 5 FFBDMO CC[N@H+](CCO)CCNCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001325614162 1046578932 /nfs/dbraw/zinc/57/89/32/1046578932.db2.gz DMAQSKVKTVROCJ-UHFFFAOYSA-N 1 1 367.833 2.912 20 5 FFBDMO CC[N@@H+](CCO)CCNCc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001325614162 1046578943 /nfs/dbraw/zinc/57/89/43/1046578943.db2.gz DMAQSKVKTVROCJ-UHFFFAOYSA-N 1 1 367.833 2.912 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001326417180 1046924012 /nfs/dbraw/zinc/92/40/12/1046924012.db2.gz ICLPLOATENURSQ-MRXNPFEDSA-N 1 1 364.398 2.689 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001326417180 1046924022 /nfs/dbraw/zinc/92/40/22/1046924022.db2.gz ICLPLOATENURSQ-MRXNPFEDSA-N 1 1 364.398 2.689 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC001333423809 1048897397 /nfs/dbraw/zinc/89/73/97/1048897397.db2.gz HFXIWBQOBKXUNN-IRXDYDNUSA-N 1 1 366.421 2.735 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC001333423809 1048897410 /nfs/dbraw/zinc/89/74/10/1048897410.db2.gz HFXIWBQOBKXUNN-IRXDYDNUSA-N 1 1 366.421 2.735 20 5 FFBDMO COC(=O)/C=C/c1ccc(N[C@@H]2CCC[N@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153577 1049434761 /nfs/dbraw/zinc/43/47/61/1049434761.db2.gz ZREYMPCLEBOTQN-HZRUHFOJSA-N 1 1 351.378 2.627 20 5 FFBDMO COC(=O)/C=C/c1ccc(N[C@@H]2CCC[N@@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153577 1049434764 /nfs/dbraw/zinc/43/47/64/1049434764.db2.gz ZREYMPCLEBOTQN-HZRUHFOJSA-N 1 1 351.378 2.627 20 5 FFBDMO Cc1ccc(NCCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)[nH+]c1 ZINC001303956782 1051480801 /nfs/dbraw/zinc/48/08/01/1051480801.db2.gz RHCCELXAZDLOIM-UHFFFAOYSA-N 1 1 360.389 2.943 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC001343003615 1051619784 /nfs/dbraw/zinc/61/97/84/1051619784.db2.gz XPZIXRHBRPDCEL-ZWKOTPCHSA-N 1 1 360.458 2.796 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1 ZINC001306660135 1052160697 /nfs/dbraw/zinc/16/06/97/1052160697.db2.gz LVMSGAKBRJKMJP-MRXNPFEDSA-N 1 1 371.441 2.546 20 5 FFBDMO CCC[N@H+]1CC[C@H](Cn2c(-c3cccc([N+](=O)[O-])c3)nnc2N(C)OC)C1 ZINC001307035997 1052243368 /nfs/dbraw/zinc/24/33/68/1052243368.db2.gz WDMQNXSFRZJTAO-AWEZNQCLSA-N 1 1 374.445 2.583 20 5 FFBDMO CC1(C)CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1 ZINC001308113294 1052410472 /nfs/dbraw/zinc/41/04/72/1052410472.db2.gz MIFOILXVHXNLHG-ZWKOTPCHSA-N 1 1 358.442 2.668 20 5 FFBDMO CCc1ccc2c(c1)C[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC001308173659 1052425979 /nfs/dbraw/zinc/42/59/79/1052425979.db2.gz DCNVKZBIEXOXRV-SFHVURJKSA-N 1 1 356.422 2.955 20 5 FFBDMO CC(C)(C)NC(=O)CC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001308253000 1052437501 /nfs/dbraw/zinc/43/75/01/1052437501.db2.gz YZXDJHZDJIOLNN-UHFFFAOYSA-N 1 1 358.236 2.752 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283582 1052441761 /nfs/dbraw/zinc/44/17/61/1052441761.db2.gz ZIFKFDVGXSQFAR-UYAOXDASSA-N 1 1 355.438 2.567 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283582 1052441764 /nfs/dbraw/zinc/44/17/64/1052441764.db2.gz ZIFKFDVGXSQFAR-UYAOXDASSA-N 1 1 355.438 2.567 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CN(C)CCN1C ZINC001308949278 1052524645 /nfs/dbraw/zinc/52/46/45/1052524645.db2.gz XPOVVTKPVNKLNI-YGRLFVJLSA-N 1 1 361.273 2.626 20 5 FFBDMO COc1ccc(NC(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c([N+](=O)[O-])c1 ZINC001346521754 1053067671 /nfs/dbraw/zinc/06/76/71/1053067671.db2.gz IVQBKJWCNUKSKQ-KDURUIRLSA-N 1 1 374.441 2.943 20 5 FFBDMO O=C(OCCCOc1ccc([N+](=O)[O-])cc1)c1ccn(-c2cc[nH+]cc2)n1 ZINC001335585506 1053449906 /nfs/dbraw/zinc/44/99/06/1053449906.db2.gz RGXVDLWXCVPCTI-UHFFFAOYSA-N 1 1 368.349 2.801 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001543415177 1071470037 /nfs/dbraw/zinc/47/00/37/1071470037.db2.gz YCTIYLOUBFTZMJ-MSOLQXFVSA-N 1 1 353.422 2.899 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@@H]2C1 ZINC001337835851 1055047783 /nfs/dbraw/zinc/04/77/83/1055047783.db2.gz XZJJFULYVSVQCC-MRCXROJRSA-N 1 1 357.332 2.684 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@H]2C1 ZINC001337835852 1055047824 /nfs/dbraw/zinc/04/78/24/1055047824.db2.gz XZJJFULYVSVQCC-WFBYXXMGSA-N 1 1 357.332 2.684 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000847254989 1055322832 /nfs/dbraw/zinc/32/28/32/1055322832.db2.gz IGNYBJMAUCTYED-CABCVRRESA-N 1 1 364.421 2.547 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+]2C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001352495449 1055526127 /nfs/dbraw/zinc/52/61/27/1055526127.db2.gz SBSPRFLVYWPMKQ-MRXNPFEDSA-N 1 1 358.446 2.652 20 5 FFBDMO CCn1c([C@H]2CCC[N@H+]2C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001352495449 1055526136 /nfs/dbraw/zinc/52/61/36/1055526136.db2.gz SBSPRFLVYWPMKQ-MRXNPFEDSA-N 1 1 358.446 2.652 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001350142185 1055646462 /nfs/dbraw/zinc/64/64/62/1055646462.db2.gz AWRPPAUFAGKGFE-UHFFFAOYSA-N 1 1 370.409 2.783 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)C1 ZINC001350473202 1055792574 /nfs/dbraw/zinc/79/25/74/1055792574.db2.gz AOKWWRNMDRMJCE-JTQLQIEISA-N 1 1 358.789 2.919 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)C1 ZINC001338796855 1055824678 /nfs/dbraw/zinc/82/46/78/1055824678.db2.gz GRAOZTROUBEMOY-OAHLLOKOSA-N 1 1 372.473 2.867 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3csc([N+](=O)[O-])c3)n2C)[C@@H](C)C1 ZINC001339521490 1056545235 /nfs/dbraw/zinc/54/52/35/1056545235.db2.gz LTBFBADJWVICDT-AAEUAGOBSA-N 1 1 364.475 2.618 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC001474155094 1056576097 /nfs/dbraw/zinc/57/60/97/1056576097.db2.gz CZLSHUGIGNOKKF-LJQANCHMSA-N 1 1 369.465 2.720 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC001474155094 1056576106 /nfs/dbraw/zinc/57/61/06/1056576106.db2.gz CZLSHUGIGNOKKF-LJQANCHMSA-N 1 1 369.465 2.720 20 5 FFBDMO C[N@@H+]1C[C@H](O)C[C@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874964 1058253449 /nfs/dbraw/zinc/25/34/49/1058253449.db2.gz QMLXMYFLTHJZLS-DNVCBOLYSA-N 1 1 371.393 2.781 20 5 FFBDMO C[N@H+]1C[C@H](O)C[C@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874964 1058253466 /nfs/dbraw/zinc/25/34/66/1058253466.db2.gz QMLXMYFLTHJZLS-DNVCBOLYSA-N 1 1 371.393 2.781 20 5 FFBDMO C[C@H](NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1 ZINC001447566242 1058670687 /nfs/dbraw/zinc/67/06/87/1058670687.db2.gz YGSQUJVTYLQHKN-LBPRGKRZSA-N 1 1 354.410 2.710 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001545661656 1071829248 /nfs/dbraw/zinc/82/92/48/1071829248.db2.gz DOYKZDRDBQHZMX-ZDUSSCGKSA-N 1 1 362.434 2.581 20 5 FFBDMO Cc1cc(C)cc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001506501613 1059522757 /nfs/dbraw/zinc/52/27/57/1059522757.db2.gz CJGVWWJBCJMCHW-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)n1 ZINC000848474444 1060090351 /nfs/dbraw/zinc/09/03/51/1060090351.db2.gz CQYYACUNASMFAG-AWEZNQCLSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)n1 ZINC000848474444 1060090364 /nfs/dbraw/zinc/09/03/64/1060090364.db2.gz CQYYACUNASMFAG-AWEZNQCLSA-N 1 1 368.397 2.987 20 5 FFBDMO CCCC(=O)NC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848474857 1060091862 /nfs/dbraw/zinc/09/18/62/1060091862.db2.gz KBDSHFSSDGMSSV-UHFFFAOYSA-N 1 1 371.441 2.797 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)n1 ZINC000848474452 1060094727 /nfs/dbraw/zinc/09/47/27/1060094727.db2.gz CQYYACUNASMFAG-CQSZACIVSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)n1 ZINC000848474452 1060094749 /nfs/dbraw/zinc/09/47/49/1060094749.db2.gz CQYYACUNASMFAG-CQSZACIVSA-N 1 1 368.397 2.987 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848476565 1060098265 /nfs/dbraw/zinc/09/82/65/1060098265.db2.gz AYDGYFSKRMFKIS-GOSISDBHSA-N 1 1 374.485 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483143 1060121290 /nfs/dbraw/zinc/12/12/90/1060121290.db2.gz YUPQNXYUUYPKQJ-MAUKXSAKSA-N 1 1 355.442 2.832 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000848487870 1060139005 /nfs/dbraw/zinc/13/90/05/1060139005.db2.gz ZOZDAFMXQXSFDM-RCCFBDPRSA-N 1 1 359.426 2.512 20 5 FFBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC001520880080 1060165818 /nfs/dbraw/zinc/16/58/18/1060165818.db2.gz VZLJVCMHFXJYID-UHFFFAOYSA-N 1 1 373.461 2.656 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001475502701 1061117183 /nfs/dbraw/zinc/11/71/83/1061117183.db2.gz IMXOAENFMMMAIO-MRXNPFEDSA-N 1 1 367.471 2.589 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001460950446 1061162078 /nfs/dbraw/zinc/16/20/78/1061162078.db2.gz QJOYLRZOCFTFAW-MJGOQNOKSA-N 1 1 372.421 2.798 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC001476916524 1061509307 /nfs/dbraw/zinc/50/93/07/1061509307.db2.gz SPEIYJSYXTUQAA-UHFFFAOYSA-N 1 1 355.826 2.826 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001462123339 1061510426 /nfs/dbraw/zinc/51/04/26/1061510426.db2.gz OFZXLWWROVHHNW-RHSMWYFYSA-N 1 1 368.437 2.796 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001463658006 1062200471 /nfs/dbraw/zinc/20/04/71/1062200471.db2.gz VCOPAEGGULTUTF-INIZCTEOSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC001529851139 1062415265 /nfs/dbraw/zinc/41/52/65/1062415265.db2.gz GUEXYNGKSKMZMY-INIZCTEOSA-N 1 1 354.410 2.693 20 5 FFBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001471042397 1064534203 /nfs/dbraw/zinc/53/42/03/1064534203.db2.gz ZGQHNHAMUPWMJE-TXEJJXNPSA-N 1 1 355.847 2.645 20 5 FFBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001471042397 1064534217 /nfs/dbraw/zinc/53/42/17/1064534217.db2.gz ZGQHNHAMUPWMJE-TXEJJXNPSA-N 1 1 355.847 2.645 20 5 FFBDMO COC(=O)/C=C\c1ccc(NCc2cc(N(C)C)cc[nH+]2)c([N+](=O)[O-])c1 ZINC001472879028 1065165573 /nfs/dbraw/zinc/16/55/73/1065165573.db2.gz WHFCODQDPNASAC-ALCCZGGFSA-N 1 1 356.382 2.854 20 5 FFBDMO CCC[C@@H]1CCC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001473260487 1065231504 /nfs/dbraw/zinc/23/15/04/1065231504.db2.gz XLVWUWCNCLAVFC-QGZVFWFLSA-N 1 1 374.485 2.756 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC001473713753 1065327695 /nfs/dbraw/zinc/32/76/95/1065327695.db2.gz XKXFEJYBPVTRTJ-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C2 ZINC001473762701 1065350003 /nfs/dbraw/zinc/35/00/03/1065350003.db2.gz YEXZMBGKIKKVTA-SJCJKPOMSA-N 1 1 352.362 2.518 20 5 FFBDMO C[C@H]([NH3+])c1nc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 ZINC001576177010 1078202131 /nfs/dbraw/zinc/20/21/31/1078202131.db2.gz IAASBFVBSYHVKS-QMMMGPOBSA-N 1 1 354.819 2.997 20 5 FFBDMO Cc1nc(NC(=O)[C@H]([NH3+])c2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC001579864259 1078701453 /nfs/dbraw/zinc/70/14/53/1078701453.db2.gz OFWZPSPXPXLLNX-CYBMUJFWSA-N 1 1 354.288 2.956 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC001557759607 1075885695 /nfs/dbraw/zinc/88/56/95/1075885695.db2.gz ASWCSHVGHXQJOF-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO CC(C)Oc1nc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001559223647 1076136690 /nfs/dbraw/zinc/13/66/90/1076136690.db2.gz IQVYGKFLQKMTII-MCIONIFRSA-N 1 1 352.435 2.687 20 5 FFBDMO CC(C)Oc1nc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001559223647 1076136693 /nfs/dbraw/zinc/13/66/93/1076136693.db2.gz IQVYGKFLQKMTII-MCIONIFRSA-N 1 1 352.435 2.687 20 5 FFBDMO CCCC[N@H+](Cc1c(C)oc(C)c1C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC001560164176 1076239929 /nfs/dbraw/zinc/23/99/29/1076239929.db2.gz NYJQEPXKMJXDKD-QGZVFWFLSA-N 1 1 364.446 2.973 20 5 FFBDMO COc1cc(CNC[C@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC001561035642 1076323648 /nfs/dbraw/zinc/32/36/48/1076323648.db2.gz DVHRPQVRBPJOHG-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO COc1cc(CNC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC001561035642 1076323652 /nfs/dbraw/zinc/32/36/52/1076323652.db2.gz DVHRPQVRBPJOHG-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001561125503 1076336203 /nfs/dbraw/zinc/33/62/03/1076336203.db2.gz OFODQQJLNSKUAQ-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCC[N@H+]2CCCC(C)(C)C2)c1 ZINC001561514542 1076387492 /nfs/dbraw/zinc/38/74/92/1076387492.db2.gz UKMBLGDCMDVKIV-UHFFFAOYSA-N 1 1 369.487 2.612 20 5 FFBDMO C[C@H](O)C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@H](C)C1 ZINC001563396348 1076550395 /nfs/dbraw/zinc/55/03/95/1076550395.db2.gz UMXGCKZEIZTPPA-KGLIPLIRSA-N 1 1 372.425 2.667 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@H](C)C1 ZINC001563396348 1076550397 /nfs/dbraw/zinc/55/03/97/1076550397.db2.gz UMXGCKZEIZTPPA-KGLIPLIRSA-N 1 1 372.425 2.667 20 5 FFBDMO Cc1c(C)c(C)c(C[N@H+](C)CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(C)c1C ZINC001568480606 1077095657 /nfs/dbraw/zinc/09/56/57/1077095657.db2.gz MVUKMQJPSKKQSZ-IEBWSBKVSA-N 1 1 361.486 2.784 20 5 FFBDMO Cc1c(C)c(C)c(C[N@@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001568480606 1077095663 /nfs/dbraw/zinc/09/56/63/1077095663.db2.gz MVUKMQJPSKKQSZ-IEBWSBKVSA-N 1 1 361.486 2.784 20 5 FFBDMO Cc1c(C)c(C)c(C[N@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001568480606 1077095668 /nfs/dbraw/zinc/09/56/68/1077095668.db2.gz MVUKMQJPSKKQSZ-IEBWSBKVSA-N 1 1 361.486 2.784 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001569400786 1077142098 /nfs/dbraw/zinc/14/20/98/1077142098.db2.gz YNCMZXQNWSLHDZ-SJLPKXTDSA-N 1 1 353.422 2.552 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1 ZINC001569514690 1077150042 /nfs/dbraw/zinc/15/00/42/1077150042.db2.gz QLIFLJOXEURDGL-OAHLLOKOSA-N 1 1 373.384 2.861 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CC/C=C/c2ccccc2)CC1 ZINC001569699887 1077160323 /nfs/dbraw/zinc/16/03/23/1077160323.db2.gz HHWDVODYIBIAAP-OELZETHLSA-N 1 1 371.481 2.973 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1ccc(Cl)cc1F)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570673373 1077220798 /nfs/dbraw/zinc/22/07/98/1077220798.db2.gz AFETZHLXHANRLI-UKRRQHHQSA-N 1 1 371.840 2.719 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC001586485483 1079637995 /nfs/dbraw/zinc/63/79/95/1079637995.db2.gz VJSXACWYRJUOMP-LIRRHRJNSA-N 1 1 368.437 2.939 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055480 1079728367 /nfs/dbraw/zinc/72/83/67/1079728367.db2.gz RQAPGHDYCLIYBK-WMLDXEAASA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055480 1079728370 /nfs/dbraw/zinc/72/83/70/1079728370.db2.gz RQAPGHDYCLIYBK-WMLDXEAASA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@@H](Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978706 1080917648 /nfs/dbraw/zinc/91/76/48/1080917648.db2.gz YMVNGWYYCRFTNL-OLZOCXBDSA-N 1 1 371.445 2.840 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000108625009 206246358 /nfs/dbraw/zinc/24/63/58/206246358.db2.gz ZLZWZHPAGJDRGJ-HNNXBMFYSA-N 1 1 372.400 2.711 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103195072 250139030 /nfs/dbraw/zinc/13/90/30/250139030.db2.gz SWZQBUZBNQJJAQ-NSHDSACASA-N 1 1 355.460 2.785 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000120927960 250643143 /nfs/dbraw/zinc/64/31/43/250643143.db2.gz BEMANMQPGXHJIF-HZMBPMFUSA-N 1 1 370.247 2.770 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000272390001 252025989 /nfs/dbraw/zinc/02/59/89/252025989.db2.gz UEUGYHGFTCBHCK-GFCCVEGCSA-N 1 1 363.443 2.546 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000272417440 252032951 /nfs/dbraw/zinc/03/29/51/252032951.db2.gz GSTKPRZBGBSCDU-ZFWWWQNUSA-N 1 1 371.441 2.521 20 5 FFBDMO COc1cc(CNC[C@@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272525879 252060041 /nfs/dbraw/zinc/06/00/41/252060041.db2.gz YYCZLQYCIOPSSV-LLVKDONJSA-N 1 1 373.400 2.820 20 5 FFBDMO COc1cc(C[NH2+]C[C@@H](C)N(C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272525879 252060044 /nfs/dbraw/zinc/06/00/44/252060044.db2.gz YYCZLQYCIOPSSV-LLVKDONJSA-N 1 1 373.400 2.820 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272584333 252074248 /nfs/dbraw/zinc/07/42/48/252074248.db2.gz YRAWSUXZBQFIFI-ROUUACIJSA-N 1 1 357.458 2.882 20 5 FFBDMO Cc1nc(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000273075143 252209112 /nfs/dbraw/zinc/20/91/12/252209112.db2.gz GIAQYSOPOSMGMN-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3c(N)cccc3[N+](=O)[O-])sc2C1 ZINC000273128050 252225561 /nfs/dbraw/zinc/22/55/61/252225561.db2.gz STDYBEJTSRZAFG-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)c3c(N)cccc3[N+](=O)[O-])sc2C1 ZINC000273128050 252225564 /nfs/dbraw/zinc/22/55/64/252225564.db2.gz STDYBEJTSRZAFG-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)c1 ZINC000273090051 252213450 /nfs/dbraw/zinc/21/34/50/252213450.db2.gz ISLIMYSJCUUSHS-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000273177563 252241721 /nfs/dbraw/zinc/24/17/21/252241721.db2.gz LIEFVDFVCNBUNE-MRXNPFEDSA-N 1 1 372.381 2.682 20 5 FFBDMO O=C(CC[N@H+]1CCOCC12CCCC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000275593974 256027412 /nfs/dbraw/zinc/02/74/12/256027412.db2.gz JWCFBFFJUNGZRK-UHFFFAOYSA-N 1 1 351.378 2.708 20 5 FFBDMO COC(=O)c1cnc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000276690049 256122053 /nfs/dbraw/zinc/12/20/53/256122053.db2.gz HBGCPSHNAVSIPV-STQMWFEESA-N 1 1 362.430 2.841 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000278363602 256304051 /nfs/dbraw/zinc/30/40/51/256304051.db2.gz FPRVBLMGLINZAX-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000278333607 256301032 /nfs/dbraw/zinc/30/10/32/256301032.db2.gz BKCPGRKJVKNQLG-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO CCOc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278113 257028996 /nfs/dbraw/zinc/02/89/96/257028996.db2.gz BQJNSIFOAPUCIZ-OLZOCXBDSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278113 257028997 /nfs/dbraw/zinc/02/89/97/257028997.db2.gz BQJNSIFOAPUCIZ-OLZOCXBDSA-N 1 1 362.348 2.986 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000287075853 257070691 /nfs/dbraw/zinc/07/06/91/257070691.db2.gz NYPDJCSPSWZMES-MRXNPFEDSA-N 1 1 362.474 2.757 20 5 FFBDMO CCC[C@]1(CO)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000288852270 257232392 /nfs/dbraw/zinc/23/23/92/257232392.db2.gz PFZRWRCSSUUHEF-KRWDZBQOSA-N 1 1 353.394 2.547 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H]3C[N@H+]4CCC[C@H]4CO3)no2)c1 ZINC000289969630 257309170 /nfs/dbraw/zinc/30/91/70/257309170.db2.gz ZZAMAFLBWWOUBQ-NHYWBVRUSA-N 1 1 360.370 2.579 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)[C@@H](C)C1 ZINC000290044478 257312747 /nfs/dbraw/zinc/31/27/47/257312747.db2.gz ZYIJXYFLNIGFKA-XJKSGUPXSA-N 1 1 358.446 2.557 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000290842182 257360409 /nfs/dbraw/zinc/36/04/09/257360409.db2.gz CIMGIHHTSQKGSW-CYBMUJFWSA-N 1 1 367.446 2.852 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c2c(c1)COCO2 ZINC000291020391 257374010 /nfs/dbraw/zinc/37/40/10/257374010.db2.gz AFPJQSSTCDTEPW-FQEVSTJZSA-N 1 1 370.405 2.597 20 5 FFBDMO CON(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000291940433 257441422 /nfs/dbraw/zinc/44/14/22/257441422.db2.gz TZXUABZLFQCQJM-UHFFFAOYSA-N 1 1 365.430 2.614 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@H+]1CCc2sccc2C1 ZINC000301126130 258027246 /nfs/dbraw/zinc/02/72/46/258027246.db2.gz VUPUYEAVIXEKEU-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000299641437 258012912 /nfs/dbraw/zinc/01/29/12/258012912.db2.gz NEDGJYLFARRQTI-BFYDXBDKSA-N 1 1 361.442 2.617 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000299727289 258020708 /nfs/dbraw/zinc/02/07/08/258020708.db2.gz VESNAXOUJOREPI-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO CCc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@H](CC)C2)c1[N+](=O)[O-] ZINC000302144428 258091068 /nfs/dbraw/zinc/09/10/68/258091068.db2.gz GXEXDLJHIKUDKD-MRXNPFEDSA-N 1 1 357.458 2.992 20 5 FFBDMO CC1=CC[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC1 ZINC000302172746 258093053 /nfs/dbraw/zinc/09/30/53/258093053.db2.gz VCEWHQOWQFOYJE-UHFFFAOYSA-N 1 1 358.442 2.895 20 5 FFBDMO C[N@@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000302194934 258094113 /nfs/dbraw/zinc/09/41/13/258094113.db2.gz SFSFPXFCVQNBOC-UHFFFAOYSA-N 1 1 361.489 2.736 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[C@H](C)C1 ZINC000302438389 258102127 /nfs/dbraw/zinc/10/21/27/258102127.db2.gz MRQSALZXLUXKPU-CABCVRRESA-N 1 1 356.426 2.548 20 5 FFBDMO Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302476625 258103436 /nfs/dbraw/zinc/10/34/36/258103436.db2.gz FJAJJLSUBWGNLF-CQSZACIVSA-N 1 1 358.442 2.733 20 5 FFBDMO C[C@H](CNc1cc(Br)ccc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000301678289 258062827 /nfs/dbraw/zinc/06/28/27/258062827.db2.gz QWOSABPKEHVHRG-LLVKDONJSA-N 1 1 358.236 2.738 20 5 FFBDMO C[C@H](CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[N@@H+](C)Cc1ccccc1 ZINC000301687246 258063184 /nfs/dbraw/zinc/06/31/84/258063184.db2.gz MDMPJSCWLJRJFR-CYBMUJFWSA-N 1 1 370.409 2.858 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2c(Br)cncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301829517 258069573 /nfs/dbraw/zinc/06/95/73/258069573.db2.gz GVVTZSBSXJFXSI-PHIMTYICSA-N 1 1 373.251 2.664 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000330836933 258171620 /nfs/dbraw/zinc/17/16/20/258171620.db2.gz TWHIDYZCBKOKAP-JQWIXIFHSA-N 1 1 357.863 2.939 20 5 FFBDMO COc1cc(C[NH+]2CCC(C(=O)N(C)C(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000330914582 258173702 /nfs/dbraw/zinc/17/37/02/258173702.db2.gz IZQMIXKHJUKGHE-UHFFFAOYSA-N 1 1 367.421 2.821 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000332343491 258226137 /nfs/dbraw/zinc/22/61/37/258226137.db2.gz SRCLUXCLRCDYFD-KBPBESRZSA-N 1 1 368.231 2.714 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000373055936 512151164 /nfs/dbraw/zinc/15/11/64/512151164.db2.gz GLOPGMLBBDCUQL-ZDUSSCGKSA-N 1 1 355.398 2.597 20 5 FFBDMO Cc1[nH+]ccn1CCCCn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000158207942 508671869 /nfs/dbraw/zinc/67/18/69/508671869.db2.gz CIGOEZGGPCQEAK-UHFFFAOYSA-N 1 1 355.192 2.504 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](C2CCOCC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000371065210 512202149 /nfs/dbraw/zinc/20/21/49/512202149.db2.gz OFRAJXPQSDHLDC-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](C2CCOCC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000371065210 512202155 /nfs/dbraw/zinc/20/21/55/512202155.db2.gz OFRAJXPQSDHLDC-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000375302711 512257813 /nfs/dbraw/zinc/25/78/13/512257813.db2.gz LKZHOGFOEIIPFJ-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000375302711 512257818 /nfs/dbraw/zinc/25/78/18/512257818.db2.gz LKZHOGFOEIIPFJ-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053615331 506415709 /nfs/dbraw/zinc/41/57/09/506415709.db2.gz OQYCSRHYKYMSIX-AWEZNQCLSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053615331 506415717 /nfs/dbraw/zinc/41/57/17/506415717.db2.gz OQYCSRHYKYMSIX-AWEZNQCLSA-N 1 1 360.370 2.562 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000054764422 506618029 /nfs/dbraw/zinc/61/80/29/506618029.db2.gz HGKHNRKLZIYDMB-UHFFFAOYSA-N 1 1 356.426 2.868 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000055416301 506747026 /nfs/dbraw/zinc/74/70/26/506747026.db2.gz PLFSVVVUOKELRB-INIZCTEOSA-N 1 1 363.461 2.755 20 5 FFBDMO C[N@H+](Cc1ccc(F)c(F)c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000044380880 506840503 /nfs/dbraw/zinc/84/05/03/506840503.db2.gz LAIAKCOEGLTNON-CQSZACIVSA-N 1 1 352.337 2.745 20 5 FFBDMO O=[N+]([O-])c1c(NCC[NH+]2CCN(c3ccccc3)CC2)nc2sccn21 ZINC000046017733 507062433 /nfs/dbraw/zinc/06/24/33/507062433.db2.gz JERKPKNEYFHURM-UHFFFAOYSA-N 1 1 372.454 2.538 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2cccs2)CC1 ZINC000019540242 507175953 /nfs/dbraw/zinc/17/59/53/507175953.db2.gz ZPYXPXDWEISRJB-CQSZACIVSA-N 1 1 374.466 2.801 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cn1 ZINC000047385590 507319180 /nfs/dbraw/zinc/31/91/80/507319180.db2.gz WFNUCJOMYHDNAY-UHFFFAOYSA-N 1 1 366.381 2.802 20 5 FFBDMO NC(=O)c1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000024203514 507398376 /nfs/dbraw/zinc/39/83/76/507398376.db2.gz ORFNWEOWZHASJB-UHFFFAOYSA-N 1 1 365.393 2.593 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCCO2 ZINC000026227870 507569959 /nfs/dbraw/zinc/56/99/59/507569959.db2.gz IBACSMNTBCFGFB-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc(F)cc4cccnc43)CC2)cn1 ZINC000026595101 507599370 /nfs/dbraw/zinc/59/93/70/507599370.db2.gz CFURBIJOTZUAJK-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[N@H+]1CCCC[C@H]1C ZINC000049749594 507636368 /nfs/dbraw/zinc/63/63/68/507636368.db2.gz RHYXEHMYWZMXIX-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO C[N@H+](CCOc1ccccc1F)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027699126 507678561 /nfs/dbraw/zinc/67/85/61/507678561.db2.gz AWDKGVWAXKHINK-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO C[N@@H+](CCOc1ccccc1F)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027699126 507678564 /nfs/dbraw/zinc/67/85/64/507678564.db2.gz AWDKGVWAXKHINK-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000027700909 507678750 /nfs/dbraw/zinc/67/87/50/507678750.db2.gz IHALLOJGAWKNBS-KRWDZBQOSA-N 1 1 360.410 2.654 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cccc(OC(F)F)c3)CC2)cn1 ZINC000050959941 507720741 /nfs/dbraw/zinc/72/07/41/507720741.db2.gz TWQGNJRHPTZXHY-UHFFFAOYSA-N 1 1 364.352 2.913 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051049485 507728049 /nfs/dbraw/zinc/72/80/49/507728049.db2.gz PZXFFLJUADVAOK-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCOCC1 ZINC000051500931 507773260 /nfs/dbraw/zinc/77/32/60/507773260.db2.gz UQRLBEJIVGCHSC-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000029444107 507778229 /nfs/dbraw/zinc/77/82/29/507778229.db2.gz YOGXWULIBOOMNN-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO Cc1csc(C(C)(C)[NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)n1 ZINC000072663025 507839646 /nfs/dbraw/zinc/83/96/46/507839646.db2.gz FVXIMYUUDPIQGY-UHFFFAOYSA-N 1 1 360.439 2.774 20 5 FFBDMO Cc1cnn(CCCCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665107 507840088 /nfs/dbraw/zinc/84/00/88/507840088.db2.gz GWRQZEACZPGBLE-MRXNPFEDSA-N 1 1 358.446 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cnn(-c4ccccc4)c3)C2)nc1 ZINC000072665023 507840303 /nfs/dbraw/zinc/84/03/03/507840303.db2.gz KGHAMPHJKWSART-MRXNPFEDSA-N 1 1 364.409 2.862 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072772418 507851788 /nfs/dbraw/zinc/85/17/88/507851788.db2.gz HRQQPIQVNTYACV-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072772418 507851790 /nfs/dbraw/zinc/85/17/90/507851790.db2.gz HRQQPIQVNTYACV-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000072975838 507879051 /nfs/dbraw/zinc/87/90/51/507879051.db2.gz ADGISWDLSLPMGN-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892662 507879762 /nfs/dbraw/zinc/87/97/62/507879762.db2.gz CWSCGZSEHHKMQD-ZDUSSCGKSA-N 1 1 358.398 2.727 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892662 507879763 /nfs/dbraw/zinc/87/97/63/507879763.db2.gz CWSCGZSEHHKMQD-ZDUSSCGKSA-N 1 1 358.398 2.727 20 5 FFBDMO CS(=O)(=O)c1ccc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000078526828 507879965 /nfs/dbraw/zinc/87/99/65/507879965.db2.gz ZCIWJAHQFPULLA-CQSZACIVSA-N 1 1 367.471 2.675 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000078562478 507883695 /nfs/dbraw/zinc/88/36/95/507883695.db2.gz MCIZSJMCNNQZHD-AWEZNQCLSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000108505994 507899670 /nfs/dbraw/zinc/89/96/70/507899670.db2.gz LGGKOUGXMJQRDB-JTQLQIEISA-N 1 1 358.345 2.660 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000108783056 507918010 /nfs/dbraw/zinc/91/80/10/507918010.db2.gz YNWKCFFYWLSCOE-HNNXBMFYSA-N 1 1 372.469 2.799 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000090552449 507927614 /nfs/dbraw/zinc/92/76/14/507927614.db2.gz DCXMQARRDOTEPD-UHFFFAOYSA-N 1 1 371.437 2.564 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000079577095 507977477 /nfs/dbraw/zinc/97/74/77/507977477.db2.gz UTSJBZNBAGUWKP-INIZCTEOSA-N 1 1 362.474 2.659 20 5 FFBDMO COCC[N@@H+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000110560216 508033899 /nfs/dbraw/zinc/03/38/99/508033899.db2.gz PITNWQIEYHYJHW-LLVKDONJSA-N 1 1 358.236 2.514 20 5 FFBDMO COCC[N@H+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000110560216 508033901 /nfs/dbraw/zinc/03/39/01/508033901.db2.gz PITNWQIEYHYJHW-LLVKDONJSA-N 1 1 358.236 2.514 20 5 FFBDMO C[C@@H](c1ccncc1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000091990417 508031375 /nfs/dbraw/zinc/03/13/75/508031375.db2.gz QYAXJHLXWCWFBF-ZDUSSCGKSA-N 1 1 356.382 2.981 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc([C@H](C)[NH+]2CCOCC2)cc1 ZINC000110722482 508043298 /nfs/dbraw/zinc/04/32/98/508043298.db2.gz HTFRDEJIDAKASF-AWEZNQCLSA-N 1 1 370.409 2.944 20 5 FFBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360165 508179120 /nfs/dbraw/zinc/17/91/20/508179120.db2.gz CTYCYBQZKIVHBP-QGZVFWFLSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCN(c2ccccc2F)C1=O ZINC000112360165 508179123 /nfs/dbraw/zinc/17/91/23/508179123.db2.gz CTYCYBQZKIVHBP-QGZVFWFLSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@H+]1CCCC12CCN(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)CC2 ZINC000369382770 512382794 /nfs/dbraw/zinc/38/27/94/512382794.db2.gz FGYDFROMYKBMLX-UHFFFAOYSA-N 1 1 357.414 2.705 20 5 FFBDMO C[N@H+](CC1CC1)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000081631144 508199571 /nfs/dbraw/zinc/19/95/71/508199571.db2.gz XQIJFZQYUGZUNY-MRXNPFEDSA-N 1 1 360.458 2.587 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000081631144 508199575 /nfs/dbraw/zinc/19/95/75/508199575.db2.gz XQIJFZQYUGZUNY-MRXNPFEDSA-N 1 1 360.458 2.587 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000113270675 508256813 /nfs/dbraw/zinc/25/68/13/508256813.db2.gz FRRPTJMWCHDFIZ-RHSMWYFYSA-N 1 1 356.426 2.961 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccco1 ZINC000088479060 508372204 /nfs/dbraw/zinc/37/22/04/508372204.db2.gz OOOLLSIZQDJAJI-MRXNPFEDSA-N 1 1 358.398 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCOCC1CC1 ZINC000088601159 508378168 /nfs/dbraw/zinc/37/81/68/508378168.db2.gz UJUBSTOEHNWVHT-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCOCC1CC1 ZINC000088601159 508378171 /nfs/dbraw/zinc/37/81/71/508378171.db2.gz UJUBSTOEHNWVHT-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156413565 508417550 /nfs/dbraw/zinc/41/75/50/508417550.db2.gz XTBUISOICGAPIQ-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156413565 508417553 /nfs/dbraw/zinc/41/75/53/508417553.db2.gz XTBUISOICGAPIQ-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156442129 508421607 /nfs/dbraw/zinc/42/16/07/508421607.db2.gz CBMLPFOHMIGJCE-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156442129 508421610 /nfs/dbraw/zinc/42/16/10/508421610.db2.gz CBMLPFOHMIGJCE-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000156477457 508426454 /nfs/dbraw/zinc/42/64/54/508426454.db2.gz OQFHSYQTYHQBBW-YOEHRIQHSA-N 1 1 357.414 2.703 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000156691762 508463050 /nfs/dbraw/zinc/46/30/50/508463050.db2.gz RYDUUYQDWWMEAU-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000116280315 508494791 /nfs/dbraw/zinc/49/47/91/508494791.db2.gz HAFSVFRVXGOBBF-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000116280315 508494796 /nfs/dbraw/zinc/49/47/96/508494796.db2.gz HAFSVFRVXGOBBF-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])cn1 ZINC000116575223 508532821 /nfs/dbraw/zinc/53/28/21/508532821.db2.gz WFCAONHIZKHBPW-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC[NH+]1CCOCC1 ZINC000157340525 508554171 /nfs/dbraw/zinc/55/41/71/508554171.db2.gz YJJODJPGXABMLN-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)COc1cccc3[nH]ccc31)C2 ZINC000153268596 508566156 /nfs/dbraw/zinc/56/61/56/508566156.db2.gz TWUGOXNTKRMWSM-OAHLLOKOSA-N 1 1 367.405 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)COc1cccc3[nH]ccc31)C2 ZINC000153268596 508566159 /nfs/dbraw/zinc/56/61/59/508566159.db2.gz TWUGOXNTKRMWSM-OAHLLOKOSA-N 1 1 367.405 2.874 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000122947116 508611691 /nfs/dbraw/zinc/61/16/91/508611691.db2.gz SAQNOUSMISBFCF-JSGCOSHPSA-N 1 1 369.849 2.958 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153634991 508612847 /nfs/dbraw/zinc/61/28/47/508612847.db2.gz QCFHETIVNBSFEC-AWEZNQCLSA-N 1 1 370.400 2.585 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](C)C1 ZINC000135650064 508637123 /nfs/dbraw/zinc/63/71/23/508637123.db2.gz CVIPXINHGGMJOJ-FZKQIMNGSA-N 1 1 358.442 2.807 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])cc1 ZINC000136008004 508664971 /nfs/dbraw/zinc/66/49/71/508664971.db2.gz RKBPKETVTAQYGJ-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1 ZINC000136008004 508664975 /nfs/dbraw/zinc/66/49/75/508664975.db2.gz RKBPKETVTAQYGJ-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1 ZINC000136008004 508664978 /nfs/dbraw/zinc/66/49/78/508664978.db2.gz RKBPKETVTAQYGJ-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO Cc1cccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866857 508688970 /nfs/dbraw/zinc/68/89/70/508688970.db2.gz OSYCCSQBRTYLKY-ZBFHGGJFSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1cccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866857 508688973 /nfs/dbraw/zinc/68/89/73/508688973.db2.gz OSYCCSQBRTYLKY-ZBFHGGJFSA-N 1 1 369.425 2.812 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000118958709 508695730 /nfs/dbraw/zinc/69/57/30/508695730.db2.gz ZSWZCAYWMOWPDA-QAPCUYQASA-N 1 1 368.437 2.915 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000129365925 508718615 /nfs/dbraw/zinc/71/86/15/508718615.db2.gz YTWTYGHLHOKVEF-RHSMWYFYSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000129365925 508718620 /nfs/dbraw/zinc/71/86/20/508718620.db2.gz YTWTYGHLHOKVEF-RHSMWYFYSA-N 1 1 357.414 2.621 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123651316 508720793 /nfs/dbraw/zinc/72/07/93/508720793.db2.gz VSMYRLNAXWWUJV-LSDHHAIUSA-N 1 1 371.441 2.610 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136939590 508726222 /nfs/dbraw/zinc/72/62/22/508726222.db2.gz DXKWFRWNTVWYGX-GOEBONIOSA-N 1 1 356.426 2.704 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000123845492 508746451 /nfs/dbraw/zinc/74/64/51/508746451.db2.gz LLGQIPXSFJKYNY-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137460193 508757273 /nfs/dbraw/zinc/75/72/73/508757273.db2.gz MYFGUFBVIRJSJQ-DOTOQJQBSA-N 1 1 369.421 2.753 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000158887746 508764045 /nfs/dbraw/zinc/76/40/45/508764045.db2.gz BCVHJWXYGYQDIN-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Cc1ccccc1 ZINC000158970351 508775400 /nfs/dbraw/zinc/77/54/00/508775400.db2.gz XOQPMQNADNLTET-UHFFFAOYSA-N 1 1 366.421 2.867 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000158995205 508778938 /nfs/dbraw/zinc/77/89/38/508778938.db2.gz ZTAXNAQGPNYNKP-VQTJNVASSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000158995205 508778942 /nfs/dbraw/zinc/77/89/42/508778942.db2.gz ZTAXNAQGPNYNKP-VQTJNVASSA-N 1 1 354.406 2.802 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000119387229 508785916 /nfs/dbraw/zinc/78/59/16/508785916.db2.gz MHXNIKNIZXSJBL-ZDUSSCGKSA-N 1 1 373.409 2.811 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000154452448 508787681 /nfs/dbraw/zinc/78/76/81/508787681.db2.gz BKNWMKISSLIMFM-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000130076680 508793323 /nfs/dbraw/zinc/79/33/23/508793323.db2.gz MWLWYBBLCVSYMS-UHFFFAOYSA-N 1 1 371.441 2.910 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124204734 508796451 /nfs/dbraw/zinc/79/64/51/508796451.db2.gz MYSXDQZPZHVDGJ-INIZCTEOSA-N 1 1 360.458 2.927 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000124282609 508809588 /nfs/dbraw/zinc/80/95/88/508809588.db2.gz JDYMSZYKMKJCPQ-INIZCTEOSA-N 1 1 362.474 2.881 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000130655986 508827534 /nfs/dbraw/zinc/82/75/34/508827534.db2.gz SXJPLYROPKLIAE-UHFFFAOYSA-N 1 1 359.430 2.841 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000159762872 508886951 /nfs/dbraw/zinc/88/69/51/508886951.db2.gz LKPBFNSDQBWSIU-HNNXBMFYSA-N 1 1 365.455 2.744 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)Nc1ccc2c(c1)OCO2 ZINC000131302749 508912698 /nfs/dbraw/zinc/91/26/98/508912698.db2.gz KVMBMDYGBCWWIA-UHFFFAOYSA-N 1 1 369.377 2.710 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000131749206 508965396 /nfs/dbraw/zinc/96/53/96/508965396.db2.gz MOZQZBJFCLQZNE-OKILXGFUSA-N 1 1 351.422 2.761 20 5 FFBDMO COc1cc(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)ccc1[N+](=O)[O-] ZINC000160328286 508971225 /nfs/dbraw/zinc/97/12/25/508971225.db2.gz CSGCAZKRKMIYRD-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC000120401451 508988658 /nfs/dbraw/zinc/98/86/58/508988658.db2.gz UMRUPNSOOZQKBI-UHFFFAOYSA-N 1 1 374.416 2.708 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000160699887 509021765 /nfs/dbraw/zinc/02/17/65/509021765.db2.gz GIHHPMAPXBKZJJ-LBPRGKRZSA-N 1 1 356.220 2.571 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000120728139 509053575 /nfs/dbraw/zinc/05/35/75/509053575.db2.gz QLJYHESONXMVPU-ZBFHGGJFSA-N 1 1 360.458 2.607 20 5 FFBDMO C[C@@H](NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801351 509085965 /nfs/dbraw/zinc/08/59/65/509085965.db2.gz BQPQZHQVFITUOO-FOIQADDNSA-N 1 1 355.438 2.665 20 5 FFBDMO C[C@@H](NC[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801351 509085967 /nfs/dbraw/zinc/08/59/67/509085967.db2.gz BQPQZHQVFITUOO-FOIQADDNSA-N 1 1 355.438 2.665 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121060001 509119900 /nfs/dbraw/zinc/11/99/00/509119900.db2.gz TVRFTIUBEAJWFY-CYBMUJFWSA-N 1 1 368.231 2.571 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)O1 ZINC000161630611 509137472 /nfs/dbraw/zinc/13/74/72/509137472.db2.gz HKQKXHDVEJEIRD-CHWSQXEVSA-N 1 1 374.441 2.694 20 5 FFBDMO Cc1c(CC(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000126904202 509145104 /nfs/dbraw/zinc/14/51/04/509145104.db2.gz UPRABUJXZWQHGL-UHFFFAOYSA-N 1 1 370.409 2.585 20 5 FFBDMO Cc1cccc(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000172750287 509211024 /nfs/dbraw/zinc/21/10/24/509211024.db2.gz VOACJUVRRFFUNF-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248034361 509220058 /nfs/dbraw/zinc/22/00/58/509220058.db2.gz KWFZLMWZPVVDJY-YLJYHZDGSA-N 1 1 368.437 2.958 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@H]21 ZINC000248144180 509246352 /nfs/dbraw/zinc/24/63/52/509246352.db2.gz ZEDGMNHWNUPXDM-FZKQIMNGSA-N 1 1 356.426 2.561 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161116 509251578 /nfs/dbraw/zinc/25/15/78/509251578.db2.gz SDFZJKDHEZVBTR-GOEBONIOSA-N 1 1 357.414 2.561 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172833089 509261623 /nfs/dbraw/zinc/26/16/23/509261623.db2.gz MLDYEBXHHOBWGB-MRXNPFEDSA-N 1 1 371.441 2.727 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000172833094 509262641 /nfs/dbraw/zinc/26/26/41/509262641.db2.gz MLDYEBXHHOBWGB-INIZCTEOSA-N 1 1 371.441 2.727 20 5 FFBDMO CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000176009539 509270135 /nfs/dbraw/zinc/27/01/35/509270135.db2.gz MBTURBLSCHOODY-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766455 509345166 /nfs/dbraw/zinc/34/51/66/509345166.db2.gz QYARXUCIYQMNAB-HOTGVXAUSA-N 1 1 374.485 2.800 20 5 FFBDMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000192219628 509410814 /nfs/dbraw/zinc/41/08/14/509410814.db2.gz MYRFWIYPXVGUMK-LJQANCHMSA-N 1 1 369.421 2.616 20 5 FFBDMO C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182821102 509442593 /nfs/dbraw/zinc/44/25/93/509442593.db2.gz OIFKCTLTOJQDGH-CABCVRRESA-N 1 1 360.458 2.776 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000248725142 509453188 /nfs/dbraw/zinc/45/31/88/509453188.db2.gz IDEWMDWXSPEMKQ-HOTGVXAUSA-N 1 1 363.458 2.770 20 5 FFBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1c2ccccc2-c2ccccc21 ZINC000176434598 509507882 /nfs/dbraw/zinc/50/78/82/509507882.db2.gz SMVFLHOWCSLRMI-HNNXBMFYSA-N 1 1 364.405 2.854 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186075021 509511955 /nfs/dbraw/zinc/51/19/55/509511955.db2.gz GDURXNYYXWUVHB-ZIAGYGMSSA-N 1 1 367.471 2.526 20 5 FFBDMO Cc1nc2ccccc2nc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173471813 509620646 /nfs/dbraw/zinc/62/06/46/509620646.db2.gz ACSRVJZEBAVITA-AWEZNQCLSA-N 1 1 364.409 2.928 20 5 FFBDMO CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@H]1CCC[N@@H+](C)C1 ZINC000267920513 509671383 /nfs/dbraw/zinc/67/13/83/509671383.db2.gz JMMOXVYRTMKJSL-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000267966242 509692654 /nfs/dbraw/zinc/69/26/54/509692654.db2.gz UUEYRVAEEQWHAW-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000183304704 509706425 /nfs/dbraw/zinc/70/64/25/509706425.db2.gz SCBBUXVKSXVUPM-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000183304704 509706429 /nfs/dbraw/zinc/70/64/29/509706429.db2.gz SCBBUXVKSXVUPM-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO CC[C@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189736457 509725922 /nfs/dbraw/zinc/72/59/22/509725922.db2.gz UGKNPEQTAPDUPE-FQEVSTJZSA-N 1 1 371.437 2.857 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058766 509730069 /nfs/dbraw/zinc/73/00/69/509730069.db2.gz JDTOHROUYBIIBZ-DGCLKSJQSA-N 1 1 374.384 2.983 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000268099097 509755560 /nfs/dbraw/zinc/75/55/60/509755560.db2.gz ASOOFFUYXKDJJT-CYBMUJFWSA-N 1 1 364.402 2.519 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000249803539 509767265 /nfs/dbraw/zinc/76/72/65/509767265.db2.gz ARWDPEUQOYFBJY-HIFRSBDPSA-N 1 1 363.439 2.671 20 5 FFBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000249817380 509768864 /nfs/dbraw/zinc/76/88/64/509768864.db2.gz LNBTWUQUIWXTQT-BFYDXBDKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000249817380 509768868 /nfs/dbraw/zinc/76/88/68/509768868.db2.gz LNBTWUQUIWXTQT-BFYDXBDKSA-N 1 1 363.458 2.677 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000173785017 509776325 /nfs/dbraw/zinc/77/63/25/509776325.db2.gz HBHIEXFGOYSJFH-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000180191131 509800958 /nfs/dbraw/zinc/80/09/58/509800958.db2.gz UROWKNUERUTDRR-AWEZNQCLSA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000180191131 509800967 /nfs/dbraw/zinc/80/09/67/509800967.db2.gz UROWKNUERUTDRR-AWEZNQCLSA-N 1 1 364.320 2.501 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183556301 509859770 /nfs/dbraw/zinc/85/97/70/509859770.db2.gz WWVGTGUZDJZHOS-AWEZNQCLSA-N 1 1 355.398 2.728 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183556301 509859776 /nfs/dbraw/zinc/85/97/76/509859776.db2.gz WWVGTGUZDJZHOS-AWEZNQCLSA-N 1 1 355.398 2.728 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000252735505 509860073 /nfs/dbraw/zinc/86/00/73/509860073.db2.gz MYSUNKDAEPTKJL-ZIAGYGMSSA-N 1 1 356.426 2.993 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)Nc1ccncc1[N+](=O)[O-] ZINC000183566325 509865660 /nfs/dbraw/zinc/86/56/60/509865660.db2.gz XHMVOKLPOYRELK-INIZCTEOSA-N 1 1 369.425 2.676 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])CC2)c1 ZINC000183639671 509898774 /nfs/dbraw/zinc/89/87/74/509898774.db2.gz CTTVLRPIMPAQGX-UHFFFAOYSA-N 1 1 355.398 2.648 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000180477153 509944676 /nfs/dbraw/zinc/94/46/76/509944676.db2.gz AZYULNZXWRYSJH-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193769717 510060017 /nfs/dbraw/zinc/06/00/17/510060017.db2.gz GTUIQSDLUBZDAR-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245658889 510067321 /nfs/dbraw/zinc/06/73/21/510067321.db2.gz PBPFDDWLBMIDCI-ZWKOTPCHSA-N 1 1 354.410 2.839 20 5 FFBDMO CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268682206 510068691 /nfs/dbraw/zinc/06/86/91/510068691.db2.gz GPLYSJFQHQXKNN-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000245671288 510074176 /nfs/dbraw/zinc/07/41/76/510074176.db2.gz SEENJAHVIIGCKP-KBPBESRZSA-N 1 1 358.442 2.855 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000193835681 510093626 /nfs/dbraw/zinc/09/36/26/510093626.db2.gz TWWVDHLHWFSFHS-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000171400647 510134150 /nfs/dbraw/zinc/13/41/50/510134150.db2.gz TUVCRXKQMVGLEB-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@H+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000171400647 510134156 /nfs/dbraw/zinc/13/41/56/510134156.db2.gz TUVCRXKQMVGLEB-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000171400647 510134165 /nfs/dbraw/zinc/13/41/65/510134165.db2.gz TUVCRXKQMVGLEB-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000190510303 510174831 /nfs/dbraw/zinc/17/48/31/510174831.db2.gz HTMLEUGEERVMDV-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258554 510222824 /nfs/dbraw/zinc/22/28/24/510222824.db2.gz JLJCKLSZWJQJQL-CYBMUJFWSA-N 1 1 367.421 2.871 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184258554 510222829 /nfs/dbraw/zinc/22/28/29/510222829.db2.gz JLJCKLSZWJQJQL-CYBMUJFWSA-N 1 1 367.421 2.871 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000174655424 510231858 /nfs/dbraw/zinc/23/18/58/510231858.db2.gz DIHPCTJLJGSODF-CQSZACIVSA-N 1 1 362.411 2.509 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279331 510320934 /nfs/dbraw/zinc/32/09/34/510320934.db2.gz OBEMGRMNQIMBLR-WBMJQRKESA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279331 510320940 /nfs/dbraw/zinc/32/09/40/510320940.db2.gz OBEMGRMNQIMBLR-WBMJQRKESA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000181308577 510350116 /nfs/dbraw/zinc/35/01/16/510350116.db2.gz IMYUBZWJGVBEOU-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO CN(CC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000246338786 510436455 /nfs/dbraw/zinc/43/64/55/510436455.db2.gz LQQNTLQXGWRPDS-RDJZCZTQSA-N 1 1 372.469 2.506 20 5 FFBDMO Cc1cc(N2CC[NH+](C[C@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181523820 510453616 /nfs/dbraw/zinc/45/36/16/510453616.db2.gz ZSEDIUXDGXCYTM-OAHLLOKOSA-N 1 1 356.426 2.610 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cccc1[N+](=O)[O-] ZINC000178182839 510475967 /nfs/dbraw/zinc/47/59/67/510475967.db2.gz LHCJRGXKSFHAGY-CYBMUJFWSA-N 1 1 374.466 2.881 20 5 FFBDMO CCc1nc([C@H](C)[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000184750032 510498609 /nfs/dbraw/zinc/49/86/09/510498609.db2.gz UUAHZZRCHXHGNS-NWDGAFQWSA-N 1 1 351.428 2.704 20 5 FFBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000187946557 510514510 /nfs/dbraw/zinc/51/45/10/510514510.db2.gz RYDXEYOZGMSSGM-BZNIZROVSA-N 1 1 355.822 2.670 20 5 FFBDMO CCN(C)c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1 ZINC000191256726 510573589 /nfs/dbraw/zinc/57/35/89/510573589.db2.gz QXFQOFZBYYRKOC-UHFFFAOYSA-N 1 1 355.442 2.768 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181775828 510586402 /nfs/dbraw/zinc/58/64/02/510586402.db2.gz JSCIYEDBWYWFGM-GFCCVEGCSA-N 1 1 357.357 2.800 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000178526002 510648159 /nfs/dbraw/zinc/64/81/59/510648159.db2.gz DICCWHPYECPDED-CYBMUJFWSA-N 1 1 374.397 2.808 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000178526002 510648169 /nfs/dbraw/zinc/64/81/69/510648169.db2.gz DICCWHPYECPDED-CYBMUJFWSA-N 1 1 374.397 2.808 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2CC[NH+](C/C=C/c3ccccc3)CC2)c1 ZINC000178563405 510665039 /nfs/dbraw/zinc/66/50/39/510665039.db2.gz AFSCNGQZSLGPME-WKOQKXSESA-N 1 1 367.449 2.959 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000178681230 510719461 /nfs/dbraw/zinc/71/94/61/510719461.db2.gz PLMYDWDPZXDDQM-UHFFFAOYSA-N 1 1 370.247 2.834 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+]2CC2CCCCC2)n1 ZINC000191608167 510748455 /nfs/dbraw/zinc/74/84/55/510748455.db2.gz WWLBCPGKGFNPLR-OAHLLOKOSA-N 1 1 363.462 2.586 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182157225 510787374 /nfs/dbraw/zinc/78/73/74/510787374.db2.gz ZDWXUBKTMSNEAW-KRWDZBQOSA-N 1 1 366.893 2.850 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000270389082 510788730 /nfs/dbraw/zinc/78/87/30/510788730.db2.gz AHYSWJDDRBRUDA-CZUORRHYSA-N 1 1 357.414 2.617 20 5 FFBDMO Cc1cnc([C@H]([NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C2CC2)s1 ZINC000185295762 510793565 /nfs/dbraw/zinc/79/35/65/510793565.db2.gz UTDCENWJIOBVBL-QGZVFWFLSA-N 1 1 372.450 2.990 20 5 FFBDMO CC(C)N1CC[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000270430837 510806420 /nfs/dbraw/zinc/80/64/20/510806420.db2.gz BNQVPLWEEDPNOD-UHFFFAOYSA-N 1 1 368.428 2.868 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000247376559 510859022 /nfs/dbraw/zinc/85/90/22/510859022.db2.gz HWBXALBKSWUOEL-CPUCHLNUSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000247376559 510859023 /nfs/dbraw/zinc/85/90/23/510859023.db2.gz HWBXALBKSWUOEL-CPUCHLNUSA-N 1 1 357.414 2.701 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247544718 510865135 /nfs/dbraw/zinc/86/51/35/510865135.db2.gz YHKBHFBNURRJNA-SUMWQHHRSA-N 1 1 360.458 2.971 20 5 FFBDMO CC(C)N1CC[NH+](C2CCN(c3ncc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000270487241 510885223 /nfs/dbraw/zinc/88/52/23/510885223.db2.gz QKYNTGUUQUATRK-UHFFFAOYSA-N 1 1 367.881 2.638 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)C2)C1 ZINC000293926720 510901804 /nfs/dbraw/zinc/90/18/04/510901804.db2.gz IVPBBNLCCKMDSR-IBGZPJMESA-N 1 1 356.426 2.563 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000285483787 510924933 /nfs/dbraw/zinc/92/49/33/510924933.db2.gz CYQHNGFRZUHXTJ-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO Cn1nccc1C1=CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000285604404 510974698 /nfs/dbraw/zinc/97/46/98/510974698.db2.gz MHFWIWRPIRVCAE-UHFFFAOYSA-N 1 1 373.388 2.585 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270857505 511006749 /nfs/dbraw/zinc/00/67/49/511006749.db2.gz YVMYPUZVFGGTOT-ACJLOTCBSA-N 1 1 358.442 2.752 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc2)CC1 ZINC000294377468 511045300 /nfs/dbraw/zinc/04/53/00/511045300.db2.gz HDWYBPUUPOZGNV-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO COC(=O)[C@]1(C)C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000282649831 511060254 /nfs/dbraw/zinc/06/02/54/511060254.db2.gz FVXJMILMBSRTKF-BFUOFWGJSA-N 1 1 372.425 2.626 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000361654161 511075964 /nfs/dbraw/zinc/07/59/64/511075964.db2.gz YRPNHRFSAUARRF-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000279419874 511076530 /nfs/dbraw/zinc/07/65/30/511076530.db2.gz WUMJEVUDCAOCPG-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000294595597 511114751 /nfs/dbraw/zinc/11/47/51/511114751.db2.gz WCBXZERUVGIBIV-LBPRGKRZSA-N 1 1 368.397 2.556 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N1CC(=O)Nc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000271621222 511266741 /nfs/dbraw/zinc/26/67/41/511266741.db2.gz MXLWBQTUZGZITA-OLZOCXBDSA-N 1 1 368.393 2.619 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000298404317 511273316 /nfs/dbraw/zinc/27/33/16/511273316.db2.gz FHPADQFGEVTSIY-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000295078323 511273460 /nfs/dbraw/zinc/27/34/60/511273460.db2.gz WOUBJMBMGKXXRT-NVXWUHKLSA-N 1 1 359.426 2.500 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC23CCOCC3)cn1 ZINC000295176319 511310381 /nfs/dbraw/zinc/31/03/81/511310381.db2.gz QWHXPYOTQBAQTA-LJQANCHMSA-N 1 1 370.453 2.767 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271783236 511322784 /nfs/dbraw/zinc/32/27/84/511322784.db2.gz SOIPAEDCIKAOFF-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000298664901 511367350 /nfs/dbraw/zinc/36/73/50/511367350.db2.gz YFRMRTOVOMMHSS-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+](C2CC2)C1 ZINC000295382124 511384941 /nfs/dbraw/zinc/38/49/41/511384941.db2.gz PPJZSYMHPSSCEL-LLVKDONJSA-N 1 1 369.368 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000280250671 511391912 /nfs/dbraw/zinc/39/19/12/511391912.db2.gz BMGCQFQEQHZNGD-FZKQIMNGSA-N 1 1 365.430 2.821 20 5 FFBDMO CC(C)[N@@H+](CCOCCO)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000283619241 511437956 /nfs/dbraw/zinc/43/79/56/511437956.db2.gz AIXVFNOYBXIIIO-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO CC(=O)c1cc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000283683032 511460291 /nfs/dbraw/zinc/46/02/91/511460291.db2.gz XWJKMVOSEKLNDL-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO COC(=O)c1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)cc(C)c1[N+](=O)[O-] ZINC000365561868 511529447 /nfs/dbraw/zinc/52/94/47/511529447.db2.gz YHBXMFLNRWDHAC-ZDUSSCGKSA-N 1 1 358.398 2.807 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)C)CC1 ZINC000295877813 511542566 /nfs/dbraw/zinc/54/25/66/511542566.db2.gz GSBRSEGFEWICLK-UHFFFAOYSA-N 1 1 358.446 2.794 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC(c3ccccn3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000363447984 511558472 /nfs/dbraw/zinc/55/84/72/511558472.db2.gz XECOZMUUJRLDRO-IBGZPJMESA-N 1 1 366.421 2.975 20 5 FFBDMO C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+](C2CCC2)C1 ZINC000292457374 511604652 /nfs/dbraw/zinc/60/46/52/511604652.db2.gz ZRBQQOZZWYTIMV-LBPRGKRZSA-N 1 1 357.414 2.554 20 5 FFBDMO CCOC(=O)[C@H](C)[C@H](C)[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000273966709 511673222 /nfs/dbraw/zinc/67/32/22/511673222.db2.gz HCXQCTZMZLWEHU-WOPDTQHZSA-N 1 1 362.386 2.883 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000281021874 511691143 /nfs/dbraw/zinc/69/11/43/511691143.db2.gz OLUZARIJFNLIGP-YXJHDRRASA-N 1 1 361.442 2.939 20 5 FFBDMO Cn1c[nH+]cc1CCc1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000350153842 511730932 /nfs/dbraw/zinc/73/09/32/511730932.db2.gz CUJDROSAHOELMT-UHFFFAOYSA-N 1 1 352.354 2.569 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000363778440 511762687 /nfs/dbraw/zinc/76/26/87/511762687.db2.gz MYXAMROOEGVPDG-GDBMZVCRSA-N 1 1 354.410 2.881 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110222 511844273 /nfs/dbraw/zinc/84/42/73/511844273.db2.gz QVNHGZZAQBRWQN-DNVCBOLYSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110222 511844278 /nfs/dbraw/zinc/84/42/78/511844278.db2.gz QVNHGZZAQBRWQN-DNVCBOLYSA-N 1 1 363.458 2.961 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000293282855 511907644 /nfs/dbraw/zinc/90/76/44/511907644.db2.gz VODUOUGUIBMSAZ-LBPRGKRZSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000293282855 511907649 /nfs/dbraw/zinc/90/76/49/511907649.db2.gz VODUOUGUIBMSAZ-LBPRGKRZSA-N 1 1 360.357 2.594 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](C[C@@H]4CCCCO4)CC3)nc2c1 ZINC000274824554 511955071 /nfs/dbraw/zinc/95/50/71/511955071.db2.gz KQJHGHPFOOBCLE-HNNXBMFYSA-N 1 1 359.430 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3C[N@H+](Cc4ccccc4)CCO3)n2)o1 ZINC000351153379 511968526 /nfs/dbraw/zinc/96/85/26/511968526.db2.gz YEYJBNGAQYFFDS-CQSZACIVSA-N 1 1 356.338 2.811 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3C[N@@H+](Cc4ccccc4)CCO3)n2)o1 ZINC000351153379 511968527 /nfs/dbraw/zinc/96/85/27/511968527.db2.gz YEYJBNGAQYFFDS-CQSZACIVSA-N 1 1 356.338 2.811 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2nnc3n2CCCC3)CC1 ZINC000274984496 512006394 /nfs/dbraw/zinc/00/63/94/512006394.db2.gz MWNSKYUODWDIGK-UHFFFAOYSA-N 1 1 371.441 2.911 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000275156924 512059125 /nfs/dbraw/zinc/05/91/25/512059125.db2.gz WJEVSIWTMMXQBD-MASHWEEQSA-N 1 1 357.332 2.608 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COCc1cccs1 ZINC000285328498 512077966 /nfs/dbraw/zinc/07/79/66/512077966.db2.gz NQKJJXFEFJVARE-OAHLLOKOSA-N 1 1 350.440 2.708 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285335543 512079980 /nfs/dbraw/zinc/07/99/80/512079980.db2.gz OGLRFXCSRIMRLB-AWEZNQCLSA-N 1 1 359.430 2.874 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285335543 512079982 /nfs/dbraw/zinc/07/99/82/512079982.db2.gz OGLRFXCSRIMRLB-AWEZNQCLSA-N 1 1 359.430 2.874 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000293827383 512093441 /nfs/dbraw/zinc/09/34/41/512093441.db2.gz BRCAFEDEHGPGDP-LJQANCHMSA-N 1 1 360.458 2.731 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000411057057 512453378 /nfs/dbraw/zinc/45/33/78/512453378.db2.gz JKTBNSZKYCACHF-LBPRGKRZSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000411057057 512453381 /nfs/dbraw/zinc/45/33/81/512453381.db2.gz JKTBNSZKYCACHF-LBPRGKRZSA-N 1 1 370.247 2.914 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000375694824 512459724 /nfs/dbraw/zinc/45/97/24/512459724.db2.gz ZLLCTFVVUBEZRP-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000373735141 512478848 /nfs/dbraw/zinc/47/88/48/512478848.db2.gz XVMHHLAGSQMQEN-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(n3cccn3)CC2)cccc1[N+](=O)[O-] ZINC000371584822 512479484 /nfs/dbraw/zinc/47/94/84/512479484.db2.gz IVMHWWLXKPTKLC-CQSZACIVSA-N 1 1 357.414 2.764 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000373769025 512495926 /nfs/dbraw/zinc/49/59/26/512495926.db2.gz GHJZZRYPYUCVAY-MRXNPFEDSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000373769025 512495929 /nfs/dbraw/zinc/49/59/29/512495929.db2.gz GHJZZRYPYUCVAY-MRXNPFEDSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000369669796 512546110 /nfs/dbraw/zinc/54/61/10/512546110.db2.gz FIJKZGZZMLWWCF-UHFFFAOYSA-N 1 1 361.358 2.545 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)CC1 ZINC000369704751 512563996 /nfs/dbraw/zinc/56/39/96/512563996.db2.gz RFDWSWNLMFAPOJ-UHFFFAOYSA-N 1 1 361.442 2.769 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1F ZINC000411414186 512624979 /nfs/dbraw/zinc/62/49/79/512624979.db2.gz HSHJKCAJGNISAY-STQMWFEESA-N 1 1 367.421 2.664 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000374169575 512690511 /nfs/dbraw/zinc/69/05/11/512690511.db2.gz DEMGKYZKKXCPBN-OTWHNJEPSA-N 1 1 370.405 2.517 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368003848 512758778 /nfs/dbraw/zinc/75/87/78/512758778.db2.gz BHTFFYYFQOWVPL-OAHLLOKOSA-N 1 1 365.393 2.830 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368003848 512758783 /nfs/dbraw/zinc/75/87/83/512758783.db2.gz BHTFFYYFQOWVPL-OAHLLOKOSA-N 1 1 365.393 2.830 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000411818103 512829224 /nfs/dbraw/zinc/82/92/24/512829224.db2.gz KHZXDLQYAPNIRX-CQSZACIVSA-N 1 1 365.430 2.823 20 5 FFBDMO COc1ncc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)n1 ZINC000368531368 512989177 /nfs/dbraw/zinc/98/91/77/512989177.db2.gz UZHWXJJYBWXKNH-UHFFFAOYSA-N 1 1 358.398 2.745 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC3(CCC[N@@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000374975937 513094902 /nfs/dbraw/zinc/09/49/02/513094902.db2.gz DOARJXHHCADJPS-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412697710 513230067 /nfs/dbraw/zinc/23/00/67/513230067.db2.gz MNBKHAZHJIFZAZ-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412697710 513230074 /nfs/dbraw/zinc/23/00/74/513230074.db2.gz MNBKHAZHJIFZAZ-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](NC(C)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000421390590 513246608 /nfs/dbraw/zinc/24/66/08/513246608.db2.gz OEDSFENKQBJKCI-CYBMUJFWSA-N 1 1 359.382 2.574 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1N[C@H]1CCC[N@H+](CCCO)C1 ZINC000450621445 513276793 /nfs/dbraw/zinc/27/67/93/513276793.db2.gz WXLNAGVYSYQQNE-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOC[C@H](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000429237047 513311842 /nfs/dbraw/zinc/31/18/42/513311842.db2.gz OBQNHYAMAWBIDV-OAHLLOKOSA-N 1 1 350.415 2.731 20 5 FFBDMO Cc1cccc2nc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])cc(=O)n12 ZINC000429259975 513318851 /nfs/dbraw/zinc/31/88/51/513318851.db2.gz ZIZNUJYVAHQTPJ-UHFFFAOYSA-N 1 1 352.394 2.936 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421701473 513375113 /nfs/dbraw/zinc/37/51/13/513375113.db2.gz HSIFVKMXPGQNCA-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418121609 513381089 /nfs/dbraw/zinc/38/10/89/513381089.db2.gz XGPFNDQHPGTYPX-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418121609 513381096 /nfs/dbraw/zinc/38/10/96/513381096.db2.gz XGPFNDQHPGTYPX-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418121609 513381102 /nfs/dbraw/zinc/38/11/02/513381102.db2.gz XGPFNDQHPGTYPX-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](O)C2)cc1OC ZINC000434705636 513402516 /nfs/dbraw/zinc/40/25/16/513402516.db2.gz HEMYBACJDJOIPN-ZFWWWQNUSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](O)C2)cc1OC ZINC000434705636 513402527 /nfs/dbraw/zinc/40/25/27/513402527.db2.gz HEMYBACJDJOIPN-ZFWWWQNUSA-N 1 1 352.431 2.985 20 5 FFBDMO Cn1c(C(=O)Nc2nc3c(s2)C[N@H+](C(C)(C)C)CC3)ccc1[N+](=O)[O-] ZINC000425083640 513405327 /nfs/dbraw/zinc/40/53/27/513405327.db2.gz PVEDHEFHXIVSRO-UHFFFAOYSA-N 1 1 363.443 2.799 20 5 FFBDMO C[C@H]1Cc2[nH+]cn(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)c2C[C@@H]1C ZINC000451006133 513453041 /nfs/dbraw/zinc/45/30/41/513453041.db2.gz ZXTWUYXRJRMXSY-STQMWFEESA-N 1 1 354.410 2.751 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](c4nnc[nH]4)C3)cs2)c1 ZINC000425361057 513528960 /nfs/dbraw/zinc/52/89/60/513528960.db2.gz XBYVGYJOMWTDCW-GFCCVEGCSA-N 1 1 356.411 2.826 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)cs2)c1 ZINC000425361057 513528965 /nfs/dbraw/zinc/52/89/65/513528965.db2.gz XBYVGYJOMWTDCW-GFCCVEGCSA-N 1 1 356.411 2.826 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294426 513533075 /nfs/dbraw/zinc/53/30/75/513533075.db2.gz HKRZARUVOZMENS-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294426 513533083 /nfs/dbraw/zinc/53/30/83/513533083.db2.gz HKRZARUVOZMENS-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO Cc1cnc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])c1 ZINC000430117262 513558399 /nfs/dbraw/zinc/55/83/99/513558399.db2.gz YTSLAKVDJOVERO-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000447813615 513578193 /nfs/dbraw/zinc/57/81/93/513578193.db2.gz SRJBCVFRMJYBIU-GOSISDBHSA-N 1 1 374.485 2.856 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc2c(c1)NC(=O)CO2 ZINC000430192350 513584057 /nfs/dbraw/zinc/58/40/57/513584057.db2.gz BNCLDJIFKXQREE-LLVKDONJSA-N 1 1 357.366 2.785 20 5 FFBDMO COC(=O)c1cnc([C@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])s1 ZINC000425477089 513588199 /nfs/dbraw/zinc/58/81/99/513588199.db2.gz AXIXMMIZKSAYEA-JTQLQIEISA-N 1 1 351.384 2.568 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430298356 513615859 /nfs/dbraw/zinc/61/58/59/513615859.db2.gz GSHXGFFGRMRXQA-MRXNPFEDSA-N 1 1 369.421 2.959 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000430662864 513715141 /nfs/dbraw/zinc/71/51/41/513715141.db2.gz KSFDTVUAOZOSFK-ZBFHGGJFSA-N 1 1 356.426 2.716 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436070263 513751813 /nfs/dbraw/zinc/75/18/13/513751813.db2.gz VLVQYPKVCIBUJH-LLVKDONJSA-N 1 1 371.387 2.641 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@@H](O)COCC(F)(F)F)C2)cc1 ZINC000451554154 513829391 /nfs/dbraw/zinc/82/93/91/513829391.db2.gz ZKCUFNCSFVKVHZ-UKRRQHHQSA-N 1 1 362.348 2.714 20 5 FFBDMO COc1cc(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000448776251 513892449 /nfs/dbraw/zinc/89/24/49/513892449.db2.gz FJYYAWPFWIKJLF-LBPRGKRZSA-N 1 1 367.421 2.983 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000431493324 513911674 /nfs/dbraw/zinc/91/16/74/513911674.db2.gz AYTZPEXLFDBALX-SKDRFNHKSA-N 1 1 356.220 2.570 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCOc2ccccc21 ZINC000451709423 513928496 /nfs/dbraw/zinc/92/84/96/513928496.db2.gz BYANTPYMQMPNHQ-KRWDZBQOSA-N 1 1 355.394 2.796 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCOc2ccccc21 ZINC000451728912 513942395 /nfs/dbraw/zinc/94/23/95/513942395.db2.gz UJIXHTLVFLGRAX-QGZVFWFLSA-N 1 1 355.394 2.796 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451732269 513945272 /nfs/dbraw/zinc/94/52/72/513945272.db2.gz SKEVCRYGAPJENY-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO CC[NH+]1CCC(N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000448877561 513946513 /nfs/dbraw/zinc/94/65/13/513946513.db2.gz HNXGAMLVQYDFMA-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCN(CC(F)(F)F)CC1 ZINC000452038256 514154423 /nfs/dbraw/zinc/15/44/23/514154423.db2.gz MJVIIISDCZWOJO-UHFFFAOYSA-N 1 1 361.364 2.932 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559717 514180176 /nfs/dbraw/zinc/18/01/76/514180176.db2.gz PLAGVGZQYPHOBL-OXJNMPFZSA-N 1 1 371.437 2.538 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559717 514180178 /nfs/dbraw/zinc/18/01/78/514180178.db2.gz PLAGVGZQYPHOBL-OXJNMPFZSA-N 1 1 371.437 2.538 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000427357026 514192999 /nfs/dbraw/zinc/19/29/99/514192999.db2.gz KQKUPZXHXIIODL-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000427369808 514195232 /nfs/dbraw/zinc/19/52/32/514195232.db2.gz KVOPLQJVLPTLGJ-LSDHHAIUSA-N 1 1 371.441 2.546 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000427369808 514195238 /nfs/dbraw/zinc/19/52/38/514195238.db2.gz KVOPLQJVLPTLGJ-LSDHHAIUSA-N 1 1 371.441 2.546 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000452121721 514205022 /nfs/dbraw/zinc/20/50/22/514205022.db2.gz KUQPZBSSNPROOY-YWPYICTPSA-N 1 1 365.405 2.545 20 5 FFBDMO C[C@@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000417315653 514289956 /nfs/dbraw/zinc/28/99/56/514289956.db2.gz SQQYJHKYNACWGX-JXFKEZNVSA-N 1 1 360.502 2.835 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(N3CCC(c4[nH+]cc5n4CCCC5)CC3)nn21 ZINC000432919041 514322502 /nfs/dbraw/zinc/32/25/02/514322502.db2.gz RLALUCUHRRYGHV-UHFFFAOYSA-N 1 1 367.413 2.554 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](CCO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421023464 514444002 /nfs/dbraw/zinc/44/40/02/514444002.db2.gz WBYZSVVGOLVSEN-LBPRGKRZSA-N 1 1 355.822 2.671 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](CCO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421023464 514444009 /nfs/dbraw/zinc/44/40/09/514444009.db2.gz WBYZSVVGOLVSEN-LBPRGKRZSA-N 1 1 355.822 2.671 20 5 FFBDMO C[NH+](C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1cccc(F)c1 ZINC000439129514 514497976 /nfs/dbraw/zinc/49/79/76/514497976.db2.gz IKBSZMXUVAODAS-INIZCTEOSA-N 1 1 371.372 2.519 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000508342018 514749537 /nfs/dbraw/zinc/74/95/37/514749537.db2.gz JTCSABFOQZVDNW-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489232580 514761406 /nfs/dbraw/zinc/76/14/06/514761406.db2.gz NQOTZCAVTRYCHI-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO COCC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489232580 514761416 /nfs/dbraw/zinc/76/14/16/514761416.db2.gz NQOTZCAVTRYCHI-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000479917883 514775488 /nfs/dbraw/zinc/77/54/88/514775488.db2.gz YWTGMEAHRZSXON-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO CCc1ccc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000471295449 514830098 /nfs/dbraw/zinc/83/00/98/514830098.db2.gz JZZFZLRQZRMOKT-UHFFFAOYSA-N 1 1 353.422 2.945 20 5 FFBDMO CCc1ccc(C(=O)NCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000471295449 514830108 /nfs/dbraw/zinc/83/01/08/514830108.db2.gz JZZFZLRQZRMOKT-UHFFFAOYSA-N 1 1 353.422 2.945 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnnn1CC1CC1 ZINC000471597767 514947740 /nfs/dbraw/zinc/94/77/40/514947740.db2.gz HCPYTWSRCAVIJY-CYBMUJFWSA-N 1 1 362.459 2.652 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000498569552 514976220 /nfs/dbraw/zinc/97/62/20/514976220.db2.gz APAHKWGQNLHEOD-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H](C)[N@H+]1CCO ZINC000456216069 515030819 /nfs/dbraw/zinc/03/08/19/515030819.db2.gz UZIROPCZOUXNFP-IYBDPMFKSA-N 1 1 363.461 2.915 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H](C)[N@@H+]1CCO ZINC000456216069 515030822 /nfs/dbraw/zinc/03/08/22/515030822.db2.gz UZIROPCZOUXNFP-IYBDPMFKSA-N 1 1 363.461 2.915 20 5 FFBDMO COc1cc(C[NH+]2CCC(NC(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000485552469 515087045 /nfs/dbraw/zinc/08/70/45/515087045.db2.gz QQXNSPXWZYPGSI-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO CCS[C@H]1CCCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000480866808 515118446 /nfs/dbraw/zinc/11/84/46/515118446.db2.gz RKUVMKCTISTZMH-WBVHZDCISA-N 1 1 354.472 2.942 20 5 FFBDMO CC(=O)N1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000498921388 515121751 /nfs/dbraw/zinc/12/17/51/515121751.db2.gz CLEKCDKOKQCZCK-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C[C@H]1C ZINC000480985833 515162026 /nfs/dbraw/zinc/16/20/26/515162026.db2.gz WEWGXMOYPHHDIX-HIFRSBDPSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000509638081 515267916 /nfs/dbraw/zinc/26/79/16/515267916.db2.gz BGKJWXXFFZREBG-UTUOFQBUSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C ZINC000509638081 515267923 /nfs/dbraw/zinc/26/79/23/515267923.db2.gz BGKJWXXFFZREBG-UTUOFQBUSA-N 1 1 355.822 2.567 20 5 FFBDMO CNc1c(C(=O)N2CC[NH+](CCc3cccs3)CC2)cccc1[N+](=O)[O-] ZINC000462928176 515302476 /nfs/dbraw/zinc/30/24/76/515302476.db2.gz UWUYZTPTEPJRPV-UHFFFAOYSA-N 1 1 374.466 2.699 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCN([C@H]4CC[NH2+]C4)CC3)s2)cc1 ZINC000491250232 515400695 /nfs/dbraw/zinc/40/06/95/515400695.db2.gz QGMGNQNDRSRVQD-KRWDZBQOSA-N 1 1 372.494 2.803 20 5 FFBDMO CCOc1cc(N2CC[NH+](CCc3c(C)noc3C)CC2)ccc1[N+](=O)[O-] ZINC000481757759 515456250 /nfs/dbraw/zinc/45/62/50/515456250.db2.gz RKIWSMKEGXPTGM-UHFFFAOYSA-N 1 1 374.441 2.963 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])[NH+](C)C ZINC000505176096 515467055 /nfs/dbraw/zinc/46/70/55/515467055.db2.gz GLIGWGOIHCLVHH-INIZCTEOSA-N 1 1 357.410 2.945 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000468740935 515498526 /nfs/dbraw/zinc/49/85/26/515498526.db2.gz VERKGYDSJZPMPG-GZIKRUCJSA-N 1 1 359.470 2.966 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000468740935 515498538 /nfs/dbraw/zinc/49/85/38/515498538.db2.gz VERKGYDSJZPMPG-GZIKRUCJSA-N 1 1 359.470 2.966 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492178022 515510856 /nfs/dbraw/zinc/51/08/56/515510856.db2.gz JFGXHTIJMDDQAM-WOJBJXKFSA-N 1 1 354.454 2.520 20 5 FFBDMO CN1CCN(C)[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492178022 515510871 /nfs/dbraw/zinc/51/08/71/515510871.db2.gz JFGXHTIJMDDQAM-WOJBJXKFSA-N 1 1 354.454 2.520 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000505505045 515562210 /nfs/dbraw/zinc/56/22/10/515562210.db2.gz HQTVMZWIXXVTOT-IBGZPJMESA-N 1 1 353.422 2.873 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457027738 515592161 /nfs/dbraw/zinc/59/21/61/515592161.db2.gz PSPSACIZWULCMK-KRWDZBQOSA-N 1 1 361.348 2.589 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC2(C)C)cc1OC ZINC000457076623 515630221 /nfs/dbraw/zinc/63/02/21/515630221.db2.gz OCCNAJFNCHHXEV-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000457110643 515658037 /nfs/dbraw/zinc/65/80/37/515658037.db2.gz HZDUORODRDHWOM-GFCCVEGCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@@H+](CCNC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C)C(C)C ZINC000486879196 515669258 /nfs/dbraw/zinc/66/92/58/515669258.db2.gz KRLYSWVFMYQUSA-UHFFFAOYSA-N 1 1 366.418 2.542 20 5 FFBDMO Cc1cc(Cl)ccc1CN1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000511075513 515769327 /nfs/dbraw/zinc/76/93/27/515769327.db2.gz ZKZKBTBFSPDURK-UHFFFAOYSA-N 1 1 363.849 2.571 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000482702156 515776006 /nfs/dbraw/zinc/77/60/06/515776006.db2.gz APQNRXADSANDLC-CQSZACIVSA-N 1 1 366.425 2.745 20 5 FFBDMO CN1C(=O)C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccc(F)c(F)c1 ZINC000482734462 515787277 /nfs/dbraw/zinc/78/72/77/515787277.db2.gz PVLITDIARYOVNY-XJKSGUPXSA-N 1 1 367.377 2.996 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@@H](C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000455089452 515951377 /nfs/dbraw/zinc/95/13/77/515951377.db2.gz DQDFZPAOTSMKPS-HNNXBMFYSA-N 1 1 369.425 2.891 20 5 FFBDMO CCSCC[C@@H](C)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000464855145 515989634 /nfs/dbraw/zinc/98/96/34/515989634.db2.gz WWZDMXQGJKOUAQ-LLVKDONJSA-N 1 1 369.443 2.726 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487925648 516035533 /nfs/dbraw/zinc/03/55/33/516035533.db2.gz WVQYQZZDGFOOKU-XHDPSFHLSA-N 1 1 366.849 2.573 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCC[C@H]1C ZINC000488075548 516106327 /nfs/dbraw/zinc/10/63/27/516106327.db2.gz ORWNDZLMNVGGEE-RHSMWYFYSA-N 1 1 361.442 2.621 20 5 FFBDMO CCC1CCC([N@@H+](CCO)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000488198954 516154724 /nfs/dbraw/zinc/15/47/24/516154724.db2.gz JSZKJIAOCQKOBT-LEOMRAHMSA-N 1 1 366.458 2.598 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285499 516156221 /nfs/dbraw/zinc/15/62/21/516156221.db2.gz VDXAAVBWHNIRGJ-IFXJQAMLSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285499 516156231 /nfs/dbraw/zinc/15/62/31/516156231.db2.gz VDXAAVBWHNIRGJ-IFXJQAMLSA-N 1 1 369.421 2.941 20 5 FFBDMO Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000479407749 516184099 /nfs/dbraw/zinc/18/40/99/516184099.db2.gz BSIAXVWWPRKHKW-ZDUSSCGKSA-N 1 1 366.414 2.994 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000483933745 516250748 /nfs/dbraw/zinc/25/07/48/516250748.db2.gz OWERXRIIXFPOFG-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C1 ZINC000507845367 516313127 /nfs/dbraw/zinc/31/31/27/516313127.db2.gz RXPBDZKTMRGKRB-CQSZACIVSA-N 1 1 358.446 2.558 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1C ZINC000497558469 516326452 /nfs/dbraw/zinc/32/64/52/516326452.db2.gz QKUJXNSXZFCGQP-GJZGRUSLSA-N 1 1 369.487 2.753 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCC[N@@H+](C)C1 ZINC000550653997 516369985 /nfs/dbraw/zinc/36/99/85/516369985.db2.gz YNKRFYFOJHPLQA-NSHDSACASA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815827 516371904 /nfs/dbraw/zinc/37/19/04/516371904.db2.gz DWQUWLJUTUHQPE-VXGBXAGGSA-N 1 1 357.357 2.791 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815827 516371910 /nfs/dbraw/zinc/37/19/10/516371910.db2.gz DWQUWLJUTUHQPE-VXGBXAGGSA-N 1 1 357.357 2.791 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000558024814 516555561 /nfs/dbraw/zinc/55/55/61/516555561.db2.gz HGBIIFBWBIBQFB-IJEWVQPXSA-N 1 1 361.442 2.796 20 5 FFBDMO Cn1cnc2cc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc21 ZINC000540481849 516575638 /nfs/dbraw/zinc/57/56/38/516575638.db2.gz NYJVTFHKTGSXOB-CQSZACIVSA-N 1 1 352.398 2.563 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000551388678 516687690 /nfs/dbraw/zinc/68/76/90/516687690.db2.gz LLRITPNCSPHXRM-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000551388678 516687696 /nfs/dbraw/zinc/68/76/96/516687696.db2.gz LLRITPNCSPHXRM-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO CCc1ccc([C@H]([NH2+]CCc2ncn(C)n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380885 516732737 /nfs/dbraw/zinc/73/27/37/516732737.db2.gz GNCSSIRUVHWAIX-GOSISDBHSA-N 1 1 355.398 2.800 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@@H](C)C1 ZINC000561760649 516753969 /nfs/dbraw/zinc/75/39/69/516753969.db2.gz IGDWIAYLRLJGFQ-DCGLDWPTSA-N 1 1 356.426 2.878 20 5 FFBDMO CCOC(=O)CC(C)(C)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000561866911 516807054 /nfs/dbraw/zinc/80/70/54/516807054.db2.gz KMZODQGQGFKZKG-AWEZNQCLSA-N 1 1 364.446 2.846 20 5 FFBDMO Cc1ccc(NCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c([N+](=O)[O-])c1 ZINC000514183071 516892054 /nfs/dbraw/zinc/89/20/54/516892054.db2.gz QZODSISHVRAVAB-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000525024174 516898949 /nfs/dbraw/zinc/89/89/49/516898949.db2.gz PEYWHOFOWPWRPG-OBJOEFQTSA-N 1 1 369.849 2.814 20 5 FFBDMO CN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000514225988 516911459 /nfs/dbraw/zinc/91/14/59/516911459.db2.gz FYDRUIHQMZTTBT-LBPRGKRZSA-N 1 1 355.341 2.505 20 5 FFBDMO CCc1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](CC)CC)cc1 ZINC000562187187 516949458 /nfs/dbraw/zinc/94/94/58/516949458.db2.gz WRFUSKFLHHSWOR-HNNXBMFYSA-N 1 1 359.430 2.693 20 5 FFBDMO Cc1ccc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000552057693 517054636 /nfs/dbraw/zinc/05/46/36/517054636.db2.gz DDOVOKHPUCECOX-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO Cc1cccc(NCCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)[nH+]1 ZINC000545149368 517070264 /nfs/dbraw/zinc/07/02/64/517070264.db2.gz UOQRJNZOECSHSN-UHFFFAOYSA-N 1 1 360.389 2.943 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000514910617 517118330 /nfs/dbraw/zinc/11/83/30/517118330.db2.gz YDEAEKOUHKNZGV-SFHVURJKSA-N 1 1 360.414 2.882 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000514910617 517118342 /nfs/dbraw/zinc/11/83/42/517118342.db2.gz YDEAEKOUHKNZGV-SFHVURJKSA-N 1 1 360.414 2.882 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH+]([C@H](C)CC(C)C)CC1 ZINC000552240711 517158251 /nfs/dbraw/zinc/15/82/51/517158251.db2.gz JESZCEUJVYCFLT-OAHLLOKOSA-N 1 1 369.487 2.644 20 5 FFBDMO COc1ccc(CC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000532991010 517241730 /nfs/dbraw/zinc/24/17/30/517241730.db2.gz CVSQWZHDWXAWST-NVXWUHKLSA-N 1 1 373.453 2.621 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(Cc4ncc[nH]4)CC3)o2)cc1 ZINC000537624014 517266147 /nfs/dbraw/zinc/26/61/47/517266147.db2.gz GDZPYDMYTUSSGT-UHFFFAOYSA-N 1 1 367.409 2.896 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000533048145 517267614 /nfs/dbraw/zinc/26/76/14/517267614.db2.gz JSNRHVVWLGOUAT-CYBMUJFWSA-N 1 1 363.414 2.564 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C)C[NH+]2CCN(c3ccccn3)CC2)n1 ZINC000541932282 517299348 /nfs/dbraw/zinc/29/93/48/517299348.db2.gz OCDPKUMTPIEFEC-INIZCTEOSA-N 1 1 370.457 2.624 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(-c3ccccc3C[NH+]3CCOCC3)no2)nc1 ZINC000545588917 517303212 /nfs/dbraw/zinc/30/32/12/517303212.db2.gz PDRZRHWKZJHQRX-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO C[C@@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000533114545 517303361 /nfs/dbraw/zinc/30/33/61/517303361.db2.gz YBEQVECVFSDZRX-NVXWUHKLSA-N 1 1 370.453 2.964 20 5 FFBDMO COC(=O)CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)C ZINC000533260195 517371861 /nfs/dbraw/zinc/37/18/61/517371861.db2.gz BYNOFABOPRHQAM-UHFFFAOYSA-N 1 1 371.821 2.708 20 5 FFBDMO COCC1(C)CC[NH+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000537995858 517429303 /nfs/dbraw/zinc/42/93/03/517429303.db2.gz SWHIQCAMFDZNMU-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(=O)N(C)C)c1ccccc1 ZINC000552913330 517440923 /nfs/dbraw/zinc/44/09/23/517440923.db2.gz HIXLDTCXDZKAPA-QGZVFWFLSA-N 1 1 357.410 2.913 20 5 FFBDMO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000520755643 517499363 /nfs/dbraw/zinc/49/93/63/517499363.db2.gz UAHTXRAQRJYLFW-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@]1(Cc2cccc(F)c2)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000563069211 517631997 /nfs/dbraw/zinc/63/19/97/517631997.db2.gz SDAMWJBTHGWBAT-LJQANCHMSA-N 1 1 359.401 2.993 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000516332426 517664895 /nfs/dbraw/zinc/66/48/95/517664895.db2.gz BPHBUWHYWZOYLU-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000521408256 517718748 /nfs/dbraw/zinc/71/87/48/517718748.db2.gz AZUNICVBHTWANF-HUUCEWRRSA-N 1 1 374.485 2.901 20 5 FFBDMO C[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1=CC[N@@H+](C)CC1 ZINC000542826125 517769376 /nfs/dbraw/zinc/76/93/76/517769376.db2.gz JFIBVLBNKYBZRJ-OAHLLOKOSA-N 1 1 372.469 2.578 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000553783336 517901136 /nfs/dbraw/zinc/90/11/36/517901136.db2.gz OZMWPIGUTHHVIB-CKFHNAJUSA-N 1 1 370.453 2.807 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000539292509 517980836 /nfs/dbraw/zinc/98/08/36/517980836.db2.gz KYGWRAYVRWKIGE-OAHLLOKOSA-N 1 1 369.425 2.891 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522180999 518021525 /nfs/dbraw/zinc/02/15/25/518021525.db2.gz BMYXTGMVZVJGMN-SFHVURJKSA-N 1 1 368.437 2.561 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000539502771 518080696 /nfs/dbraw/zinc/08/06/96/518080696.db2.gz VYMOUFKAFWQTIQ-JKSUJKDBSA-N 1 1 363.458 2.909 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC2)s1 ZINC000557586994 518090599 /nfs/dbraw/zinc/09/05/99/518090599.db2.gz AXGMHUVSAMLXQG-UHFFFAOYSA-N 1 1 374.466 2.640 20 5 FFBDMO Cc1cc(N2CC[NH+](Cc3cnn(C)c3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000539548431 518095612 /nfs/dbraw/zinc/09/56/12/518095612.db2.gz ZDDLVBMJIAFJOH-UHFFFAOYSA-N 1 1 366.425 2.507 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000543476704 518111354 /nfs/dbraw/zinc/11/13/54/518111354.db2.gz TZXHBOVOQKCFPL-GOEBONIOSA-N 1 1 352.431 2.711 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000531151899 518155811 /nfs/dbraw/zinc/15/58/11/518155811.db2.gz OUHORCQSORYGAX-HNNXBMFYSA-N 1 1 361.442 2.744 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856257 518204911 /nfs/dbraw/zinc/20/49/11/518204911.db2.gz MCVVFPCEXMXSTL-YJBOKZPZSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856257 518204913 /nfs/dbraw/zinc/20/49/13/518204913.db2.gz MCVVFPCEXMXSTL-YJBOKZPZSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C(CSc1ccccc1[N+](=O)[O-])Nc1c[nH+]ccc1-n1cccn1 ZINC000569637917 518213615 /nfs/dbraw/zinc/21/36/15/518213615.db2.gz CMPUFPSAAIOVGK-UHFFFAOYSA-N 1 1 355.379 2.906 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]21 ZINC000581479437 518305815 /nfs/dbraw/zinc/30/58/15/518305815.db2.gz ADLHUQMYTHZCRW-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000581685636 518406973 /nfs/dbraw/zinc/40/69/73/518406973.db2.gz VTZBJBSJEPUYPR-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCCc1ccc(F)cc1 ZINC000581872268 518479411 /nfs/dbraw/zinc/47/94/11/518479411.db2.gz KLLGAMCKHMJVKG-UHFFFAOYSA-N 1 1 359.401 2.567 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCCc1ccc(F)cc1 ZINC000581872268 518479413 /nfs/dbraw/zinc/47/94/13/518479413.db2.gz KLLGAMCKHMJVKG-UHFFFAOYSA-N 1 1 359.401 2.567 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(N3CC[N@H+]4CCCC[C@H]4C3)n2C2CC2)cc1 ZINC000576354132 518553413 /nfs/dbraw/zinc/55/34/13/518553413.db2.gz OLLQJLFQBCSPCD-KRWDZBQOSA-N 1 1 368.441 2.863 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000573222528 518564045 /nfs/dbraw/zinc/56/40/45/518564045.db2.gz NEDROTKWDVMQSU-UHFFFAOYSA-N 1 1 369.421 2.538 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccccc1)[C@]1(CO)CCOC1 ZINC000585718506 518573804 /nfs/dbraw/zinc/57/38/04/518573804.db2.gz JEEGKIGWMUKVNG-FQEVSTJZSA-N 1 1 372.421 2.627 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2ccc3cn[nH]c3c2)n1 ZINC000585765420 518589585 /nfs/dbraw/zinc/58/95/85/518589585.db2.gz BRHHNNBAWBSKIS-RDJZCZTQSA-N 1 1 354.414 2.984 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000570597063 518685507 /nfs/dbraw/zinc/68/55/07/518685507.db2.gz QCYGTKNBIZMJGL-YOEHRIQHSA-N 1 1 373.457 2.821 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000570597063 518685516 /nfs/dbraw/zinc/68/55/16/518685516.db2.gz QCYGTKNBIZMJGL-YOEHRIQHSA-N 1 1 373.457 2.821 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000582428165 518749457 /nfs/dbraw/zinc/74/94/57/518749457.db2.gz BQIXPGJXNITDFR-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO Cc1ccc(CCC[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000571067864 518912411 /nfs/dbraw/zinc/91/24/11/518912411.db2.gz PECFRFUTFHDBAD-UHFFFAOYSA-N 1 1 368.437 2.689 20 5 FFBDMO C[C@H](C(=O)NCCc1cccs1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000574139341 519006644 /nfs/dbraw/zinc/00/66/44/519006644.db2.gz DIUXRWQBQUSLPP-CQSZACIVSA-N 1 1 361.467 2.878 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000565778046 519127498 /nfs/dbraw/zinc/12/74/98/519127498.db2.gz NRWMANNDXLCVAH-RHSMWYFYSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2 ZINC000571740489 519247949 /nfs/dbraw/zinc/24/79/49/519247949.db2.gz WAJNJUPBMNIKGJ-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2 ZINC000571740489 519247954 /nfs/dbraw/zinc/24/79/54/519247954.db2.gz WAJNJUPBMNIKGJ-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000577898268 519313786 /nfs/dbraw/zinc/31/37/86/519313786.db2.gz DEPPOSCJRJMPBR-ZWKOTPCHSA-N 1 1 374.441 2.593 20 5 FFBDMO CC1=CC[N@@H+](CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000568990079 519320881 /nfs/dbraw/zinc/32/08/81/519320881.db2.gz CSIQIFVBLAHYHR-SFHVURJKSA-N 1 1 355.442 2.659 20 5 FFBDMO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000590781506 519366067 /nfs/dbraw/zinc/36/60/67/519366067.db2.gz BSLGNJNKUIMOMT-UHFFFAOYSA-N 1 1 360.414 2.758 20 5 FFBDMO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000590781506 519366073 /nfs/dbraw/zinc/36/60/73/519366073.db2.gz BSLGNJNKUIMOMT-UHFFFAOYSA-N 1 1 360.414 2.758 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[N@H+]1C1CC1 ZINC000583666817 519367051 /nfs/dbraw/zinc/36/70/51/519367051.db2.gz SQXBXSHQHPQYIB-DZGCQCFKSA-N 1 1 358.442 2.868 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569229159 519444796 /nfs/dbraw/zinc/44/47/96/519444796.db2.gz AKMXVIKVNSOWFT-SUMWQHHRSA-N 1 1 368.441 2.861 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000583820436 519450434 /nfs/dbraw/zinc/45/04/34/519450434.db2.gz DGNYJRQFLOGEDN-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c1 ZINC000590971425 519465596 /nfs/dbraw/zinc/46/55/96/519465596.db2.gz QQFMEIHNPFJPGY-FUHWJXTLSA-N 1 1 362.426 2.754 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000578234702 519488472 /nfs/dbraw/zinc/48/84/72/519488472.db2.gz OCGIEHRYWMLFDF-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000591054547 519493894 /nfs/dbraw/zinc/49/38/94/519493894.db2.gz CETXEECNLUISDN-MRXNPFEDSA-N 1 1 361.442 2.841 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000581213265 519579699 /nfs/dbraw/zinc/57/96/99/519579699.db2.gz YBGNYAITGNVNLH-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](CCC(=O)OC(C)(C)C)C1 ZINC000602847555 519924460 /nfs/dbraw/zinc/92/44/60/519924460.db2.gz WBKOAXBHGOCMNO-HNNXBMFYSA-N 1 1 366.462 2.934 20 5 FFBDMO Cc1c(CNC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000616259546 519957036 /nfs/dbraw/zinc/95/70/36/519957036.db2.gz UNOUTTRNUBIEKZ-KRWDZBQOSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1c(CNC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000616259546 519957043 /nfs/dbraw/zinc/95/70/43/519957043.db2.gz UNOUTTRNUBIEKZ-KRWDZBQOSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c(C)cc1[N+](=O)[O-] ZINC000594483696 519991840 /nfs/dbraw/zinc/99/18/40/519991840.db2.gz NZNCHLLGFQMLII-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1cc(CNC2CC[NH+]([C@@H]3CCOC3)CC2)cc(C(F)(F)F)c1 ZINC000594501404 520004076 /nfs/dbraw/zinc/00/40/76/520004076.db2.gz UTKLGQSAUARXII-OAHLLOKOSA-N 1 1 373.375 2.957 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000602997803 520012584 /nfs/dbraw/zinc/01/25/84/520012584.db2.gz RCABYIWXZAOPDW-OLMNPRSZSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594602739 520048782 /nfs/dbraw/zinc/04/87/82/520048782.db2.gz SCUKZXCUFJBVPG-NEPJUHHUSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594602739 520048787 /nfs/dbraw/zinc/04/87/87/520048787.db2.gz SCUKZXCUFJBVPG-NEPJUHHUSA-N 1 1 355.236 2.603 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3nc4c(cc3[N+](=O)[O-])CCCC4)CC2)c1 ZINC000591924710 520089407 /nfs/dbraw/zinc/08/94/07/520089407.db2.gz SSBLBGFGRZWFAM-UHFFFAOYSA-N 1 1 353.426 2.899 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1C ZINC000594792505 520160343 /nfs/dbraw/zinc/16/03/43/520160343.db2.gz RWJVWMOIJIJXCJ-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO CCC[NH+](CCC)CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000609076384 520186006 /nfs/dbraw/zinc/18/60/06/520186006.db2.gz TUVOBJJDNGQKSH-UHFFFAOYSA-N 1 1 361.439 2.524 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000600298886 520189048 /nfs/dbraw/zinc/18/90/48/520189048.db2.gz OEGWABRSIPIQRN-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000600298886 520189056 /nfs/dbraw/zinc/18/90/56/520189056.db2.gz OEGWABRSIPIQRN-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO Cc1nn(Cc2cccc(C[NH+]3CCOCC3)c2)c2ncc([N+](=O)[O-])cc12 ZINC000603322119 520215522 /nfs/dbraw/zinc/21/55/22/520215522.db2.gz UAVDUZALEXXPFQ-UHFFFAOYSA-N 1 1 367.409 2.528 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000609194743 520226382 /nfs/dbraw/zinc/22/63/82/520226382.db2.gz HQKTVUSXASZKOL-QGZVFWFLSA-N 1 1 360.410 2.518 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000603402187 520249876 /nfs/dbraw/zinc/24/98/76/520249876.db2.gz OFPOSSXGKWNDQZ-CQSZACIVSA-N 1 1 360.458 2.558 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C1CCCCC1 ZINC000603477915 520277595 /nfs/dbraw/zinc/27/75/95/520277595.db2.gz OZYHJRAOOSTLAJ-UHFFFAOYSA-N 1 1 363.414 2.708 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597859772 520287446 /nfs/dbraw/zinc/28/74/46/520287446.db2.gz HMJLXHMXJNLUJW-ZDUSSCGKSA-N 1 1 358.442 2.855 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1SC ZINC000597922668 520324771 /nfs/dbraw/zinc/32/47/71/520324771.db2.gz KKCHHRDRYKNFCQ-NSHDSACASA-N 1 1 367.471 2.928 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000597922615 520324838 /nfs/dbraw/zinc/32/48/38/520324838.db2.gz JJOROEVSNABDLX-GFCCVEGCSA-N 1 1 370.247 2.960 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000597926028 520327000 /nfs/dbraw/zinc/32/70/00/520327000.db2.gz ZRILEDGOMYCRJY-CYBMUJFWSA-N 1 1 357.414 2.588 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1 ZINC000609541270 520351620 /nfs/dbraw/zinc/35/16/20/520351620.db2.gz YYIGCSGQYJXLCJ-GOSISDBHSA-N 1 1 363.458 2.550 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039081 520389151 /nfs/dbraw/zinc/38/91/51/520389151.db2.gz IHSCCKLZEXCTMQ-OAHLLOKOSA-N 1 1 357.414 2.541 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)[C@@H]1CC[N@H+](CC)C1 ZINC000598039081 520389158 /nfs/dbraw/zinc/38/91/58/520389158.db2.gz IHSCCKLZEXCTMQ-OAHLLOKOSA-N 1 1 357.414 2.541 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039081 520389162 /nfs/dbraw/zinc/38/91/62/520389162.db2.gz IHSCCKLZEXCTMQ-OAHLLOKOSA-N 1 1 357.414 2.541 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCCC[N@@H+](C)Cc1ccccc1 ZINC000603929558 520407896 /nfs/dbraw/zinc/40/78/96/520407896.db2.gz VRDPDCWSEKZFBI-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000609710625 520413318 /nfs/dbraw/zinc/41/33/18/520413318.db2.gz CEHYAVKUXUESEZ-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592493964 520415879 /nfs/dbraw/zinc/41/58/79/520415879.db2.gz XYYBOBQYTZPRSZ-ULQDDVLXSA-N 1 1 374.485 2.942 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000595382518 520441492 /nfs/dbraw/zinc/44/14/92/520441492.db2.gz UKUJSVNADCQCMN-UHFFFAOYSA-N 1 1 363.867 2.647 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000604197940 520481304 /nfs/dbraw/zinc/48/13/04/520481304.db2.gz CBNJSXDEUUNXQG-LBPRGKRZSA-N 1 1 374.363 2.626 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473004 520493147 /nfs/dbraw/zinc/49/31/47/520493147.db2.gz RZUDLFWBRNIKPW-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO CCOc1cc(CN2CCC[C@@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473004 520493155 /nfs/dbraw/zinc/49/31/55/520493155.db2.gz RZUDLFWBRNIKPW-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N[C@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000604506134 520583009 /nfs/dbraw/zinc/58/30/09/520583009.db2.gz GVPSXJRMWYOTOL-HOCLYGCPSA-N 1 1 372.469 2.798 20 5 FFBDMO CCCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000592833217 520607656 /nfs/dbraw/zinc/60/76/56/520607656.db2.gz WRSXGMPYCOWGCC-JSGCOSHPSA-N 1 1 369.849 2.958 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000592879805 520629570 /nfs/dbraw/zinc/62/95/70/520629570.db2.gz DFTIMJICGYZSFI-SJORKVTESA-N 1 1 353.422 2.978 20 5 FFBDMO COc1cc2c(c(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)c1)O[C@@H](C)C2 ZINC000601149301 520661024 /nfs/dbraw/zinc/66/10/24/520661024.db2.gz KSEPKZUDXDZNBM-RBZFPXEDSA-N 1 1 372.421 2.924 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1ccc(N2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000601150376 520662064 /nfs/dbraw/zinc/66/20/64/520662064.db2.gz WMKMOTPUDYSFKH-IBGZPJMESA-N 1 1 356.426 2.587 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c1 ZINC000598507945 520666325 /nfs/dbraw/zinc/66/63/25/520666325.db2.gz FBXFOZWYVMATNF-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC000598507945 520666332 /nfs/dbraw/zinc/66/63/32/520666332.db2.gz FBXFOZWYVMATNF-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000593016839 520686090 /nfs/dbraw/zinc/68/60/90/520686090.db2.gz XUQNFLPBWXXUGV-UHFFFAOYSA-N 1 1 371.412 2.663 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595752085 520699088 /nfs/dbraw/zinc/69/90/88/520699088.db2.gz SCEAAYIRRBNOKB-KPZWWZAWSA-N 1 1 358.398 2.943 20 5 FFBDMO COc1cccc([C@]2(C)CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000595766911 520709153 /nfs/dbraw/zinc/70/91/53/520709153.db2.gz MTZSCOZJJDTUFZ-HXUWFJFHSA-N 1 1 369.421 2.866 20 5 FFBDMO C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000593057757 520712753 /nfs/dbraw/zinc/71/27/53/520712753.db2.gz HRNICKPIWVLSHJ-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO CC[C@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000593056398 520713551 /nfs/dbraw/zinc/71/35/51/520713551.db2.gz HXJLVXPYIQZRIE-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO O=C(C[NH+]1CCC([C@H]2CCCCO2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595785310 520722314 /nfs/dbraw/zinc/72/23/14/520722314.db2.gz DIIZGSGEMFEPQI-LJQANCHMSA-N 1 1 373.453 2.765 20 5 FFBDMO Cn1ncc(Br)c1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000601291611 520727233 /nfs/dbraw/zinc/72/72/33/520727233.db2.gz HEGXNZYFVOVYTI-LBPRGKRZSA-N 1 1 351.204 2.868 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595790883 520727392 /nfs/dbraw/zinc/72/73/92/520727392.db2.gz ZJUCSCFRNMUJNU-JZXOWHBKSA-N 1 1 364.442 2.616 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000593188214 520811213 /nfs/dbraw/zinc/81/12/13/520811213.db2.gz YXEYODZNLONPBX-ZNMIVQPWSA-N 1 1 360.458 2.748 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595908904 520813129 /nfs/dbraw/zinc/81/31/29/520813129.db2.gz JIOIFVGJGYESCF-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595908904 520813140 /nfs/dbraw/zinc/81/31/40/520813140.db2.gz JIOIFVGJGYESCF-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595911170 520814442 /nfs/dbraw/zinc/81/44/42/520814442.db2.gz SEHVULAEZDAZEK-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595911170 520814451 /nfs/dbraw/zinc/81/44/51/520814451.db2.gz SEHVULAEZDAZEK-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914414 520819249 /nfs/dbraw/zinc/81/92/49/520819249.db2.gz HFXHEEOVHNWWTC-DIFFPNOSSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914414 520819253 /nfs/dbraw/zinc/81/92/53/520819253.db2.gz HFXHEEOVHNWWTC-DIFFPNOSSA-N 1 1 371.384 2.976 20 5 FFBDMO COc1cc(CNC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058390 520885331 /nfs/dbraw/zinc/88/53/31/520885331.db2.gz GPVVDZBDDLLWGF-OAHLLOKOSA-N 1 1 363.458 2.824 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593321311 520908118 /nfs/dbraw/zinc/90/81/18/520908118.db2.gz HZMOARVJLKMSDV-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593321311 520908126 /nfs/dbraw/zinc/90/81/26/520908126.db2.gz HZMOARVJLKMSDV-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593320601 520908251 /nfs/dbraw/zinc/90/82/51/520908251.db2.gz UKQNFIGHSHNRSN-GOSISDBHSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593320601 520908259 /nfs/dbraw/zinc/90/82/59/520908259.db2.gz UKQNFIGHSHNRSN-GOSISDBHSA-N 1 1 371.412 2.662 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945211 520912902 /nfs/dbraw/zinc/91/29/02/520912902.db2.gz SQLPIECGDSEDIQ-LSDHHAIUSA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945211 520912910 /nfs/dbraw/zinc/91/29/10/520912910.db2.gz SQLPIECGDSEDIQ-LSDHHAIUSA-N 1 1 357.414 2.764 20 5 FFBDMO CN(CC1C[NH+](C)C1)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000618191247 520928101 /nfs/dbraw/zinc/92/81/01/520928101.db2.gz YVADTYSCTKBAGL-UHFFFAOYSA-N 1 1 371.387 2.593 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596140017 520934836 /nfs/dbraw/zinc/93/48/36/520934836.db2.gz AMLQPHFKMMACSR-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596191952 520962494 /nfs/dbraw/zinc/96/24/94/520962494.db2.gz IRPYGGLLVOOJOJ-INIZCTEOSA-N 1 1 368.437 2.795 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](n4cncn4)C3)o2)c([N+](=O)[O-])c1 ZINC000614453116 520973529 /nfs/dbraw/zinc/97/35/29/520973529.db2.gz OEUFKMMEXRAVDL-ZDUSSCGKSA-N 1 1 369.381 2.902 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000611087446 520977176 /nfs/dbraw/zinc/97/71/76/520977176.db2.gz HGXJAYQJLRIWEA-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000611087446 520977178 /nfs/dbraw/zinc/97/71/78/520977178.db2.gz HGXJAYQJLRIWEA-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611092342 520981207 /nfs/dbraw/zinc/98/12/07/520981207.db2.gz QNELBSOAYFUYCL-NSHDSACASA-N 1 1 359.373 2.731 20 5 FFBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596231492 520984541 /nfs/dbraw/zinc/98/45/41/520984541.db2.gz JVQKNRLEXYFJHQ-DGCLKSJQSA-N 1 1 359.348 2.913 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000596258989 520998132 /nfs/dbraw/zinc/99/81/32/520998132.db2.gz QBXDCBUTVKQQEO-PHIMTYICSA-N 1 1 356.220 2.632 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068657 521012961 /nfs/dbraw/zinc/01/29/61/521012961.db2.gz BNBJUDSRHMLNCF-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000611181200 521027086 /nfs/dbraw/zinc/02/70/86/521027086.db2.gz TWEJKDQTNVLXQB-UHFFFAOYSA-N 1 1 352.504 2.647 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@H]2CC[N@@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599125888 521042898 /nfs/dbraw/zinc/04/28/98/521042898.db2.gz FBTONDSCWBNFHQ-CQSZACIVSA-N 1 1 367.471 2.817 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599125888 521042910 /nfs/dbraw/zinc/04/29/10/521042910.db2.gz FBTONDSCWBNFHQ-CQSZACIVSA-N 1 1 367.471 2.817 20 5 FFBDMO CC(=O)N1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC12CCCCC2 ZINC000611225373 521045057 /nfs/dbraw/zinc/04/50/57/521045057.db2.gz NAXNBPGWFSOBPD-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO Cc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000599143697 521053329 /nfs/dbraw/zinc/05/33/29/521053329.db2.gz VJHFFUMLRPLNBC-QGZVFWFLSA-N 1 1 357.458 2.984 20 5 FFBDMO O=C1[C@H]([NH+]2CCC(c3cccnc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000611258359 521061644 /nfs/dbraw/zinc/06/16/44/521061644.db2.gz IYFOQDRMJMNDOB-LJQANCHMSA-N 1 1 366.421 2.975 20 5 FFBDMO COc1cc(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccc1[N+](=O)[O-] ZINC000596423630 521062435 /nfs/dbraw/zinc/06/24/35/521062435.db2.gz MYEHOPZBWDRGNN-QGZVFWFLSA-N 1 1 357.410 2.782 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000593559781 521076499 /nfs/dbraw/zinc/07/64/99/521076499.db2.gz NMFMADGXWJCLPV-APWZRJJASA-N 1 1 357.385 2.838 20 5 FFBDMO O=[N+]([O-])c1cnc2ccccc2c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596515230 521108318 /nfs/dbraw/zinc/10/83/18/521108318.db2.gz TVFIYPFYBMTOGG-QZTJIDSGSA-N 1 1 368.437 2.620 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@H+]1C1CCCC1 ZINC000602151124 521173905 /nfs/dbraw/zinc/17/39/05/521173905.db2.gz HBTLGVBZJQZXLE-SFHVURJKSA-N 1 1 356.426 2.752 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@H+]1C1CCCC1 ZINC000602151122 521175149 /nfs/dbraw/zinc/17/51/49/521175149.db2.gz HBTLGVBZJQZXLE-GOSISDBHSA-N 1 1 356.426 2.752 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H]2CC[N@@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000599390053 521193499 /nfs/dbraw/zinc/19/34/99/521193499.db2.gz HPQXBHYKBVAOFM-CYBMUJFWSA-N 1 1 373.500 2.650 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000599390053 521193504 /nfs/dbraw/zinc/19/35/04/521193504.db2.gz HPQXBHYKBVAOFM-CYBMUJFWSA-N 1 1 373.500 2.650 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000611527765 521203199 /nfs/dbraw/zinc/20/31/99/521203199.db2.gz BLFJKMOAESKQGU-UHFFFAOYSA-N 1 1 351.366 2.601 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CO)CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000611560771 521220255 /nfs/dbraw/zinc/22/02/55/521220255.db2.gz RYLSHGZURWDQBX-KRWDZBQOSA-N 1 1 358.442 2.950 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1C ZINC000599464244 521241026 /nfs/dbraw/zinc/24/10/26/521241026.db2.gz KRSUZHRUQGFWQH-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3ncnc4ccc([N+](=O)[O-])cc43)CC2)c1 ZINC000611712275 521293695 /nfs/dbraw/zinc/29/36/95/521293695.db2.gz ZUGVBAKIJCQZOR-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO CC1(C)[C@H](c2cccc(F)c2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599629783 521342082 /nfs/dbraw/zinc/34/20/82/521342082.db2.gz MHPFWEWUHGKZAV-IRXDYDNUSA-N 1 1 362.405 2.559 20 5 FFBDMO Cn1cc(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473065 521366012 /nfs/dbraw/zinc/36/60/12/521366012.db2.gz IMGUYQHWTYVNBS-FQEVSTJZSA-N 1 1 369.469 2.816 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCCC2)O1 ZINC000594057194 521377669 /nfs/dbraw/zinc/37/76/69/521377669.db2.gz ASZAZVITQIHWDQ-HOTGVXAUSA-N 1 1 364.442 2.758 20 5 FFBDMO CCC1(N2CCOCC2)CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000599670461 521386144 /nfs/dbraw/zinc/38/61/44/521386144.db2.gz WHYXHLUKNLQCPL-UHFFFAOYSA-N 1 1 363.458 2.550 20 5 FFBDMO Cc1cc(N2CCN(C[C@@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611918564 521392796 /nfs/dbraw/zinc/39/27/96/521392796.db2.gz CUCDJBZUHWZFNX-INIZCTEOSA-N 1 1 356.426 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CCN(C4CCC4)CC3)CC2)cn1 ZINC000602521177 521392914 /nfs/dbraw/zinc/39/29/14/521392914.db2.gz KGJQBYVCCBUAOH-UHFFFAOYSA-N 1 1 359.474 2.565 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000602705868 521487752 /nfs/dbraw/zinc/48/77/52/521487752.db2.gz NLEMFUJEWMVWKA-LLVKDONJSA-N 1 1 355.320 2.727 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597097206 521503077 /nfs/dbraw/zinc/50/30/77/521503077.db2.gz DTNWBHOUPCWYJI-JTQLQIEISA-N 1 1 355.826 2.636 20 5 FFBDMO C[NH+](C)[C@@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000594336036 521563849 /nfs/dbraw/zinc/56/38/49/521563849.db2.gz FEDNKUVVWIMNFJ-QGZVFWFLSA-N 1 1 374.828 2.831 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000619785175 521872363 /nfs/dbraw/zinc/87/23/63/521872363.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785175 521872366 /nfs/dbraw/zinc/87/23/66/521872366.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785175 521872368 /nfs/dbraw/zinc/87/23/68/521872368.db2.gz KINPGUSMGVLRKO-FQEVSTJZSA-N 1 1 357.454 2.562 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000736267995 598368053 /nfs/dbraw/zinc/36/80/53/598368053.db2.gz VUHPMPIIHYHJMU-GFCCVEGCSA-N 1 1 359.434 2.697 20 5 FFBDMO CC[N@@H+](CCC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1)CC(C)C ZINC000540205908 673528311 /nfs/dbraw/zinc/52/83/11/673528311.db2.gz VIHITOKWYXZBAY-UHFFFAOYSA-N 1 1 350.467 2.551 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626791 719073923 /nfs/dbraw/zinc/07/39/23/719073923.db2.gz PIORDQWIKYETBD-SJLPKXTDSA-N 1 1 353.426 2.794 20 5 FFBDMO Cc1c(C)c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)ncc1[N+](=O)[O-] ZINC001164729000 720396086 /nfs/dbraw/zinc/39/60/86/720396086.db2.gz UQTKTTMJIOJYQB-IAGOWNOFSA-N 1 1 353.426 2.855 20 5 FFBDMO CC[N@@H+]1CC[C@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000899223299 735461771 /nfs/dbraw/zinc/46/17/71/735461771.db2.gz DSPWWWGTZUKDEW-ZETCQYMHSA-N 1 1 350.177 2.865 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000899223299 735461773 /nfs/dbraw/zinc/46/17/73/735461773.db2.gz DSPWWWGTZUKDEW-ZETCQYMHSA-N 1 1 350.177 2.865 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000746670291 735503646 /nfs/dbraw/zinc/50/36/46/735503646.db2.gz FNSAMKPFASDTGY-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000746670291 735503647 /nfs/dbraw/zinc/50/36/47/735503647.db2.gz FNSAMKPFASDTGY-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188170 728558989 /nfs/dbraw/zinc/55/89/89/728558989.db2.gz BZTHEOWJCCDCKK-UKRRQHHQSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188170 728558992 /nfs/dbraw/zinc/55/89/92/728558992.db2.gz BZTHEOWJCCDCKK-UKRRQHHQSA-N 1 1 355.822 2.812 20 5 FFBDMO Cc1ccc(NS(=O)(=O)c2csc([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000120017299 728603912 /nfs/dbraw/zinc/60/39/12/728603912.db2.gz JUPOZFHYTVNOOX-UHFFFAOYSA-N 1 1 355.441 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CCCO3)CC2)c(C(F)(F)F)c1 ZINC000170774975 728989352 /nfs/dbraw/zinc/98/93/52/728989352.db2.gz CZVXYZFGGLUYGS-CYBMUJFWSA-N 1 1 359.348 2.915 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O ZINC000779206840 738443155 /nfs/dbraw/zinc/44/31/55/738443155.db2.gz REVZJVZBTIOKHP-IUODEOHRSA-N 1 1 369.849 2.916 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O ZINC000779206840 738443159 /nfs/dbraw/zinc/44/31/59/738443159.db2.gz REVZJVZBTIOKHP-IUODEOHRSA-N 1 1 369.849 2.916 20 5 FFBDMO C[C@H](N[C@H]1CCN(C2CC[NH+](C)CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872036521 731722882 /nfs/dbraw/zinc/72/28/82/731722882.db2.gz TVSPWSXVCHGJPE-KBPBESRZSA-N 1 1 350.438 2.553 20 5 FFBDMO C[C@H]([NH2+]CCN1C[C@@H]2CCCCN2C1=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872088831 731728586 /nfs/dbraw/zinc/72/85/86/731728586.db2.gz RIRRSKVJUNPNIE-STQMWFEESA-N 1 1 350.394 2.675 20 5 FFBDMO Cn1cc(C[NH+]2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])n1 ZINC000876722320 732272233 /nfs/dbraw/zinc/27/22/33/732272233.db2.gz RTZSJRRXULWINU-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880145544 732855516 /nfs/dbraw/zinc/85/55/16/732855516.db2.gz NXGYNJICFJDGNS-QWRGUYRKSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880145544 732855520 /nfs/dbraw/zinc/85/55/20/732855520.db2.gz NXGYNJICFJDGNS-QWRGUYRKSA-N 1 1 355.822 2.668 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435020 732907646 /nfs/dbraw/zinc/90/76/46/732907646.db2.gz IDYISIWMSAMWBA-AAEUAGOBSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435020 732907650 /nfs/dbraw/zinc/90/76/50/732907650.db2.gz IDYISIWMSAMWBA-AAEUAGOBSA-N 1 1 359.220 2.593 20 5 FFBDMO CS(=O)(=O)[C@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883374746 733376327 /nfs/dbraw/zinc/37/63/27/733376327.db2.gz NVADNOPKBVXZAT-KBAYOESNSA-N 1 1 360.435 2.849 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886822466 733843981 /nfs/dbraw/zinc/84/39/81/733843981.db2.gz QRUJSEVMMKLXPF-MLGOLLRUSA-N 1 1 351.378 2.563 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C[C@]2(C)C1 ZINC000887930824 733994513 /nfs/dbraw/zinc/99/45/13/733994513.db2.gz YFPVYFFXKJTXQU-DOMZBBRYSA-N 1 1 357.332 2.637 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc1SC ZINC000890076333 734261458 /nfs/dbraw/zinc/26/14/58/734261458.db2.gz SZZFPCPAPMPJPH-UHFFFAOYSA-N 1 1 367.471 2.787 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100783 738824283 /nfs/dbraw/zinc/82/42/83/738824283.db2.gz ZNOCHFUPYWPBMH-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100783 738824286 /nfs/dbraw/zinc/82/42/86/738824286.db2.gz ZNOCHFUPYWPBMH-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(c3ncc(Br)cc3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000894798480 734919166 /nfs/dbraw/zinc/91/91/66/734919166.db2.gz WWMAJOSFMZTLDT-OKILXGFUSA-N 1 1 355.236 2.530 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCCc2c1cnn2CCO ZINC000740004180 735064912 /nfs/dbraw/zinc/06/49/12/735064912.db2.gz HQHDMTVESDBHHH-AWEZNQCLSA-N 1 1 350.806 2.604 20 5 FFBDMO CO[C@]1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCSC1 ZINC000903314411 736074559 /nfs/dbraw/zinc/07/45/59/736074559.db2.gz NHFOOVVNVHAQCR-WBVHZDCISA-N 1 1 362.455 2.529 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] ZINC000754507472 736166148 /nfs/dbraw/zinc/16/61/48/736166148.db2.gz CLDWLGLIIXYBDL-MRXNPFEDSA-N 1 1 354.378 2.570 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000756950819 736376224 /nfs/dbraw/zinc/37/62/24/736376224.db2.gz DOHOJLHVVNGDDU-NSHDSACASA-N 1 1 352.822 2.532 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906790862 736543930 /nfs/dbraw/zinc/54/39/30/736543930.db2.gz JTAALZSLRNHMLW-WBMJQRKESA-N 1 1 353.850 2.979 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000906845401 736550491 /nfs/dbraw/zinc/55/04/91/736550491.db2.gz MCTVPMNXMNAVEX-NSHDSACASA-N 1 1 354.838 2.634 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000763309455 736926517 /nfs/dbraw/zinc/92/65/17/736926517.db2.gz XOAYBXLNYMUCKQ-KRWDZBQOSA-N 1 1 362.499 2.918 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000765734531 737150919 /nfs/dbraw/zinc/15/09/19/737150919.db2.gz JVVRDBGIUWZCIP-RYUDHWBXSA-N 1 1 354.838 2.872 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000912810577 737342810 /nfs/dbraw/zinc/34/28/10/737342810.db2.gz WIUBJKPXKKSNNK-QWHCGFSZSA-N 1 1 351.451 2.634 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000769056875 737490495 /nfs/dbraw/zinc/49/04/95/737490495.db2.gz QJBKSZQGROYIER-UHFFFAOYSA-N 1 1 370.247 2.705 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769525301 737539186 /nfs/dbraw/zinc/53/91/86/737539186.db2.gz HFSHHIWGDGBQFN-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769525301 737539187 /nfs/dbraw/zinc/53/91/87/737539187.db2.gz HFSHHIWGDGBQFN-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395083 737722090 /nfs/dbraw/zinc/72/20/90/737722090.db2.gz KITDAZRAZFCVMZ-DTWKUNHWSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395083 737722092 /nfs/dbraw/zinc/72/20/92/737722092.db2.gz KITDAZRAZFCVMZ-DTWKUNHWSA-N 1 1 374.210 2.661 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](CO)c1ccccc1 ZINC000772739894 737838340 /nfs/dbraw/zinc/83/83/40/737838340.db2.gz FHQXGHGPWIFPQZ-MRXNPFEDSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](CO)c1ccccc1 ZINC000772739894 737838344 /nfs/dbraw/zinc/83/83/44/737838344.db2.gz FHQXGHGPWIFPQZ-MRXNPFEDSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639564 738008124 /nfs/dbraw/zinc/00/81/24/738008124.db2.gz LVKWPAHTVXCFTA-MLGOLLRUSA-N 1 1 363.849 2.972 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000930160742 739067023 /nfs/dbraw/zinc/06/70/23/739067023.db2.gz XWUTVCFAISUQPK-CYBMUJFWSA-N 1 1 368.821 2.623 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CCCOCC3)CC2)c(Cl)c1 ZINC000931287195 739238234 /nfs/dbraw/zinc/23/82/34/739238234.db2.gz VWHBUEOUDYCUKQ-UHFFFAOYSA-N 1 1 353.850 2.935 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(CCC2)[C@@H]1C1CC[NH+](CC[N+](=O)[O-])CC1 ZINC000931706722 739314391 /nfs/dbraw/zinc/31/43/91/739314391.db2.gz JKXHBEGOOBISQU-HNNXBMFYSA-N 1 1 353.463 2.765 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@H](c2nccc(C(F)(F)F)n2)C1 ZINC000933708894 739675926 /nfs/dbraw/zinc/67/59/26/739675926.db2.gz BNYQRWHBOXLVJQ-JTQLQIEISA-N 1 1 353.304 2.788 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@H](c2nccc(C(F)(F)F)n2)C1 ZINC000933708894 739675929 /nfs/dbraw/zinc/67/59/29/739675929.db2.gz BNYQRWHBOXLVJQ-JTQLQIEISA-N 1 1 353.304 2.788 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@@H](c2nccc(C(F)(F)F)n2)C1 ZINC000933708895 739675974 /nfs/dbraw/zinc/67/59/74/739675974.db2.gz BNYQRWHBOXLVJQ-SNVBAGLBSA-N 1 1 353.304 2.788 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@@H](c2nccc(C(F)(F)F)n2)C1 ZINC000933708895 739675977 /nfs/dbraw/zinc/67/59/77/739675977.db2.gz BNYQRWHBOXLVJQ-SNVBAGLBSA-N 1 1 353.304 2.788 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])CC1 ZINC000819637576 742418317 /nfs/dbraw/zinc/41/83/17/742418317.db2.gz XHJPAPIQGHSBBK-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+](C2CC2)C1 ZINC000820875002 742561925 /nfs/dbraw/zinc/56/19/25/742561925.db2.gz VXDVTOJUQUOQJE-VIFPVBQESA-N 1 1 370.812 2.526 20 5 FFBDMO CCN(C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000822138858 742701798 /nfs/dbraw/zinc/70/17/98/742701798.db2.gz MJZOSJCKYLVOIF-LLVKDONJSA-N 1 1 371.235 2.915 20 5 FFBDMO CC(C)(CCC(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[N+](=O)[O-] ZINC000822883321 742796857 /nfs/dbraw/zinc/79/68/57/742796857.db2.gz AAHKYJDWMQRKKU-CQSZACIVSA-N 1 1 353.488 2.912 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643914 742927652 /nfs/dbraw/zinc/92/76/52/742927652.db2.gz UNZSNDOXFRXQPI-KLHDSHLOSA-N 1 1 351.834 2.522 20 5 FFBDMO C[N@H+]1CC[C@H](CC(=O)N[C@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)C1 ZINC000823593504 742942363 /nfs/dbraw/zinc/94/23/63/742942363.db2.gz AJJUJGDKKLMHSZ-YMTOWFKASA-N 1 1 363.311 2.795 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000825275516 743239189 /nfs/dbraw/zinc/23/91/89/743239189.db2.gz RCZHHFZETAGBGC-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](O)CNC(=O)OC(C)(C)C ZINC000830451721 745360980 /nfs/dbraw/zinc/36/09/80/745360980.db2.gz SKFIOZNGIXVNJD-CYBMUJFWSA-N 1 1 373.837 2.566 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](O)CNC(=O)OC(C)(C)C ZINC000830451721 745360987 /nfs/dbraw/zinc/36/09/87/745360987.db2.gz SKFIOZNGIXVNJD-CYBMUJFWSA-N 1 1 373.837 2.566 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000832745341 745748951 /nfs/dbraw/zinc/74/89/51/745748951.db2.gz JAAQSOJQVGINOZ-CYBMUJFWSA-N 1 1 353.394 2.811 20 5 FFBDMO C[C@H]1CN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000832949903 745767068 /nfs/dbraw/zinc/76/70/68/745767068.db2.gz QVBZVBBLKUZDRR-GFCCVEGCSA-N 1 1 353.369 2.629 20 5 FFBDMO COc1ccc(CC(=O)OC[C@H]2CCCC[N@H+]2C(C)C)cc1[N+](=O)[O-] ZINC000837499606 746461396 /nfs/dbraw/zinc/46/13/96/746461396.db2.gz LZQPTOMCUZVTPU-OAHLLOKOSA-N 1 1 350.415 2.952 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000839105063 746775836 /nfs/dbraw/zinc/77/58/36/746775836.db2.gz OEICIYCKWSHDSF-MAUKXSAKSA-N 1 1 350.415 2.682 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@@H]1C ZINC000839580943 746861355 /nfs/dbraw/zinc/86/13/55/746861355.db2.gz OVMIDZVRKGFZLE-KOLCDFICSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@@H]1C ZINC000839580943 746861365 /nfs/dbraw/zinc/86/13/65/746861365.db2.gz OVMIDZVRKGFZLE-KOLCDFICSA-N 1 1 357.204 2.741 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000839797000 746923806 /nfs/dbraw/zinc/92/38/06/746923806.db2.gz GBKXCJGNEVWGAM-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(CN1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000843387111 747822535 /nfs/dbraw/zinc/82/25/35/747822535.db2.gz FEFXJYPLBQTVHU-CHWSQXEVSA-N 1 1 366.849 2.508 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000843981674 747944682 /nfs/dbraw/zinc/94/46/82/747944682.db2.gz ORFXIKSHJVJTRS-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CN(C(=O)OC(C)(C)C)C1 ZINC000850439854 749365328 /nfs/dbraw/zinc/36/53/28/749365328.db2.gz PMRDLOPRCKYLOE-LLVKDONJSA-N 1 1 351.403 2.873 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(C(=O)OCC(C)(C)[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000851130496 749514631 /nfs/dbraw/zinc/51/46/31/749514631.db2.gz XRKTZBABBVAVAJ-OKILXGFUSA-N 1 1 350.415 2.508 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(C(=O)OCC(C)(C)[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000851130496 749514637 /nfs/dbraw/zinc/51/46/37/749514637.db2.gz XRKTZBABBVAVAJ-OKILXGFUSA-N 1 1 350.415 2.508 20 5 FFBDMO CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000852203490 749800732 /nfs/dbraw/zinc/80/07/32/749800732.db2.gz BXTUINBNMCENNP-IXKJSCDLSA-N 1 1 350.415 2.680 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c1F ZINC000854659555 750347309 /nfs/dbraw/zinc/34/73/09/750347309.db2.gz NVRKPIZGBYEQKZ-QGZVFWFLSA-N 1 1 353.369 2.739 20 5 FFBDMO CNc1nccc(C(=O)NCC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000521595740 821308427 /nfs/dbraw/zinc/30/84/27/821308427.db2.gz DKNQIZFLYDNADE-BETUJISGSA-N 1 1 363.462 2.518 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC000824414164 946699692 /nfs/dbraw/zinc/69/96/92/946699692.db2.gz VXWZSRUILTUQOR-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO COC(=O)c1ncc([N+](=O)[O-])c(C)c1NCCC[N@H+]1CCCC[C@H]1C ZINC001167751070 971699521 /nfs/dbraw/zinc/69/95/21/971699521.db2.gz FFVYWWHYZOOUPY-GFCCVEGCSA-N 1 1 350.419 2.761 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)c2ncccc2C1 ZINC000872317890 1013210730 /nfs/dbraw/zinc/21/07/30/1013210730.db2.gz HNRBSVIFMQDWOF-UHFFFAOYSA-N 1 1 369.425 2.579 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H]([C@H]2CCCO2)C1 ZINC000933189407 963691523 /nfs/dbraw/zinc/69/15/23/963691523.db2.gz ZORYBQCMVDNQAQ-KBAYOESNSA-N 1 1 362.426 2.836 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H]([C@H]2CCCO2)C1 ZINC000933189407 963691529 /nfs/dbraw/zinc/69/15/29/963691529.db2.gz ZORYBQCMVDNQAQ-KBAYOESNSA-N 1 1 362.426 2.836 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c1 ZINC000135361213 965011631 /nfs/dbraw/zinc/01/16/31/965011631.db2.gz XPQLDRBKMVNVKR-HKUYNNGSSA-N 1 1 358.442 2.640 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCCCC(F)(F)F)CC1 ZINC001270879009 967458021 /nfs/dbraw/zinc/45/80/21/967458021.db2.gz HYJDVRXSFUTIIZ-CHWSQXEVSA-N 1 1 365.396 2.603 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@@H]2C[C@@H]2CCCO2)cc1 ZINC001176611807 1013736673 /nfs/dbraw/zinc/73/66/73/1013736673.db2.gz XIMLDYYTBOLCEU-WMZOPIPTSA-N 1 1 350.415 2.634 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000874847389 1013917684 /nfs/dbraw/zinc/91/76/84/1013917684.db2.gz PBMBBLHGKQLCHA-RTBURBONSA-N 1 1 372.469 2.894 20 5 FFBDMO C[C@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876466364 1014278115 /nfs/dbraw/zinc/27/81/15/1014278115.db2.gz BCITYVLUSRUNCJ-IAOVAPTHSA-N 1 1 372.425 2.668 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](C/C=C/c1ccccc1)C2 ZINC000982278561 977375742 /nfs/dbraw/zinc/37/57/42/977375742.db2.gz IRQSYYKCDFDNKU-KJORPVEGSA-N 1 1 369.465 2.535 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](C/C=C/c1ccccc1)C2 ZINC000982278561 977375748 /nfs/dbraw/zinc/37/57/48/977375748.db2.gz IRQSYYKCDFDNKU-KJORPVEGSA-N 1 1 369.465 2.535 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](C/C=C/c1ccccc1)C2 ZINC000982278561 977375757 /nfs/dbraw/zinc/37/57/57/977375757.db2.gz IRQSYYKCDFDNKU-KJORPVEGSA-N 1 1 369.465 2.535 20 5 FFBDMO CCc1n[nH]c(C2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000190646888 979904528 /nfs/dbraw/zinc/90/45/28/979904528.db2.gz MGADMSDBUNITJI-UHFFFAOYSA-N 1 1 359.430 2.924 20 5 FFBDMO CCc1nc(C2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000190646888 979904533 /nfs/dbraw/zinc/90/45/33/979904533.db2.gz MGADMSDBUNITJI-UHFFFAOYSA-N 1 1 359.430 2.924 20 5 FFBDMO Nc1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc2ccccc2c1[N+](=O)[O-] ZINC000907789952 981294460 /nfs/dbraw/zinc/29/44/60/981294460.db2.gz MPKOVUJBALDRFU-HZPDHXFCSA-N 1 1 372.400 2.589 20 5 FFBDMO CCCc1ccc(C[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000963791873 1014766586 /nfs/dbraw/zinc/76/65/86/1014766586.db2.gz SPMQRSZWYAUYNI-JGQKGBITSA-N 1 1 371.481 2.821 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC000910778259 982060030 /nfs/dbraw/zinc/06/00/30/982060030.db2.gz NLTTXQDZDSRTJH-UHFFFAOYSA-N 1 1 369.396 2.763 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC000910778259 982060043 /nfs/dbraw/zinc/06/00/43/982060043.db2.gz NLTTXQDZDSRTJH-UHFFFAOYSA-N 1 1 369.396 2.763 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@H+]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000898035091 982599881 /nfs/dbraw/zinc/59/98/81/982599881.db2.gz KPPDMGAVSNNLQS-QGZVFWFLSA-N 1 1 357.458 2.739 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878178643 1014902150 /nfs/dbraw/zinc/90/21/50/1014902150.db2.gz IKNFAUXSNDYHIO-KGLIPLIRSA-N 1 1 357.414 2.703 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@H]21 ZINC000878351593 1014997666 /nfs/dbraw/zinc/99/76/66/1014997666.db2.gz SIZLKAVLBYDZKN-ZWNOBZJWSA-N 1 1 370.356 2.754 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)CC1 ZINC000151180416 984204290 /nfs/dbraw/zinc/20/42/90/984204290.db2.gz RSTUKNHIIALUGL-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO C[N@@H+](CCCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000129534527 984293457 /nfs/dbraw/zinc/29/34/57/984293457.db2.gz SWDOQXRWTUOIJA-UHFFFAOYSA-N 1 1 360.414 2.592 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000996429191 984353070 /nfs/dbraw/zinc/35/30/70/984353070.db2.gz LPFLQSVMIODMKA-UYAOXDASSA-N 1 1 367.449 2.894 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000764945512 984873013 /nfs/dbraw/zinc/87/30/13/984873013.db2.gz HYHNAUZFGNMXLI-OAHLLOKOSA-N 1 1 373.457 2.839 20 5 FFBDMO CCN(CC)C(=O)C1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000764945496 984873973 /nfs/dbraw/zinc/87/39/73/984873973.db2.gz OEBIAAVORSPUFW-UHFFFAOYSA-N 1 1 373.457 2.791 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC3(CCCC3)C2)C1=O ZINC000173441966 985832508 /nfs/dbraw/zinc/83/25/08/985832508.db2.gz CVLLOHDZUNPNLB-GOSISDBHSA-N 1 1 372.425 2.585 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000324062828 986609062 /nfs/dbraw/zinc/60/90/62/986609062.db2.gz WQPVFDSIHIBCIK-OAHLLOKOSA-N 1 1 368.437 2.771 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000879244862 1015435460 /nfs/dbraw/zinc/43/54/60/1015435460.db2.gz UBUWDCXREMWAQX-QUCCMNQESA-N 1 1 369.421 2.756 20 5 FFBDMO C[NH+]1CCC2(CCN([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)CC1 ZINC000879249757 1015438875 /nfs/dbraw/zinc/43/88/75/1015438875.db2.gz AGWSADDUECGUSA-SFHVURJKSA-N 1 1 372.469 2.508 20 5 FFBDMO O=C(NCc1ccc(C[NH2+]Cc2ccc(CF)cc2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001034815693 990275135 /nfs/dbraw/zinc/27/51/35/990275135.db2.gz AWZZWVUMXVAULL-RTBURBONSA-N 1 1 371.412 2.727 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000918395818 990383810 /nfs/dbraw/zinc/38/38/10/990383810.db2.gz VDQBMDXCXLNHCO-OAHLLOKOSA-N 1 1 360.458 2.655 20 5 FFBDMO CCc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)cc1 ZINC001035187259 990409925 /nfs/dbraw/zinc/40/99/25/990409925.db2.gz SHKYZSMRSGMXEI-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1ccc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035187259 990409930 /nfs/dbraw/zinc/40/99/30/990409930.db2.gz SHKYZSMRSGMXEI-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035187259 990409934 /nfs/dbraw/zinc/40/99/34/990409934.db2.gz SHKYZSMRSGMXEI-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C/C=C/c2ccccc2)CC1 ZINC001484135709 991406484 /nfs/dbraw/zinc/40/64/84/991406484.db2.gz GBAPFLMIQINRRV-HEAXLZMOSA-N 1 1 357.454 2.583 20 5 FFBDMO Cc1cncc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000879749198 1015664152 /nfs/dbraw/zinc/66/41/52/1015664152.db2.gz UIVJIZHADFMKGF-MJGOQNOKSA-N 1 1 357.410 2.875 20 5 FFBDMO CCOc1cc(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000810846312 994953838 /nfs/dbraw/zinc/95/38/38/994953838.db2.gz IROBERZTOZKVKJ-STQMWFEESA-N 1 1 364.398 2.786 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810852795 994958063 /nfs/dbraw/zinc/95/80/63/994958063.db2.gz RBAKROBBZNQHAC-IRXDYDNUSA-N 1 1 356.382 2.564 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812849845 995552119 /nfs/dbraw/zinc/55/21/19/995552119.db2.gz KGPVLYBURVXODE-ACJLOTCBSA-N 1 1 357.410 2.638 20 5 FFBDMO C[C@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844727828 998099834 /nfs/dbraw/zinc/09/98/34/998099834.db2.gz IKYPWSOVVXFXPY-UONOGXRCSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844727828 998099843 /nfs/dbraw/zinc/09/98/43/998099843.db2.gz IKYPWSOVVXFXPY-UONOGXRCSA-N 1 1 367.450 2.764 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC000741028287 999705252 /nfs/dbraw/zinc/70/52/52/999705252.db2.gz FABWMMMVSIUOKW-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO O=C(NC[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363401 999870172 /nfs/dbraw/zinc/87/01/72/999870172.db2.gz RRZHEDIJWSJCKW-UIBBOPPKSA-N 1 1 359.451 2.551 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000745090072 999891946 /nfs/dbraw/zinc/89/19/46/999891946.db2.gz UNPRZFOHWOZOBV-CJNGLKHVSA-N 1 1 363.414 2.585 20 5 FFBDMO COCOc1ccc(OC)cc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000766463972 999995560 /nfs/dbraw/zinc/99/55/60/999995560.db2.gz NONNDSVOJLNWGK-UHFFFAOYSA-N 1 1 362.382 2.885 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169010290 1000015321 /nfs/dbraw/zinc/01/53/21/1000015321.db2.gz CHLDJXDLQQBEJJ-DAYGRLMNSA-N 1 1 353.463 2.765 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169010595 1000015346 /nfs/dbraw/zinc/01/53/46/1000015346.db2.gz DYFIVXHWNHDCMB-FZKCQIBNSA-N 1 1 353.463 2.906 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169010292 1000015382 /nfs/dbraw/zinc/01/53/82/1000015382.db2.gz CHLDJXDLQQBEJJ-RKVPGOIHSA-N 1 1 353.463 2.765 20 5 FFBDMO CCOCc1nn(CC2CC2)c2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169024573 1000017815 /nfs/dbraw/zinc/01/78/15/1000017815.db2.gz XFCKRTPOOVYIKZ-HZPDHXFCSA-N 1 1 362.474 2.633 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCO[C@H]3[C@H](OCC4CCCC4)CC[C@@H]32)C1 ZINC001169025130 1000018083 /nfs/dbraw/zinc/01/80/83/1000018083.db2.gz XUGAKPVNMMPPLI-ICBNADEASA-N 1 1 352.475 2.870 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[NH+](CCc2ccccc2)CC1 ZINC000804338024 1000073235 /nfs/dbraw/zinc/07/32/35/1000073235.db2.gz GJLGEVWPHGDCRR-UHFFFAOYSA-N 1 1 356.382 2.868 20 5 FFBDMO CCC[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000767122663 1000100346 /nfs/dbraw/zinc/10/03/46/1000100346.db2.gz HVFPVNIGLGZRAR-HKMNZKMDSA-N 1 1 361.442 2.567 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000767458357 1000116446 /nfs/dbraw/zinc/11/64/46/1000116446.db2.gz BQKSXXJBKVVMQZ-CYBMUJFWSA-N 1 1 371.397 2.669 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000767598366 1000128786 /nfs/dbraw/zinc/12/87/86/1000128786.db2.gz IVFMXBOFYZNTPZ-UHFFFAOYSA-N 1 1 369.381 2.747 20 5 FFBDMO COc1cc(C(=O)OCCCCn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000769080352 1000431603 /nfs/dbraw/zinc/43/16/03/1000431603.db2.gz CWFUREKEKBICGA-UHFFFAOYSA-N 1 1 363.370 2.754 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(CCc2ccccc2)CC[NH+](C)C)c1[N+](=O)[O-] ZINC000771286412 1001057436 /nfs/dbraw/zinc/05/74/36/1001057436.db2.gz FWSXJRZXJOTMIH-UHFFFAOYSA-N 1 1 373.457 2.688 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000771289344 1001058228 /nfs/dbraw/zinc/05/82/28/1001058228.db2.gz CUKACMFYQNUROU-UHFFFAOYSA-N 1 1 355.358 2.583 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)CC1 ZINC000771403693 1001102981 /nfs/dbraw/zinc/10/29/81/1001102981.db2.gz HLESADPFHDFBSQ-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)CC1 ZINC000771403693 1001102985 /nfs/dbraw/zinc/10/29/85/1001102985.db2.gz HLESADPFHDFBSQ-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000788260677 1001780162 /nfs/dbraw/zinc/78/01/62/1001780162.db2.gz FGNVTEMZBCSQAK-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NCc3cc(Cl)ccc3[N+](=O)[O-])cc2C1 ZINC000788528348 1001822945 /nfs/dbraw/zinc/82/29/45/1001822945.db2.gz AMBZXICBGVAPLK-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NCc3cc(Cl)ccc3[N+](=O)[O-])cc2C1 ZINC000788528348 1001822950 /nfs/dbraw/zinc/82/29/50/1001822950.db2.gz AMBZXICBGVAPLK-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C(C)C)[C@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170354649 1003121175 /nfs/dbraw/zinc/12/11/75/1003121175.db2.gz NMDSRKDFAOHRGN-PBHICJAKSA-N 1 1 363.458 2.866 20 5 FFBDMO COc1c(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)cccc1[N+](=O)[O-] ZINC000793082573 1003273592 /nfs/dbraw/zinc/27/35/92/1003273592.db2.gz MLMMUQLDULXHGA-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO C[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC001129702128 1003744642 /nfs/dbraw/zinc/74/46/42/1003744642.db2.gz MXYNOWQPOPLOHW-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC001129702128 1003744650 /nfs/dbraw/zinc/74/46/50/1003744650.db2.gz MXYNOWQPOPLOHW-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC001129702129 1003744828 /nfs/dbraw/zinc/74/48/28/1003744828.db2.gz MXYNOWQPOPLOHW-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC001129702129 1003744830 /nfs/dbraw/zinc/74/48/30/1003744830.db2.gz MXYNOWQPOPLOHW-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO CC(C)(C)OC(=O)NCC[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000805765710 1004138994 /nfs/dbraw/zinc/13/89/94/1004138994.db2.gz XYLOFYYHJHOZNZ-CQSZACIVSA-N 1 1 367.450 2.561 20 5 FFBDMO O=C(CC[NH2+][C@H](CO)c1c(F)cccc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC001192461008 1004177377 /nfs/dbraw/zinc/17/73/77/1004177377.db2.gz GQXZOTMTBPDLIJ-OAHLLOKOSA-N 1 1 365.336 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@H]3COC[C@@]3(c3ccccc3)C2)cc1 ZINC001197683043 1004320543 /nfs/dbraw/zinc/32/05/43/1004320543.db2.gz RTPVPQGQDUJYQJ-DFQSSKMNSA-N 1 1 354.406 2.528 20 5 FFBDMO O=C(Nc1nccc2c1cccc2[N+](=O)[O-])c1ccn(-c2cc[nH+]cc2)n1 ZINC001130761108 1004437499 /nfs/dbraw/zinc/43/74/99/1004437499.db2.gz GKPAOFKRASUOAM-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO CCOc1ccccc1N1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776272259 1005339667 /nfs/dbraw/zinc/33/96/67/1005339667.db2.gz RQVAQPYWPXCGLR-IBGZPJMESA-N 1 1 371.437 2.849 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc(CF)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325584 1016968823 /nfs/dbraw/zinc/96/88/23/1016968823.db2.gz INGCHBCPZSGSLU-BRSBDYLESA-N 1 1 363.433 2.586 20 5 FFBDMO CO[C@@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000851035475 1005857953 /nfs/dbraw/zinc/85/79/53/1005857953.db2.gz NZAOMRMIFXWRAG-ZWKOTPCHSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000851035475 1005857955 /nfs/dbraw/zinc/85/79/55/1005857955.db2.gz NZAOMRMIFXWRAG-ZWKOTPCHSA-N 1 1 362.426 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)cc1 ZINC000776590373 1006001980 /nfs/dbraw/zinc/00/19/80/1006001980.db2.gz DBYIJSHMEOJQNN-WOJBJXKFSA-N 1 1 356.422 2.962 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2C[N@H+](Cc3ccccc3C)CCO2)c1[N+](=O)[O-] ZINC001187361493 1006036402 /nfs/dbraw/zinc/03/64/02/1006036402.db2.gz LMCDFYJUEBJUMU-INIZCTEOSA-N 1 1 373.457 2.512 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2C[N@@H+](Cc3ccccc3C)CCO2)c1[N+](=O)[O-] ZINC001187361493 1006036409 /nfs/dbraw/zinc/03/64/09/1006036409.db2.gz LMCDFYJUEBJUMU-INIZCTEOSA-N 1 1 373.457 2.512 20 5 FFBDMO COc1cc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)c([N+](=O)[O-])cc1OC ZINC001187593677 1006148060 /nfs/dbraw/zinc/14/80/60/1006148060.db2.gz NNNVXHCWWTWFTK-SMDDNHRTSA-N 1 1 353.444 2.604 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2C2CCOCC2)nc1-c1ccccn1 ZINC000853505896 1006419484 /nfs/dbraw/zinc/41/94/84/1006419484.db2.gz SBXVOVSIKNXBSY-INIZCTEOSA-N 1 1 357.414 2.702 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1cc(F)c([N+](=O)[O-])cc1CO ZINC000882520848 1006420458 /nfs/dbraw/zinc/42/04/58/1006420458.db2.gz HWCWSZPJDUBNHK-UHFFFAOYSA-N 1 1 362.405 2.580 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517476 1006423000 /nfs/dbraw/zinc/42/30/00/1006423000.db2.gz URWQOPLPQDPTNB-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517476 1006423007 /nfs/dbraw/zinc/42/30/07/1006423007.db2.gz URWQOPLPQDPTNB-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)nc1-c1ccccn1 ZINC000853517708 1006423466 /nfs/dbraw/zinc/42/34/66/1006423466.db2.gz BUMWRRKLBAJKBQ-GDBMZVCRSA-N 1 1 357.414 2.702 20 5 FFBDMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000853604873 1006471758 /nfs/dbraw/zinc/47/17/58/1006471758.db2.gz DPCDYJCEXMGJFI-AGUYFDCRSA-N 1 1 358.398 2.584 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1 ZINC000853812007 1006543375 /nfs/dbraw/zinc/54/33/75/1006543375.db2.gz GUMZUQCZCYKBTB-LBPRGKRZSA-N 1 1 371.384 2.803 20 5 FFBDMO CC1(c2nnc(-c3cccnc3)o2)C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000854082210 1006666245 /nfs/dbraw/zinc/66/62/45/1006666245.db2.gz YFGXBTLLATUFGV-UHFFFAOYSA-N 1 1 351.366 2.813 20 5 FFBDMO COCCn1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815616728 1006713825 /nfs/dbraw/zinc/71/38/25/1006713825.db2.gz WWOQNWUVIRHRML-MLGOLLRUSA-N 1 1 359.430 2.748 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ncc(C)cc3[N+](=O)[O-])C2)ccn1 ZINC000856533781 1007872383 /nfs/dbraw/zinc/87/23/83/1007872383.db2.gz MRRRUDJQWYUKJE-KRWDZBQOSA-N 1 1 371.441 2.803 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3nccc(C)c3[N+](=O)[O-])C2)ccn1 ZINC000856533769 1007872473 /nfs/dbraw/zinc/87/24/73/1007872473.db2.gz MISNCHJXHOPQTB-QGZVFWFLSA-N 1 1 371.441 2.803 20 5 FFBDMO N[C@H](CCC[NH3+])Nc1cnc(Cl)nc1Sc1ccc([N+](=O)[O-])cc1 ZINC001170897277 1007896279 /nfs/dbraw/zinc/89/62/79/1007896279.db2.gz LIGRFFLAOPKBSC-LBPRGKRZSA-N 1 1 368.850 2.625 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000820009239 1008265796 /nfs/dbraw/zinc/26/57/96/1008265796.db2.gz CFZYTFQBGLAFHT-VQIMIIECSA-N 1 1 366.421 2.934 20 5 FFBDMO COc1ccccc1NC(=O)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886049129 1008525544 /nfs/dbraw/zinc/52/55/44/1008525544.db2.gz GRCMZOUHZPVHOO-UHFFFAOYSA-N 1 1 370.409 2.849 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CC1CCCC1)CC1CCCC1 ZINC001177313678 1008559154 /nfs/dbraw/zinc/55/91/54/1008559154.db2.gz IXUYACHDOCQRHK-QZTJIDSGSA-N 1 1 351.491 2.840 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@](O)(c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000859587748 1008581939 /nfs/dbraw/zinc/58/19/39/1008581939.db2.gz OXDRBFZHVCBQFE-FQEVSTJZSA-N 1 1 369.421 2.907 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@](C)(O)c2ccccc2)c1 ZINC000822520838 1008644783 /nfs/dbraw/zinc/64/47/83/1008644783.db2.gz PZBOFTIBHNPIGG-IBGZPJMESA-N 1 1 358.394 2.721 20 5 FFBDMO O=[N+]([O-])c1c(N2CCC[N@@H+](Cc3ccccc3)CC2)nc2ccccn21 ZINC000139593369 1008982770 /nfs/dbraw/zinc/98/27/70/1008982770.db2.gz XEDKYLQMLAIDFN-UHFFFAOYSA-N 1 1 351.410 2.955 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CC1[N+](=O)[O-] ZINC001178458721 1008994575 /nfs/dbraw/zinc/99/45/75/1008994575.db2.gz UXUAMRZLPJVEDW-GDBMZVCRSA-N 1 1 371.840 2.911 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)(C)C1 ZINC001178709398 1009099557 /nfs/dbraw/zinc/09/95/57/1009099557.db2.gz NNHVVJQDVMBOHB-LJQANCHMSA-N 1 1 363.461 2.611 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598299 1009135089 /nfs/dbraw/zinc/13/50/89/1009135089.db2.gz HNWUSXPUXNHABF-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598299 1009135099 /nfs/dbraw/zinc/13/50/99/1009135099.db2.gz HNWUSXPUXNHABF-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780624 1009149552 /nfs/dbraw/zinc/14/95/52/1009149552.db2.gz MLKMWHZAOFGVNA-NFBPQSOOSA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780624 1009149559 /nfs/dbraw/zinc/14/95/59/1009149559.db2.gz MLKMWHZAOFGVNA-NFBPQSOOSA-N 1 1 362.426 2.772 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]C/C=C\CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001274016800 1009265283 /nfs/dbraw/zinc/26/52/83/1009265283.db2.gz OSVXFBYFUQYXHJ-PKVWGGKHSA-N 1 1 353.422 2.575 20 5 FFBDMO CN(C)c1n[nH]c(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC001179845333 1009469713 /nfs/dbraw/zinc/46/97/13/1009469713.db2.gz OYWYTTOMMLEHRL-UHFFFAOYSA-N 1 1 358.427 2.797 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134871171 1009495886 /nfs/dbraw/zinc/49/58/86/1009495886.db2.gz GYGPZIODBMOILR-SPYBWZPUSA-N 1 1 372.469 2.871 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(S(N)(=O)=O)cc1 ZINC001180178064 1009573889 /nfs/dbraw/zinc/57/38/89/1009573889.db2.gz NATBFHFMYPXFFY-UHFFFAOYSA-N 1 1 363.439 2.653 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(Nc2cccc(C[NH+]3CCOCC3)c2)cc1F ZINC000865478067 1010795775 /nfs/dbraw/zinc/79/57/75/1010795775.db2.gz QWKIRJRWSFLDHS-UHFFFAOYSA-N 1 1 361.373 2.802 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1C(F)F)C2 ZINC000865904636 1010886490 /nfs/dbraw/zinc/88/64/90/1010886490.db2.gz TXZQCIGRRFSNGO-LLVKDONJSA-N 1 1 366.368 2.999 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261086 1010936117 /nfs/dbraw/zinc/93/61/17/1010936117.db2.gz MHIASBXITSYPTA-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261086 1010936120 /nfs/dbraw/zinc/93/61/20/1010936120.db2.gz MHIASBXITSYPTA-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261090 1010936531 /nfs/dbraw/zinc/93/65/31/1010936531.db2.gz MHIASBXITSYPTA-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261090 1010936534 /nfs/dbraw/zinc/93/65/34/1010936534.db2.gz MHIASBXITSYPTA-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000866194334 1010949063 /nfs/dbraw/zinc/94/90/63/1010949063.db2.gz HYXZJRDPSYTAQE-INIZCTEOSA-N 1 1 354.366 2.524 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000866194334 1010949065 /nfs/dbraw/zinc/94/90/65/1010949065.db2.gz HYXZJRDPSYTAQE-INIZCTEOSA-N 1 1 354.366 2.524 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121159806 1011024228 /nfs/dbraw/zinc/02/42/28/1011024228.db2.gz WARWWDLZBUJJCG-HNNXBMFYSA-N 1 1 373.457 2.839 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121159806 1011024236 /nfs/dbraw/zinc/02/42/36/1011024236.db2.gz WARWWDLZBUJJCG-HNNXBMFYSA-N 1 1 373.457 2.839 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCc2c(F)cc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867975809 1011136976 /nfs/dbraw/zinc/13/69/76/1011136976.db2.gz AQXRBYDIERGVBU-SFHVURJKSA-N 1 1 361.348 2.632 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000868309205 1011239739 /nfs/dbraw/zinc/23/97/39/1011239739.db2.gz GWNGTNSAJGSUQM-FUHWJXTLSA-N 1 1 360.458 2.653 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CCN(C3COC3)CC1)CC2 ZINC001172908722 1012080022 /nfs/dbraw/zinc/08/00/22/1012080022.db2.gz YZQBDIUYBRVUFD-GOSISDBHSA-N 1 1 359.470 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](Oc3ncccn3)C1)CC2 ZINC001172914094 1012097717 /nfs/dbraw/zinc/09/77/17/1012097717.db2.gz ZBJPWDCENSRFSD-SJLPKXTDSA-N 1 1 354.410 2.786 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@H]4OCC[C@H]4C3)CC2)c(F)c1 ZINC001173015437 1012187042 /nfs/dbraw/zinc/18/70/42/1012187042.db2.gz QCNRIJFFDAAGMO-YVEFUNNKSA-N 1 1 367.396 2.953 20 5 FFBDMO C[N@@H+](C1CCOCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014972 1012187588 /nfs/dbraw/zinc/18/75/88/1012187588.db2.gz YDOFLXZKSNHSMT-UHFFFAOYSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@](O)(CF)CC2)c1F ZINC001173180162 1012323722 /nfs/dbraw/zinc/32/37/22/1012323722.db2.gz ITYXVFXDQMKBII-YVEFUNNKSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c1F ZINC001173192821 1012334293 /nfs/dbraw/zinc/33/42/93/1012334293.db2.gz NAZMMBDPILMNID-HEHGZKQESA-N 1 1 351.422 2.700 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173192001 1012334356 /nfs/dbraw/zinc/33/43/56/1012334356.db2.gz HELPPXYIOMMGFX-QWHCGFSZSA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)CC[C@@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195485 1012337263 /nfs/dbraw/zinc/33/72/63/1012337263.db2.gz GTSNHUMKQJZTJC-CHWSQXEVSA-N 1 1 368.405 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@]3(CCC(=O)O3)C2)c1F ZINC001173194042 1012337683 /nfs/dbraw/zinc/33/76/83/1012337683.db2.gz XSYAXCPQRMLIOF-KPZWWZAWSA-N 1 1 366.389 2.845 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195697 1012338203 /nfs/dbraw/zinc/33/82/03/1012338203.db2.gz ISOYDZHYXDKQKR-SGTLLEGYSA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195696 1012338594 /nfs/dbraw/zinc/33/85/94/1012338594.db2.gz ISOYDZHYXDKQKR-KZULUSFZSA-N 1 1 368.405 2.949 20 5 FFBDMO CCOC(=O)[C@@]12CCO[C@@H]1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173221867 1012352553 /nfs/dbraw/zinc/35/25/53/1012352553.db2.gz MYGPBFXLOAQLQF-POZUXBRTSA-N 1 1 362.426 2.570 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870905686 1012627717 /nfs/dbraw/zinc/62/77/17/1012627717.db2.gz BWARNVHEVVKUDY-PMACEKPBSA-N 1 1 369.421 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000252692208 1012628697 /nfs/dbraw/zinc/62/86/97/1012628697.db2.gz RHQVSPLPRGBJER-MAUKXSAKSA-N 1 1 355.442 2.851 20 5 FFBDMO CC(C)C[C@@H]1CCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748791890 1017654151 /nfs/dbraw/zinc/65/41/51/1017654151.db2.gz JNHUEIIWJJQIRR-QFBILLFUSA-N 1 1 374.441 2.830 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CNCC2(CCOCC2)C1)C1CC1 ZINC000925798143 1017852342 /nfs/dbraw/zinc/85/23/42/1017852342.db2.gz QRILWMIIILJEPR-ZWKOTPCHSA-N 1 1 359.470 2.664 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)c1 ZINC000801578507 1019133260 /nfs/dbraw/zinc/13/32/60/1019133260.db2.gz HHCDOGBQYHRRNV-FQEVSTJZSA-N 1 1 356.422 3.000 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000929093085 1019270178 /nfs/dbraw/zinc/27/01/78/1019270178.db2.gz YPQMYWPPXTXSDK-AWEZNQCLSA-N 1 1 362.430 2.799 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525051 1020275453 /nfs/dbraw/zinc/27/54/53/1020275453.db2.gz IOBCSDZYZWCUDL-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525051 1020275463 /nfs/dbraw/zinc/27/54/63/1020275463.db2.gz IOBCSDZYZWCUDL-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525051 1020275469 /nfs/dbraw/zinc/27/54/69/1020275469.db2.gz IOBCSDZYZWCUDL-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777952176 1020303716 /nfs/dbraw/zinc/30/37/16/1020303716.db2.gz YRMZERVJORJSEO-HNNXBMFYSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777952176 1020303727 /nfs/dbraw/zinc/30/37/27/1020303727.db2.gz YRMZERVJORJSEO-HNNXBMFYSA-N 1 1 358.398 2.691 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000800566617 1020402215 /nfs/dbraw/zinc/40/22/15/1020402215.db2.gz ZXAYPOOZTFGHQK-QGZVFWFLSA-N 1 1 354.410 2.526 20 5 FFBDMO C[N@@H+](CC1CCCCC1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726585243 1020488316 /nfs/dbraw/zinc/48/83/16/1020488316.db2.gz XOGBJIXIUUTIAD-UHFFFAOYSA-N 1 1 360.414 2.833 20 5 FFBDMO COc1cc([C@H](C)NC2CC[NH+](C[C@@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096360 1020674311 /nfs/dbraw/zinc/67/43/11/1020674311.db2.gz BSSKFJZWTWLEJT-KSSFIOAISA-N 1 1 363.458 2.897 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136306 1020716305 /nfs/dbraw/zinc/71/63/05/1020716305.db2.gz ZNHYRLMITFNVTJ-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136306 1020716314 /nfs/dbraw/zinc/71/63/14/1020716314.db2.gz ZNHYRLMITFNVTJ-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000932195677 1020739429 /nfs/dbraw/zinc/73/94/29/1020739429.db2.gz HLQXLQAAUWOOSP-AWEZNQCLSA-N 1 1 374.466 2.969 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000932195677 1020739436 /nfs/dbraw/zinc/73/94/36/1020739436.db2.gz HLQXLQAAUWOOSP-AWEZNQCLSA-N 1 1 374.466 2.969 20 5 FFBDMO COCC[N@@H+](CCc1ccccc1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749942863 1021152692 /nfs/dbraw/zinc/15/26/92/1021152692.db2.gz CGDAXLVHTUNQSW-UHFFFAOYSA-N 1 1 369.425 2.797 20 5 FFBDMO O=C(OCc1c(F)cc([N+](=O)[O-])cc1F)c1ccn(-c2cc[nH+]cc2)n1 ZINC001117159145 1021593222 /nfs/dbraw/zinc/59/32/22/1021593222.db2.gz UHEXAAMKUOLYQZ-UHFFFAOYSA-N 1 1 360.276 2.811 20 5 FFBDMO Cn1cc(CSCc2ccc(C[NH+]3CCOCC3)cc2)c([N+](=O)[O-])n1 ZINC001119603052 1022887960 /nfs/dbraw/zinc/88/79/60/1022887960.db2.gz FDXVKXKWLIECRR-UHFFFAOYSA-N 1 1 362.455 2.594 20 5 FFBDMO CCc1ccccc1C[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001040699298 1022954921 /nfs/dbraw/zinc/95/49/21/1022954921.db2.gz BLSGNEAULLXIID-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO O=C(OC[C@@H]1CCC[N@@H+]1Cc1ccco1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779229724 1023402495 /nfs/dbraw/zinc/40/24/95/1023402495.db2.gz IDXXCTKCYABAQV-ZDUSSCGKSA-N 1 1 374.349 2.738 20 5 FFBDMO O=C(OC[C@@H]1CCC[N@H+]1Cc1ccco1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779229724 1023402501 /nfs/dbraw/zinc/40/25/01/1023402501.db2.gz IDXXCTKCYABAQV-ZDUSSCGKSA-N 1 1 374.349 2.738 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3ccccn3)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000753971691 1023406936 /nfs/dbraw/zinc/40/69/36/1023406936.db2.gz GTFHOJBKCGPBLP-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO CC(=O)c1ccc(N2CCC(C[N@H+](CCO)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC001120960746 1023545450 /nfs/dbraw/zinc/54/54/50/1023545450.db2.gz XEQBAZMLWKFENN-UHFFFAOYSA-N 1 1 363.458 2.717 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC001125161740 1024421060 /nfs/dbraw/zinc/42/10/60/1024421060.db2.gz GCHLMNHGSFYHAY-KRWDZBQOSA-N 1 1 367.405 2.985 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1c(C)noc1C ZINC000080722268 1024709872 /nfs/dbraw/zinc/70/98/72/1024709872.db2.gz BGUYXWAGLRJDHP-UHFFFAOYSA-N 1 1 362.386 2.669 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCC[N@H+]2C)CC1 ZINC000194740304 1024885948 /nfs/dbraw/zinc/88/59/48/1024885948.db2.gz OYSHSVKINLJFPM-INIZCTEOSA-N 1 1 360.458 2.655 20 5 FFBDMO CCCCC[C@H](C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245431434 1025428920 /nfs/dbraw/zinc/42/89/20/1025428920.db2.gz ASLHPWAQFMSPIC-LSDHHAIUSA-N 1 1 363.462 2.561 20 5 FFBDMO CCCCC[C@H](C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245431434 1025428927 /nfs/dbraw/zinc/42/89/27/1025428927.db2.gz ASLHPWAQFMSPIC-LSDHHAIUSA-N 1 1 363.462 2.561 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccc(C3CC3)cc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160106734 1027593448 /nfs/dbraw/zinc/59/34/48/1027593448.db2.gz AAZXUVFZKZCEAO-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCCC1=CC[N@H+](Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106734 1027593459 /nfs/dbraw/zinc/59/34/59/1027593459.db2.gz AAZXUVFZKZCEAO-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106734 1027593466 /nfs/dbraw/zinc/59/34/66/1027593466.db2.gz AAZXUVFZKZCEAO-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO Cc1ccc(C(=O)N2CC[NH+](CCCOC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC001153382145 1027858368 /nfs/dbraw/zinc/85/83/68/1027858368.db2.gz RYLIKUHWRYNYLU-UHFFFAOYSA-N 1 1 363.458 2.866 20 5 FFBDMO [NH3+]CCc1cn(-c2nc(Cl)nc(Cl)c2[N+](=O)[O-])c2ccncc12 ZINC001160945657 1027935205 /nfs/dbraw/zinc/93/52/05/1027935205.db2.gz HOAWLBCBZKJDLK-UHFFFAOYSA-N 1 1 353.169 2.532 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000249752076 1028295415 /nfs/dbraw/zinc/29/54/15/1028295415.db2.gz RMCCUNUMVXLOET-VXGBXAGGSA-N 1 1 364.402 2.662 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970084 1028372345 /nfs/dbraw/zinc/37/23/45/1028372345.db2.gz STBUNPQDMIGMGZ-SJKOYZFVSA-N 1 1 366.368 2.695 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970084 1028372366 /nfs/dbraw/zinc/37/23/66/1028372366.db2.gz STBUNPQDMIGMGZ-SJKOYZFVSA-N 1 1 366.368 2.695 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCc5ccccc5[C@H]4C3)cnc2c1 ZINC001155091026 1028575131 /nfs/dbraw/zinc/57/51/31/1028575131.db2.gz ICCDEQCWROTWFE-LJQANCHMSA-N 1 1 361.405 2.957 20 5 FFBDMO CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1cnc2cc([N+](=O)[O-])ccc2n1 ZINC001162877566 1028691236 /nfs/dbraw/zinc/69/12/36/1028691236.db2.gz JRZYOBTXSGTPRT-INIZCTEOSA-N 1 1 359.430 2.697 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000780764283 1028799687 /nfs/dbraw/zinc/79/96/87/1028799687.db2.gz JLBRHAZZYOKAOU-QUCCMNQESA-N 1 1 366.421 2.915 20 5 FFBDMO C[NH+](C)C=Cc1cc(N[C@@H]2CCc3[nH]c(=O)ccc3C2)ncc1[N+](=O)[O-] ZINC001155767043 1028903532 /nfs/dbraw/zinc/90/35/32/1028903532.db2.gz MTFNVCPPGWBGBW-HSBSLETESA-N 1 1 355.398 2.592 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC001156315423 1029140741 /nfs/dbraw/zinc/14/07/41/1029140741.db2.gz NXTNGQSYPIWZKE-CGTJXYLNSA-N 1 1 354.410 2.551 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC001156318186 1029143787 /nfs/dbraw/zinc/14/37/87/1029143787.db2.gz QBMZISQPEFCCKX-KZNAEPCWSA-N 1 1 368.437 2.859 20 5 FFBDMO COc1nc(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001165090376 1029380001 /nfs/dbraw/zinc/38/00/01/1029380001.db2.gz YTJKYOBRZMZPII-RDJZCZTQSA-N 1 1 354.410 2.709 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2nccc(Cl)c2[N+](=O)[O-])CC1 ZINC001165109742 1029396777 /nfs/dbraw/zinc/39/67/77/1029396777.db2.gz VODMXHLWUARQNZ-ZDUSSCGKSA-N 1 1 354.838 2.723 20 5 FFBDMO Cc1cc(N2C[C@H]3CCC[N@H+](C)[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001157270516 1029530845 /nfs/dbraw/zinc/53/08/45/1029530845.db2.gz FQNLTHLAWWVORS-NVXWUHKLSA-N 1 1 353.426 2.891 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ncc([N+](=O)[O-])c3ccccc31)CC2 ZINC001166032594 1030213877 /nfs/dbraw/zinc/21/38/77/1030213877.db2.gz JMNIQQQQOHJFBF-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000783999413 1030405710 /nfs/dbraw/zinc/40/57/10/1030405710.db2.gz FCDFRMUGDPGMHU-OAHLLOKOSA-N 1 1 374.441 2.728 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000784030766 1030428908 /nfs/dbraw/zinc/42/89/08/1030428908.db2.gz WPHDXHUCBPLLEA-INIZCTEOSA-N 1 1 371.372 2.898 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](Oc3cccc(F)c3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000784030766 1030428917 /nfs/dbraw/zinc/42/89/17/1030428917.db2.gz WPHDXHUCBPLLEA-INIZCTEOSA-N 1 1 371.372 2.898 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000784513614 1030658131 /nfs/dbraw/zinc/65/81/31/1030658131.db2.gz DDZYBDXMQZMUAH-INIZCTEOSA-N 1 1 374.485 2.611 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000842617359 1030828967 /nfs/dbraw/zinc/82/89/67/1030828967.db2.gz QTAMDODYNQECMD-BBRMVZONSA-N 1 1 358.398 2.585 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000797518721 1031142062 /nfs/dbraw/zinc/14/20/62/1031142062.db2.gz JVESFNRJPXSNRX-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000797518721 1031142069 /nfs/dbraw/zinc/14/20/69/1031142069.db2.gz JVESFNRJPXSNRX-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO Cc1cc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cs1 ZINC001115530705 1031786556 /nfs/dbraw/zinc/78/65/56/1031786556.db2.gz MOPQLXMRKWLRNB-HUUCEWRRSA-N 1 1 351.472 2.630 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2ccnc(OC(F)F)c2)c1[N+](=O)[O-] ZINC001205758343 1031978642 /nfs/dbraw/zinc/97/86/42/1031978642.db2.gz OKRNIDIQGCXOBY-UHFFFAOYSA-N 1 1 355.297 2.595 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830189215 1033501140 /nfs/dbraw/zinc/50/11/40/1033501140.db2.gz BZTABLROWSTWDL-BFHYXJOUSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830189215 1033501146 /nfs/dbraw/zinc/50/11/46/1033501146.db2.gz BZTABLROWSTWDL-BFHYXJOUSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccnc(C[NH+](C)C)c1)c1ccccc1[N+](=O)[O-] ZINC001219714971 1033784827 /nfs/dbraw/zinc/78/48/27/1033784827.db2.gz FOSRBENWYHTPMT-CYBMUJFWSA-N 1 1 357.414 2.977 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000831563144 1034125720 /nfs/dbraw/zinc/12/57/20/1034125720.db2.gz KTBWLYMTUQILBV-XBFCOCLRSA-N 1 1 371.359 2.998 20 5 FFBDMO C[NH+](C)Cc1ncccc1O[C@H]1CCN(c2c(F)cccc2[N+](=O)[O-])C1 ZINC001225279608 1034189303 /nfs/dbraw/zinc/18/93/03/1034189303.db2.gz ZKHUOLGFSQNNPI-ZDUSSCGKSA-N 1 1 360.389 2.848 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ncc(Br)cc1[N+](=O)[O-] ZINC001225750604 1034395109 /nfs/dbraw/zinc/39/51/09/1034395109.db2.gz ONBIBQHOMOPXBJ-IWIIMEHWSA-N 1 1 356.220 2.861 20 5 FFBDMO COc1ccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001225773462 1034404768 /nfs/dbraw/zinc/40/47/68/1034404768.db2.gz WQXCNZARSJJISW-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO C[C@H](c1ccccn1)[N@@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111663 1034939281 /nfs/dbraw/zinc/93/92/81/1034939281.db2.gz PUWPBLMGGHSKQI-OCCSQVGLSA-N 1 1 373.369 2.897 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111663 1034939290 /nfs/dbraw/zinc/93/92/90/1034939290.db2.gz PUWPBLMGGHSKQI-OCCSQVGLSA-N 1 1 373.369 2.897 20 5 FFBDMO c1cnc(N2CC[NH+](Cc3ccc4ccc5cccnc5c4n3)CC2)nc1 ZINC001232219369 1035504411 /nfs/dbraw/zinc/50/44/11/1035504411.db2.gz QNAFAPUMKFFLSI-UHFFFAOYSA-N 1 1 356.433 2.895 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CCCO1 ZINC001232229015 1035507358 /nfs/dbraw/zinc/50/73/58/1035507358.db2.gz XJLDTPBJLSRDAM-KRWDZBQOSA-N 1 1 351.406 2.547 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001203067778 1036177469 /nfs/dbraw/zinc/17/74/69/1036177469.db2.gz NKQWQZWPUKKNRV-OAHLLOKOSA-N 1 1 361.446 2.639 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001229451112 1036682569 /nfs/dbraw/zinc/68/25/69/1036682569.db2.gz CLNDFBVGOXSLEW-BJWYYQGGSA-N 1 1 355.394 2.803 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001233708645 1036725768 /nfs/dbraw/zinc/72/57/68/1036725768.db2.gz XPLUVRRMPBQNAI-MRXNPFEDSA-N 1 1 373.365 2.783 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1Cc1nnc(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258080210 1039157506 /nfs/dbraw/zinc/15/75/06/1039157506.db2.gz GLRVDWAVDKVLQD-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1Cc1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258080210 1039157519 /nfs/dbraw/zinc/15/75/19/1039157519.db2.gz GLRVDWAVDKVLQD-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCOC[C@@]3(CCC[NH2+]C3)C1)CC2 ZINC001246633206 1039423711 /nfs/dbraw/zinc/42/37/11/1039423711.db2.gz FBRQXYUKSPNGEI-UYAOXDASSA-N 1 1 359.470 2.544 20 5 FFBDMO C[C@@H]1C[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H](C)N1 ZINC001246969526 1039554396 /nfs/dbraw/zinc/55/43/96/1039554396.db2.gz QHLXTTVQUBCCGQ-VXGBXAGGSA-N 1 1 354.401 2.524 20 5 FFBDMO COc1cnc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c(C)c1 ZINC001248212757 1040176353 /nfs/dbraw/zinc/17/63/53/1040176353.db2.gz ZJDKNHFDEQLKEM-AWEZNQCLSA-N 1 1 355.354 2.599 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(C(=O)c3ccco3)C[C@H]2C1 ZINC001254555571 1040793994 /nfs/dbraw/zinc/79/39/94/1040793994.db2.gz HQWUWMNBOACOIZ-BHYGNILZSA-N 1 1 369.421 2.823 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CCN(c3ncccn3)C[C@H]2C1 ZINC001254561448 1040799630 /nfs/dbraw/zinc/79/96/30/1040799630.db2.gz KXRQLXJMGYKZHG-NXHRZFHOSA-N 1 1 367.453 2.774 20 5 FFBDMO Cc1cc(C)nc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC001254563551 1040802148 /nfs/dbraw/zinc/80/21/48/1040802148.db2.gz YJANZIXRSUEYLZ-MRXNPFEDSA-N 1 1 355.442 2.755 20 5 FFBDMO COc1ccnc(O[C@@H]2CCC[N@H+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254567330 1040804379 /nfs/dbraw/zinc/80/43/79/1040804379.db2.gz BPDGQZPBHQOSIN-GOEBONIOSA-N 1 1 372.425 2.868 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H](F)[C@](O)(C(F)(F)F)CC1)C2 ZINC001254593147 1040822660 /nfs/dbraw/zinc/82/26/60/1040822660.db2.gz JJDFGGVOJIHBJZ-ILXRZTDVSA-N 1 1 362.323 2.789 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254603011 1040832689 /nfs/dbraw/zinc/83/26/89/1040832689.db2.gz KEWJFWCNLPTEEC-IBGZPJMESA-N 1 1 352.390 2.907 20 5 FFBDMO Cc1cc(O[C@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ncn1 ZINC001254610332 1040839249 /nfs/dbraw/zinc/83/92/49/1040839249.db2.gz JQOQRMZIKMLXIF-MSOLQXFVSA-N 1 1 354.410 2.704 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001265557690 1042866206 /nfs/dbraw/zinc/86/62/06/1042866206.db2.gz XVXVSJPCYYFBNB-KSSFIOAISA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CC[C@@H](SC)C1 ZINC001319541072 1045188244 /nfs/dbraw/zinc/18/82/44/1045188244.db2.gz LTGIBLHBTVUFFE-DGCLKSJQSA-N 1 1 353.444 2.758 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(Cc3ccc([N+](=O)[O-])cc3Br)C2)C1 ZINC001324370988 1045993508 /nfs/dbraw/zinc/99/35/08/1045993508.db2.gz PTEIRRGHEXUIKZ-OAHLLOKOSA-N 1 1 354.248 2.885 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@H](O)CC2(CCOCC2)C1 ZINC001331564104 1048007720 /nfs/dbraw/zinc/00/77/20/1048007720.db2.gz BXHLYWQPYFCDLL-CQSZACIVSA-N 1 1 374.359 2.977 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001327891850 1048084553 /nfs/dbraw/zinc/08/45/53/1048084553.db2.gz PFMQLQZQQWDLQM-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO CC(C)(C[NH+]1CCOCC1)Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001330059270 1049023114 /nfs/dbraw/zinc/02/31/14/1049023114.db2.gz KOUVUVRERBFYRN-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])[C@H](C)C1 ZINC001333706604 1049067944 /nfs/dbraw/zinc/06/79/44/1049067944.db2.gz KAQGKDNDLBUIAW-UKRRQHHQSA-N 1 1 358.442 2.613 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccncc3[N+](=O)[O-])C2)O1 ZINC001330829254 1049350876 /nfs/dbraw/zinc/35/08/76/1049350876.db2.gz JRXKTHHIRXNDMR-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC001296127554 1050027060 /nfs/dbraw/zinc/02/70/60/1050027060.db2.gz PXDUFTHJAOBMBH-QGZVFWFLSA-N 1 1 374.485 2.800 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc([N+](=O)[O-])c1 ZINC001298366314 1050424626 /nfs/dbraw/zinc/42/46/26/1050424626.db2.gz HYEMNIFVENNPRN-BWTSREIZSA-N 1 1 351.406 2.763 20 5 FFBDMO O=C1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CCCCCN1 ZINC001342351004 1050944559 /nfs/dbraw/zinc/94/45/59/1050944559.db2.gz YXIWEYSFNXPESD-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC001542315576 1071207486 /nfs/dbraw/zinc/20/74/86/1071207486.db2.gz DQLAUSHADASBGK-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO CC[C@H]1CN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC)CC[N@H+]1Cc1ccccc1 ZINC001341001128 1051337525 /nfs/dbraw/zinc/33/75/25/1051337525.db2.gz DEKJDMXFUGJNMI-WBVHZDCISA-N 1 1 372.473 2.737 20 5 FFBDMO Cc1nnc(N2CCc3ccc([N+](=O)[O-])cc3C2)n1CCC[N@H+](C)C(C)C ZINC001304832999 1051729112 /nfs/dbraw/zinc/72/91/12/1051729112.db2.gz OEVDSDBLOFVVRZ-UHFFFAOYSA-N 1 1 372.473 2.788 20 5 FFBDMO C[C@H]1CCC[C@H](C[N@@H+](C)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001307851204 1052356979 /nfs/dbraw/zinc/35/69/79/1052356979.db2.gz MKCMRTSWOQVGEZ-GJZGRUSLSA-N 1 1 369.487 2.631 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001307986405 1052376884 /nfs/dbraw/zinc/37/68/84/1052376884.db2.gz GGPADQXMNNINOX-KBPBESRZSA-N 1 1 365.430 2.961 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001308052647 1052394775 /nfs/dbraw/zinc/39/47/75/1052394775.db2.gz URLYGRNCCUOXBR-CYBMUJFWSA-N 1 1 374.397 2.810 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC001308100112 1052406098 /nfs/dbraw/zinc/40/60/98/1052406098.db2.gz VYHZQXIUZFJMQB-GOSISDBHSA-N 1 1 356.382 2.678 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CC[NH+]([C@H]2CCOC2)CC1 ZINC001336797218 1054234077 /nfs/dbraw/zinc/23/40/77/1054234077.db2.gz KGQGSWONGZWGFH-ZDUSSCGKSA-N 1 1 362.817 2.707 20 5 FFBDMO C/C(=C/C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178622 1055187480 /nfs/dbraw/zinc/18/74/80/1055187480.db2.gz RCUCLXAVXKHRCA-DRXRFOTISA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C/C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178622 1055187484 /nfs/dbraw/zinc/18/74/84/1055187484.db2.gz RCUCLXAVXKHRCA-DRXRFOTISA-N 1 1 361.442 2.612 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000847253515 1055319848 /nfs/dbraw/zinc/31/98/48/1055319848.db2.gz GUJLENLJUISXIK-KGLIPLIRSA-N 1 1 362.386 2.558 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])cn1 ZINC001544175405 1071607451 /nfs/dbraw/zinc/60/74/51/1071607451.db2.gz FYOVFLLJXZGMKB-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc2ccccc2c1[N+](=O)[O-] ZINC001544237542 1071617190 /nfs/dbraw/zinc/61/71/90/1071617190.db2.gz JLCYKGFSRZCSPM-JKSUJKDBSA-N 1 1 354.410 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc(CCCCNc2nc(N3CCOCC3)cc[nH+]2)cc1 ZINC000610909087 1056440123 /nfs/dbraw/zinc/44/01/23/1056440123.db2.gz CIHDLHOMXVDVSY-UHFFFAOYSA-N 1 1 357.414 2.656 20 5 FFBDMO C[C@H](c1nnc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)n1C)[N+](=O)[O-] ZINC001339541941 1056565231 /nfs/dbraw/zinc/56/52/31/1056565231.db2.gz NGULZRXXTDXTFV-LSDHHAIUSA-N 1 1 364.494 2.634 20 5 FFBDMO CCn1c(-c2cc(C)cc([N+](=O)[O-])c2)nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC001339653788 1056680794 /nfs/dbraw/zinc/68/07/94/1056680794.db2.gz OVKYOZOWNKJVRV-PBHICJAKSA-N 1 1 370.457 2.712 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC001446876529 1058567114 /nfs/dbraw/zinc/56/71/14/1058567114.db2.gz ASZMQHQSRFOHSX-LSDHHAIUSA-N 1 1 351.834 2.924 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001454899644 1059642497 /nfs/dbraw/zinc/64/24/97/1059642497.db2.gz KTNUDDFWFFEMSN-RVKKMQEKSA-N 1 1 363.458 2.653 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001454899644 1059642508 /nfs/dbraw/zinc/64/25/08/1059642508.db2.gz KTNUDDFWFFEMSN-RVKKMQEKSA-N 1 1 363.458 2.653 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848478910 1060110340 /nfs/dbraw/zinc/11/03/40/1060110340.db2.gz OLBKVWSTNFFWAH-YJBOKZPZSA-N 1 1 361.442 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC(O[C@@H]3CCOC3)CC2)c1 ZINC000848480994 1060114285 /nfs/dbraw/zinc/11/42/85/1060114285.db2.gz UHAGAFFZDUWSTM-QGZVFWFLSA-N 1 1 372.425 2.686 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000848584804 1060314180 /nfs/dbraw/zinc/31/41/80/1060314180.db2.gz ISXIXAZOMNXWMO-DOMZBBRYSA-N 1 1 369.368 2.509 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2[C@@H]2C[C@@H]2C)C[C@H]1C ZINC001547710940 1071990497 /nfs/dbraw/zinc/99/04/97/1071990497.db2.gz QINNQVQIPAHICD-JJRVBVJISA-N 1 1 370.457 2.965 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000848783915 1060690316 /nfs/dbraw/zinc/69/03/16/1060690316.db2.gz GKAJAKWLSTVLHX-ZIAGYGMSSA-N 1 1 364.402 2.733 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2c(C)cncc2[N+](=O)[O-])C1 ZINC001476375828 1061402275 /nfs/dbraw/zinc/40/22/75/1061402275.db2.gz MKJMCXBUJJEHJC-AWEZNQCLSA-N 1 1 363.462 2.742 20 5 FFBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC001463227668 1062005825 /nfs/dbraw/zinc/00/58/25/1062005825.db2.gz JMEYBTYRVLQXFF-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO Cc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@@H]1CC[N@H+](C2CC2)C1 ZINC001492781986 1062205699 /nfs/dbraw/zinc/20/56/99/1062205699.db2.gz SUFLVHPTPFYAKR-OAHLLOKOSA-N 1 1 370.457 2.615 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC2)cc1 ZINC001463909656 1062327564 /nfs/dbraw/zinc/32/75/64/1062327564.db2.gz WHUWTIQSYKENGA-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH+]([C@@H](C)c3ccccc3)CC2)n1 ZINC001531079272 1062691806 /nfs/dbraw/zinc/69/18/06/1062691806.db2.gz QHIKHVMWINJMGL-HNNXBMFYSA-N 1 1 354.410 2.817 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC001439893216 1063229136 /nfs/dbraw/zinc/22/91/36/1063229136.db2.gz XFVRJEQDXLFUNF-MRXNPFEDSA-N 1 1 360.458 2.799 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c1C ZINC001441049562 1063390719 /nfs/dbraw/zinc/39/07/19/1063390719.db2.gz NPTSHPMDNCHNBV-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCc3ccccc3C2)c1C ZINC001441049562 1063390735 /nfs/dbraw/zinc/39/07/35/1063390735.db2.gz NPTSHPMDNCHNBV-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO C[C@]([NH3+])(C(=O)Nc1cc(F)c(F)c(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC001576085171 1078193842 /nfs/dbraw/zinc/19/38/42/1078193842.db2.gz JKGJPANJGZFDQJ-OAHLLOKOSA-N 1 1 357.263 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H]3COC[C@@]3(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001473786994 1065360311 /nfs/dbraw/zinc/36/03/11/1065360311.db2.gz VZYISALSVTWYIS-QFBILLFUSA-N 1 1 369.377 2.903 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2cncn2C(C)(C)C)C1 ZINC001473896408 1065411613 /nfs/dbraw/zinc/41/16/13/1065411613.db2.gz CLRUBLVNMLXSDX-OAHLLOKOSA-N 1 1 360.462 2.931 20 5 FFBDMO O=C(NCC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)OCc1ccccc1 ZINC001474757138 1065597831 /nfs/dbraw/zinc/59/78/31/1065597831.db2.gz HTQVCNZTIVFGLR-UHFFFAOYSA-N 1 1 370.365 2.752 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001474834553 1065620322 /nfs/dbraw/zinc/62/03/22/1065620322.db2.gz NENKCEXUSSJMJW-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)NC[C@@H]2CC[N@@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938752 1079406650 /nfs/dbraw/zinc/40/66/50/1079406650.db2.gz NWNLDZDCWCZDDH-ZFWWWQNUSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938752 1079406655 /nfs/dbraw/zinc/40/66/55/1079406655.db2.gz NWNLDZDCWCZDDH-ZFWWWQNUSA-N 1 1 369.425 2.597 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001585139409 1079430412 /nfs/dbraw/zinc/43/04/12/1079430412.db2.gz VXFPLIDFBVSEOH-AWEZNQCLSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001585139409 1079430415 /nfs/dbraw/zinc/43/04/15/1079430415.db2.gz VXFPLIDFBVSEOH-AWEZNQCLSA-N 1 1 351.472 2.876 20 5 FFBDMO CCOc1cc(N2CCC(C[N@@H+](CCO)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001559285570 1076145978 /nfs/dbraw/zinc/14/59/78/1076145978.db2.gz SMOVVBNSYWYYBF-UHFFFAOYSA-N 1 1 365.474 2.913 20 5 FFBDMO CN(C(=O)C[N@@H+]1C[C@@H]2C[C@]2(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001560137669 1076233380 /nfs/dbraw/zinc/23/33/80/1076233380.db2.gz IHSSAOKJMAERPI-OXJNMPFZSA-N 1 1 351.406 2.831 20 5 FFBDMO CN(C(=O)C[N@H+]1C[C@@H]2C[C@]2(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001560137669 1076233385 /nfs/dbraw/zinc/23/33/85/1076233385.db2.gz IHSSAOKJMAERPI-OXJNMPFZSA-N 1 1 351.406 2.831 20 5 FFBDMO CCOc1cccnc1N1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC001560144540 1076235101 /nfs/dbraw/zinc/23/51/01/1076235101.db2.gz FNLPENZAYNCADQ-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO CCOc1cc(C[NH2+][C@@](C)(CC(=O)OC)c2cccnc2)ccc1[N+](=O)[O-] ZINC001560244012 1076255883 /nfs/dbraw/zinc/25/58/83/1076255883.db2.gz BOPWUUVBZNVZLT-IBGZPJMESA-N 1 1 373.409 2.957 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001561125502 1076335978 /nfs/dbraw/zinc/33/59/78/1076335978.db2.gz OFODQQJLNSKUAQ-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001566550705 1076967643 /nfs/dbraw/zinc/96/76/43/1076967643.db2.gz RWPIHIFOSKZNBZ-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001566550705 1076967649 /nfs/dbraw/zinc/96/76/49/1076967649.db2.gz RWPIHIFOSKZNBZ-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001566550705 1076967653 /nfs/dbraw/zinc/96/76/53/1076967653.db2.gz RWPIHIFOSKZNBZ-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO O=C(NC/C=C/C[NH2+]Cc1ccc(C2CCCC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001568847929 1077114209 /nfs/dbraw/zinc/11/42/09/1077114209.db2.gz BRYOGUQCAFBCDH-DUFJLWIISA-N 1 1 357.454 2.771 20 5 FFBDMO CCC1([NH2+]CCCC2CCCC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570254770 1077193231 /nfs/dbraw/zinc/19/32/31/1077193231.db2.gz CMQIXXHSBQTDDD-IAGOWNOFSA-N 1 1 351.491 2.983 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590050732 1080979788 /nfs/dbraw/zinc/97/97/88/1080979788.db2.gz OMVDNBFKSNMSAH-SJCJKPOMSA-N 1 1 368.397 2.501 20 5 FFBDMO COCC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H](C)C(N)=O ZINC000093137494 250019486 /nfs/dbraw/zinc/01/94/86/250019486.db2.gz UXLNMRKMPKTKNU-LBPRGKRZSA-N 1 1 363.439 2.646 20 5 FFBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H](C)C(N)=O ZINC000093137494 250019490 /nfs/dbraw/zinc/01/94/90/250019490.db2.gz UXLNMRKMPKTKNU-LBPRGKRZSA-N 1 1 363.439 2.646 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1)[NH+]1CCOCC1 ZINC000106450081 250271941 /nfs/dbraw/zinc/27/19/41/250271941.db2.gz YJCLUDWMZCPSPB-CYBMUJFWSA-N 1 1 370.409 2.823 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000117286075 250340977 /nfs/dbraw/zinc/34/09/77/250340977.db2.gz KWXLEOBVXDJZHO-CQSZACIVSA-N 1 1 363.458 2.685 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000117286075 250340980 /nfs/dbraw/zinc/34/09/80/250340980.db2.gz KWXLEOBVXDJZHO-CQSZACIVSA-N 1 1 363.458 2.685 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCc1ccccn1 ZINC000153103516 251103053 /nfs/dbraw/zinc/10/30/53/251103053.db2.gz MQMGZEPPOWSCPH-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](CCn4cc([N+](=O)[O-])cn4)C3)nc2c1 ZINC000181141406 251246293 /nfs/dbraw/zinc/24/62/93/251246293.db2.gz BONVUXFTVZULTM-CQSZACIVSA-N 1 1 354.414 2.856 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000181188318 251256534 /nfs/dbraw/zinc/25/65/34/251256534.db2.gz QOTVUNXNUTWXRY-UKRRQHHQSA-N 1 1 354.410 2.570 20 5 FFBDMO COc1ccc(CNC(=O)[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000267370871 251335803 /nfs/dbraw/zinc/33/58/03/251335803.db2.gz RTWQFHZLWGWJNU-HNNXBMFYSA-N 1 1 361.442 2.874 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000267393902 251343380 /nfs/dbraw/zinc/34/33/80/251343380.db2.gz DQQGAAWRIWKCNK-LBPRGKRZSA-N 1 1 364.398 2.625 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000267393902 251343384 /nfs/dbraw/zinc/34/33/84/251343384.db2.gz DQQGAAWRIWKCNK-LBPRGKRZSA-N 1 1 364.398 2.625 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268762098 251375957 /nfs/dbraw/zinc/37/59/57/251375957.db2.gz VXVQZUPDSLNRKU-OAHLLOKOSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000272415058 252033439 /nfs/dbraw/zinc/03/34/39/252033439.db2.gz GAXDPHAGXPFEKE-QMTHXVAHSA-N 1 1 357.332 2.780 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000272565358 252069727 /nfs/dbraw/zinc/06/97/27/252069727.db2.gz UVKGOPXUJGZQFV-MSOLQXFVSA-N 1 1 374.441 2.593 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1=CC[N@@H+](C)CC1 ZINC000272919579 252166027 /nfs/dbraw/zinc/16/60/27/252166027.db2.gz KDJLTXBRAVCWPJ-CQSZACIVSA-N 1 1 358.442 2.575 20 5 FFBDMO CS(=O)(=O)c1cccc(Cl)c1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000273372698 252291601 /nfs/dbraw/zinc/29/16/01/252291601.db2.gz DANAMGWNKCNCNA-UHFFFAOYSA-N 1 1 368.842 2.984 20 5 FFBDMO C[C@H]1C[C@H]1c1ccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273467564 252312819 /nfs/dbraw/zinc/31/28/19/252312819.db2.gz IOGKGTBLISJIFO-BLLLJJGKSA-N 1 1 364.423 2.875 20 5 FFBDMO CC(C)N1CCC([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000275449904 256008168 /nfs/dbraw/zinc/00/81/68/256008168.db2.gz IHYNJOJLCIQHCX-UHFFFAOYSA-N 1 1 366.437 2.867 20 5 FFBDMO CC(C)N1CCC([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000275449904 256008170 /nfs/dbraw/zinc/00/81/70/256008170.db2.gz IHYNJOJLCIQHCX-UHFFFAOYSA-N 1 1 366.437 2.867 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H](CO)c1ccccc1 ZINC000275450062 256008407 /nfs/dbraw/zinc/00/84/07/256008407.db2.gz ILJJFFKBCDRWJV-QGZVFWFLSA-N 1 1 361.373 2.728 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278504562 256319661 /nfs/dbraw/zinc/31/96/61/256319661.db2.gz XOJUONGMHDMJPW-UHFFFAOYSA-N 1 1 362.352 2.556 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000278770809 256346503 /nfs/dbraw/zinc/34/65/03/256346503.db2.gz WMHIDPWXJUOWTC-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279139853 256386335 /nfs/dbraw/zinc/38/63/35/256386335.db2.gz RUWGNTQPUYSACH-BEFAXECRSA-N 1 1 360.502 2.933 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279139859 256386440 /nfs/dbraw/zinc/38/64/40/256386440.db2.gz RUWGNTQPUYSACH-KXBFYZLASA-N 1 1 360.502 2.933 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@H]1C[C@H](C)O ZINC000286210660 257025878 /nfs/dbraw/zinc/02/58/78/257025878.db2.gz YHLMSFCRRCQTDN-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000289361358 257276855 /nfs/dbraw/zinc/27/68/55/257276855.db2.gz IUZROJNCUNGLLD-GFCCVEGCSA-N 1 1 362.817 2.974 20 5 FFBDMO O=C(CC[N@H+]1CCC2(C1)Oc1ccccc1O2)Nc1ccccc1[N+](=O)[O-] ZINC000289153330 257261196 /nfs/dbraw/zinc/26/11/96/257261196.db2.gz ZVCWNLMNYZMFSI-UHFFFAOYSA-N 1 1 369.377 2.797 20 5 FFBDMO Cc1cc(N2CCN(CCOC(C)C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302188316 258093753 /nfs/dbraw/zinc/09/37/53/258093753.db2.gz QHSZDUQMVSOHID-UHFFFAOYSA-N 1 1 358.442 2.998 20 5 FFBDMO Cc1cc(N[C@H](C)CCN2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302299919 258098830 /nfs/dbraw/zinc/09/88/30/258098830.db2.gz YGQWKKKCNDKVAA-CQSZACIVSA-N 1 1 357.458 2.889 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[C@@H](C)C1 ZINC000302438391 258101862 /nfs/dbraw/zinc/10/18/62/258101862.db2.gz MRQSALZXLUXKPU-GJZGRUSLSA-N 1 1 356.426 2.548 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1CC(C)(C)O ZINC000302474729 258103068 /nfs/dbraw/zinc/10/30/68/258103068.db2.gz DQPDCHALEXMLFJ-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000302499712 258104209 /nfs/dbraw/zinc/10/42/09/258104209.db2.gz CKESUNQWEXYVJK-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO C[C@@H]1CCC[N@@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000302675008 258107726 /nfs/dbraw/zinc/10/77/26/258107726.db2.gz UBQLRKONEYZTJT-CYBMUJFWSA-N 1 1 369.487 2.921 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000302675008 258107727 /nfs/dbraw/zinc/10/77/27/258107727.db2.gz UBQLRKONEYZTJT-CYBMUJFWSA-N 1 1 369.487 2.921 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302772840 258110341 /nfs/dbraw/zinc/11/03/41/258110341.db2.gz NOBVUFNJDONXBR-BBRMVZONSA-N 1 1 370.409 2.851 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000301535392 258054221 /nfs/dbraw/zinc/05/42/21/258054221.db2.gz MIILFYOEYCHGDO-NSHDSACASA-N 1 1 357.252 2.920 20 5 FFBDMO C[C@@H](CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[N@@H+](C)Cc1ccccc1 ZINC000301687247 258063041 /nfs/dbraw/zinc/06/30/41/258063041.db2.gz MDMPJSCWLJRJFR-ZDUSSCGKSA-N 1 1 370.409 2.858 20 5 FFBDMO Cc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000301719978 258065096 /nfs/dbraw/zinc/06/50/96/258065096.db2.gz MDEMIHVKTZXYHK-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000302026043 258082875 /nfs/dbraw/zinc/08/28/75/258082875.db2.gz QESNTFOPOKRJRF-CYBMUJFWSA-N 1 1 370.409 2.858 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(Br)cc1[N+](=O)[O-] ZINC000332228246 258220024 /nfs/dbraw/zinc/22/00/24/258220024.db2.gz CQYPJFWXOBIUPW-STQMWFEESA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000332406710 258229393 /nfs/dbraw/zinc/22/93/93/258229393.db2.gz PLRHESALHOOEQA-UHFFFAOYSA-N 1 1 364.352 2.784 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000331757815 258199411 /nfs/dbraw/zinc/19/94/11/258199411.db2.gz BDRCIYKNQRZUME-MCIONIFRSA-N 1 1 363.462 2.919 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N[C@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000409846847 512154040 /nfs/dbraw/zinc/15/40/40/512154040.db2.gz UZVNPMVPOBKLHE-BBRMVZONSA-N 1 1 355.394 2.885 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CCc2ccccc2C1 ZINC000032017890 506224890 /nfs/dbraw/zinc/22/48/90/506224890.db2.gz NPLMEFLLKRIHTQ-UHFFFAOYSA-N 1 1 371.462 2.861 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCc2ccccc2C1 ZINC000032017890 506224894 /nfs/dbraw/zinc/22/48/94/506224894.db2.gz NPLMEFLLKRIHTQ-UHFFFAOYSA-N 1 1 371.462 2.861 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000369067507 512212316 /nfs/dbraw/zinc/21/23/16/512212316.db2.gz USRJVVZUWMHKQS-CQSZACIVSA-N 1 1 369.425 2.527 20 5 FFBDMO CCc1cc(NCCC[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000053548410 506401586 /nfs/dbraw/zinc/40/15/86/506401586.db2.gz ODLADPSCQSTGQV-UHFFFAOYSA-N 1 1 371.441 2.748 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)CC[N@@H+](C)C1CCCCC1 ZINC000065971466 506402898 /nfs/dbraw/zinc/40/28/98/506402898.db2.gz BOGLUURDOVEIJP-UHFFFAOYSA-N 1 1 369.487 2.788 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000054122171 506494358 /nfs/dbraw/zinc/49/43/58/506494358.db2.gz UIFYEWYDCJIWOY-UHFFFAOYSA-N 1 1 372.400 2.785 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000054122171 506494366 /nfs/dbraw/zinc/49/43/66/506494366.db2.gz UIFYEWYDCJIWOY-UHFFFAOYSA-N 1 1 372.400 2.785 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000054226575 506518142 /nfs/dbraw/zinc/51/81/42/506518142.db2.gz MRCQQNKSHFJBPX-WBVHZDCISA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000055407449 506745913 /nfs/dbraw/zinc/74/59/13/506745913.db2.gz LRWSJRJSWLXWFO-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO O=C(c1csc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000055643937 506811223 /nfs/dbraw/zinc/81/12/23/506811223.db2.gz OZKRSSSZJVZUHP-UHFFFAOYSA-N 1 1 351.453 2.718 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000067613954 506949960 /nfs/dbraw/zinc/94/99/60/506949960.db2.gz MLCZVEMQGLYNPM-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000067613954 506949968 /nfs/dbraw/zinc/94/99/68/506949968.db2.gz MLCZVEMQGLYNPM-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000018110460 507139155 /nfs/dbraw/zinc/13/91/55/507139155.db2.gz MJMAVAXIEDAMPR-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822305 507268981 /nfs/dbraw/zinc/26/89/81/507268981.db2.gz VZQZUJHQTLYBMQ-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO Cc1c(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000047355348 507315221 /nfs/dbraw/zinc/31/52/21/507315221.db2.gz QNGUTOBORQFJEW-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000047866226 507403633 /nfs/dbraw/zinc/40/36/33/507403633.db2.gz HOFNSEAIALWSOZ-JTQLQIEISA-N 1 1 358.345 2.660 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000050029343 507653107 /nfs/dbraw/zinc/65/31/07/507653107.db2.gz XAMJLEZELYOHFP-IBGZPJMESA-N 1 1 368.437 2.788 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000027700904 507678921 /nfs/dbraw/zinc/67/89/21/507678921.db2.gz IHALLOJGAWKNBS-QGZVFWFLSA-N 1 1 360.410 2.654 20 5 FFBDMO COc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000072772024 507851344 /nfs/dbraw/zinc/85/13/44/507851344.db2.gz MXCKZZLWLULZGD-ZDUSSCGKSA-N 1 1 357.410 2.765 20 5 FFBDMO CN(C(=O)C[N@H+](C)[C@@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000072772680 507851649 /nfs/dbraw/zinc/85/16/49/507851649.db2.gz QNRSYICVJHEMIT-SFHVURJKSA-N 1 1 357.410 2.613 20 5 FFBDMO CN(C(=O)C[N@@H+](C)[C@@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000072772680 507851652 /nfs/dbraw/zinc/85/16/52/507851652.db2.gz QNRSYICVJHEMIT-SFHVURJKSA-N 1 1 357.410 2.613 20 5 FFBDMO CC(=O)c1ccc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643914 507853335 /nfs/dbraw/zinc/85/33/35/507853335.db2.gz LIZOKBMDPBKRFD-QZTJIDSGSA-N 1 1 369.421 2.845 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCN(C)c1ccccc1 ZINC000107683592 507863131 /nfs/dbraw/zinc/86/31/31/507863131.db2.gz PHPFOLDWZMRCMF-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCN(C)c1ccccc1 ZINC000107683592 507863135 /nfs/dbraw/zinc/86/31/35/507863135.db2.gz PHPFOLDWZMRCMF-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000089925449 507884909 /nfs/dbraw/zinc/88/49/09/507884909.db2.gz PLVIQAOAKUZTNH-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO Cc1cnc(N[C@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667432 507895610 /nfs/dbraw/zinc/89/56/10/507895610.db2.gz FRKPJFSYZDQZLS-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cnc(N[C@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667432 507895611 /nfs/dbraw/zinc/89/56/11/507895611.db2.gz FRKPJFSYZDQZLS-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000108505991 507899568 /nfs/dbraw/zinc/89/95/68/507899568.db2.gz LGGKOUGXMJQRDB-SNVBAGLBSA-N 1 1 358.345 2.660 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000079618571 507983882 /nfs/dbraw/zinc/98/38/82/507983882.db2.gz RRUOGUYQWNKYGG-UHFFFAOYSA-N 1 1 366.381 2.559 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000369360782 512371526 /nfs/dbraw/zinc/37/15/26/512371526.db2.gz YOTWSUPINOLPIP-JTQLQIEISA-N 1 1 366.219 2.870 20 5 FFBDMO CCc1nn(C)c(N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000091729305 508005760 /nfs/dbraw/zinc/00/57/60/508005760.db2.gz IUTKYSYQLOWQAP-HNNXBMFYSA-N 1 1 357.458 2.992 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@]3(C2)C(=O)Nc2ccccc23)c([N+](=O)[O-])cc1F ZINC000373514971 512372452 /nfs/dbraw/zinc/37/24/52/512372452.db2.gz WPGDTYWLKRSTEG-LJQANCHMSA-N 1 1 371.368 2.838 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCO)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000074312417 508009908 /nfs/dbraw/zinc/00/99/08/508009908.db2.gz KMJSFCBGZYHKPM-GOSISDBHSA-N 1 1 369.421 2.566 20 5 FFBDMO CC[C@H](c1ccccc1)[C@@H]1CCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075675203 508127886 /nfs/dbraw/zinc/12/78/86/508127886.db2.gz UIGBNJQJUQRWTH-OTWHNJEPSA-N 1 1 358.442 2.810 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000093282269 508134113 /nfs/dbraw/zinc/13/41/13/508134113.db2.gz OMMPRFUOBKGCEE-CQSZACIVSA-N 1 1 350.415 2.885 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000081095536 508137301 /nfs/dbraw/zinc/13/73/01/508137301.db2.gz UPSVCKKXTQQYLP-PBHICJAKSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000081095536 508137302 /nfs/dbraw/zinc/13/73/02/508137302.db2.gz UPSVCKKXTQQYLP-PBHICJAKSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cccn2c(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cnc12 ZINC000093534524 508148420 /nfs/dbraw/zinc/14/84/20/508148420.db2.gz WLRYMAKURGFNPU-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000093754534 508154000 /nfs/dbraw/zinc/15/40/00/508154000.db2.gz DYADWXGSSXENTO-ZDUSSCGKSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000093754534 508154001 /nfs/dbraw/zinc/15/40/01/508154001.db2.gz DYADWXGSSXENTO-ZDUSSCGKSA-N 1 1 373.247 2.842 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000081361905 508167192 /nfs/dbraw/zinc/16/71/92/508167192.db2.gz MCICGGSLEZTPSU-INIZCTEOSA-N 1 1 374.485 2.999 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081633411 508198969 /nfs/dbraw/zinc/19/89/69/508198969.db2.gz MIZFRBOZLUOBJE-GDBMZVCRSA-N 1 1 360.458 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CCO)CCc3ccccc3)n2)cc1 ZINC000112698446 508210865 /nfs/dbraw/zinc/21/08/65/508210865.db2.gz JERZEHBLKDSYIA-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CCO)CCc3ccccc3)n2)cc1 ZINC000112698446 508210867 /nfs/dbraw/zinc/21/08/67/508210867.db2.gz JERZEHBLKDSYIA-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000083247307 508243220 /nfs/dbraw/zinc/24/32/20/508243220.db2.gz BVUHBQNXFSGIKS-QZTJIDSGSA-N 1 1 361.442 2.837 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000083247307 508243221 /nfs/dbraw/zinc/24/32/21/508243221.db2.gz BVUHBQNXFSGIKS-QZTJIDSGSA-N 1 1 361.442 2.837 20 5 FFBDMO CC(=O)Nc1cccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000101543229 508244056 /nfs/dbraw/zinc/24/40/56/508244056.db2.gz RXOUTJJKYAZPMN-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000076757094 508251240 /nfs/dbraw/zinc/25/12/40/508251240.db2.gz SPYAKFPDJAFAKE-INIZCTEOSA-N 1 1 354.410 2.744 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000076757094 508251241 /nfs/dbraw/zinc/25/12/41/508251241.db2.gz SPYAKFPDJAFAKE-INIZCTEOSA-N 1 1 354.410 2.744 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000085636255 508314964 /nfs/dbraw/zinc/31/49/64/508314964.db2.gz SSSVJKQBDNZCIS-MRXNPFEDSA-N 1 1 364.446 2.690 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000086962914 508329191 /nfs/dbraw/zinc/32/91/91/508329191.db2.gz LPOOUHJCXRGZCD-UHFFFAOYSA-N 1 1 353.422 2.872 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000114644113 508333338 /nfs/dbraw/zinc/33/33/38/508333338.db2.gz POJZPQKPMRASQY-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645221 508333518 /nfs/dbraw/zinc/33/35/18/508333518.db2.gz KWOFQEDWDDXJOW-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCCC[C@@H]1C ZINC000087037217 508333562 /nfs/dbraw/zinc/33/35/62/508333562.db2.gz FAHIPHXKPPWZOB-GJZGRUSLSA-N 1 1 360.458 2.925 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCOCC1CC1 ZINC000088599977 508377995 /nfs/dbraw/zinc/37/79/95/508377995.db2.gz QECQMLWWSGRHCV-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCOCC1CC1 ZINC000088599977 508377998 /nfs/dbraw/zinc/37/79/98/508377998.db2.gz QECQMLWWSGRHCV-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000133734442 508441289 /nfs/dbraw/zinc/44/12/89/508441289.db2.gz OYUQRJPWLZMUCQ-CVEARBPZSA-N 1 1 360.458 2.654 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000134234756 508510928 /nfs/dbraw/zinc/51/09/28/508510928.db2.gz WKDOCOGDMNNWAB-LIVBEALHSA-N 1 1 372.421 2.659 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000122318387 508517372 /nfs/dbraw/zinc/51/73/72/508517372.db2.gz AARRRBCRQOUDGQ-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122414590 508531126 /nfs/dbraw/zinc/53/11/26/508531126.db2.gz QSLYPOMPHPUGCX-QAPCUYQASA-N 1 1 365.474 2.830 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157317966 508552111 /nfs/dbraw/zinc/55/21/11/508552111.db2.gz LOAVKESDIAXOQD-CJNGLKHVSA-N 1 1 351.834 2.733 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000153610662 508607522 /nfs/dbraw/zinc/60/75/22/508607522.db2.gz YFWHILWOPLMSDG-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000128759747 508639938 /nfs/dbraw/zinc/63/99/38/508639938.db2.gz CLHHUERKIOWHBQ-HNNXBMFYSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000128759747 508639941 /nfs/dbraw/zinc/63/99/41/508639941.db2.gz CLHHUERKIOWHBQ-HNNXBMFYSA-N 1 1 369.849 2.821 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123418743 508684124 /nfs/dbraw/zinc/68/41/24/508684124.db2.gz ZECRQZLQAFJAKE-GOEBONIOSA-N 1 1 360.458 2.750 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123663935 508722335 /nfs/dbraw/zinc/72/23/35/508722335.db2.gz PIQFZROUNDJUOJ-BFYDXBDKSA-N 1 1 361.442 2.617 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000130207291 508804274 /nfs/dbraw/zinc/80/42/74/508804274.db2.gz KIIYEOLVMSSWRO-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO Cc1c(CN2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cccc1[N+](=O)[O-] ZINC000119526904 508813137 /nfs/dbraw/zinc/81/31/37/508813137.db2.gz QKVCKIKEKGPTNK-DFNIBXOVSA-N 1 1 358.486 2.646 20 5 FFBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(S(N)(=O)=O)cc1 ZINC000119622673 508831087 /nfs/dbraw/zinc/83/10/87/508831087.db2.gz PYXODKLJHFRBEZ-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@H]3COc4ccccc4O3)CC2)c1 ZINC000143910233 508834839 /nfs/dbraw/zinc/83/48/39/508834839.db2.gz LZJBGANOXVVAGB-KRWDZBQOSA-N 1 1 355.394 2.557 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000119768845 508859310 /nfs/dbraw/zinc/85/93/10/508859310.db2.gz SKRNWAUCRYVKFP-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000119836215 508872544 /nfs/dbraw/zinc/87/25/44/508872544.db2.gz OXASXQNBVPQYCI-AWEZNQCLSA-N 1 1 351.472 2.781 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1OC ZINC000159704146 508878249 /nfs/dbraw/zinc/87/82/49/508878249.db2.gz JGDRBTYFXXMERK-MRXNPFEDSA-N 1 1 373.409 2.611 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000150835219 508903878 /nfs/dbraw/zinc/90/38/78/508903878.db2.gz KNXQTKSCPNXIJK-INIZCTEOSA-N 1 1 360.458 2.650 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125257561 508956648 /nfs/dbraw/zinc/95/66/48/508956648.db2.gz FKVCWPLYQLQRDL-LPHOPBHVSA-N 1 1 372.469 2.796 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CCC1CCOCC1 ZINC000120322178 508972865 /nfs/dbraw/zinc/97/28/65/508972865.db2.gz RZMZISBSDKRJOR-UHFFFAOYSA-N 1 1 363.414 2.641 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000151475512 509024844 /nfs/dbraw/zinc/02/48/44/509024844.db2.gz AITWJHFWKJFJIO-UHFFFAOYSA-N 1 1 370.247 2.500 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)[nH+]1 ZINC000369495653 512437751 /nfs/dbraw/zinc/43/77/51/512437751.db2.gz CMAFNUREXMAYJE-AWEZNQCLSA-N 1 1 355.398 2.597 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC000133449960 509161656 /nfs/dbraw/zinc/16/16/56/509161656.db2.gz UERVSHGBOMNJBX-MFKMUULPSA-N 1 1 355.236 2.673 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179016634 509226502 /nfs/dbraw/zinc/22/65/02/509226502.db2.gz YRYLACHZUFNMKK-LBPRGKRZSA-N 1 1 355.398 2.576 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175994510 509263000 /nfs/dbraw/zinc/26/30/00/509263000.db2.gz LBVKDMSGWVXHRY-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175994510 509263003 /nfs/dbraw/zinc/26/30/03/509263003.db2.gz LBVKDMSGWVXHRY-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO C[N@@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000248404373 509298733 /nfs/dbraw/zinc/29/87/33/509298733.db2.gz QDARGCFCHXITTK-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000248404373 509298740 /nfs/dbraw/zinc/29/87/40/509298740.db2.gz QDARGCFCHXITTK-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000248454782 509329852 /nfs/dbraw/zinc/32/98/52/509329852.db2.gz KMJBRXNBKHOJHO-CVEARBPZSA-N 1 1 352.431 2.616 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC ZINC000163242181 509355101 /nfs/dbraw/zinc/35/51/01/509355101.db2.gz BCPZUFWZEJUGEN-MRXNPFEDSA-N 1 1 364.446 2.868 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000173039641 509363560 /nfs/dbraw/zinc/36/35/60/509363560.db2.gz OQJUMHSJCMDTKG-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163413750 509374222 /nfs/dbraw/zinc/37/42/22/509374222.db2.gz JOBZBGFSWZLWFR-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000176207791 509378602 /nfs/dbraw/zinc/37/86/02/509378602.db2.gz NXQKHHPYRQLGOP-ZFWWWQNUSA-N 1 1 371.224 2.688 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCS[C@H](C)CC1 ZINC000192171886 509388160 /nfs/dbraw/zinc/38/81/60/509388160.db2.gz LQAULHMVBQHHGB-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000192171886 509388164 /nfs/dbraw/zinc/38/81/64/509388164.db2.gz LQAULHMVBQHHGB-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1SC ZINC000264221697 509392632 /nfs/dbraw/zinc/39/26/32/509392632.db2.gz WBQCHZBPDASGRZ-CHWSQXEVSA-N 1 1 365.455 2.682 20 5 FFBDMO C[NH+](C)CCN(Cc1cccs1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000176257873 509405941 /nfs/dbraw/zinc/40/59/41/509405941.db2.gz QJAVHEWQOCWRGK-UHFFFAOYSA-N 1 1 373.438 2.737 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000182853722 509460254 /nfs/dbraw/zinc/46/02/54/509460254.db2.gz QVWKZBNAOFQLKP-STQMWFEESA-N 1 1 363.462 2.653 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000192360583 509481362 /nfs/dbraw/zinc/48/13/62/509481362.db2.gz YEIFECAYYYKKRO-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186159868 509552210 /nfs/dbraw/zinc/55/22/10/509552210.db2.gz IAKZODLQKASUHY-MRXNPFEDSA-N 1 1 354.406 2.882 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189416127 509565910 /nfs/dbraw/zinc/56/59/10/509565910.db2.gz FCTIDOPFZZNQQM-CQSZACIVSA-N 1 1 374.441 2.527 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000173596848 509665986 /nfs/dbraw/zinc/66/59/86/509665986.db2.gz BINXGDGZWNIACC-OAHLLOKOSA-N 1 1 373.457 2.517 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000170648239 509696768 /nfs/dbraw/zinc/69/67/68/509696768.db2.gz AIXZDUCSABUFRB-ZDUSSCGKSA-N 1 1 365.430 2.950 20 5 FFBDMO CNC(=O)c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192958408 509714470 /nfs/dbraw/zinc/71/44/70/509714470.db2.gz ABOFEYSWFLETRX-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000189953841 509850549 /nfs/dbraw/zinc/85/05/49/509850549.db2.gz DWFVBNFXFMBOIX-HZPDHXFCSA-N 1 1 357.458 2.538 20 5 FFBDMO COC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000190081176 509927968 /nfs/dbraw/zinc/92/79/68/509927968.db2.gz AFNBHUYPKIIASW-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177195592 509929983 /nfs/dbraw/zinc/92/99/83/509929983.db2.gz FYYSZQRVIJMAAW-YPMHNXCESA-N 1 1 367.833 2.759 20 5 FFBDMO CC(C)N(C(=O)[C@@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000245440585 509936231 /nfs/dbraw/zinc/93/62/31/509936231.db2.gz GPDZTUYYFUHXDI-HUUCEWRRSA-N 1 1 363.462 2.510 20 5 FFBDMO C[C@H](CN1CCN(C)CC1)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180497721 509956046 /nfs/dbraw/zinc/95/60/46/509956046.db2.gz TZPSKPPEJSMHOR-DYESRHJHSA-N 1 1 368.481 2.910 20 5 FFBDMO O=C(NC1CC[NH+](C2CCCCC2)CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177252821 509961013 /nfs/dbraw/zinc/96/10/13/509961013.db2.gz JHLPKOKYGVXDNH-UHFFFAOYSA-N 1 1 371.441 2.998 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCCOC1 ZINC000245499865 509969135 /nfs/dbraw/zinc/96/91/35/509969135.db2.gz YZLQZYWBUYMXHB-VXGBXAGGSA-N 1 1 355.822 2.934 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585298 509978686 /nfs/dbraw/zinc/97/86/86/509978686.db2.gz HRJHVDMHXYCTFB-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3ccn[nH]3)C2)cccc1[N+](=O)[O-] ZINC000193585298 509978692 /nfs/dbraw/zinc/97/86/92/509978692.db2.gz HRJHVDMHXYCTFB-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3ccn[nH]3)C2)cccc1[N+](=O)[O-] ZINC000193585298 509978699 /nfs/dbraw/zinc/97/86/99/509978699.db2.gz HRJHVDMHXYCTFB-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNc2ncc(C(=O)OC)cc2[N+](=O)[O-])c1 ZINC000190169572 509983265 /nfs/dbraw/zinc/98/32/65/509983265.db2.gz ZOGUQZZOSJMWAE-UHFFFAOYSA-N 1 1 358.398 2.840 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180578603 509996024 /nfs/dbraw/zinc/99/60/24/509996024.db2.gz LIBXRLXZMIIESO-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000180647551 510032294 /nfs/dbraw/zinc/03/22/94/510032294.db2.gz AOIDQTSOUFAEQG-OAHLLOKOSA-N 1 1 354.410 2.571 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000261709586 510036544 /nfs/dbraw/zinc/03/65/44/510036544.db2.gz DLKXJNUOIPWLAU-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265443704 510057374 /nfs/dbraw/zinc/05/73/74/510057374.db2.gz AGUFLYAOXWNGMB-OLZOCXBDSA-N 1 1 368.865 2.849 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193825208 510088631 /nfs/dbraw/zinc/08/86/31/510088631.db2.gz SUHHIYNXLMUKNP-CYBMUJFWSA-N 1 1 364.402 2.631 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193825208 510088634 /nfs/dbraw/zinc/08/86/34/510088634.db2.gz SUHHIYNXLMUKNP-CYBMUJFWSA-N 1 1 364.402 2.631 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184176560 510175629 /nfs/dbraw/zinc/17/56/29/510175629.db2.gz HKJAVGPMJRXDNI-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000246021973 510254510 /nfs/dbraw/zinc/25/45/10/510254510.db2.gz PEFMUNWZNDACBX-FUHWJXTLSA-N 1 1 357.410 2.521 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000246037549 510258470 /nfs/dbraw/zinc/25/84/70/510258470.db2.gz WSBZJWCEBIFDBD-SMDDNHRTSA-N 1 1 374.384 2.840 20 5 FFBDMO CC(C)[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])N1CC[NH+](C)CC1 ZINC000194262607 510284639 /nfs/dbraw/zinc/28/46/39/510284639.db2.gz HWROSQFWMIMGEG-SFHVURJKSA-N 1 1 357.458 2.827 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000190731905 510314130 /nfs/dbraw/zinc/31/41/30/510314130.db2.gz MISDRGJQTNXAOT-GDBMZVCRSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000190731905 510314135 /nfs/dbraw/zinc/31/41/35/510314135.db2.gz MISDRGJQTNXAOT-GDBMZVCRSA-N 1 1 365.430 2.617 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000171952943 510469907 /nfs/dbraw/zinc/46/99/07/510469907.db2.gz LHNWZXYHJNHXTP-UHFFFAOYSA-N 1 1 363.439 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000194714752 510492186 /nfs/dbraw/zinc/49/21/86/510492186.db2.gz WKIDGIFVRAAWTC-UHFFFAOYSA-N 1 1 353.400 2.601 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000194714752 510492191 /nfs/dbraw/zinc/49/21/91/510492191.db2.gz WKIDGIFVRAAWTC-UHFFFAOYSA-N 1 1 353.400 2.601 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])CC1 ZINC000194730664 510499210 /nfs/dbraw/zinc/49/92/10/510499210.db2.gz ZEQGYVRVXQTSMD-MRXNPFEDSA-N 1 1 360.458 2.655 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCN(c2cc(OC)cc[nH+]2)CC1 ZINC000175182515 510521486 /nfs/dbraw/zinc/52/14/86/510521486.db2.gz YBGKCDJRCFYEBC-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181679759 510536221 /nfs/dbraw/zinc/53/62/21/510536221.db2.gz REVOTNQRWSFJCU-KBPBESRZSA-N 1 1 361.442 2.986 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCCCC2=O)CC1 ZINC000178432625 510602249 /nfs/dbraw/zinc/60/22/49/510602249.db2.gz LZBTVCMEBLGESD-UHFFFAOYSA-N 1 1 361.442 2.970 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[NH+](CCOC(C)C)CC1 ZINC000191346205 510616582 /nfs/dbraw/zinc/61/65/82/510616582.db2.gz HPJOWLFPUULICH-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO C[C@H](CCNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000175386072 510619587 /nfs/dbraw/zinc/61/95/87/510619587.db2.gz DGQCWWGDHDMWNB-CQSZACIVSA-N 1 1 357.410 2.941 20 5 FFBDMO COc1ccc([C@H]2CCCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000246801911 510682897 /nfs/dbraw/zinc/68/28/97/510682897.db2.gz VNMKFJPFVAOCNP-IEBWSBKVSA-N 1 1 374.441 2.778 20 5 FFBDMO COc1ccc(OCC[N@@H+](CCO)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000181970227 510684875 /nfs/dbraw/zinc/68/48/75/510684875.db2.gz WMGSMCUFLVPGQT-UHFFFAOYSA-N 1 1 360.410 2.785 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOC2(C1)CCCCCC2 ZINC000182020866 510713366 /nfs/dbraw/zinc/71/33/66/510713366.db2.gz ZYLQALYBWWSVLI-INIZCTEOSA-N 1 1 364.442 2.760 20 5 FFBDMO O=c1cc(C[N@@H+]2CCO[C@]3(CCOC3)C2)c2c(ccc3ccccc32)o1 ZINC000185177246 510729951 /nfs/dbraw/zinc/72/99/51/510729951.db2.gz DASBXDBGPZXXDJ-OAQYLSRUSA-N 1 1 351.402 2.938 20 5 FFBDMO O=c1cc(C[N@H+]2CCO[C@]3(CCOC3)C2)c2c(ccc3ccccc32)o1 ZINC000185177246 510729962 /nfs/dbraw/zinc/72/99/62/510729962.db2.gz DASBXDBGPZXXDJ-OAQYLSRUSA-N 1 1 351.402 2.938 20 5 FFBDMO CC(C)(C)OC(=O)CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182179522 510798098 /nfs/dbraw/zinc/79/80/98/510798098.db2.gz DQZMRHVJWLVXJL-ZDUSSCGKSA-N 1 1 350.419 2.598 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182310529 510847897 /nfs/dbraw/zinc/84/78/97/510847897.db2.gz ZFZUGZPRSDHBBG-NSHDSACASA-N 1 1 357.863 2.798 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000247277509 510855033 /nfs/dbraw/zinc/85/50/33/510855033.db2.gz XBPQWHLJSFMMEP-GXFFZTMASA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000247310570 510856470 /nfs/dbraw/zinc/85/64/70/510856470.db2.gz HLKBCJFEBOYTGU-IINYFYTJSA-N 1 1 370.247 2.770 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000247496853 510863401 /nfs/dbraw/zinc/86/34/01/510863401.db2.gz UQPCNJFDTCBWLH-STQMWFEESA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCc2sccc2C1 ZINC000285402926 510892527 /nfs/dbraw/zinc/89/25/27/510892527.db2.gz UCUHBJALIVHUOQ-UHFFFAOYSA-N 1 1 359.451 2.716 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCc2sccc2C1 ZINC000285402926 510892531 /nfs/dbraw/zinc/89/25/31/510892531.db2.gz UCUHBJALIVHUOQ-UHFFFAOYSA-N 1 1 359.451 2.716 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000360451087 510909312 /nfs/dbraw/zinc/90/93/12/510909312.db2.gz ZMUXVERWISPYNM-IBGZPJMESA-N 1 1 374.368 2.694 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c2c(c1)COCO2 ZINC000360451087 510909314 /nfs/dbraw/zinc/90/93/14/510909314.db2.gz ZMUXVERWISPYNM-IBGZPJMESA-N 1 1 374.368 2.694 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000294028918 510935063 /nfs/dbraw/zinc/93/50/63/510935063.db2.gz OBMYEXVPPRXFOY-SFHVURJKSA-N 1 1 352.431 2.843 20 5 FFBDMO COc1ccc([C@@H](CCO)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000270682957 510950224 /nfs/dbraw/zinc/95/02/24/510950224.db2.gz TVHWHLAFJMQXEG-GOSISDBHSA-N 1 1 374.393 2.683 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000282428769 510973817 /nfs/dbraw/zinc/97/38/17/510973817.db2.gz JWWZOMVXTZNSCD-CYBMUJFWSA-N 1 1 359.348 2.811 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000297702926 511040400 /nfs/dbraw/zinc/04/04/00/511040400.db2.gz AVCIOPUDOSADIB-DOTOQJQBSA-N 1 1 363.414 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@H](O)C3)o2)c(Cl)c1 ZINC000294679607 511141172 /nfs/dbraw/zinc/14/11/72/511141172.db2.gz BLCMWQFTBFAFGU-GFCCVEGCSA-N 1 1 352.774 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC[C@H](O)C3)o2)c(Cl)c1 ZINC000294679607 511141174 /nfs/dbraw/zinc/14/11/74/511141174.db2.gz BLCMWQFTBFAFGU-GFCCVEGCSA-N 1 1 352.774 2.701 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)[nH+]1 ZINC000364920558 511154113 /nfs/dbraw/zinc/15/41/13/511154113.db2.gz ZQFYEOYUBBXERD-CQSZACIVSA-N 1 1 355.398 2.597 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000294729427 511158825 /nfs/dbraw/zinc/15/88/25/511158825.db2.gz NGNVTKAZKDOQCR-MRXNPFEDSA-N 1 1 369.425 2.685 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291625654 511272602 /nfs/dbraw/zinc/27/26/02/511272602.db2.gz AAADWTJRKBLFEV-ZDUSSCGKSA-N 1 1 359.430 2.970 20 5 FFBDMO Cc1cccnc1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000295115339 511288021 /nfs/dbraw/zinc/28/80/21/511288021.db2.gz WPYFOSXBNXVRRR-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000295140371 511296471 /nfs/dbraw/zinc/29/64/71/511296471.db2.gz OLZADTSOGNCDQA-KOLCDFICSA-N 1 1 357.332 2.969 20 5 FFBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000291785003 511336599 /nfs/dbraw/zinc/33/65/99/511336599.db2.gz FYRXZCRTJMUUKX-OAHLLOKOSA-N 1 1 362.474 2.656 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000295372926 511381779 /nfs/dbraw/zinc/38/17/79/511381779.db2.gz RVXTVXPZFHUCSX-AWEZNQCLSA-N 1 1 371.441 2.789 20 5 FFBDMO CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295372926 511381785 /nfs/dbraw/zinc/38/17/85/511381785.db2.gz RVXTVXPZFHUCSX-AWEZNQCLSA-N 1 1 371.441 2.789 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295372926 511381791 /nfs/dbraw/zinc/38/17/91/511381791.db2.gz RVXTVXPZFHUCSX-AWEZNQCLSA-N 1 1 371.441 2.789 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291908842 511386796 /nfs/dbraw/zinc/38/67/96/511386796.db2.gz RQJZYRDWGOFRBF-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291908842 511386801 /nfs/dbraw/zinc/38/68/01/511386801.db2.gz RQJZYRDWGOFRBF-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO CCCCC[C@@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365509223 511495218 /nfs/dbraw/zinc/49/52/18/511495218.db2.gz JBTADSTVOLSWRA-CQSZACIVSA-N 1 1 351.451 2.513 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC[N@H+](C2CC2)C1 ZINC000295757001 511506833 /nfs/dbraw/zinc/50/68/33/511506833.db2.gz VMGXATLJYHZHAR-OAHLLOKOSA-N 1 1 372.469 2.751 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000299086639 511509879 /nfs/dbraw/zinc/50/98/79/511509879.db2.gz SWHGESNOULEQPW-HZPDHXFCSA-N 1 1 358.442 2.552 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3Br)C2)C1 ZINC000292236700 511516299 /nfs/dbraw/zinc/51/62/99/511516299.db2.gz NWVFHCXYZHMHAC-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO COC(=O)c1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)cc(C)c1[N+](=O)[O-] ZINC000365561867 511529341 /nfs/dbraw/zinc/52/93/41/511529341.db2.gz YHBXMFLNRWDHAC-CYBMUJFWSA-N 1 1 358.398 2.807 20 5 FFBDMO CC(C)[N@H+]1CCCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000292324513 511553738 /nfs/dbraw/zinc/55/37/38/511553738.db2.gz BPWNPPDWTTXLNY-ZDUSSCGKSA-N 1 1 368.865 2.991 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000284217796 511646305 /nfs/dbraw/zinc/64/63/05/511646305.db2.gz TUDLWNLDNCTKQN-VKJFTORMSA-N 1 1 364.490 2.965 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@@H]2C1 ZINC000284521967 511757803 /nfs/dbraw/zinc/75/78/03/511757803.db2.gz FPXOQCPTWFDTIP-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)n1 ZINC000312597586 511786651 /nfs/dbraw/zinc/78/66/51/511786651.db2.gz FIHSRZPESIZCOC-UKRRQHHQSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CC2)C1 ZINC000296699623 511860624 /nfs/dbraw/zinc/86/06/24/511860624.db2.gz KTXZQYQRQITJRK-GFCCVEGCSA-N 1 1 366.849 2.603 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000296731176 511873317 /nfs/dbraw/zinc/87/33/17/511873317.db2.gz NYYDYFASNCMQMP-CYBMUJFWSA-N 1 1 369.849 2.787 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886359 511913214 /nfs/dbraw/zinc/91/32/14/511913214.db2.gz TZFNTOPNDAFDDW-HIFRSBDPSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886359 511913218 /nfs/dbraw/zinc/91/32/18/511913218.db2.gz TZFNTOPNDAFDDW-HIFRSBDPSA-N 1 1 353.806 2.830 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000351201782 511981065 /nfs/dbraw/zinc/98/10/65/511981065.db2.gz OXUNPWBNHFBCHL-TXEJJXNPSA-N 1 1 369.385 2.598 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c4cccnc34)C2)CC1 ZINC000367517297 512539096 /nfs/dbraw/zinc/53/90/96/512539096.db2.gz KWCRFFPMYHYKAU-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000411283156 512561861 /nfs/dbraw/zinc/56/18/61/512561861.db2.gz YNWNCYDEWCXVSO-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000373942514 512584099 /nfs/dbraw/zinc/58/40/99/512584099.db2.gz HBGFQVZRSKPCQY-CVEARBPZSA-N 1 1 361.442 2.615 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000374028779 512630374 /nfs/dbraw/zinc/63/03/74/512630374.db2.gz STDQRVLSKWVZOQ-RVKKMQEKSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000372014421 512679002 /nfs/dbraw/zinc/67/90/02/512679002.db2.gz YCBGZJWMYHDXRX-OAHLLOKOSA-N 1 1 354.410 2.726 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(CC[NH+]2CCOCC2)CC1 ZINC000367943481 512734816 /nfs/dbraw/zinc/73/48/16/512734816.db2.gz HXBMZHRTJGYIHE-UHFFFAOYSA-N 1 1 361.442 2.736 20 5 FFBDMO COC(=O)[C@]1(C)C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000374373647 512798490 /nfs/dbraw/zinc/79/84/90/512798490.db2.gz IVEGPSZFKWUCFZ-FTLABTOESA-N 1 1 374.397 2.837 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)CC2 ZINC000378518271 512802319 /nfs/dbraw/zinc/80/23/19/512802319.db2.gz KJRLCGBFBFOXIN-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc2c1C[N@H+](C1CC1)C2 ZINC000378526823 512807950 /nfs/dbraw/zinc/80/79/50/512807950.db2.gz ABHQDMNYGVPYFU-UHFFFAOYSA-N 1 1 355.398 2.607 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000376543093 512865333 /nfs/dbraw/zinc/86/53/33/512865333.db2.gz WBDDCWGBBQTJGA-NSHDSACASA-N 1 1 368.231 2.668 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@@H](O)C[C@H]3c3ccccc3)n2)cc1 ZINC000411933588 512879458 /nfs/dbraw/zinc/87/94/58/512879458.db2.gz GVEGQKPGNXTNNG-IRXDYDNUSA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@@H](O)C[C@H]3c3ccccc3)n2)cc1 ZINC000411933588 512879461 /nfs/dbraw/zinc/87/94/61/512879461.db2.gz GVEGQKPGNXTNNG-IRXDYDNUSA-N 1 1 366.377 2.953 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000383835696 512881504 /nfs/dbraw/zinc/88/15/04/512881504.db2.gz SXBJJCHULPGTKW-BLLLJJGKSA-N 1 1 372.400 2.709 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000412074662 512945901 /nfs/dbraw/zinc/94/59/01/512945901.db2.gz IOZDLDAEMQODJV-NWDGAFQWSA-N 1 1 374.384 2.840 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086828 512995928 /nfs/dbraw/zinc/99/59/28/512995928.db2.gz LVYSHOUMLWQLML-PMPSAXMXSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086828 512995932 /nfs/dbraw/zinc/99/59/32/512995932.db2.gz LVYSHOUMLWQLML-PMPSAXMXSA-N 1 1 374.485 2.996 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412214345 512999542 /nfs/dbraw/zinc/99/95/42/512999542.db2.gz GHQYQPGQECJZFR-ZGXWSNOMSA-N 1 1 365.433 2.912 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000412214343 513000160 /nfs/dbraw/zinc/00/01/60/513000160.db2.gz GHQYQPGQECJZFR-NMLBUPMWSA-N 1 1 365.433 2.912 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412351194 513050170 /nfs/dbraw/zinc/05/01/70/513050170.db2.gz ANIQCFRQEVXBOU-GFCCVEGCSA-N 1 1 355.410 2.522 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000374918557 513072436 /nfs/dbraw/zinc/07/24/36/513072436.db2.gz SJQHOKSZOQACML-MLGOLLRUSA-N 1 1 372.450 2.885 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](CO)C2)cc1OC ZINC000446027451 513168017 /nfs/dbraw/zinc/16/80/17/513168017.db2.gz XJPMGWDYAIQZKG-UONOGXRCSA-N 1 1 352.431 2.843 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](CO)C2)cc1OC ZINC000446027451 513168019 /nfs/dbraw/zinc/16/80/19/513168019.db2.gz XJPMGWDYAIQZKG-UONOGXRCSA-N 1 1 352.431 2.843 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428997147 513247055 /nfs/dbraw/zinc/24/70/55/513247055.db2.gz RYVYKWQUXBKSLB-BASYENTBSA-N 1 1 360.458 2.584 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000429046933 513267756 /nfs/dbraw/zinc/26/77/56/513267756.db2.gz XZRLEYMNYUZBCT-HLLBOEOZSA-N 1 1 363.458 2.644 20 5 FFBDMO CC(C)([NH2+]CC(=O)NC[C@H]1Cc2ccccc2O1)c1ccccc1[N+](=O)[O-] ZINC000429246570 513314601 /nfs/dbraw/zinc/31/46/01/513314601.db2.gz OJZAXCOWTZHOST-OAHLLOKOSA-N 1 1 369.421 2.539 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000429279139 513324749 /nfs/dbraw/zinc/32/47/49/513324749.db2.gz KJRCMQTUKAIPOS-CYBMUJFWSA-N 1 1 365.455 2.968 20 5 FFBDMO Cn1c(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000440494250 513334505 /nfs/dbraw/zinc/33/45/05/513334505.db2.gz IGMNQVXQJNMFDF-CQSZACIVSA-N 1 1 366.425 2.605 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C[C@H](C)[N@@H+]1CCO ZINC000450791302 513343508 /nfs/dbraw/zinc/34/35/08/513343508.db2.gz IILBJFBAFAFSMY-OKILXGFUSA-N 1 1 374.416 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cnn(CC(F)(F)F)c3)nc2c1 ZINC000446833719 513346524 /nfs/dbraw/zinc/34/65/24/513346524.db2.gz DVNSGJOPFTYCAT-UHFFFAOYSA-N 1 1 354.292 2.520 20 5 FFBDMO C[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@@H+](Cc2ccccc2)C1 ZINC000450814451 513352139 /nfs/dbraw/zinc/35/21/39/513352139.db2.gz VHTQNOLYQCKUTP-OAHLLOKOSA-N 1 1 366.425 2.596 20 5 FFBDMO C[C@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+](C2CCC2)C1 ZINC000429370740 513354896 /nfs/dbraw/zinc/35/48/96/513354896.db2.gz FJSMAATWZVLBAN-DNVCBOLYSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000418105910 513373368 /nfs/dbraw/zinc/37/33/68/513373368.db2.gz BQIBKYGTTIABNK-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000418105910 513373376 /nfs/dbraw/zinc/37/33/76/513373376.db2.gz BQIBKYGTTIABNK-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000418105910 513373384 /nfs/dbraw/zinc/37/33/84/513373384.db2.gz BQIBKYGTTIABNK-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000434768773 513424763 /nfs/dbraw/zinc/42/47/63/513424763.db2.gz TTZOWENHALPDDA-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000434768773 513424765 /nfs/dbraw/zinc/42/47/65/513424765.db2.gz TTZOWENHALPDDA-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425399106 513544412 /nfs/dbraw/zinc/54/44/12/513544412.db2.gz VXLLMOATFUCFND-UHFFFAOYSA-N 1 1 372.263 2.511 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279256 513609764 /nfs/dbraw/zinc/60/97/64/513609764.db2.gz SODXYYMSIBFDDX-DEYYWGMASA-N 1 1 350.415 2.762 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279256 513609773 /nfs/dbraw/zinc/60/97/73/513609773.db2.gz SODXYYMSIBFDDX-DEYYWGMASA-N 1 1 350.415 2.762 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000451265900 513636490 /nfs/dbraw/zinc/63/64/90/513636490.db2.gz ONYKDNKIMGUMGV-OALUTQOASA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000451265900 513636491 /nfs/dbraw/zinc/63/64/91/513636491.db2.gz ONYKDNKIMGUMGV-OALUTQOASA-N 1 1 360.385 2.774 20 5 FFBDMO Cc1cc(OCC(=O)NCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000430396598 513643237 /nfs/dbraw/zinc/64/32/37/513643237.db2.gz ULDYRTJDROMLFJ-UHFFFAOYSA-N 1 1 357.410 2.530 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)c1 ZINC000435634961 513645508 /nfs/dbraw/zinc/64/55/08/513645508.db2.gz DNENSLWVKRKDIH-MRXNPFEDSA-N 1 1 367.471 2.670 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431040550 513813220 /nfs/dbraw/zinc/81/32/20/513813220.db2.gz XAKBNUXUSOPIHK-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO CC(C)S(=O)(=O)CCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451546723 513826371 /nfs/dbraw/zinc/82/63/71/513826371.db2.gz JMEPMJSVCLSWIF-INIZCTEOSA-N 1 1 354.472 2.988 20 5 FFBDMO CC(C)S(=O)(=O)CCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451546723 513826374 /nfs/dbraw/zinc/82/63/74/513826374.db2.gz JMEPMJSVCLSWIF-INIZCTEOSA-N 1 1 354.472 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@H](O)COCC(F)(F)F)C2)cc1 ZINC000451554153 513830281 /nfs/dbraw/zinc/83/02/81/513830281.db2.gz ZKCUFNCSFVKVHZ-HIFRSBDPSA-N 1 1 362.348 2.714 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC[C@@H]1C1CC1 ZINC000451656569 513893651 /nfs/dbraw/zinc/89/36/51/513893651.db2.gz UIHAPHHOYIBCBN-OAHLLOKOSA-N 1 1 365.455 2.759 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCSC[C@@H]1C1CC1 ZINC000451658929 513895155 /nfs/dbraw/zinc/89/51/55/513895155.db2.gz YXTHLXFRIIYHBQ-OAHLLOKOSA-N 1 1 363.439 2.720 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431495424 513911421 /nfs/dbraw/zinc/91/14/21/513911421.db2.gz JHIWEFPKLPDWEY-LKFCYVNXSA-N 1 1 368.231 2.570 20 5 FFBDMO CCOC(=O)c1cc(NCCc2cn3c([nH+]2)CCCC3)ccc1[N+](=O)[O-] ZINC000443427986 513967375 /nfs/dbraw/zinc/96/73/75/513967375.db2.gz NQJKZFXAODNMCY-UHFFFAOYSA-N 1 1 358.398 2.959 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2nccc(C(F)(F)F)n2)n1 ZINC000414239681 514017546 /nfs/dbraw/zinc/01/75/46/514017546.db2.gz LGLDBJPDBVWQCZ-GHMZBOCLSA-N 1 1 370.335 2.874 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc2ncccn2n1 ZINC000414265158 514028265 /nfs/dbraw/zinc/02/82/65/514028265.db2.gz LBDRJENSEVQICC-LBPRGKRZSA-N 1 1 358.427 2.693 20 5 FFBDMO CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000431942250 514046517 /nfs/dbraw/zinc/04/65/17/514046517.db2.gz YWTPKNIYHBOLEB-CYBMUJFWSA-N 1 1 368.231 2.666 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1c1ccccc1 ZINC000452010798 514134848 /nfs/dbraw/zinc/13/48/48/514134848.db2.gz WFOCZKRHYOJPJL-QZTJIDSGSA-N 1 1 370.405 2.992 20 5 FFBDMO COC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000452089961 514184287 /nfs/dbraw/zinc/18/42/87/514184287.db2.gz RUPQUIYHIGDXHO-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000452089961 514184293 /nfs/dbraw/zinc/18/42/93/514184293.db2.gz RUPQUIYHIGDXHO-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452103056 514192540 /nfs/dbraw/zinc/19/25/40/514192540.db2.gz LNQZBUWIXQCGLJ-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CSc1cccc(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)c1[N+](=O)[O-] ZINC000432573648 514230269 /nfs/dbraw/zinc/23/02/69/514230269.db2.gz GKWOUSYNLCIKGG-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C[C@@H]3CCCO3)[C@@H]3CCSC3)nc2c1 ZINC000444664109 514288064 /nfs/dbraw/zinc/28/80/64/514288064.db2.gz PYDVNIYIGHQZCV-KGLIPLIRSA-N 1 1 362.455 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C[C@@H]3CCCO3)[C@@H]3CCSC3)nc2c1 ZINC000444664109 514288067 /nfs/dbraw/zinc/28/80/67/514288067.db2.gz PYDVNIYIGHQZCV-KGLIPLIRSA-N 1 1 362.455 2.958 20 5 FFBDMO O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000427913748 514345063 /nfs/dbraw/zinc/34/50/63/514345063.db2.gz LSNOLXPPTAPSAJ-OAHLLOKOSA-N 1 1 361.423 2.929 20 5 FFBDMO NC(=O)c1cccc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439098498 514493049 /nfs/dbraw/zinc/49/30/49/514493049.db2.gz JMJYFWSITUNVBY-HNNXBMFYSA-N 1 1 354.410 2.770 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000445717365 514510433 /nfs/dbraw/zinc/51/04/33/514510433.db2.gz CSZVITBXTUAUNU-SFHVURJKSA-N 1 1 353.422 2.918 20 5 FFBDMO C[C@@H](C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[NH+]1CCSCC1 ZINC000452836894 514511647 /nfs/dbraw/zinc/51/16/47/514511647.db2.gz DKBUJRMIWZDHBF-GOEBONIOSA-N 1 1 363.483 2.738 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000461112924 514519068 /nfs/dbraw/zinc/51/90/68/514519068.db2.gz NVROVDARCXEFCS-OAHLLOKOSA-N 1 1 374.372 2.945 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000461261764 514553753 /nfs/dbraw/zinc/55/37/53/514553753.db2.gz GUGCKSHPBAHOQL-INIZCTEOSA-N 1 1 358.442 2.882 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000439474913 514560609 /nfs/dbraw/zinc/56/06/09/514560609.db2.gz XVLOCNLZUAEBPU-KBXCAEBGSA-N 1 1 350.415 2.948 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000470710767 514582832 /nfs/dbraw/zinc/58/28/32/514582832.db2.gz UAMAERFRLAESQP-SFHVURJKSA-N 1 1 372.400 2.661 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458155835 514588837 /nfs/dbraw/zinc/58/88/37/514588837.db2.gz AXNFWQYBHQWMEO-STQMWFEESA-N 1 1 369.849 2.864 20 5 FFBDMO CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475319788 514618174 /nfs/dbraw/zinc/61/81/74/514618174.db2.gz UVXUCPRDAAVANC-SFHVURJKSA-N 1 1 369.421 2.707 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000458201324 514623746 /nfs/dbraw/zinc/62/37/46/514623746.db2.gz WOFKZVXTETUMOG-INIZCTEOSA-N 1 1 374.485 2.659 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000461638584 514679751 /nfs/dbraw/zinc/67/97/51/514679751.db2.gz VYWRJUDQVFYUND-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000466557840 514690317 /nfs/dbraw/zinc/69/03/17/514690317.db2.gz YOPRYVOXVJZJPB-KBXCAEBGSA-N 1 1 360.458 2.699 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000475580796 514721517 /nfs/dbraw/zinc/72/15/17/514721517.db2.gz LQTLCCUHLZQLLO-OAHLLOKOSA-N 1 1 359.382 2.812 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000475580796 514721529 /nfs/dbraw/zinc/72/15/29/514721529.db2.gz LQTLCCUHLZQLLO-OAHLLOKOSA-N 1 1 359.382 2.812 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000489188790 514744612 /nfs/dbraw/zinc/74/46/12/514744612.db2.gz ZRCCWQGXQBJYGL-INIZCTEOSA-N 1 1 358.341 2.552 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CC[C@H](C)C1 ZINC000484855048 514815832 /nfs/dbraw/zinc/81/58/32/514815832.db2.gz GLUZLZDUXSJTQR-HOCLYGCPSA-N 1 1 361.442 2.621 20 5 FFBDMO CCc1ccc(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000471358309 514848805 /nfs/dbraw/zinc/84/88/05/514848805.db2.gz SYGYWWRKMZBUFM-OKILXGFUSA-N 1 1 363.458 2.775 20 5 FFBDMO CCc1ccc(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000471358309 514848812 /nfs/dbraw/zinc/84/88/12/514848812.db2.gz SYGYWWRKMZBUFM-OKILXGFUSA-N 1 1 363.458 2.775 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000498316824 514857699 /nfs/dbraw/zinc/85/76/99/514857699.db2.gz JQPNYZQNDKZWFO-HNNXBMFYSA-N 1 1 368.437 2.947 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H]1CC=CCC1 ZINC000485112479 514917857 /nfs/dbraw/zinc/91/78/57/514917857.db2.gz HVKVLDGMQLDGEC-MRXNPFEDSA-N 1 1 373.453 2.789 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458621937 514961334 /nfs/dbraw/zinc/96/13/34/514961334.db2.gz DPCDRWXHWNBHKR-CYBMUJFWSA-N 1 1 368.865 2.822 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC[NH+]2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000467423371 515002595 /nfs/dbraw/zinc/00/25/95/515002595.db2.gz MLVGPKFYWDICTK-GHMZBOCLSA-N 1 1 361.489 2.506 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000503702942 515124936 /nfs/dbraw/zinc/12/49/36/515124936.db2.gz RSFSGNRUTIFDBE-GOEBONIOSA-N 1 1 360.385 2.963 20 5 FFBDMO COc1cc(C[N@@H+](Cc2ccc(C(N)=O)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000485816006 515201706 /nfs/dbraw/zinc/20/17/06/515201706.db2.gz NOYNMWGVFBXFRB-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO CC(=O)N[C@H](C)C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000481133434 515217548 /nfs/dbraw/zinc/21/75/48/515217548.db2.gz AXOVFQIZWICMLV-CYBMUJFWSA-N 1 1 372.425 2.986 20 5 FFBDMO CNc1c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000462781602 515242970 /nfs/dbraw/zinc/24/29/70/515242970.db2.gz YWCUOZMBVPHEBY-BBRMVZONSA-N 1 1 358.442 2.725 20 5 FFBDMO COc1cc(NCCCN2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000462795457 515248509 /nfs/dbraw/zinc/24/85/09/515248509.db2.gz SQCQLXYAGCVOHM-UHFFFAOYSA-N 1 1 371.441 2.623 20 5 FFBDMO COc1ccc(CNc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000462856903 515271147 /nfs/dbraw/zinc/27/11/47/515271147.db2.gz UMCNEOWVCUAISV-KRWDZBQOSA-N 1 1 357.410 2.782 20 5 FFBDMO Cc1[nH+]ccn1C[C@H]1CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000485956480 515273626 /nfs/dbraw/zinc/27/36/26/515273626.db2.gz KTOAZMBMSQDMIL-OAHLLOKOSA-N 1 1 354.370 2.819 20 5 FFBDMO CCC[C@H]1CN(c2ccc([N+](=O)[O-])c(OCC)c2)CC[N@H+]1CCOC ZINC000499640864 515394949 /nfs/dbraw/zinc/39/49/49/515394949.db2.gz KKLHCUWMYPWHES-INIZCTEOSA-N 1 1 351.447 2.931 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713381 515434599 /nfs/dbraw/zinc/43/45/99/515434599.db2.gz CHGBPTXREABMAM-ZIAGYGMSSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713381 515434605 /nfs/dbraw/zinc/43/46/05/515434605.db2.gz CHGBPTXREABMAM-ZIAGYGMSSA-N 1 1 356.806 2.791 20 5 FFBDMO CN(CC(=O)NCCC[N@@H+](C)C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000463324536 515442007 /nfs/dbraw/zinc/44/20/07/515442007.db2.gz ILFKYWACYVBMAO-UHFFFAOYSA-N 1 1 362.474 2.802 20 5 FFBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)OC ZINC000499786699 515453710 /nfs/dbraw/zinc/45/37/10/515453710.db2.gz PIEBRYYKOIKSMQ-LBPRGKRZSA-N 1 1 351.403 2.505 20 5 FFBDMO CNC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000468672725 515463102 /nfs/dbraw/zinc/46/31/02/515463102.db2.gz BTTUPUJJLKTHHM-ZDUSSCGKSA-N 1 1 360.439 2.827 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000499879358 515490842 /nfs/dbraw/zinc/49/08/42/515490842.db2.gz RZFIRMGACYIUBD-ZFWWWQNUSA-N 1 1 354.410 2.742 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000481985228 515537482 /nfs/dbraw/zinc/53/74/82/515537482.db2.gz XTJFQTHCAWAIDZ-ZDUSSCGKSA-N 1 1 368.397 2.837 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NCC[N@@H+]3CC=CCC3)cc2[N+](=O)[O-])CC1 ZINC000477638037 515537858 /nfs/dbraw/zinc/53/78/58/515537858.db2.gz IFBPVPUCVITVTR-UHFFFAOYSA-N 1 1 372.469 2.823 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457009393 515581795 /nfs/dbraw/zinc/58/17/95/515581795.db2.gz DAHSCZFFPZZVFQ-IBGZPJMESA-N 1 1 364.405 2.792 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000500096533 515589962 /nfs/dbraw/zinc/58/99/62/515589962.db2.gz DRURGJXXUNGCGU-UHFFFAOYSA-N 1 1 363.414 2.731 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000457048068 515607644 /nfs/dbraw/zinc/60/76/44/515607644.db2.gz DHRMEAVJBANWAZ-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2c(F)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000505798190 515675450 /nfs/dbraw/zinc/67/54/50/515675450.db2.gz ZDLGUHFMKKJSDC-QLFBSQMISA-N 1 1 351.422 2.808 20 5 FFBDMO CC[N@@H+](CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000487005903 515717982 /nfs/dbraw/zinc/71/79/82/515717982.db2.gz MFIHAVBMCKJDCQ-UHFFFAOYSA-N 1 1 356.854 2.820 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c2c(c1)COCO2 ZINC000459747850 515785392 /nfs/dbraw/zinc/78/53/92/515785392.db2.gz HEIFKNZRQSQYBO-ZWKOTPCHSA-N 1 1 362.426 2.834 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511120716 515792131 /nfs/dbraw/zinc/79/21/31/515792131.db2.gz DDFBXWUMXJREOR-UHFFFAOYSA-N 1 1 358.394 2.935 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459806283 515818192 /nfs/dbraw/zinc/81/81/92/515818192.db2.gz MOBZCBMLKMKMDR-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459806283 515818198 /nfs/dbraw/zinc/81/81/98/515818198.db2.gz MOBZCBMLKMKMDR-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000482986346 515872702 /nfs/dbraw/zinc/87/27/02/515872702.db2.gz CHGHLKXKZOVCDQ-OAHLLOKOSA-N 1 1 360.458 2.778 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2sccc2Cl)cc1 ZINC000487550695 515902053 /nfs/dbraw/zinc/90/20/53/515902053.db2.gz RSLCTDYIHQSIPX-UHFFFAOYSA-N 1 1 360.844 2.873 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000487948452 516047261 /nfs/dbraw/zinc/04/72/61/516047261.db2.gz DLRNHBAWPQCVHH-AWEZNQCLSA-N 1 1 373.400 2.977 20 5 FFBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000495083532 516059212 /nfs/dbraw/zinc/05/92/12/516059212.db2.gz COKBLEBRPOARMB-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000495083532 516059219 /nfs/dbraw/zinc/05/92/19/516059219.db2.gz COKBLEBRPOARMB-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCC[C@H]1C ZINC000487992116 516067607 /nfs/dbraw/zinc/06/76/07/516067607.db2.gz XBICEWLWNKIBTM-CZUORRHYSA-N 1 1 365.430 2.679 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H](C)[N@@H+](CC)C[C@H]1C ZINC000460208861 516068898 /nfs/dbraw/zinc/06/88/98/516068898.db2.gz HPXRHCGOIZWVCR-ZIAGYGMSSA-N 1 1 358.446 2.792 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1c2ccccc2ncc1[N+](=O)[O-] ZINC000488087409 516112997 /nfs/dbraw/zinc/11/29/97/516112997.db2.gz KDIKYPBFFZFEEB-UHFFFAOYSA-N 1 1 365.393 2.849 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000512076994 516141800 /nfs/dbraw/zinc/14/18/00/516141800.db2.gz NSZHHTLZMQUUIP-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000470152527 516147582 /nfs/dbraw/zinc/14/75/82/516147582.db2.gz NJMZDIUJHQDUSU-IAISJRAMSA-N 1 1 355.394 2.941 20 5 FFBDMO CC(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000495369362 516147937 /nfs/dbraw/zinc/14/79/37/516147937.db2.gz QNXSRABTWWWRMF-QGZVFWFLSA-N 1 1 368.397 2.563 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000507271135 516149629 /nfs/dbraw/zinc/14/96/29/516149629.db2.gz FCMBZPIDEOGBBO-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(Cc2cnn(C)c2)CC1 ZINC000470176476 516163306 /nfs/dbraw/zinc/16/33/06/516163306.db2.gz WOAAZSNHBBRTAM-MHWRWJLKSA-N 1 1 355.442 2.549 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](CCC(F)(F)F)C[C@H](O)CO ZINC000470182136 516166504 /nfs/dbraw/zinc/16/65/04/516166504.db2.gz IWNXXVSXZIYLHR-XCHKQJEOSA-N 1 1 362.348 2.606 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000474755940 516182874 /nfs/dbraw/zinc/18/28/74/516182874.db2.gz KSOAGFIMNSLEGU-UHFFFAOYSA-N 1 1 372.347 2.675 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@H](C)c1ccccc1 ZINC000488390882 516212185 /nfs/dbraw/zinc/21/21/85/516212185.db2.gz NCKFLHNXHSGLLO-HIFRSBDPSA-N 1 1 359.430 2.813 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCc2ccccc2C1 ZINC000501818000 516234488 /nfs/dbraw/zinc/23/44/88/516234488.db2.gz ULDOJFCCZOARNX-SFHVURJKSA-N 1 1 370.453 2.746 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC000460801326 516251541 /nfs/dbraw/zinc/25/15/41/516251541.db2.gz WISSTYBNMSFHQT-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cncs1 ZINC000501887724 516256312 /nfs/dbraw/zinc/25/63/12/516256312.db2.gz NEVXXRSJJMTMJX-UHFFFAOYSA-N 1 1 364.427 2.529 20 5 FFBDMO COc1ccc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000512399728 516264744 /nfs/dbraw/zinc/26/47/44/516264744.db2.gz MDWBGVWAMMQCHH-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO Cc1c(Br)c(N2CC[C@]3(CC[N@H+](C)C3)C2)ncc1[N+](=O)[O-] ZINC000488743163 516298507 /nfs/dbraw/zinc/29/85/07/516298507.db2.gz HBSUGVKZJBJVTJ-AWEZNQCLSA-N 1 1 355.236 2.593 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000497532612 516325541 /nfs/dbraw/zinc/32/55/41/516325541.db2.gz KVSLPGIUFSFICB-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000497532612 516325542 /nfs/dbraw/zinc/32/55/42/516325542.db2.gz KVSLPGIUFSFICB-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000497603993 516327664 /nfs/dbraw/zinc/32/76/64/516327664.db2.gz JXXKKPXTMHERES-MNOVXSKESA-N 1 1 357.357 2.751 20 5 FFBDMO C[C@H](O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000554544975 516500422 /nfs/dbraw/zinc/50/04/22/516500422.db2.gz XXHUPJMVKXXFRI-HNNXBMFYSA-N 1 1 357.410 2.806 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000524314288 516691999 /nfs/dbraw/zinc/69/19/99/516691999.db2.gz LITIUQKIWQQVPY-ZNMIVQPWSA-N 1 1 363.458 2.629 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000536391299 516748098 /nfs/dbraw/zinc/74/80/98/516748098.db2.gz UHPNZZPYZMGKNQ-INIZCTEOSA-N 1 1 356.426 2.601 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@@H](C)C1 ZINC000561762681 516758333 /nfs/dbraw/zinc/75/83/33/516758333.db2.gz PTYKIIXRYKWZSH-DCGLDWPTSA-N 1 1 356.426 2.878 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441007 516760674 /nfs/dbraw/zinc/76/06/74/516760674.db2.gz UYRCYIHUWTWMDY-VBQJREDUSA-N 1 1 363.458 2.959 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441007 516760680 /nfs/dbraw/zinc/76/06/80/516760680.db2.gz UYRCYIHUWTWMDY-VBQJREDUSA-N 1 1 363.458 2.959 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000524708486 516795912 /nfs/dbraw/zinc/79/59/12/516795912.db2.gz KQUWLAKUHANKEI-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO CNc1ccc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000558556954 516806808 /nfs/dbraw/zinc/80/68/08/516806808.db2.gz CAYZUQVWPDWFAK-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000524881120 516858337 /nfs/dbraw/zinc/85/83/37/516858337.db2.gz UTVCOVPJZIOBRY-PBHICJAKSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@@H](C(=O)NCC[N@@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000555309591 516874310 /nfs/dbraw/zinc/87/43/10/516874310.db2.gz GPQHYKVMQSIOFC-CYBMUJFWSA-N 1 1 359.451 2.934 20 5 FFBDMO C[C@@H](C(=O)NCC[N@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000555309591 516874323 /nfs/dbraw/zinc/87/43/23/516874323.db2.gz GPQHYKVMQSIOFC-CYBMUJFWSA-N 1 1 359.451 2.934 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000536659632 516880178 /nfs/dbraw/zinc/88/01/78/516880178.db2.gz DFHPIUKEVFIEIK-LJQANCHMSA-N 1 1 355.394 2.957 20 5 FFBDMO O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000548410965 516965570 /nfs/dbraw/zinc/96/55/70/516965570.db2.gz YHNYVAAYXRSUFC-AWEZNQCLSA-N 1 1 363.805 2.538 20 5 FFBDMO CCO[C@H]1C[C@@H]1[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000514707986 517013747 /nfs/dbraw/zinc/01/37/47/517013747.db2.gz HSKTULGYGPXBEU-JQWIXIFHSA-N 1 1 364.320 2.812 20 5 FFBDMO CCc1cnc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)o1 ZINC000548488004 517013849 /nfs/dbraw/zinc/01/38/49/517013849.db2.gz NGPGQZVIENWHEI-UHFFFAOYSA-N 1 1 370.413 2.734 20 5 FFBDMO CCc1cnc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)o1 ZINC000548488004 517013853 /nfs/dbraw/zinc/01/38/53/517013853.db2.gz NGPGQZVIENWHEI-UHFFFAOYSA-N 1 1 370.413 2.734 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000525353686 517014451 /nfs/dbraw/zinc/01/44/51/517014451.db2.gz BNZSVFXHVCDXDQ-QGZVFWFLSA-N 1 1 362.474 2.947 20 5 FFBDMO COc1ccc(CC(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)cc1[N+](=O)[O-] ZINC000532691300 517100380 /nfs/dbraw/zinc/10/03/80/517100380.db2.gz DXYAPARGEZWGPM-MRXNPFEDSA-N 1 1 363.458 2.773 20 5 FFBDMO CCOc1cc(C(=O)NCCNc2cccc(C)[nH+]2)c([N+](=O)[O-])cc1OC ZINC000525686259 517115191 /nfs/dbraw/zinc/11/51/91/517115191.db2.gz BSFYLGRYJUZYRT-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1C ZINC000515100457 517211008 /nfs/dbraw/zinc/21/10/08/517211008.db2.gz WIKCTBIRGHGPAG-UONOGXRCSA-N 1 1 369.487 2.753 20 5 FFBDMO COc1cc(C[N@@H+](C)CC2(O)CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000545394378 517218249 /nfs/dbraw/zinc/21/82/49/517218249.db2.gz GTIDTATWIJIXHD-UHFFFAOYSA-N 1 1 360.357 2.594 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@@H+]1Cc1ccccc1 ZINC000545403473 517221666 /nfs/dbraw/zinc/22/16/66/517221666.db2.gz CKBCMMZACBCNKA-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000545403473 517221677 /nfs/dbraw/zinc/22/16/77/517221677.db2.gz CKBCMMZACBCNKA-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO CC1(C)C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]2CCC[C@@H]21 ZINC000559424973 517249433 /nfs/dbraw/zinc/24/94/33/517249433.db2.gz FTPIHDLQBCLCLL-WCQYABFASA-N 1 1 361.398 2.773 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000520058907 517267097 /nfs/dbraw/zinc/26/70/97/517267097.db2.gz NBHGCPFDAMNIAN-MRXNPFEDSA-N 1 1 356.426 2.718 20 5 FFBDMO CCc1ccc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000552516031 517290566 /nfs/dbraw/zinc/29/05/66/517290566.db2.gz GQNIPZIVIVVHTC-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO COc1cc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000520198614 517297470 /nfs/dbraw/zinc/29/74/70/517297470.db2.gz WGVCSNLSOPNLJA-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1cc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000520198614 517297476 /nfs/dbraw/zinc/29/74/76/517297476.db2.gz WGVCSNLSOPNLJA-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C[C@H](C)OC)C(C)C ZINC000533295909 517390389 /nfs/dbraw/zinc/39/03/89/517390389.db2.gz NIADGSIRFWKSDX-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549171754 517435380 /nfs/dbraw/zinc/43/53/80/517435380.db2.gz PDRGFCOALZUIEC-HNNXBMFYSA-N 1 1 373.428 2.956 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000538262757 517528795 /nfs/dbraw/zinc/52/87/95/517528795.db2.gz HZWLVNFSFVNEPQ-ADAWSYLGSA-N 1 1 363.458 2.906 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])Nc1c[nH+]ccc1-n1cccn1 ZINC000521077093 517606231 /nfs/dbraw/zinc/60/62/31/517606231.db2.gz YHDHFNLQFASCLB-UHFFFAOYSA-N 1 1 353.338 2.583 20 5 FFBDMO CC[C@@H](CO)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000542518645 517607864 /nfs/dbraw/zinc/60/78/64/517607864.db2.gz YTXMNDBGADRVCU-INIZCTEOSA-N 1 1 357.410 2.806 20 5 FFBDMO CC[C@@H](CO)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000542518645 517607874 /nfs/dbraw/zinc/60/78/74/517607874.db2.gz YTXMNDBGADRVCU-INIZCTEOSA-N 1 1 357.410 2.806 20 5 FFBDMO CC(C)c1cc(N2CCOc3ccc([N+](=O)[O-])cc3C2)nc(N(C)C)[nH+]1 ZINC000516221821 517624537 /nfs/dbraw/zinc/62/45/37/517624537.db2.gz ZNOKNRYKZMFJEG-UHFFFAOYSA-N 1 1 357.414 2.973 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000553353283 517662763 /nfs/dbraw/zinc/66/27/63/517662763.db2.gz SPDWTGXKVKTHAA-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)s1 ZINC000553482553 517738799 /nfs/dbraw/zinc/73/87/99/517738799.db2.gz GTEKNXXCCHYLSZ-OLZOCXBDSA-N 1 1 363.443 2.655 20 5 FFBDMO CC(=O)NCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCSCC1 ZINC000549852311 517745862 /nfs/dbraw/zinc/74/58/62/517745862.db2.gz ILDRDNHRGISRTI-XQRVVYSFSA-N 1 1 363.483 2.942 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516826136 517859238 /nfs/dbraw/zinc/85/92/38/517859238.db2.gz OROYAWHIIAEYGA-UGSOOPFHSA-N 1 1 373.457 2.600 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000538953269 517861768 /nfs/dbraw/zinc/86/17/68/517861768.db2.gz LLPOWUZHYXZLGN-MNOVXSKESA-N 1 1 359.373 2.729 20 5 FFBDMO COc1cc(CN2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000534348633 517865316 /nfs/dbraw/zinc/86/53/16/517865316.db2.gz GPXYBVBBVMYRDE-UHFFFAOYSA-N 1 1 351.447 2.918 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@@H+]1Cc1ccccc1 ZINC000546820555 517876417 /nfs/dbraw/zinc/87/64/17/517876417.db2.gz XQBOCJPFJDKRTA-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000546820555 517876427 /nfs/dbraw/zinc/87/64/27/517876427.db2.gz XQBOCJPFJDKRTA-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000543060187 517888551 /nfs/dbraw/zinc/88/85/51/517888551.db2.gz AVDOVSJFGAUNSD-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000543060187 517888559 /nfs/dbraw/zinc/88/85/59/517888559.db2.gz AVDOVSJFGAUNSD-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO COC(=O)CCC1CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000530764403 517965716 /nfs/dbraw/zinc/96/57/16/517965716.db2.gz VYOWMYFOONZUFY-UHFFFAOYSA-N 1 1 374.397 2.810 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000553958768 517993109 /nfs/dbraw/zinc/99/31/09/517993109.db2.gz QOXSOWPCVCZVBI-HNNXBMFYSA-N 1 1 372.425 2.988 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000543284470 518003012 /nfs/dbraw/zinc/00/30/12/518003012.db2.gz YQKIQBNFAUFSDE-NSHDSACASA-N 1 1 357.863 2.893 20 5 FFBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000543459306 518102980 /nfs/dbraw/zinc/10/29/80/518102980.db2.gz YYRPNWDDWNOATJ-MRVPVSSYSA-N 1 1 360.340 2.555 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1C ZINC000531141293 518152777 /nfs/dbraw/zinc/15/27/77/518152777.db2.gz QCCGODROAOLRSH-HIFRSBDPSA-N 1 1 359.430 2.949 20 5 FFBDMO COc1cc(CNCC[N@H+]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000539813154 518166951 /nfs/dbraw/zinc/16/69/51/518166951.db2.gz DKXGSDDIPBSIHL-LBPRGKRZSA-N 1 1 373.400 2.679 20 5 FFBDMO COc1cc(C[NH2+]CCN2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000539813154 518166954 /nfs/dbraw/zinc/16/69/54/518166954.db2.gz DKXGSDDIPBSIHL-LBPRGKRZSA-N 1 1 373.400 2.679 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000584245207 518245250 /nfs/dbraw/zinc/24/52/50/518245250.db2.gz SXDKVYFQSSFYMZ-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000584245207 518245255 /nfs/dbraw/zinc/24/52/55/518245255.db2.gz SXDKVYFQSSFYMZ-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO C[C@H](NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1=CC[N@@H+](C)CC1 ZINC000564076632 518296176 /nfs/dbraw/zinc/29/61/76/518296176.db2.gz MSQPKWURFSGOKA-ZDUSSCGKSA-N 1 1 371.441 2.568 20 5 FFBDMO CCc1cc(NC[C@H](C)[N@@H+](C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000567097663 518349343 /nfs/dbraw/zinc/34/93/43/518349343.db2.gz HSHULQGGDOWBCW-ZDUSSCGKSA-N 1 1 355.442 2.931 20 5 FFBDMO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202507 518349548 /nfs/dbraw/zinc/34/95/48/518349548.db2.gz MLBMUEXAGLNOCP-BZUAXINKSA-N 1 1 362.474 2.879 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000581685635 518407450 /nfs/dbraw/zinc/40/74/50/518407450.db2.gz VTZBJBSJEPUYPR-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC[C@@H]1CCO ZINC000585754722 518584620 /nfs/dbraw/zinc/58/46/20/518584620.db2.gz XGLKUCSXFXAVGU-CQSZACIVSA-N 1 1 365.430 2.559 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+]1C1CC1 ZINC000586836242 518658152 /nfs/dbraw/zinc/65/81/52/518658152.db2.gz KNEPYQSMSYCHSP-ZDUSSCGKSA-N 1 1 354.204 2.923 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000586836242 518658148 /nfs/dbraw/zinc/65/81/48/518658148.db2.gz KNEPYQSMSYCHSP-ZDUSSCGKSA-N 1 1 354.204 2.923 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CCc3c[nH+]cn3C2)ncc1[N+](=O)[O-] ZINC000588067775 518714523 /nfs/dbraw/zinc/71/45/23/518714523.db2.gz PAASGKVEUFRAIJ-SECBINFHSA-N 1 1 352.192 2.684 20 5 FFBDMO CC(C)[NH2+]CCCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000567850795 518746346 /nfs/dbraw/zinc/74/63/46/518746346.db2.gz FQJGQYCOZVZRHO-UHFFFAOYSA-N 1 1 370.258 2.568 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000565170698 518822349 /nfs/dbraw/zinc/82/23/49/518822349.db2.gz JVJIBIOBXRRFHR-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000565175760 518825702 /nfs/dbraw/zinc/82/57/02/518825702.db2.gz WLHCZJDXFLVKFZ-INIZCTEOSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000565175760 518825707 /nfs/dbraw/zinc/82/57/07/518825707.db2.gz WLHCZJDXFLVKFZ-INIZCTEOSA-N 1 1 371.441 2.701 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(=O)n3ccccc3n2)cc1[N+](=O)[O-] ZINC000573854112 518867305 /nfs/dbraw/zinc/86/73/05/518867305.db2.gz PGNCPOVTILQKTE-CYBMUJFWSA-N 1 1 368.393 2.852 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000579858521 518890564 /nfs/dbraw/zinc/89/05/64/518890564.db2.gz FDFJXHKPAYMXHH-QGZVFWFLSA-N 1 1 363.414 2.640 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000589107180 518917189 /nfs/dbraw/zinc/91/71/89/518917189.db2.gz PONFFVBSJPLPRN-UHFFFAOYSA-N 1 1 370.400 2.935 20 5 FFBDMO CCC(CC)[C@H](CNc1c([N+](=O)[O-])nc(C)n1CC)[NH+]1CCOCC1 ZINC000577167803 518945669 /nfs/dbraw/zinc/94/56/69/518945669.db2.gz BSQIJOMPLLBQSZ-HNNXBMFYSA-N 1 1 353.467 2.669 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000574065095 518972208 /nfs/dbraw/zinc/97/22/08/518972208.db2.gz SGZDCDHRFYGKDD-UHFFFAOYSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1cc(C[NH2+]Cc2cc(I)cc([N+](=O)[O-])c2)[nH]n1 ZINC000589313821 518980198 /nfs/dbraw/zinc/98/01/98/518980198.db2.gz YTGJSRPPCJPJHK-UHFFFAOYSA-N 1 1 372.166 2.521 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582922266 518988676 /nfs/dbraw/zinc/98/86/76/518988676.db2.gz PTBRBFWJGVAUPP-KRWDZBQOSA-N 1 1 368.437 2.645 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[N@H+](C2CCCC2)CC1 ZINC000589839030 519088285 /nfs/dbraw/zinc/08/82/85/519088285.db2.gz OVILHSYRTYXROO-UHFFFAOYSA-N 1 1 367.396 2.892 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135217 519158496 /nfs/dbraw/zinc/15/84/96/519158496.db2.gz FCBKJDMZHCIYAG-CYBMUJFWSA-N 1 1 374.363 2.674 20 5 FFBDMO CC1(C2CC2)CC[NH+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC1 ZINC000580485901 519199846 /nfs/dbraw/zinc/19/98/46/519199846.db2.gz GBSOHVMQVZFRMQ-UHFFFAOYSA-N 1 1 361.398 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000590602695 519285048 /nfs/dbraw/zinc/28/50/48/519285048.db2.gz VTQMLTRXAQRLKZ-RDJZCZTQSA-N 1 1 357.410 2.609 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1 ZINC000590656886 519303547 /nfs/dbraw/zinc/30/35/47/519303547.db2.gz FSEXDIZUDBNOHP-CGTJXYLNSA-N 1 1 362.426 2.897 20 5 FFBDMO COC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000590752234 519349835 /nfs/dbraw/zinc/34/98/35/519349835.db2.gz ICBQFDHITBZUIQ-GDLCADMTSA-N 1 1 360.370 2.637 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC[C@@H](C)C1 ZINC000578030769 519381771 /nfs/dbraw/zinc/38/17/71/519381771.db2.gz PTXDBFLVOWLZIB-SNVBAGLBSA-N 1 1 370.247 2.737 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2c([N+](=O)[O-])nc(C)n2CC)[C@H](C)C1 ZINC000578159842 519450379 /nfs/dbraw/zinc/45/03/79/519450379.db2.gz ZHYLNGBDGGEDOG-HIFRSBDPSA-N 1 1 353.467 2.669 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000581085223 519516937 /nfs/dbraw/zinc/51/69/37/519516937.db2.gz GQNQZAMNRASCOG-GOSISDBHSA-N 1 1 370.405 2.595 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000581085223 519516942 /nfs/dbraw/zinc/51/69/42/519516942.db2.gz GQNQZAMNRASCOG-GOSISDBHSA-N 1 1 370.405 2.595 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](O)[C@H]1CCc1ccccc1 ZINC000602851524 519924315 /nfs/dbraw/zinc/92/43/15/519924315.db2.gz LOIRZUISEHHLNW-QZTJIDSGSA-N 1 1 358.442 2.558 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000602875149 519942240 /nfs/dbraw/zinc/94/22/40/519942240.db2.gz WNMGNDXWXUTZGS-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC=C(c3cnn(C)c3)C2)c([N+](=O)[O-])c1 ZINC000602886107 519948989 /nfs/dbraw/zinc/94/89/89/519948989.db2.gz GYWPMTZSCQSLNR-UHFFFAOYSA-N 1 1 358.398 2.505 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000599930535 519957472 /nfs/dbraw/zinc/95/74/72/519957472.db2.gz QCMIKESSQZMJTQ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000599930535 519957479 /nfs/dbraw/zinc/95/74/79/519957479.db2.gz QCMIKESSQZMJTQ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccncc1)C1(CO)CCC1 ZINC000602903898 519962313 /nfs/dbraw/zinc/96/23/13/519962313.db2.gz SEGCIWAYWVZMEW-GOSISDBHSA-N 1 1 357.410 2.992 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccncc1)C1(CO)CCC1 ZINC000602903370 519963459 /nfs/dbraw/zinc/96/34/59/519963459.db2.gz RMBODIOLYAQUPA-GOSISDBHSA-N 1 1 357.410 2.992 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC2CC2)C[C@H]1C ZINC000597407062 520005977 /nfs/dbraw/zinc/00/59/77/520005977.db2.gz QVTXGDQGAAYCRF-CQSZACIVSA-N 1 1 370.457 2.794 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000602997804 520012637 /nfs/dbraw/zinc/01/26/37/520012637.db2.gz RCABYIWXZAOPDW-QGTPRVQTSA-N 1 1 361.442 2.857 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997775 520013125 /nfs/dbraw/zinc/01/31/25/520013125.db2.gz QMTMYCXSDGZUHM-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997775 520013129 /nfs/dbraw/zinc/01/31/29/520013129.db2.gz QMTMYCXSDGZUHM-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597575937 520114051 /nfs/dbraw/zinc/11/40/51/520114051.db2.gz AIKIZBPSPAOAGU-QWHCGFSZSA-N 1 1 355.797 2.815 20 5 FFBDMO Cc1cc(N2CCOC3(CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000591990882 520125193 /nfs/dbraw/zinc/12/51/93/520125193.db2.gz GBPFXLIHXVRDDX-UHFFFAOYSA-N 1 1 356.426 2.752 20 5 FFBDMO CCn1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000616785233 520137721 /nfs/dbraw/zinc/13/77/21/520137721.db2.gz FGEAAHNNMUKECA-CYBMUJFWSA-N 1 1 360.414 2.884 20 5 FFBDMO CCn1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000616785233 520137728 /nfs/dbraw/zinc/13/77/28/520137728.db2.gz FGEAAHNNMUKECA-CYBMUJFWSA-N 1 1 360.414 2.884 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594791307 520160047 /nfs/dbraw/zinc/16/00/47/520160047.db2.gz NWDXKHWYGFOISE-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000597680599 520172858 /nfs/dbraw/zinc/17/28/58/520172858.db2.gz XENDZLIEJFFUSP-ZDUSSCGKSA-N 1 1 373.409 2.666 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000600299225 520188313 /nfs/dbraw/zinc/18/83/13/520188313.db2.gz RHHNCEOUPVUUPA-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000600299225 520188322 /nfs/dbraw/zinc/18/83/22/520188322.db2.gz RHHNCEOUPVUUPA-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO Cn1cc(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000592130999 520205825 /nfs/dbraw/zinc/20/58/25/520205825.db2.gz OSSMSKWHBKYHCC-IYARVYRRSA-N 1 1 358.442 2.677 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+](CC(C)C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000592138793 520215093 /nfs/dbraw/zinc/21/50/93/520215093.db2.gz CTDUHGIZVGJOKI-GOSISDBHSA-N 1 1 360.458 2.927 20 5 FFBDMO Cc1ncc2c(n1)CC[N@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000609193267 520226665 /nfs/dbraw/zinc/22/66/65/520226665.db2.gz XGXJIWMRYGKKKC-UHFFFAOYSA-N 1 1 365.393 2.949 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1[C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CCOCC2 ZINC000592183920 520249788 /nfs/dbraw/zinc/24/97/88/520249788.db2.gz LFJILTUSDNKZTN-PBHICJAKSA-N 1 1 359.426 2.591 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000592184601 520251505 /nfs/dbraw/zinc/25/15/05/520251505.db2.gz KVZPFVZRHKCCAJ-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000592184601 520251509 /nfs/dbraw/zinc/25/15/09/520251509.db2.gz KVZPFVZRHKCCAJ-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO COc1cc(CNc2cc[nH+]c(C)c2Br)cc([N+](=O)[O-])c1O ZINC000616955333 520255814 /nfs/dbraw/zinc/25/58/14/520255814.db2.gz DEAGWOFNOHWZIY-UHFFFAOYSA-N 1 1 368.187 2.809 20 5 FFBDMO Cn1ccnc1[C@@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056503 520272444 /nfs/dbraw/zinc/27/24/44/520272444.db2.gz KAFKUOFDGUBJCL-WBVHZDCISA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000597857339 520284195 /nfs/dbraw/zinc/28/41/95/520284195.db2.gz DUVNYXZRDXCNDY-HNNXBMFYSA-N 1 1 360.458 2.798 20 5 FFBDMO O=[N+]([O-])c1cccnc1NCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000603591399 520319447 /nfs/dbraw/zinc/31/94/47/520319447.db2.gz XBEMHCHGIAPWEW-UHFFFAOYSA-N 1 1 355.442 2.610 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4cncs4)CC3)nc2c1 ZINC000595431175 520466076 /nfs/dbraw/zinc/46/60/76/520466076.db2.gz DUOXJHXAJKVUES-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO COc1ccc(C[N@H+](Cc2onc(C)c2[N+](=O)[O-])[C@H](CO)C(C)C)cc1 ZINC000595430022 520466773 /nfs/dbraw/zinc/46/67/73/520466773.db2.gz UQSJCJBSLSCNJH-MRXNPFEDSA-N 1 1 363.414 2.919 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2onc(C)c2[N+](=O)[O-])[C@H](CO)C(C)C)cc1 ZINC000595430022 520466784 /nfs/dbraw/zinc/46/67/84/520466784.db2.gz UQSJCJBSLSCNJH-MRXNPFEDSA-N 1 1 363.414 2.919 20 5 FFBDMO C[C@@H]1C[C@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000595431112 520466905 /nfs/dbraw/zinc/46/69/05/520466905.db2.gz CLBRRVMJZLLGMK-ZIAGYGMSSA-N 1 1 359.430 2.551 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000609963933 520491317 /nfs/dbraw/zinc/49/13/17/520491317.db2.gz JQVKYJWUSCZYCS-QWHCGFSZSA-N 1 1 350.419 2.841 20 5 FFBDMO C[C@H]1C[NH+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)c2)C[C@H](C)O1 ZINC000609992948 520497331 /nfs/dbraw/zinc/49/73/31/520497331.db2.gz HKQMYPVGQSJTLQ-STQMWFEESA-N 1 1 358.398 2.784 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000595513504 520521979 /nfs/dbraw/zinc/52/19/79/520521979.db2.gz FUQLUGUUBBNIRK-QGZVFWFLSA-N 1 1 374.416 2.864 20 5 FFBDMO Cc1cc(C(=O)N[C@H](C)C2([NH+]3CCOCC3)CCCC2)ccc1[N+](=O)[O-] ZINC000610247337 520599181 /nfs/dbraw/zinc/59/91/81/520599181.db2.gz ZGVCYTLWXTZTFK-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO CCCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000592828863 520604511 /nfs/dbraw/zinc/60/45/11/520604511.db2.gz KFWMLAZFEMPZQU-LBPRGKRZSA-N 1 1 357.357 2.753 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000604573292 520609365 /nfs/dbraw/zinc/60/93/65/520609365.db2.gz DAPZLRPWKAIPTM-INIZCTEOSA-N 1 1 373.409 2.668 20 5 FFBDMO CC(=O)c1ccc(OC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000601070364 520623649 /nfs/dbraw/zinc/62/36/49/520623649.db2.gz QLSXLPIFZYQGIV-HXUWFJFHSA-N 1 1 370.405 2.813 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610335349 520640738 /nfs/dbraw/zinc/64/07/38/520640738.db2.gz LILQZIUTCXNADR-ZDUSSCGKSA-N 1 1 359.213 2.591 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595684256 520647916 /nfs/dbraw/zinc/64/79/16/520647916.db2.gz MVKFAVWBVHKOQE-MRXNPFEDSA-N 1 1 359.382 2.519 20 5 FFBDMO COc1ccc(COCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000610391526 520663966 /nfs/dbraw/zinc/66/39/66/520663966.db2.gz OZUUDIKUVBKMQG-INIZCTEOSA-N 1 1 372.425 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCn4c(CC5CC5)nnc4C3)c2c1 ZINC000601184704 520677707 /nfs/dbraw/zinc/67/77/07/520677707.db2.gz MELIENVIRNVBMR-UHFFFAOYSA-N 1 1 350.382 2.707 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000610430766 520680448 /nfs/dbraw/zinc/68/04/48/520680448.db2.gz OKTOJLGBFZJWSN-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CO)c2sccc2C)c1 ZINC000593024238 520691197 /nfs/dbraw/zinc/69/11/97/520691197.db2.gz DCWYVBVEMGVEEZ-ZDUSSCGKSA-N 1 1 350.396 2.575 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCCC[N@H+]1CCc2ccccc2C1 ZINC000593030214 520695332 /nfs/dbraw/zinc/69/53/32/520695332.db2.gz JEZMBXJIRBEFRZ-UHFFFAOYSA-N 1 1 371.412 2.841 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC1=CCCOC1 ZINC000595752487 520699647 /nfs/dbraw/zinc/69/96/47/520699647.db2.gz KRXLCRWDVOQZBG-NSHDSACASA-N 1 1 353.806 2.854 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1=CCCOC1 ZINC000595752487 520699652 /nfs/dbraw/zinc/69/96/52/520699652.db2.gz KRXLCRWDVOQZBG-NSHDSACASA-N 1 1 353.806 2.854 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595788975 520724779 /nfs/dbraw/zinc/72/47/79/520724779.db2.gz ORIQCFFAMLUADY-LPHOPBHVSA-N 1 1 373.453 2.765 20 5 FFBDMO COc1ccc(C[C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000593085567 520734927 /nfs/dbraw/zinc/73/49/27/520734927.db2.gz ZPEVWOQCZWUDNE-KRWDZBQOSA-N 1 1 371.437 2.862 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000593094227 520741289 /nfs/dbraw/zinc/74/12/89/520741289.db2.gz YCADOUBFLXYZIB-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000598612510 520742349 /nfs/dbraw/zinc/74/23/49/520742349.db2.gz QABNONDTEPFOBP-DZGCQCFKSA-N 1 1 369.487 2.562 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CN2CCCC2=O)C1 ZINC000595832388 520756038 /nfs/dbraw/zinc/75/60/38/520756038.db2.gz PENWOYVMBAXMJG-OAHLLOKOSA-N 1 1 361.442 2.826 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCc2ccccc21 ZINC000595882213 520790323 /nfs/dbraw/zinc/79/03/23/520790323.db2.gz ZJNUHGMBYWTYNV-SJLPKXTDSA-N 1 1 356.422 2.996 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]2C)cc1OC ZINC000593188160 520810453 /nfs/dbraw/zinc/81/04/53/520810453.db2.gz WWZMRGRAPJDZFP-UPJWGTAASA-N 1 1 365.430 2.555 20 5 FFBDMO CCOc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000593187408 520811412 /nfs/dbraw/zinc/81/14/12/520811412.db2.gz KCGOVPXLLHNWAQ-UPJWGTAASA-N 1 1 365.430 2.555 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000595915675 520822419 /nfs/dbraw/zinc/82/24/19/520822419.db2.gz JPXSSHCDUDGOAR-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@](C)(C(F)F)C1 ZINC000595915675 520822426 /nfs/dbraw/zinc/82/24/26/520822426.db2.gz JPXSSHCDUDGOAR-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO COCCOc1ccccc1N1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610765269 520834008 /nfs/dbraw/zinc/83/40/08/520834008.db2.gz IQEDYJVDIGMHIN-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cn1cc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993521 520966551 /nfs/dbraw/zinc/96/65/51/520966551.db2.gz DDIRSUUJOSFIDL-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO Cn1cc(CNC[C@H]2CCCC[N@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993521 520966561 /nfs/dbraw/zinc/96/65/61/520966561.db2.gz DDIRSUUJOSFIDL-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO Cn1cc(CNC[C@H]2CCCC[N@@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993521 520966572 /nfs/dbraw/zinc/96/65/72/520966572.db2.gz DDIRSUUJOSFIDL-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@@H](C)C1 ZINC000596270237 521002985 /nfs/dbraw/zinc/00/29/85/521002985.db2.gz XEXRNDBWEPWCPW-NSHDSACASA-N 1 1 355.822 2.955 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596309324 521021694 /nfs/dbraw/zinc/02/16/94/521021694.db2.gz YNTAHTVWFMYDDY-SNVBAGLBSA-N 1 1 361.489 2.592 20 5 FFBDMO COc1cccc(C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC(C)C)c1 ZINC000611185027 521028806 /nfs/dbraw/zinc/02/88/06/521028806.db2.gz LFRKQUQMTKXGPE-UHFFFAOYSA-N 1 1 359.426 2.923 20 5 FFBDMO O=C(c1c(Br)cccc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000599110738 521037306 /nfs/dbraw/zinc/03/73/06/521037306.db2.gz MSLOJQMRHLTNIU-UHFFFAOYSA-N 1 1 368.231 2.525 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000599121694 521040562 /nfs/dbraw/zinc/04/05/62/521040562.db2.gz VLFMQCLOGXSYMC-ZWKOTPCHSA-N 1 1 369.421 2.565 20 5 FFBDMO CCc1nn(C)c(N2CCC[N@@H+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000611280747 521077695 /nfs/dbraw/zinc/07/76/95/521077695.db2.gz DZXXOCOPAGUUHN-UHFFFAOYSA-N 1 1 357.458 2.911 20 5 FFBDMO COc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c([N+](=O)[O-])cc1F ZINC000596514943 521108034 /nfs/dbraw/zinc/10/80/34/521108034.db2.gz OOAIIGVZMXPHQX-IAGOWNOFSA-N 1 1 365.405 2.798 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1C(F)(F)F ZINC000596541605 521123416 /nfs/dbraw/zinc/12/34/16/521123416.db2.gz ZVNJWJYOZMJBRG-ZDUSSCGKSA-N 1 1 359.348 2.649 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735959 521182405 /nfs/dbraw/zinc/18/24/05/521182405.db2.gz AYJYDPNHUMBGQB-LXZKKBNFSA-N 1 1 353.850 2.967 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735959 521182406 /nfs/dbraw/zinc/18/24/06/521182406.db2.gz AYJYDPNHUMBGQB-LXZKKBNFSA-N 1 1 353.850 2.967 20 5 FFBDMO Cc1ccc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)c(N2CCCC2)[nH+]1 ZINC000611576593 521229379 /nfs/dbraw/zinc/22/93/79/521229379.db2.gz XCGIHNRXLDNRDZ-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO Cc1ccc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611583863 521236671 /nfs/dbraw/zinc/23/66/71/521236671.db2.gz FLEHSZWNRGDHHR-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000599453336 521237370 /nfs/dbraw/zinc/23/73/70/521237370.db2.gz QBVHXRVKRPECBE-UHFFFAOYSA-N 1 1 356.304 2.691 20 5 FFBDMO C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)C1(F)F ZINC000599512746 521270232 /nfs/dbraw/zinc/27/02/32/521270232.db2.gz MEESXMCCPWORFG-ZOWXZIJZSA-N 1 1 353.369 2.923 20 5 FFBDMO C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)C1(F)F ZINC000599512746 521270237 /nfs/dbraw/zinc/27/02/37/521270237.db2.gz MEESXMCCPWORFG-ZOWXZIJZSA-N 1 1 353.369 2.923 20 5 FFBDMO C[C@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2ccccc2C1 ZINC000611703513 521288021 /nfs/dbraw/zinc/28/80/21/521288021.db2.gz UAAHNTDKUCNECF-CQSZACIVSA-N 1 1 363.421 2.819 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000596891935 521360580 /nfs/dbraw/zinc/36/05/80/521360580.db2.gz YFNDGUTVPUUATG-ZDUSSCGKSA-N 1 1 350.419 2.988 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])n1 ZINC000602481690 521369882 /nfs/dbraw/zinc/36/98/82/521369882.db2.gz CTQRBOLFCYRHCI-HKUYNNGSSA-N 1 1 369.469 2.815 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000599659915 521373483 /nfs/dbraw/zinc/37/34/83/521373483.db2.gz LSMQKTVMFWJUDU-UWVGGRQHSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCCC2)O1 ZINC000594057195 521378233 /nfs/dbraw/zinc/37/82/33/521378233.db2.gz ASZAZVITQIHWDQ-HZPDHXFCSA-N 1 1 364.442 2.758 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CCN[C@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000611938549 521401846 /nfs/dbraw/zinc/40/18/46/521401846.db2.gz NYWNEHWIUYAYRN-LJQANCHMSA-N 1 1 370.453 2.573 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597091222 521496368 /nfs/dbraw/zinc/49/63/68/521496368.db2.gz YRYFRYYHEZFXMZ-SNVBAGLBSA-N 1 1 355.826 2.684 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC000597095658 521501515 /nfs/dbraw/zinc/50/15/15/521501515.db2.gz ZMGKERNUXWGRMH-GHMZBOCLSA-N 1 1 353.810 2.579 20 5 FFBDMO Cn1cc(C[N@@H+]2CCCC[C@H]2CCC(=O)OC(C)(C)C)c([N+](=O)[O-])n1 ZINC000602844569 521566027 /nfs/dbraw/zinc/56/60/27/521566027.db2.gz BWSRFZFLHOMZDZ-AWEZNQCLSA-N 1 1 352.435 2.805 20 5 FFBDMO Cn1cc(C[N@H+]2CCCC[C@H]2CCC(=O)OC(C)(C)C)c([N+](=O)[O-])n1 ZINC000602844569 521566033 /nfs/dbraw/zinc/56/60/33/521566033.db2.gz BWSRFZFLHOMZDZ-AWEZNQCLSA-N 1 1 352.435 2.805 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000616136123 521628614 /nfs/dbraw/zinc/62/86/14/521628614.db2.gz XJZBLUFZEHBVHY-CQSZACIVSA-N 1 1 360.366 2.729 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]([NH+]3CCOCC3)C2)nc1-c1ccc(F)cc1 ZINC000619527578 521752855 /nfs/dbraw/zinc/75/28/55/521752855.db2.gz XRFDHQMCUWPJHW-INIZCTEOSA-N 1 1 372.400 2.707 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000619566972 521773265 /nfs/dbraw/zinc/77/32/65/521773265.db2.gz DRCOALBQGRNWFD-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO Cc1c(C)c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)ncc1[N+](=O)[O-] ZINC001164729004 720395252 /nfs/dbraw/zinc/39/52/52/720395252.db2.gz UQTKTTMJIOJYQB-SJORKVTESA-N 1 1 353.426 2.855 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(N3CC[C@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc21 ZINC001164724697 720403129 /nfs/dbraw/zinc/40/31/29/720403129.db2.gz KOCZLXGWUSWNIN-JKSUJKDBSA-N 1 1 364.409 2.719 20 5 FFBDMO Cc1nc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)ccc1[N+](=O)[O-] ZINC001164858492 720925465 /nfs/dbraw/zinc/92/54/65/720925465.db2.gz NNQMQDZRRWUMPW-CQSZACIVSA-N 1 1 358.446 2.916 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c1 ZINC001164786811 721390372 /nfs/dbraw/zinc/39/03/72/721390372.db2.gz PFFSAVIXJFMZLF-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO Cc1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001164896265 721511529 /nfs/dbraw/zinc/51/15/29/721511529.db2.gz AESSGNGEUAHDJU-NVXWUHKLSA-N 1 1 372.400 2.779 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164897251 721512009 /nfs/dbraw/zinc/51/20/09/721512009.db2.gz FNQHHVCHYADCEU-AEFFLSMTSA-N 1 1 372.400 2.779 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000159110050 728900994 /nfs/dbraw/zinc/90/09/94/728900994.db2.gz AKIRZQJITPKRDN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000159110050 728900995 /nfs/dbraw/zinc/90/09/95/728900995.db2.gz AKIRZQJITPKRDN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000898039362 735306264 /nfs/dbraw/zinc/30/62/64/735306264.db2.gz ZTYMWUJGWFQHSW-LLVKDONJSA-N 1 1 370.247 2.500 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]Cc1cnc2n1CCOC2 ZINC000898266802 735335225 /nfs/dbraw/zinc/33/52/25/735335225.db2.gz VOIUUZMHSSOJFH-UHFFFAOYSA-N 1 1 356.304 2.630 20 5 FFBDMO O=C(CN1CCC(c2[nH]cc[nH+]2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000745984789 735456500 /nfs/dbraw/zinc/45/65/00/735456500.db2.gz QORRETNCJWGRRB-UHFFFAOYSA-N 1 1 363.805 2.789 20 5 FFBDMO CCc1nn(C)c(Cl)c1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534248 728476199 /nfs/dbraw/zinc/47/61/99/728476199.db2.gz RXYZGKOXRUIOMM-LLVKDONJSA-N 1 1 364.837 2.626 20 5 FFBDMO CCc1nn(C)c(Cl)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534248 728476201 /nfs/dbraw/zinc/47/62/01/728476201.db2.gz RXYZGKOXRUIOMM-LLVKDONJSA-N 1 1 364.837 2.626 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000112209252 728543127 /nfs/dbraw/zinc/54/31/27/728543127.db2.gz YCAFIDOFSBCMIU-VXGBXAGGSA-N 1 1 356.220 2.632 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000300488225 729731480 /nfs/dbraw/zinc/73/14/80/729731480.db2.gz PYMFFEMRQDOFBJ-MWLCHTKSSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000300488225 729731482 /nfs/dbraw/zinc/73/14/82/729731482.db2.gz PYMFFEMRQDOFBJ-MWLCHTKSSA-N 1 1 357.204 2.598 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1NC[C@@H]1CCC[N@@H+]1CCCO ZINC000856761587 730355669 /nfs/dbraw/zinc/35/56/69/730355669.db2.gz RTRGGBZTVCDXHI-NSHDSACASA-N 1 1 358.236 2.616 20 5 FFBDMO O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861985102 730658715 /nfs/dbraw/zinc/65/87/15/730658715.db2.gz DGPAANCOOAEEDZ-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO CN(C)C(=O)C1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000768194423 737405716 /nfs/dbraw/zinc/40/57/16/737405716.db2.gz ZABQMIHHXRTZIX-UHFFFAOYSA-N 1 1 370.247 2.658 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)CC2)C1 ZINC000865541469 730968256 /nfs/dbraw/zinc/96/82/56/730968256.db2.gz HCGOLVZAWHQRHW-AWEZNQCLSA-N 1 1 354.401 2.749 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CCC1(C)C ZINC000871156045 731601231 /nfs/dbraw/zinc/60/12/31/731601231.db2.gz LWYIMFDGARRQPL-UHFFFAOYSA-N 1 1 357.357 2.753 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCN1CCN(C)CC1 ZINC000872017513 731720784 /nfs/dbraw/zinc/72/07/84/731720784.db2.gz AXXJQJZUEZQHEV-CQSZACIVSA-N 1 1 352.504 2.605 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+](Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872807598 731834638 /nfs/dbraw/zinc/83/46/38/731834638.db2.gz WOWIUHANWDGQPR-NSHDSACASA-N 1 1 360.395 2.715 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872807598 731834642 /nfs/dbraw/zinc/83/46/42/731834642.db2.gz WOWIUHANWDGQPR-NSHDSACASA-N 1 1 360.395 2.715 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000874832567 732105188 /nfs/dbraw/zinc/10/51/88/732105188.db2.gz FXRPAPWJXNNTGN-CHWSQXEVSA-N 1 1 355.341 2.505 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000876734693 732273819 /nfs/dbraw/zinc/27/38/19/732273819.db2.gz ITMCEDPYBFNAOH-CQSZACIVSA-N 1 1 359.348 2.807 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000876734693 732273822 /nfs/dbraw/zinc/27/38/22/732273822.db2.gz ITMCEDPYBFNAOH-CQSZACIVSA-N 1 1 359.348 2.807 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880144358 732855001 /nfs/dbraw/zinc/85/50/01/732855001.db2.gz CULUTMXKMIRCRC-QWRGUYRKSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880144358 732855004 /nfs/dbraw/zinc/85/50/04/732855004.db2.gz CULUTMXKMIRCRC-QWRGUYRKSA-N 1 1 355.822 2.668 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000886551383 733801560 /nfs/dbraw/zinc/80/15/60/733801560.db2.gz GXVCYFIVMSXZCD-ZDUSSCGKSA-N 1 1 364.789 2.856 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000782978424 738770188 /nfs/dbraw/zinc/77/01/88/738770188.db2.gz HBXNOKXDRHBDSG-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO CCOc1cc(NC(=O)NCCCC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-] ZINC000888831570 734103496 /nfs/dbraw/zinc/10/34/96/734103496.db2.gz LWZCGMPZHCDJHI-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095502 738821812 /nfs/dbraw/zinc/82/18/12/738821812.db2.gz KFHMFSBRIOOVSM-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095502 738821814 /nfs/dbraw/zinc/82/18/14/738821814.db2.gz KFHMFSBRIOOVSM-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCc2c1cnn2CCO ZINC000892672387 734588803 /nfs/dbraw/zinc/58/88/03/734588803.db2.gz LNOLSYUGZUAGIO-CQSZACIVSA-N 1 1 350.806 2.604 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000894484069 734866768 /nfs/dbraw/zinc/86/67/68/734866768.db2.gz BJDGXHNMVWFLDO-KGLIPLIRSA-N 1 1 350.415 2.948 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000749880936 735757889 /nfs/dbraw/zinc/75/78/89/735757889.db2.gz YHAHACKFRKVIQJ-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000749880936 735757893 /nfs/dbraw/zinc/75/78/93/735757893.db2.gz YHAHACKFRKVIQJ-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@]12CSC[C@H]1C[N@@H+](CN1CC[C@@H](c3ccc([N+](=O)[O-])cc3)C1=O)C2 ZINC000902674931 735980120 /nfs/dbraw/zinc/98/01/20/735980120.db2.gz LGARUVRGKKFZQQ-HFTRVMKXSA-N 1 1 361.467 2.553 20 5 FFBDMO CO[C@@]1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCSC1 ZINC000903315099 736074464 /nfs/dbraw/zinc/07/44/64/736074464.db2.gz SHMIEESRPDZKRN-DOTOQJQBSA-N 1 1 362.455 2.529 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000755022771 736227422 /nfs/dbraw/zinc/22/74/22/736227422.db2.gz YDYGWDMXXXPJDK-SECBINFHSA-N 1 1 374.210 2.568 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000755031273 736228271 /nfs/dbraw/zinc/22/82/71/736228271.db2.gz UPWKIHZLAMNZBO-JTQLQIEISA-N 1 1 357.208 2.573 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875069 736676402 /nfs/dbraw/zinc/67/64/02/736676402.db2.gz XVYGXDPKJKRDIA-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875069 736676406 /nfs/dbraw/zinc/67/64/06/736676406.db2.gz XVYGXDPKJKRDIA-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000763744489 736965383 /nfs/dbraw/zinc/96/53/83/736965383.db2.gz NBRDOXDCODZDRE-CYBMUJFWSA-N 1 1 368.455 2.710 20 5 FFBDMO O=C(N[C@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000764294483 737009474 /nfs/dbraw/zinc/00/94/74/737009474.db2.gz VYDFEWIKKFMILK-GOEBONIOSA-N 1 1 367.833 2.621 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000914240143 737536512 /nfs/dbraw/zinc/53/65/12/737536512.db2.gz ZMEQQCZUFHMMIA-VBNZEHGJSA-N 1 1 364.471 2.535 20 5 FFBDMO COc1ccc(CSCC(=O)OCCn2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000771902626 737764727 /nfs/dbraw/zinc/76/47/27/737764727.db2.gz BZBFBUXDZBUFBE-UHFFFAOYSA-N 1 1 365.411 2.585 20 5 FFBDMO Cc1nc(N2CC[NH+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000776275488 738177114 /nfs/dbraw/zinc/17/71/14/738177114.db2.gz FMUBIOPVDBCFGV-MRXNPFEDSA-N 1 1 362.455 2.524 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000923317695 738270437 /nfs/dbraw/zinc/27/04/37/738270437.db2.gz VNISYZNQHNZLTG-DZGCQCFKSA-N 1 1 351.834 2.876 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000778010109 738342127 /nfs/dbraw/zinc/34/21/27/738342127.db2.gz LAYTYZFVIDKBQJ-ZDUSSCGKSA-N 1 1 373.450 2.537 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1C ZINC000787420335 739135105 /nfs/dbraw/zinc/13/51/05/739135105.db2.gz HAQTWJJHEZZQRM-ZJUUUORDSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1C ZINC000787420335 739135110 /nfs/dbraw/zinc/13/51/10/739135110.db2.gz HAQTWJJHEZZQRM-ZJUUUORDSA-N 1 1 357.204 2.741 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000931296831 739239852 /nfs/dbraw/zinc/23/98/52/739239852.db2.gz ALAMZDJIFJOQFB-GWCFXTLKSA-N 1 1 370.862 2.950 20 5 FFBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788492289 739249884 /nfs/dbraw/zinc/24/98/84/739249884.db2.gz CJTVSXNKXGXTFA-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788492289 739249888 /nfs/dbraw/zinc/24/98/88/739249888.db2.gz CJTVSXNKXGXTFA-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@@]1(C2CC[NH+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)COC(=O)N1 ZINC000932095951 739385779 /nfs/dbraw/zinc/38/57/79/739385779.db2.gz IJGREWZRORAOKL-INIZCTEOSA-N 1 1 353.806 2.959 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000790667754 739483640 /nfs/dbraw/zinc/48/36/40/739483640.db2.gz FNEYGTCMFVZDJJ-GFCCVEGCSA-N 1 1 355.797 2.530 20 5 FFBDMO O=C1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)CCCCCN1 ZINC000934152771 739736429 /nfs/dbraw/zinc/73/64/29/739736429.db2.gz PFPPLXJSTXPJGB-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934335794 739768136 /nfs/dbraw/zinc/76/81/36/739768136.db2.gz KPCZKJSHSRXJGO-CYBMUJFWSA-N 1 1 360.439 2.579 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934335794 739768139 /nfs/dbraw/zinc/76/81/39/739768139.db2.gz KPCZKJSHSRXJGO-CYBMUJFWSA-N 1 1 360.439 2.579 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])C[C@@H]2C1 ZINC000793930737 739827686 /nfs/dbraw/zinc/82/76/86/739827686.db2.gz ZLMJFLBMHSFDTL-ZJUUUORDSA-N 1 1 358.225 2.925 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)CC[C@H]21 ZINC000934892541 739862407 /nfs/dbraw/zinc/86/24/07/739862407.db2.gz XVMLUSMOGMKLCE-JOYOIKCWSA-N 1 1 370.812 2.526 20 5 FFBDMO CCCN(CC[NH+]1CCCCC1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000796124786 740104566 /nfs/dbraw/zinc/10/45/66/740104566.db2.gz FGFWMPQIDGJJDF-UHFFFAOYSA-N 1 1 361.489 2.543 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000801507888 740625445 /nfs/dbraw/zinc/62/54/45/740625445.db2.gz JZINKOBUVSHYIF-UHFFFAOYSA-N 1 1 363.311 2.624 20 5 FFBDMO CSc1cccc(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)c1[N+](=O)[O-] ZINC000802132799 740675491 /nfs/dbraw/zinc/67/54/91/740675491.db2.gz MVMZQENIJAELML-LBPRGKRZSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1cccc(C(=O)OC[C@@H]2C[N@H+](C(C)C)CCO2)c1[N+](=O)[O-] ZINC000802132799 740675494 /nfs/dbraw/zinc/67/54/94/740675494.db2.gz MVMZQENIJAELML-LBPRGKRZSA-N 1 1 354.428 2.583 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000803859759 740836049 /nfs/dbraw/zinc/83/60/49/740836049.db2.gz VVZADDDMQXXGAQ-ZDUSSCGKSA-N 1 1 351.359 2.811 20 5 FFBDMO COCC[N@H+]1CCCN(c2ccc(C)c(Br)c2[N+](=O)[O-])CC1 ZINC000804353337 740862784 /nfs/dbraw/zinc/86/27/84/740862784.db2.gz ICGGQUIUQUSMAC-UHFFFAOYSA-N 1 1 372.263 2.824 20 5 FFBDMO COCC[N@H+](CCC(=O)OC)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809946372 741364902 /nfs/dbraw/zinc/36/49/02/741364902.db2.gz ULWLXVKQNUSNPR-UHFFFAOYSA-N 1 1 365.213 2.913 20 5 FFBDMO COCC[N@@H+](CCC(=O)OC)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809946372 741364905 /nfs/dbraw/zinc/36/49/05/741364905.db2.gz ULWLXVKQNUSNPR-UHFFFAOYSA-N 1 1 365.213 2.913 20 5 FFBDMO CC[C@H](C)[C@H](OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173251 741684517 /nfs/dbraw/zinc/68/45/17/741684517.db2.gz ZKTPIUCQTKNSTO-JQFCIGGWSA-N 1 1 350.415 2.773 20 5 FFBDMO CC[C@H](C)[C@H](OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173251 741684518 /nfs/dbraw/zinc/68/45/18/741684518.db2.gz ZKTPIUCQTKNSTO-JQFCIGGWSA-N 1 1 350.415 2.773 20 5 FFBDMO CC(C)CO[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171238 741684670 /nfs/dbraw/zinc/68/46/70/741684670.db2.gz HHNGUTFOZXIVOL-PBHICJAKSA-N 1 1 350.415 2.773 20 5 FFBDMO CC(C)CO[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171238 741684673 /nfs/dbraw/zinc/68/46/73/741684673.db2.gz HHNGUTFOZXIVOL-PBHICJAKSA-N 1 1 350.415 2.773 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000814655901 741854082 /nfs/dbraw/zinc/85/40/82/741854082.db2.gz KDEUMTMERGXNIX-NOZJJQNGSA-N 1 1 367.203 2.532 20 5 FFBDMO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000814655835 741854216 /nfs/dbraw/zinc/85/42/16/741854216.db2.gz YHCOCIRMSVKHDZ-RNCFNFMXSA-N 1 1 367.203 2.532 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2c(F)cccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643397 742927218 /nfs/dbraw/zinc/92/72/18/742927218.db2.gz NUWPOQUGYBROFD-DSZLRUIBSA-N 1 1 369.824 2.661 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(F)c(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643935 742928535 /nfs/dbraw/zinc/92/85/35/742928535.db2.gz VNSAGBPGIYAYSZ-BRXULGCHSA-N 1 1 369.824 2.661 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045436978 743273964 /nfs/dbraw/zinc/27/39/64/743273964.db2.gz ZSXDBIPKTFRHHK-HZPDHXFCSA-N 1 1 365.861 2.784 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)n2)cc1 ZINC000827497334 743589792 /nfs/dbraw/zinc/58/97/92/743589792.db2.gz UMPHOOYDKAPDKA-HUUCEWRRSA-N 1 1 360.439 2.993 20 5 FFBDMO C[C@H]1CN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000830083160 745303431 /nfs/dbraw/zinc/30/34/31/745303431.db2.gz ZEDCEMDSUNSHKQ-LBPRGKRZSA-N 1 1 366.849 2.603 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831159704 745492566 /nfs/dbraw/zinc/49/25/66/745492566.db2.gz XZCFWIUIDYJQNJ-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO COC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000832744664 745748276 /nfs/dbraw/zinc/74/82/76/745748276.db2.gz GFQTXENAYLNFAU-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000832744664 745748281 /nfs/dbraw/zinc/74/82/81/745748281.db2.gz GFQTXENAYLNFAU-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COc1cc(C(=O)OCC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])cc1F ZINC000835601292 746048030 /nfs/dbraw/zinc/04/80/30/746048030.db2.gz JHQKJZLWBWBSBH-YOGCLGLASA-N 1 1 352.362 2.772 20 5 FFBDMO COc1ccc(CC(=O)OC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000842834083 747702487 /nfs/dbraw/zinc/70/24/87/747702487.db2.gz QZHJSKNCTGEYIO-OAHLLOKOSA-N 1 1 350.415 2.810 20 5 FFBDMO C[C@@H]1[C@H](C(=O)N[C@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)CC[N@H+]1C ZINC000843907414 747925755 /nfs/dbraw/zinc/92/57/55/747925755.db2.gz ZCRZFXSZMLBVDZ-JRKPZEMJSA-N 1 1 363.311 2.794 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000846930012 748578080 /nfs/dbraw/zinc/57/80/80/748578080.db2.gz PKOIQMTWLBZVOD-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000848490228 748939223 /nfs/dbraw/zinc/93/92/23/748939223.db2.gz XQRJRXGDJFWJJD-HOCLYGCPSA-N 1 1 351.353 2.599 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000848490228 748939228 /nfs/dbraw/zinc/93/92/28/748939228.db2.gz XQRJRXGDJFWJJD-HOCLYGCPSA-N 1 1 351.353 2.599 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000848920973 749034871 /nfs/dbraw/zinc/03/48/71/749034871.db2.gz NEDUCIIMTUERHX-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000848929394 749036904 /nfs/dbraw/zinc/03/69/04/749036904.db2.gz DLEDGIZASKHVEG-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000848929394 749036906 /nfs/dbraw/zinc/03/69/06/749036906.db2.gz DLEDGIZASKHVEG-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)c1 ZINC000848929867 749037740 /nfs/dbraw/zinc/03/77/40/749037740.db2.gz KPZICXJDWCNZAM-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)c1 ZINC000848929867 749037743 /nfs/dbraw/zinc/03/77/43/749037743.db2.gz KPZICXJDWCNZAM-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000851864789 749709685 /nfs/dbraw/zinc/70/96/85/749709685.db2.gz KFRCJVSNRLBBPI-ZYHUDNBSSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000851864789 749709687 /nfs/dbraw/zinc/70/96/87/749709687.db2.gz KFRCJVSNRLBBPI-ZYHUDNBSSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852019016 749752283 /nfs/dbraw/zinc/75/22/83/749752283.db2.gz SUCRCKCBBGVETF-MRXNPFEDSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852019016 749752285 /nfs/dbraw/zinc/75/22/85/749752285.db2.gz SUCRCKCBBGVETF-MRXNPFEDSA-N 1 1 354.407 2.628 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852424271 749856742 /nfs/dbraw/zinc/85/67/42/749856742.db2.gz ALMMOYBKNPETQS-MLGOLLRUSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000795186692 1013047630 /nfs/dbraw/zinc/04/76/30/1013047630.db2.gz BLRLFXSKRJDIIL-AUUYWEPGSA-N 1 1 359.401 2.978 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3C[C@@]3(O)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000895645902 970815041 /nfs/dbraw/zinc/81/50/41/970815041.db2.gz FEFZTLCRHXZVGR-OXQOHEQNSA-N 1 1 370.405 2.749 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(Nc3ccccn3)CC1)OCCO2 ZINC000896197371 971332902 /nfs/dbraw/zinc/33/29/02/971332902.db2.gz CEXQHKMFZBORPE-UHFFFAOYSA-N 1 1 370.409 2.838 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2c([N+](=O)[O-])cnn2C)c1 ZINC000126182987 963466181 /nfs/dbraw/zinc/46/61/81/963466181.db2.gz KMRNMPXVRSOWLV-UHFFFAOYSA-N 1 1 373.457 2.880 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)C[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248914 963750803 /nfs/dbraw/zinc/75/08/03/963750803.db2.gz OHORNNWZQDJNRU-INIZCTEOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@@H+](C)C[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248914 963750817 /nfs/dbraw/zinc/75/08/17/963750817.db2.gz OHORNNWZQDJNRU-INIZCTEOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)C[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248914 963750824 /nfs/dbraw/zinc/75/08/24/963750824.db2.gz OHORNNWZQDJNRU-INIZCTEOSA-N 1 1 362.474 2.894 20 5 FFBDMO C[C@@H]1C[C@H](c2ccccc2)C(C)(C)[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC001175651735 1013522545 /nfs/dbraw/zinc/52/25/45/1013522545.db2.gz OFKFNYPBORHODP-ZTFGCOKTSA-N 1 1 358.442 2.809 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000891705171 964907434 /nfs/dbraw/zinc/90/74/34/964907434.db2.gz OMNOZKQNGXZVML-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000891705171 964907441 /nfs/dbraw/zinc/90/74/41/964907441.db2.gz OMNOZKQNGXZVML-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000843759528 965673223 /nfs/dbraw/zinc/67/32/23/965673223.db2.gz QYARXCONVJTBMM-VXGBXAGGSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@H](c1ccccc1)N1CC[NH+](C)CC1 ZINC000728466830 966153694 /nfs/dbraw/zinc/15/36/94/966153694.db2.gz STANHPDXEYTEQX-IBGZPJMESA-N 1 1 369.421 2.797 20 5 FFBDMO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001176676131 1013750457 /nfs/dbraw/zinc/75/04/57/1013750457.db2.gz UPUVUHKAKZKTEN-QGZVFWFLSA-N 1 1 352.435 2.625 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000874846334 1013916627 /nfs/dbraw/zinc/91/66/27/1013916627.db2.gz IRBPBBSGYZUSKX-MSOLQXFVSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@@]1([C@H]2CCCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)COC(=O)N1 ZINC000895531847 970707665 /nfs/dbraw/zinc/70/76/65/970707665.db2.gz MNFNGXJDMZTYAU-SGTLLEGYSA-N 1 1 356.382 2.858 20 5 FFBDMO C[N@@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n[nH]1 ZINC000897064646 973215914 /nfs/dbraw/zinc/21/59/14/973215914.db2.gz KUXJMHFTOZCAAJ-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n[nH]1 ZINC000897064646 973215922 /nfs/dbraw/zinc/21/59/22/973215922.db2.gz KUXJMHFTOZCAAJ-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1ccccc1C1CC1)C2 ZINC000981764276 976764609 /nfs/dbraw/zinc/76/46/09/976764609.db2.gz QPLLDAWVYWXPLT-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](Cc1ccccc1C1CC1)C2 ZINC000981764276 976764617 /nfs/dbraw/zinc/76/46/17/976764617.db2.gz QPLLDAWVYWXPLT-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1ccccc1C1CC1)C2 ZINC000981764276 976764626 /nfs/dbraw/zinc/76/46/26/976764626.db2.gz QPLLDAWVYWXPLT-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO CCc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)cc1 ZINC000982278998 977375610 /nfs/dbraw/zinc/37/56/10/977375610.db2.gz WYCLSOIQCFUHMJ-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccc(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)cc1 ZINC000982278998 977375617 /nfs/dbraw/zinc/37/56/17/977375617.db2.gz WYCLSOIQCFUHMJ-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)cc1 ZINC000982278998 977375625 /nfs/dbraw/zinc/37/56/25/977375625.db2.gz WYCLSOIQCFUHMJ-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000728915836 977487160 /nfs/dbraw/zinc/48/71/60/977487160.db2.gz ZTHCDEVKGBTNAT-ZDUSSCGKSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000728915836 977487163 /nfs/dbraw/zinc/48/71/63/977487163.db2.gz ZTHCDEVKGBTNAT-ZDUSSCGKSA-N 1 1 358.373 2.980 20 5 FFBDMO CC(C)c1ccccc1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001481897191 977741646 /nfs/dbraw/zinc/74/16/46/977741646.db2.gz RNTWHKOSLRJCLJ-QZTJIDSGSA-N 1 1 359.470 2.994 20 5 FFBDMO Cc1c(C)c(C)c(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001268792306 978395686 /nfs/dbraw/zinc/39/56/86/978395686.db2.gz WFQJVDACZGPFRB-IEBWSBKVSA-N 1 1 361.486 2.832 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000900267425 979126907 /nfs/dbraw/zinc/12/69/07/979126907.db2.gz GDNYBYRLACELNA-INIZCTEOSA-N 1 1 362.474 2.578 20 5 FFBDMO COc1cc(CN2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877743307 1014703749 /nfs/dbraw/zinc/70/37/49/1014703749.db2.gz JNIOJSKHEXBNCV-DGCLKSJQSA-N 1 1 371.384 2.731 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000910289559 981888624 /nfs/dbraw/zinc/88/86/24/981888624.db2.gz TWYFILHYWXZBLS-CQSZACIVSA-N 1 1 371.441 2.552 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)o1 ZINC000878300475 1014974828 /nfs/dbraw/zinc/97/48/28/1014974828.db2.gz FRSDLXMGJKFPOS-CQSZACIVSA-N 1 1 358.398 2.893 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC[N@@H+]1C ZINC000764400385 984479552 /nfs/dbraw/zinc/47/95/52/984479552.db2.gz AVDXUQGNXHICJD-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC[N@H+]1C ZINC000764400385 984479553 /nfs/dbraw/zinc/47/95/53/984479553.db2.gz AVDXUQGNXHICJD-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000170647424 985104368 /nfs/dbraw/zinc/10/43/68/985104368.db2.gz UEVIDMVBAWUPGA-CQSZACIVSA-N 1 1 365.430 2.950 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C(C)(C)C ZINC000878840598 1015246504 /nfs/dbraw/zinc/24/65/04/1015246504.db2.gz ORHPJRSNVOOAHL-MRXNPFEDSA-N 1 1 366.437 2.725 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C(C)(C)C ZINC000878840598 1015246513 /nfs/dbraw/zinc/24/65/13/1015246513.db2.gz ORHPJRSNVOOAHL-MRXNPFEDSA-N 1 1 366.437 2.725 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C(C)(C)C ZINC000878840598 1015246521 /nfs/dbraw/zinc/24/65/21/1015246521.db2.gz ORHPJRSNVOOAHL-MRXNPFEDSA-N 1 1 366.437 2.725 20 5 FFBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000914784533 987906612 /nfs/dbraw/zinc/90/66/12/987906612.db2.gz DNXIKTDHBWYSJQ-ACWOFJMJSA-N 1 1 374.441 2.830 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[NH+](Cc4cccs4)CC3)cc2N1 ZINC000917011834 990092426 /nfs/dbraw/zinc/09/24/26/990092426.db2.gz ZOSXMOMVGPOVNC-UHFFFAOYSA-N 1 1 372.450 2.863 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2CC[NH+](C/C=C\c3ccccc3)CC2)cc1 ZINC000033409505 990283402 /nfs/dbraw/zinc/28/34/02/990283402.db2.gz OPZYKJXPYQSPLO-ANIGNSTFSA-N 1 1 367.449 2.959 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCN(C/C=C\c3ccccc3)CC2)cc1 ZINC000033409505 990283408 /nfs/dbraw/zinc/28/34/08/990283408.db2.gz OPZYKJXPYQSPLO-ANIGNSTFSA-N 1 1 367.449 2.959 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000920450977 990851123 /nfs/dbraw/zinc/85/11/23/990851123.db2.gz ICPUKRDUZAAMEI-HNNXBMFYSA-N 1 1 373.457 2.573 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000920810254 990921741 /nfs/dbraw/zinc/92/17/41/990921741.db2.gz TVIIFSYRIQOFJI-UHFFFAOYSA-N 1 1 373.457 2.523 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)CC[C@@H]21 ZINC000880164945 1015770448 /nfs/dbraw/zinc/77/04/48/1015770448.db2.gz HIQPWPPHTVNWFA-LRDDRELGSA-N 1 1 355.398 2.701 20 5 FFBDMO CCCC[C@@H](C)[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810125050 994708100 /nfs/dbraw/zinc/70/81/00/994708100.db2.gz MXSXRUNIDAKLAJ-MRXNPFEDSA-N 1 1 362.474 2.754 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810844483 994951199 /nfs/dbraw/zinc/95/11/99/994951199.db2.gz NWXKAYNKIOHPBR-HOTGVXAUSA-N 1 1 356.382 2.564 20 5 FFBDMO COc1cc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000811444995 995148571 /nfs/dbraw/zinc/14/85/71/995148571.db2.gz NRKWSNUQAZRWOT-KRWDZBQOSA-N 1 1 372.368 2.998 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849848 995551614 /nfs/dbraw/zinc/55/16/14/995551614.db2.gz KGPVLYBURVXODE-UGSOOPFHSA-N 1 1 357.410 2.638 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849847 995552582 /nfs/dbraw/zinc/55/25/82/995552582.db2.gz KGPVLYBURVXODE-SCLBCKFNSA-N 1 1 357.410 2.638 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H]1C ZINC000677182557 1016118558 /nfs/dbraw/zinc/11/85/58/1016118558.db2.gz IFHWVYXIQSFSAN-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H]1C ZINC000677182557 1016118564 /nfs/dbraw/zinc/11/85/64/1016118564.db2.gz IFHWVYXIQSFSAN-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@@H]1C ZINC000677182556 1016119235 /nfs/dbraw/zinc/11/92/35/1016119235.db2.gz IFHWVYXIQSFSAN-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@@H]1C ZINC000677182556 1016119238 /nfs/dbraw/zinc/11/92/38/1016119238.db2.gz IFHWVYXIQSFSAN-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO C[C@H]1CCC[C@H](C)[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000742154155 999762358 /nfs/dbraw/zinc/76/23/58/999762358.db2.gz DPVQCVYVAPIDBY-KBPBESRZSA-N 1 1 360.414 2.831 20 5 FFBDMO O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363162 999870202 /nfs/dbraw/zinc/87/02/02/999870202.db2.gz FKCXPHOYIUDLLU-UTRMSSBJSA-N 1 1 357.454 2.604 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(N(C)CC(F)F)CC1 ZINC000746482478 999998112 /nfs/dbraw/zinc/99/81/12/999998112.db2.gz REDBDNBPBZBKDT-LBPRGKRZSA-N 1 1 370.400 2.583 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169011643 1000015727 /nfs/dbraw/zinc/01/57/27/1000015727.db2.gz LWVMMTXMISOGCL-RLFYNMQTSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036850 1000016643 /nfs/dbraw/zinc/01/66/43/1000016643.db2.gz QIJDEHQFRWOMBH-DGXTUMSLSA-N 1 1 353.463 2.952 20 5 FFBDMO Cc1cccc(CN2CC[C@]3(CC[N@H+]([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)C2=O)c1 ZINC001169020618 1000017415 /nfs/dbraw/zinc/01/74/15/1000017415.db2.gz JOJPMQHSHLIOGU-SFHLNBCPSA-N 1 1 371.481 2.865 20 5 FFBDMO O=C1N(CC2CC2)c2ccccc2[C@]12CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169026749 1000018184 /nfs/dbraw/zinc/01/81/84/1000018184.db2.gz NTDYIXVYNAKWSE-LLGFUMIMSA-N 1 1 369.465 2.832 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001169503742 1000054051 /nfs/dbraw/zinc/05/40/51/1000054051.db2.gz LMIYVMYVBNJWBN-YJBOKZPZSA-N 1 1 370.409 2.861 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@H](Nc2cccnc2[N+](=O)[O-])C1 ZINC001169519135 1000056042 /nfs/dbraw/zinc/05/60/42/1000056042.db2.gz MZRANCIAKAWZJJ-DOTOQJQBSA-N 1 1 370.409 2.861 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742148562 1000141203 /nfs/dbraw/zinc/14/12/03/1000141203.db2.gz VHLZQAVAARHESY-UHFFFAOYSA-N 1 1 358.446 2.617 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000769146513 1000447031 /nfs/dbraw/zinc/44/70/31/1000447031.db2.gz SKIQUBCOGKGSQS-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)CC1 ZINC000769146513 1000447033 /nfs/dbraw/zinc/44/70/33/1000447033.db2.gz SKIQUBCOGKGSQS-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770038687 1000661365 /nfs/dbraw/zinc/66/13/65/1000661365.db2.gz DHTXGNQTYIEXOM-UYAOXDASSA-N 1 1 374.437 2.779 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ccnn1C ZINC001147337327 1000873730 /nfs/dbraw/zinc/87/37/30/1000873730.db2.gz XKWVPNILLBPCKS-UHFFFAOYSA-N 1 1 361.405 2.677 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)OC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000785742831 1001474518 /nfs/dbraw/zinc/47/45/18/1001474518.db2.gz OYJYXBURUDWRHP-MBNYWOFBSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)OC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000785742831 1001474520 /nfs/dbraw/zinc/47/45/20/1001474520.db2.gz OYJYXBURUDWRHP-MBNYWOFBSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493287 1002094185 /nfs/dbraw/zinc/09/41/85/1002094185.db2.gz GCXWMAJEWIYCAL-LIRRHRJNSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@H]1CN(c2ccccc2F)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493287 1002094194 /nfs/dbraw/zinc/09/41/94/1002094194.db2.gz GCXWMAJEWIYCAL-LIRRHRJNSA-N 1 1 359.401 2.978 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC001182908844 1002098082 /nfs/dbraw/zinc/09/80/82/1002098082.db2.gz BIQFITBJQHPXOA-UHFFFAOYSA-N 1 1 367.427 2.573 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791217975 1002609803 /nfs/dbraw/zinc/60/98/03/1002609803.db2.gz HATCDIYBYXBQSM-ZDUSSCGKSA-N 1 1 366.437 2.794 20 5 FFBDMO COc1ccc(C[C@@H](C)N2CC3(C2)CC[N@@H+](CC2CC2)C3)c([N+](=O)[O-])c1 ZINC001170339803 1003128551 /nfs/dbraw/zinc/12/85/51/1003128551.db2.gz JOMYZBLQGYCANG-OAHLLOKOSA-N 1 1 359.470 2.952 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001170341344 1003130249 /nfs/dbraw/zinc/13/02/49/1003130249.db2.gz PIXPYBFEHIAACG-BBRMVZONSA-N 1 1 374.441 2.514 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])[C@H]1C ZINC001170345205 1003131876 /nfs/dbraw/zinc/13/18/76/1003131876.db2.gz HYRTVJQDWWWGBM-DVOMOZLQSA-N 1 1 350.415 2.808 20 5 FFBDMO Cc1cc(C)c(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001001395455 1016778794 /nfs/dbraw/zinc/77/87/94/1016778794.db2.gz MTSSDRHWNWQXEM-IEBWSBKVSA-N 1 1 359.470 2.605 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@]12CCCOC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198830788 1004738833 /nfs/dbraw/zinc/73/88/33/1004738833.db2.gz XFJWBZHHYICFBI-LJQANCHMSA-N 1 1 359.426 2.519 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@]12CCCOC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198830788 1004738835 /nfs/dbraw/zinc/73/88/35/1004738835.db2.gz XFJWBZHHYICFBI-LJQANCHMSA-N 1 1 359.426 2.519 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c(N)c([N+](=O)[O-])c1 ZINC000104821981 1004815977 /nfs/dbraw/zinc/81/59/77/1004815977.db2.gz RRGMWIMJHXHMPA-HNNXBMFYSA-N 1 1 358.398 2.645 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077106 1005939640 /nfs/dbraw/zinc/93/96/40/1005939640.db2.gz OMMLBKFFGQGWMP-OLZOCXBDSA-N 1 1 366.418 2.723 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077106 1005939641 /nfs/dbraw/zinc/93/96/41/1005939641.db2.gz OMMLBKFFGQGWMP-OLZOCXBDSA-N 1 1 366.418 2.723 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077108 1005939847 /nfs/dbraw/zinc/93/98/47/1005939847.db2.gz OMMLBKFFGQGWMP-QWHCGFSZSA-N 1 1 366.418 2.723 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077108 1005939849 /nfs/dbraw/zinc/93/98/49/1005939849.db2.gz OMMLBKFFGQGWMP-QWHCGFSZSA-N 1 1 366.418 2.723 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1 ZINC000776594144 1006009451 /nfs/dbraw/zinc/00/94/51/1006009451.db2.gz XADAPRKJODGROZ-WOJBJXKFSA-N 1 1 356.422 2.901 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000129579085 1006349078 /nfs/dbraw/zinc/34/90/78/1006349078.db2.gz RSNRPDYSPNXGAG-OKILXGFUSA-N 1 1 364.446 2.785 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505627 1006418874 /nfs/dbraw/zinc/41/88/74/1006418874.db2.gz MSUNXJQQSWXUSA-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505627 1006418881 /nfs/dbraw/zinc/41/88/81/1006418881.db2.gz MSUNXJQQSWXUSA-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC3(CCOCC3)CC2)nc1-c1ccccn1 ZINC000853512002 1006420767 /nfs/dbraw/zinc/42/07/67/1006420767.db2.gz XEISJLFMWIOJIZ-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000853601206 1006470129 /nfs/dbraw/zinc/47/01/29/1006470129.db2.gz FZSPOMJZDVRPRJ-INIZCTEOSA-N 1 1 371.441 2.652 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000882979989 1006586188 /nfs/dbraw/zinc/58/61/88/1006586188.db2.gz VIHLOYJCFHAXDG-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162888 1032163458 /nfs/dbraw/zinc/16/34/58/1032163458.db2.gz YZXHORPIWLIYLZ-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162888 1032163463 /nfs/dbraw/zinc/16/34/63/1032163463.db2.gz YZXHORPIWLIYLZ-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO C/C(=C\C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000854571023 1006894250 /nfs/dbraw/zinc/89/42/50/1006894250.db2.gz SYAKQUHEVBLLGH-MDJJKAFGSA-N 1 1 373.453 2.710 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000855165250 1007148998 /nfs/dbraw/zinc/14/89/98/1007148998.db2.gz SLRGBDJENJIFSB-LLVKDONJSA-N 1 1 357.813 2.919 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)c2ccccc21 ZINC000884529608 1007471323 /nfs/dbraw/zinc/47/13/23/1007471323.db2.gz RTDKGWOEAGELGZ-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO CC(C)C(C[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC001206328688 1032232937 /nfs/dbraw/zinc/23/29/37/1032232937.db2.gz MSOKFRTUIITGEU-UHFFFAOYSA-N 1 1 371.503 2.733 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H](O)c2ccnn2C)CC1 ZINC000856800803 1007979685 /nfs/dbraw/zinc/97/96/85/1007979685.db2.gz WAVHVZDPNPOIJX-LJQANCHMSA-N 1 1 374.441 2.673 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000819015665 1008023582 /nfs/dbraw/zinc/02/35/82/1008023582.db2.gz MZCXRZIISUKCMA-GHTZIAJQSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000819015665 1008023589 /nfs/dbraw/zinc/02/35/89/1008023589.db2.gz MZCXRZIISUKCMA-GHTZIAJQSA-N 1 1 369.465 2.782 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[NH+]1CCOCC1 ZINC000821718875 1008491029 /nfs/dbraw/zinc/49/10/29/1008491029.db2.gz WPRPHWRWDVLSEX-KRWDZBQOSA-N 1 1 367.421 2.601 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@]2(CC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)C1 ZINC000886136306 1008582892 /nfs/dbraw/zinc/58/28/92/1008582892.db2.gz KRMHRJPHQJYKQI-GOSISDBHSA-N 1 1 362.430 2.823 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@]2(CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)C1 ZINC000886136306 1008582906 /nfs/dbraw/zinc/58/29/06/1008582906.db2.gz KRMHRJPHQJYKQI-GOSISDBHSA-N 1 1 362.430 2.823 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859613055 1008588981 /nfs/dbraw/zinc/58/89/81/1008588981.db2.gz VZKZAGFPRUOJHC-XYPHTWIQSA-N 1 1 364.442 2.928 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000886241273 1008611030 /nfs/dbraw/zinc/61/10/30/1008611030.db2.gz TXDDOYHIIUSUNM-DZGCQCFKSA-N 1 1 364.446 2.973 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000886241273 1008611037 /nfs/dbraw/zinc/61/10/37/1008611037.db2.gz TXDDOYHIIUSUNM-DZGCQCFKSA-N 1 1 364.446 2.973 20 5 FFBDMO C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001177708400 1008723178 /nfs/dbraw/zinc/72/31/78/1008723178.db2.gz PAZLSWXBKVZDHT-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)CC2)[nH+]c1C ZINC001178042851 1008856444 /nfs/dbraw/zinc/85/64/44/1008856444.db2.gz LLZCXIZKKMKHCC-UHFFFAOYSA-N 1 1 372.381 2.683 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@H]1CO)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860253686 1008917638 /nfs/dbraw/zinc/91/76/38/1008917638.db2.gz GBKZZCWYTDYJLM-INIZCTEOSA-N 1 1 371.437 2.715 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1c(F)cccc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458755 1008995529 /nfs/dbraw/zinc/99/55/29/1008995529.db2.gz WTCHHTOWSWBOLI-MLGOLLRUSA-N 1 1 371.840 2.911 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@](C)(O)c1ccccc1 ZINC000823597838 1009134652 /nfs/dbraw/zinc/13/46/52/1009134652.db2.gz CHQCAGZYBANELQ-IBGZPJMESA-N 1 1 357.410 2.763 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000824003107 1009290145 /nfs/dbraw/zinc/29/01/45/1009290145.db2.gz PHLBJWZOMHAOIY-CYBMUJFWSA-N 1 1 369.425 2.745 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C1CC[NH+](C)CC1 ZINC000861891311 1009607760 /nfs/dbraw/zinc/60/77/60/1009607760.db2.gz WZVUAKXDDSLQTC-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000866204232 1010950878 /nfs/dbraw/zinc/95/08/78/1010950878.db2.gz BGBWGBYTMIMUDX-RDJZCZTQSA-N 1 1 353.426 2.891 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121159506 1011024370 /nfs/dbraw/zinc/02/43/70/1011024370.db2.gz BAQQPBPAAQKBTP-OAHLLOKOSA-N 1 1 373.457 2.695 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121159506 1011024378 /nfs/dbraw/zinc/02/43/78/1011024378.db2.gz BAQQPBPAAQKBTP-OAHLLOKOSA-N 1 1 373.457 2.695 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@H](CO)[C@@H](C(F)(F)F)C1)CC2 ZINC001172905633 1012077990 /nfs/dbraw/zinc/07/79/90/1012077990.db2.gz UBCIZLZZUGQZLQ-YCPHGPKFSA-N 1 1 358.360 2.945 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](Oc3ncc(F)cn3)C1)CC2 ZINC001172913082 1012124844 /nfs/dbraw/zinc/12/48/44/1012124844.db2.gz OTLFKBLWCWFPRJ-FUHWJXTLSA-N 1 1 372.400 2.925 20 5 FFBDMO C[C@@]1(CO)CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010567 1012179891 /nfs/dbraw/zinc/17/98/91/1012179891.db2.gz VAPHEEQIPSDTAD-QGZVFWFLSA-N 1 1 355.385 2.546 20 5 FFBDMO C[C@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1=O ZINC001173010304 1012180055 /nfs/dbraw/zinc/18/00/55/1012180055.db2.gz PZOJBCYYABARDD-NSHDSACASA-N 1 1 353.369 2.753 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1=O ZINC001173010304 1012180070 /nfs/dbraw/zinc/18/00/70/1012180070.db2.gz PZOJBCYYABARDD-NSHDSACASA-N 1 1 353.369 2.753 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCCC[C@@H](O)C3)CC2)c(F)c1 ZINC001173010778 1012182494 /nfs/dbraw/zinc/18/24/94/1012182494.db2.gz YTCXSAVODSUPIW-CQSZACIVSA-N 1 1 355.385 2.689 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[N@H+]3CCCC[C@@H]3C2)c1F ZINC001173189896 1012331558 /nfs/dbraw/zinc/33/15/58/1012331558.db2.gz OIEMHPVDASRDTC-ZIAGYGMSSA-N 1 1 351.422 2.844 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@H](n3ccnn3)C2)c1F ZINC001173191183 1012331645 /nfs/dbraw/zinc/33/16/45/1012331645.db2.gz AVCYMOQDUJCPSB-QWHCGFSZSA-N 1 1 363.393 2.602 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN([C@H](C)Cc3c(F)c(OC)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC001173191319 1012333080 /nfs/dbraw/zinc/33/30/80/1012333080.db2.gz BXZMNNKEJKGIPV-KFWWJZLASA-N 1 1 365.449 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCc3c(=O)[nH]ccc3C2)c1F ZINC001173192181 1012335380 /nfs/dbraw/zinc/33/53/80/1012335380.db2.gz JIVUQNGTQPARCC-NSHDSACASA-N 1 1 361.373 2.832 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1C1CCOCC1 ZINC000870376523 1012340804 /nfs/dbraw/zinc/34/08/04/1012340804.db2.gz AVDLPDBPBILVNA-GBESFXJTSA-N 1 1 374.437 2.775 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1C1CCOCC1 ZINC000870376523 1012340819 /nfs/dbraw/zinc/34/08/19/1012340819.db2.gz AVDLPDBPBILVNA-GBESFXJTSA-N 1 1 374.437 2.775 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2C[C@H](C(=O)NC3CC3)C[C@@H]2C1 ZINC001173223176 1012353586 /nfs/dbraw/zinc/35/35/86/1012353586.db2.gz AGDCNOFDHZXTPT-QSPRXWTASA-N 1 1 357.454 2.762 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)c2ccc(O)cc2)CC1 ZINC001173231837 1012364313 /nfs/dbraw/zinc/36/43/13/1012364313.db2.gz NPBRBWMUYGNHHY-HNNXBMFYSA-N 1 1 369.421 2.689 20 5 FFBDMO COc1cc(C)nc(O[C@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237131 1012382187 /nfs/dbraw/zinc/38/21/87/1012382187.db2.gz IAZCJIVNXHLWAZ-YOEHRIQHSA-N 1 1 372.425 2.786 20 5 FFBDMO COC(=O)c1cnc2c(c1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173237135 1012382760 /nfs/dbraw/zinc/38/27/60/1012382760.db2.gz ICCPSVOEJUJFQH-ZDUSSCGKSA-N 1 1 355.394 2.766 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(Cc2cccc(N)c2)CC1 ZINC001173237742 1012386501 /nfs/dbraw/zinc/38/65/01/1012386501.db2.gz LTGILNZIDUHLGS-INIZCTEOSA-N 1 1 354.454 2.926 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1=CCCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051290991 1017272121 /nfs/dbraw/zinc/27/21/21/1017272121.db2.gz HQDPQUDFFDACDF-WOJBJXKFSA-N 1 1 369.465 2.827 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](CC1=CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051290991 1017272127 /nfs/dbraw/zinc/27/21/27/1017272127.db2.gz HQDPQUDFFDACDF-WOJBJXKFSA-N 1 1 369.465 2.827 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1=CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051290991 1017272135 /nfs/dbraw/zinc/27/21/35/1017272135.db2.gz HQDPQUDFFDACDF-WOJBJXKFSA-N 1 1 369.465 2.827 20 5 FFBDMO CC(C)C[C@@H]1CCC[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748791885 1017653895 /nfs/dbraw/zinc/65/38/95/1017653895.db2.gz JNHUEIIWJJQIRR-LPHOPBHVSA-N 1 1 374.441 2.830 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000928245275 1018906692 /nfs/dbraw/zinc/90/66/92/1018906692.db2.gz MDXGQIYLLBOJJB-MRXNPFEDSA-N 1 1 362.474 2.578 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000801981620 1019575056 /nfs/dbraw/zinc/57/50/56/1019575056.db2.gz RGSUJVVXHYIUBQ-ZDUSSCGKSA-N 1 1 364.421 2.843 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000930861691 1020216237 /nfs/dbraw/zinc/21/62/37/1020216237.db2.gz FWZVRIYCSIDRJM-HNNXBMFYSA-N 1 1 362.430 2.586 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@H](Cc4nccs4)C3)n2)c1 ZINC000902649522 1020374448 /nfs/dbraw/zinc/37/44/48/1020374448.db2.gz NUBRMJREKXBTJP-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](Cc4nccs4)C3)n2)c1 ZINC000902649522 1020374459 /nfs/dbraw/zinc/37/44/59/1020374459.db2.gz NUBRMJREKXBTJP-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)c1 ZINC000931795694 1020590440 /nfs/dbraw/zinc/59/04/40/1020590440.db2.gz IAXGMIUNLUDZFS-UYAOXDASSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)c1 ZINC000931795694 1020590449 /nfs/dbraw/zinc/59/04/49/1020590449.db2.gz IAXGMIUNLUDZFS-UYAOXDASSA-N 1 1 364.405 2.999 20 5 FFBDMO COCCO[C@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000800849784 1020592421 /nfs/dbraw/zinc/59/24/21/1020592421.db2.gz GDYVRGNGUMXZIM-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000800849784 1020592428 /nfs/dbraw/zinc/59/24/28/1020592428.db2.gz GDYVRGNGUMXZIM-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO Cc1cccc(C2=CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)c1C ZINC000934845916 1021427988 /nfs/dbraw/zinc/42/79/88/1021427988.db2.gz ZQXLTXCXLZVMPM-GOSISDBHSA-N 1 1 356.426 2.558 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC001118774448 1022394190 /nfs/dbraw/zinc/39/41/90/1022394190.db2.gz DCVSPSYUSZJBMQ-OAHLLOKOSA-N 1 1 360.458 2.799 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001118844502 1022433846 /nfs/dbraw/zinc/43/38/46/1022433846.db2.gz IWCANJPJUDRHAJ-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001118844502 1022433850 /nfs/dbraw/zinc/43/38/50/1022433850.db2.gz IWCANJPJUDRHAJ-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1C[N@@H+](C)CCN1C ZINC001120959333 1023544370 /nfs/dbraw/zinc/54/43/70/1023544370.db2.gz IHHWXLLDRPUTAB-XJKSGUPXSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1CN(C)CC[N@@H+]1C ZINC001120959333 1023544374 /nfs/dbraw/zinc/54/43/74/1023544374.db2.gz IHHWXLLDRPUTAB-XJKSGUPXSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1CN(C)CC[N@H+]1C ZINC001120959333 1023544377 /nfs/dbraw/zinc/54/43/77/1023544377.db2.gz IHHWXLLDRPUTAB-XJKSGUPXSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1C[N@@H+](C)CCN1C ZINC001120959331 1023544415 /nfs/dbraw/zinc/54/44/15/1023544415.db2.gz IHHWXLLDRPUTAB-CJNGLKHVSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1CN(C)CC[N@@H+]1C ZINC001120959331 1023544418 /nfs/dbraw/zinc/54/44/18/1023544418.db2.gz IHHWXLLDRPUTAB-CJNGLKHVSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1CN(C)CC[N@H+]1C ZINC001120959331 1023544425 /nfs/dbraw/zinc/54/44/25/1023544425.db2.gz IHHWXLLDRPUTAB-CJNGLKHVSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000758333642 1024049478 /nfs/dbraw/zinc/04/94/78/1024049478.db2.gz IBKWGNVHDYLNJH-KBXCAEBGSA-N 1 1 372.469 2.798 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](c2cccnc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000829522711 1033198405 /nfs/dbraw/zinc/19/84/05/1033198405.db2.gz OEBAMYPAXGOTQU-AWEZNQCLSA-N 1 1 358.373 2.947 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000837158361 1025623129 /nfs/dbraw/zinc/62/31/29/1025623129.db2.gz BSQCQWNYQWHATP-MRXNPFEDSA-N 1 1 372.400 2.587 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000837514898 1025865513 /nfs/dbraw/zinc/86/55/13/1025865513.db2.gz NONSHXQWRDYNFG-HNNXBMFYSA-N 1 1 364.398 2.592 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000838101766 1026208881 /nfs/dbraw/zinc/20/88/81/1026208881.db2.gz LPAVEIJJGHNDBM-OAHLLOKOSA-N 1 1 358.398 2.812 20 5 FFBDMO C[C@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000839646237 1026772806 /nfs/dbraw/zinc/77/28/06/1026772806.db2.gz KTFRQWYFISFAJL-JXFKEZNVSA-N 1 1 355.438 2.835 20 5 FFBDMO C[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000839646238 1026773935 /nfs/dbraw/zinc/77/39/35/1026773935.db2.gz KTFRQWYFISFAJL-OXJNMPFZSA-N 1 1 355.438 2.835 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)n2)c1 ZINC000840114434 1026962262 /nfs/dbraw/zinc/96/22/62/1026962262.db2.gz IDYXXGVHKPOWCI-KSZLIROESA-N 1 1 371.441 2.826 20 5 FFBDMO Cc1nn(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c2ncc([N+](=O)[O-])cc12 ZINC000840130997 1026972751 /nfs/dbraw/zinc/97/27/51/1026972751.db2.gz XLTXFWDLJOMYRK-SJORKVTESA-N 1 1 371.441 2.887 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC(C)(C)C1 ZINC000840183706 1027001834 /nfs/dbraw/zinc/00/18/34/1027001834.db2.gz IHUSYDRHOYRZLC-IBGZPJMESA-N 1 1 374.441 2.830 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@H]2CCc3ccccc3[C@H]2O)ncc1[N+](=O)[O-] ZINC001158684170 1027093765 /nfs/dbraw/zinc/09/37/65/1027093765.db2.gz NGSBZRDIKPFMPX-AUEOTKQJSA-N 1 1 354.410 2.982 20 5 FFBDMO COC(=O)c1nn(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c2ccccc12 ZINC000795645233 1027383063 /nfs/dbraw/zinc/38/30/63/1027383063.db2.gz RSSBBLHBXTWVGR-UHFFFAOYSA-N 1 1 368.393 2.863 20 5 FFBDMO CCc1cccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001160097827 1027589917 /nfs/dbraw/zinc/58/99/17/1027589917.db2.gz KJUWJKQAPIVYSF-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1cccc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160097827 1027589927 /nfs/dbraw/zinc/58/99/27/1027589927.db2.gz KJUWJKQAPIVYSF-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1cccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160097827 1027589938 /nfs/dbraw/zinc/58/99/38/1027589938.db2.gz KJUWJKQAPIVYSF-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CC(C)(C)C(=O)C[NH+]1CCC(Nc2nc(Cl)ncc2[N+](=O)[O-])CC1 ZINC001161118034 1028019946 /nfs/dbraw/zinc/01/99/46/1028019946.db2.gz AQTGBDHWMSEXGY-UHFFFAOYSA-N 1 1 355.826 2.530 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)[n+]([O-])c(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC001161886231 1028350416 /nfs/dbraw/zinc/35/04/16/1028350416.db2.gz ZHPDULQCVZDLAF-AWEZNQCLSA-N 1 1 362.817 2.958 20 5 FFBDMO CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1cnc2ccc([N+](=O)[O-])cc2n1 ZINC001162877478 1028691285 /nfs/dbraw/zinc/69/12/85/1028691285.db2.gz GPWYLIBOKDHSES-MRXNPFEDSA-N 1 1 359.430 2.697 20 5 FFBDMO Cc1[nH+]ccn1CCNc1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001156010265 1029010773 /nfs/dbraw/zinc/01/07/73/1029010773.db2.gz IXIFNSZPHJNHGQ-UHFFFAOYSA-N 1 1 350.688 2.674 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cn3ncc4cc([N+](=O)[O-])ccc43)CC2)n1 ZINC000781149777 1029022446 /nfs/dbraw/zinc/02/24/46/1029022446.db2.gz MUFVWEWAJDDOQT-UHFFFAOYSA-N 1 1 356.386 2.647 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001165151656 1029423582 /nfs/dbraw/zinc/42/35/82/1029423582.db2.gz XVGPWZCIUKJBQA-UHFFFAOYSA-N 1 1 368.437 2.564 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@H]21 ZINC001157282989 1029536014 /nfs/dbraw/zinc/53/60/14/1029536014.db2.gz SCKLPJXAZVFGPE-CXAGYDPISA-N 1 1 357.389 2.721 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)[C@H]2CCCC[C@H]12 ZINC000782277750 1029637879 /nfs/dbraw/zinc/63/78/79/1029637879.db2.gz RUVBNDZSKGNWKI-XYPHTWIQSA-N 1 1 372.425 2.831 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000783910625 1030334478 /nfs/dbraw/zinc/33/44/78/1030334478.db2.gz IKPJYKMKZMMLLC-CQSZACIVSA-N 1 1 364.373 2.614 20 5 FFBDMO C/C(=C/C(=O)N1CCCC[C@H]1C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784027119 1030425739 /nfs/dbraw/zinc/42/57/39/1030425739.db2.gz RSIDFSCDDZVJHH-VDUFWMCCSA-N 1 1 373.453 2.711 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000784031116 1030430310 /nfs/dbraw/zinc/43/03/10/1030430310.db2.gz JWIXJHQIAGMSJX-AUUYWEPGSA-N 1 1 374.441 2.687 20 5 FFBDMO COC(=O)CCN(Cc1ccco1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001166581704 1030448567 /nfs/dbraw/zinc/44/85/67/1030448567.db2.gz DJDLORUFFXAPKO-SOFGYWHQSA-N 1 1 374.397 2.685 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3cccnc3)C2)nc1-c1ccncc1 ZINC000842629355 1030851709 /nfs/dbraw/zinc/85/17/09/1030851709.db2.gz VHFSGXODGPRUKQ-MRXNPFEDSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3cccnc3)C2)nc1-c1ccncc1 ZINC000842629355 1030851725 /nfs/dbraw/zinc/85/17/25/1030851725.db2.gz VHFSGXODGPRUKQ-MRXNPFEDSA-N 1 1 350.382 2.695 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000843422466 1031396140 /nfs/dbraw/zinc/39/61/40/1031396140.db2.gz VPYKKIIYCDUVQD-HXUWFJFHSA-N 1 1 372.421 2.878 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001149847442 1031606147 /nfs/dbraw/zinc/60/61/47/1031606147.db2.gz MWWMELFBXQFTPY-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196596 1031693880 /nfs/dbraw/zinc/69/38/80/1031693880.db2.gz UHTKJMFHXMEGPV-KBXCAEBGSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196596 1031693893 /nfs/dbraw/zinc/69/38/93/1031693893.db2.gz UHTKJMFHXMEGPV-KBXCAEBGSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1cc([N+](=O)[O-])ccc1F ZINC000831164319 1033975177 /nfs/dbraw/zinc/97/51/77/1033975177.db2.gz BTQJKKYMSBJTQX-IAOVAPTHSA-N 1 1 365.405 2.688 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000831563141 1034125122 /nfs/dbraw/zinc/12/51/22/1034125122.db2.gz KTBWLYMTUQILBV-BNOWGMLFSA-N 1 1 371.359 2.998 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ncccc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001225598710 1034328131 /nfs/dbraw/zinc/32/81/31/1034328131.db2.gz YJCKPKDFDNJDJF-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ncccc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225598710 1034328135 /nfs/dbraw/zinc/32/81/35/1034328135.db2.gz YJCKPKDFDNJDJF-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO Cc1cc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)ncc1[N+](=O)[O-] ZINC001225660075 1034355976 /nfs/dbraw/zinc/35/59/76/1034355976.db2.gz BKGZSCPKZFGTGC-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO O=c1cc[nH]c(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC001225664528 1034358339 /nfs/dbraw/zinc/35/83/39/1034358339.db2.gz QCENFWHHGIUHTC-ZMSDIMECSA-N 1 1 355.394 2.985 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1 ZINC000832054883 1034523382 /nfs/dbraw/zinc/52/33/82/1034523382.db2.gz XBYXUTSNGXKQLK-BPQIPLTHSA-N 1 1 362.426 2.636 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226167333 1034555419 /nfs/dbraw/zinc/55/54/19/1034555419.db2.gz HWGLDVXIGMUPIB-KSSFIOAISA-N 1 1 369.421 2.983 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ncc([N+](=O)[O-])cc1Br ZINC001226344565 1034640011 /nfs/dbraw/zinc/64/00/11/1034640011.db2.gz QOAXPUOHHUSXFQ-IWIIMEHWSA-N 1 1 356.220 2.861 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001536195322 1069933757 /nfs/dbraw/zinc/93/37/57/1069933757.db2.gz OFTRJFDECHSXDR-AWEZNQCLSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001536195322 1069933766 /nfs/dbraw/zinc/93/37/66/1069933766.db2.gz OFTRJFDECHSXDR-AWEZNQCLSA-N 1 1 364.402 2.614 20 5 FFBDMO COC(=O)c1ccc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)cc1[N+](=O)[O-] ZINC001234056070 1036897634 /nfs/dbraw/zinc/89/76/34/1036897634.db2.gz CCMJTSUZQNKPCC-UKRRQHHQSA-N 1 1 371.393 2.991 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@](C)(O)[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093507 1038379151 /nfs/dbraw/zinc/37/91/51/1038379151.db2.gz MWWYEWBFBSKCOM-AUUYWEPGSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](C)[C@@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256092953 1038380429 /nfs/dbraw/zinc/38/04/29/1038380429.db2.gz CFALUFULMPRPMP-KDOFPFPSSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)Cc3cnc(C)nc3)CC2)ccc1[N+](=O)[O-] ZINC001256101168 1038383965 /nfs/dbraw/zinc/38/39/65/1038383965.db2.gz AEYYDTMTTOCTKR-UHFFFAOYSA-N 1 1 371.441 2.803 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@@H]3C3CC3)CC2)ccc1[N+](=O)[O-] ZINC001256101493 1038387907 /nfs/dbraw/zinc/38/79/07/1038387907.db2.gz LAEBJOJWGQMDMB-GOSISDBHSA-N 1 1 361.442 2.683 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(Cc2nnc(CC[NH+]3C[C@H](C)O[C@@H](C)C3)o2)c1 ZINC001258089632 1039163586 /nfs/dbraw/zinc/16/35/86/1039163586.db2.gz AKZWGEPJMKRETB-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO CCC[C@@]1(CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[NH2+]1 ZINC001246455668 1039359137 /nfs/dbraw/zinc/35/91/37/1039359137.db2.gz IXWBQKWDGPVIRR-SFHVURJKSA-N 1 1 368.428 2.964 20 5 FFBDMO CCC[C@H]1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)CCN1 ZINC001246904698 1039527273 /nfs/dbraw/zinc/52/72/73/1039527273.db2.gz WUEBSTVCZQBXMO-HNNXBMFYSA-N 1 1 362.474 2.646 20 5 FFBDMO CCC[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)CCN1 ZINC001246904698 1039527289 /nfs/dbraw/zinc/52/72/89/1039527289.db2.gz WUEBSTVCZQBXMO-HNNXBMFYSA-N 1 1 362.474 2.646 20 5 FFBDMO Cc1ccc(CNC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC001253394192 1040150175 /nfs/dbraw/zinc/15/01/75/1040150175.db2.gz AYAAIWSHNHMXQA-SFHVURJKSA-N 1 1 368.437 2.977 20 5 FFBDMO COc1cc(OC)cc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC001248210196 1040173945 /nfs/dbraw/zinc/17/39/45/1040173945.db2.gz MAZIDGCCQDVXMD-INIZCTEOSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH+]3CC(N4CCC(F)(F)C4)C3)CC2)cc1 ZINC001254480188 1040747820 /nfs/dbraw/zinc/74/78/20/1040747820.db2.gz XHHGNVMAIQJDPJ-UHFFFAOYSA-N 1 1 366.412 2.589 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2ccncc2)C1 ZINC001254568506 1040806100 /nfs/dbraw/zinc/80/61/00/1040806100.db2.gz GJYXQNCTIGCXPS-CRAIPNDOSA-N 1 1 368.437 2.815 20 5 FFBDMO CN1CCN(c2cccc(C[NH2+][C@H]3Cc4ccc([N+](=O)[O-])cc4C3)c2)CC1 ZINC001254573054 1040810338 /nfs/dbraw/zinc/81/03/38/1040810338.db2.gz WCJJZOMZQBZVNW-IBGZPJMESA-N 1 1 366.465 2.604 20 5 FFBDMO CC(=O)N1CCCC[C@@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594722 1040822557 /nfs/dbraw/zinc/82/25/57/1040822557.db2.gz HFDYZDJQMMYBOK-UXHICEINSA-N 1 1 357.454 2.929 20 5 FFBDMO CC(=O)N1CCCC[C@@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594721 1040823031 /nfs/dbraw/zinc/82/30/31/1040823031.db2.gz HFDYZDJQMMYBOK-PMACEKPBSA-N 1 1 357.454 2.929 20 5 FFBDMO Cc1cccnc1N1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254597410 1040827568 /nfs/dbraw/zinc/82/75/68/1040827568.db2.gz DGZZNVPALZPWRN-IBGZPJMESA-N 1 1 352.438 2.978 20 5 FFBDMO COc1ccccc1CN1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254598582 1040829545 /nfs/dbraw/zinc/82/95/45/1040829545.db2.gz IANDOLOZODDKKH-FQEVSTJZSA-N 1 1 367.449 2.888 20 5 FFBDMO COc1cc(O[C@@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ccn1 ZINC001254605392 1040834214 /nfs/dbraw/zinc/83/42/14/1040834214.db2.gz BNQXGHOGWQDNMU-SJLPKXTDSA-N 1 1 355.394 2.619 20 5 FFBDMO COc1ccc(O[C@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254612163 1040841779 /nfs/dbraw/zinc/84/17/79/1040841779.db2.gz VOQVWGVIPOALTC-WMZOPIPTSA-N 1 1 355.394 2.619 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)n1 ZINC001537964482 1070304426 /nfs/dbraw/zinc/30/44/26/1070304426.db2.gz FYNVECPMSRUMQC-IBGZPJMESA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC001538310443 1070402609 /nfs/dbraw/zinc/40/26/09/1070402609.db2.gz XFJKHECIGPPOHS-GFCCVEGCSA-N 1 1 353.394 2.545 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC001538310443 1070402616 /nfs/dbraw/zinc/40/26/16/1070402616.db2.gz XFJKHECIGPPOHS-GFCCVEGCSA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC001309636819 1043464989 /nfs/dbraw/zinc/46/49/89/1043464989.db2.gz RLYRYGXBRKSISS-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[N@H+](C)C2(CCCCC2)C1 ZINC001309636819 1043464993 /nfs/dbraw/zinc/46/49/93/1043464993.db2.gz RLYRYGXBRKSISS-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001318609294 1044771008 /nfs/dbraw/zinc/77/10/08/1044771008.db2.gz HTKREOBHNWUNLM-HNNXBMFYSA-N 1 1 369.425 2.813 20 5 FFBDMO O=C(NC1CC1)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001319559281 1045194520 /nfs/dbraw/zinc/19/45/20/1045194520.db2.gz ZRDDNMXHWNXBMV-CQSZACIVSA-N 1 1 370.409 2.740 20 5 FFBDMO O=C(NC1CC1)[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001319559281 1045194523 /nfs/dbraw/zinc/19/45/23/1045194523.db2.gz ZRDDNMXHWNXBMV-CQSZACIVSA-N 1 1 370.409 2.740 20 5 FFBDMO COc1ccc(COC(=O)c2cnn(-c3cc[nH+]cc3)c2C)cc1[N+](=O)[O-] ZINC001320068921 1045342151 /nfs/dbraw/zinc/34/21/51/1045342151.db2.gz XUQLPOYLPCFLHQ-UHFFFAOYSA-N 1 1 368.349 2.850 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001320174760 1045362218 /nfs/dbraw/zinc/36/22/18/1045362218.db2.gz BKKMEVDGQUJSSA-MSOLQXFVSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001320174760 1045362224 /nfs/dbraw/zinc/36/22/24/1045362224.db2.gz BKKMEVDGQUJSSA-MSOLQXFVSA-N 1 1 372.400 2.951 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(Cc1ccc(C[NH+]3CCOCC3)cc1)C2 ZINC001325458957 1046514967 /nfs/dbraw/zinc/51/49/67/1046514967.db2.gz SZDSALGNRDLLIX-UHFFFAOYSA-N 1 1 353.422 2.943 20 5 FFBDMO CN(CC(=O)NC[C@@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1[N+](=O)[O-] ZINC001287947049 1047376694 /nfs/dbraw/zinc/37/66/94/1047376694.db2.gz MBEGCCNMOFOMOV-KRWDZBQOSA-N 1 1 374.485 2.944 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3nccs3)C2)nc1-c1ccccn1 ZINC001332150891 1048269708 /nfs/dbraw/zinc/26/97/08/1048269708.db2.gz IICMJBOTOMLOCA-LBPRGKRZSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3nccs3)C2)nc1-c1ccccn1 ZINC001332150891 1048269724 /nfs/dbraw/zinc/26/97/24/1048269724.db2.gz IICMJBOTOMLOCA-LBPRGKRZSA-N 1 1 356.411 2.757 20 5 FFBDMO CN1CC[NH+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC001329275960 1048649619 /nfs/dbraw/zinc/64/96/19/1048649619.db2.gz IAAKZQOHBKMYHY-UHFFFAOYSA-N 1 1 370.453 2.504 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@@H](C)[N+](=O)[O-])n2Cc2ccccc2)C[C@H]1C ZINC001342144905 1050739473 /nfs/dbraw/zinc/73/94/73/1050739473.db2.gz OVQZCUWABBTDJB-OWCLPIDISA-N 1 1 372.473 2.583 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001342591583 1051197309 /nfs/dbraw/zinc/19/73/09/1051197309.db2.gz NHZJHFHYFOQRMC-KRWDZBQOSA-N 1 1 372.425 2.555 20 5 FFBDMO Cc1c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2N)cnn1-c1cc[nH+]cc1 ZINC001304499970 1051626045 /nfs/dbraw/zinc/62/60/45/1051626045.db2.gz HWDHGEVCGRVSME-UHFFFAOYSA-N 1 1 352.354 2.627 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(F)cc1F ZINC001307436375 1052307081 /nfs/dbraw/zinc/30/70/81/1052307081.db2.gz UWLFYSJGOSOAKP-UHFFFAOYSA-N 1 1 351.353 2.947 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@@H]2CCO)o1 ZINC001307824404 1052354379 /nfs/dbraw/zinc/35/43/79/1052354379.db2.gz YSFACWSPZCFXPB-LLVKDONJSA-N 1 1 352.778 2.645 20 5 FFBDMO CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](CO)c1ccccc1 ZINC001308029518 1052387449 /nfs/dbraw/zinc/38/74/49/1052387449.db2.gz NLFCUBQISUZJKX-LJQANCHMSA-N 1 1 369.421 2.539 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](CO)c1ccccc1 ZINC001308029518 1052387455 /nfs/dbraw/zinc/38/74/55/1052387455.db2.gz NLFCUBQISUZJKX-LJQANCHMSA-N 1 1 369.421 2.539 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]1(CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC001308161190 1052421555 /nfs/dbraw/zinc/42/15/55/1052421555.db2.gz QEHVLQCPHANTAR-LJQANCHMSA-N 1 1 355.394 2.517 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]1(CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC001308161190 1052421557 /nfs/dbraw/zinc/42/15/57/1052421557.db2.gz QEHVLQCPHANTAR-LJQANCHMSA-N 1 1 355.394 2.517 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001308170768 1052425252 /nfs/dbraw/zinc/42/52/52/1052425252.db2.gz NDUDCQJRUQYIQY-BGYRXZFFSA-N 1 1 372.469 2.650 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1[N+](=O)[O-] ZINC001308509359 1052463053 /nfs/dbraw/zinc/46/30/53/1052463053.db2.gz NOVLTERBZBYTON-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO CCc1ccc(S(=O)(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC001309015860 1052539810 /nfs/dbraw/zinc/53/98/10/1052539810.db2.gz KCQNBLVQZGLLKF-AWEZNQCLSA-N 1 1 369.487 2.700 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3c(C)c(F)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336026478 1053716513 /nfs/dbraw/zinc/71/65/13/1053716513.db2.gz YITIPJGGLGQMTE-INIZCTEOSA-N 1 1 373.384 2.838 20 5 FFBDMO O=C(c1cc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-])N1CCCC1 ZINC001337735679 1054978792 /nfs/dbraw/zinc/97/87/92/1054978792.db2.gz XLQNDDPGLYQQBM-WMZOPIPTSA-N 1 1 358.442 2.870 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc(C[NH+]2CCCC2)n1C ZINC001337933973 1055112717 /nfs/dbraw/zinc/11/27/17/1055112717.db2.gz WXDTXTGUJOHIDD-UHFFFAOYSA-N 1 1 358.446 2.734 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001337997029 1055159978 /nfs/dbraw/zinc/15/99/78/1055159978.db2.gz MDSCOXHLWQHWCK-GOSISDBHSA-N 1 1 360.458 2.508 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC001352451510 1055487711 /nfs/dbraw/zinc/48/77/11/1055487711.db2.gz CFFWZQBIJCIVIJ-OLZOCXBDSA-N 1 1 364.475 2.580 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N3CC[C@H](c4[nH+]ccn4C)C3)c2c1 ZINC001350003400 1055578177 /nfs/dbraw/zinc/57/81/77/1055578177.db2.gz ABFXQAABUZEGJA-LBPRGKRZSA-N 1 1 353.382 2.879 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC001350857289 1055969598 /nfs/dbraw/zinc/96/95/98/1055969598.db2.gz ZWCMYRCSAVIGMN-INIZCTEOSA-N 1 1 367.405 2.985 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001339235569 1056233796 /nfs/dbraw/zinc/23/37/96/1056233796.db2.gz WAKQCNJRQSGVKM-RHSMWYFYSA-N 1 1 370.457 2.712 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ncnc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000611701460 1056448301 /nfs/dbraw/zinc/44/83/01/1056448301.db2.gz JKGRFZTUWAXODS-BETUJISGSA-N 1 1 359.430 2.838 20 5 FFBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)OCc2cn(C)nc2[N+](=O)[O-])cc1 ZINC000847785840 1056620741 /nfs/dbraw/zinc/62/07/41/1056620741.db2.gz YENDPKNKFYWADG-UHFFFAOYSA-N 1 1 360.414 2.917 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000538096315 1056796083 /nfs/dbraw/zinc/79/60/83/1056796083.db2.gz BLEGVECDXVMQOJ-HIFRSBDPSA-N 1 1 352.398 2.885 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2cnn(C)c2)C1 ZINC000849483055 1056869439 /nfs/dbraw/zinc/86/94/39/1056869439.db2.gz VJAQJTAPKCBPTD-MSOLQXFVSA-N 1 1 371.441 2.781 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@H+](C)C[C@H]1c1cnn(C)c1 ZINC000849483719 1056870040 /nfs/dbraw/zinc/87/00/40/1056870040.db2.gz IVHVJYKGVKESEK-CVEARBPZSA-N 1 1 371.441 2.619 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CC[N@H+](C)C[C@H]1c1cnn(C)c1 ZINC000849597327 1056938318 /nfs/dbraw/zinc/93/83/18/1056938318.db2.gz SFOVPIGLQNCLQH-HOTGVXAUSA-N 1 1 371.441 2.619 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2C)cc1SC ZINC001518485529 1058397874 /nfs/dbraw/zinc/39/78/74/1058397874.db2.gz JGSGXWLCBPXDNK-NSHDSACASA-N 1 1 353.444 2.539 20 5 FFBDMO Cc1ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704261 1059154504 /nfs/dbraw/zinc/15/45/04/1059154504.db2.gz SCUNSGSORUPPDI-WOJBJXKFSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704261 1059154532 /nfs/dbraw/zinc/15/45/32/1059154532.db2.gz SCUNSGSORUPPDI-WOJBJXKFSA-N 1 1 369.465 2.876 20 5 FFBDMO Nc1c(C(=O)NC[C@@]23CC[N@@H+](C2)CCC3)cc2ccccc2c1[N+](=O)[O-] ZINC001452596448 1059258042 /nfs/dbraw/zinc/25/80/42/1059258042.db2.gz BVTSWVHEHHDMNZ-LJQANCHMSA-N 1 1 354.410 2.546 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000848488418 1060135811 /nfs/dbraw/zinc/13/58/11/1060135811.db2.gz BLDUNDQHVCSNLH-HKUYNNGSSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000848488418 1060135825 /nfs/dbraw/zinc/13/58/25/1060135825.db2.gz BLDUNDQHVCSNLH-HKUYNNGSSA-N 1 1 366.421 2.753 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC[C@H](OC4CCC4)C3)n2)cc1 ZINC000848496835 1060167980 /nfs/dbraw/zinc/16/79/80/1060167980.db2.gz FLEMNKVFEDKNDL-KRWDZBQOSA-N 1 1 357.414 2.844 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H](OC4CCC4)C3)n2)cc1 ZINC000848496835 1060167990 /nfs/dbraw/zinc/16/79/90/1060167990.db2.gz FLEMNKVFEDKNDL-KRWDZBQOSA-N 1 1 357.414 2.844 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(N)c1[N+](=O)[O-] ZINC001456751986 1060189288 /nfs/dbraw/zinc/18/92/88/1060189288.db2.gz SSRAGLZQKJZIRX-OAHLLOKOSA-N 1 1 354.410 2.946 20 5 FFBDMO Nc1c(C(=O)NCc2c[nH+]c3n2CCCC3)cc2ccccc2c1[N+](=O)[O-] ZINC001520988373 1060277572 /nfs/dbraw/zinc/27/75/72/1060277572.db2.gz GJYZLCPAAVYYHY-UHFFFAOYSA-N 1 1 365.393 2.793 20 5 FFBDMO CCC(=O)c1ccc(N2CCC[C@H]([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000848795510 1060715880 /nfs/dbraw/zinc/71/58/80/1060715880.db2.gz IPJNYZWSPKYNPM-INIZCTEOSA-N 1 1 361.442 2.879 20 5 FFBDMO CCOC(=O)CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001460366668 1060977883 /nfs/dbraw/zinc/97/78/83/1060977883.db2.gz RDGCEDUEBQBFEA-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC001460733694 1061079159 /nfs/dbraw/zinc/07/91/59/1061079159.db2.gz WANQLLMREKYYDJ-VIFPVBQESA-N 1 1 368.315 2.958 20 5 FFBDMO Cc1cc([C@H]2CCCC[N@@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837709 1061124407 /nfs/dbraw/zinc/12/44/07/1061124407.db2.gz YIRKRWGEUSLJEE-GOEBONIOSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1cc([C@H]2CCCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837709 1061124415 /nfs/dbraw/zinc/12/44/15/1061124415.db2.gz YIRKRWGEUSLJEE-GOEBONIOSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)n1 ZINC001463593387 1062174320 /nfs/dbraw/zinc/17/43/20/1062174320.db2.gz SGENVYKGCCYNDT-UHFFFAOYSA-N 1 1 354.410 2.565 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001529550420 1062338140 /nfs/dbraw/zinc/33/81/40/1062338140.db2.gz ISVYHONWRMNOTD-APWZRJJASA-N 1 1 351.406 2.941 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001463989562 1062367460 /nfs/dbraw/zinc/36/74/60/1062367460.db2.gz AMCMHOUIBFDBJY-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@H+](C)C3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001463989562 1062367484 /nfs/dbraw/zinc/36/74/84/1062367484.db2.gz AMCMHOUIBFDBJY-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001465619773 1063156977 /nfs/dbraw/zinc/15/69/77/1063156977.db2.gz AAQULNOJVCOACW-HOCLYGCPSA-N 1 1 368.437 2.960 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001440030959 1063253409 /nfs/dbraw/zinc/25/34/09/1063253409.db2.gz CLJIIGQOHSRSNO-UHFFFAOYSA-N 1 1 369.849 2.865 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCC[N@H+]1CCO ZINC001466686085 1063520395 /nfs/dbraw/zinc/52/03/95/1063520395.db2.gz CUHHAHJEKWZHLV-GFCCVEGCSA-N 1 1 370.837 2.525 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001472495929 1065082288 /nfs/dbraw/zinc/08/22/88/1065082288.db2.gz FMTSEJOVXMEGDO-GOSISDBHSA-N 1 1 374.485 2.504 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001472730615 1065136610 /nfs/dbraw/zinc/13/66/10/1065136610.db2.gz QTXADVJAYKCAKS-ZDUSSCGKSA-N 1 1 373.413 2.863 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC001472821531 1065152182 /nfs/dbraw/zinc/15/21/82/1065152182.db2.gz NLIQXTGFCLESDA-UHFFFAOYSA-N 1 1 359.386 2.856 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(Cc3cncs3)CC2)cc1 ZINC001473720682 1065331613 /nfs/dbraw/zinc/33/16/13/1065331613.db2.gz ADNYFVLSKYWFJU-UHFFFAOYSA-N 1 1 362.455 2.638 20 5 FFBDMO Cc1nc(CC2CC[NH+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC001473816202 1065375526 /nfs/dbraw/zinc/37/55/26/1065375526.db2.gz XWYBSCONBGOLJL-LBPRGKRZSA-N 1 1 373.413 2.568 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1CC1CC1 ZINC001474684117 1065578473 /nfs/dbraw/zinc/57/84/73/1065578473.db2.gz SOLZNLQEBZOQRQ-ZDUSSCGKSA-N 1 1 357.332 2.714 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001558291983 1075973865 /nfs/dbraw/zinc/97/38/65/1075973865.db2.gz TZTRLXFVXPVASC-UHFFFAOYSA-N 1 1 356.304 2.803 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@@H]21 ZINC001559259889 1076140850 /nfs/dbraw/zinc/14/08/50/1076140850.db2.gz PXGCUOFWFBYLTH-ABAIWWIYSA-N 1 1 357.370 2.582 20 5 FFBDMO CC(C)[C@H]1CCCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559541394 1076170637 /nfs/dbraw/zinc/17/06/37/1076170637.db2.gz PAZZKRAQDLOSPL-LJQANCHMSA-N 1 1 374.485 2.754 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H]2CC3(CO2)CCCCC3)CC1 ZINC001559888605 1076199302 /nfs/dbraw/zinc/19/93/02/1076199302.db2.gz ANGJGBQNCPAUNG-MRXNPFEDSA-N 1 1 360.458 2.851 20 5 FFBDMO CN(Cc1cnccn1)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001560659237 1076289157 /nfs/dbraw/zinc/28/91/57/1076289157.db2.gz BWRGCGRWMKDHOU-UHFFFAOYSA-N 1 1 369.469 2.771 20 5 FFBDMO COc1c(O)ccc(C[NH2+]C(C)(C)C(=O)Nc2ccccc2)c1[N+](=O)[O-] ZINC001560949553 1076312368 /nfs/dbraw/zinc/31/23/68/1076312368.db2.gz BACMIZSWIXRYRD-UHFFFAOYSA-N 1 1 359.382 2.816 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1N)C1CC1 ZINC001567881115 1077057675 /nfs/dbraw/zinc/05/76/75/1077057675.db2.gz DBGNZLBSWIHGRB-IBGZPJMESA-N 1 1 368.437 2.817 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(Cl)cc2F)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001568235112 1077079866 /nfs/dbraw/zinc/07/98/66/1077079866.db2.gz KKSSNJSQPINQNV-UKRRQHHQSA-N 1 1 369.824 2.663 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001585856663 1079506309 /nfs/dbraw/zinc/50/63/09/1079506309.db2.gz XMIUTHPLCHFMDG-LBPRGKRZSA-N 1 1 357.863 2.941 20 5 FFBDMO CCNc1ccc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001586605043 1079654936 /nfs/dbraw/zinc/65/49/36/1079654936.db2.gz XRABDOLHMMAROY-BGYRXZFFSA-N 1 1 372.469 2.975 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001590153615 1081056004 /nfs/dbraw/zinc/05/60/04/1081056004.db2.gz MNVYZQYJRIYJMW-LJQANCHMSA-N 1 1 364.409 2.939 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001590259430 1081129301 /nfs/dbraw/zinc/12/93/01/1081129301.db2.gz KOFWTMFQPFCMJV-ZDUSSCGKSA-N 1 1 359.434 2.699 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000022474518 206335798 /nfs/dbraw/zinc/33/57/98/206335798.db2.gz CUCQXUZRMGOXFM-BETUJISGSA-N 1 1 350.419 2.604 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000022474518 206335802 /nfs/dbraw/zinc/33/58/02/206335802.db2.gz CUCQXUZRMGOXFM-BETUJISGSA-N 1 1 350.419 2.604 20 5 FFBDMO Cn1cccc1[C@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000073101524 249793944 /nfs/dbraw/zinc/79/39/44/249793944.db2.gz RXFLBSLCOIOXOG-GOSISDBHSA-N 1 1 354.410 2.660 20 5 FFBDMO Cn1cccc1[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000073101524 249793947 /nfs/dbraw/zinc/79/39/47/249793947.db2.gz RXFLBSLCOIOXOG-GOSISDBHSA-N 1 1 354.410 2.660 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000091081332 249922995 /nfs/dbraw/zinc/92/29/95/249922995.db2.gz YDKMGPCGOCHWJB-MRXNPFEDSA-N 1 1 369.425 2.661 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000091081332 249923001 /nfs/dbraw/zinc/92/30/01/249923001.db2.gz YDKMGPCGOCHWJB-MRXNPFEDSA-N 1 1 369.425 2.661 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000105008164 250193755 /nfs/dbraw/zinc/19/37/55/250193755.db2.gz BTOMPIKAQYXNQR-GFCCVEGCSA-N 1 1 370.356 2.898 20 5 FFBDMO CCOC(=O)c1cc(N2CCN(c3cc(C)cc[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000152999469 251091026 /nfs/dbraw/zinc/09/10/26/251091026.db2.gz PBXOVFYJMVWPBF-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])c1 ZINC000153389818 251132125 /nfs/dbraw/zinc/13/21/25/251132125.db2.gz NDMLBPKYVVJVGU-UHFFFAOYSA-N 1 1 359.430 2.870 20 5 FFBDMO CCCC[N@H+](CC)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1 ZINC000153389818 251132129 /nfs/dbraw/zinc/13/21/29/251132129.db2.gz NDMLBPKYVVJVGU-UHFFFAOYSA-N 1 1 359.430 2.870 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1 ZINC000153389818 251132134 /nfs/dbraw/zinc/13/21/34/251132134.db2.gz NDMLBPKYVVJVGU-UHFFFAOYSA-N 1 1 359.430 2.870 20 5 FFBDMO O=C(C[NH+]1CCC(C2CCOCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000153584866 251152196 /nfs/dbraw/zinc/15/21/96/251152196.db2.gz JMCBFKYCEHJLDC-UHFFFAOYSA-N 1 1 373.453 2.623 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000181083652 251238567 /nfs/dbraw/zinc/23/85/67/251238567.db2.gz UOBVZCVBKKPJBJ-CABCVRRESA-N 1 1 360.458 2.904 20 5 FFBDMO O=C(CC[N@H+]1CCSC2(CCOCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000186813237 251269482 /nfs/dbraw/zinc/26/94/82/251269482.db2.gz DCLIQMZHNMDBQR-UHFFFAOYSA-N 1 1 365.455 2.521 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272470424 252046268 /nfs/dbraw/zinc/04/62/68/252046268.db2.gz AFPATKFGHWACMD-PKOBYXMFSA-N 1 1 366.421 2.783 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000272474660 252047724 /nfs/dbraw/zinc/04/77/24/252047724.db2.gz IUBAUWKRMASZBY-UHFFFAOYSA-N 1 1 354.838 2.528 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272584335 252073819 /nfs/dbraw/zinc/07/38/19/252073819.db2.gz YRAWSUXZBQFIFI-ZWKOTPCHSA-N 1 1 357.458 2.882 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)[C@H]2C1 ZINC000272604396 252079224 /nfs/dbraw/zinc/07/92/24/252079224.db2.gz YYBYDVUWTAOWQY-HZMBPMFUSA-N 1 1 368.231 2.524 20 5 FFBDMO C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000273025624 252195426 /nfs/dbraw/zinc/19/54/26/252195426.db2.gz UJSJKOUAVUMRLI-AWEZNQCLSA-N 1 1 358.442 2.575 20 5 FFBDMO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000276039574 256067591 /nfs/dbraw/zinc/06/75/91/256067591.db2.gz GFTKYVJLNRRTOG-MRXNPFEDSA-N 1 1 363.439 2.713 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(N3CCCCC3=O)CC2)ccc1[N+](=O)[O-] ZINC000276866760 256137942 /nfs/dbraw/zinc/13/79/42/256137942.db2.gz HDZSYJZLLOCUCY-UHFFFAOYSA-N 1 1 361.442 2.970 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[NH+](C2CCC2)CC1 ZINC000277414496 256195897 /nfs/dbraw/zinc/19/58/97/256195897.db2.gz ZRVSQKNYAUVPHC-UHFFFAOYSA-N 1 1 368.231 2.668 20 5 FFBDMO COCCn1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000282020450 256685127 /nfs/dbraw/zinc/68/51/27/256685127.db2.gz NMBMCKCRPHASMV-UHFFFAOYSA-N 1 1 356.382 2.988 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000285942680 257012575 /nfs/dbraw/zinc/01/25/75/257012575.db2.gz MFEDGTZHQDNFEK-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOC[C@H]1CC(F)F ZINC000286257059 257028177 /nfs/dbraw/zinc/02/81/77/257028177.db2.gz AWRSBFAZOTUKBR-CYBMUJFWSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@H]1CC(F)F ZINC000286257059 257028178 /nfs/dbraw/zinc/02/81/78/257028178.db2.gz AWRSBFAZOTUKBR-CYBMUJFWSA-N 1 1 357.357 2.588 20 5 FFBDMO C[C@H](CO)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1 ZINC000287598149 257097844 /nfs/dbraw/zinc/09/78/44/257097844.db2.gz DCFOYVUCMVWXAS-GFCCVEGCSA-N 1 1 353.394 2.688 20 5 FFBDMO CN(C(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])nc1 ZINC000288737662 257222098 /nfs/dbraw/zinc/22/20/98/257222098.db2.gz HCHZJDRACNPWTM-MRXNPFEDSA-N 1 1 354.410 2.865 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000289419096 257280032 /nfs/dbraw/zinc/28/00/32/257280032.db2.gz BSYLRKKCMAFFKJ-WMZOPIPTSA-N 1 1 359.426 2.957 20 5 FFBDMO CN1CCN(CCC[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000289417101 257280262 /nfs/dbraw/zinc/28/02/62/257280262.db2.gz IQKXKUHZWMVDFO-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO CN1CCN(CCC[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000289417101 257280263 /nfs/dbraw/zinc/28/02/63/257280263.db2.gz IQKXKUHZWMVDFO-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290799864 257358298 /nfs/dbraw/zinc/35/82/98/257358298.db2.gz DYOUNCDSXPWVDL-MRVPVSSYSA-N 1 1 355.243 2.814 20 5 FFBDMO COC(=O)c1cnc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000291058726 257378375 /nfs/dbraw/zinc/37/83/75/257378375.db2.gz FLXAJXAIFVGJJE-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000301131397 258027980 /nfs/dbraw/zinc/02/79/80/258027980.db2.gz RVPADTCFRFRUID-GASCZTMLSA-N 1 1 350.438 2.729 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000301185887 258032460 /nfs/dbraw/zinc/03/24/60/258032460.db2.gz JYWIDCQDMZQXKQ-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC1CCN(c2ccc(C)c[nH+]2)CC1 ZINC000301393237 258046977 /nfs/dbraw/zinc/04/69/77/258046977.db2.gz JACIHIWTBXGBTP-UHFFFAOYSA-N 1 1 369.425 2.739 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000302195415 258093954 /nfs/dbraw/zinc/09/39/54/258093954.db2.gz SIKKGOJPXNILNB-GOEBONIOSA-N 1 1 359.426 2.835 20 5 FFBDMO C[C@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000302480143 258103481 /nfs/dbraw/zinc/10/34/81/258103481.db2.gz GJYYEGBJRVHUBO-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1cnc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)c([N+](=O)[O-])c1 ZINC000301731033 258065553 /nfs/dbraw/zinc/06/55/53/258065553.db2.gz SLCAWAHEQKRRNU-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000330587742 258166283 /nfs/dbraw/zinc/16/62/83/258166283.db2.gz UATMFTKVUHIFKJ-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121798 258177664 /nfs/dbraw/zinc/17/76/64/258177664.db2.gz NDCWZDUMALLZAT-IYOUNJFTSA-N 1 1 363.458 2.653 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121798 258177665 /nfs/dbraw/zinc/17/76/65/258177665.db2.gz NDCWZDUMALLZAT-IYOUNJFTSA-N 1 1 363.458 2.653 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000331148485 258178280 /nfs/dbraw/zinc/17/82/80/258178280.db2.gz NYJPZXRPKVPKJU-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270756 258180851 /nfs/dbraw/zinc/18/08/51/258180851.db2.gz AROXMDPIOYREAL-UHIISALHSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270756 258180852 /nfs/dbraw/zinc/18/08/52/258180852.db2.gz AROXMDPIOYREAL-UHIISALHSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000331458506 258187011 /nfs/dbraw/zinc/18/70/11/258187011.db2.gz ARTNHMNOJJAHBU-OKILXGFUSA-N 1 1 354.410 2.821 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000331458506 258187012 /nfs/dbraw/zinc/18/70/12/258187012.db2.gz ARTNHMNOJJAHBU-OKILXGFUSA-N 1 1 354.410 2.821 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(Br)cc1[N+](=O)[O-] ZINC000332228244 258219937 /nfs/dbraw/zinc/21/99/37/258219937.db2.gz CQYPJFWXOBIUPW-OLZOCXBDSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000332520035 258233431 /nfs/dbraw/zinc/23/34/31/258233431.db2.gz LVGMIYZVOSQESX-AAEUAGOBSA-N 1 1 369.368 2.895 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000332631817 258238413 /nfs/dbraw/zinc/23/84/13/258238413.db2.gz RHBCLUWKTMOLPT-QGZVFWFLSA-N 1 1 362.474 2.899 20 5 FFBDMO Cc1cc(NCCC[NH+]2CCOCC2)c(Br)cc1[N+](=O)[O-] ZINC000235876199 509453953 /nfs/dbraw/zinc/45/39/53/509453953.db2.gz ADNJMICMVKHDJA-UHFFFAOYSA-N 1 1 358.236 2.800 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000245708363 510098074 /nfs/dbraw/zinc/09/80/74/510098074.db2.gz YRFMJEAGCWRCAT-QMTHXVAHSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1ccccc1N1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065208250 506270346 /nfs/dbraw/zinc/27/03/46/506270346.db2.gz SKRPHSUUZNNWJC-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000052862434 506268495 /nfs/dbraw/zinc/26/84/95/506268495.db2.gz WOPIYHVSKLMQPU-CQSZACIVSA-N 1 1 373.413 2.803 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000065868011 506382372 /nfs/dbraw/zinc/38/23/72/506382372.db2.gz BNRLMPJQPWGSAK-IYBDPMFKSA-N 1 1 362.474 2.881 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC000366850901 512217869 /nfs/dbraw/zinc/21/78/69/512217869.db2.gz LJCIYOQQPVLYKB-DLBZAZTESA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC000366850901 512217871 /nfs/dbraw/zinc/21/78/71/512217871.db2.gz LJCIYOQQPVLYKB-DLBZAZTESA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC000371211110 512270920 /nfs/dbraw/zinc/27/09/20/512270920.db2.gz XCMWRBGCFKQDJW-UHFFFAOYSA-N 1 1 354.410 2.646 20 5 FFBDMO CC(C)COC1CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000054326957 506539025 /nfs/dbraw/zinc/53/90/25/506539025.db2.gz UYEWHIRJBAPTGD-UHFFFAOYSA-N 1 1 361.442 2.621 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[NH+]1CCOCC1 ZINC000041935646 506569654 /nfs/dbraw/zinc/56/96/54/506569654.db2.gz HMTQLUAJSSZYRV-OAHLLOKOSA-N 1 1 374.441 2.553 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](c1ccsc1)[NH+](C)C ZINC000008896364 506672895 /nfs/dbraw/zinc/67/28/95/506672895.db2.gz BCHOMTKOSLQWIE-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000010448455 506742652 /nfs/dbraw/zinc/74/26/52/506742652.db2.gz RWUXILJSOSKYIR-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000055416300 506747152 /nfs/dbraw/zinc/74/71/52/506747152.db2.gz PLFSVVVUOKELRB-MRXNPFEDSA-N 1 1 363.461 2.755 20 5 FFBDMO COc1ccc(CC(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000067911400 507049731 /nfs/dbraw/zinc/04/97/31/507049731.db2.gz LITIUQKIWQQVPY-QLFBSQMISA-N 1 1 363.458 2.629 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000375435102 512325603 /nfs/dbraw/zinc/32/56/03/512325603.db2.gz WXWIWAJAHLQZAE-ZDUSSCGKSA-N 1 1 371.397 2.673 20 5 FFBDMO Cc1c(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000057778239 507327172 /nfs/dbraw/zinc/32/71/72/507327172.db2.gz KNEWBWLRIGAMLI-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO C[C@@H](CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000069066680 507395552 /nfs/dbraw/zinc/39/55/52/507395552.db2.gz BPVXPQAVXJYHPG-CABCVRRESA-N 1 1 364.446 2.536 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000060330694 507524516 /nfs/dbraw/zinc/52/45/16/507524516.db2.gz UVLPOCFGPHJDFM-KRWDZBQOSA-N 1 1 369.487 2.669 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1cccs1 ZINC000026923702 507622987 /nfs/dbraw/zinc/62/29/87/507622987.db2.gz CRWWMJQISREZTJ-UHFFFAOYSA-N 1 1 363.395 2.846 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)Cc1cccs1 ZINC000026923702 507622995 /nfs/dbraw/zinc/62/29/95/507622995.db2.gz CRWWMJQISREZTJ-UHFFFAOYSA-N 1 1 363.395 2.846 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000028049776 507706419 /nfs/dbraw/zinc/70/64/19/507706419.db2.gz HREXRKGPRJYEMP-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1C ZINC000071808485 507717947 /nfs/dbraw/zinc/71/79/47/507717947.db2.gz VRXICQHTDYHPEG-AWEZNQCLSA-N 1 1 369.487 2.754 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000063831357 507774447 /nfs/dbraw/zinc/77/44/47/507774447.db2.gz VQPLFRWZXGNCCV-BETUJISGSA-N 1 1 366.437 2.804 20 5 FFBDMO CCC[NH+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000073460758 507922777 /nfs/dbraw/zinc/92/27/77/507922777.db2.gz KMEAEGOHEFTEMB-UHFFFAOYSA-N 1 1 363.461 2.709 20 5 FFBDMO COc1ccc(Cl)cc1C[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090511193 507924353 /nfs/dbraw/zinc/92/43/53/507924353.db2.gz IXFANDAOQGSERD-UHFFFAOYSA-N 1 1 351.790 2.551 20 5 FFBDMO COc1ccc(Cl)cc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090511193 507924355 /nfs/dbraw/zinc/92/43/55/507924355.db2.gz IXFANDAOQGSERD-UHFFFAOYSA-N 1 1 351.790 2.551 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCCC2 ZINC000090550704 507926900 /nfs/dbraw/zinc/92/69/00/507926900.db2.gz ZBNMUCQQFWEKKQ-DLBZAZTESA-N 1 1 363.458 2.816 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000079757878 507998864 /nfs/dbraw/zinc/99/88/64/507998864.db2.gz VKAQYCCOJZBQJB-UHFFFAOYSA-N 1 1 362.474 2.610 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000074325538 508012936 /nfs/dbraw/zinc/01/29/36/508012936.db2.gz ZPGNZLZOYAXUCQ-CQSZACIVSA-N 1 1 356.426 2.880 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000079945114 508017661 /nfs/dbraw/zinc/01/76/61/508017661.db2.gz NHQZZPYMXFUOGZ-ZBFHGGJFSA-N 1 1 368.437 2.960 20 5 FFBDMO CN(CC(=O)N1CC[N@H+](C)Cc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000080029351 508028225 /nfs/dbraw/zinc/02/82/25/508028225.db2.gz QIYTVOSYEMZSNB-UHFFFAOYSA-N 1 1 354.410 2.510 20 5 FFBDMO CN(CC(=O)N1CC[N@@H+](C)Cc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000080029351 508028229 /nfs/dbraw/zinc/02/82/29/508028229.db2.gz QIYTVOSYEMZSNB-UHFFFAOYSA-N 1 1 354.410 2.510 20 5 FFBDMO CCCNC(=O)C[N@@H+](CCC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092191970 508049470 /nfs/dbraw/zinc/04/94/70/508049470.db2.gz PZWZSVVTIDFFKU-UHFFFAOYSA-N 1 1 373.457 2.734 20 5 FFBDMO CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074775071 508054172 /nfs/dbraw/zinc/05/41/72/508054172.db2.gz MMQQMEHXGKMFDR-KRWDZBQOSA-N 1 1 368.437 2.795 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCC[NH+]1CCN(c2ccc(F)cc2)CC1 ZINC000111176645 508075695 /nfs/dbraw/zinc/07/56/95/508075695.db2.gz PFEMOROBAWOVCO-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000080718446 508097915 /nfs/dbraw/zinc/09/79/15/508097915.db2.gz VDOIUGSWLVUAPK-AGUYFDCRSA-N 1 1 351.834 2.922 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](CO)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000092764915 508100372 /nfs/dbraw/zinc/10/03/72/508100372.db2.gz HHUYBVRPIQOPNP-QGZVFWFLSA-N 1 1 372.421 2.997 20 5 FFBDMO CCOc1cc(N2CCN(C[C@H]3CCCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000080788487 508103557 /nfs/dbraw/zinc/10/35/57/508103557.db2.gz JAOCFEXNMOGLOU-QGZVFWFLSA-N 1 1 362.474 2.600 20 5 FFBDMO COc1cc[nH+]c(N2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000093078917 508119339 /nfs/dbraw/zinc/11/93/39/508119339.db2.gz MEZGZCQXSBCJCK-GQCTYLIASA-N 1 1 354.410 2.834 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000081095871 508137329 /nfs/dbraw/zinc/13/73/29/508137329.db2.gz QZEDUSYWWSDMSM-QAPCUYQASA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000081095871 508137330 /nfs/dbraw/zinc/13/73/30/508137330.db2.gz QZEDUSYWWSDMSM-QAPCUYQASA-N 1 1 362.474 2.894 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000075953889 508146263 /nfs/dbraw/zinc/14/62/63/508146263.db2.gz AFUIPZWOOPQXQM-OAHLLOKOSA-N 1 1 352.431 2.867 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000081289730 508155920 /nfs/dbraw/zinc/15/59/20/508155920.db2.gz HAWRPXOEFJOORS-INIZCTEOSA-N 1 1 361.442 2.988 20 5 FFBDMO O=C(NCC1(C[NH+]2CCOCC2)CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000081666828 508203442 /nfs/dbraw/zinc/20/34/42/508203442.db2.gz PDVXJZNJUDFOHY-UHFFFAOYSA-N 1 1 361.442 2.607 20 5 FFBDMO C[N@H+](CCCC(=O)OC(C)(C)C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000076416357 508203614 /nfs/dbraw/zinc/20/36/14/508203614.db2.gz JFRDYJHUPNQNRY-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO C[N@@H+](CCCC(=O)OC(C)(C)C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000076416357 508203617 /nfs/dbraw/zinc/20/36/17/508203617.db2.gz JFRDYJHUPNQNRY-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000112700821 508211521 /nfs/dbraw/zinc/21/15/21/508211521.db2.gz MNMSDAWCRAQOMF-AWEZNQCLSA-N 1 1 363.458 2.978 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000112700821 508211524 /nfs/dbraw/zinc/21/15/24/508211524.db2.gz MNMSDAWCRAQOMF-AWEZNQCLSA-N 1 1 363.458 2.978 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC(C)(C)C1 ZINC000083415231 508245335 /nfs/dbraw/zinc/24/53/35/508245335.db2.gz CTMZIOWRJPSHFI-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187160 508298225 /nfs/dbraw/zinc/29/82/25/508298225.db2.gz CVHYOQCKZKKPMY-UKRRQHHQSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187160 508298226 /nfs/dbraw/zinc/29/82/26/508298226.db2.gz CVHYOQCKZKKPMY-UKRRQHHQSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000087496381 508354054 /nfs/dbraw/zinc/35/40/54/508354054.db2.gz JBERROLAONFJBL-IYBDPMFKSA-N 1 1 363.458 2.533 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000133527211 508412088 /nfs/dbraw/zinc/41/20/88/508412088.db2.gz LZIJCKFZHPBJIU-GXTWGEPZSA-N 1 1 369.425 2.596 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@H]1C ZINC000133563647 508416672 /nfs/dbraw/zinc/41/66/72/508416672.db2.gz CIMDWRUNRRLFTO-ZIAGYGMSSA-N 1 1 351.447 2.663 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000127319335 508431909 /nfs/dbraw/zinc/43/19/09/508431909.db2.gz ZINRTXZBPSFAJB-CRAIPNDOSA-N 1 1 362.474 2.976 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC1 ZINC000127402292 508445001 /nfs/dbraw/zinc/44/50/01/508445001.db2.gz OOASLWPSOFNHEH-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO CCC[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1CCOC ZINC000122011992 508467036 /nfs/dbraw/zinc/46/70/36/508467036.db2.gz SPBRAPWZEXDHJT-HNNXBMFYSA-N 1 1 362.430 2.669 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153293796 508569247 /nfs/dbraw/zinc/56/92/47/508569247.db2.gz SIFUCHCSLNGXQY-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153293796 508569251 /nfs/dbraw/zinc/56/92/51/508569251.db2.gz SIFUCHCSLNGXQY-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341321 508593796 /nfs/dbraw/zinc/59/37/96/508593796.db2.gz LOERFPSHDCWJEX-ZBFHGGJFSA-N 1 1 363.414 2.518 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 ZINC000369429768 512406398 /nfs/dbraw/zinc/40/63/98/512406398.db2.gz WVGOXLDWHNGKMD-UHFFFAOYSA-N 1 1 357.414 2.643 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000157949342 508637373 /nfs/dbraw/zinc/63/73/73/508637373.db2.gz BTWZYBHJQSBTGR-CQSZACIVSA-N 1 1 355.394 2.692 20 5 FFBDMO CCOc1ccc([C@@H](C)NCC2([NH+](C)C)CCOCC2)cc1[N+](=O)[O-] ZINC000153791606 508650272 /nfs/dbraw/zinc/65/02/72/508650272.db2.gz HAINLLYLQYPQJE-CQSZACIVSA-N 1 1 351.447 2.755 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000123238603 508657430 /nfs/dbraw/zinc/65/74/30/508657430.db2.gz SUEZHBREQWWZIU-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCC[C@@H](C)C1 ZINC000135996989 508664251 /nfs/dbraw/zinc/66/42/51/508664251.db2.gz WCTKIDTYRPHQQP-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[NH+](C2CCCCC2)CC1 ZINC000123288967 508664306 /nfs/dbraw/zinc/66/43/06/508664306.db2.gz CUFPVOITZMDLSL-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000137507079 508758732 /nfs/dbraw/zinc/75/87/32/508758732.db2.gz QWMWUBHEIMJBLQ-ZFWWWQNUSA-N 1 1 371.441 2.663 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)c1 ZINC000154341365 508764251 /nfs/dbraw/zinc/76/42/51/508764251.db2.gz JVBWWCKRJGBNPS-RDJZCZTQSA-N 1 1 367.409 2.551 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nncn2C2CC2)C1 ZINC000159061761 508787263 /nfs/dbraw/zinc/78/72/63/508787263.db2.gz NFWAHCBLGPBSDD-ZDUSSCGKSA-N 1 1 357.414 2.909 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000141721198 508817851 /nfs/dbraw/zinc/81/78/51/508817851.db2.gz LPEWRNIRZDHQQR-UHFFFAOYSA-N 1 1 357.410 2.742 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000131015233 508877159 /nfs/dbraw/zinc/87/71/59/508877159.db2.gz ZBKLMVOUAZCLMS-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000131015233 508877161 /nfs/dbraw/zinc/87/71/61/508877161.db2.gz ZBKLMVOUAZCLMS-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000120040868 508915687 /nfs/dbraw/zinc/91/56/87/508915687.db2.gz UJIRKVKBEZNBIC-QGZVFWFLSA-N 1 1 364.446 2.690 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000120208447 508950742 /nfs/dbraw/zinc/95/07/42/508950742.db2.gz CUWYJEIZQZVJPM-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000120208447 508950745 /nfs/dbraw/zinc/95/07/45/508950745.db2.gz CUWYJEIZQZVJPM-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125307606 508963477 /nfs/dbraw/zinc/96/34/77/508963477.db2.gz VITWQEXIQBCVHF-HUUCEWRRSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000125405473 508978010 /nfs/dbraw/zinc/97/80/10/508978010.db2.gz QOEUPOVYGDYECB-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000125405473 508978014 /nfs/dbraw/zinc/97/80/14/508978014.db2.gz QOEUPOVYGDYECB-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515469 509011779 /nfs/dbraw/zinc/01/17/79/509011779.db2.gz IARRHHKZARUBIN-HZPDHXFCSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515469 509011781 /nfs/dbraw/zinc/01/17/81/509011781.db2.gz IARRHHKZARUBIN-HZPDHXFCSA-N 1 1 365.430 2.677 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000132320397 509014774 /nfs/dbraw/zinc/01/47/74/509014774.db2.gz XMZNIQXGMGRPNN-GFCCVEGCSA-N 1 1 367.471 2.546 20 5 FFBDMO C[C@]1(CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCC[N@H+]1Cc1ccccc1 ZINC000160795033 509034080 /nfs/dbraw/zinc/03/40/80/509034080.db2.gz ITSUQWHOMYRWGE-LJQANCHMSA-N 1 1 369.425 2.555 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)cc1SC ZINC000120649258 509038258 /nfs/dbraw/zinc/03/82/58/509038258.db2.gz NZLISILUGQDXEJ-YPMHNXCESA-N 1 1 367.471 2.738 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000263846379 509182853 /nfs/dbraw/zinc/18/28/53/509182853.db2.gz XIIANHNCOMBFEI-GASCZTMLSA-N 1 1 361.442 2.556 20 5 FFBDMO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000185475185 509194281 /nfs/dbraw/zinc/19/42/81/509194281.db2.gz SBGCOJLHTJGJSB-AWEZNQCLSA-N 1 1 353.382 2.905 20 5 FFBDMO CC(C)(C)OC1CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000162506759 509238806 /nfs/dbraw/zinc/23/88/06/509238806.db2.gz CWBABVHYCYRTSX-UHFFFAOYSA-N 1 1 361.442 2.763 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@@H]21 ZINC000182476634 509259136 /nfs/dbraw/zinc/25/91/36/509259136.db2.gz WDZDIJRSIPTQOP-FZMZJTMJSA-N 1 1 369.368 2.753 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000172957694 509323411 /nfs/dbraw/zinc/32/34/11/509323411.db2.gz WQEJFXRUMGMPMG-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000185948315 509442552 /nfs/dbraw/zinc/44/25/52/509442552.db2.gz GCQYBJXYJDXULF-KBMXLJTQSA-N 1 1 364.446 2.766 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000185948315 509442558 /nfs/dbraw/zinc/44/25/58/509442558.db2.gz GCQYBJXYJDXULF-KBMXLJTQSA-N 1 1 364.446 2.766 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH+](C2CCCCC2)CC1 ZINC000173185381 509443920 /nfs/dbraw/zinc/44/39/20/509443920.db2.gz LNBGIGBIQDMUQC-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000248950488 509552737 /nfs/dbraw/zinc/55/27/37/509552737.db2.gz ZTLHAKWTCNYICR-CRAIPNDOSA-N 1 1 368.437 2.643 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC[N@H+]1C[C@H](C)O ZINC000249063842 509588805 /nfs/dbraw/zinc/58/88/05/509588805.db2.gz JYMLAMBSZSCVLZ-LSDHHAIUSA-N 1 1 364.446 2.521 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000192707256 509606054 /nfs/dbraw/zinc/60/60/54/509606054.db2.gz GDCVIDAGSXVTIP-QGZVFWFLSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1 ZINC000176740751 509666832 /nfs/dbraw/zinc/66/68/32/509666832.db2.gz QBBMPLIVVWBGDA-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC[C@]1(CO)CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000189689227 509704038 /nfs/dbraw/zinc/70/40/38/509704038.db2.gz HFVQFQWJZWGBNK-MRXNPFEDSA-N 1 1 360.357 2.942 20 5 FFBDMO Cn1cc(C[NH2+]Cc2nccn2C(F)F)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237667826 509707428 /nfs/dbraw/zinc/70/74/28/509707428.db2.gz DYHMLDZSSXAJKW-UHFFFAOYSA-N 1 1 362.340 2.877 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058742 509729498 /nfs/dbraw/zinc/72/94/98/509729498.db2.gz JDTOHROUYBIIBZ-YPMHNXCESA-N 1 1 374.384 2.983 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268045688 509733667 /nfs/dbraw/zinc/73/36/67/509733667.db2.gz ZKIQKUSCJINTAH-KOLCDFICSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000186586894 509788548 /nfs/dbraw/zinc/78/85/48/509788548.db2.gz KHGUZKPBQCCCEC-NLWGTHIKSA-N 1 1 374.529 2.922 20 5 FFBDMO CC(C)(O)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000180238687 509827902 /nfs/dbraw/zinc/82/79/02/509827902.db2.gz SVURFJBYKWGCTQ-UHFFFAOYSA-N 1 1 357.410 2.806 20 5 FFBDMO CC(C)(O)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000180238687 509827906 /nfs/dbraw/zinc/82/79/06/509827906.db2.gz SVURFJBYKWGCTQ-UHFFFAOYSA-N 1 1 357.410 2.806 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183583669 509871358 /nfs/dbraw/zinc/87/13/58/509871358.db2.gz ZVTMLWYAYCCLNY-INIZCTEOSA-N 1 1 369.425 2.976 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[N@H+]1C1CC1 ZINC000177154076 509905464 /nfs/dbraw/zinc/90/54/64/509905464.db2.gz OPHPKQDLLZYTGE-HOCLYGCPSA-N 1 1 372.469 2.553 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000174215404 510007652 /nfs/dbraw/zinc/00/76/52/510007652.db2.gz BVXBWGRBPRJSNE-WBVHZDCISA-N 1 1 360.458 2.789 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193814099 510083980 /nfs/dbraw/zinc/08/39/80/510083980.db2.gz SAVHHTCFTAPTER-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000245731908 510113308 /nfs/dbraw/zinc/11/33/08/510113308.db2.gz YXIPDVNOKWTSOC-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCCNc1ccc(C)c[nH+]1 ZINC000193947058 510143212 /nfs/dbraw/zinc/14/32/12/510143212.db2.gz IWGGHKDCTQHMMB-UHFFFAOYSA-N 1 1 373.413 2.608 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000174513359 510151286 /nfs/dbraw/zinc/15/12/86/510151286.db2.gz UVTHSBHAPCDMCB-LBPRGKRZSA-N 1 1 367.471 2.739 20 5 FFBDMO COc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000262087192 510173925 /nfs/dbraw/zinc/17/39/25/510173925.db2.gz YDGRQLQGILEMNN-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO Cc1nn(C)c(C(=O)N[C@@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000187322020 510192580 /nfs/dbraw/zinc/19/25/80/510192580.db2.gz PVTCVMMPFWPCPE-INIZCTEOSA-N 1 1 373.457 2.523 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)cs1 ZINC000265760791 510215609 /nfs/dbraw/zinc/21/56/09/510215609.db2.gz JUECEDWMOBRPBH-DLBZAZTESA-N 1 1 361.467 2.629 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000184259306 510224563 /nfs/dbraw/zinc/22/45/63/510224563.db2.gz BZPRIWUVWVLTRB-CQSZACIVSA-N 1 1 369.487 2.525 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000174656442 510234759 /nfs/dbraw/zinc/23/47/59/510234759.db2.gz PLTKNPCMPAICDA-UHFFFAOYSA-N 1 1 362.474 2.659 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000245977299 510235171 /nfs/dbraw/zinc/23/51/71/510235171.db2.gz GLSJGDKHDNTIKG-SWLSCSKDSA-N 1 1 350.419 2.797 20 5 FFBDMO COc1ccc([C@@H]2CCCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000174709239 510263397 /nfs/dbraw/zinc/26/33/97/510263397.db2.gz VNMKFJPFVAOCNP-HKUYNNGSSA-N 1 1 374.441 2.778 20 5 FFBDMO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269284743 510324638 /nfs/dbraw/zinc/32/46/38/510324638.db2.gz NBMZCIVBYCGQNZ-INIZCTEOSA-N 1 1 369.421 2.895 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269284743 510324643 /nfs/dbraw/zinc/32/46/43/510324643.db2.gz NBMZCIVBYCGQNZ-INIZCTEOSA-N 1 1 369.421 2.895 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000246212814 510367317 /nfs/dbraw/zinc/36/73/17/510367317.db2.gz NXQKHHPYRQLGOP-HIFRSBDPSA-N 1 1 371.224 2.688 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)C[C@H]2C)cc1[N+](=O)[O-] ZINC000190988641 510453869 /nfs/dbraw/zinc/45/38/69/510453869.db2.gz NDRFLMJSXHGZRL-CQSZACIVSA-N 1 1 363.458 2.635 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000184731717 510489849 /nfs/dbraw/zinc/48/98/49/510489849.db2.gz CMSASHSHISKQKJ-AWEZNQCLSA-N 1 1 374.441 2.800 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181679736 510536048 /nfs/dbraw/zinc/53/60/48/510536048.db2.gz REVOTNQRWSFJCU-ZIAGYGMSSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181680532 510537939 /nfs/dbraw/zinc/53/79/39/510537939.db2.gz MPPLLRGRYPPENR-LSDHHAIUSA-N 1 1 361.442 2.743 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181775844 510586152 /nfs/dbraw/zinc/58/61/52/510586152.db2.gz JSCIYEDBWYWFGM-LBPRGKRZSA-N 1 1 357.357 2.800 20 5 FFBDMO CCC1(O)CC[NH+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000266603948 510683933 /nfs/dbraw/zinc/68/39/33/510683933.db2.gz SIPUGRPXHYIEOJ-UHFFFAOYSA-N 1 1 360.357 2.942 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2ccc([S@](C)=O)cc2)c([N+](=O)[O-])cc1O ZINC000270126558 510685994 /nfs/dbraw/zinc/68/59/94/510685994.db2.gz PAIZAILWGXYXKP-FTJNGKRUSA-N 1 1 364.423 2.897 20 5 FFBDMO COC(=O)c1ccc(F)c(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000182006469 510702610 /nfs/dbraw/zinc/70/26/10/510702610.db2.gz CYYRNNABRRJPLU-CQSZACIVSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(F)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000182006469 510702615 /nfs/dbraw/zinc/70/26/15/510702615.db2.gz CYYRNNABRRJPLU-CQSZACIVSA-N 1 1 374.372 2.602 20 5 FFBDMO CN(Cc1csc([N+](=O)[O-])c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188322945 510709015 /nfs/dbraw/zinc/70/90/15/510709015.db2.gz DFAKYJLRNJINMY-GOSISDBHSA-N 1 1 361.467 2.725 20 5 FFBDMO CS[C@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182223219 510822146 /nfs/dbraw/zinc/82/21/46/510822146.db2.gz QCGQEDRJRBZZKN-AWEZNQCLSA-N 1 1 358.485 2.586 20 5 FFBDMO CS[C@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182223219 510822141 /nfs/dbraw/zinc/82/21/41/510822141.db2.gz QCGQEDRJRBZZKN-AWEZNQCLSA-N 1 1 358.485 2.586 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000185422052 510840922 /nfs/dbraw/zinc/84/09/22/510840922.db2.gz ZDBBRSPCMYJARD-DYVFJYSZSA-N 1 1 354.410 2.626 20 5 FFBDMO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000247531757 510864752 /nfs/dbraw/zinc/86/47/52/510864752.db2.gz OGSLSUSBVGTMMU-UNEWFSDZSA-N 1 1 362.430 2.781 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000293927704 510901658 /nfs/dbraw/zinc/90/16/58/510901658.db2.gz QEAPJKNIYBVZHS-OAHLLOKOSA-N 1 1 357.332 2.781 20 5 FFBDMO CO[C@H](C)C[N@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000285451494 510911472 /nfs/dbraw/zinc/91/14/72/510911472.db2.gz ABFOPFLQVLZHBR-LLVKDONJSA-N 1 1 364.427 2.624 20 5 FFBDMO CO[C@H](C)C[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000285451494 510911474 /nfs/dbraw/zinc/91/14/74/510911474.db2.gz ABFOPFLQVLZHBR-LLVKDONJSA-N 1 1 364.427 2.624 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000275733806 510912753 /nfs/dbraw/zinc/91/27/53/510912753.db2.gz WCOXJFKLWMJHKG-UHFFFAOYSA-N 1 1 367.449 2.792 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000285461695 510915189 /nfs/dbraw/zinc/91/51/89/510915189.db2.gz ZHUNNOVILNZVHJ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000285461695 510915192 /nfs/dbraw/zinc/91/51/92/510915192.db2.gz ZHUNNOVILNZVHJ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1 ZINC000277737116 510970578 /nfs/dbraw/zinc/97/05/78/510970578.db2.gz KLKWETBLMHHZSK-SWLSCSKDSA-N 1 1 362.348 2.999 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000282611054 511045315 /nfs/dbraw/zinc/04/53/15/511045315.db2.gz YURRNUVZUBEMKL-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO C[C@H]([NH2+]Cc1ccncc1OC[C@@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294457270 511071487 /nfs/dbraw/zinc/07/14/87/511071487.db2.gz VYVKJCRCVGZMRT-UONOGXRCSA-N 1 1 372.425 2.838 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)N1CCN(C)CC1 ZINC000271135024 511094008 /nfs/dbraw/zinc/09/40/08/511094008.db2.gz MSXQGCZLWXDQID-HZPDHXFCSA-N 1 1 366.531 2.691 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294596790 511115191 /nfs/dbraw/zinc/11/51/91/511115191.db2.gz USMIWNPTJFFRPA-NWDGAFQWSA-N 1 1 353.394 2.593 20 5 FFBDMO CC(C)(CCC(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1)[N+](=O)[O-] ZINC000294633640 511126908 /nfs/dbraw/zinc/12/69/08/511126908.db2.gz SLEJLTOSZGXRRY-UHFFFAOYSA-N 1 1 361.486 2.989 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000279726325 511191090 /nfs/dbraw/zinc/19/10/90/511191090.db2.gz JEINTXLOAHJMIE-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000279726326 511191243 /nfs/dbraw/zinc/19/12/43/511191243.db2.gz JEINTXLOAHJMIE-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1cc(C[NH2+]Cc2cnc(OC)c(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000295114224 511287883 /nfs/dbraw/zinc/28/78/83/511287883.db2.gz WLLLJJRMIOGSNY-UHFFFAOYSA-N 1 1 367.789 2.959 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000295140369 511296445 /nfs/dbraw/zinc/29/64/45/511296445.db2.gz OLZADTSOGNCDQA-GXSJLCMTSA-N 1 1 357.332 2.969 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000363026743 511305871 /nfs/dbraw/zinc/30/58/71/511305871.db2.gz MPRFWZOOZVMRJA-CABCVRRESA-N 1 1 358.442 2.552 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295237868 511332509 /nfs/dbraw/zinc/33/25/09/511332509.db2.gz ZXCGTEABBPGYAX-RNCFNFMXSA-N 1 1 357.332 2.826 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291908844 511386774 /nfs/dbraw/zinc/38/67/74/511386774.db2.gz RQJZYRDWGOFRBF-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291908844 511386779 /nfs/dbraw/zinc/38/67/79/511386779.db2.gz RQJZYRDWGOFRBF-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCC[C@](C)(OC)CC1 ZINC000280250668 511391494 /nfs/dbraw/zinc/39/14/94/511391494.db2.gz BMGCQFQEQHZNGD-ACJLOTCBSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1CSC ZINC000298738811 511394187 /nfs/dbraw/zinc/39/41/87/511394187.db2.gz VTCITBLYJYGRGU-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000271999012 511395507 /nfs/dbraw/zinc/39/55/07/511395507.db2.gz GYKDOYSOGHORDV-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000271999012 511395513 /nfs/dbraw/zinc/39/55/13/511395513.db2.gz GYKDOYSOGHORDV-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cn2c(n1)CCCC2 ZINC000365404875 511431042 /nfs/dbraw/zinc/43/10/42/511431042.db2.gz QOOWWZRCZXTNQU-UHFFFAOYSA-N 1 1 357.414 2.588 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cn2c(n1)CCCC2 ZINC000365404875 511431046 /nfs/dbraw/zinc/43/10/46/511431046.db2.gz QOOWWZRCZXTNQU-UHFFFAOYSA-N 1 1 357.414 2.588 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000334042138 511435303 /nfs/dbraw/zinc/43/53/03/511435303.db2.gz GXXHGVMEUPLHPR-UWVGGRQHSA-N 1 1 356.220 2.570 20 5 FFBDMO O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CCC[N@H+](C2CCCC2)CC1 ZINC000363238535 511436440 /nfs/dbraw/zinc/43/64/40/511436440.db2.gz FXQXEGXGDFLBDS-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000363238535 511436443 /nfs/dbraw/zinc/43/64/43/511436443.db2.gz FXQXEGXGDFLBDS-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[N@H+](C2CCCC2)CC1 ZINC000363238535 511436448 /nfs/dbraw/zinc/43/64/48/511436448.db2.gz FXQXEGXGDFLBDS-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272234593 511473892 /nfs/dbraw/zinc/47/38/92/511473892.db2.gz FKJJGNRKFGTEHT-RHSMWYFYSA-N 1 1 368.437 2.817 20 5 FFBDMO O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc2ccccc2c2cccnc12 ZINC000363377101 511512584 /nfs/dbraw/zinc/51/25/84/511512584.db2.gz WRKNZRAVCLNKJA-SJORKVTESA-N 1 1 361.445 2.981 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194953 511547715 /nfs/dbraw/zinc/54/77/15/511547715.db2.gz MHHUBJVFHCIQHU-BFYDXBDKSA-N 1 1 361.442 2.617 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNC(=O)c3ccccc3[N+](=O)[O-])c2)CCO1 ZINC000299203975 511551370 /nfs/dbraw/zinc/55/13/70/511551370.db2.gz AVXTYBKSMLTUIH-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)c3ccccc3[N+](=O)[O-])c2)CCO1 ZINC000299203975 511551375 /nfs/dbraw/zinc/55/13/75/511551375.db2.gz AVXTYBKSMLTUIH-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000365856523 511689833 /nfs/dbraw/zinc/68/98/33/511689833.db2.gz JHKNLMKOJCIUIJ-KRWDZBQOSA-N 1 1 372.368 2.594 20 5 FFBDMO COc1cc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000292699446 511691015 /nfs/dbraw/zinc/69/10/15/511691015.db2.gz CDYPFSSHCZMENS-OAHLLOKOSA-N 1 1 350.415 2.861 20 5 FFBDMO COc1cc(C[N@H+]2CCOC[C@H](C3CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000292699446 511691019 /nfs/dbraw/zinc/69/10/19/511691019.db2.gz CDYPFSSHCZMENS-OAHLLOKOSA-N 1 1 350.415 2.861 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000281025127 511693682 /nfs/dbraw/zinc/69/36/82/511693682.db2.gz UOVWYGYWXJTYBO-AWEZNQCLSA-N 1 1 366.421 2.871 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)nc1 ZINC000274044793 511703667 /nfs/dbraw/zinc/70/36/67/511703667.db2.gz YDLIHYLRKMPFIM-WMZOPIPTSA-N 1 1 353.426 2.876 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCn3cc[nH+]c3C2)n1 ZINC000350057282 511710793 /nfs/dbraw/zinc/71/07/93/511710793.db2.gz MHGCNBHXJZBYGR-LBPRGKRZSA-N 1 1 354.370 2.559 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000365926013 511731681 /nfs/dbraw/zinc/73/16/81/511731681.db2.gz ZPVRKVVREDJLML-LLVKDONJSA-N 1 1 369.385 2.704 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCN(C)c1ccccc1 ZINC000303333773 511735319 /nfs/dbraw/zinc/73/53/19/511735319.db2.gz WZFVMOVJNDXRMZ-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303333773 511735320 /nfs/dbraw/zinc/73/53/20/511735320.db2.gz WZFVMOVJNDXRMZ-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000303653305 511746120 /nfs/dbraw/zinc/74/61/20/511746120.db2.gz XLCQQALHLURLON-GJZGRUSLSA-N 1 1 362.474 2.759 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000281180430 511749312 /nfs/dbraw/zinc/74/93/12/511749312.db2.gz QUBBSDCGTJHGGV-APWZRJJASA-N 1 1 369.421 2.613 20 5 FFBDMO COc1cccc(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)c1[N+](=O)[O-] ZINC000350346475 511785193 /nfs/dbraw/zinc/78/51/93/511785193.db2.gz ARINAHLAGUCPHW-DYVFJYSZSA-N 1 1 360.370 2.579 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)C[C@H]21 ZINC000284797609 511873589 /nfs/dbraw/zinc/87/35/89/511873589.db2.gz OITJSTREGISUNN-RTBURBONSA-N 1 1 364.445 2.851 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CCc4[nH+]ccn4C3)n2)c1 ZINC000350898521 511903902 /nfs/dbraw/zinc/90/39/02/511903902.db2.gz ILCLIKGYFJWCCZ-NSHDSACASA-N 1 1 355.354 2.504 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H](C[N@@H+](C)CC)C1 ZINC000281949061 512022565 /nfs/dbraw/zinc/02/25/65/512022565.db2.gz MBAULVMTEGFRMG-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCO[C@]4(CCCOC4)C3)o2)c1 ZINC000285274021 512060907 /nfs/dbraw/zinc/06/09/07/512060907.db2.gz IWHBHCRDXPORGI-LJQANCHMSA-N 1 1 373.409 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](c4ccncn4)C3)n2)cc1 ZINC000364358015 512098814 /nfs/dbraw/zinc/09/88/14/512098814.db2.gz HUSYJPHSSWWRGI-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](c4ccncn4)C3)n2)cc1 ZINC000364358015 512098817 /nfs/dbraw/zinc/09/88/17/512098817.db2.gz HUSYJPHSSWWRGI-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000369662404 512541786 /nfs/dbraw/zinc/54/17/86/512541786.db2.gz HMJLMQBJLYXBBZ-MRXNPFEDSA-N 1 1 363.458 2.549 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000411283471 512561743 /nfs/dbraw/zinc/56/17/43/512561743.db2.gz YWDDEOAGNFFLQC-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO O=C(CC[N@H+](CCO)[C@@H]1CCc2ccccc21)Nc1ccc([N+](=O)[O-])cc1 ZINC000411339359 512587457 /nfs/dbraw/zinc/58/74/57/512587457.db2.gz YUDJNXRRGHBEKT-LJQANCHMSA-N 1 1 369.421 2.905 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)c([N+](=O)[O-])cc1F ZINC000372009630 512677328 /nfs/dbraw/zinc/67/73/28/512677328.db2.gz LCBLZWIOZZYHMI-CYBMUJFWSA-N 1 1 368.405 2.760 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCCC[C@H]2CCO)c([N+](=O)[O-])c1 ZINC000411697888 512766407 /nfs/dbraw/zinc/76/64/07/512766407.db2.gz LJMXTRXEYFDYGI-AWEZNQCLSA-N 1 1 365.430 2.559 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000368074647 512790657 /nfs/dbraw/zinc/79/06/57/512790657.db2.gz OQGBKEDJBPOFLB-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000368074647 512790662 /nfs/dbraw/zinc/79/06/62/512790662.db2.gz OQGBKEDJBPOFLB-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000376421403 512811909 /nfs/dbraw/zinc/81/19/09/512811909.db2.gz NZSCBRMWDKXANX-UHFFFAOYSA-N 1 1 357.414 2.512 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000378563071 512825504 /nfs/dbraw/zinc/82/55/04/512825504.db2.gz RPNPHXGVQGCEDT-KBAYOESNSA-N 1 1 355.442 2.634 20 5 FFBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000378639137 512860830 /nfs/dbraw/zinc/86/08/30/512860830.db2.gz DPBGPSSFWATKAO-KDOFPFPSSA-N 1 1 357.410 2.848 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)c1 ZINC000374531875 512876667 /nfs/dbraw/zinc/87/66/67/512876667.db2.gz SXXDQKHSZOELGS-VQTJNVASSA-N 1 1 356.422 2.654 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411932529 512878610 /nfs/dbraw/zinc/87/86/10/512878610.db2.gz GAEJBUROQPVAKG-ROUUACIJSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411932528 512878784 /nfs/dbraw/zinc/87/87/84/512878784.db2.gz GAEJBUROQPVAKG-QZTJIDSGSA-N 1 1 355.394 2.731 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000383835700 512881926 /nfs/dbraw/zinc/88/19/26/512881926.db2.gz SXBJJCHULPGTKW-MLGOLLRUSA-N 1 1 372.400 2.709 20 5 FFBDMO Cc1ccnc(C2CC[NH+]([C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000368328503 512901706 /nfs/dbraw/zinc/90/17/06/512901706.db2.gz PQDSZFBZROUNQP-CQSZACIVSA-N 1 1 369.425 2.900 20 5 FFBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000412017526 512913223 /nfs/dbraw/zinc/91/32/23/512913223.db2.gz ZVXFYNROHFGSCH-IPMKNSEASA-N 1 1 358.442 2.810 20 5 FFBDMO CN(C)c1noc([C@@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1 ZINC000374640215 512932228 /nfs/dbraw/zinc/93/22/28/512932228.db2.gz YWSKANBNEHHGDG-LLVKDONJSA-N 1 1 372.385 2.565 20 5 FFBDMO CN(C)c1noc([C@@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1 ZINC000374640215 512932231 /nfs/dbraw/zinc/93/22/31/512932231.db2.gz YWSKANBNEHHGDG-LLVKDONJSA-N 1 1 372.385 2.565 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062527 512938867 /nfs/dbraw/zinc/93/88/67/512938867.db2.gz ASDYPLZYKSHJOQ-GHMZBOCLSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062527 512938874 /nfs/dbraw/zinc/93/88/74/512938874.db2.gz ASDYPLZYKSHJOQ-GHMZBOCLSA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1C ZINC000408069486 512993470 /nfs/dbraw/zinc/99/34/70/512993470.db2.gz BVICIIPKITXWPG-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000408069486 512993473 /nfs/dbraw/zinc/99/34/73/512993473.db2.gz BVICIIPKITXWPG-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1c(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000370603889 513013242 /nfs/dbraw/zinc/01/32/42/513013242.db2.gz WSIKDRWYLGUEIK-CYBMUJFWSA-N 1 1 362.430 2.620 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000368610445 513024034 /nfs/dbraw/zinc/02/40/34/513024034.db2.gz CHEVBCSSYJJOJF-GOEBONIOSA-N 1 1 354.410 2.881 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000439930081 513212652 /nfs/dbraw/zinc/21/26/52/513212652.db2.gz LPRHFXKOVWMZBQ-HNNXBMFYSA-N 1 1 350.419 2.797 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])c2cccnc12)C(C)C ZINC000450594104 513265988 /nfs/dbraw/zinc/26/59/88/513265988.db2.gz CCGWHFKLBFUJSB-INIZCTEOSA-N 1 1 360.414 2.732 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000429046940 513268477 /nfs/dbraw/zinc/26/84/77/513268477.db2.gz XZRLEYMNYUZBCT-ZMSDIMECSA-N 1 1 363.458 2.644 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1ccc2ncccc2c1[N+](=O)[O-])C(C)C ZINC000450600089 513268589 /nfs/dbraw/zinc/26/85/89/513268589.db2.gz MLMKZLVFYSFOSB-INIZCTEOSA-N 1 1 360.414 2.732 20 5 FFBDMO Cc1cccc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)n1 ZINC000450734905 513319693 /nfs/dbraw/zinc/31/96/93/513319693.db2.gz DQVNVDCDEJJMKN-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO CC(C)(C)OC(=O)CN[C@]1(C)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000440491426 513332831 /nfs/dbraw/zinc/33/28/31/513332831.db2.gz SEPYBXCEFNZZJV-LJQANCHMSA-N 1 1 363.458 2.533 20 5 FFBDMO C[C@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000450807620 513351946 /nfs/dbraw/zinc/35/19/46/513351946.db2.gz GWTDJWWHHQHALL-OAHLLOKOSA-N 1 1 368.437 2.652 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425002593 513362585 /nfs/dbraw/zinc/36/25/85/513362585.db2.gz LGVUDOFITWQTSY-AZUAARDMSA-N 1 1 365.433 2.870 20 5 FFBDMO CN1CC[N@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1(C)C ZINC000440646492 513369753 /nfs/dbraw/zinc/36/97/53/513369753.db2.gz GGNWXVGZZQGNMM-UHFFFAOYSA-N 1 1 369.469 2.517 20 5 FFBDMO CN1CC[N@@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1(C)C ZINC000440646492 513369760 /nfs/dbraw/zinc/36/97/60/513369760.db2.gz GGNWXVGZZQGNMM-UHFFFAOYSA-N 1 1 369.469 2.517 20 5 FFBDMO COCCO[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000447101479 513398927 /nfs/dbraw/zinc/39/89/27/513398927.db2.gz XKEBAFFYIDRKLY-IAGOWNOFSA-N 1 1 366.458 2.564 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000450951893 513421960 /nfs/dbraw/zinc/42/19/60/513421960.db2.gz GUQVSSAAQPYVFB-NSHDSACASA-N 1 1 357.252 2.980 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294425 513533716 /nfs/dbraw/zinc/53/37/16/513533716.db2.gz HKRZARUVOZMENS-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294425 513533724 /nfs/dbraw/zinc/53/37/24/513533724.db2.gz HKRZARUVOZMENS-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO C[N@H+](Cc1ncccn1)[C@@H]1CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413256299 513550897 /nfs/dbraw/zinc/55/08/97/513550897.db2.gz CHAVZRMXLNFNFR-CQSZACIVSA-N 1 1 364.409 2.644 20 5 FFBDMO C[N@@H+](Cc1ncccn1)[C@@H]1CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413256299 513550903 /nfs/dbraw/zinc/55/09/03/513550903.db2.gz CHAVZRMXLNFNFR-CQSZACIVSA-N 1 1 364.409 2.644 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451154943 513555680 /nfs/dbraw/zinc/55/56/80/513555680.db2.gz OFJSKAZNWBRNIV-UHFFFAOYSA-N 1 1 361.442 2.859 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425423247 513556248 /nfs/dbraw/zinc/55/62/48/513556248.db2.gz UDXYYNUNXVSOQL-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425423247 513556252 /nfs/dbraw/zinc/55/62/52/513556252.db2.gz UDXYYNUNXVSOQL-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO Cc1ccccc1CC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451165416 513563179 /nfs/dbraw/zinc/56/31/79/513563179.db2.gz KUSADWCRQPWTQO-UHFFFAOYSA-N 1 1 353.422 2.967 20 5 FFBDMO Cc1ccccc1CC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451165416 513563182 /nfs/dbraw/zinc/56/31/82/513563182.db2.gz KUSADWCRQPWTQO-UHFFFAOYSA-N 1 1 353.422 2.967 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000416129374 513585676 /nfs/dbraw/zinc/58/56/76/513585676.db2.gz VYKAKSWVUIWLSA-UHFFFAOYSA-N 1 1 368.437 2.571 20 5 FFBDMO COC(=O)c1cnc([C@@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])s1 ZINC000425477090 513588515 /nfs/dbraw/zinc/58/85/15/513588515.db2.gz AXIXMMIZKSAYEA-SNVBAGLBSA-N 1 1 351.384 2.568 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451341207 513688535 /nfs/dbraw/zinc/68/85/35/513688535.db2.gz KTIBYXRDXVPOMO-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO C[N@@H+]1CCCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000435836234 513695313 /nfs/dbraw/zinc/69/53/13/513695313.db2.gz QATKZAAOMPICRZ-UHFFFAOYSA-N 1 1 353.397 2.598 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000435836234 513695318 /nfs/dbraw/zinc/69/53/18/513695318.db2.gz QATKZAAOMPICRZ-UHFFFAOYSA-N 1 1 353.397 2.598 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000451381202 513713048 /nfs/dbraw/zinc/71/30/48/513713048.db2.gz ZWRFERFIHAQBIO-UHFFFAOYSA-N 1 1 372.425 2.994 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000430803876 513752450 /nfs/dbraw/zinc/75/24/50/513752450.db2.gz WGGIBPARKRRCRJ-UHFFFAOYSA-N 1 1 367.365 2.810 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000416462476 513783838 /nfs/dbraw/zinc/78/38/38/513783838.db2.gz QPQAACDWGBRDMG-GJZGRUSLSA-N 1 1 369.487 2.705 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@@H](CO)c1ccccc1 ZINC000436250123 513806206 /nfs/dbraw/zinc/80/62/06/513806206.db2.gz BNQAXNKPEBSULP-KRWDZBQOSA-N 1 1 371.393 2.558 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2ncc(Br)cc2[N+](=O)[O-])CCCO1 ZINC000431420226 513895162 /nfs/dbraw/zinc/89/51/62/513895162.db2.gz HBVWELSHPDSNHF-LLVKDONJSA-N 1 1 373.251 2.665 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691974 513913758 /nfs/dbraw/zinc/91/37/58/513913758.db2.gz DCUVABYYXGIRAU-DYEKYZERSA-N 1 1 367.833 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691974 513913763 /nfs/dbraw/zinc/91/37/63/513913763.db2.gz DCUVABYYXGIRAU-DYEKYZERSA-N 1 1 367.833 2.670 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000451700291 513921226 /nfs/dbraw/zinc/92/12/26/513921226.db2.gz XFOMSUUMSISDSV-HLLBOEOZSA-N 1 1 361.442 2.715 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000431717970 513978198 /nfs/dbraw/zinc/97/81/98/513978198.db2.gz AYGHZFYFGMRCDJ-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO CCc1ccc([C@@H](NCCCN2CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423179119 514071185 /nfs/dbraw/zinc/07/11/85/514071185.db2.gz HBFNJOLNFBFDPF-FQEVSTJZSA-N 1 1 372.469 2.725 20 5 FFBDMO CC1(C)CCC[N@H+](CCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000443959851 514083936 /nfs/dbraw/zinc/08/39/36/514083936.db2.gz IKFURRZMNCRQFB-UHFFFAOYSA-N 1 1 355.460 2.532 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000443959851 514083941 /nfs/dbraw/zinc/08/39/41/514083941.db2.gz IKFURRZMNCRQFB-UHFFFAOYSA-N 1 1 355.460 2.532 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444021127 514101886 /nfs/dbraw/zinc/10/18/86/514101886.db2.gz MTGUDNSNCFWJSH-UHFFFAOYSA-N 1 1 355.413 2.890 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432322194 514158931 /nfs/dbraw/zinc/15/89/31/514158931.db2.gz YIRJJOITBOVXAD-CQSZACIVSA-N 1 1 352.866 2.855 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F)CCC(F)(F)F ZINC000427254984 514162836 /nfs/dbraw/zinc/16/28/36/514162836.db2.gz BRSBKVPVLKJTLU-UHFFFAOYSA-N 1 1 365.327 2.667 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C[C@H]1c1ccc(O)cc1 ZINC000449348291 514177406 /nfs/dbraw/zinc/17/74/06/514177406.db2.gz LPBZIDFMPFKLPL-RBUKOAKNSA-N 1 1 370.405 2.997 20 5 FFBDMO COC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097745 514190752 /nfs/dbraw/zinc/19/07/52/514190752.db2.gz ZQJGFAPCGWDQDY-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO COC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097745 514190759 /nfs/dbraw/zinc/19/07/59/514190759.db2.gz ZQJGFAPCGWDQDY-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H]1C[C@@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000420602223 514197103 /nfs/dbraw/zinc/19/71/03/514197103.db2.gz OLQWAHCQYMZJKM-DZGCQCFKSA-N 1 1 354.410 2.769 20 5 FFBDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000449421969 514205139 /nfs/dbraw/zinc/20/51/39/514205139.db2.gz MFJQCTHGMDQNNE-JQWIXIFHSA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000452120845 514205230 /nfs/dbraw/zinc/20/52/30/514205230.db2.gz JNTUOKHUXPMVJV-MPGHIAIKSA-N 1 1 373.453 2.746 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](CCCO)C1 ZINC000452130254 514211433 /nfs/dbraw/zinc/21/14/33/514211433.db2.gz NQDUMQMZATVCNM-RYUDHWBXSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](CCCO)C1 ZINC000452130254 514211438 /nfs/dbraw/zinc/21/14/38/514211438.db2.gz NQDUMQMZATVCNM-RYUDHWBXSA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C[C@H]3CCCO3)[C@H]3CCSC3)nc2c1 ZINC000444664112 514287459 /nfs/dbraw/zinc/28/74/59/514287459.db2.gz PYDVNIYIGHQZCV-UONOGXRCSA-N 1 1 362.455 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C[C@H]3CCCO3)[C@H]3CCSC3)nc2c1 ZINC000444664112 514287463 /nfs/dbraw/zinc/28/74/63/514287463.db2.gz PYDVNIYIGHQZCV-UONOGXRCSA-N 1 1 362.455 2.958 20 5 FFBDMO COC(=O)c1cc(NCCC[N@H+]2CCCO[C@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000432850911 514300814 /nfs/dbraw/zinc/30/08/14/514300814.db2.gz IGZATRAPCFSQNO-CQSZACIVSA-N 1 1 365.430 2.603 20 5 FFBDMO Cc1cc(NCCC[N@@H+]2CCCO[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000432865825 514305292 /nfs/dbraw/zinc/30/52/92/514305292.db2.gz MMRAOCFFWOOVMD-HNNXBMFYSA-N 1 1 358.442 2.786 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCCO[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000432865825 514305298 /nfs/dbraw/zinc/30/52/98/514305298.db2.gz MMRAOCFFWOOVMD-HNNXBMFYSA-N 1 1 358.442 2.786 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1cc2ccccc2c2cccnc12 ZINC000452378665 514320863 /nfs/dbraw/zinc/32/08/63/514320863.db2.gz XBQPUTYVTPBZKI-QGZVFWFLSA-N 1 1 363.461 2.965 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000432910813 514321280 /nfs/dbraw/zinc/32/12/80/514321280.db2.gz OQJZETXLODGJLX-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000432910813 514321289 /nfs/dbraw/zinc/32/12/89/514321289.db2.gz OQJZETXLODGJLX-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000449783457 514352282 /nfs/dbraw/zinc/35/22/82/514352282.db2.gz PFRHCXROBSNEFI-KRWDZBQOSA-N 1 1 357.458 2.882 20 5 FFBDMO CC[C@@H]1C[N@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420964264 514405070 /nfs/dbraw/zinc/40/50/70/514405070.db2.gz WNMXSFHFFOMJKT-OKILXGFUSA-N 1 1 365.430 2.821 20 5 FFBDMO CC(C)c1cc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(N(C)C)[nH+]1 ZINC000428156877 514410648 /nfs/dbraw/zinc/41/06/48/514410648.db2.gz XANQJOAMQCDBJM-ZDUSSCGKSA-N 1 1 371.445 2.660 20 5 FFBDMO C[N@@H+](CCc1cccc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)c1)C1CC1 ZINC000445131415 514423610 /nfs/dbraw/zinc/42/36/10/514423610.db2.gz DIMCQYBWWGPODH-UHFFFAOYSA-N 1 1 356.382 2.584 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@@H]1CCC[N@H+]1C ZINC000420994428 514429681 /nfs/dbraw/zinc/42/96/81/514429681.db2.gz CDQFXFDDXJBCGC-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000449986021 514453543 /nfs/dbraw/zinc/45/35/43/514453543.db2.gz FVZPVMXTMZJLGW-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@H](C)C1 ZINC000449990726 514456555 /nfs/dbraw/zinc/45/65/55/514456555.db2.gz XCZKLNOJLSTKLW-GDBMZVCRSA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475309636 514612244 /nfs/dbraw/zinc/61/22/44/514612244.db2.gz XKCCESPKPMVFCN-INIZCTEOSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000484311717 514627567 /nfs/dbraw/zinc/62/75/67/514627567.db2.gz KOCYOGCNZSIYRU-UHFFFAOYSA-N 1 1 368.437 2.925 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000470955781 514691047 /nfs/dbraw/zinc/69/10/47/514691047.db2.gz OOLVCLYVRHIBBZ-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000470955781 514691051 /nfs/dbraw/zinc/69/10/51/514691051.db2.gz OOLVCLYVRHIBBZ-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO CC[N@H+](Cc1ccncc1)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000502732842 514756342 /nfs/dbraw/zinc/75/63/42/514756342.db2.gz OJJKMAZTXCVZJU-ZDUSSCGKSA-N 1 1 358.398 2.848 20 5 FFBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000502732842 514756346 /nfs/dbraw/zinc/75/63/46/514756346.db2.gz OJJKMAZTXCVZJU-ZDUSSCGKSA-N 1 1 358.398 2.848 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c1 ZINC000475728400 514781106 /nfs/dbraw/zinc/78/11/06/514781106.db2.gz AKZHSCHQBDNUOW-FQEVSTJZSA-N 1 1 369.469 2.779 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H](C)C1 ZINC000484893145 514832363 /nfs/dbraw/zinc/83/23/63/514832363.db2.gz HBGKDZTTYAIKRQ-HOCLYGCPSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H](C)C1 ZINC000484893145 514832371 /nfs/dbraw/zinc/83/23/71/514832371.db2.gz HBGKDZTTYAIKRQ-HOCLYGCPSA-N 1 1 370.471 2.506 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000467132028 514910278 /nfs/dbraw/zinc/91/02/78/514910278.db2.gz PWPOICJJIAUYER-GFCCVEGCSA-N 1 1 373.413 2.533 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000498493454 514929066 /nfs/dbraw/zinc/92/90/66/514929066.db2.gz JNDQBNUMWXKHFE-UHFFFAOYSA-N 1 1 368.865 2.916 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000480419969 514950874 /nfs/dbraw/zinc/95/08/74/514950874.db2.gz NEOGYFYPIYRDDW-AWEZNQCLSA-N 1 1 371.441 2.703 20 5 FFBDMO COc1c(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476310137 514994458 /nfs/dbraw/zinc/99/44/58/514994458.db2.gz UKMBMLZRWHSLAG-GOEBONIOSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000498705637 515032373 /nfs/dbraw/zinc/03/23/73/515032373.db2.gz ITAIVZWCIDWYJH-JKSUJKDBSA-N 1 1 374.485 2.997 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000467550646 515045221 /nfs/dbraw/zinc/04/52/21/515045221.db2.gz MCTQQWJCVGCQES-SFHVURJKSA-N 1 1 350.415 2.695 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000456324518 515092263 /nfs/dbraw/zinc/09/22/63/515092263.db2.gz XOCWYOLLJFDIAP-HLVVYCRESA-N 1 1 367.833 2.757 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000490171668 515129568 /nfs/dbraw/zinc/12/95/68/515129568.db2.gz GTJNRUFTPQKCKZ-CQSZACIVSA-N 1 1 359.430 2.620 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509450685 515184993 /nfs/dbraw/zinc/18/49/93/515184993.db2.gz HBFSOMXQFKBQNX-UHFFFAOYSA-N 1 1 352.398 2.789 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C[C@H]1C ZINC000481057239 515190325 /nfs/dbraw/zinc/19/03/25/515190325.db2.gz KGXDYLUPCCJQCX-HUUCEWRRSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCC[C@H](C)C1 ZINC000485824627 515204951 /nfs/dbraw/zinc/20/49/51/515204951.db2.gz ZWSLRBVJPVKRQN-RYUDHWBXSA-N 1 1 355.385 2.652 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240412 515277618 /nfs/dbraw/zinc/27/76/18/515277618.db2.gz LZEHKDHBIKDQKG-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)C[N@H+]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240412 515277628 /nfs/dbraw/zinc/27/76/28/515277628.db2.gz LZEHKDHBIKDQKG-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240412 515277635 /nfs/dbraw/zinc/27/76/35/515277635.db2.gz LZEHKDHBIKDQKG-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240412 515277639 /nfs/dbraw/zinc/27/76/39/515277639.db2.gz LZEHKDHBIKDQKG-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[NH+](C2CCC2)CC1 ZINC000499622309 515389617 /nfs/dbraw/zinc/38/96/17/515389617.db2.gz OMUIQLWYFAJQGG-GFCCVEGCSA-N 1 1 367.833 2.712 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000481793547 515469931 /nfs/dbraw/zinc/46/99/31/515469931.db2.gz KKWMTEZKDDGUMM-PKOBYXMFSA-N 1 1 364.405 2.904 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486527717 515525506 /nfs/dbraw/zinc/52/55/06/515525506.db2.gz DRFUKDNWBOELGM-GFCCVEGCSA-N 1 1 355.385 2.748 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([O-])ccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000505419659 515529456 /nfs/dbraw/zinc/52/94/56/515529456.db2.gz FWEPXZKPVXIABA-INIZCTEOSA-N 1 1 369.421 2.867 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([O-])ccc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000505419659 515529466 /nfs/dbraw/zinc/52/94/66/515529466.db2.gz FWEPXZKPVXIABA-INIZCTEOSA-N 1 1 369.421 2.867 20 5 FFBDMO COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCC[NH+]2CCC2)cc1 ZINC000505436631 515534541 /nfs/dbraw/zinc/53/45/41/515534541.db2.gz NGCMZJQUTLEWRD-UHFFFAOYSA-N 1 1 371.393 2.831 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492828502 515565579 /nfs/dbraw/zinc/56/55/79/515565579.db2.gz JDPVGYFEHIQEBL-CQSZACIVSA-N 1 1 357.414 2.909 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492831438 515566842 /nfs/dbraw/zinc/56/68/42/515566842.db2.gz NVSOCSVKSPQONR-HOCLYGCPSA-N 1 1 359.426 2.579 20 5 FFBDMO O=C(CC[N@H+](CCO)[C@@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000500069637 515580265 /nfs/dbraw/zinc/58/02/65/515580265.db2.gz JGYZKTYOJXZGTD-GOSISDBHSA-N 1 1 369.421 2.905 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000457120093 515665601 /nfs/dbraw/zinc/66/56/01/515665601.db2.gz NQBRWMPCTLDPCB-MRXNPFEDSA-N 1 1 371.441 2.550 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511062990 515763445 /nfs/dbraw/zinc/76/34/45/515763445.db2.gz GDCILBYSYXRAOL-AWEZNQCLSA-N 1 1 373.375 2.918 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000459721953 515770333 /nfs/dbraw/zinc/77/03/33/515770333.db2.gz UJMMQAKRNKKMQM-OAHLLOKOSA-N 1 1 365.430 2.823 20 5 FFBDMO Cc1ccccc1CCNC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511143907 515805521 /nfs/dbraw/zinc/80/55/21/515805521.db2.gz RJGUMYFQAKORGL-UHFFFAOYSA-N 1 1 355.438 2.736 20 5 FFBDMO Cc1ccccc1CCNC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511143907 515805531 /nfs/dbraw/zinc/80/55/31/515805531.db2.gz RJGUMYFQAKORGL-UHFFFAOYSA-N 1 1 355.438 2.736 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000459808455 515822302 /nfs/dbraw/zinc/82/23/02/515822302.db2.gz OWISYXUYBKGMAO-OLZOCXBDSA-N 1 1 365.430 2.831 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000494679474 515920354 /nfs/dbraw/zinc/92/03/54/515920354.db2.gz FJLGEAISPKKKCE-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000501079596 515969977 /nfs/dbraw/zinc/96/99/77/515969977.db2.gz ARICHTJMVASBQA-UHFFFAOYSA-N 1 1 371.235 2.917 20 5 FFBDMO O=C(NCC[N@H+]1CC=CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000506764718 515976860 /nfs/dbraw/zinc/97/68/60/515976860.db2.gz BREHFTVJCBFJQT-UHFFFAOYSA-N 1 1 373.331 2.528 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000506764718 515976868 /nfs/dbraw/zinc/97/68/68/515976868.db2.gz BREHFTVJCBFJQT-UHFFFAOYSA-N 1 1 373.331 2.528 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000501212277 516017757 /nfs/dbraw/zinc/01/77/57/516017757.db2.gz QSFHVBKYYFZSNW-HNNXBMFYSA-N 1 1 368.865 2.964 20 5 FFBDMO COc1c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000474390593 516026147 /nfs/dbraw/zinc/02/61/47/516026147.db2.gz LHEJOOVCBYUNTD-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000488075356 516107394 /nfs/dbraw/zinc/10/73/94/516107394.db2.gz OKSGYIPEDQKAIL-HUUCEWRRSA-N 1 1 366.849 2.717 20 5 FFBDMO CC(C)[C@H]1CN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000488083088 516109995 /nfs/dbraw/zinc/10/99/95/516109995.db2.gz YVZUBHVWHNWPAX-BLLLJJGKSA-N 1 1 368.865 2.847 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135465 516136087 /nfs/dbraw/zinc/13/60/87/516136087.db2.gz UILLMSXRXZVFSG-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135465 516136091 /nfs/dbraw/zinc/13/60/91/516136091.db2.gz UILLMSXRXZVFSG-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135465 516136099 /nfs/dbraw/zinc/13/60/99/516136099.db2.gz UILLMSXRXZVFSG-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO CCC[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2OC)CC[N@H+]1CCOC ZINC000501771408 516219773 /nfs/dbraw/zinc/21/97/73/516219773.db2.gz FVJKDZPDPOXZFV-KRWDZBQOSA-N 1 1 351.447 2.536 20 5 FFBDMO CCC[C@@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CC[N@H+]1CCOC ZINC000557609306 516333937 /nfs/dbraw/zinc/33/39/37/516333937.db2.gz DKYDPYPPCBYOIX-GFCCVEGCSA-N 1 1 365.459 2.537 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000535383501 516334998 /nfs/dbraw/zinc/33/49/98/516334998.db2.gz CJWIJJGCCGTMPC-HIFRSBDPSA-N 1 1 358.442 2.950 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021365 516404522 /nfs/dbraw/zinc/40/45/22/516404522.db2.gz POZUSESLYGQYFS-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021365 516404527 /nfs/dbraw/zinc/40/45/27/516404527.db2.gz POZUSESLYGQYFS-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000561157827 516415693 /nfs/dbraw/zinc/41/56/93/516415693.db2.gz XGLZCCUOJWLWBM-DGCLKSJQSA-N 1 1 350.419 2.617 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000557919996 516506093 /nfs/dbraw/zinc/50/60/93/516506093.db2.gz LWKJLFIOTLZICD-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000557919996 516506100 /nfs/dbraw/zinc/50/61/00/516506100.db2.gz LWKJLFIOTLZICD-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)CC1 ZINC000531558760 516525548 /nfs/dbraw/zinc/52/55/48/516525548.db2.gz MDIRLWZMRFKNIL-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000544047915 516556905 /nfs/dbraw/zinc/55/69/05/516556905.db2.gz SNTVBOPHMPAGNZ-KBPBESRZSA-N 1 1 351.472 2.876 20 5 FFBDMO Cn1cnc2cc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc21 ZINC000540481848 516574427 /nfs/dbraw/zinc/57/44/27/516574427.db2.gz NYJVTFHKTGSXOB-AWEZNQCLSA-N 1 1 352.398 2.563 20 5 FFBDMO C[C@@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+](C2CCC2)C1 ZINC000561536043 516637378 /nfs/dbraw/zinc/63/73/78/516637378.db2.gz ROESXQGJHISUEN-HNNXBMFYSA-N 1 1 370.453 2.882 20 5 FFBDMO Cc1nn(C)c(C)c1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000513656351 516708991 /nfs/dbraw/zinc/70/89/91/516708991.db2.gz RLPYANQEXKJCAU-GOSISDBHSA-N 1 1 368.441 2.600 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000536494973 516788784 /nfs/dbraw/zinc/78/87/84/516788784.db2.gz ZOKGCSSXMOAJQL-UHFFFAOYSA-N 1 1 355.442 2.821 20 5 FFBDMO COc1nc(C)cc(C)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000561866808 516807831 /nfs/dbraw/zinc/80/78/31/516807831.db2.gz JZZNCOQSTKVQMB-AWEZNQCLSA-N 1 1 357.414 2.697 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000525054892 516903648 /nfs/dbraw/zinc/90/36/48/516903648.db2.gz LHWWDVXAHJQMEB-UHFFFAOYSA-N 1 1 371.393 2.704 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000525054892 516903657 /nfs/dbraw/zinc/90/36/57/516903657.db2.gz LHWWDVXAHJQMEB-UHFFFAOYSA-N 1 1 371.393 2.704 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H]1C ZINC000525396029 517029384 /nfs/dbraw/zinc/02/93/84/517029384.db2.gz KRAKLPRVNUDROD-KDOFPFPSSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525466493 517050623 /nfs/dbraw/zinc/05/06/23/517050623.db2.gz ZYJSMZVFMJIZIX-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525466493 517050631 /nfs/dbraw/zinc/05/06/31/517050631.db2.gz ZYJSMZVFMJIZIX-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@](CO)(C(C)C)C2)c([N+](=O)[O-])c1 ZINC000555711889 517079136 /nfs/dbraw/zinc/07/91/36/517079136.db2.gz CUYGLPWJYOEWKQ-SFHVURJKSA-N 1 1 352.431 2.713 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000541525054 517094338 /nfs/dbraw/zinc/09/43/38/517094338.db2.gz WEWAJIPSKXKSAW-HIFRSBDPSA-N 1 1 364.446 2.618 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000519697476 517133916 /nfs/dbraw/zinc/13/39/16/517133916.db2.gz KAKMQFWSXQATHL-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000562477710 517133891 /nfs/dbraw/zinc/13/38/91/517133891.db2.gz NNGIJRPYYMMTJF-DUVNUKRYSA-N 1 1 357.414 2.874 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000537411382 517175342 /nfs/dbraw/zinc/17/53/42/517175342.db2.gz NFUHQOXUFPSSCZ-GOSISDBHSA-N 1 1 363.414 2.520 20 5 FFBDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000520439423 517393834 /nfs/dbraw/zinc/39/38/34/517393834.db2.gz UVUDXQXYXGFWSQ-SJKOYZFVSA-N 1 1 354.414 2.670 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000552803430 517397555 /nfs/dbraw/zinc/39/75/55/517397555.db2.gz GEBHNSRBECHOTP-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000552803430 517397560 /nfs/dbraw/zinc/39/75/60/517397560.db2.gz GEBHNSRBECHOTP-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO O=C(NC[C@@H]([NH2+]Cc1ccccc1)c1ccco1)c1cc([N+](=O)[O-])c[nH]1 ZINC000516033431 517543309 /nfs/dbraw/zinc/54/33/09/517543309.db2.gz XDNFLBKHHXGZRX-MRXNPFEDSA-N 1 1 354.366 2.777 20 5 FFBDMO COc1ccc2c(c1)CCC[N@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C2 ZINC000556686086 517570828 /nfs/dbraw/zinc/57/08/28/517570828.db2.gz MHTMUKDUGLBXSN-SFHVURJKSA-N 1 1 372.421 2.792 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000542744742 517715037 /nfs/dbraw/zinc/71/50/37/517715037.db2.gz IETPOWHUPMYGRC-UKRRQHHQSA-N 1 1 369.487 2.562 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000546565840 517728471 /nfs/dbraw/zinc/72/84/71/517728471.db2.gz RPRWOVMYEGOMTM-ZDUSSCGKSA-N 1 1 351.422 2.812 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(Br)c1 ZINC000534138421 517759285 /nfs/dbraw/zinc/75/92/85/517759285.db2.gz PTPBQBYOVJNERS-UHFFFAOYSA-N 1 1 366.215 2.651 20 5 FFBDMO CC(C)(C)C1CC[NH+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000530461360 517789159 /nfs/dbraw/zinc/78/91/59/517789159.db2.gz ZRXXYMBCRJHHLS-INIZCTEOSA-N 1 1 359.426 2.985 20 5 FFBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553600851 517804260 /nfs/dbraw/zinc/80/42/60/517804260.db2.gz BOUNBMUVNLASBH-AAEUAGOBSA-N 1 1 359.348 2.913 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918425 517843478 /nfs/dbraw/zinc/84/34/78/517843478.db2.gz ARSTYYUFTKZKPV-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918425 517843488 /nfs/dbraw/zinc/84/34/88/517843488.db2.gz ARSTYYUFTKZKPV-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000521769651 517850058 /nfs/dbraw/zinc/85/00/58/517850058.db2.gz FNKCTWHSTMVGJZ-NEPJUHHUSA-N 1 1 367.833 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000534797001 518036660 /nfs/dbraw/zinc/03/66/60/518036660.db2.gz IWCBICILMYULKM-HOTGVXAUSA-N 1 1 357.410 2.651 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)COc1ccccc1[N+](=O)[O-] ZINC000560804658 518036836 /nfs/dbraw/zinc/03/68/36/518036836.db2.gz AXVPNDPUUONXSE-UHFFFAOYSA-N 1 1 361.398 2.547 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557537021 518062756 /nfs/dbraw/zinc/06/27/56/518062756.db2.gz KXPRUUWQWLZFEQ-CVEARBPZSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557537021 518062759 /nfs/dbraw/zinc/06/27/59/518062759.db2.gz KXPRUUWQWLZFEQ-CVEARBPZSA-N 1 1 374.485 2.997 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CN(c2ccccc2)CCO1 ZINC000569821834 518311883 /nfs/dbraw/zinc/31/18/83/518311883.db2.gz DNGVAXWVQJEGKR-FQEVSTJZSA-N 1 1 355.438 2.975 20 5 FFBDMO Cc1c(CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000573036211 518475528 /nfs/dbraw/zinc/47/55/28/518475528.db2.gz DOCZNRWFRGNGET-GOSISDBHSA-N 1 1 368.437 2.827 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000579154210 518546462 /nfs/dbraw/zinc/54/64/62/518546462.db2.gz XLVSUTXSHGAQOS-MBNYWOFBSA-N 1 1 364.446 2.863 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000573320658 518609998 /nfs/dbraw/zinc/60/99/98/518609998.db2.gz DMEHHNIXEZESCM-HNNXBMFYSA-N 1 1 368.393 2.777 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000573478604 518685316 /nfs/dbraw/zinc/68/53/16/518685316.db2.gz QLRIWIUUCXZEPR-MSOLQXFVSA-N 1 1 371.441 2.545 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C[N@H+]1C1CC1 ZINC000582311529 518692469 /nfs/dbraw/zinc/69/24/69/518692469.db2.gz PCEAFIZSXZNNDI-CHWSQXEVSA-N 1 1 364.421 2.608 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)C[C@H]1Cc1ccccc1 ZINC000588053403 518711287 /nfs/dbraw/zinc/71/12/87/518711287.db2.gz KTLHEJXOGFLYCJ-QGZVFWFLSA-N 1 1 363.421 2.901 20 5 FFBDMO CC(=O)NCC[N@H+](C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000564990965 518733620 /nfs/dbraw/zinc/73/36/20/518733620.db2.gz RNRKMFGNCQBUAI-UHFFFAOYSA-N 1 1 356.426 2.931 20 5 FFBDMO CC(C)OCCC[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000568078945 518863901 /nfs/dbraw/zinc/86/39/01/518863901.db2.gz TUHKGQLYHUIRGN-UHFFFAOYSA-N 1 1 351.403 2.640 20 5 FFBDMO CS(=O)(=O)c1ccc(F)c(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577191881 518958008 /nfs/dbraw/zinc/95/80/08/518958008.db2.gz ZKYIIBFOPMFOBF-MRXNPFEDSA-N 1 1 364.398 2.915 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000582919208 518986118 /nfs/dbraw/zinc/98/61/18/518986118.db2.gz WJQOCVUZBJKSHE-HNNXBMFYSA-N 1 1 370.409 2.771 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000589509545 519022206 /nfs/dbraw/zinc/02/22/06/519022206.db2.gz YGVNQMXWQBBIGB-GDBMZVCRSA-N 1 1 350.415 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000589509545 519022215 /nfs/dbraw/zinc/02/22/15/519022215.db2.gz YGVNQMXWQBBIGB-GDBMZVCRSA-N 1 1 350.415 2.610 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000589520492 519022852 /nfs/dbraw/zinc/02/28/52/519022852.db2.gz TWQBDKJUCJCYBR-NSHDSACASA-N 1 1 358.341 2.624 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC(F)(F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000589520492 519022860 /nfs/dbraw/zinc/02/28/60/519022860.db2.gz TWQBDKJUCJCYBR-NSHDSACASA-N 1 1 358.341 2.624 20 5 FFBDMO C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1Cc1ccccc1 ZINC000583100594 519076961 /nfs/dbraw/zinc/07/69/61/519076961.db2.gz RMAAOHKZVCRUJN-MRXNPFEDSA-N 1 1 351.410 2.834 20 5 FFBDMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000589859449 519094612 /nfs/dbraw/zinc/09/46/12/519094612.db2.gz HTSSCNUKXBBCAZ-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000565778041 519128195 /nfs/dbraw/zinc/12/81/95/519128195.db2.gz NRWMANNDXLCVAH-PBHICJAKSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659905 519153532 /nfs/dbraw/zinc/15/35/32/519153532.db2.gz MRKJNEJDKSRWGL-DNVCBOLYSA-N 1 1 366.421 2.893 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659905 519153535 /nfs/dbraw/zinc/15/35/35/519153535.db2.gz MRKJNEJDKSRWGL-DNVCBOLYSA-N 1 1 366.421 2.893 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000574473718 519171890 /nfs/dbraw/zinc/17/18/90/519171890.db2.gz FZTPMPAMXGDTQG-VEVIJQCQSA-N 1 1 356.426 2.878 20 5 FFBDMO Cn1c2ccccc2nc1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000580487396 519199494 /nfs/dbraw/zinc/19/94/94/519199494.db2.gz UVDAANJDEMKXNF-UHFFFAOYSA-N 1 1 352.394 2.919 20 5 FFBDMO Cn1c2ccccc2nc1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000580487396 519199497 /nfs/dbraw/zinc/19/94/97/519199497.db2.gz UVDAANJDEMKXNF-UHFFFAOYSA-N 1 1 352.394 2.919 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000565935664 519205375 /nfs/dbraw/zinc/20/53/75/519205375.db2.gz BRPRZDBXPIZCLT-OAHLLOKOSA-N 1 1 354.410 2.584 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000571758300 519259947 /nfs/dbraw/zinc/25/99/47/519259947.db2.gz NHLHEYXCQBIJCC-RBUKOAKNSA-N 1 1 367.405 2.853 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000571758300 519259953 /nfs/dbraw/zinc/25/99/53/519259953.db2.gz NHLHEYXCQBIJCC-RBUKOAKNSA-N 1 1 367.405 2.853 20 5 FFBDMO Nc1ccc(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)nc1[N+](=O)[O-] ZINC000590572424 519269903 /nfs/dbraw/zinc/26/99/03/519269903.db2.gz MZLMECMUEREPCU-UHFFFAOYSA-N 1 1 361.833 2.938 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000590632603 519296646 /nfs/dbraw/zinc/29/66/46/519296646.db2.gz JSZYERYQAMMZCF-LBPRGKRZSA-N 1 1 357.332 2.828 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000590632602 519296734 /nfs/dbraw/zinc/29/67/34/519296734.db2.gz JSZYERYQAMMZCF-GFCCVEGCSA-N 1 1 357.332 2.828 20 5 FFBDMO COc1c(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000574921178 519405800 /nfs/dbraw/zinc/40/58/00/519405800.db2.gz OLWZBGACWWTCIO-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000574933658 519412311 /nfs/dbraw/zinc/41/23/11/519412311.db2.gz BLKNABGOMXHOIT-HZSPNIEDSA-N 1 1 362.430 2.618 20 5 FFBDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591016064 519477756 /nfs/dbraw/zinc/47/77/56/519477756.db2.gz OLRHIDSJYDBRHZ-QGZVFWFLSA-N 1 1 357.414 2.802 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147590 519529947 /nfs/dbraw/zinc/52/99/47/519529947.db2.gz RKWWOEAEBORHFX-HNNXBMFYSA-N 1 1 355.442 2.723 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2CCCNC2=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591245204 519560862 /nfs/dbraw/zinc/56/08/62/519560862.db2.gz QXOUFMPPZNBYDT-KDOFPFPSSA-N 1 1 357.410 2.955 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602856887 519930115 /nfs/dbraw/zinc/93/01/15/519930115.db2.gz STXWIYJJNHQBLB-DLBZAZTESA-N 1 1 357.410 2.609 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C(C)(C)C ZINC000602873294 519939847 /nfs/dbraw/zinc/93/98/47/519939847.db2.gz IRTUKFUYIYAXQI-OAHLLOKOSA-N 1 1 368.865 2.849 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873238 519940833 /nfs/dbraw/zinc/94/08/33/519940833.db2.gz ICMRPOQAXLFAQC-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873238 519940843 /nfs/dbraw/zinc/94/08/43/519940843.db2.gz ICMRPOQAXLFAQC-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873238 519940850 /nfs/dbraw/zinc/94/08/50/519940850.db2.gz ICMRPOQAXLFAQC-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccncc1)C1(CO)CCC1 ZINC000602903899 519962646 /nfs/dbraw/zinc/96/26/46/519962646.db2.gz SEGCIWAYWVZMEW-SFHVURJKSA-N 1 1 357.410 2.992 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1C ZINC000594483930 519992279 /nfs/dbraw/zinc/99/22/79/519992279.db2.gz LFRNTHYRIAXOME-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000591685120 519996613 /nfs/dbraw/zinc/99/66/13/519996613.db2.gz RYCJVTVKWBVHKC-UHFFFAOYSA-N 1 1 353.422 2.872 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000591750369 520023104 /nfs/dbraw/zinc/02/31/04/520023104.db2.gz QGCNAHKJMDGHDV-SECBINFHSA-N 1 1 374.290 2.681 20 5 FFBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594588942 520041318 /nfs/dbraw/zinc/04/13/18/520041318.db2.gz GIDXXHNWZQQCMP-MXWKQRLJSA-N 1 1 362.352 2.918 20 5 FFBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594588942 520041321 /nfs/dbraw/zinc/04/13/21/520041321.db2.gz GIDXXHNWZQQCMP-MXWKQRLJSA-N 1 1 362.352 2.918 20 5 FFBDMO CCc1cc(NCC[N@H+](CC)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608788496 520127352 /nfs/dbraw/zinc/12/73/52/520127352.db2.gz WIAGRNKWRPQCFY-UHFFFAOYSA-N 1 1 355.442 2.932 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000608855773 520145135 /nfs/dbraw/zinc/14/51/35/520145135.db2.gz PYGSITJOKQAVRM-ZDUSSCGKSA-N 1 1 370.247 2.658 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1 ZINC000600298794 520188159 /nfs/dbraw/zinc/18/81/59/520188159.db2.gz MPZJLODTTYRVHY-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1 ZINC000600298794 520188163 /nfs/dbraw/zinc/18/81/63/520188163.db2.gz MPZJLODTTYRVHY-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000600297788 520189411 /nfs/dbraw/zinc/18/94/11/520189411.db2.gz FIOAEUHCZPIQBS-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000600297788 520189418 /nfs/dbraw/zinc/18/94/18/520189418.db2.gz FIOAEUHCZPIQBS-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594854454 520190607 /nfs/dbraw/zinc/19/06/07/520190607.db2.gz LGSIZZJMXMHDAO-AWEZNQCLSA-N 1 1 367.471 2.589 20 5 FFBDMO Cc1nn(C)cc1C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132871 520206813 /nfs/dbraw/zinc/20/68/13/520206813.db2.gz OPUTXALZRFUYPO-IYARVYRRSA-N 1 1 358.442 2.942 20 5 FFBDMO Cc1nn(C)cc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132871 520206821 /nfs/dbraw/zinc/20/68/21/520206821.db2.gz OPUTXALZRFUYPO-IYARVYRRSA-N 1 1 358.442 2.942 20 5 FFBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)nn1 ZINC000592132528 520207115 /nfs/dbraw/zinc/20/71/15/520207115.db2.gz IGGIOYTZSQRXNK-QAQDUYKDSA-N 1 1 372.425 2.699 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)nn1 ZINC000592132528 520207118 /nfs/dbraw/zinc/20/71/18/520207118.db2.gz IGGIOYTZSQRXNK-QAQDUYKDSA-N 1 1 372.425 2.699 20 5 FFBDMO CC(C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000592153988 520230183 /nfs/dbraw/zinc/23/01/83/520230183.db2.gz FBHJZXRZVOHXPQ-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000592153988 520230188 /nfs/dbraw/zinc/23/01/88/520230188.db2.gz FBHJZXRZVOHXPQ-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000592153988 520230194 /nfs/dbraw/zinc/23/01/94/520230194.db2.gz FBHJZXRZVOHXPQ-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1ncnc2ccc([N+](=O)[O-])cc21 ZINC000603400121 520248104 /nfs/dbraw/zinc/24/81/04/520248104.db2.gz KKCWUZJPLPRIDV-UHFFFAOYSA-N 1 1 366.425 2.891 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1[C@@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CCOCC2 ZINC000592183921 520248817 /nfs/dbraw/zinc/24/88/17/520248817.db2.gz LFJILTUSDNKZTN-RHSMWYFYSA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000603403886 520249528 /nfs/dbraw/zinc/24/95/28/520249528.db2.gz WNHGIWSITJOZAR-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[N@@H+](CCn1cc(Br)c([N+](=O)[O-])n1)Cc1ccc(F)cc1 ZINC000612998688 520263248 /nfs/dbraw/zinc/26/32/48/520263248.db2.gz AQYSWXZKKVKIGX-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000595050609 520269426 /nfs/dbraw/zinc/26/94/26/520269426.db2.gz SREDMIIONOYHMM-DLBZAZTESA-N 1 1 357.458 2.880 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600470129 520278721 /nfs/dbraw/zinc/27/87/21/520278721.db2.gz GDFKXORVNTUXQM-KRWDZBQOSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000597854660 520283921 /nfs/dbraw/zinc/28/39/21/520283921.db2.gz KYLOGXJOFKQLCH-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000597859591 520286559 /nfs/dbraw/zinc/28/65/59/520286559.db2.gz VSGYGINELXBMJD-INIZCTEOSA-N 1 1 374.485 2.800 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597944069 520342757 /nfs/dbraw/zinc/34/27/57/520342757.db2.gz BXIXLWMPDLXIKQ-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597945578 520344957 /nfs/dbraw/zinc/34/49/57/520344957.db2.gz ITDLLUNPUSVAKO-DGCLKSJQSA-N 1 1 355.822 2.568 20 5 FFBDMO CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597945597 520345072 /nfs/dbraw/zinc/34/50/72/520345072.db2.gz JKZIBDDBMDKMEW-ZDUSSCGKSA-N 1 1 355.822 2.570 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000609560654 520358776 /nfs/dbraw/zinc/35/87/76/520358776.db2.gz DVNUHFMQZVPZKD-CQSZACIVSA-N 1 1 371.441 2.702 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@H]2COc3ccccc3O2)CC1 ZINC000603782452 520359601 /nfs/dbraw/zinc/35/96/01/520359601.db2.gz RHRBADMKFNUOLI-HNNXBMFYSA-N 1 1 355.394 2.557 20 5 FFBDMO O=C(C[NH+]1C[C@H]2CN(c3ccccc3)C[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000603906195 520400058 /nfs/dbraw/zinc/40/00/58/520400058.db2.gz WPPXKJQHTKZOOF-HOTGVXAUSA-N 1 1 366.421 2.602 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000592478719 520407193 /nfs/dbraw/zinc/40/71/93/520407193.db2.gz ITGSKIVCVWQHOH-QAPCUYQASA-N 1 1 360.458 2.696 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492970 520416224 /nfs/dbraw/zinc/41/62/24/520416224.db2.gz JVAUFIOWCXKHLM-JKSUJKDBSA-N 1 1 360.458 2.553 20 5 FFBDMO CCc1nocc1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000595433175 520468866 /nfs/dbraw/zinc/46/88/66/520468866.db2.gz PBMGXDXAFZGIRH-UHFFFAOYSA-N 1 1 370.413 2.734 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604198969 520483429 /nfs/dbraw/zinc/48/34/29/520483429.db2.gz NCPBBWDWEGDPGM-INMHGKMJSA-N 1 1 374.485 2.901 20 5 FFBDMO Cc1noc(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000595480867 520498358 /nfs/dbraw/zinc/49/83/58/520498358.db2.gz AFEACQHCJLAICO-LJQANCHMSA-N 1 1 356.426 2.989 20 5 FFBDMO COc1cc(C[NH2+]Cc2cc(C)n[nH]2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000610009968 520506371 /nfs/dbraw/zinc/50/63/71/520506371.db2.gz MIOZJMYWIMLROK-UHFFFAOYSA-N 1 1 374.319 2.866 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000604473160 520572199 /nfs/dbraw/zinc/57/21/99/520572199.db2.gz ONDMLVHQYFYVCL-LSDHHAIUSA-N 1 1 369.425 2.598 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](CO)Cc1ccccc1 ZINC000595594559 520579666 /nfs/dbraw/zinc/57/96/66/520579666.db2.gz GBTBLZUNIOCJEB-GOSISDBHSA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3nnnn3C3CC3)s2)cc1 ZINC000610271847 520616020 /nfs/dbraw/zinc/61/60/20/520616020.db2.gz GTIHKLRFYGLCIQ-UHFFFAOYSA-N 1 1 356.411 2.935 20 5 FFBDMO CCCC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccc(C)o1 ZINC000610368245 520655102 /nfs/dbraw/zinc/65/51/02/520655102.db2.gz PYDQZVDCNOYKHN-HOCLYGCPSA-N 1 1 350.419 2.917 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601147260 520659428 /nfs/dbraw/zinc/65/94/28/520659428.db2.gz XKQHSZKYDQJYQN-UONOGXRCSA-N 1 1 359.382 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H]3CCC4(CCOCC4)[C@@H]3O)c2c1 ZINC000601161861 520667706 /nfs/dbraw/zinc/66/77/06/520667706.db2.gz VKQXLQKELVJWLK-FZKQIMNGSA-N 1 1 357.410 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c1 ZINC000593015901 520685797 /nfs/dbraw/zinc/68/57/97/520685797.db2.gz BSIGVJKRHZQLDE-LJQANCHMSA-N 1 1 370.405 2.863 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c1 ZINC000593015901 520685802 /nfs/dbraw/zinc/68/58/02/520685802.db2.gz BSIGVJKRHZQLDE-LJQANCHMSA-N 1 1 370.405 2.863 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595756245 520701900 /nfs/dbraw/zinc/70/19/00/520701900.db2.gz FRMFUYJNALOUCD-SJKOYZFVSA-N 1 1 372.368 2.716 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000598559429 520705907 /nfs/dbraw/zinc/70/59/07/520705907.db2.gz HHFRKMIDMBBVIP-AWEZNQCLSA-N 1 1 356.426 2.928 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](CC)CO1 ZINC000593059752 520714872 /nfs/dbraw/zinc/71/48/72/520714872.db2.gz TWSGEXDKMJPDQE-UKRRQHHQSA-N 1 1 363.414 2.782 20 5 FFBDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000593059997 520715662 /nfs/dbraw/zinc/71/56/62/520715662.db2.gz VAWQTONCGXKLJK-KGLIPLIRSA-N 1 1 365.430 2.821 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](Cc2ccccc2)C1 ZINC000593089890 520736535 /nfs/dbraw/zinc/73/65/35/520736535.db2.gz VEIBIXJPHRVFRV-KRWDZBQOSA-N 1 1 365.437 2.830 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C1 ZINC000598603936 520737730 /nfs/dbraw/zinc/73/77/30/520737730.db2.gz IAYKBZPSKVEWKO-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO COC(=O)c1ccnc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000598610158 520741145 /nfs/dbraw/zinc/74/11/45/520741145.db2.gz DZPRIRXFFFXPDS-OLZOCXBDSA-N 1 1 362.430 2.841 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC000593115670 520755480 /nfs/dbraw/zinc/75/54/80/520755480.db2.gz HVAFFFIEQSGEEU-LBPRGKRZSA-N 1 1 357.385 2.995 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593118339 520757913 /nfs/dbraw/zinc/75/79/13/520757913.db2.gz QKCQPTVOQWRWEX-HNNXBMFYSA-N 1 1 355.341 2.663 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119419 520759130 /nfs/dbraw/zinc/75/91/30/520759130.db2.gz YHUDPPYXTKEVEZ-OAHLLOKOSA-N 1 1 355.341 2.663 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000595881542 520789563 /nfs/dbraw/zinc/78/95/63/520789563.db2.gz UAKQICNTEXQEFZ-DLBZAZTESA-N 1 1 356.422 2.996 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000595881546 520789651 /nfs/dbraw/zinc/78/96/51/520789651.db2.gz UAKQICNTEXQEFZ-IRXDYDNUSA-N 1 1 356.422 2.996 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601446709 520790085 /nfs/dbraw/zinc/79/00/85/520790085.db2.gz AQPFDIILWLMOTE-CJNGLKHVSA-N 1 1 357.385 2.984 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601446710 520790437 /nfs/dbraw/zinc/79/04/37/520790437.db2.gz AQPFDIILWLMOTE-CZUORRHYSA-N 1 1 357.385 2.984 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901308 520808062 /nfs/dbraw/zinc/80/80/62/520808062.db2.gz VFKAADMCWJQREO-INIZCTEOSA-N 1 1 360.458 2.553 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)C(=O)Nc1ccccc1 ZINC000610844314 520867051 /nfs/dbraw/zinc/86/70/51/520867051.db2.gz HOAJXXBJCFUXOD-UHFFFAOYSA-N 1 1 370.409 2.849 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[N@H+]1CCc2ccccc2C1 ZINC000596074870 520895568 /nfs/dbraw/zinc/89/55/68/520895568.db2.gz IRMPDXSUOIOFBG-ZDUSSCGKSA-N 1 1 354.410 2.552 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596160219 520945874 /nfs/dbraw/zinc/94/58/74/520945874.db2.gz BEXFBBZZSRQGTP-CABZTGNLSA-N 1 1 353.806 2.929 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000611088284 520980028 /nfs/dbraw/zinc/98/00/28/520980028.db2.gz NTQGVPPXXFETKN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000611088284 520980034 /nfs/dbraw/zinc/98/00/34/520980034.db2.gz NTQGVPPXXFETKN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000611092120 520980860 /nfs/dbraw/zinc/98/08/60/520980860.db2.gz JDHZPBLESAPXLX-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000611104577 520986022 /nfs/dbraw/zinc/98/60/22/520986022.db2.gz OXWYCNCHRJSWJY-QWHCGFSZSA-N 1 1 353.785 2.978 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000611104577 520986030 /nfs/dbraw/zinc/98/60/30/520986030.db2.gz OXWYCNCHRJSWJY-QWHCGFSZSA-N 1 1 353.785 2.978 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000596251679 520995165 /nfs/dbraw/zinc/99/51/65/520995165.db2.gz WAOKMAYHVHASGS-UHFFFAOYSA-N 1 1 362.430 2.540 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596258361 520998360 /nfs/dbraw/zinc/99/83/60/520998360.db2.gz ZLHUBICODDCBLR-LLVKDONJSA-N 1 1 355.822 2.955 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596258361 520998365 /nfs/dbraw/zinc/99/83/65/520998365.db2.gz ZLHUBICODDCBLR-LLVKDONJSA-N 1 1 355.822 2.955 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000593479349 521020877 /nfs/dbraw/zinc/02/08/77/521020877.db2.gz BGSQTHKUDSVKHU-UHFFFAOYSA-N 1 1 364.490 2.817 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000596309473 521021922 /nfs/dbraw/zinc/02/19/22/521021922.db2.gz SCQPTKQUJMMZDU-CYBMUJFWSA-N 1 1 366.437 2.855 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CC[N@@H+]1Cc1ccc(OC)cc1 ZINC000599139369 521051189 /nfs/dbraw/zinc/05/11/89/521051189.db2.gz LCJCIFXLZFTGIT-OAHLLOKOSA-N 1 1 359.430 2.815 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1Cc1ccc(OC)cc1 ZINC000599139369 521051196 /nfs/dbraw/zinc/05/11/96/521051196.db2.gz LCJCIFXLZFTGIT-OAHLLOKOSA-N 1 1 359.430 2.815 20 5 FFBDMO CC[N@H+](CC(=O)N(C)C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000611254588 521060302 /nfs/dbraw/zinc/06/03/02/521060302.db2.gz VDGHEVFEALSDIS-UHFFFAOYSA-N 1 1 361.398 2.774 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000611254588 521060305 /nfs/dbraw/zinc/06/03/05/521060305.db2.gz VDGHEVFEALSDIS-UHFFFAOYSA-N 1 1 361.398 2.774 20 5 FFBDMO CCN(C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000596585184 521146526 /nfs/dbraw/zinc/14/65/26/521146526.db2.gz DYVLRRKUAOCENE-CYBMUJFWSA-N 1 1 374.363 2.849 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC([N@@H+]3CC[C@@H](O)C3)C2)s1 ZINC000593680122 521151327 /nfs/dbraw/zinc/15/13/27/521151327.db2.gz PTFAPYVDGQBLDM-CQSZACIVSA-N 1 1 359.451 2.574 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC([N@H+]3CC[C@@H](O)C3)C2)s1 ZINC000593680122 521151333 /nfs/dbraw/zinc/15/13/33/521151333.db2.gz PTFAPYVDGQBLDM-CQSZACIVSA-N 1 1 359.451 2.574 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000593714140 521169967 /nfs/dbraw/zinc/16/99/67/521169967.db2.gz MYRDOQRDIXUYJY-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772758 521206166 /nfs/dbraw/zinc/20/61/66/521206166.db2.gz ZNFGYSFPJDNOOQ-CFVMTHIKSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772758 521206174 /nfs/dbraw/zinc/20/61/74/521206174.db2.gz ZNFGYSFPJDNOOQ-CFVMTHIKSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772758 521206191 /nfs/dbraw/zinc/20/61/91/521206191.db2.gz ZNFGYSFPJDNOOQ-CFVMTHIKSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772758 521206195 /nfs/dbraw/zinc/20/61/95/521206195.db2.gz ZNFGYSFPJDNOOQ-CFVMTHIKSA-N 1 1 371.441 2.750 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000611543827 521212156 /nfs/dbraw/zinc/21/21/56/521212156.db2.gz KCXDUPVNHHGEIO-WFASDCNBSA-N 1 1 367.471 2.546 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000611543827 521212162 /nfs/dbraw/zinc/21/21/62/521212162.db2.gz KCXDUPVNHHGEIO-WFASDCNBSA-N 1 1 367.471 2.546 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000602291270 521262850 /nfs/dbraw/zinc/26/28/50/521262850.db2.gz KMMMPWIRIWFLBW-YJBOKZPZSA-N 1 1 357.454 2.959 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](N4CCOCC4)C3)co2)cc1 ZINC000593996033 521337177 /nfs/dbraw/zinc/33/71/77/521337177.db2.gz HOUQCZUHAAQMQR-GOSISDBHSA-N 1 1 372.425 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](N4CCOCC4)C3)co2)cc1 ZINC000593996033 521337184 /nfs/dbraw/zinc/33/71/84/521337184.db2.gz HOUQCZUHAAQMQR-GOSISDBHSA-N 1 1 372.425 2.546 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccc(=O)[nH]n1 ZINC000599640399 521353214 /nfs/dbraw/zinc/35/32/14/521353214.db2.gz DQKIIXBHYIJRDQ-INIZCTEOSA-N 1 1 371.397 2.565 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611828822 521354471 /nfs/dbraw/zinc/35/44/71/521354471.db2.gz WXGKIQPGFMOLEZ-CQSZACIVSA-N 1 1 350.419 2.989 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(Oc2ncc(C)cn2)CC1 ZINC000594021339 521356197 /nfs/dbraw/zinc/35/61/97/521356197.db2.gz SEOYYWMMYUEHQC-UHFFFAOYSA-N 1 1 358.398 2.745 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594099875 521403385 /nfs/dbraw/zinc/40/33/85/521403385.db2.gz WTCBAIQXUVGWIL-SOUVJXGZSA-N 1 1 363.458 2.748 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594099875 521403393 /nfs/dbraw/zinc/40/33/93/521403393.db2.gz WTCBAIQXUVGWIL-SOUVJXGZSA-N 1 1 363.458 2.748 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(Cc3cc(Br)c([N+](=O)[O-])s3)[C@H]2C1 ZINC000602592403 521429604 /nfs/dbraw/zinc/42/96/04/521429604.db2.gz QWUKHRIZZNYFOB-SKDRFNHKSA-N 1 1 360.277 2.945 20 5 FFBDMO Cn1ncc(C2CCC2)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000597015785 521446996 /nfs/dbraw/zinc/44/69/96/521446996.db2.gz XVVLGIXTWJJGIO-CQSZACIVSA-N 1 1 356.430 2.677 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599768817 521458517 /nfs/dbraw/zinc/45/85/17/521458517.db2.gz NJBXFDXGBRQCGJ-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000594198715 521465238 /nfs/dbraw/zinc/46/52/38/521465238.db2.gz VFPGQRSUYZPBKF-ZBFHGGJFSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn(C[C@H]4CCOC4)nn3)C2)cc1 ZINC000602686596 521479172 /nfs/dbraw/zinc/47/91/72/521479172.db2.gz XULPULULSIWRCD-NVXWUHKLSA-N 1 1 371.441 2.602 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn(C[C@H]4CCOC4)nn3)C2)cc1 ZINC000602686596 521479181 /nfs/dbraw/zinc/47/91/81/521479181.db2.gz XULPULULSIWRCD-NVXWUHKLSA-N 1 1 371.441 2.602 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597091961 521498552 /nfs/dbraw/zinc/49/85/52/521498552.db2.gz HULQDHKBQILLKA-AAEUAGOBSA-N 1 1 367.837 2.969 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)C2)C1 ZINC000597093866 521499649 /nfs/dbraw/zinc/49/96/49/521499649.db2.gz ZAGNQXADIPYIRD-INIZCTEOSA-N 1 1 367.837 2.780 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@@H]2C1 ZINC000599836981 521502736 /nfs/dbraw/zinc/50/27/36/521502736.db2.gz BBRWDKFONHTJRM-YVEFUNNKSA-N 1 1 355.398 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(O[C@@H]4CCOC4)cc3)nc2c1 ZINC000597114914 521516239 /nfs/dbraw/zinc/51/62/39/521516239.db2.gz CNKHILDMIJGEQZ-MRXNPFEDSA-N 1 1 368.393 2.929 20 5 FFBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)nc2c1 ZINC000602801610 521539966 /nfs/dbraw/zinc/53/99/66/521539966.db2.gz XKEOXHJSWKIPSM-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000602801610 521539973 /nfs/dbraw/zinc/53/99/73/521539973.db2.gz XKEOXHJSWKIPSM-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000602801610 521539981 /nfs/dbraw/zinc/53/99/81/521539981.db2.gz XKEOXHJSWKIPSM-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH+]2CCC(O)(CO)CC2)cc1[N+](=O)[O-] ZINC000597207286 521575238 /nfs/dbraw/zinc/57/52/38/521575238.db2.gz URYIOPYMUKXQMV-UHFFFAOYSA-N 1 1 371.437 2.682 20 5 FFBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826202139 609331100 /nfs/dbraw/zinc/33/11/00/609331100.db2.gz PJCFTLFAFUODSY-SNVBAGLBSA-N 1 1 372.360 2.773 20 5 FFBDMO O=[N+]([O-])c1ccnc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)c1 ZINC001164700290 719886933 /nfs/dbraw/zinc/88/69/33/719886933.db2.gz JFTIBCGCUXXOMY-UHFFFAOYSA-N 1 1 374.466 2.923 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc2[nH]ccc21 ZINC001164732945 720412162 /nfs/dbraw/zinc/41/21/62/720412162.db2.gz OWDBUASTGOEGRH-HOTGVXAUSA-N 1 1 364.409 2.719 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783325 721391126 /nfs/dbraw/zinc/39/11/26/721391126.db2.gz HJYXPIBKKLFFBN-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783325 721391127 /nfs/dbraw/zinc/39/11/27/721391127.db2.gz HJYXPIBKKLFFBN-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783490 721391462 /nfs/dbraw/zinc/39/14/62/721391462.db2.gz IMPAPVYOHWXUID-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164783490 721391465 /nfs/dbraw/zinc/39/14/65/721391465.db2.gz IMPAPVYOHWXUID-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164786259 721413822 /nfs/dbraw/zinc/41/38/22/721413822.db2.gz ORGQKABLDAKTPJ-KBPBESRZSA-N 1 1 359.455 2.631 20 5 FFBDMO Cc1c(C)c(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001164788336 721413848 /nfs/dbraw/zinc/41/38/48/721413848.db2.gz SDKVCAFDUTUPQX-OKILXGFUSA-N 1 1 359.455 2.631 20 5 FFBDMO Cc1c(C)c(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001164788336 721413852 /nfs/dbraw/zinc/41/38/52/721413852.db2.gz SDKVCAFDUTUPQX-OKILXGFUSA-N 1 1 359.455 2.631 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1CCOCC1 ZINC000155784816 728836090 /nfs/dbraw/zinc/83/60/90/728836090.db2.gz GNPALBBBPKIKFG-LLVKDONJSA-N 1 1 355.822 2.934 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H](Cc3nccs3)C1)OCCO2 ZINC000898071788 735310204 /nfs/dbraw/zinc/31/02/04/735310204.db2.gz SQAIOWXDKIQNKJ-GFCCVEGCSA-N 1 1 361.423 2.887 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000744345424 735350788 /nfs/dbraw/zinc/35/07/88/735350788.db2.gz OIKCLZVCMDAGBE-LBPRGKRZSA-N 1 1 360.439 2.932 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000110508287 728532129 /nfs/dbraw/zinc/53/21/29/728532129.db2.gz AFYJQGYSHHKINB-JTQLQIEISA-N 1 1 365.402 2.733 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](CN3CCOCC3)C2)c1 ZINC000172180342 729021067 /nfs/dbraw/zinc/02/10/67/729021067.db2.gz GTUADNNRBVHZDR-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](CN3CCOCC3)C2)c1 ZINC000172180342 729021070 /nfs/dbraw/zinc/02/10/70/729021070.db2.gz GTUADNNRBVHZDR-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860053967 730474402 /nfs/dbraw/zinc/47/44/02/730474402.db2.gz DZKKFVZFFATLTI-VHSXEESVSA-N 1 1 350.400 2.738 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CCC[N@H+]1CCOC ZINC000861036123 730569708 /nfs/dbraw/zinc/56/97/08/730569708.db2.gz ULAMVSUESMGGNF-AWEZNQCLSA-N 1 1 368.455 2.974 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000865151663 730918790 /nfs/dbraw/zinc/91/87/90/730918790.db2.gz TWUYICLWCWTPFT-UHFFFAOYSA-N 1 1 370.247 2.500 20 5 FFBDMO C[C@]([NH3+])(C(=O)N(CCC(F)(F)F)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000867966109 731246686 /nfs/dbraw/zinc/24/66/86/731246686.db2.gz LLRSIZDAJCQYNM-OAHLLOKOSA-N 1 1 359.348 2.960 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+](CC(C)(C)O)C1 ZINC000872090317 731728716 /nfs/dbraw/zinc/72/87/16/731728716.db2.gz AORQSICNSQBRMN-STQMWFEESA-N 1 1 353.488 2.813 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+](CC(C)(C)O)C1 ZINC000872090317 731728721 /nfs/dbraw/zinc/72/87/21/731728721.db2.gz AORQSICNSQBRMN-STQMWFEESA-N 1 1 353.488 2.813 20 5 FFBDMO CSC1CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000872628227 731802936 /nfs/dbraw/zinc/80/29/36/731802936.db2.gz RCMJYMGJHGOZRG-UHFFFAOYSA-N 1 1 350.444 2.622 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])cnc43)C2)n1 ZINC000872806085 731834042 /nfs/dbraw/zinc/83/40/42/731834042.db2.gz IREYRFOSVHZYFO-GFCCVEGCSA-N 1 1 358.427 2.860 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C[C@H]1CCOC1 ZINC000878168898 732492241 /nfs/dbraw/zinc/49/22/41/732492241.db2.gz WYNRFXWFKRMXFS-SNVBAGLBSA-N 1 1 352.778 2.767 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879556931 732721840 /nfs/dbraw/zinc/72/18/40/732721840.db2.gz AKPKEHGPFBTCTL-OLZOCXBDSA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879556931 732721842 /nfs/dbraw/zinc/72/18/42/732721842.db2.gz AKPKEHGPFBTCTL-OLZOCXBDSA-N 1 1 365.455 2.617 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](C(F)(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000880052278 732833736 /nfs/dbraw/zinc/83/37/36/732833736.db2.gz HMXDLFUSHKZVHK-CYBMUJFWSA-N 1 1 361.320 2.577 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000880166865 732858737 /nfs/dbraw/zinc/85/87/37/732858737.db2.gz FXNREIGOJORHQV-UHFFFAOYSA-N 1 1 357.332 2.858 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCN1 ZINC000880166865 732858741 /nfs/dbraw/zinc/85/87/41/732858741.db2.gz FXNREIGOJORHQV-UHFFFAOYSA-N 1 1 357.332 2.858 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](C3OCCO3)C2)c1Br ZINC000719025953 734377045 /nfs/dbraw/zinc/37/70/45/734377045.db2.gz XCZMYGIBZKNCLJ-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](C3OCCO3)C2)c1Br ZINC000719025953 734377048 /nfs/dbraw/zinc/37/70/48/734377048.db2.gz XCZMYGIBZKNCLJ-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000719025849 734377102 /nfs/dbraw/zinc/37/71/02/734377102.db2.gz VVPLLMLBKSISKZ-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000719025849 734377105 /nfs/dbraw/zinc/37/71/05/734377105.db2.gz VVPLLMLBKSISKZ-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000726187989 734412686 /nfs/dbraw/zinc/41/26/86/734412686.db2.gz JXROWPKJLWTKHO-CYBMUJFWSA-N 1 1 373.450 2.667 20 5 FFBDMO COCc1cc(C[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])ccc1F ZINC000892886837 734618341 /nfs/dbraw/zinc/61/83/41/734618341.db2.gz YFDGTQYLXLPHPW-UHFFFAOYSA-N 1 1 350.346 2.884 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)O[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000783924946 738849608 /nfs/dbraw/zinc/84/96/08/738849608.db2.gz RZGWLGGSMKGSKN-GUYCJALGSA-N 1 1 350.415 2.992 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cccc1C(F)(F)F ZINC000897216014 735207182 /nfs/dbraw/zinc/20/71/82/735207182.db2.gz GRBYLLJFFFBNES-QWHCGFSZSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO ZINC000897220405 735207904 /nfs/dbraw/zinc/20/79/04/735207904.db2.gz ASLDRYCVEADEEZ-CHWSQXEVSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cc1C(F)(F)F ZINC000897221198 735207971 /nfs/dbraw/zinc/20/79/71/735207971.db2.gz JFFGCOWIDLFFBF-LSDHHAIUSA-N 1 1 359.348 2.649 20 5 FFBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000752252409 735971316 /nfs/dbraw/zinc/97/13/16/735971316.db2.gz XSNMNACOPVQPFL-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO NC(=[NH+]OCc1c(Br)cccc1[N+](=O)[O-])C1CCOCC1 ZINC000902710248 735984765 /nfs/dbraw/zinc/98/47/65/735984765.db2.gz BJKQNULHBMIXOS-UHFFFAOYSA-N 1 1 358.192 2.782 20 5 FFBDMO CO[C@]1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCSC1 ZINC000903314410 736074457 /nfs/dbraw/zinc/07/44/57/736074457.db2.gz NHFOOVVNVHAQCR-RDJZCZTQSA-N 1 1 362.455 2.529 20 5 FFBDMO COc1cc(CN2CCC(C(C)(C)C[NH3+])CC2)c([N+](=O)[O-])cc1OC ZINC000904444996 736252860 /nfs/dbraw/zinc/25/28/60/736252860.db2.gz UXHIVSWEMBXUNY-UHFFFAOYSA-N 1 1 351.447 2.809 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000756950818 736376383 /nfs/dbraw/zinc/37/63/83/736376383.db2.gz DOHOJLHVVNGDDU-LLVKDONJSA-N 1 1 352.822 2.532 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756951475 736376390 /nfs/dbraw/zinc/37/63/90/736376390.db2.gz RTJQWQQVZRNXDQ-GFCCVEGCSA-N 1 1 354.838 2.778 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000758905886 736530793 /nfs/dbraw/zinc/53/07/93/736530793.db2.gz XSWFEOQEBHEQQW-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000908358120 736763310 /nfs/dbraw/zinc/76/33/10/736763310.db2.gz LLHJHVCMXNKMBO-NSHDSACASA-N 1 1 366.849 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)c([N+](=O)[O-])c1 ZINC000763377430 736932971 /nfs/dbraw/zinc/93/29/71/736932971.db2.gz YBJCPMZOOKAITQ-ZFWWWQNUSA-N 1 1 350.375 2.558 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000910285587 737053240 /nfs/dbraw/zinc/05/32/40/737053240.db2.gz SGUFUOJAIJBKQL-GFCCVEGCSA-N 1 1 367.471 2.882 20 5 FFBDMO C[C@](O)(C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1)C(F)(F)F ZINC000767903885 737381111 /nfs/dbraw/zinc/38/11/11/737381111.db2.gz UVOBHSLAYRLFRM-GJZGRUSLSA-N 1 1 362.348 2.654 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc(Br)ncc1[N+](=O)[O-] ZINC000769826579 737570993 /nfs/dbraw/zinc/57/09/93/737570993.db2.gz UMGGUAAYWJUCGQ-UHFFFAOYSA-N 1 1 369.175 2.504 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000771938831 737768075 /nfs/dbraw/zinc/76/80/75/737768075.db2.gz QOSZKEBCGFQMEW-JTQLQIEISA-N 1 1 353.762 2.764 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)OCCn2cc[nH+]c2C)cc1SC ZINC000771954064 737769936 /nfs/dbraw/zinc/76/99/36/737769936.db2.gz YBWZNTYOQOGLIH-UHFFFAOYSA-N 1 1 351.384 2.687 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)o1)c1cccc([N+](=O)[O-])c1 ZINC000775537557 738100383 /nfs/dbraw/zinc/10/03/83/738100383.db2.gz ABLNKFWBXCCISA-HNNXBMFYSA-N 1 1 367.427 2.679 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000923279578 738265670 /nfs/dbraw/zinc/26/56/70/738265670.db2.gz QORJZOGTAVBRMV-NWDGAFQWSA-N 1 1 368.231 2.666 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000930318038 739086456 /nfs/dbraw/zinc/08/64/56/739086456.db2.gz ZPSUHYLPKYMRNA-ZFWWWQNUSA-N 1 1 364.471 2.913 20 5 FFBDMO CC(C)(C)OC(=O)NCC[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000932698350 739496814 /nfs/dbraw/zinc/49/68/14/739496814.db2.gz SUTKLNZADUEOQA-ZDUSSCGKSA-N 1 1 350.419 2.727 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000933778388 739688955 /nfs/dbraw/zinc/68/89/55/739688955.db2.gz GVFSWKCCZMRBRN-CQSZACIVSA-N 1 1 351.422 2.857 20 5 FFBDMO CN(C)[S@](C)(=O)=NCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000934761482 739834218 /nfs/dbraw/zinc/83/42/18/739834218.db2.gz YGZRGTSXEWANPZ-RUZDIDTESA-N 1 1 372.466 2.520 20 5 FFBDMO C[C@]12CSC[C@H]1C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC000934765069 739835263 /nfs/dbraw/zinc/83/52/63/739835263.db2.gz BUEUHDNGNHHCCI-BZNIZROVSA-N 1 1 353.419 2.747 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796163888 740110259 /nfs/dbraw/zinc/11/02/59/740110259.db2.gz REIUTKXXDBMXDU-HNNXBMFYSA-N 1 1 351.403 2.574 20 5 FFBDMO Cc1ccc(NCCC[NH+]2CCOCC2)c([N+](=O)[O-])c1Br ZINC000804317780 740860351 /nfs/dbraw/zinc/86/03/51/740860351.db2.gz PSCRUVQVVWCDDC-UHFFFAOYSA-N 1 1 358.236 2.800 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCCc1ccc([N+](=O)[O-])cc1 ZINC000808267993 741204840 /nfs/dbraw/zinc/20/48/40/741204840.db2.gz YLYCLZNUAUFBIH-UHFFFAOYSA-N 1 1 352.391 2.551 20 5 FFBDMO CC(C)[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1Cl ZINC000809837372 741351965 /nfs/dbraw/zinc/35/19/65/741351965.db2.gz YTWDPWKUGOGQKD-UHFFFAOYSA-N 1 1 370.258 2.520 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)c1 ZINC000810091430 741384810 /nfs/dbraw/zinc/38/48/10/741384810.db2.gz UUDDONITONDOID-LLVKDONJSA-N 1 1 363.867 2.564 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCCOc2ccccc2[N+](=O)[O-])C1 ZINC000811448752 741523723 /nfs/dbraw/zinc/52/37/23/741523723.db2.gz ZPTSTVYOXAKOOM-QGZVFWFLSA-N 1 1 354.378 2.729 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@H](n4ccnn4)C3)c2c1 ZINC000819897687 742441391 /nfs/dbraw/zinc/44/13/91/742441391.db2.gz RUPMDIXZWAONQB-LBPRGKRZSA-N 1 1 360.399 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@H](n4ccnn4)C3)c2c1 ZINC000819897687 742441392 /nfs/dbraw/zinc/44/13/92/742441392.db2.gz RUPMDIXZWAONQB-LBPRGKRZSA-N 1 1 360.399 2.758 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1nc2ccc([N+](=O)[O-])cc2s1)C(C)C ZINC000828435994 745066326 /nfs/dbraw/zinc/06/63/26/745066326.db2.gz RGOUEZCAAUTSMI-AWEZNQCLSA-N 1 1 366.443 2.794 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)[nH+]1 ZINC000828875733 745130991 /nfs/dbraw/zinc/13/09/91/745130991.db2.gz INQRIQGPMJXBIE-UHFFFAOYSA-N 1 1 350.325 2.727 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000830674413 745402884 /nfs/dbraw/zinc/40/28/84/745402884.db2.gz NELHRCOHXLHSNY-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000830674413 745402888 /nfs/dbraw/zinc/40/28/88/745402888.db2.gz NELHRCOHXLHSNY-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839141083 746787077 /nfs/dbraw/zinc/78/70/77/746787077.db2.gz XWJURDJKBWZSLW-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839141083 746787079 /nfs/dbraw/zinc/78/70/79/746787079.db2.gz XWJURDJKBWZSLW-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000839580164 746861386 /nfs/dbraw/zinc/86/13/86/746861386.db2.gz XTLMFCALZMNVFY-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)C1 ZINC000840085204 746995366 /nfs/dbraw/zinc/99/53/66/746995366.db2.gz BRCMXDQVYVGHCX-QGZVFWFLSA-N 1 1 363.849 2.973 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000844439220 748030848 /nfs/dbraw/zinc/03/08/48/748030848.db2.gz VLUQVSSZHHEXHY-INIZCTEOSA-N 1 1 351.353 2.605 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000844439220 748030855 /nfs/dbraw/zinc/03/08/55/748030855.db2.gz VLUQVSSZHHEXHY-INIZCTEOSA-N 1 1 351.353 2.605 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H](C)C[N@H+]1C ZINC000844643564 748062956 /nfs/dbraw/zinc/06/29/56/748062956.db2.gz UHWZZQIAFZEWHX-AXFHLTTASA-N 1 1 370.247 2.910 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000844645107 748063365 /nfs/dbraw/zinc/06/33/65/748063365.db2.gz PNTYUVLNUCUSJK-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000844902199 748131712 /nfs/dbraw/zinc/13/17/12/748131712.db2.gz KZGIVXHBXUNEKP-MRRJBJDNSA-N 1 1 353.850 2.967 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000846929292 748577458 /nfs/dbraw/zinc/57/74/58/748577458.db2.gz KCNZOJYRSCVNCF-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCC[C@@H]1CC[N@@H+](C)C1 ZINC000847823269 748790153 /nfs/dbraw/zinc/79/01/53/748790153.db2.gz KIAPLDUGCLXZBK-ZDUSSCGKSA-N 1 1 368.455 2.832 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000848920975 749034799 /nfs/dbraw/zinc/03/47/99/749034799.db2.gz NEDUCIIMTUERHX-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO CCCCCCNC(=O)[C@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000851741881 749658139 /nfs/dbraw/zinc/65/81/39/749658139.db2.gz OJBKDWPOHHXRQJ-AWEZNQCLSA-N 1 1 352.435 2.800 20 5 FFBDMO CCCCCCNC(=O)[C@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000851741881 749658140 /nfs/dbraw/zinc/65/81/40/749658140.db2.gz OJBKDWPOHHXRQJ-AWEZNQCLSA-N 1 1 352.435 2.800 20 5 FFBDMO Cc1noc(C[NH+]2CCC(CNC(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000851834982 749696024 /nfs/dbraw/zinc/69/60/24/749696024.db2.gz ZGTNNMSGVPPMCE-UHFFFAOYSA-N 1 1 354.407 2.628 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CSCc2cccc([N+](=O)[O-])c2Br)C1 ZINC000400798025 845874971 /nfs/dbraw/zinc/87/49/71/845874971.db2.gz OREPDLJBEJNYOL-LLVKDONJSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@@H](CSCc2cccc([N+](=O)[O-])c2Br)C1 ZINC000400798025 845874975 /nfs/dbraw/zinc/87/49/75/845874975.db2.gz OREPDLJBEJNYOL-LLVKDONJSA-N 1 1 361.261 2.921 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000893317713 971570890 /nfs/dbraw/zinc/57/08/90/971570890.db2.gz OJZNSSZFQMQTAM-GOSISDBHSA-N 1 1 362.357 2.542 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759892734 971907083 /nfs/dbraw/zinc/90/70/83/971907083.db2.gz BPRLFOSMYLOLFD-MRXNPFEDSA-N 1 1 352.394 2.628 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)cc1 ZINC001174843395 1013323139 /nfs/dbraw/zinc/32/31/39/1013323139.db2.gz NBDBRCGMDLSDGD-OAHLLOKOSA-N 1 1 371.441 2.754 20 5 FFBDMO Cc1ccc(F)c(C[NH+]2CCC(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001270111319 964699259 /nfs/dbraw/zinc/69/92/59/964699259.db2.gz MQDJNYUINXWZDG-SJLPKXTDSA-N 1 1 363.433 2.518 20 5 FFBDMO CC(C)C[C@@H](C(N)=O)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001175650523 1013523199 /nfs/dbraw/zinc/52/31/99/1013523199.db2.gz GOQAHZFNPUPZNE-ZDUSSCGKSA-N 1 1 358.236 2.689 20 5 FFBDMO CC(C)C[C@@H](C(N)=O)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001175650523 1013523207 /nfs/dbraw/zinc/52/32/07/1013523207.db2.gz GOQAHZFNPUPZNE-ZDUSSCGKSA-N 1 1 358.236 2.689 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000236842598 965748954 /nfs/dbraw/zinc/74/89/54/965748954.db2.gz JPHNYSRPUKDFPI-IYBDPMFKSA-N 1 1 365.474 2.973 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000072073652 966229715 /nfs/dbraw/zinc/22/97/15/966229715.db2.gz DNHFMZJZPDDQPM-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000072073652 966229722 /nfs/dbraw/zinc/22/97/22/966229722.db2.gz DNHFMZJZPDDQPM-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3cc(C4CC4)[nH]n3)CC2)cc1 ZINC000189725435 969929224 /nfs/dbraw/zinc/92/92/24/969929224.db2.gz BTOUDHGNYSCCMV-UHFFFAOYSA-N 1 1 371.441 2.786 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC000892857315 970332825 /nfs/dbraw/zinc/33/28/25/970332825.db2.gz WVBHWSNWEFUYCX-KGLIPLIRSA-N 1 1 356.426 2.510 20 5 FFBDMO C[C@@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000893011138 970496407 /nfs/dbraw/zinc/49/64/07/970496407.db2.gz CCLNHBAURYZXJZ-CHWSQXEVSA-N 1 1 359.430 2.806 20 5 FFBDMO CCCC(=O)NC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898525 976852200 /nfs/dbraw/zinc/85/22/00/976852200.db2.gz YXGNQHRMIJVUDN-UHFFFAOYSA-N 1 1 371.441 2.797 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000899199335 977009380 /nfs/dbraw/zinc/00/93/80/977009380.db2.gz HDNQCHXQMVLBMW-CVEARBPZSA-N 1 1 354.410 2.639 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796601190 1014569697 /nfs/dbraw/zinc/56/96/97/1014569697.db2.gz IIYUAPRMWUIUKY-SFHVURJKSA-N 1 1 363.458 2.741 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796601190 1014569703 /nfs/dbraw/zinc/56/97/03/1014569703.db2.gz IIYUAPRMWUIUKY-SFHVURJKSA-N 1 1 363.458 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000249107231 979415523 /nfs/dbraw/zinc/41/55/23/979415523.db2.gz QPNIVJNVDXWCPE-YWPYICTPSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000249107231 979415526 /nfs/dbraw/zinc/41/55/26/979415526.db2.gz QPNIVJNVDXWCPE-YWPYICTPSA-N 1 1 374.397 2.837 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000156448647 984333519 /nfs/dbraw/zinc/33/35/19/984333519.db2.gz PGTGQOLTQUKYKZ-CVEARBPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123195 984969465 /nfs/dbraw/zinc/96/94/65/984969465.db2.gz HLDMTKPPCNBRGJ-HOTGVXAUSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123195 984969470 /nfs/dbraw/zinc/96/94/70/984969470.db2.gz HLDMTKPPCNBRGJ-HOTGVXAUSA-N 1 1 363.414 2.986 20 5 FFBDMO CCCc1ccc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000997770899 985735630 /nfs/dbraw/zinc/73/56/30/985735630.db2.gz ALRZMWXCLSAPQX-RTBURBONSA-N 1 1 359.470 2.633 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]2CC1 ZINC000946589352 988765730 /nfs/dbraw/zinc/76/57/30/988765730.db2.gz UOGWFTHQQXCLBC-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]2CC1 ZINC000946589352 988765738 /nfs/dbraw/zinc/76/57/38/988765738.db2.gz UOGWFTHQQXCLBC-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]2CC1 ZINC000946589352 988765746 /nfs/dbraw/zinc/76/57/46/988765746.db2.gz UOGWFTHQQXCLBC-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]1[C@H](O)c1ccccc1 ZINC000879244545 1015434505 /nfs/dbraw/zinc/43/45/05/1015434505.db2.gz QZKMEIVRRIXDRB-YVWKXTFCSA-N 1 1 372.421 2.533 20 5 FFBDMO C[NH+]1CCC2(CCN([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)CC1 ZINC000879249756 1015438885 /nfs/dbraw/zinc/43/88/85/1015438885.db2.gz AGWSADDUECGUSA-GOSISDBHSA-N 1 1 372.469 2.508 20 5 FFBDMO COc1cccc(C(=O)NCCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000193989614 989120228 /nfs/dbraw/zinc/12/02/28/989120228.db2.gz NTJZOLQFAHYAFO-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC001005383707 989741088 /nfs/dbraw/zinc/74/10/88/989741088.db2.gz VNTDLNMVLYTIFL-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000919853784 990747433 /nfs/dbraw/zinc/74/74/33/990747433.db2.gz SFSPKGSXQAVTLE-TWGQIWQCSA-N 1 1 363.377 2.814 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000068964534 991554233 /nfs/dbraw/zinc/55/42/33/991554233.db2.gz WTGMSBILBVZYGG-GOEBONIOSA-N 1 1 373.457 2.919 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccccc2Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001485450738 991943230 /nfs/dbraw/zinc/94/32/30/991943230.db2.gz MCKUIQXZGYIAPQ-GDBMZVCRSA-N 1 1 365.861 2.914 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000880030648 1015738687 /nfs/dbraw/zinc/73/86/87/1015738687.db2.gz AINMSBNCFIKRGE-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C ZINC000880489243 1015849092 /nfs/dbraw/zinc/84/90/92/1015849092.db2.gz QURAGYRGHLYSEG-WMGCDEKXSA-N 1 1 373.453 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](O)CC3(CCOCC3)C2)c1 ZINC000880584306 1015877922 /nfs/dbraw/zinc/87/79/22/1015877922.db2.gz HVRGKHBDRMWHHL-CQSZACIVSA-N 1 1 374.359 2.977 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2C[C@H](O)CC3(CCOCC3)C2)c1 ZINC000880584306 1015877927 /nfs/dbraw/zinc/87/79/27/1015877927.db2.gz HVRGKHBDRMWHHL-CQSZACIVSA-N 1 1 374.359 2.977 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851772 995553317 /nfs/dbraw/zinc/55/33/17/995553317.db2.gz ZAOFRHXBPWJBEL-KNBMTAEXSA-N 1 1 374.437 2.779 20 5 FFBDMO CCCn1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173258 995634614 /nfs/dbraw/zinc/63/46/14/995634614.db2.gz WUDWPDNTQHVALZ-KRWDZBQOSA-N 1 1 358.398 2.633 20 5 FFBDMO CCCn1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173258 995634618 /nfs/dbraw/zinc/63/46/18/995634618.db2.gz WUDWPDNTQHVALZ-KRWDZBQOSA-N 1 1 358.398 2.633 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001136839292 996846316 /nfs/dbraw/zinc/84/63/16/996846316.db2.gz DHPBPWJPGZARKY-ZDUSSCGKSA-N 1 1 356.426 2.744 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825389876 997333582 /nfs/dbraw/zinc/33/35/82/997333582.db2.gz VZPUTLMCUBYERC-LJHODMEESA-N 1 1 369.421 2.580 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)CC[C@@H]21 ZINC000827277682 1016124472 /nfs/dbraw/zinc/12/44/72/1016124472.db2.gz OFLVQJLQUYSQLA-YWZLYKJASA-N 1 1 361.445 2.848 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000844021577 997588191 /nfs/dbraw/zinc/58/81/91/997588191.db2.gz COIJRTBSEIWCHM-YIMOIBLRSA-N 1 1 361.442 2.566 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)[C@@H]1CCCO1 ZINC001119856255 998358706 /nfs/dbraw/zinc/35/87/06/998358706.db2.gz PGVSTCNUTUTPOY-KGLIPLIRSA-N 1 1 359.220 2.641 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000732165173 998498115 /nfs/dbraw/zinc/49/81/15/998498115.db2.gz CTWKVROQQZJTEA-KRWDZBQOSA-N 1 1 372.469 2.894 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000845735484 998641879 /nfs/dbraw/zinc/64/18/79/998641879.db2.gz NFDVLYCYIMPAQG-HNNXBMFYSA-N 1 1 358.398 2.810 20 5 FFBDMO O=[N+]([O-])c1ccccc1CN[C@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC000733898732 999127356 /nfs/dbraw/zinc/12/73/56/999127356.db2.gz TXLCVWCILQDROA-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1ccccc1CN[C@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000733898732 999127358 /nfs/dbraw/zinc/12/73/58/999127358.db2.gz TXLCVWCILQDROA-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO C[C@@H]1CCCCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000738227502 999623288 /nfs/dbraw/zinc/62/32/88/999623288.db2.gz WJRVSIPOHKONQV-FZKQIMNGSA-N 1 1 360.414 2.584 20 5 FFBDMO CCN(CC[NH2+]Cc1c(C)c(C)c(C)c(C)c1C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273374185 999688146 /nfs/dbraw/zinc/68/81/46/999688146.db2.gz HDKPAABFUWZXDA-IEBWSBKVSA-N 1 1 361.486 2.832 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741033367 999701880 /nfs/dbraw/zinc/70/18/80/999701880.db2.gz QQODHQLKVIDNBD-KBPBESRZSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741017037 999702499 /nfs/dbraw/zinc/70/24/99/999702499.db2.gz LTXKLUMLVIPVRP-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741017037 999702502 /nfs/dbraw/zinc/70/25/02/999702502.db2.gz LTXKLUMLVIPVRP-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO Cc1nn(CN2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000766376522 999989721 /nfs/dbraw/zinc/98/97/21/999989721.db2.gz NZJJPPXONHQCEJ-GJZGRUSLSA-N 1 1 357.458 2.960 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn([C@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168978589 1000012218 /nfs/dbraw/zinc/01/22/18/1000012218.db2.gz SPRUKNASMVVVSC-FRIZHTMISA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCCC[N@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011394 1000015589 /nfs/dbraw/zinc/01/55/89/1000015589.db2.gz KDAJAMMPHBZCJR-HUUCEWRRSA-N 1 1 353.463 2.907 20 5 FFBDMO CCOC(=O)C[N@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038240 1000016752 /nfs/dbraw/zinc/01/67/52/1000016752.db2.gz XIBAIIKFMDZTGD-HOTGVXAUSA-N 1 1 350.415 2.506 20 5 FFBDMO CCOC(=O)C[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038240 1000016753 /nfs/dbraw/zinc/01/67/53/1000016753.db2.gz XIBAIIKFMDZTGD-HOTGVXAUSA-N 1 1 350.415 2.506 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)s1 ZINC001169020113 1000017419 /nfs/dbraw/zinc/01/74/19/1000017419.db2.gz IHYJSKMSQPNCNN-IIDMSEBBSA-N 1 1 363.483 2.931 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019195 1000017561 /nfs/dbraw/zinc/01/75/61/1000017561.db2.gz FJIHNJWRMDVLAJ-ZPKKHLQPSA-N 1 1 361.442 2.528 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019188 1000017652 /nfs/dbraw/zinc/01/76/52/1000017652.db2.gz FJIHNJWRMDVLAJ-BHEBFOIGSA-N 1 1 361.442 2.528 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2C[C@@H]3COC[C@]3(COCC3CCCC3)C2)C1 ZINC001169025800 1000018291 /nfs/dbraw/zinc/01/82/91/1000018291.db2.gz VJGAENBQOIRTFY-ZSYWTGECSA-N 1 1 352.475 2.587 20 5 FFBDMO CCOC(=O)c1cccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)n1 ZINC001169878094 1000081356 /nfs/dbraw/zinc/08/13/56/1000081356.db2.gz YRERRTTVGCMRDG-UHFFFAOYSA-N 1 1 370.409 2.767 20 5 FFBDMO CCOC(=O)c1cccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)n1 ZINC001169878094 1000081358 /nfs/dbraw/zinc/08/13/58/1000081358.db2.gz YRERRTTVGCMRDG-UHFFFAOYSA-N 1 1 370.409 2.767 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)c([N+](=O)[O-])c1 ZINC001147330724 1000872569 /nfs/dbraw/zinc/87/25/69/1000872569.db2.gz CJAOBOIGJWJMTN-DOTOQJQBSA-N 1 1 360.458 2.838 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C[C@@H]1C ZINC001147743445 1000968593 /nfs/dbraw/zinc/96/85/93/1000968593.db2.gz WHNFEBQMYNFJOJ-QWHCGFSZSA-N 1 1 366.437 2.745 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[NH+]([C@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC001148140012 1001042682 /nfs/dbraw/zinc/04/26/82/1001042682.db2.gz HHHUJPRQVGVUPR-MRXNPFEDSA-N 1 1 371.441 2.789 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[NH+]([C@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC001148140012 1001042686 /nfs/dbraw/zinc/04/26/86/1001042686.db2.gz HHHUJPRQVGVUPR-MRXNPFEDSA-N 1 1 371.441 2.789 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC001149018220 1001250720 /nfs/dbraw/zinc/25/07/20/1001250720.db2.gz JBNHZWJSBOGURR-HNNXBMFYSA-N 1 1 361.442 2.797 20 5 FFBDMO Cc1cc(F)ccc1[C@@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000746652949 1001670400 /nfs/dbraw/zinc/67/04/00/1001670400.db2.gz IRHRBZVDEOJMTE-IBGZPJMESA-N 1 1 359.401 2.898 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000788113766 1001763474 /nfs/dbraw/zinc/76/34/74/1001763474.db2.gz BWRPFHAQPZZLTL-CHWSQXEVSA-N 1 1 364.398 2.786 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000774530093 1002000219 /nfs/dbraw/zinc/00/02/19/1002000219.db2.gz ZAXATCVVNDFCFV-GFCCVEGCSA-N 1 1 355.398 2.594 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000790284844 1002319708 /nfs/dbraw/zinc/31/97/08/1002319708.db2.gz IDUKFBXSSNMZJE-AWEZNQCLSA-N 1 1 366.418 2.836 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H]1CC[C@@H](C)C1 ZINC000790477750 1002388224 /nfs/dbraw/zinc/38/82/24/1002388224.db2.gz JHWAFSBIOYLKEK-ZBFHGGJFSA-N 1 1 359.430 2.948 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@@H]21 ZINC001185701247 1003027004 /nfs/dbraw/zinc/02/70/04/1003027004.db2.gz FTCIVELAEORKBH-WBMJQRKESA-N 1 1 371.397 2.972 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC001185746384 1003049001 /nfs/dbraw/zinc/04/90/01/1003049001.db2.gz QVJONPHXGNSDBQ-UHFFFAOYSA-N 1 1 372.816 2.857 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(c3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC001170329946 1003116912 /nfs/dbraw/zinc/11/69/12/1003116912.db2.gz XDLWTKRGVFKDIO-HNNXBMFYSA-N 1 1 356.426 2.752 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(c3ncccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170356262 1003122657 /nfs/dbraw/zinc/12/26/57/1003122657.db2.gz ZXCXPLIHEVQHDY-CQSZACIVSA-N 1 1 374.416 2.891 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@]23CC(=O)N(C)C3)c([N+](=O)[O-])c1 ZINC001170340482 1003130588 /nfs/dbraw/zinc/13/05/88/1003130588.db2.gz MBPQAXMAKZZVGF-KUHUBIRLSA-N 1 1 361.442 2.621 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345854 1003134290 /nfs/dbraw/zinc/13/42/90/1003134290.db2.gz MZYFFZWUTCYGAL-UGSOOPFHSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCN3CC(F)(F)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170351767 1003137225 /nfs/dbraw/zinc/13/72/25/1003137225.db2.gz IIPQWCNLNJQYPS-OCCSQVGLSA-N 1 1 355.385 2.560 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCN3CC(F)(F)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170351767 1003137233 /nfs/dbraw/zinc/13/72/33/1003137233.db2.gz IIPQWCNLNJQYPS-OCCSQVGLSA-N 1 1 355.385 2.560 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCOC[C@H](C4CCC4)C3)n2)c1 ZINC000793747706 1003491891 /nfs/dbraw/zinc/49/18/91/1003491891.db2.gz SASRYPAKPLSFMY-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCOC[C@H](C4CCC4)C3)n2)c1 ZINC000793747706 1003491892 /nfs/dbraw/zinc/49/18/92/1003491892.db2.gz SASRYPAKPLSFMY-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO CC(C)(C)OC(=O)NCC[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000805764564 1004138200 /nfs/dbraw/zinc/13/82/00/1004138200.db2.gz HFWNPTJXMQMSBW-CQSZACIVSA-N 1 1 367.450 2.561 20 5 FFBDMO 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CC(C)[C@H](C)NC(=O)C1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000725786737 1020258251 /nfs/dbraw/zinc/25/82/51/1020258251.db2.gz MLZAMRWSDUQNQU-AWEZNQCLSA-N 1 1 373.457 2.775 20 5 FFBDMO Cc1csc(C[C@H]2CC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])cnc43)C2)n1 ZINC000902540237 1020268906 /nfs/dbraw/zinc/26/89/06/1020268906.db2.gz LJWHLCQCDIZJIH-CYBMUJFWSA-N 1 1 372.454 2.935 20 5 FFBDMO COCCCOC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777956768 1020331114 /nfs/dbraw/zinc/33/11/14/1020331114.db2.gz MMKFHSWENPCAMN-UHFFFAOYSA-N 1 1 374.441 2.933 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963008 1020355909 /nfs/dbraw/zinc/35/59/09/1020355909.db2.gz FORBQYITJLOWBY-APWZRJJASA-N 1 1 355.442 2.832 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@]2(C)C[NH+](C)C[C@@]2(C)C1 ZINC000931308271 1020413841 /nfs/dbraw/zinc/41/38/41/1020413841.db2.gz SEVKWLDOVJRSBW-OALUTQOASA-N 1 1 360.458 2.505 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@H]2C2CCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000726587525 1020490398 /nfs/dbraw/zinc/49/03/98/1020490398.db2.gz SGEOECGKAWNWOF-KRWDZBQOSA-N 1 1 372.425 2.976 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932144532 1020723339 /nfs/dbraw/zinc/72/33/39/1020723339.db2.gz USHQUBXBQDCFHF-ZDUSSCGKSA-N 1 1 357.414 2.535 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](C2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000933081577 1020953396 /nfs/dbraw/zinc/95/33/96/1020953396.db2.gz LHJJYCRDKZEZIM-MRXNPFEDSA-N 1 1 361.442 2.696 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000749601114 1021011789 /nfs/dbraw/zinc/01/17/89/1021011789.db2.gz CBZMWIDRQZHYJC-CQSZACIVSA-N 1 1 367.421 2.884 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(C=Cc3ccccc3O2)C1 ZINC000933657095 1021061683 /nfs/dbraw/zinc/06/16/83/1021061683.db2.gz PTHLRPCDBZCHBJ-HXUWFJFHSA-N 1 1 367.405 2.697 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2Cc3ncccc3N3CCC[C@H]3C2)cc1 ZINC000934491658 1021258975 /nfs/dbraw/zinc/25/89/75/1021258975.db2.gz ZGBPUXYECMXUNW-LPHOPBHVSA-N 1 1 354.410 2.508 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000750603146 1022224179 /nfs/dbraw/zinc/22/41/79/1022224179.db2.gz MWWLJHIQPFKURS-UHFFFAOYSA-N 1 1 368.393 2.967 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000750603146 1022224186 /nfs/dbraw/zinc/22/41/86/1022224186.db2.gz MWWLJHIQPFKURS-UHFFFAOYSA-N 1 1 368.393 2.967 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000778763689 1022335053 /nfs/dbraw/zinc/33/50/53/1022335053.db2.gz XPMOVJFWZDHWJS-UHFFFAOYSA-N 1 1 361.354 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c(Br)c1 ZINC001118846778 1022434924 /nfs/dbraw/zinc/43/49/24/1022434924.db2.gz PYCXNABWSJZEHF-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c(Br)c1 ZINC001118846778 1022434930 /nfs/dbraw/zinc/43/49/30/1022434930.db2.gz PYCXNABWSJZEHF-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC001118913022 1022471196 /nfs/dbraw/zinc/47/11/96/1022471196.db2.gz HZAKGEFNYUKKIY-CYBMUJFWSA-N 1 1 357.414 2.996 20 5 FFBDMO Cc1ccc(C)c(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c1 ZINC001040699503 1022954073 /nfs/dbraw/zinc/95/40/73/1022954073.db2.gz DPPQMQSTNKRULM-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1CN(C)CC[N@@H+]1C ZINC001120960110 1023544325 /nfs/dbraw/zinc/54/43/25/1023544325.db2.gz QUJIQTBXFLJSOU-LRDDRELGSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1CN(C)CC[N@H+]1C ZINC001120960110 1023544332 /nfs/dbraw/zinc/54/43/32/1023544332.db2.gz QUJIQTBXFLJSOU-LRDDRELGSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1C[N@H+](C)CCN1C ZINC001120960110 1023544338 /nfs/dbraw/zinc/54/43/38/1023544338.db2.gz QUJIQTBXFLJSOU-LRDDRELGSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1C[N@@H+](C)CCN1C ZINC001120960110 1023544342 /nfs/dbraw/zinc/54/43/42/1023544342.db2.gz QUJIQTBXFLJSOU-LRDDRELGSA-N 1 1 361.471 2.765 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001123372155 1023765559 /nfs/dbraw/zinc/76/55/59/1023765559.db2.gz LYOJOGZQQIAYLC-HNNXBMFYSA-N 1 1 350.419 2.845 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+]1Cc1ccccn1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000757638223 1023841297 /nfs/dbraw/zinc/84/12/97/1023841297.db2.gz IXVWPQPKEPOFTN-IBGZPJMESA-N 1 1 366.421 2.539 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1Cc1ccccn1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000757638223 1023841300 /nfs/dbraw/zinc/84/13/00/1023841300.db2.gz IXVWPQPKEPOFTN-IBGZPJMESA-N 1 1 366.421 2.539 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000246353606 1026042133 /nfs/dbraw/zinc/04/21/33/1026042133.db2.gz WLHIISUKAAYEHW-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000246353606 1026042151 /nfs/dbraw/zinc/04/21/51/1026042151.db2.gz WLHIISUKAAYEHW-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO CCOC(=O)c1cccc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)n1 ZINC001158893531 1027179527 /nfs/dbraw/zinc/17/95/27/1027179527.db2.gz WRCCVDNBFMGCMT-CMDGGOBGSA-N 1 1 371.397 2.706 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000795643216 1027387035 /nfs/dbraw/zinc/38/70/35/1027387035.db2.gz AADOAUWUAXOTBY-UHFFFAOYSA-N 1 1 355.354 2.985 20 5 FFBDMO CCc1ccccc1C[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001160098090 1027589823 /nfs/dbraw/zinc/58/98/23/1027589823.db2.gz SLCXWUKDLOSDAP-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1ccccc1C[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160098090 1027589835 /nfs/dbraw/zinc/58/98/35/1027589835.db2.gz SLCXWUKDLOSDAP-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1ccccc1C[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160098090 1027589839 /nfs/dbraw/zinc/58/98/39/1027589839.db2.gz SLCXWUKDLOSDAP-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000795750277 1028068861 /nfs/dbraw/zinc/06/88/61/1028068861.db2.gz BLLSGRXTQBUQDU-UHFFFAOYSA-N 1 1 357.414 2.949 20 5 FFBDMO CN(CCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)Cc1ccco1 ZINC000795750277 1028068880 /nfs/dbraw/zinc/06/88/80/1028068880.db2.gz BLLSGRXTQBUQDU-UHFFFAOYSA-N 1 1 357.414 2.949 20 5 FFBDMO CN(CCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)Cc1ccco1 ZINC000795750277 1028068896 /nfs/dbraw/zinc/06/88/96/1028068896.db2.gz BLLSGRXTQBUQDU-UHFFFAOYSA-N 1 1 357.414 2.949 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CCC1CCCC1)CC2 ZINC000957547547 1028323659 /nfs/dbraw/zinc/32/36/59/1028323659.db2.gz IJBJEJLFVHWAIU-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO CCOc1nc(N2CC[N@@H+]3CCc4ccccc4[C@H]3C2)ccc1[N+](=O)[O-] ZINC001155094378 1028576094 /nfs/dbraw/zinc/57/60/94/1028576094.db2.gz ASMYPGOUQGFXBM-QGZVFWFLSA-N 1 1 354.410 2.808 20 5 FFBDMO CCOc1nc(N2CC[N@H+]3CCc4ccccc4[C@H]3C2)ccc1[N+](=O)[O-] ZINC001155094378 1028576104 /nfs/dbraw/zinc/57/61/04/1028576104.db2.gz ASMYPGOUQGFXBM-QGZVFWFLSA-N 1 1 354.410 2.808 20 5 FFBDMO COc1cc(Nc2ccc(N3CCOCC3)[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC001162774027 1028652720 /nfs/dbraw/zinc/65/27/20/1028652720.db2.gz JPVOYLIDHVBONG-UHFFFAOYSA-N 1 1 374.397 2.896 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001163371321 1028908565 /nfs/dbraw/zinc/90/85/65/1028908565.db2.gz ONXQOCOZUPGKEB-JSGCOSHPSA-N 1 1 350.419 2.697 20 5 FFBDMO CN(C)C(=O)CC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000781149260 1029021182 /nfs/dbraw/zinc/02/11/82/1029021182.db2.gz UGASSXRVMXWPGK-UHFFFAOYSA-N 1 1 371.441 2.606 20 5 FFBDMO COc1nc(N2CC[NH+](C/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001163845796 1029087347 /nfs/dbraw/zinc/08/73/47/1029087347.db2.gz QIXWFEMRYKHMSW-VMPITWQZSA-N 1 1 354.410 2.834 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC001164124144 1029179670 /nfs/dbraw/zinc/17/96/70/1029179670.db2.gz BNEGHRNHAWOFPK-JQWIXIFHSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001164124144 1029179674 /nfs/dbraw/zinc/17/96/74/1029179674.db2.gz BNEGHRNHAWOFPK-JQWIXIFHSA-N 1 1 373.276 2.744 20 5 FFBDMO CCc1cc(N2CCC(F)(F)[C@@H]([NH3+])C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164327114 1029247166 /nfs/dbraw/zinc/24/71/66/1029247166.db2.gz LVFQBOIBGAJPLZ-AWEZNQCLSA-N 1 1 363.368 2.787 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])cc1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC001164492478 1029297278 /nfs/dbraw/zinc/29/72/78/1029297278.db2.gz LOXPPCYMPOCDBD-IXDOHACOSA-N 1 1 354.410 2.551 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC001165106826 1029392076 /nfs/dbraw/zinc/39/20/76/1029392076.db2.gz BBQFYKLEJMOJPD-MRXNPFEDSA-N 1 1 371.441 2.618 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[C@@H]([N@@H+](C)C(C)C)C1 ZINC001157001943 1029438399 /nfs/dbraw/zinc/43/83/99/1029438399.db2.gz QTRQBVBOSHGCRM-LLVKDONJSA-N 1 1 370.837 2.739 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)[C@H]2CCCC[C@@H]12 ZINC000782277747 1029637812 /nfs/dbraw/zinc/63/78/12/1029637812.db2.gz RUVBNDZSKGNWKI-COXVUDFISA-N 1 1 372.425 2.831 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](OCC2CC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782549832 1029743056 /nfs/dbraw/zinc/74/30/56/1029743056.db2.gz KBWHONAWLZDVMI-HNNXBMFYSA-N 1 1 365.405 2.954 20 5 FFBDMO C[N@@H+](C[C@H]1CC=CCC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000784011338 1030414373 /nfs/dbraw/zinc/41/43/73/1030414373.db2.gz PNQAFAMAWFKVTE-LIRRHRJNSA-N 1 1 372.425 2.607 20 5 FFBDMO COc1cc(C(=O)OC[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000842836192 1030987642 /nfs/dbraw/zinc/98/76/42/1030987642.db2.gz NFGOWKAIDCSGOQ-ZDUSSCGKSA-N 1 1 366.414 2.889 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CC/C=C/c2ccccc2)CC1 ZINC001205230352 1031613260 /nfs/dbraw/zinc/61/32/60/1031613260.db2.gz OFRZNOORMDGIMC-KDBJMCLYSA-N 1 1 357.454 2.583 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799194741 1031690830 /nfs/dbraw/zinc/69/08/30/1031690830.db2.gz XOVYNJGFFZZRMD-CQSZACIVSA-N 1 1 370.409 2.817 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])CC2 ZINC001205446628 1031753517 /nfs/dbraw/zinc/75/35/17/1031753517.db2.gz MKZCLCURCQUBNI-UHFFFAOYSA-N 1 1 358.394 2.918 20 5 FFBDMO CCc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1 ZINC001115530529 1031787535 /nfs/dbraw/zinc/78/75/35/1031787535.db2.gz BPHMFVLDECYCBP-QZTJIDSGSA-N 1 1 359.470 2.823 20 5 FFBDMO O=C(Nc1cc2cccnc2c2ncccc12)[C@H]1CCC2(CC[NH2+]CC2)N1 ZINC001218979084 1033441170 /nfs/dbraw/zinc/44/11/70/1033441170.db2.gz CSBMKSFHSZPXCD-MRXNPFEDSA-N 1 1 361.449 2.596 20 5 FFBDMO C[C@H](OCc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001224108832 1033718487 /nfs/dbraw/zinc/71/84/87/1033718487.db2.gz LCLQVOJREHMSQE-YJBOKZPZSA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@H](OCc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001224108832 1033718500 /nfs/dbraw/zinc/71/85/00/1033718500.db2.gz LCLQVOJREHMSQE-YJBOKZPZSA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@H](OCc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001224108829 1033718549 /nfs/dbraw/zinc/71/85/49/1033718549.db2.gz LCLQVOJREHMSQE-MAUKXSAKSA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@H](OCc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001224108829 1033718563 /nfs/dbraw/zinc/71/85/63/1033718563.db2.gz LCLQVOJREHMSQE-MAUKXSAKSA-N 1 1 357.410 2.796 20 5 FFBDMO O=C1C[C@H]2C[C@@H](OCc3ccc([N+](=O)[O-])nc3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001224113824 1033720701 /nfs/dbraw/zinc/72/07/01/1033720701.db2.gz KUZSGNDTECUANJ-QXAKKESOSA-N 1 1 367.405 2.881 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCOc2ccccc21 ZINC000831896727 1034389540 /nfs/dbraw/zinc/38/95/40/1034389540.db2.gz WMLKJEOQMCXYEE-INIZCTEOSA-N 1 1 373.384 2.935 20 5 FFBDMO COc1cc(O[C@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC001226579772 1034745777 /nfs/dbraw/zinc/74/57/77/1034745777.db2.gz USSPUCPGHXOVEC-KGLIPLIRSA-N 1 1 358.398 2.998 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001227108096 1034937752 /nfs/dbraw/zinc/93/77/52/1034937752.db2.gz JRGCIWUKZUYQLV-HNNXBMFYSA-N 1 1 358.354 2.941 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000835081527 1035521141 /nfs/dbraw/zinc/52/11/41/1035521141.db2.gz AANSOBYNMRIUEH-INIZCTEOSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000835081527 1035521146 /nfs/dbraw/zinc/52/11/46/1035521146.db2.gz AANSOBYNMRIUEH-INIZCTEOSA-N 1 1 365.430 2.710 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227514916 1035593566 /nfs/dbraw/zinc/59/35/66/1035593566.db2.gz DWCQRYBHSFUWSO-LLVKDONJSA-N 1 1 362.411 2.777 20 5 FFBDMO CCc1cccc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000835457003 1035777367 /nfs/dbraw/zinc/77/73/67/1035777367.db2.gz HNNJYLKBBXGHRZ-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO CCc1cccc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000835457003 1035777383 /nfs/dbraw/zinc/77/73/83/1035777383.db2.gz HNNJYLKBBXGHRZ-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3c4ccccc4c([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001229424972 1036666895 /nfs/dbraw/zinc/66/68/95/1036666895.db2.gz UNJOTWQCECSWJK-UDTVLSCZSA-N 1 1 371.349 2.839 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3c4ccccc4c([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001229424972 1036666903 /nfs/dbraw/zinc/66/69/03/1036666903.db2.gz UNJOTWQCECSWJK-UDTVLSCZSA-N 1 1 371.349 2.839 20 5 FFBDMO C[C@@H](CON)Oc1nc2ccc(NC(=O)C[NH+](C)C)cc2c2ccccc21 ZINC001229806778 1036911411 /nfs/dbraw/zinc/91/14/11/1036911411.db2.gz AVFAVKORCHWOOC-ZDUSSCGKSA-N 1 1 368.437 2.546 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC001208040241 1037966240 /nfs/dbraw/zinc/96/62/40/1037966240.db2.gz FBUIIUOISPUNQA-AWEZNQCLSA-N 1 1 369.487 2.754 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1-c1nc2ccc(N3CC[NH+](C)CC3)cc2[nH]1 ZINC001251438395 1039131661 /nfs/dbraw/zinc/13/16/61/1039131661.db2.gz SRJPKNRQOHRTQM-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO Cc1cccc(Cc2nnc(CC[NH+]3C[C@@H](C)O[C@H](C)C3)o2)c1[N+](=O)[O-] ZINC001258101847 1039173144 /nfs/dbraw/zinc/17/31/44/1039173144.db2.gz NKCYENDXOAJJDN-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(F)c([N+](=O)[O-])c(F)c3)o2)C[C@H](C)O1 ZINC001258146543 1039225810 /nfs/dbraw/zinc/22/58/10/1039225810.db2.gz OKSVCFOCAKGBPC-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(F)cc([N+](=O)[O-])c3F)o2)C[C@H](C)O1 ZINC001258150700 1039231945 /nfs/dbraw/zinc/23/19/45/1039231945.db2.gz BFVZPEBXRAPDLB-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO Cc1cc(F)c(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258154642 1039234529 /nfs/dbraw/zinc/23/45/29/1039234529.db2.gz XLHYQYWJUFBETR-TXEJJXNPSA-N 1 1 364.377 2.744 20 5 FFBDMO C[C@H]1CC[C@H](NC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[NH2+]1 ZINC001246083388 1039238847 /nfs/dbraw/zinc/23/88/47/1039238847.db2.gz HMHAJBLYFBDNRJ-AAEUAGOBSA-N 1 1 354.401 2.572 20 5 FFBDMO C[C@H]1CC[C@@H](CN)[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569308 1039401399 /nfs/dbraw/zinc/40/13/99/1039401399.db2.gz OTIWZJASLGSYQN-JSGCOSHPSA-N 1 1 368.428 2.901 20 5 FFBDMO C[C@H]1CC[C@@H](CN)[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569308 1039401402 /nfs/dbraw/zinc/40/14/02/1039401402.db2.gz OTIWZJASLGSYQN-JSGCOSHPSA-N 1 1 368.428 2.901 20 5 FFBDMO Cn1cc2cccc(-c3noc([C@@H]([NH3+])Cc4ccc([N+](=O)[O-])cc4)n3)c2n1 ZINC001248210212 1040174062 /nfs/dbraw/zinc/17/40/62/1040174062.db2.gz MNFJLGUWJIKSMA-HNNXBMFYSA-N 1 1 364.365 2.774 20 5 FFBDMO CC(=O)N1CC[C@H]([N@H+](C(C)C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254481128 1040747978 /nfs/dbraw/zinc/74/79/78/1040747978.db2.gz TYHTZIZBAMVOPF-FQEVSTJZSA-N 1 1 374.485 2.895 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254482981 1040749411 /nfs/dbraw/zinc/74/94/11/1040749411.db2.gz NVQQJCHGTHPNGE-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598343 1040827118 /nfs/dbraw/zinc/82/71/18/1040827118.db2.gz WLDKFGGMFXDYAH-WMZOPIPTSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598343 1040827127 /nfs/dbraw/zinc/82/71/27/1040827127.db2.gz WLDKFGGMFXDYAH-WMZOPIPTSA-N 1 1 370.453 2.914 20 5 FFBDMO CC(C)C(=O)N1CCC[C@]12CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599057 1040829352 /nfs/dbraw/zinc/82/93/52/1040829352.db2.gz JWXGCJJTWCCQJH-UYAOXDASSA-N 1 1 357.454 2.785 20 5 FFBDMO COc1cccc(O[C@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610258 1040838863 /nfs/dbraw/zinc/83/88/63/1040838863.db2.gz ISCXLIFGQDZQNH-IRXDYDNUSA-N 1 1 355.394 2.619 20 5 FFBDMO COc1cccc(O[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610254 1040838987 /nfs/dbraw/zinc/83/89/87/1040838987.db2.gz ISCXLIFGQDZQNH-DLBZAZTESA-N 1 1 355.394 2.619 20 5 FFBDMO Cc1nccnc1O[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611798 1040841252 /nfs/dbraw/zinc/84/12/52/1040841252.db2.gz TUQCUNWPNNYOSK-MSOLQXFVSA-N 1 1 354.410 2.704 20 5 FFBDMO CCNC(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC001261238022 1041091163 /nfs/dbraw/zinc/09/11/63/1041091163.db2.gz OECLVXGCPYVKSL-ZDUSSCGKSA-N 1 1 358.236 2.608 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc(F)cc1[N+](=O)[O-] ZINC001261585325 1041319719 /nfs/dbraw/zinc/31/97/19/1041319719.db2.gz WJAYQEQNORTPCM-MRXNPFEDSA-N 1 1 354.378 2.570 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001262636697 1041767100 /nfs/dbraw/zinc/76/71/00/1041767100.db2.gz YVZFGSCJVNLGIB-KRWDZBQOSA-N 1 1 373.384 2.838 20 5 FFBDMO COc1ccc(NC(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001263641210 1042414586 /nfs/dbraw/zinc/41/45/86/1042414586.db2.gz JJAAHBPHYOBQFG-KDURUIRLSA-N 1 1 374.441 2.943 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001310159643 1043645434 /nfs/dbraw/zinc/64/54/34/1043645434.db2.gz KDEMUQZDUWNOPK-JTQLQIEISA-N 1 1 358.345 2.660 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@H+]1CCC[C@H]1C ZINC001313562183 1044381249 /nfs/dbraw/zinc/38/12/49/1044381249.db2.gz WDEYWMVEWDAIOM-CQSZACIVSA-N 1 1 358.446 2.794 20 5 FFBDMO O=C(NCC1([NH2+]C/C=C/c2ccc(Cl)cc2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480119 1044663083 /nfs/dbraw/zinc/66/30/83/1044663083.db2.gz BPMSADHFKVBXDJ-SYLAGYCLSA-N 1 1 363.845 2.647 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2[nH]1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC001319493863 1045172158 /nfs/dbraw/zinc/17/21/58/1045172158.db2.gz ZIUHGAHNEQIEGY-KRWDZBQOSA-N 1 1 355.394 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)c1ccn(-c2cc[nH+]cc2)n1 ZINC001320813326 1045473128 /nfs/dbraw/zinc/47/31/28/1045473128.db2.gz ZHSUOEMYJHCSGP-UHFFFAOYSA-N 1 1 354.322 2.541 20 5 FFBDMO C[C@@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[N@@H+]1CCc2ccccc2C1 ZINC001323221321 1045511289 /nfs/dbraw/zinc/51/12/89/1045511289.db2.gz LJRPDDXKFQCQQM-AWEZNQCLSA-N 1 1 351.406 2.884 20 5 FFBDMO C[C@@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCc2ccccc2C1 ZINC001323221321 1045511291 /nfs/dbraw/zinc/51/12/91/1045511291.db2.gz LJRPDDXKFQCQQM-AWEZNQCLSA-N 1 1 351.406 2.884 20 5 FFBDMO C[N@H+]1CC[C@](O)(CNCc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128751 1045556112 /nfs/dbraw/zinc/55/61/12/1045556112.db2.gz AUIZIHPIZFBSOC-KRWDZBQOSA-N 1 1 365.817 2.664 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1COC(=O)c1cnn(-c2cc[nH+]cc2)c1C ZINC001321572570 1045713955 /nfs/dbraw/zinc/71/39/55/1045713955.db2.gz QOQMAFHCSLGVMH-UHFFFAOYSA-N 1 1 368.349 2.850 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001328886327 1048502535 /nfs/dbraw/zinc/50/25/35/1048502535.db2.gz VYOHFJFDMGQWQW-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001328886327 1048502546 /nfs/dbraw/zinc/50/25/46/1048502546.db2.gz VYOHFJFDMGQWQW-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC001304041468 1051511466 /nfs/dbraw/zinc/51/14/66/1051511466.db2.gz NFIGREHJGDXRIP-QGZVFWFLSA-N 1 1 360.458 2.655 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC1CC1 ZINC001307443536 1052307339 /nfs/dbraw/zinc/30/73/39/1052307339.db2.gz YNKWWDWRHWAVHU-UHFFFAOYSA-N 1 1 354.378 2.908 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@@H]2C[C@@H](OC)C23CCC3)c([N+](=O)[O-])c1 ZINC001307772091 1052348644 /nfs/dbraw/zinc/34/86/44/1052348644.db2.gz QOBSCICIJDJVLT-IAGOWNOFSA-N 1 1 350.415 2.872 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC001309282176 1052591130 /nfs/dbraw/zinc/59/11/30/1052591130.db2.gz GNOFPCSTKQAUKZ-VNHYZAJKSA-N 1 1 369.487 2.548 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001335393427 1053333171 /nfs/dbraw/zinc/33/31/71/1053333171.db2.gz LHIXNXXWAQBUPB-HNNXBMFYSA-N 1 1 351.834 2.878 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N1CCC(CC[N@@H+](CC)CC(C)C)CC1 ZINC001356347523 1055465322 /nfs/dbraw/zinc/46/53/22/1055465322.db2.gz AVHWEDCTADXPHO-UHFFFAOYSA-N 1 1 366.510 2.659 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001349833942 1055492982 /nfs/dbraw/zinc/49/29/82/1055492982.db2.gz NYGNNSDUIWXAQT-QZTJIDSGSA-N 1 1 358.442 2.679 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C[C@@H]21 ZINC001338572675 1055633504 /nfs/dbraw/zinc/63/35/04/1055633504.db2.gz HMUXQLLGCTZIRP-XCBNKYQSSA-N 1 1 362.188 2.817 20 5 FFBDMO CC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC001300086352 1055719687 /nfs/dbraw/zinc/71/96/87/1055719687.db2.gz WSUORVBRMHFVNP-PHIMTYICSA-N 1 1 357.357 2.751 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC001300086352 1055719701 /nfs/dbraw/zinc/71/97/01/1055719701.db2.gz WSUORVBRMHFVNP-PHIMTYICSA-N 1 1 357.357 2.751 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001350370409 1055744387 /nfs/dbraw/zinc/74/43/87/1055744387.db2.gz APVUJBBBDSIUEM-CYBMUJFWSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001350370409 1055744394 /nfs/dbraw/zinc/74/43/94/1055744394.db2.gz APVUJBBBDSIUEM-CYBMUJFWSA-N 1 1 361.377 2.795 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+]2C)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001339484635 1056498954 /nfs/dbraw/zinc/49/89/54/1056498954.db2.gz CKFNVMDFBCPQMI-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@H]2CCC[N@H+]2C)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001339484635 1056498960 /nfs/dbraw/zinc/49/89/60/1056498960.db2.gz CKFNVMDFBCPQMI-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001443768454 1058240909 /nfs/dbraw/zinc/24/09/09/1058240909.db2.gz CTMRTIYWOWMQJV-AWEZNQCLSA-N 1 1 354.410 2.728 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)n1 ZINC001518643018 1058449601 /nfs/dbraw/zinc/44/96/01/1058449601.db2.gz PFGIARDXZYANQE-GDBMZVCRSA-N 1 1 354.410 2.864 20 5 FFBDMO CC1(C)CC(C[NH2+]CCN(Cc2ccccc2)C(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001501193852 1058641532 /nfs/dbraw/zinc/64/15/32/1058641532.db2.gz SICLZHDHPKJIEA-QZTJIDSGSA-N 1 1 359.470 2.706 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)cc(F)cc1[N+](=O)[O-] ZINC001454872721 1059637230 /nfs/dbraw/zinc/63/72/30/1059637230.db2.gz DJWBUXDYKSESMV-CQSZACIVSA-N 1 1 364.421 2.843 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c(C)ccc([N+](=O)[O-])c3C)CC2)c1 ZINC001515969430 1059912838 /nfs/dbraw/zinc/91/28/38/1059912838.db2.gz UDMAIJCLGUPBDR-UHFFFAOYSA-N 1 1 354.410 2.877 20 5 FFBDMO COC1CCC([N@@H+](C)CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848479089 1060107282 /nfs/dbraw/zinc/10/72/82/1060107282.db2.gz QMNWNJUTCUVSSQ-VJFUWPCTSA-N 1 1 361.442 2.758 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000848488422 1060136148 /nfs/dbraw/zinc/13/61/48/1060136148.db2.gz BLDUNDQHVCSNLH-MJGOQNOKSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000848488422 1060136160 /nfs/dbraw/zinc/13/61/60/1060136160.db2.gz BLDUNDQHVCSNLH-MJGOQNOKSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000848487867 1060138076 /nfs/dbraw/zinc/13/80/76/1060138076.db2.gz ZOZDAFMXQXSFDM-BZSNNMDCSA-N 1 1 359.426 2.512 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491412 1060148894 /nfs/dbraw/zinc/14/88/94/1060148894.db2.gz WAFSMCSKRMOCFM-MSOLQXFVSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491412 1060148899 /nfs/dbraw/zinc/14/88/99/1060148899.db2.gz WAFSMCSKRMOCFM-MSOLQXFVSA-N 1 1 361.442 2.615 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001457018943 1060252851 /nfs/dbraw/zinc/25/28/51/1060252851.db2.gz GRKIUUCFFQUGQX-CYBMUJFWSA-N 1 1 351.366 2.975 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000848591524 1060323236 /nfs/dbraw/zinc/32/32/36/1060323236.db2.gz VDIKUNAEBKPALE-MRXNPFEDSA-N 1 1 369.368 2.511 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)[C@@H]2C1 ZINC001521372848 1060562641 /nfs/dbraw/zinc/56/26/41/1060562641.db2.gz JYEXLZVYNAYHNC-QGTPRVQTSA-N 1 1 358.442 2.609 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1c1ncc([N+](=O)[O-])c(C)c1Br ZINC001458458604 1060595563 /nfs/dbraw/zinc/59/55/63/1060595563.db2.gz XIBAYZXNIDJCFL-LLVKDONJSA-N 1 1 357.252 2.981 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC(NC(=O)OC(C)(C)C)C1 ZINC001460113340 1060901156 /nfs/dbraw/zinc/90/11/56/1060901156.db2.gz PQNQZQNUXLETSI-UHFFFAOYSA-N 1 1 365.430 2.961 20 5 FFBDMO CC1([NH+]2CCCC2)CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC001462813620 1061788126 /nfs/dbraw/zinc/78/81/26/1061788126.db2.gz NUTCPVZKWSGCIC-UHFFFAOYSA-N 1 1 371.441 2.998 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 ZINC001463648844 1062198776 /nfs/dbraw/zinc/19/87/76/1062198776.db2.gz GDRXPKBAETXMFQ-CQSZACIVSA-N 1 1 351.790 2.803 20 5 FFBDMO Cc1ccc(CNC(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001479122645 1062236854 /nfs/dbraw/zinc/23/68/54/1062236854.db2.gz SCFOLCOLTNJIEI-CQSZACIVSA-N 1 1 360.458 2.919 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1cccc(Cl)c1F)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001479868197 1063011890 /nfs/dbraw/zinc/01/18/90/1063011890.db2.gz AOAIVPKVCXKOHW-UKRRQHHQSA-N 1 1 369.824 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001466355288 1063405483 /nfs/dbraw/zinc/40/54/83/1063405483.db2.gz VLFMQCLOGXSYMC-MSOLQXFVSA-N 1 1 369.421 2.565 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC001467805774 1063857944 /nfs/dbraw/zinc/85/79/44/1063857944.db2.gz RLIPGOSYKDVCSW-GFCCVEGCSA-N 1 1 352.822 2.577 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC001470779876 1064448453 /nfs/dbraw/zinc/44/84/53/1064448453.db2.gz JWCBVQSDJMIVMU-RHSMWYFYSA-N 1 1 356.426 2.574 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777712 1064449462 /nfs/dbraw/zinc/44/94/62/1064449462.db2.gz MANFZIOZHUQHMR-AUUYWEPGSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777712 1064449463 /nfs/dbraw/zinc/44/94/63/1064449463.db2.gz MANFZIOZHUQHMR-AUUYWEPGSA-N 1 1 369.421 2.941 20 5 FFBDMO COc1ccc(CC(=O)N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)cc1[N+](=O)[O-] ZINC001471912189 1064848570 /nfs/dbraw/zinc/84/85/70/1064848570.db2.gz UYBZBHCCBUZBPU-UHFFFAOYSA-N 1 1 372.425 2.892 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001472674887 1065126072 /nfs/dbraw/zinc/12/60/72/1065126072.db2.gz IOFMCJXPYYLAOA-LBPRGKRZSA-N 1 1 359.386 2.615 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])c1 ZINC001472844319 1065155482 /nfs/dbraw/zinc/15/54/82/1065155482.db2.gz MOFVKUGGPPQJBB-MRXNPFEDSA-N 1 1 370.409 2.771 20 5 FFBDMO Cc1ccc(NCCNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)[nH+]c1 ZINC001472884775 1065167206 /nfs/dbraw/zinc/16/72/06/1065167206.db2.gz DDPPSASYTXQFEW-UHFFFAOYSA-N 1 1 355.398 2.714 20 5 FFBDMO COC(=O)c1ccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1F ZINC001473713587 1065328584 /nfs/dbraw/zinc/32/85/84/1065328584.db2.gz BGKNQTHIJMAHGT-GOSISDBHSA-N 1 1 362.357 2.518 20 5 FFBDMO Cn1ccc(C2CC[NH+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC2)n1 ZINC001473808160 1065371003 /nfs/dbraw/zinc/37/10/03/1065371003.db2.gz HOCJFUMICZRVOC-UHFFFAOYSA-N 1 1 368.397 2.758 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H](c2ccccc2)[C@H](C(N)=O)C1 ZINC001474567948 1065552954 /nfs/dbraw/zinc/55/29/54/1065552954.db2.gz SWICYLYZGSNQPV-ZWKOTPCHSA-N 1 1 353.422 2.913 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001474834554 1065620927 /nfs/dbraw/zinc/62/09/27/1065620927.db2.gz NENKCEXUSSJMJW-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO CCOc1cc(NC(=O)[C@@H]2[NH2+]CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC001578168539 1078446170 /nfs/dbraw/zinc/44/61/70/1078446170.db2.gz UKFDSOLDQKHNTD-QGZVFWFLSA-N 1 1 357.366 2.655 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001558528254 1076025647 /nfs/dbraw/zinc/02/56/47/1076025647.db2.gz UVPSSIYXAFJTLA-CYBMUJFWSA-N 1 1 370.247 2.817 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001559235059 1076137878 /nfs/dbraw/zinc/13/78/78/1076137878.db2.gz IUZFHAMITAWPIN-GFCCVEGCSA-N 1 1 359.386 2.758 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CCc2cc[nH+]c(N)c2C1 ZINC001559300474 1076147694 /nfs/dbraw/zinc/14/76/94/1076147694.db2.gz RJYPJVWASDAMDY-UHFFFAOYSA-N 1 1 362.773 2.575 20 5 FFBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559751937 1076187844 /nfs/dbraw/zinc/18/78/44/1076187844.db2.gz OVYXPFHFHOPEAB-QFBILLFUSA-N 1 1 374.485 2.754 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1CN[C@@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC001560134395 1076232757 /nfs/dbraw/zinc/23/27/57/1076232757.db2.gz DNJYTZOIKIWMSD-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1CN[C@@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC001560134395 1076232758 /nfs/dbraw/zinc/23/27/58/1076232758.db2.gz DNJYTZOIKIWMSD-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]Cc1cnc2cnccn12 ZINC001560571837 1076280791 /nfs/dbraw/zinc/28/07/91/1076280791.db2.gz KFXHLYZBPILHSY-UHFFFAOYSA-N 1 1 362.187 2.690 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC001560587407 1076282221 /nfs/dbraw/zinc/28/22/21/1076282221.db2.gz LPIXQYUIRBKBQB-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cccc(OC)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001568140943 1077073945 /nfs/dbraw/zinc/07/39/45/1077073945.db2.gz YOOCHQNYGBVXGP-QGZVFWFLSA-N 1 1 369.421 2.953 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)cc1 ZINC001587797261 1079867827 /nfs/dbraw/zinc/86/78/27/1079867827.db2.gz YGFGSQCJTVHETM-OAHLLOKOSA-N 1 1 372.400 2.629 20 5 FFBDMO C[C@H](Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978708 1080917452 /nfs/dbraw/zinc/91/74/52/1080917452.db2.gz YMVNGWYYCRFTNL-STQMWFEESA-N 1 1 371.445 2.840 20 5 FFBDMO C[C@H](Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978707 1080917922 /nfs/dbraw/zinc/91/79/22/1080917922.db2.gz YMVNGWYYCRFTNL-QWHCGFSZSA-N 1 1 371.445 2.840 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000026218841 249340937 /nfs/dbraw/zinc/34/09/37/249340937.db2.gz RNGDCILWTUHWSD-AWEZNQCLSA-N 1 1 363.414 2.507 20 5 FFBDMO CC(=O)Nc1ccccc1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000092048151 249967071 /nfs/dbraw/zinc/96/70/71/249967071.db2.gz PHGSEUYLQPMJNJ-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093505010 250037021 /nfs/dbraw/zinc/03/70/21/250037021.db2.gz NEXZDZKYNBWMQE-QAPCUYQASA-N 1 1 356.426 2.996 20 5 FFBDMO O=C(NC1CC1)[C@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666870 250181990 /nfs/dbraw/zinc/18/19/90/250181990.db2.gz IOWAFPNVIPOARJ-MRXNPFEDSA-N 1 1 370.409 2.535 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1C ZINC000106891509 250296320 /nfs/dbraw/zinc/29/63/20/250296320.db2.gz KOOANLQVTZBLJU-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1SCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000118419490 250385800 /nfs/dbraw/zinc/38/58/00/250385800.db2.gz BQEWRORZHSFFTD-RYUDHWBXSA-N 1 1 351.428 2.719 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000119676234 250498948 /nfs/dbraw/zinc/49/89/48/250498948.db2.gz UHDZPNVVUZGSRP-CYBMUJFWSA-N 1 1 364.402 2.519 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1S(=O)(=O)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000129972093 250872293 /nfs/dbraw/zinc/87/22/93/250872293.db2.gz ZKPBATUEZWGSNA-CYBMUJFWSA-N 1 1 363.439 2.696 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@H]1C ZINC000186780938 251261684 /nfs/dbraw/zinc/26/16/84/251261684.db2.gz OKBFYMFAZKCIHG-CQSZACIVSA-N 1 1 364.446 2.521 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000181085993 251240857 /nfs/dbraw/zinc/24/08/57/251240857.db2.gz UPOVRTQZTBAWEP-OAHLLOKOSA-N 1 1 354.410 2.571 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264600396 251318339 /nfs/dbraw/zinc/31/83/39/251318339.db2.gz NHEDBRDFNRDQCV-INIZCTEOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264600396 251318343 /nfs/dbraw/zinc/31/83/43/251318343.db2.gz NHEDBRDFNRDQCV-INIZCTEOSA-N 1 1 360.458 2.792 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1Cl ZINC000268780623 251381106 /nfs/dbraw/zinc/38/11/06/251381106.db2.gz CDUYQXBCYSVWTL-MNOVXSKESA-N 1 1 353.806 2.708 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272234590 251987574 /nfs/dbraw/zinc/98/75/74/251987574.db2.gz FKJJGNRKFGTEHT-PBHICJAKSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000272425339 252036700 /nfs/dbraw/zinc/03/67/00/252036700.db2.gz CARKBRLVZRYJET-WBMJQRKESA-N 1 1 366.849 2.874 20 5 FFBDMO Cc1n[nH]cc1CCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272496170 252052784 /nfs/dbraw/zinc/05/27/84/252052784.db2.gz FYYNCSUIZKLNFO-QGZVFWFLSA-N 1 1 354.414 2.672 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272527029 252060881 /nfs/dbraw/zinc/06/08/81/252060881.db2.gz MGGNGMVKISUEHY-MAUKXSAKSA-N 1 1 357.458 2.882 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272576458 252072269 /nfs/dbraw/zinc/07/22/69/252072269.db2.gz XGPLEQZJHZAMMJ-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272548486 252065031 /nfs/dbraw/zinc/06/50/31/252065031.db2.gz QRHBPORYMGQBPX-SFHVURJKSA-N 1 1 374.441 2.593 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H](c1ccco1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272554367 252065824 /nfs/dbraw/zinc/06/58/24/252065824.db2.gz RURCKZDZIPMARV-AEFFLSMTSA-N 1 1 369.425 2.903 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000272637980 252088071 /nfs/dbraw/zinc/08/80/71/252088071.db2.gz XXZFFXKZMQFLEP-AEFFLSMTSA-N 1 1 360.458 2.653 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272599296 252077469 /nfs/dbraw/zinc/07/74/69/252077469.db2.gz UYINQUMXGHONBC-ZDUSSCGKSA-N 1 1 355.385 2.923 20 5 FFBDMO CC(C)[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000272895042 252158354 /nfs/dbraw/zinc/15/83/54/252158354.db2.gz YPTMBUSQPFNSGT-LBPRGKRZSA-N 1 1 361.489 2.592 20 5 FFBDMO COc1ccc(OCC[NH2+][C@H](CO)c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000273125166 252223035 /nfs/dbraw/zinc/22/30/35/252223035.db2.gz QHESIGBZSJRNRL-CQSZACIVSA-N 1 1 368.336 2.584 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000273455995 252310011 /nfs/dbraw/zinc/31/00/11/252310011.db2.gz POQSOWVXEOXRGP-UHFFFAOYSA-N 1 1 360.502 2.894 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2cnn(C)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000273437959 252305297 /nfs/dbraw/zinc/30/52/97/252305297.db2.gz YSPOFSHPLRHHAR-SNVBAGLBSA-N 1 1 370.356 2.832 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000273515635 252322061 /nfs/dbraw/zinc/32/20/61/252322061.db2.gz RRLCIIIWDAGBIG-UHFFFAOYSA-N 1 1 352.387 2.606 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285786506 257004820 /nfs/dbraw/zinc/00/48/20/257004820.db2.gz SWHAKUJTVKLUGS-GOSISDBHSA-N 1 1 363.458 2.741 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285786506 257004821 /nfs/dbraw/zinc/00/48/21/257004821.db2.gz SWHAKUJTVKLUGS-GOSISDBHSA-N 1 1 363.458 2.741 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000278732449 256342593 /nfs/dbraw/zinc/34/25/93/256342593.db2.gz RZFBBSYZUZZWCU-AWEZNQCLSA-N 1 1 369.849 2.523 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H](Oc3ncccc3F)C2)c1 ZINC000278905132 256361050 /nfs/dbraw/zinc/36/10/50/256361050.db2.gz SBIOXCNICBLMJF-DOTOQJQBSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](Oc3ncccc3F)C2)c1 ZINC000278905132 256361051 /nfs/dbraw/zinc/36/10/51/256361051.db2.gz SBIOXCNICBLMJF-DOTOQJQBSA-N 1 1 361.373 2.706 20 5 FFBDMO NC(=O)c1ccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c([N+](=O)[O-])c1 ZINC000279002024 256370591 /nfs/dbraw/zinc/37/05/91/256370591.db2.gz FWHGEGPBZQKIMB-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCCO)Cc1ccccn1 ZINC000287710734 257104128 /nfs/dbraw/zinc/10/41/28/257104128.db2.gz JPZGHPJWRJXJMJ-UHFFFAOYSA-N 1 1 372.425 2.511 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(N2CCOCC2)s1 ZINC000289562317 257287426 /nfs/dbraw/zinc/28/74/26/257287426.db2.gz RWJSGHBGXXRZQF-UHFFFAOYSA-N 1 1 362.455 2.562 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000291176893 257389926 /nfs/dbraw/zinc/38/99/26/257389926.db2.gz FFQYVYPNHDNSPW-LBPRGKRZSA-N 1 1 368.340 2.848 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000291176893 257389927 /nfs/dbraw/zinc/38/99/27/257389927.db2.gz FFQYVYPNHDNSPW-LBPRGKRZSA-N 1 1 368.340 2.848 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000296919190 257767240 /nfs/dbraw/zinc/76/72/40/257767240.db2.gz YZSDZZBEXVXTPQ-GOSISDBHSA-N 1 1 362.430 2.943 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(NC[C@]3([NH+]4CCOCC4)CCSC3)ccc2c1 ZINC000301126715 258027083 /nfs/dbraw/zinc/02/70/83/258027083.db2.gz WVUHMWQCDTYINO-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301189928 258032482 /nfs/dbraw/zinc/03/24/82/258032482.db2.gz LUFXKIILNOHBJE-OAHLLOKOSA-N 1 1 352.866 2.855 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2cccnc2)C2CC2)c([N+](=O)[O-])c1 ZINC000299730506 258021403 /nfs/dbraw/zinc/02/14/03/258021403.db2.gz WSNLWVOZITUDBZ-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO Cc1cc(N2CCC([N@@H+](C)CCCO)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302047481 258084492 /nfs/dbraw/zinc/08/44/92/258084492.db2.gz YTQPCEGEPOXJFQ-UHFFFAOYSA-N 1 1 358.442 2.734 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1 ZINC000302120780 258089329 /nfs/dbraw/zinc/08/93/29/258089329.db2.gz XTWZWINVXYGNJH-STQMWFEESA-N 1 1 365.430 2.681 20 5 FFBDMO Cc1nn(C)c(N2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)c1[N+](=O)[O-] ZINC000312058468 258115590 /nfs/dbraw/zinc/11/55/90/258115590.db2.gz GSQSCKPGJXWNCR-SJORKVTESA-N 1 1 355.442 2.595 20 5 FFBDMO Cc1cnc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000301415699 258048212 /nfs/dbraw/zinc/04/82/12/258048212.db2.gz BVFIGCWVIPBJLU-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO CCOc1cc(NC[C@@]2([NH+]3CCOCC3)CCSC2)ccc1[N+](=O)[O-] ZINC000301447023 258050383 /nfs/dbraw/zinc/05/03/83/258050383.db2.gz QNZSOILWDOHFLT-KRWDZBQOSA-N 1 1 367.471 2.613 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000301826373 258069699 /nfs/dbraw/zinc/06/96/99/258069699.db2.gz JEEOUYIKFUQJAT-FUHWJXTLSA-N 1 1 372.400 2.951 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@@H]1C ZINC000301854741 258070526 /nfs/dbraw/zinc/07/05/26/258070526.db2.gz CIMDWRUNRRLFTO-KBPBESRZSA-N 1 1 351.447 2.663 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CC[N@@H+](CCc4ccccc4)C3)nn21 ZINC000302019149 258082490 /nfs/dbraw/zinc/08/24/90/258082490.db2.gz ZUQZTKRGQIWTNM-INIZCTEOSA-N 1 1 366.425 2.614 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C ZINC000330481093 258164664 /nfs/dbraw/zinc/16/46/64/258164664.db2.gz SYUKFCDLXIRBJB-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O ZINC000330700643 258168703 /nfs/dbraw/zinc/16/87/03/258168703.db2.gz GXULSFWCTQVKQU-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O ZINC000330700643 258168704 /nfs/dbraw/zinc/16/87/04/258168704.db2.gz GXULSFWCTQVKQU-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844691 258171715 /nfs/dbraw/zinc/17/17/15/258171715.db2.gz WRUQJJAWFWBKKL-GHMZBOCLSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844691 258171716 /nfs/dbraw/zinc/17/17/16/258171716.db2.gz WRUQJJAWFWBKKL-GHMZBOCLSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000331106901 258177375 /nfs/dbraw/zinc/17/73/75/258177375.db2.gz GSHOKAFOYRSGRS-FRRDWIJNSA-N 1 1 369.412 2.898 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000331980682 258208691 /nfs/dbraw/zinc/20/86/91/258208691.db2.gz FHXJGHDTRNFKDV-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000332065466 258212084 /nfs/dbraw/zinc/21/20/84/258212084.db2.gz SINFGDVXIGKJKM-AAEUAGOBSA-N 1 1 370.356 2.945 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000332331080 258225715 /nfs/dbraw/zinc/22/57/15/258225715.db2.gz QIGNCCSOIYPIGV-SCLBCKFNSA-N 1 1 365.430 2.821 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@H](C)[N@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402839 258228945 /nfs/dbraw/zinc/22/89/45/258228945.db2.gz VBBGYJYVYLCBIO-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@H](C)[N@@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402839 258228946 /nfs/dbraw/zinc/22/89/46/258228946.db2.gz VBBGYJYVYLCBIO-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cccc4c3OCCO4)CC2)c1 ZINC000109472140 132245402 /nfs/dbraw/zinc/24/54/02/132245402.db2.gz KQCLYVHSRLYRSV-UHFFFAOYSA-N 1 1 355.394 2.688 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N[C@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000409846851 512154067 /nfs/dbraw/zinc/15/40/67/512154067.db2.gz UZVNPMVPOBKLHE-CJNGLKHVSA-N 1 1 355.394 2.885 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000366841463 512212081 /nfs/dbraw/zinc/21/20/81/512212081.db2.gz ALJQJDZQXBKYPO-DNVCBOLYSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000366841463 512212083 /nfs/dbraw/zinc/21/20/83/512212083.db2.gz ALJQJDZQXBKYPO-DNVCBOLYSA-N 1 1 373.384 2.674 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)c1 ZINC000065970883 506403923 /nfs/dbraw/zinc/40/39/23/506403923.db2.gz PXPYAEJODQJXKP-UHFFFAOYSA-N 1 1 369.468 2.587 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000066137816 506427179 /nfs/dbraw/zinc/42/71/79/506427179.db2.gz KXLOJDIQHVSFTE-HNNXBMFYSA-N 1 1 362.474 2.658 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000053722101 506436029 /nfs/dbraw/zinc/43/60/29/506436029.db2.gz PCBBQPUOAXAQPO-AWEZNQCLSA-N 1 1 357.414 2.804 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000054226573 506517378 /nfs/dbraw/zinc/51/73/78/506517378.db2.gz MRCQQNKSHFJBPX-RDJZCZTQSA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2cccs2)CC1 ZINC000007615400 506575045 /nfs/dbraw/zinc/57/50/45/506575045.db2.gz IBDPRPZBQWDULY-CQSZACIVSA-N 1 1 374.466 2.801 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000054620803 506588565 /nfs/dbraw/zinc/58/85/65/506588565.db2.gz HDTRAEJWYYZYAV-LBPRGKRZSA-N 1 1 357.414 2.740 20 5 FFBDMO Cc1sc(C(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)cc1[N+](=O)[O-] ZINC000054626253 506591187 /nfs/dbraw/zinc/59/11/87/506591187.db2.gz IEGJMOQTUICUBB-UHFFFAOYSA-N 1 1 357.395 2.784 20 5 FFBDMO C[N@@H+](CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Cc1ccccc1 ZINC000056191982 506958498 /nfs/dbraw/zinc/95/84/98/506958498.db2.gz ZLTTUZSIGFLMAD-UHFFFAOYSA-N 1 1 352.394 2.938 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000069045936 507391056 /nfs/dbraw/zinc/39/10/56/507391056.db2.gz BFLVLAPRRNEHES-OAHLLOKOSA-N 1 1 358.442 2.786 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000069389216 507479661 /nfs/dbraw/zinc/47/96/61/507479661.db2.gz YFDANXDLQBJPBS-OAHLLOKOSA-N 1 1 364.446 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4nc(C5CC5)no4)C3)nc2c1 ZINC000375470705 512347892 /nfs/dbraw/zinc/34/78/92/512347892.db2.gz OUOIQIZYHSGMNX-NSHDSACASA-N 1 1 355.354 2.986 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4nc(C5CC5)no4)C3)nc2c1 ZINC000375470705 512347897 /nfs/dbraw/zinc/34/78/97/512347897.db2.gz OUOIQIZYHSGMNX-NSHDSACASA-N 1 1 355.354 2.986 20 5 FFBDMO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc(OC)c1 ZINC000051407646 507769255 /nfs/dbraw/zinc/76/92/55/507769255.db2.gz JBTNZMJIVUMFJR-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc(OC)c1 ZINC000051407646 507769258 /nfs/dbraw/zinc/76/92/58/507769258.db2.gz JBTNZMJIVUMFJR-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO COc1ccc(CN2CC[NH+](CCOc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000051562491 507775188 /nfs/dbraw/zinc/77/51/88/507775188.db2.gz PLKFUNWEULRJQZ-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(CCCO)CC2)s1 ZINC000051916599 507790050 /nfs/dbraw/zinc/79/00/50/507790050.db2.gz USVPHPFJENIATO-UHFFFAOYSA-N 1 1 361.467 2.823 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[NH+](CCCO)CC2)s1 ZINC000051916599 507790052 /nfs/dbraw/zinc/79/00/52/507790052.db2.gz USVPHPFJENIATO-UHFFFAOYSA-N 1 1 361.467 2.823 20 5 FFBDMO Cc1nn(C)c(C)c1NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350215 507791927 /nfs/dbraw/zinc/79/19/27/507791927.db2.gz WUXRTHDZALNNCX-UHFFFAOYSA-N 1 1 359.430 2.794 20 5 FFBDMO Cc1nn(C)c(C)c1NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350215 507791929 /nfs/dbraw/zinc/79/19/29/507791929.db2.gz WUXRTHDZALNNCX-UHFFFAOYSA-N 1 1 359.430 2.794 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cnn(-c4ccccc4)c3)C2)nc1 ZINC000072665022 507840524 /nfs/dbraw/zinc/84/05/24/507840524.db2.gz KGHAMPHJKWSART-INIZCTEOSA-N 1 1 364.409 2.862 20 5 FFBDMO CC[NH+](CC)C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000072823445 507857949 /nfs/dbraw/zinc/85/79/49/507857949.db2.gz NEHAWUGAJCMTQL-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000107891836 507873116 /nfs/dbraw/zinc/87/31/16/507873116.db2.gz FENNZVACQLRNQU-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000089929006 507885846 /nfs/dbraw/zinc/88/58/46/507885846.db2.gz BTCMQATTYUVRMA-MNOVXSKESA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000108305867 507885935 /nfs/dbraw/zinc/88/59/35/507885935.db2.gz IRJKUBKZTNWJIQ-FZMZJTMJSA-N 1 1 367.833 2.616 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000109782312 507986078 /nfs/dbraw/zinc/98/60/78/507986078.db2.gz SXMWOHFYLUBKJT-CYBMUJFWSA-N 1 1 355.394 2.883 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000109782312 507986080 /nfs/dbraw/zinc/98/60/80/507986080.db2.gz SXMWOHFYLUBKJT-CYBMUJFWSA-N 1 1 355.394 2.883 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000080125658 508041381 /nfs/dbraw/zinc/04/13/81/508041381.db2.gz AFXCPYKLNZYVMH-LBPRGKRZSA-N 1 1 357.332 2.828 20 5 FFBDMO C[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000110966869 508061290 /nfs/dbraw/zinc/06/12/90/508061290.db2.gz NMAQZJXQOOLGIK-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@H+](C)Cc1ccccc1 ZINC000110966869 508061291 /nfs/dbraw/zinc/06/12/91/508061291.db2.gz NMAQZJXQOOLGIK-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000110966869 508061293 /nfs/dbraw/zinc/06/12/93/508061293.db2.gz NMAQZJXQOOLGIK-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])cc1OC(F)F ZINC000111317372 508089603 /nfs/dbraw/zinc/08/96/03/508089603.db2.gz JRSHPQZBXUUUKV-FOSCPWQOSA-N 1 1 358.341 2.693 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])cc1OC(F)F ZINC000111317372 508089611 /nfs/dbraw/zinc/08/96/11/508089611.db2.gz JRSHPQZBXUUUKV-FOSCPWQOSA-N 1 1 358.341 2.693 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](CCc2ccccc2)C2CCCC2)c1 ZINC000075674739 508126893 /nfs/dbraw/zinc/12/68/93/508126893.db2.gz VQKDPSPZHRCIAJ-LJQANCHMSA-N 1 1 358.442 2.640 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096033 508136845 /nfs/dbraw/zinc/13/68/45/508136845.db2.gz UAPKAZZVTKUAJJ-IUODEOHRSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cccc4c3OCCCO4)C2)nc1 ZINC000093534231 508147730 /nfs/dbraw/zinc/14/77/30/508147730.db2.gz UCPVCLRMEOYINE-HNNXBMFYSA-N 1 1 370.409 2.838 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000112079815 508149532 /nfs/dbraw/zinc/14/95/32/508149532.db2.gz KACPCQVOPIFIFM-CYBMUJFWSA-N 1 1 359.430 2.702 20 5 FFBDMO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076145404 508163470 /nfs/dbraw/zinc/16/34/70/508163470.db2.gz OGSLSUSBVGTMMU-QRTARXTBSA-N 1 1 362.430 2.781 20 5 FFBDMO C[N@H+](CC1CC1)C[C@@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081636300 508199846 /nfs/dbraw/zinc/19/98/46/508199846.db2.gz CDTUNQPMRPFHAI-INIZCTEOSA-N 1 1 360.458 2.587 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081636300 508199848 /nfs/dbraw/zinc/19/98/48/508199848.db2.gz CDTUNQPMRPFHAI-INIZCTEOSA-N 1 1 360.458 2.587 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000112700709 508211319 /nfs/dbraw/zinc/21/13/19/508211319.db2.gz BJQWRFRSGCLUMC-HNNXBMFYSA-N 1 1 363.458 2.978 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000076496158 508214752 /nfs/dbraw/zinc/21/47/52/508214752.db2.gz YNEUWDDLYNZIAW-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000076496158 508214754 /nfs/dbraw/zinc/21/47/54/508214754.db2.gz YNEUWDDLYNZIAW-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H]2[C@@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460665 508317321 /nfs/dbraw/zinc/31/73/21/508317321.db2.gz CUJHIZRBXHTJSG-WBVHZDCISA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@@H]2[C@@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460665 508317323 /nfs/dbraw/zinc/31/73/23/508317323.db2.gz CUJHIZRBXHTJSG-WBVHZDCISA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@@H+](CCN1CCOCC1)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000114464417 508318122 /nfs/dbraw/zinc/31/81/22/508318122.db2.gz LZJRZZYVWBRRPV-UHFFFAOYSA-N 1 1 352.434 2.710 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000114641563 508332840 /nfs/dbraw/zinc/33/28/40/508332840.db2.gz RGKXQMXLPAYCTA-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087116219 508337209 /nfs/dbraw/zinc/33/72/09/508337209.db2.gz HEJRTMZIJQEMFA-MRXNPFEDSA-N 1 1 358.442 2.679 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1 ZINC000105168801 508363645 /nfs/dbraw/zinc/36/36/45/508363645.db2.gz LSRZFIVETLUFLV-AWEZNQCLSA-N 1 1 364.446 2.523 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000115270344 508380062 /nfs/dbraw/zinc/38/00/62/508380062.db2.gz IITJRRMKTWHOEW-QAPCUYQASA-N 1 1 363.458 2.770 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ccncc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000088751559 508382504 /nfs/dbraw/zinc/38/25/04/508382504.db2.gz PGEPNFUNNCCUTB-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1ccnc1 ZINC000156454813 508423346 /nfs/dbraw/zinc/42/33/46/508423346.db2.gz BLEBKEBRXYASDH-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1ccnc1 ZINC000156454813 508423348 /nfs/dbraw/zinc/42/33/48/508423348.db2.gz BLEBKEBRXYASDH-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[NH+]1CCN(C(=O)Cc2cccc(NCc3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000152434823 508446017 /nfs/dbraw/zinc/44/60/17/508446017.db2.gz KSBIHDAKQSQOBX-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 ZINC000156689118 508462359 /nfs/dbraw/zinc/46/23/59/508462359.db2.gz LZILGQZMIQXSPR-UHFFFAOYSA-N 1 1 368.309 2.644 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000156751434 508472346 /nfs/dbraw/zinc/47/23/46/508472346.db2.gz NKTYDWVCFVYABE-KRWDZBQOSA-N 1 1 351.447 2.900 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000116206383 508486335 /nfs/dbraw/zinc/48/63/35/508486335.db2.gz CNCGXAHGIVDULC-CYBMUJFWSA-N 1 1 371.441 2.788 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCc2ccccc21 ZINC000153034906 508541396 /nfs/dbraw/zinc/54/13/96/508541396.db2.gz YATKBPKYPYNQGA-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116746451 508554482 /nfs/dbraw/zinc/55/44/82/508554482.db2.gz ZXVMXQUTOHFZBK-LBPRGKRZSA-N 1 1 357.838 2.864 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000134918844 508575122 /nfs/dbraw/zinc/57/51/22/508575122.db2.gz SPTFVWARVUCHDM-GDBMZVCRSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@@H+](CCO)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000157754868 508607777 /nfs/dbraw/zinc/60/77/77/508607777.db2.gz JQLSWBSXOJCHBZ-UHFFFAOYSA-N 1 1 352.394 2.872 20 5 FFBDMO Cc1c(CN2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000153920211 508676984 /nfs/dbraw/zinc/67/69/84/508676984.db2.gz XXDQTAZVUJBSKR-CALCHBBNSA-N 1 1 360.502 2.894 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000123897668 508755064 /nfs/dbraw/zinc/75/50/64/508755064.db2.gz WUGIBFBYAQTXEI-CABZTGNLSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137455801 508756080 /nfs/dbraw/zinc/75/60/80/508756080.db2.gz WDRKRUHYXLLZEF-NVXWUHKLSA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000137432896 508756110 /nfs/dbraw/zinc/75/61/10/508756110.db2.gz YEOILEHXMYXTIN-DOTOQJQBSA-N 1 1 368.437 2.786 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SCCOC)C1 ZINC000137948828 508767467 /nfs/dbraw/zinc/76/74/67/508767467.db2.gz RMDJGELDHCXJNN-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)CC[C@@H]21 ZINC000154394429 508775900 /nfs/dbraw/zinc/77/59/00/508775900.db2.gz FGSCAKJDNZSOCI-QAPCUYQASA-N 1 1 372.469 2.751 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000159061907 508787755 /nfs/dbraw/zinc/78/77/55/508787755.db2.gz NFWAHCBLGPBSDD-CYBMUJFWSA-N 1 1 357.414 2.909 20 5 FFBDMO Cc1cc(=O)n2nc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)sc2n1 ZINC000130015430 508788011 /nfs/dbraw/zinc/78/80/11/508788011.db2.gz JSHIULQTRKGVIW-UHFFFAOYSA-N 1 1 371.422 2.532 20 5 FFBDMO Cc1cc(=O)n2nc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)sc2n1 ZINC000130015430 508788012 /nfs/dbraw/zinc/78/80/12/508788012.db2.gz JSHIULQTRKGVIW-UHFFFAOYSA-N 1 1 371.422 2.532 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]([NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000119576844 508821738 /nfs/dbraw/zinc/82/17/38/508821738.db2.gz BUTSWFNOLFBSJR-MRXNPFEDSA-N 1 1 354.410 2.568 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@@H]3COc4ccccc4O3)CC2)c1 ZINC000143910045 508834663 /nfs/dbraw/zinc/83/46/63/508834663.db2.gz LZJBGANOXVVAGB-QGZVFWFLSA-N 1 1 355.394 2.557 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124552401 508850647 /nfs/dbraw/zinc/85/06/47/508850647.db2.gz WSTOFKOOTYGKBL-HNNXBMFYSA-N 1 1 358.442 2.679 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159533608 508854942 /nfs/dbraw/zinc/85/49/42/508854942.db2.gz INANOZYIXWCUGE-PGUXBMHVSA-N 1 1 355.822 2.668 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000154866128 508872853 /nfs/dbraw/zinc/87/28/53/508872853.db2.gz SKHWNSKDDDJBCZ-INIZCTEOSA-N 1 1 364.446 2.868 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000160237171 508958505 /nfs/dbraw/zinc/95/85/05/508958505.db2.gz BOIIIVQNUUNRFL-ZFWWWQNUSA-N 1 1 352.398 2.570 20 5 FFBDMO CCc1ccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000155302711 508972406 /nfs/dbraw/zinc/97/24/06/508972406.db2.gz CSSNCXLAQBVVQE-SFHVURJKSA-N 1 1 356.422 2.955 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515630 509011998 /nfs/dbraw/zinc/01/19/98/509011998.db2.gz IARRHHKZARUBIN-CVEARBPZSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515630 509012002 /nfs/dbraw/zinc/01/20/02/509012002.db2.gz IARRHHKZARUBIN-CVEARBPZSA-N 1 1 365.430 2.677 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000161318313 509101240 /nfs/dbraw/zinc/10/12/40/509101240.db2.gz AIZLDPYECKTVNV-CQSZACIVSA-N 1 1 364.446 2.946 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000156054458 509117698 /nfs/dbraw/zinc/11/76/98/509117698.db2.gz RMYBAGITEGPTSQ-MRXNPFEDSA-N 1 1 364.446 2.772 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C(C)C)cc([N+](=O)[O-])c1C ZINC000188634499 509183761 /nfs/dbraw/zinc/18/37/61/509183761.db2.gz HBJFISSETCPDQW-JKSUJKDBSA-N 1 1 361.442 2.999 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000191798598 509185114 /nfs/dbraw/zinc/18/51/14/509185114.db2.gz BGDALIZQZUKPOM-WBMJQRKESA-N 1 1 359.382 2.881 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000191798598 509185123 /nfs/dbraw/zinc/18/51/23/509185123.db2.gz BGDALIZQZUKPOM-WBMJQRKESA-N 1 1 359.382 2.881 20 5 FFBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 ZINC000263876013 509200826 /nfs/dbraw/zinc/20/08/26/509200826.db2.gz JZHZUIOHTTZHHL-UHFFFAOYSA-N 1 1 356.426 2.907 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H]1c1ccccc1 ZINC000248029574 509220962 /nfs/dbraw/zinc/22/09/62/509220962.db2.gz KAUABHDMDALFDP-FUHWJXTLSA-N 1 1 365.393 2.646 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)o2)cc1 ZINC000266920024 509258540 /nfs/dbraw/zinc/25/85/40/509258540.db2.gz LPYZYWOJMDGIRM-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000162764112 509294979 /nfs/dbraw/zinc/29/49/79/509294979.db2.gz MQSVUARYSJHHJJ-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182657034 509353415 /nfs/dbraw/zinc/35/34/15/509353415.db2.gz OCWWPFLZWSOYFX-LLVKDONJSA-N 1 1 357.863 2.798 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1Br)C1CCCC1 ZINC000182662800 509357919 /nfs/dbraw/zinc/35/79/19/509357919.db2.gz OSLRLBWKKJAPQJ-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1cccc2c1CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000182670306 509361421 /nfs/dbraw/zinc/36/14/21/509361421.db2.gz PEOPBGUEUBNAHX-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000185877444 509401221 /nfs/dbraw/zinc/40/12/21/509401221.db2.gz ZPDVFFDXYXLCLU-MRXNPFEDSA-N 1 1 372.469 2.970 20 5 FFBDMO COc1ccnc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182748439 509408061 /nfs/dbraw/zinc/40/80/61/509408061.db2.gz HQIFLEFIPJFKEZ-AWEZNQCLSA-N 1 1 357.414 2.585 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCC[C@@H](C)C1 ZINC000227840421 509414719 /nfs/dbraw/zinc/41/47/19/509414719.db2.gz OQDCHXWRUJVNLF-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000173258683 509485651 /nfs/dbraw/zinc/48/56/51/509485651.db2.gz RKUJBHQCFCHVGZ-CABCVRRESA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@H](NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315878 509526986 /nfs/dbraw/zinc/52/69/86/509526986.db2.gz ONUBAVLLWQOWCN-MGPUTAFESA-N 1 1 355.438 2.665 20 5 FFBDMO C[C@H](NC[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315878 509526994 /nfs/dbraw/zinc/52/69/94/509526994.db2.gz ONUBAVLLWQOWCN-MGPUTAFESA-N 1 1 355.438 2.665 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000248945917 509550515 /nfs/dbraw/zinc/55/05/15/509550515.db2.gz ZGWNKOIOHPAFKS-ACJLOTCBSA-N 1 1 354.410 2.549 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000189416151 509565336 /nfs/dbraw/zinc/56/53/36/509565336.db2.gz FCTIDOPFZZNQQM-AWEZNQCLSA-N 1 1 374.441 2.527 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)C1CC1 ZINC000186415831 509699290 /nfs/dbraw/zinc/69/92/90/509699290.db2.gz ZKRGZZWZHMPFGB-MRXNPFEDSA-N 1 1 366.425 2.960 20 5 FFBDMO Cc1n[nH]c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000264834166 509731904 /nfs/dbraw/zinc/73/19/04/509731904.db2.gz ZTYQTJNRFBGUGB-MQVJKMGUSA-N 1 1 369.425 2.552 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173844014 509812110 /nfs/dbraw/zinc/81/21/10/509812110.db2.gz AUYWVCMDJLLMQA-CABCVRRESA-N 1 1 367.471 2.539 20 5 FFBDMO Cc1csc([C@@H]([NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C2CC2)n1 ZINC000183524321 509841435 /nfs/dbraw/zinc/84/14/35/509841435.db2.gz NWLONCDKSSOVLG-KRWDZBQOSA-N 1 1 372.450 2.990 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)Nc1ccncc1[N+](=O)[O-] ZINC000183566305 509865741 /nfs/dbraw/zinc/86/57/41/509865741.db2.gz XHMVOKLPOYRELK-MRXNPFEDSA-N 1 1 369.425 2.676 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000177207988 509937822 /nfs/dbraw/zinc/93/78/22/509937822.db2.gz NWMUOXNEWGHTPX-ZFWWWQNUSA-N 1 1 358.442 2.550 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000174124470 509958562 /nfs/dbraw/zinc/95/85/62/509958562.db2.gz LONAAWQMMWUVEG-AWEZNQCLSA-N 1 1 362.430 2.989 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c([N+](=O)[O-])c1 ZINC000193585088 509977681 /nfs/dbraw/zinc/97/76/81/509977681.db2.gz MOGOKJBQMNDMJE-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC000190211328 510007225 /nfs/dbraw/zinc/00/72/25/510007225.db2.gz AUXAGGGJHYGFOS-INIZCTEOSA-N 1 1 363.458 2.685 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000174411698 510101792 /nfs/dbraw/zinc/10/17/92/510101792.db2.gz KXXJYULOXDTIDE-CQSZACIVSA-N 1 1 373.457 2.911 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245743939 510122436 /nfs/dbraw/zinc/12/24/36/510122436.db2.gz XSOBULNJHPURNJ-GUYCJALGSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245743939 510122451 /nfs/dbraw/zinc/12/24/51/510122451.db2.gz XSOBULNJHPURNJ-GUYCJALGSA-N 1 1 357.414 2.621 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180831063 510133468 /nfs/dbraw/zinc/13/34/68/510133468.db2.gz OVXVTKDMEQYJNR-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194000653 510169347 /nfs/dbraw/zinc/16/93/47/510169347.db2.gz HMUZJVNRKHJTDO-QGZVFWFLSA-N 1 1 368.437 2.916 20 5 FFBDMO COc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000262087194 510173904 /nfs/dbraw/zinc/17/39/04/510173904.db2.gz YDGRQLQGILEMNN-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000190510321 510176254 /nfs/dbraw/zinc/17/62/54/510176254.db2.gz HTMLEUGEERVMDV-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(O)CCCCCC1 ZINC000187359370 510216728 /nfs/dbraw/zinc/21/67/28/510216728.db2.gz GLGFVNRYRODLDK-UHFFFAOYSA-N 1 1 361.442 2.501 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCCc3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1 ZINC000194194183 510257773 /nfs/dbraw/zinc/25/77/73/510257773.db2.gz ZWDRIUPSVVPHNK-UHFFFAOYSA-N 1 1 368.437 2.874 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC000174738459 510283495 /nfs/dbraw/zinc/28/34/95/510283495.db2.gz RYFKKCFKKGWBLO-JKSUJKDBSA-N 1 1 350.806 2.643 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)cc1)[NH+]1CCOCC1 ZINC000184380675 510296027 /nfs/dbraw/zinc/29/60/27/510296027.db2.gz HXFXJRHEEGMEED-CYBMUJFWSA-N 1 1 370.409 2.823 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269428959 510402376 /nfs/dbraw/zinc/40/23/76/510402376.db2.gz ZFGNNRCSTMSZOY-OAHLLOKOSA-N 1 1 371.441 2.836 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000246324620 510425927 /nfs/dbraw/zinc/42/59/27/510425927.db2.gz NEDLHSYWAYDNOL-CRAIPNDOSA-N 1 1 362.474 2.899 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000178155050 510461578 /nfs/dbraw/zinc/46/15/78/510461578.db2.gz ZHLMLBONVYCLIR-UHFFFAOYSA-N 1 1 354.410 2.525 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000246441006 510490165 /nfs/dbraw/zinc/49/01/65/510490165.db2.gz CAOACTXUPVYMMQ-GUYCJALGSA-N 1 1 359.426 2.579 20 5 FFBDMO COc1cccc(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000194828830 510548731 /nfs/dbraw/zinc/54/87/31/510548731.db2.gz LYSUGRZAOBOVFU-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246742440 510646732 /nfs/dbraw/zinc/64/67/32/510646732.db2.gz IPNVHXXLZHDRDH-DOTOQJQBSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178653527 510705642 /nfs/dbraw/zinc/70/56/42/510705642.db2.gz IWBMWWFDYQFFKM-OAHLLOKOSA-N 1 1 370.453 2.737 20 5 FFBDMO CC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000246850070 510709261 /nfs/dbraw/zinc/70/92/61/510709261.db2.gz ZTXWGCZHPKVOAW-CZUORRHYSA-N 1 1 358.398 2.982 20 5 FFBDMO COCC[N@H+]1CCCN(c2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000270207543 510716280 /nfs/dbraw/zinc/71/62/80/510716280.db2.gz KWRHTRJYVOBELW-UHFFFAOYSA-N 1 1 371.441 2.519 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909293 510739860 /nfs/dbraw/zinc/73/98/60/510739860.db2.gz RWUUKLLOYOKVMT-IFXJQAMLSA-N 1 1 373.453 2.910 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000182075734 510743367 /nfs/dbraw/zinc/74/33/67/510743367.db2.gz YDVPZAWPWDUDRK-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO Cc1cc(N2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000263564718 510750979 /nfs/dbraw/zinc/75/09/79/510750979.db2.gz VBQRZISTLPRSOV-AWEZNQCLSA-N 1 1 372.425 2.827 20 5 FFBDMO O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1cccc([N+](=O)[O-])c1 ZINC000175749361 510769921 /nfs/dbraw/zinc/76/99/21/510769921.db2.gz SLALJMKNPADOAE-LJQANCHMSA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1cccc([N+](=O)[O-])c1 ZINC000175749361 510769929 /nfs/dbraw/zinc/76/99/29/510769929.db2.gz SLALJMKNPADOAE-LJQANCHMSA-N 1 1 369.421 2.502 20 5 FFBDMO CCC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000182156995 510785969 /nfs/dbraw/zinc/78/59/69/510785969.db2.gz HKDMMOJWTYNQEY-JKSUJKDBSA-N 1 1 352.431 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000247032423 510809686 /nfs/dbraw/zinc/80/96/86/510809686.db2.gz ZVUUJJYWPSQMHX-PKOBYXMFSA-N 1 1 371.437 2.911 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182250119 510833836 /nfs/dbraw/zinc/83/38/36/510833836.db2.gz AQOMBOJFAPGEJB-AWEZNQCLSA-N 1 1 365.455 2.744 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000247113463 510837394 /nfs/dbraw/zinc/83/73/94/510837394.db2.gz LRPCHFGOGCROIL-MAUKXSAKSA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000247267782 510854911 /nfs/dbraw/zinc/85/49/11/510854911.db2.gz FIQCKGSRMPODET-DVOMOZLQSA-N 1 1 351.472 2.874 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000282396279 510959290 /nfs/dbraw/zinc/95/92/90/510959290.db2.gz HIBKNUJQMZAUPL-UHFFFAOYSA-N 1 1 372.381 2.640 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 ZINC000282396279 510959295 /nfs/dbraw/zinc/95/92/95/510959295.db2.gz HIBKNUJQMZAUPL-UHFFFAOYSA-N 1 1 372.381 2.640 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000364601662 510964308 /nfs/dbraw/zinc/96/43/08/510964308.db2.gz GHDUCXQBVXTFCB-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000361035448 510984110 /nfs/dbraw/zinc/98/41/10/510984110.db2.gz ZQBGNAVEJWZFSK-LIRRHRJNSA-N 1 1 368.437 2.939 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000294907171 511217054 /nfs/dbraw/zinc/21/70/54/511217054.db2.gz JZLLULLEYGOGHT-ZBFHGGJFSA-N 1 1 369.425 2.684 20 5 FFBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000294907171 511217058 /nfs/dbraw/zinc/21/70/58/511217058.db2.gz JZLLULLEYGOGHT-ZBFHGGJFSA-N 1 1 369.425 2.684 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000294907171 511217060 /nfs/dbraw/zinc/21/70/60/511217060.db2.gz JZLLULLEYGOGHT-ZBFHGGJFSA-N 1 1 369.425 2.684 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481712 511219450 /nfs/dbraw/zinc/21/94/50/511219450.db2.gz NPSMRMKGRIXIGK-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481712 511219453 /nfs/dbraw/zinc/21/94/53/511219453.db2.gz NPSMRMKGRIXIGK-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481712 511219455 /nfs/dbraw/zinc/21/94/55/511219455.db2.gz NPSMRMKGRIXIGK-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000362776418 511236166 /nfs/dbraw/zinc/23/61/66/511236166.db2.gz UZUNJGCMPSLDGW-GDBMZVCRSA-N 1 1 361.442 2.979 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271734960 511304408 /nfs/dbraw/zinc/30/44/08/511304408.db2.gz NTEYCLVKAGHUDT-ZDUSSCGKSA-N 1 1 370.409 2.586 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000291726407 511313231 /nfs/dbraw/zinc/31/32/31/511313231.db2.gz HXIJLSLYPDYSSF-KBXCAEBGSA-N 1 1 369.421 2.996 20 5 FFBDMO O=c1[nH]nc(C2CCN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)o1 ZINC000295276829 511346299 /nfs/dbraw/zinc/34/62/99/511346299.db2.gz IDEHVORARRZUFW-UHFFFAOYSA-N 1 1 372.303 2.670 20 5 FFBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000291924445 511392371 /nfs/dbraw/zinc/39/23/71/511392371.db2.gz NSUPKWIALROSFY-UHFFFAOYSA-N 1 1 370.409 2.983 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(n4cccn4)CC3)n2)c1 ZINC000363187296 511406456 /nfs/dbraw/zinc/40/64/56/511406456.db2.gz KOGTUPHGYWWUJH-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO Nc1ccc(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000283757189 511489806 /nfs/dbraw/zinc/48/98/06/511489806.db2.gz MFLLCDXVKQEGBO-QGZVFWFLSA-N 1 1 356.426 2.746 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccc(O)cc1 ZINC000296119895 511625612 /nfs/dbraw/zinc/62/56/12/511625612.db2.gz SYSCMUZUEMLKKB-ZWKOTPCHSA-N 1 1 356.378 2.689 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](CCCO)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000281006865 511686493 /nfs/dbraw/zinc/68/64/93/511686493.db2.gz NCRMWIJUUZKKMM-UHFFFAOYSA-N 1 1 372.425 2.511 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000296450731 511747852 /nfs/dbraw/zinc/74/78/52/511747852.db2.gz IQIPVKGUXWYONM-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450731 511747854 /nfs/dbraw/zinc/74/78/54/511747854.db2.gz IQIPVKGUXWYONM-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450731 511747858 /nfs/dbraw/zinc/74/78/58/511747858.db2.gz IQIPVKGUXWYONM-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO COc1cc(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350340287 511783684 /nfs/dbraw/zinc/78/36/84/511783684.db2.gz NTDZWVMAGYVCNX-RHSMWYFYSA-N 1 1 360.370 2.579 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000284634918 511804415 /nfs/dbraw/zinc/80/44/15/511804415.db2.gz NNJKFACVQCNCDF-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4CCn5c[nH+]cc5C4)n3)c2c1 ZINC000363994425 511893483 /nfs/dbraw/zinc/89/34/83/511893483.db2.gz NIOVMOHHTXZKPN-LLVKDONJSA-N 1 1 364.365 2.976 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000364053269 511931796 /nfs/dbraw/zinc/93/17/96/511931796.db2.gz GRIDTLDJXYXCTE-MJGOQNOKSA-N 1 1 369.421 2.782 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](O)Cc1ccccc1 ZINC000293441375 511966957 /nfs/dbraw/zinc/96/69/57/511966957.db2.gz VBWHWRCJNSUGHK-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](O)Cc1ccccc1 ZINC000293441375 511966963 /nfs/dbraw/zinc/96/69/63/511966963.db2.gz VBWHWRCJNSUGHK-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875403 511973155 /nfs/dbraw/zinc/97/31/55/511973155.db2.gz XIUYKPQCHWLSHB-IAGOWNOFSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875403 511973161 /nfs/dbraw/zinc/97/31/61/511973161.db2.gz XIUYKPQCHWLSHB-IAGOWNOFSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875403 511973167 /nfs/dbraw/zinc/97/31/67/511973167.db2.gz XIUYKPQCHWLSHB-IAGOWNOFSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000281912239 512008757 /nfs/dbraw/zinc/00/87/57/512008757.db2.gz JACLQGLKSQJNNC-CZUORRHYSA-N 1 1 362.430 2.942 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000375774461 512500070 /nfs/dbraw/zinc/50/00/70/512500070.db2.gz PDAYSUHREQTBOI-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000375774461 512500075 /nfs/dbraw/zinc/50/00/75/512500075.db2.gz PDAYSUHREQTBOI-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccnc1-n1cc[nH+]c1C ZINC000373781993 512502599 /nfs/dbraw/zinc/50/25/99/512502599.db2.gz WCKKHPNQOPALJN-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917707 512511343 /nfs/dbraw/zinc/51/13/43/512511343.db2.gz RXYCEAYCDONAJL-CHWSQXEVSA-N 1 1 373.413 2.533 20 5 FFBDMO O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000367478709 512522225 /nfs/dbraw/zinc/52/22/25/512522225.db2.gz MTXDWRGNSYHHAO-MRXNPFEDSA-N 1 1 370.409 2.844 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000374169574 512689603 /nfs/dbraw/zinc/68/96/03/512689603.db2.gz DEMGKYZKKXCPBN-IPMKNSEASA-N 1 1 370.405 2.517 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1F ZINC000411606232 512715240 /nfs/dbraw/zinc/71/52/40/512715240.db2.gz QPIDEKGZICAASE-STQMWFEESA-N 1 1 367.421 2.522 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000372330088 512818561 /nfs/dbraw/zinc/81/85/61/512818561.db2.gz DRZXIVZSRBBWNB-CRAIPNDOSA-N 1 1 358.442 2.896 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000378563069 512825615 /nfs/dbraw/zinc/82/56/15/512825615.db2.gz RPNPHXGVQGCEDT-BPQIPLTHSA-N 1 1 355.442 2.634 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC000412060132 512936888 /nfs/dbraw/zinc/93/68/88/512936888.db2.gz DZBYMHPXGHJUJK-AWEZNQCLSA-N 1 1 352.435 2.625 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000396464033 512942863 /nfs/dbraw/zinc/94/28/63/512942863.db2.gz VWKOLDNLSZIUDS-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000396464033 512942867 /nfs/dbraw/zinc/94/28/67/512942867.db2.gz VWKOLDNLSZIUDS-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000397976610 512951359 /nfs/dbraw/zinc/95/13/59/512951359.db2.gz KWJZIHPNMNUTDR-BBRMVZONSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090909 512996714 /nfs/dbraw/zinc/99/67/14/512996714.db2.gz VXBOJXNXKQQLSK-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090909 512996717 /nfs/dbraw/zinc/99/67/17/512996717.db2.gz VXBOJXNXKQQLSK-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370588031 513006283 /nfs/dbraw/zinc/00/62/83/513006283.db2.gz KCAXEJVISHCLRE-MAUKXSAKSA-N 1 1 352.394 2.746 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000439705435 513168629 /nfs/dbraw/zinc/16/86/29/513168629.db2.gz USHHIOYCLZAQPR-ZDUSSCGKSA-N 1 1 352.410 2.556 20 5 FFBDMO Cc1nc(NCC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450401272 513178296 /nfs/dbraw/zinc/17/82/96/513178296.db2.gz HXUZEFSPXKPWHD-YOEHRIQHSA-N 1 1 355.442 2.828 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)C1CCCC1 ZINC000439923008 513211512 /nfs/dbraw/zinc/21/15/12/513211512.db2.gz CBGIDJJYPOBIMS-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000417859827 513242899 /nfs/dbraw/zinc/24/28/99/513242899.db2.gz XBIDJXLJGKOGEW-RDTXWAMCSA-N 1 1 369.425 2.715 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000417859824 513243715 /nfs/dbraw/zinc/24/37/15/513243715.db2.gz XBIDJXLJGKOGEW-KBXCAEBGSA-N 1 1 369.425 2.715 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](NC(C)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000421390591 513246412 /nfs/dbraw/zinc/24/64/12/513246412.db2.gz OEDSFENKQBJKCI-ZDUSSCGKSA-N 1 1 359.382 2.574 20 5 FFBDMO C[C@H](c1ccccc1)[C@@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450566526 513253542 /nfs/dbraw/zinc/25/35/42/513253542.db2.gz KXYFLUQDTWFPPN-HFTRVMKXSA-N 1 1 356.426 2.641 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCOC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042783 513266330 /nfs/dbraw/zinc/26/63/30/513266330.db2.gz RHVSAQRLAWQYIA-GOEBONIOSA-N 1 1 361.442 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCOC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042783 513266339 /nfs/dbraw/zinc/26/63/39/513266339.db2.gz RHVSAQRLAWQYIA-GOEBONIOSA-N 1 1 361.442 2.979 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000434710055 513404872 /nfs/dbraw/zinc/40/48/72/513404872.db2.gz ZCFBAEJYRLARFB-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000434710055 513404876 /nfs/dbraw/zinc/40/48/76/513404876.db2.gz ZCFBAEJYRLARFB-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@]3(CO)CCCc4ccccc43)nc2c1 ZINC000440822366 513415498 /nfs/dbraw/zinc/41/54/98/513415498.db2.gz TTYMVAITIPALFW-IBGZPJMESA-N 1 1 352.394 2.785 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3nccc4ccc([N+](=O)[O-])cc43)CC2)CCO1 ZINC000413069388 513422138 /nfs/dbraw/zinc/42/21/38/513422138.db2.gz DVGHSGBYAQARBC-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@H]1CN(c2cccc3cnccc32)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000447383382 513459481 /nfs/dbraw/zinc/45/94/81/513459481.db2.gz KNLDMBDYDGXMKR-HNNXBMFYSA-N 1 1 366.425 2.550 20 5 FFBDMO Cn1cc(C[N@H+]2CCCN(c3ccc([N+](=O)[O-])c4ncccc34)CC2)cn1 ZINC000413122613 513462763 /nfs/dbraw/zinc/46/27/63/513462763.db2.gz AGTYPWSDLAQSGH-UHFFFAOYSA-N 1 1 366.425 2.589 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)n2)cc1 ZINC000441198866 513509490 /nfs/dbraw/zinc/50/94/90/513509490.db2.gz CKNMIHOWRKERCW-HUUCEWRRSA-N 1 1 358.398 2.893 20 5 FFBDMO Cn1cc(CN2CCC[C@H]3C[N@@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000425361781 513529455 /nfs/dbraw/zinc/52/94/55/513529455.db2.gz YQWNNCPKEPVNGS-MAUKXSAKSA-N 1 1 355.442 2.521 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(Cc3ccc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000425447590 513571142 /nfs/dbraw/zinc/57/11/42/513571142.db2.gz PXZZGARWOWSRGB-HNNXBMFYSA-N 1 1 354.248 2.885 20 5 FFBDMO NC(=O)c1cccc(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000451202431 513585995 /nfs/dbraw/zinc/58/59/95/513585995.db2.gz MZUZTOBXILLLTC-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201043 513587394 /nfs/dbraw/zinc/58/73/94/513587394.db2.gz BWBCISSAYLLLNN-MAUKXSAKSA-N 1 1 365.474 2.830 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000447852206 513601192 /nfs/dbraw/zinc/60/11/92/513601192.db2.gz YTCISGNZMSOFII-MRXNPFEDSA-N 1 1 365.430 2.679 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCCCC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1 ZINC000413348290 513607359 /nfs/dbraw/zinc/60/73/59/513607359.db2.gz NTMRREFVZPZIMZ-UHFFFAOYSA-N 1 1 371.441 2.846 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000448036421 513663085 /nfs/dbraw/zinc/66/30/85/513663085.db2.gz YAPMBEQFDOXGEE-QGZVFWFLSA-N 1 1 360.458 2.783 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451339622 513687065 /nfs/dbraw/zinc/68/70/65/513687065.db2.gz ILTBNIWGSFOVTH-RNJTYBCJSA-N 1 1 361.442 2.937 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000451428945 513745991 /nfs/dbraw/zinc/74/59/91/513745991.db2.gz WVRSOEDPENAZCP-MJSCVDMRSA-N 1 1 361.442 2.856 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c(C)cc1[N+](=O)[O-] ZINC000416395139 513750181 /nfs/dbraw/zinc/75/01/81/513750181.db2.gz YGENDATXTPHBQP-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000416406203 513754920 /nfs/dbraw/zinc/75/49/20/513754920.db2.gz FCGKTBUNWDOOMI-HUUCEWRRSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000419340397 513782413 /nfs/dbraw/zinc/78/24/13/513782413.db2.gz NAYPZTJSWGAJKH-VXGBXAGGSA-N 1 1 361.364 2.501 20 5 FFBDMO C[NH+](C)CC(C)(C)NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000416510994 513810303 /nfs/dbraw/zinc/81/03/03/513810303.db2.gz WKOOPKJIFHPIJK-UHFFFAOYSA-N 1 1 370.258 2.520 20 5 FFBDMO CNC(=O)Cc1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451545462 513823966 /nfs/dbraw/zinc/82/39/66/513823966.db2.gz HLFMOBCXKDBHHO-AWEZNQCLSA-N 1 1 374.466 2.719 20 5 FFBDMO CNC(=O)Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451545462 513823974 /nfs/dbraw/zinc/82/39/74/513823974.db2.gz HLFMOBCXKDBHHO-AWEZNQCLSA-N 1 1 374.466 2.719 20 5 FFBDMO C[C@H](C(=O)Nc1ncccn1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548441 513825390 /nfs/dbraw/zinc/82/53/90/513825390.db2.gz NFPGBFMTLHIIGW-UKRRQHHQSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@H](C(=O)Nc1ncccn1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548441 513825399 /nfs/dbraw/zinc/82/53/99/513825399.db2.gz NFPGBFMTLHIIGW-UKRRQHHQSA-N 1 1 355.398 2.591 20 5 FFBDMO CCOCCCNC(=O)[C@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549682 513825778 /nfs/dbraw/zinc/82/57/78/513825778.db2.gz QCNRZUDXXDSVGS-RDJZCZTQSA-N 1 1 363.458 2.706 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000413843427 513844465 /nfs/dbraw/zinc/84/44/65/513844465.db2.gz JJFZMABOMKXLLS-IPMKNSEASA-N 1 1 351.406 2.871 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)[C@@H]1CCCC[C@H]1O ZINC000426234783 513880273 /nfs/dbraw/zinc/88/02/73/513880273.db2.gz AKUNVYOSZDNFAE-VCTAVGKDSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448780733 513895833 /nfs/dbraw/zinc/89/58/33/513895833.db2.gz KWJHYYACJWRNQQ-LSDHHAIUSA-N 1 1 361.442 2.794 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000431493219 513911304 /nfs/dbraw/zinc/91/13/04/513911304.db2.gz AYTZPEXLFDBALX-JOYOIKCWSA-N 1 1 356.220 2.570 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691976 513914408 /nfs/dbraw/zinc/91/44/08/513914408.db2.gz DCUVABYYXGIRAU-YRGRVCCFSA-N 1 1 367.833 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691976 513914413 /nfs/dbraw/zinc/91/44/13/513914413.db2.gz DCUVABYYXGIRAU-YRGRVCCFSA-N 1 1 367.833 2.670 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1 ZINC000451697801 513917309 /nfs/dbraw/zinc/91/73/09/513917309.db2.gz ROXAARLVRRTFOP-HLLBOEOZSA-N 1 1 361.442 2.715 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)n2)c1 ZINC000451707784 513927062 /nfs/dbraw/zinc/92/70/62/513927062.db2.gz NBZMPBUJMVLERT-XPKDYRNWSA-N 1 1 358.398 2.628 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H](CO)CC(C)(C)C ZINC000451791517 513983321 /nfs/dbraw/zinc/98/33/21/513983321.db2.gz QAXLMMDXGCFFDC-AWEZNQCLSA-N 1 1 365.430 2.622 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601474 514196942 /nfs/dbraw/zinc/19/69/42/514196942.db2.gz NMMWGPSMGAJJLA-MRXNPFEDSA-N 1 1 368.437 2.652 20 5 FFBDMO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449456801 514219025 /nfs/dbraw/zinc/21/90/25/514219025.db2.gz SRWVVRBSSYIZFE-IBGZPJMESA-N 1 1 374.393 2.866 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000449550066 514249986 /nfs/dbraw/zinc/24/99/86/514249986.db2.gz BXERSONCJLPBDB-VNHYZAJKSA-N 1 1 350.415 2.595 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438022926 514290297 /nfs/dbraw/zinc/29/02/97/514290297.db2.gz ZCODOCYHLWJOGL-AEFFLSMTSA-N 1 1 358.442 2.896 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CCCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000449791133 514353402 /nfs/dbraw/zinc/35/34/02/514353402.db2.gz NSJIURRKMOAUNU-NSHDSACASA-N 1 1 360.357 2.799 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2NCc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1 ZINC000470524957 514513780 /nfs/dbraw/zinc/51/37/80/514513780.db2.gz BREFCOLHTZESTD-OKILXGFUSA-N 1 1 359.430 2.550 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2NCc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1 ZINC000470524957 514513788 /nfs/dbraw/zinc/51/37/88/514513788.db2.gz BREFCOLHTZESTD-OKILXGFUSA-N 1 1 359.430 2.550 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)c([N+](=O)[O-])cc1F ZINC000450192874 514533097 /nfs/dbraw/zinc/53/30/97/514533097.db2.gz LKGRTLUGCTYTNU-ZDUSSCGKSA-N 1 1 367.421 2.983 20 5 FFBDMO Cc1nc(NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)ncc1[N+](=O)[O-] ZINC000450256797 514567582 /nfs/dbraw/zinc/56/75/82/514567582.db2.gz INNRRDNVGCNYPZ-CQSZACIVSA-N 1 1 355.442 2.959 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cccc4c(=O)c5cccc(F)c5[nH]c34)C[C@@H]21 ZINC000452976216 514581795 /nfs/dbraw/zinc/58/17/95/514581795.db2.gz OBWXGROBZNKDIV-PXAZEXFGSA-N 1 1 365.408 2.597 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)CC2)c1 ZINC000484305025 514625316 /nfs/dbraw/zinc/62/53/16/514625316.db2.gz DESOOPVJTVRRSB-UHFFFAOYSA-N 1 1 365.393 2.742 20 5 FFBDMO Cc1ccc(CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]2CCCO2)cc1 ZINC000475368056 514636642 /nfs/dbraw/zinc/63/66/42/514636642.db2.gz ZGUGPMCAEAPBNF-QGZVFWFLSA-N 1 1 358.442 2.860 20 5 FFBDMO Cc1ccc(CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]2CCCO2)cc1 ZINC000475368056 514636651 /nfs/dbraw/zinc/63/66/51/514636651.db2.gz ZGUGPMCAEAPBNF-QGZVFWFLSA-N 1 1 358.442 2.860 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)[C@@H]1CC[N@H+](C(C)C)C1 ZINC000453473004 514663593 /nfs/dbraw/zinc/66/35/93/514663593.db2.gz WLTYJENMWVKQIO-MRXNPFEDSA-N 1 1 358.446 2.792 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000470963177 514695729 /nfs/dbraw/zinc/69/57/29/514695729.db2.gz ZCKDSQMQINCBIC-OAHLLOKOSA-N 1 1 371.441 2.809 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCCC[C@@H]1C ZINC000479858258 514747676 /nfs/dbraw/zinc/74/76/76/514747676.db2.gz AUXVGQIPCCVPKS-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000508342020 514748919 /nfs/dbraw/zinc/74/89/19/514748919.db2.gz JTCSABFOQZVDNW-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO COC(=O)c1cc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)cc([N+](=O)[O-])c1 ZINC000502790869 514779747 /nfs/dbraw/zinc/77/97/47/514779747.db2.gz DITQGPXJHOBENO-UHFFFAOYSA-N 1 1 354.322 2.590 20 5 FFBDMO COc1cc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)cc([N+](=O)[O-])c1OC ZINC000502841466 514804548 /nfs/dbraw/zinc/80/45/48/514804548.db2.gz QXXYNWLHCFGICE-UHFFFAOYSA-N 1 1 356.338 2.820 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000484929734 514847053 /nfs/dbraw/zinc/84/70/53/514847053.db2.gz XZZUPTUKEOZWMH-XJKSGUPXSA-N 1 1 359.430 2.949 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000458658058 514995291 /nfs/dbraw/zinc/99/52/91/514995291.db2.gz UTXVIFYPXAGZIN-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO CC(C)[C@H](CNc1ccc([N+](=O)[O-])cc1OC(F)F)[NH+]1CCOCC1 ZINC000509040530 514998772 /nfs/dbraw/zinc/99/87/72/514998772.db2.gz OITTYCBFQVVQCE-AWEZNQCLSA-N 1 1 359.373 2.965 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000480581398 515007065 /nfs/dbraw/zinc/00/70/65/515007065.db2.gz BPVSHUCPLSRDOM-IRXDYDNUSA-N 1 1 369.421 2.739 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000498723815 515041782 /nfs/dbraw/zinc/04/17/82/515041782.db2.gz YXRXFWWKVGBSNX-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000503473111 515046228 /nfs/dbraw/zinc/04/62/28/515046228.db2.gz VNWNNCDGJIZKFD-HNNXBMFYSA-N 1 1 372.425 2.755 20 5 FFBDMO CC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000462496889 515086920 /nfs/dbraw/zinc/08/69/20/515086920.db2.gz WVHFWJRSFKILIJ-INIZCTEOSA-N 1 1 356.426 2.887 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000456326213 515094962 /nfs/dbraw/zinc/09/49/62/515094962.db2.gz GLIKNIOOYBZELR-HNNXBMFYSA-N 1 1 369.421 2.895 20 5 FFBDMO CC[NH+]1CCN(c2ccc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000467840732 515143385 /nfs/dbraw/zinc/14/33/85/515143385.db2.gz WOLKFYHFNDLPMO-INIZCTEOSA-N 1 1 369.469 2.983 20 5 FFBDMO CCN1CCN(c2ccc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000467840732 515143395 /nfs/dbraw/zinc/14/33/95/515143395.db2.gz WOLKFYHFNDLPMO-INIZCTEOSA-N 1 1 369.469 2.983 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000481132621 515217038 /nfs/dbraw/zinc/21/70/38/515217038.db2.gz DFAWBKSRTFNILD-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345134 515236045 /nfs/dbraw/zinc/23/60/45/515236045.db2.gz VJIMWFQAASOZAI-QGZVFWFLSA-N 1 1 362.474 2.571 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000509591627 515247809 /nfs/dbraw/zinc/24/78/09/515247809.db2.gz JXVBXULEXCNTCU-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000509591627 515247814 /nfs/dbraw/zinc/24/78/14/515247814.db2.gz JXVBXULEXCNTCU-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254802 515285597 /nfs/dbraw/zinc/28/55/97/515285597.db2.gz VRWYRMOLZGLQIN-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)C[N@H+]1CCCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254802 515285606 /nfs/dbraw/zinc/28/56/06/515285606.db2.gz VRWYRMOLZGLQIN-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254802 515285612 /nfs/dbraw/zinc/28/56/12/515285612.db2.gz VRWYRMOLZGLQIN-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254802 515285621 /nfs/dbraw/zinc/28/56/21/515285621.db2.gz VRWYRMOLZGLQIN-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO COc1c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477128428 515340847 /nfs/dbraw/zinc/34/08/47/515340847.db2.gz PYVMFWVUMMGMFQ-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519327 515360357 /nfs/dbraw/zinc/36/03/57/515360357.db2.gz LEYZRIFDSVTILG-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519327 515360364 /nfs/dbraw/zinc/36/03/64/515360364.db2.gz LEYZRIFDSVTILG-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000499713064 515423616 /nfs/dbraw/zinc/42/36/16/515423616.db2.gz NFAFDRQMNGXHMR-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000481757050 515453430 /nfs/dbraw/zinc/45/34/30/515453430.db2.gz WQJCCCYRSJYVQQ-SJORKVTESA-N 1 1 369.421 2.578 20 5 FFBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(=O)OC ZINC000499789706 515455620 /nfs/dbraw/zinc/45/56/20/515455620.db2.gz IGIIMXLUQNLYQK-ZDUSSCGKSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C[C@H](C)OC ZINC000463426499 515490004 /nfs/dbraw/zinc/49/00/04/515490004.db2.gz AVBMVUXMNPOXNZ-JTQLQIEISA-N 1 1 374.235 2.653 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)C[C@H](C)OC ZINC000463426499 515490013 /nfs/dbraw/zinc/49/00/13/515490013.db2.gz AVBMVUXMNPOXNZ-JTQLQIEISA-N 1 1 374.235 2.653 20 5 FFBDMO CCNc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000481899175 515504593 /nfs/dbraw/zinc/50/45/93/515504593.db2.gz BOOWAGLFJLPFKI-UHFFFAOYSA-N 1 1 369.425 2.692 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146113 515505967 /nfs/dbraw/zinc/50/59/67/515505967.db2.gz YCINQAZKALPDKW-UYAOXDASSA-N 1 1 355.438 2.995 20 5 FFBDMO COCC[N@H+]1CC[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146113 515505975 /nfs/dbraw/zinc/50/59/75/515505975.db2.gz YCINQAZKALPDKW-UYAOXDASSA-N 1 1 355.438 2.995 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486509361 515518450 /nfs/dbraw/zinc/51/84/50/515518450.db2.gz BOWHFPKIHZAPPO-ZDUSSCGKSA-N 1 1 367.396 2.606 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N(C)CC[NH+]2CCN(c3ccccc3)CC2)n1 ZINC000482000313 515543370 /nfs/dbraw/zinc/54/33/70/515543370.db2.gz JOHMJDWDIGRBQO-UHFFFAOYSA-N 1 1 355.442 2.557 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000505569325 515588286 /nfs/dbraw/zinc/58/82/86/515588286.db2.gz UCMVHPLOLCDEDJ-RISCZKNCSA-N 1 1 374.384 2.840 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC[NH2+]2)cc1 ZINC000505573287 515590146 /nfs/dbraw/zinc/59/01/46/515590146.db2.gz RZOUFFVLKNZPGN-KRWDZBQOSA-N 1 1 369.421 2.953 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000500109341 515593166 /nfs/dbraw/zinc/59/31/66/515593166.db2.gz BOAADLOSVQQJQH-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000500121231 515599290 /nfs/dbraw/zinc/59/92/90/515599290.db2.gz KVPOXMUTUFQLGJ-KBPBESRZSA-N 1 1 371.441 2.550 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505870009 515703278 /nfs/dbraw/zinc/70/32/78/515703278.db2.gz RVLMNYILFIBNFJ-MRXNPFEDSA-N 1 1 369.421 2.959 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505870009 515703290 /nfs/dbraw/zinc/70/32/90/515703290.db2.gz RVLMNYILFIBNFJ-MRXNPFEDSA-N 1 1 369.421 2.959 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000494036219 515716129 /nfs/dbraw/zinc/71/61/29/515716129.db2.gz DEZNCQOWQQNQJD-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000478169055 515723621 /nfs/dbraw/zinc/72/36/21/515723621.db2.gz KZVMPHQGAJWGMJ-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929497 515727677 /nfs/dbraw/zinc/72/76/77/515727677.db2.gz DOCMPUOMVGAASJ-CZUORRHYSA-N 1 1 355.394 2.866 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929497 515727684 /nfs/dbraw/zinc/72/76/84/515727684.db2.gz DOCMPUOMVGAASJ-CZUORRHYSA-N 1 1 355.394 2.866 20 5 FFBDMO C[C@H](C(=O)NCc1ccc(F)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511066484 515763304 /nfs/dbraw/zinc/76/33/04/515763304.db2.gz REXIGJFTKFSMRG-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511066484 515763309 /nfs/dbraw/zinc/76/33/09/515763309.db2.gz REXIGJFTKFSMRG-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459801292 515814584 /nfs/dbraw/zinc/81/45/84/515814584.db2.gz KXQRNYWOYQVGAF-JEBQAFNWSA-N 1 1 361.442 2.795 20 5 FFBDMO O=C(NCC[N@H+]1CC=CCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506766864 515978039 /nfs/dbraw/zinc/97/80/39/515978039.db2.gz ITBZXBLKUNJUML-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506766864 515978050 /nfs/dbraw/zinc/97/80/50/515978050.db2.gz ITBZXBLKUNJUML-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)o1 ZINC000483194426 515979183 /nfs/dbraw/zinc/97/91/83/515979183.db2.gz IQLBXFIJMBKBPZ-UHFFFAOYSA-N 1 1 361.398 2.628 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000507003299 516050163 /nfs/dbraw/zinc/05/01/63/516050163.db2.gz VRQGWRJIGPKUSX-BBRMVZONSA-N 1 1 354.410 2.941 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCC[C@@H]1C ZINC000487998521 516071686 /nfs/dbraw/zinc/07/16/86/516071686.db2.gz IGARPZFQQOKSCD-BBRMVZONSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)C1 ZINC000465184852 516088311 /nfs/dbraw/zinc/08/83/11/516088311.db2.gz LAEKXTNOKLXCBN-CYBMUJFWSA-N 1 1 358.398 2.896 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCC[C@H]1C ZINC000488075547 516107782 /nfs/dbraw/zinc/10/77/82/516107782.db2.gz ORWNDZLMNVGGEE-PBHICJAKSA-N 1 1 361.442 2.621 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000507285924 516158488 /nfs/dbraw/zinc/15/84/88/516158488.db2.gz VVQAYHBELADXFU-CJNGLKHVSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000507285924 516158500 /nfs/dbraw/zinc/15/85/00/516158500.db2.gz VVQAYHBELADXFU-CJNGLKHVSA-N 1 1 355.394 2.693 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000488493296 516239515 /nfs/dbraw/zinc/23/95/15/516239515.db2.gz KZIGGQQFICQZIE-AWEZNQCLSA-N 1 1 363.414 2.708 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000465735800 516242122 /nfs/dbraw/zinc/24/21/22/516242122.db2.gz BLSFRBFHUHRNJU-XHSDSOJGSA-N 1 1 362.474 2.803 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@]3(CC[N@H+](C)C3)C2)ncc1[N+](=O)[O-] ZINC000488743164 516299243 /nfs/dbraw/zinc/29/92/43/516299243.db2.gz HBSUGVKZJBJVTJ-CQSZACIVSA-N 1 1 355.236 2.593 20 5 FFBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000517556487 516360800 /nfs/dbraw/zinc/36/08/00/516360800.db2.gz PZLCYQYCPURWNJ-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000517556487 516360810 /nfs/dbraw/zinc/36/08/10/516360810.db2.gz PZLCYQYCPURWNJ-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCN([C@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000550681064 516382689 /nfs/dbraw/zinc/38/26/89/516382689.db2.gz SUXVUJODGMNSLV-NRFANRHFSA-N 1 1 366.465 2.991 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000531342955 516417185 /nfs/dbraw/zinc/41/71/85/516417185.db2.gz UQRJKTCGVOEMFR-UHFFFAOYSA-N 1 1 363.311 2.624 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000558027890 516558551 /nfs/dbraw/zinc/55/85/51/516558551.db2.gz XFFMFBWSWPJWAP-DOXZYTNZSA-N 1 1 370.453 2.738 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000531624601 516560561 /nfs/dbraw/zinc/56/05/61/516560561.db2.gz XMSJWCZYYQTXFE-LJQANCHMSA-N 1 1 368.437 2.803 20 5 FFBDMO CC[N@H+](CCc1cccs1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000544061936 516564720 /nfs/dbraw/zinc/56/47/20/516564720.db2.gz MJAGCZGVJBTJAD-UHFFFAOYSA-N 1 1 368.480 2.995 20 5 FFBDMO CC[N@@H+](CCc1cccs1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000544061936 516564729 /nfs/dbraw/zinc/56/47/29/516564729.db2.gz MJAGCZGVJBTJAD-UHFFFAOYSA-N 1 1 368.480 2.995 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544144004 516612794 /nfs/dbraw/zinc/61/27/94/516612794.db2.gz MEFUQULTKIVYCV-FXAWDEMLSA-N 1 1 356.422 2.998 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000561506421 516622672 /nfs/dbraw/zinc/62/26/72/516622672.db2.gz XMGJQUFSIWOBGY-UHFFFAOYSA-N 1 1 370.453 2.911 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000536097135 516628027 /nfs/dbraw/zinc/62/80/27/516628027.db2.gz ZNBLBEGJMHOFJM-HNNXBMFYSA-N 1 1 362.474 2.947 20 5 FFBDMO C[N@@H+](CCN1CCN(Cc2cccc([N+](=O)[O-])c2)CC1)Cc1ccccc1 ZINC000513451072 516628761 /nfs/dbraw/zinc/62/87/61/516628761.db2.gz NRUKJZBGERESHS-UHFFFAOYSA-N 1 1 368.481 2.844 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1)CC(C)C ZINC000554874782 516676243 /nfs/dbraw/zinc/67/62/43/516676243.db2.gz VURJDFHKCNSEKP-UHFFFAOYSA-N 1 1 351.451 2.538 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000555099889 516780540 /nfs/dbraw/zinc/78/05/40/516780540.db2.gz QWDKXIQOUBMQBR-GOSISDBHSA-N 1 1 360.410 2.911 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@H+]([C@@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000540977323 516812335 /nfs/dbraw/zinc/81/23/35/516812335.db2.gz HQKVGPVGTWTIJX-VVFCZOMOSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@@H](CO)[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000561887397 516816493 /nfs/dbraw/zinc/81/64/93/516816493.db2.gz WRPJBCOXDHTGMQ-ZDUSSCGKSA-N 1 1 363.414 2.518 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551782911 516869284 /nfs/dbraw/zinc/86/92/84/516869284.db2.gz XCGQSBNEAJQMNW-GOSISDBHSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551782911 516869287 /nfs/dbraw/zinc/86/92/87/516869287.db2.gz XCGQSBNEAJQMNW-GOSISDBHSA-N 1 1 353.422 2.523 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000525024175 516899055 /nfs/dbraw/zinc/89/90/55/516899055.db2.gz PEYWHOFOWPWRPG-SGMGOOAPSA-N 1 1 369.849 2.814 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000541205529 516928417 /nfs/dbraw/zinc/92/84/17/516928417.db2.gz FMDYUHVWUYFUPI-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO CCC[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000537221231 517094890 /nfs/dbraw/zinc/09/48/90/517094890.db2.gz RPKQIZSDSNBUKC-GOSISDBHSA-N 1 1 357.458 2.778 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3ncnc4cccc([N+](=O)[O-])c43)CC2)c1 ZINC000541576998 517121702 /nfs/dbraw/zinc/12/17/02/517121702.db2.gz ZFVBKAGHQNLKOU-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO CC1=CC[N@H+](CCN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552280258 517175693 /nfs/dbraw/zinc/17/56/93/517175693.db2.gz ASTSNGBMNFPFKE-SFHVURJKSA-N 1 1 355.442 2.659 20 5 FFBDMO CC1=CC[N@@H+](CCN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552280258 517175702 /nfs/dbraw/zinc/17/57/02/517175702.db2.gz ASTSNGBMNFPFKE-SFHVURJKSA-N 1 1 355.442 2.659 20 5 FFBDMO COc1ccc(CC(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000532991253 517241317 /nfs/dbraw/zinc/24/13/17/517241317.db2.gz OLPRYROSPSEUFO-INIZCTEOSA-N 1 1 363.458 2.630 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000537628037 517267471 /nfs/dbraw/zinc/26/74/71/517267471.db2.gz BMKMEXAESSCIGY-HNNXBMFYSA-N 1 1 361.442 2.828 20 5 FFBDMO CCc1ccc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000552516032 517289999 /nfs/dbraw/zinc/28/99/99/517289999.db2.gz GQNIPZIVIVVHTC-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541924622 517295329 /nfs/dbraw/zinc/29/53/29/517295329.db2.gz HYRXRJHSJBMNJW-HUUCEWRRSA-N 1 1 369.425 2.538 20 5 FFBDMO COc1cc(C)c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1 ZINC000541927962 517297180 /nfs/dbraw/zinc/29/71/80/517297180.db2.gz RKOLKZRJJPPAQB-AWEZNQCLSA-N 1 1 357.414 2.697 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)Cc2ccccc2)c1 ZINC000548951394 517323476 /nfs/dbraw/zinc/32/34/76/517323476.db2.gz ZYXNKYGNRFEJHU-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC2 ZINC000537842708 517375410 /nfs/dbraw/zinc/37/54/10/517375410.db2.gz BZOCEZFBVGDHDO-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC2 ZINC000537842708 517375418 /nfs/dbraw/zinc/37/54/18/517375418.db2.gz BZOCEZFBVGDHDO-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO O=C(c1cc(NC[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000559691114 517376099 /nfs/dbraw/zinc/37/60/99/517376099.db2.gz UIHDHEFMFZHJPY-CQSZACIVSA-N 1 1 358.442 2.727 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000552805467 517400312 /nfs/dbraw/zinc/40/03/12/517400312.db2.gz CFQHCQCJTDGDIH-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000552805467 517400319 /nfs/dbraw/zinc/40/03/19/517400319.db2.gz CFQHCQCJTDGDIH-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO CC(C)(C)c1nc(CN2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000533380582 517435148 /nfs/dbraw/zinc/43/51/48/517435148.db2.gz IYYBVGVNAGPCTK-UHFFFAOYSA-N 1 1 373.457 2.636 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCc1c(F)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000538225093 517515198 /nfs/dbraw/zinc/51/51/98/517515198.db2.gz UBALFWFQBIBJIF-GFCCVEGCSA-N 1 1 363.364 2.883 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c1C ZINC000521046106 517592940 /nfs/dbraw/zinc/59/29/40/517592940.db2.gz IWJJOGJUNYECTG-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000553330559 517649385 /nfs/dbraw/zinc/64/93/85/517649385.db2.gz FUUSGYKIPGMLOQ-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000553330559 517649390 /nfs/dbraw/zinc/64/93/90/517649390.db2.gz FUUSGYKIPGMLOQ-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)c1 ZINC000556915994 517743919 /nfs/dbraw/zinc/74/39/19/517743919.db2.gz DIGSZKAXTHNISS-UHFFFAOYSA-N 1 1 359.430 2.870 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884304 517799633 /nfs/dbraw/zinc/79/96/33/517799633.db2.gz WTYKBEYIPNYXRJ-XIKOKIGWSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884304 517799640 /nfs/dbraw/zinc/79/96/40/517799640.db2.gz WTYKBEYIPNYXRJ-XIKOKIGWSA-N 1 1 361.398 2.774 20 5 FFBDMO CC[NH+](CC)CC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000521791787 517853361 /nfs/dbraw/zinc/85/33/61/517853361.db2.gz FKGZMTCCJDJLAK-UHFFFAOYSA-N 1 1 359.430 2.665 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCCn1ccnc1)c1cccc([N+](=O)[O-])c1 ZINC000560516478 517866563 /nfs/dbraw/zinc/86/65/63/517866563.db2.gz KBVNVQFAAKKGRV-KRWDZBQOSA-N 1 1 354.414 2.684 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000521931416 517905190 /nfs/dbraw/zinc/90/51/90/517905190.db2.gz AHGWVIRQAZSRAV-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000521931416 517905199 /nfs/dbraw/zinc/90/51/99/517905199.db2.gz AHGWVIRQAZSRAV-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000563544004 517974159 /nfs/dbraw/zinc/97/41/59/517974159.db2.gz YITITXJUKTWCFH-QGZVFWFLSA-N 1 1 370.453 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCN([C@@H]3CC[N@@H+](Cc4ccccc4)C3)C2)nc1 ZINC000560729798 517992660 /nfs/dbraw/zinc/99/26/60/517992660.db2.gz OTBMXCOGLQDGPD-IEBWSBKVSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]([C@@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729798 517992671 /nfs/dbraw/zinc/99/26/71/517992671.db2.gz OTBMXCOGLQDGPD-IEBWSBKVSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729798 517992680 /nfs/dbraw/zinc/99/26/80/517992680.db2.gz OTBMXCOGLQDGPD-IEBWSBKVSA-N 1 1 367.453 2.751 20 5 FFBDMO CCC[NH+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000543289350 518007156 /nfs/dbraw/zinc/00/71/56/518007156.db2.gz YHOVWADMWPGDEW-UHFFFAOYSA-N 1 1 357.863 2.895 20 5 FFBDMO COc1ccc2c(c1)CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000534837247 518052429 /nfs/dbraw/zinc/05/24/29/518052429.db2.gz KKXBWALDBDQIBI-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000534837247 518052437 /nfs/dbraw/zinc/05/24/37/518052437.db2.gz KKXBWALDBDQIBI-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H](c3[nH+]ccn3C)C2)ncc1[N+](=O)[O-] ZINC000543435149 518089476 /nfs/dbraw/zinc/08/94/76/518089476.db2.gz IHHFNHQNXWTIBU-SNVBAGLBSA-N 1 1 366.219 2.788 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000534983621 518106415 /nfs/dbraw/zinc/10/64/15/518106415.db2.gz NOVURJHKMSAGDO-UHFFFAOYSA-N 1 1 364.405 2.864 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000522436687 518106855 /nfs/dbraw/zinc/10/68/55/518106855.db2.gz VVJGWIFFOQCSBU-ZDUSSCGKSA-N 1 1 373.450 2.667 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000522436687 518106863 /nfs/dbraw/zinc/10/68/63/518106863.db2.gz VVJGWIFFOQCSBU-ZDUSSCGKSA-N 1 1 373.450 2.667 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000522435560 518108279 /nfs/dbraw/zinc/10/82/79/518108279.db2.gz WUYJBAPKJHXHJL-AWEZNQCLSA-N 1 1 373.450 2.667 20 5 FFBDMO CCc1ccc(-c2noc([C@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000543548825 518133889 /nfs/dbraw/zinc/13/38/89/518133889.db2.gz LRDSFJXWNRMPHQ-LBPRGKRZSA-N 1 1 356.386 2.755 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522830460 518168278 /nfs/dbraw/zinc/16/82/78/518168278.db2.gz VGABNXYUYUMTTB-QGZVFWFLSA-N 1 1 354.410 2.518 20 5 FFBDMO COC(=O)c1cccc(OCC[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000535247152 518170127 /nfs/dbraw/zinc/17/01/27/518170127.db2.gz OINODOATQBUQHR-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc(OCC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000535247152 518170129 /nfs/dbraw/zinc/17/01/29/518170129.db2.gz OINODOATQBUQHR-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000578594911 518280600 /nfs/dbraw/zinc/28/06/00/518280600.db2.gz GIOKMVCDWDFJFN-CYBMUJFWSA-N 1 1 370.409 2.837 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000576143019 518448628 /nfs/dbraw/zinc/44/86/28/518448628.db2.gz HFHBCJNJDKBSCJ-KRWDZBQOSA-N 1 1 359.426 2.533 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000585745500 518582357 /nfs/dbraw/zinc/58/23/57/518582357.db2.gz KQEFKRYDCGDMMJ-UHFFFAOYSA-N 1 1 363.805 2.780 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000585808422 518614020 /nfs/dbraw/zinc/61/40/20/518614020.db2.gz BRGPOXDCCXBGGP-JTQLQIEISA-N 1 1 357.208 2.573 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(=O)n3ccccc3n2)cc1[N+](=O)[O-] ZINC000573854113 518867086 /nfs/dbraw/zinc/86/70/86/518867086.db2.gz PGNCPOVTILQKTE-ZDUSSCGKSA-N 1 1 368.393 2.852 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](CC)C[C@@H]2C)cc1OC ZINC000588997448 518891743 /nfs/dbraw/zinc/89/17/43/518891743.db2.gz YGVCVOQKATTYGA-BETUJISGSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000589261244 518966409 /nfs/dbraw/zinc/96/64/09/518966409.db2.gz IXUGASHZOAICMV-DGCLKSJQSA-N 1 1 355.822 2.670 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CC2(O)CCCCCC2)c1 ZINC000589515073 519021937 /nfs/dbraw/zinc/02/19/37/519021937.db2.gz VGKXYEKJNISLQL-UHFFFAOYSA-N 1 1 350.415 2.899 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)[C@@H]2C1 ZINC000580186826 519050769 /nfs/dbraw/zinc/05/07/69/519050769.db2.gz UPDYGBJTAVCXHF-IFXJQAMLSA-N 1 1 361.445 2.848 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000568572041 519104933 /nfs/dbraw/zinc/10/49/33/519104933.db2.gz VDVBEPLBHKUPOV-LLVKDONJSA-N 1 1 351.378 2.807 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000568663993 519154950 /nfs/dbraw/zinc/15/49/50/519154950.db2.gz JPVSIIUWPWZNPC-XLIONFOSSA-N 1 1 367.449 2.591 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000568663993 519154959 /nfs/dbraw/zinc/15/49/59/519154959.db2.gz JPVSIIUWPWZNPC-XLIONFOSSA-N 1 1 367.449 2.591 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(c3ccc(Br)cc3[N+](=O)[O-])[C@H]2C1 ZINC000590142493 519160122 /nfs/dbraw/zinc/16/01/22/519160122.db2.gz AZDTVHCTKLSXNJ-LSDHHAIUSA-N 1 1 370.247 2.657 20 5 FFBDMO CCC[N@@H+](C)[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000574476839 519172910 /nfs/dbraw/zinc/17/29/10/519172910.db2.gz BNEVUNWMDKADFZ-AWEZNQCLSA-N 1 1 365.821 2.784 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680774 519199953 /nfs/dbraw/zinc/19/99/53/519199953.db2.gz SVNIBFLAHZULNZ-QAPCUYQASA-N 1 1 358.398 2.689 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680774 519199961 /nfs/dbraw/zinc/19/99/61/519199961.db2.gz SVNIBFLAHZULNZ-QAPCUYQASA-N 1 1 358.398 2.689 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@](C)(O)C2)cc1OC ZINC000571792810 519278136 /nfs/dbraw/zinc/27/81/36/519278136.db2.gz PIBGUAVLKWOFLM-SCLBCKFNSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@](C)(O)C2)cc1OC ZINC000571792810 519278140 /nfs/dbraw/zinc/27/81/40/519278140.db2.gz PIBGUAVLKWOFLM-SCLBCKFNSA-N 1 1 352.431 2.985 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2ccccn2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000590600737 519283535 /nfs/dbraw/zinc/28/35/35/519283535.db2.gz LXIKRSYGOGDRNY-MRXNPFEDSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2ccccn2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000590600737 519283538 /nfs/dbraw/zinc/28/35/38/519283538.db2.gz LXIKRSYGOGDRNY-MRXNPFEDSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601948 519283989 /nfs/dbraw/zinc/28/39/89/519283989.db2.gz UEMUGRPZNDPGHU-DNVCBOLYSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601948 519283998 /nfs/dbraw/zinc/28/39/98/519283998.db2.gz UEMUGRPZNDPGHU-DNVCBOLYSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C([O-])C[N@@H+](CC1CC1)C1CC(NC/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000568972021 519310688 /nfs/dbraw/zinc/31/06/88/519310688.db2.gz SJVFQECOFFHGKE-HYXAFXHYSA-N 1 1 359.426 2.525 20 5 FFBDMO O=C([O-])C[N@H+](CC1CC1)C1CC([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000568972021 519310694 /nfs/dbraw/zinc/31/06/94/519310694.db2.gz SJVFQECOFFHGKE-HYXAFXHYSA-N 1 1 359.426 2.525 20 5 FFBDMO O=C([O-])C[N@@H+](CC1CC1)C1CC([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000568972021 519310703 /nfs/dbraw/zinc/31/07/03/519310703.db2.gz SJVFQECOFFHGKE-HYXAFXHYSA-N 1 1 359.426 2.525 20 5 FFBDMO CC[C@@H](C)[NH2+][C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000580793374 519361166 /nfs/dbraw/zinc/36/11/66/519361166.db2.gz DXCGASLDEZDDQD-ABAIWWIYSA-N 1 1 371.397 2.923 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490202 519578494 /nfs/dbraw/zinc/57/84/94/519578494.db2.gz UIIYWASJIRUUDG-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@H](C[N@H+](C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490202 519578530 /nfs/dbraw/zinc/57/85/30/519578530.db2.gz UIIYWASJIRUUDG-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@H](C[N@@H+](C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490202 519578538 /nfs/dbraw/zinc/57/85/38/519578538.db2.gz UIIYWASJIRUUDG-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000566647461 519593244 /nfs/dbraw/zinc/59/32/44/519593244.db2.gz YIXIYKTVMJLACM-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](c3cccnc3)C2)c1 ZINC000602855820 519929366 /nfs/dbraw/zinc/92/93/66/519929366.db2.gz PQYMUTUFHUMHHG-FUHWJXTLSA-N 1 1 357.410 2.609 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C(C)(C)C)C1 ZINC000602874493 519942034 /nfs/dbraw/zinc/94/20/34/519942034.db2.gz RSYXIKUGLWJYSM-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)[C@H](C(C)(C)C)C1 ZINC000602874493 519942044 /nfs/dbraw/zinc/94/20/44/519942044.db2.gz RSYXIKUGLWJYSM-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)[C@H](C(C)(C)C)C1 ZINC000602874493 519942054 /nfs/dbraw/zinc/94/20/54/519942054.db2.gz RSYXIKUGLWJYSM-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(CNC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000616259547 519958301 /nfs/dbraw/zinc/95/83/01/519958301.db2.gz UNOUTTRNUBIEKZ-QGZVFWFLSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1c(CNC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000616259547 519958310 /nfs/dbraw/zinc/95/83/10/519958310.db2.gz UNOUTTRNUBIEKZ-QGZVFWFLSA-N 1 1 354.410 2.889 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461775 519973532 /nfs/dbraw/zinc/97/35/32/519973532.db2.gz VYABRAXCKXGQTC-MWLCHTKSSA-N 1 1 362.386 2.886 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1C ZINC000594483929 519991923 /nfs/dbraw/zinc/99/19/23/519991923.db2.gz LFRNTHYRIAXOME-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000599997518 519993204 /nfs/dbraw/zinc/99/32/04/519993204.db2.gz PKTHJCQFNITACK-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(F)c1N1CCOCC1 ZINC000594546558 520019421 /nfs/dbraw/zinc/01/94/21/520019421.db2.gz QXCBIEZVVQGJOM-KBPBESRZSA-N 1 1 364.421 2.609 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)ccc1[N+](=O)[O-] ZINC000597574914 520111748 /nfs/dbraw/zinc/11/17/48/520111748.db2.gz IVBIASRDWMOPEL-LSDHHAIUSA-N 1 1 365.405 2.640 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597606074 520131911 /nfs/dbraw/zinc/13/19/11/520131911.db2.gz UGJOWSRXPGSRPW-TZMCWYRMSA-N 1 1 369.849 2.958 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000600311267 520197607 /nfs/dbraw/zinc/19/76/07/520197607.db2.gz ONCJQALHURYYPL-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000609234154 520241316 /nfs/dbraw/zinc/24/13/16/520241316.db2.gz SZXPDEWFIAXIKX-GOSISDBHSA-N 1 1 355.394 2.657 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(=O)NCCc1ccccc1 ZINC000595022363 520260386 /nfs/dbraw/zinc/26/03/86/520260386.db2.gz ISEYYYUODAQZQL-AWEZNQCLSA-N 1 1 357.410 2.613 20 5 FFBDMO COc1cc(C[NH+]2CCC(CCO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609312335 520271516 /nfs/dbraw/zinc/27/15/16/520271516.db2.gz PNUDZQLGSCFHFZ-UHFFFAOYSA-N 1 1 360.357 2.799 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1Cc2ccccc2N(C)C1=O ZINC000595067898 520277090 /nfs/dbraw/zinc/27/70/90/520277090.db2.gz YYDDQYSTBPGWRL-MLGOLLRUSA-N 1 1 355.394 2.842 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000600469259 520279181 /nfs/dbraw/zinc/27/91/81/520279181.db2.gz IOCBOUOOXLWJTK-MRXNPFEDSA-N 1 1 369.425 2.732 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000597854307 520283799 /nfs/dbraw/zinc/28/37/99/520283799.db2.gz FXPFOVSXLHHFSK-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000597859771 520285763 /nfs/dbraw/zinc/28/57/63/520285763.db2.gz HMJLXHMXJNLUJW-CYBMUJFWSA-N 1 1 358.442 2.855 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000603784732 520359474 /nfs/dbraw/zinc/35/94/74/520359474.db2.gz JYJMPGQXXZKQHF-BETUJISGSA-N 1 1 361.398 2.570 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493526 520415805 /nfs/dbraw/zinc/41/58/05/520415805.db2.gz UBORCMQXIKAKSB-JKSUJKDBSA-N 1 1 360.458 2.553 20 5 FFBDMO CCOc1cc(N2CC[NH+](CCO[C@H]3CC3(F)F)CC2)ccc1[N+](=O)[O-] ZINC000595464086 520488040 /nfs/dbraw/zinc/48/80/40/520488040.db2.gz GKOLALCDSSBWDP-INIZCTEOSA-N 1 1 371.384 2.540 20 5 FFBDMO C[C@H]1C[NH+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)C[C@H](C)O1 ZINC000609975672 520495206 /nfs/dbraw/zinc/49/52/06/520495206.db2.gz NVHWFTBMNHAOHL-KBPBESRZSA-N 1 1 372.425 2.795 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2cccnc2)C(C)(C)CO)c1 ZINC000595498985 520509468 /nfs/dbraw/zinc/50/94/68/520509468.db2.gz JOSKBSMWEQILLL-KRWDZBQOSA-N 1 1 373.409 2.626 20 5 FFBDMO CN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000610104851 520540254 /nfs/dbraw/zinc/54/02/54/520540254.db2.gz YUNOXEBULLVPOX-SFHVURJKSA-N 1 1 360.458 2.796 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000610129633 520552200 /nfs/dbraw/zinc/55/22/00/520552200.db2.gz VOVCXNLGXULQHT-NEPJUHHUSA-N 1 1 351.378 2.949 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000592745581 520554782 /nfs/dbraw/zinc/55/47/82/520554782.db2.gz APRAZROBNGKVOX-OAHLLOKOSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(NCC[NH+]3Cc4ccccc4C3)cc2N1 ZINC000604482888 520574476 /nfs/dbraw/zinc/57/44/76/520574476.db2.gz FCYUPPDHCIPTSU-UHFFFAOYSA-N 1 1 352.394 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](C)c1cscn1 ZINC000595669460 520634657 /nfs/dbraw/zinc/63/46/57/520634657.db2.gz UXKHBDXESVCOPF-SNVBAGLBSA-N 1 1 350.400 2.739 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595684255 520648305 /nfs/dbraw/zinc/64/83/05/520648305.db2.gz MVKFAVWBVHKOQE-INIZCTEOSA-N 1 1 359.382 2.519 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598508862 520668532 /nfs/dbraw/zinc/66/85/32/520668532.db2.gz IVHTYAATKRFCGY-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508862 520668536 /nfs/dbraw/zinc/66/85/36/520668536.db2.gz IVHTYAATKRFCGY-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc([N+](=O)[O-])c1C ZINC000598559358 520705609 /nfs/dbraw/zinc/70/56/09/520705609.db2.gz GFKCGYMGXCDWOK-HNNXBMFYSA-N 1 1 361.442 2.764 20 5 FFBDMO CC[C@H]1COC(C)(C)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000593058752 520715241 /nfs/dbraw/zinc/71/52/41/520715241.db2.gz NRBPGDCDCXQXNU-ZDUSSCGKSA-N 1 1 363.414 2.782 20 5 FFBDMO O=C(C[NH+]1CCC([C@@H]2CCCCO2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595785308 520721664 /nfs/dbraw/zinc/72/16/64/520721664.db2.gz DIIZGSGEMFEPQI-IBGZPJMESA-N 1 1 373.453 2.765 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@@H]2C1)Nc1cc(N2CC[C@@H]3C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000595810775 520740808 /nfs/dbraw/zinc/74/08/08/520740808.db2.gz NXWUHUAVTRGTNC-KLHDSHLOSA-N 1 1 370.453 2.721 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@@H]2C1)Nc1cc(N2CC[C@@H]3C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000595810775 520740817 /nfs/dbraw/zinc/74/08/17/520740817.db2.gz NXWUHUAVTRGTNC-KLHDSHLOSA-N 1 1 370.453 2.721 20 5 FFBDMO COC(=O)c1ccnc(NCc2ccc(C)[nH+]c2N2CCCC2)c1[N+](=O)[O-] ZINC000598610553 520742201 /nfs/dbraw/zinc/74/22/01/520742201.db2.gz HRVHHVINSYUTCP-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO O=C(CC[N@H+]1CCOC(C2CC2)(C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595822145 520746978 /nfs/dbraw/zinc/74/69/78/520746978.db2.gz NMALMADNLHGDOM-UHFFFAOYSA-N 1 1 359.426 2.814 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000595825705 520749813 /nfs/dbraw/zinc/74/98/13/520749813.db2.gz FVCQERGXTLSCMK-OALUTQOASA-N 1 1 371.437 2.545 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](O)C2)cc1OC ZINC000593115086 520755255 /nfs/dbraw/zinc/75/52/55/520755255.db2.gz HEMYBACJDJOIPN-DZGCQCFKSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](O)C2)cc1OC ZINC000593115086 520755266 /nfs/dbraw/zinc/75/52/66/520755266.db2.gz HEMYBACJDJOIPN-DZGCQCFKSA-N 1 1 352.431 2.985 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Oc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595832220 520755524 /nfs/dbraw/zinc/75/55/24/520755524.db2.gz TZVCAJRYGFPBKS-GOSISDBHSA-N 1 1 367.405 2.637 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Oc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595832220 520755532 /nfs/dbraw/zinc/75/55/32/520755532.db2.gz TZVCAJRYGFPBKS-GOSISDBHSA-N 1 1 367.405 2.637 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595836688 520757226 /nfs/dbraw/zinc/75/72/26/520757226.db2.gz YEEMWFUUHDQLHZ-YPMHNXCESA-N 1 1 372.368 2.716 20 5 FFBDMO CCC[N@H+](C)CC(C)(C)NCCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000595874615 520782558 /nfs/dbraw/zinc/78/25/58/520782558.db2.gz WGORHDPJDMZXKA-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000595874615 520782563 /nfs/dbraw/zinc/78/25/63/520782563.db2.gz WGORHDPJDMZXKA-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)CC2=CCSC2)c([N+](=O)[O-])c1 ZINC000595889821 520796727 /nfs/dbraw/zinc/79/67/27/520796727.db2.gz XCLLMXHISWSIQV-NSHDSACASA-N 1 1 351.428 2.535 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CC2=CCSC2)c([N+](=O)[O-])c1 ZINC000595889821 520796734 /nfs/dbraw/zinc/79/67/34/520796734.db2.gz XCLLMXHISWSIQV-NSHDSACASA-N 1 1 351.428 2.535 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000595920974 520825084 /nfs/dbraw/zinc/82/50/84/520825084.db2.gz VYQNTPONUOBEER-SJKOYZFVSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000595920974 520825092 /nfs/dbraw/zinc/82/50/92/520825092.db2.gz VYQNTPONUOBEER-SJKOYZFVSA-N 1 1 371.384 2.976 20 5 FFBDMO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@](C)(C(F)F)O1 ZINC000595922326 520827061 /nfs/dbraw/zinc/82/70/61/520827061.db2.gz ORBCTMARFPSOFF-BDJLRTHQSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@](C)(C(F)F)O1 ZINC000595922326 520827066 /nfs/dbraw/zinc/82/70/66/520827066.db2.gz ORBCTMARFPSOFF-BDJLRTHQSA-N 1 1 357.357 2.668 20 5 FFBDMO COC(=O)c1c(Cl)c(NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596079594 520899357 /nfs/dbraw/zinc/89/93/57/520899357.db2.gz UBCUEZRNKCCSID-JTQLQIEISA-N 1 1 353.806 2.931 20 5 FFBDMO Cn1cc(CN2C[C@@H]3CCC[C@]3(C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000593315541 520903554 /nfs/dbraw/zinc/90/35/54/520903554.db2.gz LEQIJSWYOQVERU-LPHOPBHVSA-N 1 1 355.442 2.556 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000593320727 520907705 /nfs/dbraw/zinc/90/77/05/520907705.db2.gz FIHLTICZYFFFPB-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000593320727 520907714 /nfs/dbraw/zinc/90/77/14/520907714.db2.gz FIHLTICZYFFFPB-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1 ZINC000601849882 520985186 /nfs/dbraw/zinc/98/51/86/520985186.db2.gz LLBCPPOIHSDNEY-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-] ZINC000596238904 520989172 /nfs/dbraw/zinc/98/91/72/520989172.db2.gz RDEORDPMLWVQQB-QMMMGPOBSA-N 1 1 350.762 2.727 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000596238904 520989179 /nfs/dbraw/zinc/98/91/79/520989179.db2.gz RDEORDPMLWVQQB-QMMMGPOBSA-N 1 1 350.762 2.727 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)F)ccc1NCC1([NH+]2CCOCC2)CCOCC1 ZINC000596265560 521001377 /nfs/dbraw/zinc/00/13/77/521001377.db2.gz SBUCXINHJZUOKQ-UHFFFAOYSA-N 1 1 371.384 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc2c(ccnc2N2CCC([N@H+]3CCCOCC3)CC2)c1 ZINC000596269373 521001735 /nfs/dbraw/zinc/00/17/35/521001735.db2.gz SAHSKQIIFRBGTI-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)[C@@H](Cc2ccccc2)C1 ZINC000593503891 521036585 /nfs/dbraw/zinc/03/65/85/521036585.db2.gz MFHPXVYTGFJWRZ-AWEZNQCLSA-N 1 1 369.450 2.963 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287366 521081558 /nfs/dbraw/zinc/08/15/58/521081558.db2.gz ZUDJVJXEWWGKGD-WMLDXEAASA-N 1 1 373.453 2.815 20 5 FFBDMO COc1cc(OC)c(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1F ZINC000593621960 521113104 /nfs/dbraw/zinc/11/31/04/521113104.db2.gz VSPGFKGHAZDMCM-UHFFFAOYSA-N 1 1 364.377 2.785 20 5 FFBDMO CC(C)c1[nH+]ccn1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602106527 521146459 /nfs/dbraw/zinc/14/64/59/521146459.db2.gz OBSAIVVPKBXJLB-UHFFFAOYSA-N 1 1 372.425 2.985 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000596627176 521173870 /nfs/dbraw/zinc/17/38/70/521173870.db2.gz VYYMSKBJYMHVNI-GFCCVEGCSA-N 1 1 350.419 2.845 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599393408 521193474 /nfs/dbraw/zinc/19/34/74/521193474.db2.gz HZHLHBVKKOHGNX-NSHDSACASA-N 1 1 368.231 2.571 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000593755744 521195527 /nfs/dbraw/zinc/19/55/27/521195527.db2.gz MGKMEXPLPIAHRS-UHFFFAOYSA-N 1 1 360.414 2.556 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)[C@]1(CO)CCOC1 ZINC000599395916 521198692 /nfs/dbraw/zinc/19/86/92/521198692.db2.gz LXMWFYQTFTWVGD-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)[C@]1(CO)CCOC1 ZINC000599395916 521198700 /nfs/dbraw/zinc/19/87/00/521198700.db2.gz LXMWFYQTFTWVGD-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O ZINC000611526048 521203755 /nfs/dbraw/zinc/20/37/55/521203755.db2.gz FLPSVEIIURSWLD-HIFRSBDPSA-N 1 1 350.415 2.595 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O ZINC000611526048 521203767 /nfs/dbraw/zinc/20/37/67/521203767.db2.gz FLPSVEIIURSWLD-HIFRSBDPSA-N 1 1 350.415 2.595 20 5 FFBDMO CCN(Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000602448276 521350811 /nfs/dbraw/zinc/35/08/11/521350811.db2.gz ICMYMDCATPMEAJ-MAUKXSAKSA-N 1 1 357.458 2.986 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602448934 521352081 /nfs/dbraw/zinc/35/20/81/521352081.db2.gz WISMKKGHLCSOKY-ZETCQYMHSA-N 1 1 351.222 2.660 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602448934 521352089 /nfs/dbraw/zinc/35/20/89/521352089.db2.gz WISMKKGHLCSOKY-ZETCQYMHSA-N 1 1 351.222 2.660 20 5 FFBDMO COC[C@H](C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCc2ccccc21 ZINC000599682860 521398768 /nfs/dbraw/zinc/39/87/68/521398768.db2.gz MHUKSMGVPWCPIY-HNAYVOBHSA-N 1 1 371.437 2.781 20 5 FFBDMO Cc1noc([C@@H]2OCC[C@@H]2[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000599684076 521399500 /nfs/dbraw/zinc/39/95/00/521399500.db2.gz ZGFGVMJAERRSHV-LSDHHAIUSA-N 1 1 371.353 2.561 20 5 FFBDMO Cc1noc([C@H]2OCC[C@H]2[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)n1 ZINC000599686141 521400455 /nfs/dbraw/zinc/40/04/55/521400455.db2.gz UCQUTKHWBYBIRU-ZBFHGGJFSA-N 1 1 362.386 2.693 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@@H]1CCCO1 ZINC000602642609 521453718 /nfs/dbraw/zinc/45/37/18/521453718.db2.gz DAHSZTWIEOFSLH-MNOVXSKESA-N 1 1 365.249 2.702 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(Cc3cc(Br)c([N+](=O)[O-])s3)C2)C1 ZINC000602670639 521471624 /nfs/dbraw/zinc/47/16/24/521471624.db2.gz AXUBEWUDUXNMMI-ZDUSSCGKSA-N 1 1 360.277 2.946 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597091221 521495681 /nfs/dbraw/zinc/49/56/81/521495681.db2.gz YRYFRYYHEZFXMZ-JTQLQIEISA-N 1 1 355.826 2.684 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H]1CCN(Cc2ccccc2)C[C@H]1C ZINC000602809365 521545786 /nfs/dbraw/zinc/54/57/86/521545786.db2.gz BXADCXHULZBGMD-QAPCUYQASA-N 1 1 357.458 2.600 20 5 FFBDMO COCC1(C2CCC2)C[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000597191007 521566877 /nfs/dbraw/zinc/56/68/77/521566877.db2.gz IMLLXAFQAJSSLW-UHFFFAOYSA-N 1 1 350.415 2.861 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNc2ncc([N+](=O)[O-])c(N)n2)c1 ZINC000471744159 561011233 /nfs/dbraw/zinc/01/12/33/561011233.db2.gz CHKMZSSLMWAOAD-UHFFFAOYSA-N 1 1 358.446 2.623 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000826028463 607968001 /nfs/dbraw/zinc/96/80/01/607968001.db2.gz APOUIAIRWJQIHV-RDJZCZTQSA-N 1 1 365.397 2.632 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC001165042682 721952585 /nfs/dbraw/zinc/95/25/85/721952585.db2.gz PSLIYRLOGLCMJX-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Nc1nc(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC001164996749 722202676 /nfs/dbraw/zinc/20/26/76/722202676.db2.gz WIYKKBDUHNENMZ-IBGZPJMESA-N 1 1 371.416 2.956 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154794303 728812290 /nfs/dbraw/zinc/81/22/90/728812290.db2.gz SJDXMLQRGQCFGE-ZDUSSCGKSA-N 1 1 350.444 2.622 20 5 FFBDMO CSC[C@@H]1CCC[N@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154794303 728812291 /nfs/dbraw/zinc/81/22/91/728812291.db2.gz SJDXMLQRGQCFGE-ZDUSSCGKSA-N 1 1 350.444 2.622 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000127438534 728706328 /nfs/dbraw/zinc/70/63/28/728706328.db2.gz NGFDJSYXQIABBS-UHFFFAOYSA-N 1 1 372.263 2.511 20 5 FFBDMO CC(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@H](O)c1ccc(F)cc1 ZINC000176248181 729112994 /nfs/dbraw/zinc/11/29/94/729112994.db2.gz GQRZCDXWLXJXSM-INIZCTEOSA-N 1 1 350.394 2.622 20 5 FFBDMO CCOC(=O)N1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194855844 729522994 /nfs/dbraw/zinc/52/29/94/729522994.db2.gz WPVXDQSYKACWQL-UHFFFAOYSA-N 1 1 351.403 2.528 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)c3cccc(Cl)c3)C2)nc1 ZINC000245459830 729570139 /nfs/dbraw/zinc/57/01/39/729570139.db2.gz VNGRFLOADNRNHV-GDBMZVCRSA-N 1 1 362.817 2.863 20 5 FFBDMO C[C@H](CNc1cccc(Br)c1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000856730806 730351236 /nfs/dbraw/zinc/35/12/36/730351236.db2.gz HRWQOJSHMFLFHZ-LLVKDONJSA-N 1 1 358.236 2.738 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000857062388 730377026 /nfs/dbraw/zinc/37/70/26/730377026.db2.gz KTAHISKUPPSVSX-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1Br ZINC000859925839 730469638 /nfs/dbraw/zinc/46/96/38/730469638.db2.gz XBYLGAIKCMWPSE-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1Br ZINC000859925839 730469639 /nfs/dbraw/zinc/46/96/39/730469639.db2.gz XBYLGAIKCMWPSE-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860053965 730474474 /nfs/dbraw/zinc/47/44/74/730474474.db2.gz DZKKFVZFFATLTI-NXEZZACHSA-N 1 1 350.400 2.738 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccns1 ZINC000860055395 730474537 /nfs/dbraw/zinc/47/45/37/730474537.db2.gz XSPXYMDNIMAOFD-VHSXEESVSA-N 1 1 350.400 2.738 20 5 FFBDMO COC(=O)C1C[C@@H](C)[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1 ZINC000860189966 730485470 /nfs/dbraw/zinc/48/54/70/730485470.db2.gz NXUWUNOWJUYXKM-GHMZBOCLSA-N 1 1 351.359 2.665 20 5 FFBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl ZINC000779905372 738496039 /nfs/dbraw/zinc/49/60/39/738496039.db2.gz TYHSHNFZQZYJTF-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO CCS[C@@H]1CC[C@@H](N(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867962442 731246132 /nfs/dbraw/zinc/24/61/32/731246132.db2.gz BJGZQVZKZWSLTJ-UNEWFSDZSA-N 1 1 351.472 2.901 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCN1CCN(C)CC1 ZINC000872017512 731720827 /nfs/dbraw/zinc/72/08/27/731720827.db2.gz AXXJQJZUEZQHEV-AWEZNQCLSA-N 1 1 352.504 2.605 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000874837254 732106022 /nfs/dbraw/zinc/10/60/22/732106022.db2.gz KDHRYTIVDCPRMV-STQMWFEESA-N 1 1 357.332 2.922 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@H]3COC[C@H]3C2)o1 ZINC000878991192 732627894 /nfs/dbraw/zinc/62/78/94/732627894.db2.gz VSVOYSCVMUBRIB-WDEREUQCSA-N 1 1 364.789 2.767 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000879557770 732721766 /nfs/dbraw/zinc/72/17/66/732721766.db2.gz FLOHMRJPGPSRCO-YNEHKIRRSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000879557770 732721770 /nfs/dbraw/zinc/72/17/70/732721770.db2.gz FLOHMRJPGPSRCO-YNEHKIRRSA-N 1 1 365.455 2.615 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557757 732721965 /nfs/dbraw/zinc/72/19/65/732721965.db2.gz FKAFDIBRKVLDAX-MNOVXSKESA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557757 732721967 /nfs/dbraw/zinc/72/19/67/732721967.db2.gz FKAFDIBRKVLDAX-MNOVXSKESA-N 1 1 355.847 2.872 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000879961771 732809523 /nfs/dbraw/zinc/80/95/23/732809523.db2.gz HWHXMOGZURRGMX-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000879961771 732809526 /nfs/dbraw/zinc/80/95/26/732809526.db2.gz HWHXMOGZURRGMX-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000881466477 733058206 /nfs/dbraw/zinc/05/82/06/733058206.db2.gz XIRIIRASFGQBJF-VXGBXAGGSA-N 1 1 368.231 2.666 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] ZINC000726187990 734412742 /nfs/dbraw/zinc/41/27/42/734412742.db2.gz JXROWPKJLWTKHO-ZDUSSCGKSA-N 1 1 373.450 2.667 20 5 FFBDMO C[NH+](C)CCc1ccccc1NS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000783611059 738819271 /nfs/dbraw/zinc/81/92/71/738819271.db2.gz PULPYXDLVKVKFW-UHFFFAOYSA-N 1 1 355.441 2.561 20 5 FFBDMO CC(C)(C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000928095257 738821976 /nfs/dbraw/zinc/82/19/76/738821976.db2.gz NRZXRWZAGSHEPF-HZPDHXFCSA-N 1 1 363.483 2.568 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)O[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000783924944 738849232 /nfs/dbraw/zinc/84/92/32/738849232.db2.gz RZGWLGGSMKGSKN-CXAGYDPISA-N 1 1 350.415 2.992 20 5 FFBDMO CCO/C=C/[C@](O)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000895710502 735044706 /nfs/dbraw/zinc/04/47/06/735044706.db2.gz MDKMZRYUWWTSOK-GFUIURDCSA-N 1 1 352.284 2.667 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000751913262 735933433 /nfs/dbraw/zinc/93/34/33/735933433.db2.gz FRMFMMQBRAICAP-ZFWWWQNUSA-N 1 1 350.488 2.913 20 5 FFBDMO CSCC1CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000902394411 735941670 /nfs/dbraw/zinc/94/16/70/735941670.db2.gz VVLGIAUHRUXOFR-UHFFFAOYSA-N 1 1 364.471 2.869 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[N@@H+]2CCOC[C@H]2C1 ZINC000754080854 736123191 /nfs/dbraw/zinc/12/31/91/736123191.db2.gz CSOQXVJXZMADNG-SECBINFHSA-N 1 1 365.739 2.788 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[N@H+]2CCOC[C@H]2C1 ZINC000754080854 736123195 /nfs/dbraw/zinc/12/31/95/736123195.db2.gz CSOQXVJXZMADNG-SECBINFHSA-N 1 1 365.739 2.788 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc([N+](=O)[O-])cc1F ZINC000754506922 736166223 /nfs/dbraw/zinc/16/62/23/736166223.db2.gz AJNXUAOFJPACQK-INIZCTEOSA-N 1 1 354.378 2.570 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccnc(Cl)c1 ZINC000757677113 736418821 /nfs/dbraw/zinc/41/88/21/736418821.db2.gz YBOKXJJRUVISEM-LLVKDONJSA-N 1 1 369.830 2.768 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C[C@H]1C ZINC000906781220 736543125 /nfs/dbraw/zinc/54/31/25/736543125.db2.gz RKTUBTGYCGCLJC-PWSUYJOCSA-N 1 1 354.838 2.775 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000906939489 736562763 /nfs/dbraw/zinc/56/27/63/736562763.db2.gz DCYFEJVQROUMRH-AAEUAGOBSA-N 1 1 351.834 2.922 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000906939494 736562817 /nfs/dbraw/zinc/56/28/17/736562817.db2.gz DCYFEJVQROUMRH-WCQYABFASA-N 1 1 351.834 2.922 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768542221 737431259 /nfs/dbraw/zinc/43/12/59/737431259.db2.gz QNLSJWGYQISEGJ-JSGCOSHPSA-N 1 1 369.849 2.611 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768542222 737431370 /nfs/dbraw/zinc/43/13/70/737431370.db2.gz QNLSJWGYQISEGJ-OCCSQVGLSA-N 1 1 369.849 2.611 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000769141859 737500628 /nfs/dbraw/zinc/50/06/28/737500628.db2.gz NITRCCSPDXNQTL-IUCAKERBSA-N 1 1 374.210 2.661 20 5 FFBDMO 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742173630 /nfs/dbraw/zinc/17/36/30/742173630.db2.gz AXJOPULMRTYXSK-YTHBIGJYSA-N 1 1 363.845 2.599 20 5 FFBDMO Cc1cc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001034644572 742928299 /nfs/dbraw/zinc/92/82/99/742928299.db2.gz IIOQEOADRMXSKK-KLHDSHLOSA-N 1 1 351.472 2.547 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827308979 743552668 /nfs/dbraw/zinc/55/26/68/743552668.db2.gz DTXHRFONAXZOLO-MFKMUULPSA-N 1 1 357.332 2.780 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC000827328396 743556333 /nfs/dbraw/zinc/55/63/33/743556333.db2.gz FBFVVMRUPXHCRM-OBJOEFQTSA-N 1 1 367.833 2.568 20 5 FFBDMO Cc1[nH+]ccn1CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000840526831 747116526 /nfs/dbraw/zinc/11/65/26/747116526.db2.gz JQNGPQWKNTZWKQ-ZDUSSCGKSA-N 1 1 360.267 2.659 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437601 748030037 /nfs/dbraw/zinc/03/00/37/748030037.db2.gz ODFUAHQHNGXEPL-HOCLYGCPSA-N 1 1 351.353 2.821 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437601 748030041 /nfs/dbraw/zinc/03/00/41/748030041.db2.gz ODFUAHQHNGXEPL-HOCLYGCPSA-N 1 1 351.353 2.821 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000844643565 748063013 /nfs/dbraw/zinc/06/30/13/748063013.db2.gz UHWZZQIAFZEWHX-GMTAPVOTSA-N 1 1 370.247 2.910 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCCC[N@H+](C)CC(C)C)cc1[N+](=O)[O-] ZINC000844655495 748066589 /nfs/dbraw/zinc/06/65/89/748066589.db2.gz JTQAXHQRRQOBOP-UHFFFAOYSA-N 1 1 352.391 2.519 20 5 FFBDMO C[C@@]12COC[C@]1(C)C[N@@H+](Cn1ncc3cc([N+](=O)[O-])cc(Cl)c31)C2 ZINC000853543368 750088281 /nfs/dbraw/zinc/08/82/81/750088281.db2.gz WKPGXSCCJHEZRI-IYBDPMFKSA-N 1 1 350.806 2.914 20 5 FFBDMO C[C@@]12COC[C@]1(C)C[N@H+](Cn1ncc3cc([N+](=O)[O-])cc(Cl)c31)C2 ZINC000853543368 750088286 /nfs/dbraw/zinc/08/82/86/750088286.db2.gz WKPGXSCCJHEZRI-IYBDPMFKSA-N 1 1 350.806 2.914 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c1F ZINC000854659554 750347692 /nfs/dbraw/zinc/34/76/92/750347692.db2.gz NVRKPIZGBYEQKZ-KRWDZBQOSA-N 1 1 353.369 2.739 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1F ZINC000854676806 750350598 /nfs/dbraw/zinc/35/05/98/750350598.db2.gz CWUXYIBVBFKLBT-JTQLQIEISA-N 1 1 353.369 2.738 20 5 FFBDMO C[C@H]([NH2+]C[C@@H]1CN(Cc2ccncc2)CCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090226 1013142922 /nfs/dbraw/zinc/14/29/22/1013142922.db2.gz NYSMEUVJDHUWHE-GOEBONIOSA-N 1 1 374.416 2.681 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872281719 1013200284 /nfs/dbraw/zinc/20/02/84/1013200284.db2.gz YLIOHUBPBWPKIM-DOTOQJQBSA-N 1 1 364.442 2.758 20 5 FFBDMO CN(CCC[NH2+]Cc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001276002753 1013270945 /nfs/dbraw/zinc/27/09/45/1013270945.db2.gz YCHWOMXITLVFII-TZMCWYRMSA-N 1 1 360.241 2.597 20 5 FFBDMO CC(C)N(C(=O)[C@@H](C)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)C ZINC000008474512 1013302599 /nfs/dbraw/zinc/30/25/99/1013302599.db2.gz WARDQJRNEWXGPP-MRXNPFEDSA-N 1 1 362.474 2.751 20 5 FFBDMO CNC(=O)c1ccc(C[N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000179543145 968968770 /nfs/dbraw/zinc/96/87/70/968968770.db2.gz OANOUJWTISDSPS-UHFFFAOYSA-N 1 1 367.409 2.702 20 5 FFBDMO CNC(=O)c1ccc(C[N@@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000179543145 968968779 /nfs/dbraw/zinc/96/87/79/968968779.db2.gz OANOUJWTISDSPS-UHFFFAOYSA-N 1 1 367.409 2.702 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000874827009 1013910728 /nfs/dbraw/zinc/91/07/28/1013910728.db2.gz AGCGJLCENFUWCS-VQTJNVASSA-N 1 1 361.445 2.990 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000892962938 970444136 /nfs/dbraw/zinc/44/41/36/970444136.db2.gz QIMUVSPQHSBKEJ-STQMWFEESA-N 1 1 362.382 2.540 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000893045432 970533886 /nfs/dbraw/zinc/53/38/86/970533886.db2.gz WOPAYJWPBDQEDB-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO CN1CCC[C@@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]n1 ZINC000897139629 973377183 /nfs/dbraw/zinc/37/71/83/973377183.db2.gz OKOUJQWNQKIZFM-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n[nH]1 ZINC000897139629 973377190 /nfs/dbraw/zinc/37/71/90/973377190.db2.gz OKOUJQWNQKIZFM-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n[nH]1 ZINC000897139629 973377195 /nfs/dbraw/zinc/37/71/95/973377195.db2.gz OKOUJQWNQKIZFM-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@H]4[C@H]3CCC[N@@H+]4CCO)n2)cc1 ZINC000897219824 973456621 /nfs/dbraw/zinc/45/66/21/973456621.db2.gz OSXYDZICGXNUBY-DLBZAZTESA-N 1 1 374.466 2.754 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001481350019 974281538 /nfs/dbraw/zinc/28/15/38/974281538.db2.gz DWJLRCJGSMQVPS-CZUORRHYSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001481350019 974281544 /nfs/dbraw/zinc/28/15/44/974281544.db2.gz DWJLRCJGSMQVPS-CZUORRHYSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001481350019 974281551 /nfs/dbraw/zinc/28/15/51/974281551.db2.gz DWJLRCJGSMQVPS-CZUORRHYSA-N 1 1 371.840 2.861 20 5 FFBDMO C[N@@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2ccccc2C1 ZINC000728833603 974927535 /nfs/dbraw/zinc/92/75/35/974927535.db2.gz IHWWORUQMJPUPG-UHFFFAOYSA-N 1 1 359.357 2.591 20 5 FFBDMO C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2ccccc2C1 ZINC000728833603 974927539 /nfs/dbraw/zinc/92/75/39/974927539.db2.gz IHWWORUQMJPUPG-UHFFFAOYSA-N 1 1 359.357 2.591 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000843802942 976844624 /nfs/dbraw/zinc/84/46/24/976844624.db2.gz FQTVCTTYZMLAIH-RISCZKNCSA-N 1 1 364.402 2.756 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000728915835 977487078 /nfs/dbraw/zinc/48/70/78/977487078.db2.gz ZTHCDEVKGBTNAT-CYBMUJFWSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000728915835 977487082 /nfs/dbraw/zinc/48/70/82/977487082.db2.gz ZTHCDEVKGBTNAT-CYBMUJFWSA-N 1 1 358.373 2.980 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)Cc1ccccc1 ZINC000729185419 978198871 /nfs/dbraw/zinc/19/88/71/978198871.db2.gz PXIYWVFRGQKWOI-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO COc1cc(CN2CCC3(CC2)CC[NH+](C)CC3)c([N+](=O)[O-])cc1OC ZINC000877684577 1014677881 /nfs/dbraw/zinc/67/78/81/1014677881.db2.gz QAVMYSMXMJZOER-UHFFFAOYSA-N 1 1 363.458 2.920 20 5 FFBDMO CN(C)C(=O)c1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000841829193 981641323 /nfs/dbraw/zinc/64/13/23/981641323.db2.gz GBEOFPTZNJJDLJ-UHFFFAOYSA-N 1 1 368.437 2.619 20 5 FFBDMO CC(C)[NH+]1CC(Nc2ncccc2NC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC001168312095 982799735 /nfs/dbraw/zinc/79/97/35/982799735.db2.gz VYZAMHLGHDJDOT-UHFFFAOYSA-N 1 1 355.398 2.747 20 5 FFBDMO C/C(=C\C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000911839221 983904623 /nfs/dbraw/zinc/90/46/23/983904623.db2.gz AGWMWHOZBHZZAI-UQPQFNMUSA-N 1 1 373.453 2.614 20 5 FFBDMO Cc1nn(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765057910 984954461 /nfs/dbraw/zinc/95/44/61/984954461.db2.gz SCWBKGTXMPWFJL-MRXNPFEDSA-N 1 1 357.458 2.874 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293173 985133115 /nfs/dbraw/zinc/13/31/15/985133115.db2.gz SBPTYXHZYHQBQQ-HNNXBMFYSA-N 1 1 371.441 2.545 20 5 FFBDMO COC(=O)Cc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cc1 ZINC001168572076 985485187 /nfs/dbraw/zinc/48/51/87/985485187.db2.gz OCOUHNPIOMLHGH-UHFFFAOYSA-N 1 1 369.421 2.910 20 5 FFBDMO COC(=O)Cc1ccc(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cc1 ZINC001168572076 985485195 /nfs/dbraw/zinc/48/51/95/985485195.db2.gz OCOUHNPIOMLHGH-UHFFFAOYSA-N 1 1 369.421 2.910 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913684550 986834794 /nfs/dbraw/zinc/83/47/94/986834794.db2.gz AMPPXDUQXWAFRH-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913684550 986834800 /nfs/dbraw/zinc/83/48/00/986834800.db2.gz AMPPXDUQXWAFRH-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO C[C@H]1CC2(CCC2)C[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000762145601 988144699 /nfs/dbraw/zinc/14/46/99/988144699.db2.gz WEZHBWAPYGZWID-ZDUSSCGKSA-N 1 1 358.398 2.585 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153819534 989735074 /nfs/dbraw/zinc/73/50/74/989735074.db2.gz JPRPNCLNPBVWPI-HNNXBMFYSA-N 1 1 364.402 2.532 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000153819534 989735081 /nfs/dbraw/zinc/73/50/81/989735081.db2.gz JPRPNCLNPBVWPI-HNNXBMFYSA-N 1 1 364.402 2.532 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(C(F)F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034644156 990148697 /nfs/dbraw/zinc/14/86/97/990148697.db2.gz CZPULDIREAPRBF-KLHDSHLOSA-N 1 1 367.396 2.806 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)c1 ZINC000879499648 1015564734 /nfs/dbraw/zinc/56/47/34/1015564734.db2.gz AKUMZQADNZFROG-QZTJIDSGSA-N 1 1 354.410 2.508 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373094095 990716052 /nfs/dbraw/zinc/71/60/52/990716052.db2.gz FFXQIIPFJBEYRY-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373094095 990716059 /nfs/dbraw/zinc/71/60/59/990716059.db2.gz FFXQIIPFJBEYRY-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000920474226 990861970 /nfs/dbraw/zinc/86/19/70/990861970.db2.gz YRAJXGFZEXUFKJ-HKUYNNGSSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)[N@H+](CC(=O)[O-])CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001591569556 992773094 /nfs/dbraw/zinc/77/30/94/992773094.db2.gz MITLEYAYJPOJOD-UHFFFAOYSA-N 1 1 363.458 2.644 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1 ZINC000808795332 994270604 /nfs/dbraw/zinc/27/06/04/994270604.db2.gz TYRQLRJHOUPSBY-WOJBJXKFSA-N 1 1 374.412 2.694 20 5 FFBDMO CCc1cnccc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174090 995633526 /nfs/dbraw/zinc/63/35/26/995633526.db2.gz PUWUDLYBLPPJNF-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO CCc1cnccc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174090 995633534 /nfs/dbraw/zinc/63/35/34/995633534.db2.gz PUWUDLYBLPPJNF-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO CC[C@@H]1C[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173879 995633652 /nfs/dbraw/zinc/63/36/52/995633652.db2.gz LCKLJUSHWIALSG-NXHRZFHOSA-N 1 1 362.426 2.918 20 5 FFBDMO CC[C@@H]1C[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173879 995633654 /nfs/dbraw/zinc/63/36/54/995633654.db2.gz LCKLJUSHWIALSG-NXHRZFHOSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@H](CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000826747867 1016057934 /nfs/dbraw/zinc/05/79/34/1016057934.db2.gz YRUXAFBNFUSDOK-DNVCBOLYSA-N 1 1 371.437 2.655 20 5 FFBDMO CN(C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000823979792 996771496 /nfs/dbraw/zinc/77/14/96/996771496.db2.gz CTIGBVHIVGVKJX-MRXNPFEDSA-N 1 1 369.425 2.915 20 5 FFBDMO COc1ccc(C[NH2+]CC(=O)Nc2cccc3cccnc32)cc1[N+](=O)[O-] ZINC000730107127 996836650 /nfs/dbraw/zinc/83/66/50/996836650.db2.gz XRQRVEQWZLTBNC-UHFFFAOYSA-N 1 1 366.377 2.880 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@@H]3C[C@H](C)C[N@@H+]3C2)c([N+](=O)[O-])c1 ZINC001136872057 996951553 /nfs/dbraw/zinc/95/15/53/996951553.db2.gz BTOGJOAXKCVTBE-GVDBMIGSSA-N 1 1 374.485 2.942 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000803731868 1016113395 /nfs/dbraw/zinc/11/33/95/1016113395.db2.gz SGTBEDXHWYBWKT-RGFVMQALSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000803731868 1016113397 /nfs/dbraw/zinc/11/33/97/1016113397.db2.gz SGTBEDXHWYBWKT-RGFVMQALSA-N 1 1 365.433 2.993 20 5 FFBDMO C[C@@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844731423 998128423 /nfs/dbraw/zinc/12/84/23/998128423.db2.gz SMQQXUYJECAUBL-UKRRQHHQSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844731423 998128426 /nfs/dbraw/zinc/12/84/26/998128426.db2.gz SMQQXUYJECAUBL-UKRRQHHQSA-N 1 1 367.450 2.764 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H](Cc2ccccc2)C1 ZINC000844739446 998135978 /nfs/dbraw/zinc/13/59/78/998135978.db2.gz DTRYTLMJLRKHSY-IBGZPJMESA-N 1 1 365.437 2.761 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CC[NH+](C2CCC2)CC1 ZINC000733274847 998944913 /nfs/dbraw/zinc/94/49/13/998944913.db2.gz XNDKNABWGJTWMT-UHFFFAOYSA-N 1 1 372.469 2.895 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000740757800 999681665 /nfs/dbraw/zinc/68/16/65/999681665.db2.gz BAMQRSLOHGQBGC-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NCC[NH+]1Cc2ccccc2C1 ZINC000742397211 999772051 /nfs/dbraw/zinc/77/20/51/999772051.db2.gz DEBBEBODEXLJLW-UHFFFAOYSA-N 1 1 368.393 2.979 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000742419172 999773319 /nfs/dbraw/zinc/77/33/19/999773319.db2.gz VTPGSMCJXQMHPU-HNNXBMFYSA-N 1 1 360.458 2.798 20 5 FFBDMO CCc1cc(NCC[N@H+]2CCC[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000742424718 999773665 /nfs/dbraw/zinc/77/36/65/999773665.db2.gz CEIFXBNIRQUXNO-CQSZACIVSA-N 1 1 355.442 2.932 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)c1 ZINC001169150969 1000028046 /nfs/dbraw/zinc/02/80/46/1000028046.db2.gz XSZPUUZHLCNTKV-GOSISDBHSA-N 1 1 371.412 2.976 20 5 FFBDMO C[N@@H+]1CCc2c(NC[C@H](CO)Cc3ccccc3)ccc([N+](=O)[O-])c2C1 ZINC001169902547 1000084811 /nfs/dbraw/zinc/08/48/11/1000084811.db2.gz BCQDINWPRUJIFN-MRXNPFEDSA-N 1 1 355.438 2.846 20 5 FFBDMO C[N@H+]1CCc2c(NC[C@H](CO)Cc3ccccc3)ccc([N+](=O)[O-])c2C1 ZINC001169902547 1000084814 /nfs/dbraw/zinc/08/48/14/1000084814.db2.gz BCQDINWPRUJIFN-MRXNPFEDSA-N 1 1 355.438 2.846 20 5 FFBDMO C[N@@H+](CCOC(=O)CNc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000769089812 1000420554 /nfs/dbraw/zinc/42/05/54/1000420554.db2.gz DTHZWRZAYLWDBZ-UHFFFAOYSA-N 1 1 361.373 2.821 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395801 1001100244 /nfs/dbraw/zinc/10/02/44/1001100244.db2.gz MAAAMAFFMSRTRP-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395801 1001100249 /nfs/dbraw/zinc/10/02/49/1001100249.db2.gz MAAAMAFFMSRTRP-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 ZINC000771602415 1001156629 /nfs/dbraw/zinc/15/66/29/1001156629.db2.gz ILLCDKSGAPCCFT-UHFFFAOYSA-N 1 1 374.485 2.898 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000785744862 1001486052 /nfs/dbraw/zinc/48/60/52/1001486052.db2.gz QPWXKNLCWOQROA-VXGBXAGGSA-N 1 1 360.370 2.561 20 5 FFBDMO CCc1ccc(C(=O)NCc2cccnc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000746590498 1001599712 /nfs/dbraw/zinc/59/97/12/1001599712.db2.gz JUCSJMQJQJSQEW-UHFFFAOYSA-N 1 1 365.393 2.976 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000786782297 1001626368 /nfs/dbraw/zinc/62/63/68/1001626368.db2.gz MRMAHCMAORMFAL-UHFFFAOYSA-N 1 1 370.365 2.660 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000788380266 1001797089 /nfs/dbraw/zinc/79/70/89/1001797089.db2.gz CVXLXNWIQZWSEG-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000788380266 1001797093 /nfs/dbraw/zinc/79/70/93/1001797093.db2.gz CVXLXNWIQZWSEG-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NCc3cc([N+](=O)[O-])ccc3Cl)cc2C1 ZINC000788528886 1001822846 /nfs/dbraw/zinc/82/28/46/1001822846.db2.gz IMJPFLBBMFDEOX-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NCc3cc([N+](=O)[O-])ccc3Cl)cc2C1 ZINC000788528886 1001822857 /nfs/dbraw/zinc/82/28/57/1001822857.db2.gz IMJPFLBBMFDEOX-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+]Cc2c(C)cccc2F)cc1[N+](=O)[O-] ZINC000788961848 1001923598 /nfs/dbraw/zinc/92/35/98/1001923598.db2.gz BMQHTGCORQFYEJ-UHFFFAOYSA-N 1 1 362.357 2.884 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCC[C@@H](C)C1 ZINC000791207729 1002617671 /nfs/dbraw/zinc/61/76/71/1002617671.db2.gz CQZJGEUIYDIDHM-CHWSQXEVSA-N 1 1 366.437 2.650 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](NC(=O)C3CC3)C2)c([N+](=O)[O-])c1 ZINC001170355181 1003122743 /nfs/dbraw/zinc/12/27/43/1003122743.db2.gz WYAAUFSKEFNWAL-XJKSGUPXSA-N 1 1 361.442 2.525 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339906 1003130347 /nfs/dbraw/zinc/13/03/47/1003130347.db2.gz KRUIZILUKCRKDN-GJZGRUSLSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339906 1003130349 /nfs/dbraw/zinc/13/03/49/1003130349.db2.gz KRUIZILUKCRKDN-GJZGRUSLSA-N 1 1 374.441 2.509 20 5 FFBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000792939748 1003226232 /nfs/dbraw/zinc/22/62/32/1003226232.db2.gz ICQBOUPVRCXVSL-GOSISDBHSA-N 1 1 370.409 2.862 20 5 FFBDMO C/C(=C\C(=O)NC1CCN(c2[nH+]ccn2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000793946781 1003542234 /nfs/dbraw/zinc/54/22/34/1003542234.db2.gz MQFCIESDXPCUTO-BUHFOSPRSA-N 1 1 369.425 2.517 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]12COC[C@@H]1C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C2 ZINC001195968965 1003620347 /nfs/dbraw/zinc/62/03/47/1003620347.db2.gz GIRXXZYPCGKBBN-UGSOOPFHSA-N 1 1 366.389 2.524 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]12COC[C@@H]1C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C2 ZINC001195968965 1003620351 /nfs/dbraw/zinc/62/03/51/1003620351.db2.gz GIRXXZYPCGKBBN-UGSOOPFHSA-N 1 1 366.389 2.524 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000804497772 1003704712 /nfs/dbraw/zinc/70/47/12/1003704712.db2.gz IEELJUZJEGJGAQ-GOSISDBHSA-N 1 1 372.381 2.552 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](n2ccnn2)CC1 ZINC001196525228 1003804828 /nfs/dbraw/zinc/80/48/28/1003804828.db2.gz FENXPDGIZGFHBO-OAHLLOKOSA-N 1 1 372.429 2.551 20 5 FFBDMO CC[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1O ZINC001193002206 1004338098 /nfs/dbraw/zinc/33/80/98/1004338098.db2.gz LAVIBFZFVYCWPL-NOZJJQNGSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1O ZINC001193002206 1004338108 /nfs/dbraw/zinc/33/81/08/1004338108.db2.gz LAVIBFZFVYCWPL-NOZJJQNGSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001198584208 1004683713 /nfs/dbraw/zinc/68/37/13/1004683713.db2.gz TUYHCJGRSDDDQN-LLVKDONJSA-N 1 1 358.345 2.754 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776275096 1005342381 /nfs/dbraw/zinc/34/23/81/1005342381.db2.gz JGYXEPTUYHKUGR-QZTJIDSGSA-N 1 1 352.394 2.741 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851742996 1005910536 /nfs/dbraw/zinc/91/05/36/1005910536.db2.gz PYTCFAARUYZCTK-ZDUSSCGKSA-N 1 1 368.434 2.970 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851742996 1005910539 /nfs/dbraw/zinc/91/05/39/1005910539.db2.gz PYTCFAARUYZCTK-ZDUSSCGKSA-N 1 1 368.434 2.970 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153209 1005946082 /nfs/dbraw/zinc/94/60/82/1005946082.db2.gz CRQXKYNCNJWBSX-DGCLKSJQSA-N 1 1 368.434 2.874 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153209 1005946084 /nfs/dbraw/zinc/94/60/84/1005946084.db2.gz CRQXKYNCNJWBSX-DGCLKSJQSA-N 1 1 368.434 2.874 20 5 FFBDMO C[N@H+](Cc1cnn(-c2ccccc2)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575304 1005953446 /nfs/dbraw/zinc/95/34/46/1005953446.db2.gz PUYUOJIKZDRPIJ-IBGZPJMESA-N 1 1 352.394 2.946 20 5 FFBDMO O=C(CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)OCc1ccccc1 ZINC000776579764 1005961120 /nfs/dbraw/zinc/96/11/20/1005961120.db2.gz PWLOERFSINOPCS-UHFFFAOYSA-N 1 1 369.421 2.850 20 5 FFBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000776582191 1005962031 /nfs/dbraw/zinc/96/20/31/1005962031.db2.gz LRBNXZHVDJXGOY-MSOLQXFVSA-N 1 1 373.384 2.505 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000776582191 1005962034 /nfs/dbraw/zinc/96/20/34/1005962034.db2.gz LRBNXZHVDJXGOY-MSOLQXFVSA-N 1 1 373.384 2.505 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 ZINC000882330494 1006358873 /nfs/dbraw/zinc/35/88/73/1006358873.db2.gz RNUJXEVWFNRFAW-UHFFFAOYSA-N 1 1 367.421 2.697 20 5 FFBDMO O=C(Nc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1)c1ccc([N+](=O)[O-])cn1 ZINC000882394177 1006382101 /nfs/dbraw/zinc/38/21/01/1006382101.db2.gz RBXHVRCOGDRAKW-KRWDZBQOSA-N 1 1 367.409 2.527 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505628 1006419252 /nfs/dbraw/zinc/41/92/52/1006419252.db2.gz MSUNXJQQSWXUSA-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505628 1006419256 /nfs/dbraw/zinc/41/92/56/1006419256.db2.gz MSUNXJQQSWXUSA-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@@H](Oc4ccccc4)C3)n2)c1 ZINC000853594469 1006466391 /nfs/dbraw/zinc/46/63/91/1006466391.db2.gz QZDLRTCYHRJZIM-GOSISDBHSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](Oc4ccccc4)C3)n2)c1 ZINC000853594469 1006466398 /nfs/dbraw/zinc/46/63/98/1006466398.db2.gz QZDLRTCYHRJZIM-GOSISDBHSA-N 1 1 365.393 2.964 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(N[C@@H]3CC[N@H+](C4CCCCC4)C3)cc2N1 ZINC000853849795 1006555548 /nfs/dbraw/zinc/55/55/48/1006555548.db2.gz FDZVWMOMGQAEQH-GFCCVEGCSA-N 1 1 360.414 2.745 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H]1CC1CCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000815293123 1006568185 /nfs/dbraw/zinc/56/81/85/1006568185.db2.gz XEOHAAIIXNGSJF-OAHLLOKOSA-N 1 1 365.405 2.954 20 5 FFBDMO O=c1[nH]ccc(Nc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c1[N+](=O)[O-] ZINC000882943984 1006570655 /nfs/dbraw/zinc/57/06/55/1006570655.db2.gz OQSNIQSXMNQRFG-HNNXBMFYSA-N 1 1 355.398 2.723 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@H]2C1 ZINC001135059706 1006660032 /nfs/dbraw/zinc/66/00/32/1006660032.db2.gz OGWVPHGZKNTZTA-QCZZGDTMSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC001152413010 1032162966 /nfs/dbraw/zinc/16/29/66/1032162966.db2.gz WCTKURGVCNEBHT-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171104 1032168034 /nfs/dbraw/zinc/16/80/34/1032168034.db2.gz OLSJDBSXFDNCBQ-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171104 1032168041 /nfs/dbraw/zinc/16/80/41/1032168041.db2.gz OLSJDBSXFDNCBQ-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H](C)C(C)C ZINC000112657210 1006988724 /nfs/dbraw/zinc/98/87/24/1006988724.db2.gz IJMGEDSRHZMMBU-MRXNPFEDSA-N 1 1 362.474 2.610 20 5 FFBDMO C[C@@H]1C[C@@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000817376776 1007569802 /nfs/dbraw/zinc/56/98/02/1007569802.db2.gz CSGCWUUJURQOLU-MGPQQGTHSA-N 1 1 367.450 2.620 20 5 FFBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000817376776 1007569812 /nfs/dbraw/zinc/56/98/12/1007569812.db2.gz CSGCWUUJURQOLU-MGPQQGTHSA-N 1 1 367.450 2.620 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000856356143 1007787778 /nfs/dbraw/zinc/78/77/78/1007787778.db2.gz YCYVFFZHWLNIBQ-UFUQCMIWSA-N 1 1 351.406 2.999 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ncc([N+](=O)[O-])cc3C)C2)ccn1 ZINC000856533879 1007873010 /nfs/dbraw/zinc/87/30/10/1007873010.db2.gz QNZYYQSCOUCMNA-SFHVURJKSA-N 1 1 371.441 2.803 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000820099684 1008285743 /nfs/dbraw/zinc/28/57/43/1008285743.db2.gz FOFFQYMWRRQXGI-MNZLEMJZSA-N 1 1 369.396 2.523 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[NH+]1CCOCC1 ZINC000821718876 1008491267 /nfs/dbraw/zinc/49/12/67/1008491267.db2.gz WPRPHWRWDVLSEX-QGZVFWFLSA-N 1 1 367.421 2.601 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000859616033 1008590131 /nfs/dbraw/zinc/59/01/31/1008590131.db2.gz DGWDZBSWJSZLIT-OAHLLOKOSA-N 1 1 369.421 2.542 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886268954 1008618463 /nfs/dbraw/zinc/61/84/63/1008618463.db2.gz GXJWJMXEAUYYGT-UHFFFAOYSA-N 1 1 362.430 2.823 20 5 FFBDMO COc1cccc([C@H](O)C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886302042 1008628891 /nfs/dbraw/zinc/62/88/91/1008628891.db2.gz DASYINVBQPBFQO-GOSISDBHSA-N 1 1 357.410 2.944 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000805797592 1008733466 /nfs/dbraw/zinc/73/34/66/1008733466.db2.gz KAIMXFMDMDPKDK-BBRMVZONSA-N 1 1 365.430 2.961 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598934 1009137022 /nfs/dbraw/zinc/13/70/22/1009137022.db2.gz OMCAXWGHXOIAKU-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598934 1009137028 /nfs/dbraw/zinc/13/70/28/1009137028.db2.gz OMCAXWGHXOIAKU-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]C/C=C/CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001274016798 1009265215 /nfs/dbraw/zinc/26/52/15/1009265215.db2.gz OSVXFBYFUQYXHJ-MSIWKICXSA-N 1 1 353.422 2.575 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823962329 1009280770 /nfs/dbraw/zinc/28/07/70/1009280770.db2.gz RLVWQKSMMFTGQX-SUMWQHHRSA-N 1 1 369.425 2.819 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@]2(C)C1 ZINC000887934736 1009686874 /nfs/dbraw/zinc/68/68/74/1009686874.db2.gz SLMZIUFTEQLLAT-ACJLOTCBSA-N 1 1 372.450 2.742 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000862790207 1009975455 /nfs/dbraw/zinc/97/54/55/1009975455.db2.gz QKHABBMTAGZLAD-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO C[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCC(C)(C)C1 ZINC000794688344 1010474379 /nfs/dbraw/zinc/47/43/79/1010474379.db2.gz YKPFAOIYBFZVLJ-BEFAXECRSA-N 1 1 374.441 2.830 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1C[C@@H]1C(N)=O ZINC001182379598 1010540734 /nfs/dbraw/zinc/54/07/34/1010540734.db2.gz HHWKJPKHOVTDDF-HOTGVXAUSA-N 1 1 362.433 2.822 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1C[C@H]1C(N)=O ZINC001182379600 1010541375 /nfs/dbraw/zinc/54/13/75/1010541375.db2.gz HHWKJPKHOVTDDF-HZPDHXFCSA-N 1 1 362.433 2.822 20 5 FFBDMO COc1ccccc1[C@@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867944162 1011126791 /nfs/dbraw/zinc/12/67/91/1011126791.db2.gz QJFDSJCKYKPKDA-VLIAUNLRSA-N 1 1 369.421 2.793 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCc2c(F)ccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000867946400 1011128021 /nfs/dbraw/zinc/12/80/21/1011128021.db2.gz QBTSCJLUEJPGOX-SFHVURJKSA-N 1 1 361.348 2.632 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)cc1[N+](=O)[O-] ZINC000868081646 1011160564 /nfs/dbraw/zinc/16/05/64/1011160564.db2.gz ZXDITTZHOGMIQH-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)cc1[N+](=O)[O-] ZINC000868081646 1011160565 /nfs/dbraw/zinc/16/05/65/1011160565.db2.gz ZXDITTZHOGMIQH-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3C)CC[NH2+]2)cc1 ZINC000870138954 1012184650 /nfs/dbraw/zinc/18/46/50/1012184650.db2.gz QEFVXPBUGRGBFC-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO CC[N@@H+](CC(C)(C)O)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015226 1012187099 /nfs/dbraw/zinc/18/70/99/1012187099.db2.gz MOKNHXXHOKYBQE-UHFFFAOYSA-N 1 1 357.401 2.935 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870143900 1012195743 /nfs/dbraw/zinc/19/57/43/1012195743.db2.gz YTGYVRGGCOLVKA-IBGZPJMESA-N 1 1 369.421 2.709 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173185911 1012330280 /nfs/dbraw/zinc/33/02/80/1012330280.db2.gz QAQJIZYDRHVNLA-RYUDHWBXSA-N 1 1 354.378 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c1F ZINC001173193629 1012335635 /nfs/dbraw/zinc/33/56/35/1012335635.db2.gz UUKXOQOHLAZBSF-CHWSQXEVSA-N 1 1 368.405 2.901 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@H]3C[N@@H+](C)C[C@@H]32)c1F ZINC001173195433 1012338518 /nfs/dbraw/zinc/33/85/18/1012338518.db2.gz FXVJPGYCSGUWHB-ZENOOKHLSA-N 1 1 351.422 2.700 20 5 FFBDMO Cc1noc(C[C@@H]2C[C@H]3C[N@H+]([C@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3O2)n1 ZINC001173222800 1012353933 /nfs/dbraw/zinc/35/39/33/1012353933.db2.gz CJBAHZNKCWEWPF-BGIURUKPSA-N 1 1 372.425 2.549 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880305 1012617870 /nfs/dbraw/zinc/61/78/70/1012617870.db2.gz YYQNKHAJSAMZAH-HKUYNNGSSA-N 1 1 373.384 2.508 20 5 FFBDMO C[N@@H+](C1CCCC1)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173698215 1012902917 /nfs/dbraw/zinc/90/29/17/1012902917.db2.gz HCMZVUYNLFCJBF-UHFFFAOYSA-N 1 1 367.471 2.622 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC[C@@H]21 ZINC000827330621 1017639873 /nfs/dbraw/zinc/63/98/73/1017639873.db2.gz QBULSIVHDZNGPY-BBRMVZONSA-N 1 1 372.450 2.885 20 5 FFBDMO Nc1ccc2c(c1)C[N@@H+]([C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CCO2 ZINC000925755799 1017841937 /nfs/dbraw/zinc/84/19/37/1017841937.db2.gz YMVREPUAXFRCSZ-JKSUJKDBSA-N 1 1 357.414 2.752 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000927056894 1018340109 /nfs/dbraw/zinc/34/01/09/1018340109.db2.gz NJTSOOUBDRCKMI-LLLHUVSDSA-N 1 1 372.425 2.690 20 5 FFBDMO CC(C)c1ccccc1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045437239 1019965782 /nfs/dbraw/zinc/96/57/82/1019965782.db2.gz JDGZXWQQUFLEIG-QZTJIDSGSA-N 1 1 359.470 2.946 20 5 FFBDMO COc1cn(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)cc1=O ZINC000902291711 1020058872 /nfs/dbraw/zinc/05/88/72/1020058872.db2.gz XZVXEUFERCNWIK-INIZCTEOSA-N 1 1 357.410 2.911 20 5 FFBDMO O=C1C[C@H]([C@H]2CCCO2)CN1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291661 1020058899 /nfs/dbraw/zinc/05/88/99/1020058899.db2.gz XQTZAFBRWRSUJT-JENIJYKNSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1C[C@H]([C@H]2CCCO2)CN1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291661 1020058913 /nfs/dbraw/zinc/05/89/13/1020058913.db2.gz XQTZAFBRWRSUJT-JENIJYKNSA-N 1 1 373.453 2.759 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@@](C)(c2ccccn2)CC1=O ZINC000800866114 1020611518 /nfs/dbraw/zinc/61/15/18/1020611518.db2.gz SLWHZJIGMZODQI-FQEVSTJZSA-N 1 1 368.437 2.612 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@@](C)(c2ccccn2)CC1=O ZINC000800866114 1020611521 /nfs/dbraw/zinc/61/15/21/1020611521.db2.gz SLWHZJIGMZODQI-FQEVSTJZSA-N 1 1 368.437 2.612 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c1 ZINC000931905093 1020626021 /nfs/dbraw/zinc/62/60/21/1020626021.db2.gz BLSJBMJVDICDIJ-HOJAQTOUSA-N 1 1 354.406 2.528 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2c2ccnn2C)cccc1[N+](=O)[O-] ZINC000932267069 1020759160 /nfs/dbraw/zinc/75/91/60/1020759160.db2.gz YBHIJQDALCLJMZ-QGZVFWFLSA-N 1 1 357.414 2.802 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1 ZINC000933944555 1021118530 /nfs/dbraw/zinc/11/85/30/1021118530.db2.gz HWNPLBRVASAECB-SNRMKQJTSA-N 1 1 357.454 2.889 20 5 FFBDMO COc1ccccc1N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000934176040 1021158292 /nfs/dbraw/zinc/15/82/92/1021158292.db2.gz NIHPPEULTKDCKM-LJQANCHMSA-N 1 1 371.437 2.849 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001116374420 1021184007 /nfs/dbraw/zinc/18/40/07/1021184007.db2.gz IGKNBNNCJNJSMR-HKUYNNGSSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001116374420 1021184014 /nfs/dbraw/zinc/18/40/14/1021184014.db2.gz IGKNBNNCJNJSMR-HKUYNNGSSA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000934836971 1021421753 /nfs/dbraw/zinc/42/17/53/1021421753.db2.gz GUIPBEFTCXMJCB-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000934895541 1021451280 /nfs/dbraw/zinc/45/12/80/1021451280.db2.gz CDRQEPDKDIZKCI-ZWKOTPCHSA-N 1 1 366.421 2.751 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000934895538 1021451602 /nfs/dbraw/zinc/45/16/02/1021451602.db2.gz CDRQEPDKDIZKCI-MSOLQXFVSA-N 1 1 366.421 2.751 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@H+]2CC[C@H](O)[C@@H](CO)C2)o1 ZINC001118013599 1022018884 /nfs/dbraw/zinc/01/88/84/1022018884.db2.gz ZQPLRMJHPIGTQV-BZNIZROVSA-N 1 1 366.801 2.683 20 5 FFBDMO Cc1cccc(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001039485507 1022759445 /nfs/dbraw/zinc/75/94/45/1022759445.db2.gz BPXHSSZCTGYTMB-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1cccc(C[N@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001039485507 1022759461 /nfs/dbraw/zinc/75/94/61/1022759461.db2.gz BPXHSSZCTGYTMB-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1cccc(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001039485507 1022759476 /nfs/dbraw/zinc/75/94/76/1022759476.db2.gz BPXHSSZCTGYTMB-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CC1CC3(CCC3)C1)CC2 ZINC001040701299 1022954342 /nfs/dbraw/zinc/95/43/42/1022954342.db2.gz XQJKDWSFLPHWSH-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350128 1033112177 /nfs/dbraw/zinc/11/21/77/1033112177.db2.gz MKGGOCKOIWNFMA-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350128 1033112184 /nfs/dbraw/zinc/11/21/84/1033112184.db2.gz MKGGOCKOIWNFMA-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350652 1033114549 /nfs/dbraw/zinc/11/45/49/1033114549.db2.gz QZTFXIFXSSZUCD-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350652 1033114559 /nfs/dbraw/zinc/11/45/59/1033114559.db2.gz QZTFXIFXSSZUCD-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC001122823390 1023496462 /nfs/dbraw/zinc/49/64/62/1023496462.db2.gz ZAPYHYJMFZTFSL-CABCVRRESA-N 1 1 364.494 2.582 20 5 FFBDMO CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC001122823391 1023496892 /nfs/dbraw/zinc/49/68/92/1023496892.db2.gz ZAPYHYJMFZTFSL-GJZGRUSLSA-N 1 1 364.494 2.582 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)C[C@]2(C)C1 ZINC001121236753 1023662872 /nfs/dbraw/zinc/66/28/72/1023662872.db2.gz BQYFHMBDQXYXDG-BMIGLBTASA-N 1 1 357.332 2.637 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC001123268820 1023715889 /nfs/dbraw/zinc/71/58/89/1023715889.db2.gz UIQDHYDADBXENI-IUODEOHRSA-N 1 1 350.419 2.797 20 5 FFBDMO C[C@@H]1CC[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999366 1024418887 /nfs/dbraw/zinc/41/88/87/1024418887.db2.gz HMMVLAAOWMBCEW-YJYMSZOUSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999366 1024418894 /nfs/dbraw/zinc/41/88/94/1024418894.db2.gz HMMVLAAOWMBCEW-YJYMSZOUSA-N 1 1 374.441 2.687 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)C1 ZINC000840086534 1026951121 /nfs/dbraw/zinc/95/11/21/1026951121.db2.gz MQRRNQWXYGQGKM-LJQANCHMSA-N 1 1 355.442 2.834 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000840130968 1026973209 /nfs/dbraw/zinc/97/32/09/1026973209.db2.gz WIVHYUWDQIPROR-KGLIPLIRSA-N 1 1 373.409 2.741 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000840184050 1027001626 /nfs/dbraw/zinc/00/16/26/1027001626.db2.gz JFLNDUIOKGATPT-GOSISDBHSA-N 1 1 358.398 2.691 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000840230820 1027013637 /nfs/dbraw/zinc/01/36/37/1027013637.db2.gz LRXVIFMRVRTZLF-GFCCVEGCSA-N 1 1 359.382 2.880 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001154713358 1028419250 /nfs/dbraw/zinc/41/92/50/1028419250.db2.gz JPGIVEWQERUMPZ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001154713358 1028419253 /nfs/dbraw/zinc/41/92/53/1028419253.db2.gz JPGIVEWQERUMPZ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO Cc1cccc(N2CCN(c3ncnc4cccc([N+](=O)[O-])c43)CC2)[nH+]1 ZINC001163668592 1029016844 /nfs/dbraw/zinc/01/68/44/1029016844.db2.gz WQASTHSOZQDHEI-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1 ZINC001163825617 1029076447 /nfs/dbraw/zinc/07/64/47/1029076447.db2.gz IGAWWCOJNBATDS-IRXDYDNUSA-N 1 1 367.405 2.845 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1)C1CCN(c2ncc([N+](=O)[O-])cc2N)CC1 ZINC001157074566 1029458355 /nfs/dbraw/zinc/45/83/55/1029458355.db2.gz KNOCVDMEGAHDJT-UHFFFAOYSA-N 1 1 359.405 2.812 20 5 FFBDMO CCC[C@H]1CN(C(=O)OC(C)(C)C)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000782095947 1029567955 /nfs/dbraw/zinc/56/79/55/1029567955.db2.gz PBYNOCNNPLAKOZ-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO CCC[C@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000782095947 1029567962 /nfs/dbraw/zinc/56/79/62/1029567962.db2.gz PBYNOCNNPLAKOZ-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1C[C@@H]2CC[NH2+][C@@H]2C1 ZINC001158306127 1029792544 /nfs/dbraw/zinc/79/25/44/1029792544.db2.gz OHXPBNQNFNSANA-BULFRSBZSA-N 1 1 359.473 2.683 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NCc3ccc(C[NH+]4CCOCC4)cc3)cn21 ZINC001165384646 1029963223 /nfs/dbraw/zinc/96/32/23/1029963223.db2.gz NFWYLMQSRHDBKT-UHFFFAOYSA-N 1 1 367.409 2.687 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC(OC4CCC4)CC3)n2)c1 ZINC000841687310 1030404077 /nfs/dbraw/zinc/40/40/77/1030404077.db2.gz CMQWUCSSOSYOJJ-UHFFFAOYSA-N 1 1 357.414 2.844 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C)c1 ZINC000842366194 1030689043 /nfs/dbraw/zinc/68/90/43/1030689043.db2.gz DMYZHSRJTCOPRV-KDOFPFPSSA-N 1 1 372.425 2.640 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C)c1 ZINC000842366194 1030689051 /nfs/dbraw/zinc/68/90/51/1030689051.db2.gz DMYZHSRJTCOPRV-KDOFPFPSSA-N 1 1 372.425 2.640 20 5 FFBDMO C[N@H+](CCC(C)(C)C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000842632240 1030856789 /nfs/dbraw/zinc/85/67/89/1030856789.db2.gz WFDJPFGEVDHCKA-SFHVURJKSA-N 1 1 362.430 2.687 20 5 FFBDMO C[N@@H+](CCC(C)(C)C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000842632240 1030856807 /nfs/dbraw/zinc/85/68/07/1030856807.db2.gz WFDJPFGEVDHCKA-SFHVURJKSA-N 1 1 362.430 2.687 20 5 FFBDMO COC(=O)CC[N@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C[C@H]1CCCO1 ZINC001204350284 1031248477 /nfs/dbraw/zinc/24/84/77/1031248477.db2.gz YVIKOYUWHHWBNR-OAHLLOKOSA-N 1 1 350.415 2.756 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c1 ZINC000843421483 1031395290 /nfs/dbraw/zinc/39/52/90/1031395290.db2.gz PYSLCHLRJPVUAG-HXUWFJFHSA-N 1 1 370.405 2.647 20 5 FFBDMO C[C@@H]1C[C@H]2CC[C@@H](C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C[N@H+]2C1 ZINC001150828045 1031790402 /nfs/dbraw/zinc/79/04/02/1031790402.db2.gz WEGAMYCAMSUKQV-YRGRVCCFSA-N 1 1 351.834 2.985 20 5 FFBDMO O=C(Nc1cc2cccnc2c2ncccc12)[C@@H]1CCC2(CC[NH2+]CC2)N1 ZINC001218979082 1033440666 /nfs/dbraw/zinc/44/06/66/1033440666.db2.gz CSBMKSFHSZPXCD-INIZCTEOSA-N 1 1 361.449 2.596 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCOC[C@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC001224777172 1034002364 /nfs/dbraw/zinc/00/23/64/1034002364.db2.gz NAYHTGWJNNUHTK-HXUWFJFHSA-N 1 1 372.421 2.891 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCOC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC001224777172 1034002374 /nfs/dbraw/zinc/00/23/74/1034002374.db2.gz NAYHTGWJNNUHTK-HXUWFJFHSA-N 1 1 372.421 2.891 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC(NC(=O)OC(C)(C)C)C1 ZINC000831237287 1034003631 /nfs/dbraw/zinc/00/36/31/1034003631.db2.gz PEOBDHJTIVZPQI-BCLQGDPASA-N 1 1 365.430 2.616 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@H]3CN(C(=O)C(F)(F)F)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000831563767 1034127564 /nfs/dbraw/zinc/12/75/64/1034127564.db2.gz POSWZBWKXZNVDG-KBPBESRZSA-N 1 1 371.359 2.746 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226165516 1034553842 /nfs/dbraw/zinc/55/38/42/1034553842.db2.gz LLWMESBQOZWIPA-IFXJQAMLSA-N 1 1 369.421 2.983 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC(C)([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000832234827 1034660563 /nfs/dbraw/zinc/66/05/63/1034660563.db2.gz ZWBQDDUUYJOEGK-UHFFFAOYSA-N 1 1 363.462 2.922 20 5 FFBDMO Cc1cc[nH+]c(N2CCC(Oc3ncc([N+](=O)[O-])c4nc[nH]c43)CC2)c1 ZINC001227692178 1035675411 /nfs/dbraw/zinc/67/54/11/1035675411.db2.gz VLKJWMSKXDYBBM-UHFFFAOYSA-N 1 1 354.370 2.617 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1cc(Br)cnc1[N+](=O)[O-] ZINC001229562321 1036746501 /nfs/dbraw/zinc/74/65/01/1036746501.db2.gz FNGDOTWLUIOQIO-IWIIMEHWSA-N 1 1 356.220 2.861 20 5 FFBDMO Cc1cc(O)c(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001229754076 1036873801 /nfs/dbraw/zinc/87/38/01/1036873801.db2.gz MDGGIKZVBFXQPP-MRXNPFEDSA-N 1 1 358.394 2.889 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2ccc(I)c([N+](=O)[O-])c2)C1 ZINC001229945644 1036992668 /nfs/dbraw/zinc/99/26/68/1036992668.db2.gz ALWQDMLMGWKMSV-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO COc1cc(N2CCC([NH2+][C@@H]3CCCN(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256087132 1038372732 /nfs/dbraw/zinc/37/27/32/1038372732.db2.gz PDVLIEMMWFSAQG-OAHLLOKOSA-N 1 1 362.474 2.646 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCC(=O)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093973 1038380390 /nfs/dbraw/zinc/38/03/90/1038380390.db2.gz UEIKUNXIUWLNMU-AWEZNQCLSA-N 1 1 361.442 2.873 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](C(C)=O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101142 1038384687 /nfs/dbraw/zinc/38/46/87/1038384687.db2.gz ZGMIEJVEMNBOBP-OAHLLOKOSA-N 1 1 361.442 2.873 20 5 FFBDMO COCC[N@@H+](C(C)C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256099730 1038385344 /nfs/dbraw/zinc/38/53/44/1038385344.db2.gz VYEXHHSCCSKJEN-UHFFFAOYSA-N 1 1 351.447 2.929 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)C1 ZINC001210683263 1039668623 /nfs/dbraw/zinc/66/86/23/1039668623.db2.gz RDUHMZYHYAREAH-ZDUSSCGKSA-N 1 1 372.425 2.715 20 5 FFBDMO COc1ccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c(OC)c1 ZINC001248210012 1040174174 /nfs/dbraw/zinc/17/41/74/1040174174.db2.gz JEFGZAGBJVTMNL-HNNXBMFYSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCC(F)(F)[C@@H](CO)C3)CC2)cc1 ZINC001254475716 1040743769 /nfs/dbraw/zinc/74/37/69/1040743769.db2.gz ILGNJYMKOIUGGQ-CYBMUJFWSA-N 1 1 355.385 2.513 20 5 FFBDMO O=c1[nH]ccc2c1CC[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254481124 1040748282 /nfs/dbraw/zinc/74/82/82/1040748282.db2.gz SXXZLDWMQFQSLY-UHFFFAOYSA-N 1 1 354.410 2.723 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cnn(C)c21 ZINC001254560674 1040796365 /nfs/dbraw/zinc/79/63/65/1040796365.db2.gz HAQHAFPOKAPWLS-WMLDXEAASA-N 1 1 358.442 2.895 20 5 FFBDMO CN1CCN(c2ccccc2C[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254583931 1040816688 /nfs/dbraw/zinc/81/66/88/1040816688.db2.gz OYWSHZSSTPPGEB-LJQANCHMSA-N 1 1 366.465 2.604 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597624 1040827282 /nfs/dbraw/zinc/82/72/82/1040827282.db2.gz UIFBMOKVQPWTLT-AEFFLSMTSA-N 1 1 356.426 2.524 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254601374 1040832526 /nfs/dbraw/zinc/83/25/26/1040832526.db2.gz YZEYEOSWEWKRCV-CXAGYDPISA-N 1 1 361.442 2.909 20 5 FFBDMO Cc1ccnc(O[C@@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610864 1040840318 /nfs/dbraw/zinc/84/03/18/1040840318.db2.gz MMJYSWPXUFCDSQ-QZTJIDSGSA-N 1 1 354.410 2.704 20 5 FFBDMO C[N@H+]1C[C@@]23CN(c4ncnc5sc([N+](=O)[O-])cc54)C[C@]2(C1)CCCC3 ZINC001262716944 1041811825 /nfs/dbraw/zinc/81/18/25/1041811825.db2.gz WUZFOPKDUHZAFJ-CALCHBBNSA-N 1 1 359.455 2.912 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001538464859 1070438389 /nfs/dbraw/zinc/43/83/89/1070438389.db2.gz XAKXVVBHGWUGGS-UHFFFAOYSA-N 1 1 358.402 2.514 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@H+]1CCC[C@@H]1C ZINC001313562181 1044381102 /nfs/dbraw/zinc/38/11/02/1044381102.db2.gz WDEYWMVEWDAIOM-AWEZNQCLSA-N 1 1 358.446 2.794 20 5 FFBDMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(Cl)oc2ccccc21 ZINC001316824015 1045032651 /nfs/dbraw/zinc/03/26/51/1045032651.db2.gz SJLTUCNSQMGYGI-TZMCWYRMSA-N 1 1 365.817 2.690 20 5 FFBDMO Cc1ccc(F)cc1C[N@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C ZINC001317686426 1045119107 /nfs/dbraw/zinc/11/91/07/1045119107.db2.gz MLZFKVHYHMLDMX-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1ccc(F)cc1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001317686426 1045119114 /nfs/dbraw/zinc/11/91/14/1045119114.db2.gz MLZFKVHYHMLDMX-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1ccc(F)cc1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001317686426 1045119124 /nfs/dbraw/zinc/11/91/24/1045119124.db2.gz MLZFKVHYHMLDMX-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001319876442 1045290753 /nfs/dbraw/zinc/29/07/53/1045290753.db2.gz MCRIIUUJSIUALV-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO Cc1ccccc1C[N@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001319876442 1045290759 /nfs/dbraw/zinc/29/07/59/1045290759.db2.gz MCRIIUUJSIUALV-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001319876442 1045290765 /nfs/dbraw/zinc/29/07/65/1045290765.db2.gz MCRIIUUJSIUALV-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(Cc3ccc([N+](=O)[O-])cc3Br)C2)C1 ZINC001324370983 1045993876 /nfs/dbraw/zinc/99/38/76/1045993876.db2.gz PTEIRRGHEXUIKZ-HNNXBMFYSA-N 1 1 354.248 2.885 20 5 FFBDMO CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)c1nc([C@@H]([NH3+])c2ccccc2)no1 ZINC001326173160 1046794373 /nfs/dbraw/zinc/79/43/73/1046794373.db2.gz PDZAKDQCXWEFJU-STQMWFEESA-N 1 1 371.401 2.631 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC001328553229 1048351583 /nfs/dbraw/zinc/35/15/83/1048351583.db2.gz LHKCUNXDXAEKEC-CJNGLKHVSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC001328553229 1048351597 /nfs/dbraw/zinc/35/15/97/1048351597.db2.gz LHKCUNXDXAEKEC-CJNGLKHVSA-N 1 1 361.398 2.741 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001328689377 1048421079 /nfs/dbraw/zinc/42/10/79/1048421079.db2.gz PYIDAZVQZKSJFK-LLVKDONJSA-N 1 1 365.821 2.714 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001301801316 1050988128 /nfs/dbraw/zinc/98/81/28/1050988128.db2.gz DLGNUTQKBOBFOW-MRXNPFEDSA-N 1 1 361.785 2.741 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001301878151 1051008719 /nfs/dbraw/zinc/00/87/19/1051008719.db2.gz BMAFVEBQPORVRG-RHSMWYFYSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1nnc(N(C)CCc2cccc([N+](=O)[O-])c2)n1CCC[N@H+](C)C(C)C ZINC001304796657 1051703422 /nfs/dbraw/zinc/70/34/22/1051703422.db2.gz GONKUXNWSSCWMH-UHFFFAOYSA-N 1 1 374.489 2.904 20 5 FFBDMO COC[C@H]([NH2+]Cc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC001341427788 1051782304 /nfs/dbraw/zinc/78/23/04/1051782304.db2.gz PMVFXTRNKMQRRU-JSGCOSHPSA-N 1 1 359.220 2.641 20 5 FFBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)Nc2nccc3c2cccc3[N+](=O)[O-])n[nH]1 ZINC001306862823 1052203949 /nfs/dbraw/zinc/20/39/49/1052203949.db2.gz PBTUIDZQKZWFQU-MRXNPFEDSA-N 1 1 366.381 2.885 20 5 FFBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)Nc2nccc3c2cccc3[N+](=O)[O-])n[nH]1 ZINC001306862823 1052203951 /nfs/dbraw/zinc/20/39/51/1052203951.db2.gz PBTUIDZQKZWFQU-MRXNPFEDSA-N 1 1 366.381 2.885 20 5 FFBDMO C[C@@H](O)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307938734 1052369698 /nfs/dbraw/zinc/36/96/98/1052369698.db2.gz KYUDEKJPRBYPOQ-BXKDBHETSA-N 1 1 352.778 2.643 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CCCCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC001307994211 1052378786 /nfs/dbraw/zinc/37/87/86/1052378786.db2.gz ZWHBFEUWFWYEFJ-AWEZNQCLSA-N 1 1 367.450 2.561 20 5 FFBDMO C[N@H+]1C[C@@]23CN(c4nc5ccc([N+](=O)[O-])cc5c(=O)[nH]4)C[C@]2(C1)CCCC3 ZINC001337353414 1054681236 /nfs/dbraw/zinc/68/12/36/1054681236.db2.gz PEKMBFHYMYOAKC-KDURUIRLSA-N 1 1 369.425 2.556 20 5 FFBDMO O=C(c1cc(N[C@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-])N1CCCC1 ZINC001337735673 1054979185 /nfs/dbraw/zinc/97/91/85/1054979185.db2.gz XLQNDDPGLYQQBM-FUHWJXTLSA-N 1 1 358.442 2.870 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001352452854 1055489149 /nfs/dbraw/zinc/48/91/49/1055489149.db2.gz LNRGNUHRTYRAJR-PMPSAXMXSA-N 1 1 372.473 2.735 20 5 FFBDMO O=C1O[C@H](C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1c1ccccc1 ZINC001338751483 1055784164 /nfs/dbraw/zinc/78/41/64/1055784164.db2.gz ZMELOHIQNBEYJQ-GOSISDBHSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C1O[C@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1c1ccccc1 ZINC001338751483 1055784174 /nfs/dbraw/zinc/78/41/74/1055784174.db2.gz ZMELOHIQNBEYJQ-GOSISDBHSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC2(CCCCO2)CC1 ZINC001353206631 1056187859 /nfs/dbraw/zinc/18/78/59/1056187859.db2.gz GWEDFHPGDYBSNS-GOSISDBHSA-N 1 1 373.453 2.903 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])[C@H]2C1 ZINC001339317276 1056323799 /nfs/dbraw/zinc/32/37/99/1056323799.db2.gz MFLUBWLKUGMFDL-WHOFXGATSA-N 1 1 351.834 2.637 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@@H+](C)CCN1C ZINC001517886783 1058189930 /nfs/dbraw/zinc/18/99/30/1058189930.db2.gz BEPPJRRCCDGVEF-UGSOOPFHSA-N 1 1 371.441 2.504 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC001449167763 1058868018 /nfs/dbraw/zinc/86/80/18/1058868018.db2.gz DBEJAZKKUTULRY-HNNXBMFYSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC001449167763 1058868037 /nfs/dbraw/zinc/86/80/37/1058868037.db2.gz DBEJAZKKUTULRY-HNNXBMFYSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001455009347 1059669047 /nfs/dbraw/zinc/66/90/47/1059669047.db2.gz MOHLCEAJHNMULN-GOSISDBHSA-N 1 1 371.412 2.976 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(OCC2CC2)CC1 ZINC000848480242 1060108809 /nfs/dbraw/zinc/10/88/09/1060108809.db2.gz JHRKBRNKPPYGOS-IBGZPJMESA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000848485532 1060132802 /nfs/dbraw/zinc/13/28/02/1060132802.db2.gz PHVVTIJODGEMOD-RTBURBONSA-N 1 1 373.453 2.759 20 5 FFBDMO CC[N@@H+](CCn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001547578815 1071973393 /nfs/dbraw/zinc/97/33/93/1071973393.db2.gz GUXPORLERGJCDA-UHFFFAOYSA-N 1 1 372.473 2.658 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001517710097 1060603689 /nfs/dbraw/zinc/60/36/89/1060603689.db2.gz WADSBMNRBSSYQR-UHFFFAOYSA-N 1 1 358.398 2.857 20 5 FFBDMO O=C(COC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000848774736 1060661555 /nfs/dbraw/zinc/66/15/55/1060661555.db2.gz QZCPCYPKWWXMEY-QGZVFWFLSA-N 1 1 368.389 2.843 20 5 FFBDMO COc1ccc(C[C@H]2CC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001459656051 1060788131 /nfs/dbraw/zinc/78/81/31/1060788131.db2.gz OTECNLBVYGBCKH-IAGOWNOFSA-N 1 1 372.421 2.660 20 5 FFBDMO CCOC(=O)c1cnn(C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)c1C ZINC001460083382 1060893433 /nfs/dbraw/zinc/89/34/33/1060893433.db2.gz LSXVMLWQAUAYIQ-UHFFFAOYSA-N 1 1 373.413 2.509 20 5 FFBDMO CN(CCOCC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC001460453122 1060996469 /nfs/dbraw/zinc/99/64/69/1060996469.db2.gz VOYSPGFEHVRZLS-UHFFFAOYSA-N 1 1 367.446 2.910 20 5 FFBDMO CN(CCOCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC001460453122 1060996484 /nfs/dbraw/zinc/99/64/84/1060996484.db2.gz VOYSPGFEHVRZLS-UHFFFAOYSA-N 1 1 367.446 2.910 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001462123352 1061509398 /nfs/dbraw/zinc/50/93/98/1061509398.db2.gz OFZXLWWROVHHNW-YOEHRIQHSA-N 1 1 368.437 2.796 20 5 FFBDMO NC(=O)OC[C@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001462351037 1061590218 /nfs/dbraw/zinc/59/02/18/1061590218.db2.gz ZITSTUQHIWUYCX-ZDUSSCGKSA-N 1 1 370.365 2.946 20 5 FFBDMO CN(Cc1ccn(C)n1)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001462655029 1061707891 /nfs/dbraw/zinc/70/78/91/1061707891.db2.gz PTQLNCQSOOMVBK-UHFFFAOYSA-N 1 1 371.485 2.715 20 5 FFBDMO Cc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1C ZINC001492781761 1062207482 /nfs/dbraw/zinc/20/74/82/1062207482.db2.gz KGLHCNLZMAFDOC-AWEZNQCLSA-N 1 1 358.446 2.615 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC001464142553 1062447604 /nfs/dbraw/zinc/44/76/04/1062447604.db2.gz BBQWMIPDYHZMND-UHFFFAOYSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001532859708 1063195363 /nfs/dbraw/zinc/19/53/63/1063195363.db2.gz NOCBFWSMGPPQRB-KRWDZBQOSA-N 1 1 368.437 2.892 20 5 FFBDMO CCc1c[nH]c2nc[nH+]c(N3CCN(c4ccccc4[N+](=O)[O-])CC3)c12 ZINC001472638345 1065119740 /nfs/dbraw/zinc/11/97/40/1065119740.db2.gz NXDKLCJOWWSQEW-UHFFFAOYSA-N 1 1 352.398 2.755 20 5 FFBDMO CC[C@H](C)Oc1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001577001990 1078293096 /nfs/dbraw/zinc/29/30/96/1078293096.db2.gz ASISXALJNXJZTJ-SGTLLEGYSA-N 1 1 358.398 2.980 20 5 FFBDMO COc1ccccc1[C@@H]([NH3+])C(=O)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC001579302428 1078614329 /nfs/dbraw/zinc/61/43/29/1078614329.db2.gz WRLQXDUOHXSLQM-MRXNPFEDSA-N 1 1 352.350 2.790 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N3CCc4cc[nH+]c(N)c4C3)c2c1 ZINC001559301397 1076148284 /nfs/dbraw/zinc/14/82/84/1076148284.db2.gz WSJMCGPVVJXDGF-UHFFFAOYSA-N 1 1 351.366 2.692 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc2cc[nH]c2c1 ZINC001559831626 1076194807 /nfs/dbraw/zinc/19/48/07/1076194807.db2.gz YVNWWWCICYKTHF-QGZVFWFLSA-N 1 1 369.421 2.990 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1c1ncccn1 ZINC001560014323 1076213099 /nfs/dbraw/zinc/21/30/99/1076213099.db2.gz PIJKDYVFKUHQJK-HNNXBMFYSA-N 1 1 371.397 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ncccn1 ZINC001560014323 1076213101 /nfs/dbraw/zinc/21/31/01/1076213101.db2.gz PIJKDYVFKUHQJK-HNNXBMFYSA-N 1 1 371.397 2.559 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC001562575488 1076504691 /nfs/dbraw/zinc/50/46/91/1076504691.db2.gz PWPQJFHCQYAUOV-SNVBAGLBSA-N 1 1 371.235 2.915 20 5 FFBDMO CC/C=C/CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001570078409 1077181534 /nfs/dbraw/zinc/18/15/34/1077181534.db2.gz WPGVKAJJTMOKKB-DUFJLWIISA-N 1 1 357.454 2.682 20 5 FFBDMO CC/C=C/CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001570078409 1077181536 /nfs/dbraw/zinc/18/15/36/1077181536.db2.gz WPGVKAJJTMOKKB-DUFJLWIISA-N 1 1 357.454 2.682 20 5 FFBDMO CC/C=C/CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001570078409 1077181538 /nfs/dbraw/zinc/18/15/38/1077181538.db2.gz WPGVKAJJTMOKKB-DUFJLWIISA-N 1 1 357.454 2.682 20 5 FFBDMO CC(C)([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccc(-c2nn[nH]n2)c1 ZINC001573919727 1077847588 /nfs/dbraw/zinc/84/75/88/1077847588.db2.gz IURDUMQTAZAESW-UHFFFAOYSA-N 1 1 356.361 2.939 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCOC1)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047405727 205146543 /nfs/dbraw/zinc/14/65/43/205146543.db2.gz HMHSDOPRKSPVJR-LLVKDONJSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1ccccc1[N+](=O)[O-] ZINC000175502162 251218206 /nfs/dbraw/zinc/21/82/06/251218206.db2.gz NXJGINHBWDIWOO-SFHVURJKSA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1ccccc1[N+](=O)[O-] ZINC000175502162 251218211 /nfs/dbraw/zinc/21/82/11/251218211.db2.gz NXJGINHBWDIWOO-SFHVURJKSA-N 1 1 369.421 2.502 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000181188278 251255199 /nfs/dbraw/zinc/25/51/99/251255199.db2.gz QOTVUNXNUTWXRY-HIFRSBDPSA-N 1 1 354.410 2.570 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264600397 251319621 /nfs/dbraw/zinc/31/96/21/251319621.db2.gz NHEDBRDFNRDQCV-MRXNPFEDSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](N3CCCCC3)C2)cccc1[N+](=O)[O-] ZINC000264600397 251319625 /nfs/dbraw/zinc/31/96/25/251319625.db2.gz NHEDBRDFNRDQCV-MRXNPFEDSA-N 1 1 360.458 2.792 20 5 FFBDMO C[C@@H]1C[C@@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000272568320 252068827 /nfs/dbraw/zinc/06/88/27/252068827.db2.gz VJARECJRWDPNJW-DDUZABMNSA-N 1 1 355.442 2.633 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000272565365 252069202 /nfs/dbraw/zinc/06/92/02/252069202.db2.gz UVKGOPXUJGZQFV-ROUUACIJSA-N 1 1 374.441 2.593 20 5 FFBDMO CCc1ccc([C@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273423851 252304004 /nfs/dbraw/zinc/30/40/04/252304004.db2.gz JTLPQUMMJFFXMA-LBPRGKRZSA-N 1 1 352.412 2.875 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000277074535 256158615 /nfs/dbraw/zinc/15/86/15/256158615.db2.gz TTYVTEFDPBGFLY-CRAIPNDOSA-N 1 1 372.469 2.751 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000278644350 256334351 /nfs/dbraw/zinc/33/43/51/256334351.db2.gz MILGWVVKGHKOJQ-UHFFFAOYSA-N 1 1 356.382 2.564 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279313139 256404673 /nfs/dbraw/zinc/40/46/73/256404673.db2.gz OPCMKOMCYNLNJT-LKFCYVNXSA-N 1 1 355.797 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSCC[C@H]1C ZINC000286124282 257021377 /nfs/dbraw/zinc/02/13/77/257021377.db2.gz MJPTYWXFMSPGIZ-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@@H]1C[C@H](C)O ZINC000286210674 257025689 /nfs/dbraw/zinc/02/56/89/257025689.db2.gz YHLMSFCRRCQTDN-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000289346543 257275795 /nfs/dbraw/zinc/27/57/95/257275795.db2.gz MNSBGCTWCYPPMI-SJORKVTESA-N 1 1 357.410 2.609 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000289655647 257292242 /nfs/dbraw/zinc/29/22/42/257292242.db2.gz FDRPZKQRSOCBRE-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CN(CCCN(C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC[NH+](C)C ZINC000289655647 257292243 /nfs/dbraw/zinc/29/22/43/257292243.db2.gz FDRPZKQRSOCBRE-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC(C)(C)C1 ZINC000289762614 257297733 /nfs/dbraw/zinc/29/77/33/257297733.db2.gz KUBBZEIRHSFSAO-OAHLLOKOSA-N 1 1 370.471 2.648 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)[C@H](C)C1 ZINC000290044473 257312726 /nfs/dbraw/zinc/31/27/26/257312726.db2.gz ZYIJXYFLNIGFKA-CZUORRHYSA-N 1 1 358.446 2.557 20 5 FFBDMO CC[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000301237682 258036574 /nfs/dbraw/zinc/03/65/74/258036574.db2.gz IKYJOVDTVOXMDE-WCQYABFASA-N 1 1 372.263 2.639 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC000299709649 258018792 /nfs/dbraw/zinc/01/87/92/258018792.db2.gz QDHMTDZOYFKURQ-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO CCc1nc(C[NH+]2CCC(CNc3ncc([N+](=O)[O-])cn3)CC2)cs1 ZINC000302154442 258091831 /nfs/dbraw/zinc/09/18/31/258091831.db2.gz LVBYDSNOECWBIM-UHFFFAOYSA-N 1 1 362.459 2.728 20 5 FFBDMO CC1=CC[N@H+](CCNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])CC1 ZINC000302180975 258093667 /nfs/dbraw/zinc/09/36/67/258093667.db2.gz YLAUTQCINOPTCJ-UHFFFAOYSA-N 1 1 369.425 2.623 20 5 FFBDMO CC1=CC[N@@H+](CCNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])CC1 ZINC000302180975 258093668 /nfs/dbraw/zinc/09/36/68/258093668.db2.gz YLAUTQCINOPTCJ-UHFFFAOYSA-N 1 1 369.425 2.623 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3cccc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000302464433 258102462 /nfs/dbraw/zinc/10/24/62/258102462.db2.gz AXRGMTWPUXFXID-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000302466551 258102778 /nfs/dbraw/zinc/10/27/78/258102778.db2.gz SQUSGWZJMODIEX-IBGZPJMESA-N 1 1 359.401 2.807 20 5 FFBDMO C[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000302475683 258103571 /nfs/dbraw/zinc/10/35/71/258103571.db2.gz DWZLCFOKMJXQOB-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NCCc1cn2c([nH+]1)CCCC2 ZINC000302624459 258106849 /nfs/dbraw/zinc/10/68/49/258106849.db2.gz FGVYGELAQRPMAW-UHFFFAOYSA-N 1 1 371.397 2.739 20 5 FFBDMO COC(=O)c1cnc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302749520 258109777 /nfs/dbraw/zinc/10/97/77/258109777.db2.gz GRQRHRXGLSQSBX-XQQFMLRXSA-N 1 1 350.419 2.555 20 5 FFBDMO C[N@@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302836583 258112030 /nfs/dbraw/zinc/11/20/30/258112030.db2.gz WQIPTEMABNWIEN-GUYCJALGSA-N 1 1 374.351 2.773 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302836583 258112031 /nfs/dbraw/zinc/11/20/31/258112031.db2.gz WQIPTEMABNWIEN-GUYCJALGSA-N 1 1 374.351 2.773 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2nc3sccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000301551684 258055223 /nfs/dbraw/zinc/05/52/23/258055223.db2.gz HCOCEWJQSCPFSS-TXEJJXNPSA-N 1 1 353.448 2.605 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@H]3CC[N@@H+](CCc4ccccc4)C3)nn21 ZINC000302019150 258082391 /nfs/dbraw/zinc/08/23/91/258082391.db2.gz ZUQZTKRGQIWTNM-MRXNPFEDSA-N 1 1 366.425 2.614 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[NH+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000331207659 258179601 /nfs/dbraw/zinc/17/96/01/258179601.db2.gz FHOJTYZFTWPRTA-UHFFFAOYSA-N 1 1 363.462 2.779 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389552 258228391 /nfs/dbraw/zinc/22/83/91/258228391.db2.gz LFWQEFSCEVWQIS-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389552 258228392 /nfs/dbraw/zinc/22/83/92/258228392.db2.gz LFWQEFSCEVWQIS-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@H]1C ZINC000032737680 506287625 /nfs/dbraw/zinc/28/76/25/506287625.db2.gz GBNRWGPDGBDBFG-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000065487210 506308832 /nfs/dbraw/zinc/30/88/32/506308832.db2.gz MYFUNDMXWDMTPD-HNNXBMFYSA-N 1 1 368.437 2.841 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000375220713 512218693 /nfs/dbraw/zinc/21/86/93/512218693.db2.gz DFEBFEZOLGAMNX-CYBMUJFWSA-N 1 1 357.414 2.996 20 5 FFBDMO NC(=O)c1ccc(CN2CCC[N@@H+](CC3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000054319032 506536637 /nfs/dbraw/zinc/53/66/37/506536637.db2.gz YPNBKZPIMRKRTL-UHFFFAOYSA-N 1 1 374.485 2.782 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000054548132 506575751 /nfs/dbraw/zinc/57/57/51/506575751.db2.gz PUPDRQYNHLGWKR-CHWSQXEVSA-N 1 1 350.419 2.604 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043148859 506709478 /nfs/dbraw/zinc/70/94/78/506709478.db2.gz LVXMUCBDSSFSLS-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043148859 506709482 /nfs/dbraw/zinc/70/94/82/506709482.db2.gz LVXMUCBDSSFSLS-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1c(NC(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043347433 506737119 /nfs/dbraw/zinc/73/71/19/506737119.db2.gz AZGYFPAOBAMYKB-BETUJISGSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1c(NC(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043347433 506737123 /nfs/dbraw/zinc/73/71/23/506737123.db2.gz AZGYFPAOBAMYKB-BETUJISGSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000043347306 506737442 /nfs/dbraw/zinc/73/74/42/506737442.db2.gz YCIPCEHVJMJNRK-OAHLLOKOSA-N 1 1 364.446 2.772 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1C1CCCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000055927792 506890599 /nfs/dbraw/zinc/89/05/99/506890599.db2.gz KCGQRNYQLPNAQZ-CQSZACIVSA-N 1 1 361.398 2.917 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])c4cnccc34)C2)CC1 ZINC000369245562 512305389 /nfs/dbraw/zinc/30/53/89/512305389.db2.gz YPZBNIJKYJIIBM-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000056344640 506992665 /nfs/dbraw/zinc/99/26/65/506992665.db2.gz XCFVQGWYGLFJNJ-UHFFFAOYSA-N 1 1 352.354 2.806 20 5 FFBDMO CC[NH+](CC)CCN(CC(C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068180988 507139638 /nfs/dbraw/zinc/13/96/38/507139638.db2.gz KWJFTGDITYGDKM-UHFFFAOYSA-N 1 1 361.446 2.911 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000057222477 507211794 /nfs/dbraw/zinc/21/17/94/507211794.db2.gz CMXNPHUARAPUDA-UHFFFAOYSA-N 1 1 368.309 2.644 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000023245068 507340828 /nfs/dbraw/zinc/34/08/28/507340828.db2.gz HLTFKZSBIRAPFZ-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000023245068 507340833 /nfs/dbraw/zinc/34/08/33/507340833.db2.gz HLTFKZSBIRAPFZ-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000068902007 507355215 /nfs/dbraw/zinc/35/52/15/507355215.db2.gz YBYPOUBPCXZEPL-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000047866224 507403377 /nfs/dbraw/zinc/40/33/77/507403377.db2.gz HOFNSEAIALWSOZ-SNVBAGLBSA-N 1 1 358.345 2.660 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000058883755 507476858 /nfs/dbraw/zinc/47/68/58/507476858.db2.gz BEYJMFWZEWDSFD-SCRDCRAPSA-N 1 1 364.421 2.794 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1 ZINC000060063823 507511759 /nfs/dbraw/zinc/51/17/59/507511759.db2.gz WKHQIONFIYLOJU-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO O=C(CC[NH+]1CCN(c2ccccc2F)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000026160594 507563037 /nfs/dbraw/zinc/56/30/37/507563037.db2.gz NHIIXYPILUMYDB-UHFFFAOYSA-N 1 1 372.400 2.885 20 5 FFBDMO C[N@H+](CCOc1ccccc1F)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027374058 507652896 /nfs/dbraw/zinc/65/28/96/507652896.db2.gz DSZRBPAXNTXFQE-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO C[N@@H+](CCOc1ccccc1F)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027374058 507652901 /nfs/dbraw/zinc/65/29/01/507652901.db2.gz DSZRBPAXNTXFQE-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000027914919 507692256 /nfs/dbraw/zinc/69/22/56/507692256.db2.gz SPKWRYOLZSJLHF-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000027914919 507692262 /nfs/dbraw/zinc/69/22/62/507692262.db2.gz SPKWRYOLZSJLHF-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1C ZINC000071808486 507717728 /nfs/dbraw/zinc/71/77/28/507717728.db2.gz VRXICQHTDYHPEG-CQSZACIVSA-N 1 1 369.487 2.754 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@@H](c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000029536829 507782142 /nfs/dbraw/zinc/78/21/42/507782142.db2.gz OSGJICNXADHORM-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000029536829 507782143 /nfs/dbraw/zinc/78/21/43/507782143.db2.gz OSGJICNXADHORM-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO C[N@H+](CCCOc1ccccc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000029854510 507792807 /nfs/dbraw/zinc/79/28/07/507792807.db2.gz NQPNVVFDVBSZCC-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO C[N@@H+](CCCOc1ccccc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000029854510 507792809 /nfs/dbraw/zinc/79/28/09/507792809.db2.gz NQPNVVFDVBSZCC-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000052101366 507797944 /nfs/dbraw/zinc/79/79/44/507797944.db2.gz WACWAVKHZJNGQC-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000052101366 507797945 /nfs/dbraw/zinc/79/79/45/507797945.db2.gz WACWAVKHZJNGQC-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000064725821 507807797 /nfs/dbraw/zinc/80/77/97/507807797.db2.gz XBDUBXCKXRNZAR-OWCLPIDISA-N 1 1 361.442 2.837 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000078454781 507872138 /nfs/dbraw/zinc/87/21/38/507872138.db2.gz VCVUUOXESSPTNO-MRXNPFEDSA-N 1 1 360.458 2.798 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CCCC1 ZINC000078510186 507878606 /nfs/dbraw/zinc/87/86/06/507878606.db2.gz NMTHLWNSVZAPGX-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000089929005 507885960 /nfs/dbraw/zinc/88/59/60/507885960.db2.gz BTCMQATTYUVRMA-QWRGUYRKSA-N 1 1 360.357 2.798 20 5 FFBDMO CC[C@@H](CSC)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000091099784 507955279 /nfs/dbraw/zinc/95/52/79/507955279.db2.gz JANZASZYYDTDGH-LBPRGKRZSA-N 1 1 353.444 2.966 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000091479775 507988711 /nfs/dbraw/zinc/98/87/11/507988711.db2.gz FUKJDDKYVPTHKO-GFCCVEGCSA-N 1 1 357.370 2.659 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)CCn2cc([N+](=O)[O-])nc2C)C1 ZINC000109966512 507998151 /nfs/dbraw/zinc/99/81/51/507998151.db2.gz OIGAYEISWJSYLK-HNNXBMFYSA-N 1 1 365.478 2.507 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000110653207 508039675 /nfs/dbraw/zinc/03/96/75/508039675.db2.gz WFQWCJTWIXITPV-HNNXBMFYSA-N 1 1 360.458 2.513 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2CC)cc1OC ZINC000110996518 508063833 /nfs/dbraw/zinc/06/38/33/508063833.db2.gz IWMRKWZDOVCOHK-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO C[C@@H]1C[N@@H+](CC2CC[NH+](Cc3cc([O-])ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586996 508084189 /nfs/dbraw/zinc/08/41/89/508084189.db2.gz KNKSHHSNXHKHEO-GASCZTMLSA-N 1 1 363.458 2.622 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CC[NH+](Cc3cc([O-])ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586996 508084191 /nfs/dbraw/zinc/08/41/91/508084191.db2.gz KNKSHHSNXHKHEO-GASCZTMLSA-N 1 1 363.458 2.622 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000092612724 508086457 /nfs/dbraw/zinc/08/64/57/508086457.db2.gz HUPKSBOMOGDOMQ-ZDUSSCGKSA-N 1 1 372.416 2.882 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000092612741 508086720 /nfs/dbraw/zinc/08/67/20/508086720.db2.gz RVAMIQSYIPBRTN-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092734479 508099280 /nfs/dbraw/zinc/09/92/80/508099280.db2.gz QQOBLWMPJQACQQ-LBPRGKRZSA-N 1 1 371.384 2.934 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092734479 508099281 /nfs/dbraw/zinc/09/92/81/508099281.db2.gz QQOBLWMPJQACQQ-LBPRGKRZSA-N 1 1 371.384 2.934 20 5 FFBDMO C[C@H]1C[C@H]1c1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000075588846 508120633 /nfs/dbraw/zinc/12/06/33/508120633.db2.gz FSMPWCOSJHILKC-YLQAJVPDSA-N 1 1 360.414 2.533 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000081128573 508141007 /nfs/dbraw/zinc/14/10/07/508141007.db2.gz CKNHOJHKJUAVBG-LJQANCHMSA-N 1 1 353.422 2.870 20 5 FFBDMO CCCn1nc(C)c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000093534245 508147386 /nfs/dbraw/zinc/14/73/86/508147386.db2.gz MQWKCWYQDQYRMH-HNNXBMFYSA-N 1 1 358.446 2.900 20 5 FFBDMO CNC(=O)CCC[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000093717827 508153135 /nfs/dbraw/zinc/15/31/35/508153135.db2.gz NNJQGWZMQBLVMB-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3nccn3C(F)F)CC2)cc1 ZINC000081600884 508196043 /nfs/dbraw/zinc/19/60/43/508196043.db2.gz VMSQRHXRIVWXBO-UHFFFAOYSA-N 1 1 365.384 2.547 20 5 FFBDMO CC[N@@H+](CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000102066024 508266194 /nfs/dbraw/zinc/26/61/94/508266194.db2.gz FEDBJYQSUNHBPF-UHFFFAOYSA-N 1 1 358.345 2.802 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@H]1CC(C)C ZINC000113942111 508287373 /nfs/dbraw/zinc/28/73/73/508287373.db2.gz UBIVRPNEOHARLA-OAHLLOKOSA-N 1 1 365.430 2.679 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187156 508298076 /nfs/dbraw/zinc/29/80/76/508298076.db2.gz CVHYOQCKZKKPMY-HIFRSBDPSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187156 508298078 /nfs/dbraw/zinc/29/80/78/508298078.db2.gz CVHYOQCKZKKPMY-HIFRSBDPSA-N 1 1 355.822 2.812 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCCOc2ccccc2)CC1 ZINC000077359441 508304869 /nfs/dbraw/zinc/30/48/69/508304869.db2.gz ORIKZRFSRDRIGK-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000085619956 508314423 /nfs/dbraw/zinc/31/44/23/508314423.db2.gz ULXLNLSDZLWSCI-OAHLLOKOSA-N 1 1 364.446 2.690 20 5 FFBDMO COc1ccnc(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000104720162 508343417 /nfs/dbraw/zinc/34/34/17/508343417.db2.gz SXWAEXCJRCDFSZ-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@H](C)C1 ZINC000115274199 508380455 /nfs/dbraw/zinc/38/04/55/508380455.db2.gz RZXXLUITEWCKIC-NVXWUHKLSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000153083012 508545996 /nfs/dbraw/zinc/54/59/96/508545996.db2.gz MQAOLCMVSHNJLC-UHFFFAOYSA-N 1 1 356.426 2.939 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134873652 508571499 /nfs/dbraw/zinc/57/14/99/508571499.db2.gz ZHNLQPAYZDKSIC-DNVCBOLYSA-N 1 1 372.469 2.790 20 5 FFBDMO Cc1cnc(CC[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000157836936 508620259 /nfs/dbraw/zinc/62/02/59/508620259.db2.gz USPHRFQNARCLED-HNNXBMFYSA-N 1 1 360.439 2.640 20 5 FFBDMO Cc1cnc(CC[N@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000157836936 508620263 /nfs/dbraw/zinc/62/02/63/508620263.db2.gz USPHRFQNARCLED-HNNXBMFYSA-N 1 1 360.439 2.640 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000153742814 508639228 /nfs/dbraw/zinc/63/92/28/508639228.db2.gz XQPASSXLDGGKPT-CYBMUJFWSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000123199090 508651229 /nfs/dbraw/zinc/65/12/29/508651229.db2.gz UHUBGROLADNFKN-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[NH+]1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094169 508682324 /nfs/dbraw/zinc/68/23/24/508682324.db2.gz RRUJPDWJIDBPPS-DYVFJYSZSA-N 1 1 366.437 2.725 20 5 FFBDMO CC[NH+]1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094169 508682327 /nfs/dbraw/zinc/68/23/27/508682327.db2.gz RRUJPDWJIDBPPS-DYVFJYSZSA-N 1 1 366.437 2.725 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094169 508682328 /nfs/dbraw/zinc/68/23/28/508682328.db2.gz RRUJPDWJIDBPPS-DYVFJYSZSA-N 1 1 366.437 2.725 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094169 508682331 /nfs/dbraw/zinc/68/23/31/508682331.db2.gz RRUJPDWJIDBPPS-DYVFJYSZSA-N 1 1 366.437 2.725 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841698 508682486 /nfs/dbraw/zinc/68/24/86/508682486.db2.gz UIOHIAQFRDTFHP-QWHCGFSZSA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000119097456 508725043 /nfs/dbraw/zinc/72/50/43/508725043.db2.gz OHXLOYAHYZXAAC-NSHDSACASA-N 1 1 370.247 2.737 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)COc2ccccc2[N+](=O)[O-])cn1 ZINC000123712901 508728230 /nfs/dbraw/zinc/72/82/30/508728230.db2.gz PBUVZVUEOYXNSX-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123848901 508747400 /nfs/dbraw/zinc/74/74/00/508747400.db2.gz BQPBFFUWVFHFRU-LSDHHAIUSA-N 1 1 371.441 2.610 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000119249106 508757439 /nfs/dbraw/zinc/75/74/39/508757439.db2.gz BKIKHGDKIWUGMV-AWEZNQCLSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000119249106 508757443 /nfs/dbraw/zinc/75/74/43/508757443.db2.gz BKIKHGDKIWUGMV-AWEZNQCLSA-N 1 1 353.850 2.935 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119264823 508760096 /nfs/dbraw/zinc/76/00/96/508760096.db2.gz SRCAKTHEOBXRNR-NSHDSACASA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000119264823 508760099 /nfs/dbraw/zinc/76/00/99/508760099.db2.gz SRCAKTHEOBXRNR-NSHDSACASA-N 1 1 362.411 2.524 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159032630 508783634 /nfs/dbraw/zinc/78/36/34/508783634.db2.gz FOGWEPZNRCKSKU-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000139911307 508796861 /nfs/dbraw/zinc/79/68/61/508796861.db2.gz HWCALUSISDRHGN-DOMZBBRYSA-N 1 1 366.849 2.603 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000119476651 508804311 /nfs/dbraw/zinc/80/43/11/508804311.db2.gz IMEAKYDXKDLWFJ-SNVBAGLBSA-N 1 1 368.231 2.571 20 5 FFBDMO C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@@H+]1CCc2ccccc2C1 ZINC000130265268 508808497 /nfs/dbraw/zinc/80/84/97/508808497.db2.gz HKDGGEPKQMALPD-OAHLLOKOSA-N 1 1 365.433 2.926 20 5 FFBDMO C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCc2ccccc2C1 ZINC000130265268 508808501 /nfs/dbraw/zinc/80/85/01/508808501.db2.gz HKDGGEPKQMALPD-OAHLLOKOSA-N 1 1 365.433 2.926 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000159257886 508815492 /nfs/dbraw/zinc/81/54/92/508815492.db2.gz CAOACTXUPVYMMQ-CXAGYDPISA-N 1 1 359.426 2.579 20 5 FFBDMO CCC(CC)(CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@H](C)c1ccccc1 ZINC000154950291 508889820 /nfs/dbraw/zinc/88/98/20/508889820.db2.gz BIMUOGNSWPAISK-CYBMUJFWSA-N 1 1 359.430 2.957 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150861191 508909826 /nfs/dbraw/zinc/90/98/26/508909826.db2.gz VXFYKGXKEDRKSB-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150861191 508909829 /nfs/dbraw/zinc/90/98/29/508909829.db2.gz VXFYKGXKEDRKSB-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150880676 508914567 /nfs/dbraw/zinc/91/45/67/508914567.db2.gz MKZDRRKYSOOQSD-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150880676 508914572 /nfs/dbraw/zinc/91/45/72/508914572.db2.gz MKZDRRKYSOOQSD-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000377761353 512436119 /nfs/dbraw/zinc/43/61/19/512436119.db2.gz PFRVAZRHZOCWOS-INIZCTEOSA-N 1 1 357.414 2.684 20 5 FFBDMO COC(=O)C1=NOC2(C1)CC[NH+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000161253803 509092462 /nfs/dbraw/zinc/09/24/62/509092462.db2.gz FTVJSBLNQWBNOC-UHFFFAOYSA-N 1 1 367.789 2.532 20 5 FFBDMO C[N@@H+](Cc1nc2ccccc2o1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000156242220 509149228 /nfs/dbraw/zinc/14/92/28/509149228.db2.gz RTTSRYSAHXHYKP-AWEZNQCLSA-N 1 1 357.366 2.608 20 5 FFBDMO C[N@H+](Cc1nc2ccccc2o1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000156242220 509149232 /nfs/dbraw/zinc/14/92/32/509149232.db2.gz RTTSRYSAHXHYKP-AWEZNQCLSA-N 1 1 357.366 2.608 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2c([N+](=O)[O-])cnn2C)cc1 ZINC000162104671 509172577 /nfs/dbraw/zinc/17/25/77/509172577.db2.gz BKCIHMLZNQYHOR-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000191798616 509185650 /nfs/dbraw/zinc/18/56/50/509185650.db2.gz BGDALIZQZUKPOM-LRDDRELGSA-N 1 1 359.382 2.881 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000191798616 509185656 /nfs/dbraw/zinc/18/56/56/509185656.db2.gz BGDALIZQZUKPOM-LRDDRELGSA-N 1 1 359.382 2.881 20 5 FFBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000247922314 509192162 /nfs/dbraw/zinc/19/21/62/509192162.db2.gz BHKXMOHPAVYXME-APWZRJJASA-N 1 1 357.410 2.875 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 ZINC000162388134 509213557 /nfs/dbraw/zinc/21/35/57/509213557.db2.gz MFMPWWYRYWMIES-CYBMUJFWSA-N 1 1 357.414 2.955 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248147467 509248475 /nfs/dbraw/zinc/24/84/75/509248475.db2.gz ZWZPPBVFCLROJZ-VQIMIIECSA-N 1 1 354.410 2.568 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000172863455 509278308 /nfs/dbraw/zinc/27/83/08/509278308.db2.gz KJOZEAMAGZCLPB-UHFFFAOYSA-N 1 1 369.421 2.651 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000176193351 509370005 /nfs/dbraw/zinc/37/00/05/509370005.db2.gz CWXYGJMHQRQVRD-UHFFFAOYSA-N 1 1 372.212 2.669 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000176193351 509370010 /nfs/dbraw/zinc/37/00/10/509370010.db2.gz CWXYGJMHQRQVRD-UHFFFAOYSA-N 1 1 372.212 2.669 20 5 FFBDMO COc1ccc2c(c1)nc(C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)n2C ZINC000185843011 509382677 /nfs/dbraw/zinc/38/26/77/509382677.db2.gz DWACHXZUKJJYGQ-UHFFFAOYSA-N 1 1 356.382 2.789 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H]1CCCN1c1ncc([N+](=O)[O-])cc1Br ZINC000267234131 509404920 /nfs/dbraw/zinc/40/49/20/509404920.db2.gz QPQHOEVSOBHXAW-NSHDSACASA-N 1 1 366.219 2.926 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Br)c1 ZINC000267276535 509423621 /nfs/dbraw/zinc/42/36/21/509423621.db2.gz UKGPCUDLZMPHKW-VIFPVBQESA-N 1 1 352.192 2.859 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000248719035 509451168 /nfs/dbraw/zinc/45/11/68/509451168.db2.gz CDVJBGKBCXQYCM-CZUORRHYSA-N 1 1 371.441 2.521 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)[C@H](C)C1 ZINC000173259562 509485776 /nfs/dbraw/zinc/48/57/76/509485776.db2.gz XMICXBFCERNSMY-CZUORRHYSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000248816807 509495873 /nfs/dbraw/zinc/49/58/73/509495873.db2.gz LAKNBZFUOFWMNE-HNAYVOBHSA-N 1 1 353.422 2.774 20 5 FFBDMO CC[C@H]1CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC[N@@H+]1CCOC ZINC000179585611 509523984 /nfs/dbraw/zinc/52/39/84/509523984.db2.gz LIJNVFVZGBKPFK-INIZCTEOSA-N 1 1 363.458 2.703 20 5 FFBDMO CC[C@H]1CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000179585611 509523986 /nfs/dbraw/zinc/52/39/86/509523986.db2.gz LIJNVFVZGBKPFK-INIZCTEOSA-N 1 1 363.458 2.703 20 5 FFBDMO CCCN1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1=O ZINC000189374096 509543547 /nfs/dbraw/zinc/54/35/47/509543547.db2.gz WNEWKZIOKONKTC-UHFFFAOYSA-N 1 1 372.425 2.737 20 5 FFBDMO CCCN1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1=O ZINC000189374096 509543552 /nfs/dbraw/zinc/54/35/52/509543552.db2.gz WNEWKZIOKONKTC-UHFFFAOYSA-N 1 1 372.425 2.737 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000264472867 509548584 /nfs/dbraw/zinc/54/85/84/509548584.db2.gz OAKABYFVQHDDDZ-KRWDZBQOSA-N 1 1 368.437 2.904 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000189428409 509571003 /nfs/dbraw/zinc/57/10/03/509571003.db2.gz ITEMIXAXBQLOTI-IBGZPJMESA-N 1 1 371.441 2.665 20 5 FFBDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000192650910 509582739 /nfs/dbraw/zinc/58/27/39/509582739.db2.gz HBSRGPPIRKXNGE-LLVKDONJSA-N 1 1 359.382 2.562 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000192707236 509606082 /nfs/dbraw/zinc/60/60/82/509606082.db2.gz GDCVIDAGSXVTIP-KRWDZBQOSA-N 1 1 360.410 2.613 20 5 FFBDMO Cc1nc2ccccc2nc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173471833 509621673 /nfs/dbraw/zinc/62/16/73/509621673.db2.gz ACSRVJZEBAVITA-CQSZACIVSA-N 1 1 364.409 2.928 20 5 FFBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000183181422 509644087 /nfs/dbraw/zinc/64/40/87/509644087.db2.gz FTOTUKSTXCIOCB-CYBMUJFWSA-N 1 1 360.414 2.769 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192823672 509658874 /nfs/dbraw/zinc/65/88/74/509658874.db2.gz DIVNSLQBRXHOEZ-OXQOHEQNSA-N 1 1 360.502 2.835 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000267946610 509681389 /nfs/dbraw/zinc/68/13/89/509681389.db2.gz PEOPNXMIOWBIHZ-OKILXGFUSA-N 1 1 350.419 2.606 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000173666532 509708638 /nfs/dbraw/zinc/70/86/38/509708638.db2.gz JIIRFWPGFGDVQE-OAHLLOKOSA-N 1 1 369.487 2.652 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058726 509729169 /nfs/dbraw/zinc/72/91/69/509729169.db2.gz JDTOHROUYBIIBZ-AAEUAGOBSA-N 1 1 374.384 2.983 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268040713 509731035 /nfs/dbraw/zinc/73/10/35/509731035.db2.gz XYWBBGDLFRDMIF-KOLCDFICSA-N 1 1 357.332 2.969 20 5 FFBDMO COc1cc(C[N@@H+]2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180063954 509733133 /nfs/dbraw/zinc/73/31/33/509733133.db2.gz SLBYPIVMPBXMPG-LLVKDONJSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@H+]2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180063954 509733142 /nfs/dbraw/zinc/73/31/42/509733142.db2.gz SLBYPIVMPBXMPG-LLVKDONJSA-N 1 1 360.357 2.858 20 5 FFBDMO C[C@H](O)C[NH+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000189845731 509784483 /nfs/dbraw/zinc/78/44/83/509784483.db2.gz ZLWNHNSNUSGQCO-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H](O)CN1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000189845731 509784494 /nfs/dbraw/zinc/78/44/94/509784494.db2.gz ZLWNHNSNUSGQCO-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO COc1ccc(OCCN(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000173960799 509876568 /nfs/dbraw/zinc/87/65/68/509876568.db2.gz PKRCKLITJPSWBS-OAHLLOKOSA-N 1 1 351.447 2.788 20 5 FFBDMO COc1cc(CN(C)CC[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000186754027 509889392 /nfs/dbraw/zinc/88/93/92/509889392.db2.gz HEHWWJRLDJMYJW-UHFFFAOYSA-N 1 1 359.373 2.731 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000177138825 509895995 /nfs/dbraw/zinc/89/59/95/509895995.db2.gz ARNKXHQDMMWDEA-GOSISDBHSA-N 1 1 369.421 2.527 20 5 FFBDMO CCc1oc(C(=O)OC)cc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000177199415 509932588 /nfs/dbraw/zinc/93/25/88/509932588.db2.gz AVGQKVZBKUJJJH-ZDUSSCGKSA-N 1 1 374.397 2.618 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000177207976 509937750 /nfs/dbraw/zinc/93/77/50/509937750.db2.gz NWMUOXNEWGHTPX-HIFRSBDPSA-N 1 1 358.442 2.550 20 5 FFBDMO C[N@H+](Cc1cc(F)c(F)c(F)c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000180496339 509955644 /nfs/dbraw/zinc/95/56/44/509955644.db2.gz DCOBDPGQJLXJGA-CYBMUJFWSA-N 1 1 370.327 2.884 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000180508023 509960482 /nfs/dbraw/zinc/96/04/82/509960482.db2.gz QFPAXDXNKXKVRC-ZDUSSCGKSA-N 1 1 363.414 2.565 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585279 509978139 /nfs/dbraw/zinc/97/81/39/509978139.db2.gz HRJHVDMHXYCTFB-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3ccn[nH]3)C2)cccc1[N+](=O)[O-] ZINC000193585279 509978144 /nfs/dbraw/zinc/97/81/44/509978144.db2.gz HRJHVDMHXYCTFB-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3ccn[nH]3)C2)cccc1[N+](=O)[O-] ZINC000193585279 509978152 /nfs/dbraw/zinc/97/81/52/509978152.db2.gz HRJHVDMHXYCTFB-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO COC(=O)c1cnc(NCCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000190168008 509982355 /nfs/dbraw/zinc/98/23/55/509982355.db2.gz IILBMKXRPAHCHZ-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991210 /nfs/dbraw/zinc/99/12/10/509991210.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991216 /nfs/dbraw/zinc/99/12/16/509991216.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000177312283 509991224 /nfs/dbraw/zinc/99/12/24/509991224.db2.gz JBILXFYYBLMAHK-CVEARBPZSA-N 1 1 360.458 2.790 20 5 FFBDMO C[C@@H]1CCCCN1C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174241216 510021085 /nfs/dbraw/zinc/02/10/85/510021085.db2.gz QUOCJHTXLQLHBM-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO COc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000268622707 510040424 /nfs/dbraw/zinc/04/04/24/510040424.db2.gz YNIVBKSWMBCANO-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cccc2c1CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000193731623 510041623 /nfs/dbraw/zinc/04/16/23/510041623.db2.gz DBBZRICRDCUOOU-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1cccc2c1CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000193731623 510041626 /nfs/dbraw/zinc/04/16/26/510041626.db2.gz DBBZRICRDCUOOU-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO O=C(CN1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265522624 510098067 /nfs/dbraw/zinc/09/80/67/510098067.db2.gz TXPPBLOIZIDSEY-UHFFFAOYSA-N 1 1 363.805 2.789 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000193949939 510144808 /nfs/dbraw/zinc/14/48/08/510144808.db2.gz POPSUPGUXIQWFN-CQSZACIVSA-N 1 1 364.446 2.667 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3CCC[N@H+]3Cc3ccccc32)cc1 ZINC000180949219 510201516 /nfs/dbraw/zinc/20/15/16/510201516.db2.gz JCLBFPLRPTUWQI-MRXNPFEDSA-N 1 1 373.434 2.768 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194107141 510218024 /nfs/dbraw/zinc/21/80/24/510218024.db2.gz SUTFAQGUYXPPKH-SFHVURJKSA-N 1 1 368.437 2.916 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000246025809 510254537 /nfs/dbraw/zinc/25/45/37/510254537.db2.gz VNGNHSFYCKZVFJ-FZMZJTMJSA-N 1 1 369.368 2.753 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C2 ZINC000174985076 510419400 /nfs/dbraw/zinc/41/94/00/510419400.db2.gz FZXSNFAZNASEKA-GOEBONIOSA-N 1 1 360.458 2.748 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000178164504 510466769 /nfs/dbraw/zinc/46/67/69/510466769.db2.gz MCBWLWSWMAIHFV-OAHLLOKOSA-N 1 1 354.410 2.571 20 5 FFBDMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000171953077 510469401 /nfs/dbraw/zinc/46/94/01/510469401.db2.gz JNUVYWPTVFSSKX-OAHLLOKOSA-N 1 1 367.427 2.549 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)N1CC(=O)Nc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000181559344 510473488 /nfs/dbraw/zinc/47/34/88/510473488.db2.gz BFBRVYSDCSOASM-OAHLLOKOSA-N 1 1 368.393 2.621 20 5 FFBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000175116237 510490029 /nfs/dbraw/zinc/49/00/29/510490029.db2.gz DDDWLHPUNDTHLB-QFBILLFUSA-N 1 1 359.426 2.900 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000181650178 510521988 /nfs/dbraw/zinc/52/19/88/510521988.db2.gz FXGFONYBAOFZBN-SJORKVTESA-N 1 1 372.421 2.833 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000246730074 510640510 /nfs/dbraw/zinc/64/05/10/510640510.db2.gz MVZOVJDKHONBLT-CVEARBPZSA-N 1 1 350.806 2.643 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC000178577394 510671314 /nfs/dbraw/zinc/67/13/14/510671314.db2.gz IBRLIRPYGIHSIH-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)c1ccccc1Cl ZINC000175755163 510772701 /nfs/dbraw/zinc/77/27/01/510772701.db2.gz YMUHYTAZIBBXTG-HNNXBMFYSA-N 1 1 362.817 2.863 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000247009528 510796535 /nfs/dbraw/zinc/79/65/35/510796535.db2.gz RFDAARZQRIDTCS-SJORKVTESA-N 1 1 372.469 2.894 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1ccnc1 ZINC000247014315 510798312 /nfs/dbraw/zinc/79/83/12/510798312.db2.gz DFRWGSJKLRESGA-CZUORRHYSA-N 1 1 368.397 2.924 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172581214 510804259 /nfs/dbraw/zinc/80/42/59/510804259.db2.gz MMWFLOSZLZASKW-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO CCOc1ccccc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182216740 510818352 /nfs/dbraw/zinc/81/83/52/510818352.db2.gz QJYGMLPKHCXFOV-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000247113483 510837498 /nfs/dbraw/zinc/83/74/98/510837498.db2.gz LRPCHFGOGCROIL-YJBOKZPZSA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000247167346 510848080 /nfs/dbraw/zinc/84/80/80/510848080.db2.gz AQQSGDRHZLQPAI-ZWNOBZJWSA-N 1 1 370.247 2.770 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000182310663 510848569 /nfs/dbraw/zinc/84/85/69/510848569.db2.gz TXYPQWZVIARCMB-NSHDSACASA-N 1 1 369.874 2.941 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000247333567 510857418 /nfs/dbraw/zinc/85/74/18/510857418.db2.gz XBOHXWFQSDKPJU-BLLLJJGKSA-N 1 1 366.849 2.603 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247425374 510860622 /nfs/dbraw/zinc/86/06/22/510860622.db2.gz OHJAWPTUODUMSX-BBRMVZONSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])c1 ZINC000270779171 510981687 /nfs/dbraw/zinc/98/16/87/510981687.db2.gz STDIYWJPPATBCW-UHFFFAOYSA-N 1 1 368.397 2.949 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000294231690 510998211 /nfs/dbraw/zinc/99/82/11/510998211.db2.gz RNVRZAKNASVTJR-QGZVFWFLSA-N 1 1 369.824 2.874 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H](C2CC2)O1 ZINC000279366761 511058261 /nfs/dbraw/zinc/05/82/61/511058261.db2.gz RLZXPHZVDIUSFW-ZBEGNZNMSA-N 1 1 351.378 2.562 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294606513 511118522 /nfs/dbraw/zinc/11/85/22/511118522.db2.gz VIIYIAKPYHDXJH-TZMCWYRMSA-N 1 1 357.332 2.970 20 5 FFBDMO Cc1cc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000291374283 511171532 /nfs/dbraw/zinc/17/15/32/511171532.db2.gz DJPYXWWGTQMTJZ-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1C[C@H](C)O ZINC000279726324 511191252 /nfs/dbraw/zinc/19/12/52/511191252.db2.gz JEINTXLOAHJMIE-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C2 ZINC000291446832 511200646 /nfs/dbraw/zinc/20/06/46/511200646.db2.gz MVHHYWSVEZLEPA-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO COc1cccc(CNC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271577750 511250430 /nfs/dbraw/zinc/25/04/30/511250430.db2.gz BGYSZSSVMZSJQA-KBPBESRZSA-N 1 1 357.410 2.959 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000295007603 511252107 /nfs/dbraw/zinc/25/21/07/511252107.db2.gz PQQODQGJDAQHCA-UHFFFAOYSA-N 1 1 368.397 2.700 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CNC(=O)C(F)(F)F)C1 ZINC000291575569 511253257 /nfs/dbraw/zinc/25/32/57/511253257.db2.gz OHFVZUKPTRJHKQ-GFCCVEGCSA-N 1 1 359.348 2.794 20 5 FFBDMO COc1cccc(S(=O)(=O)CC[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271718761 511299285 /nfs/dbraw/zinc/29/92/85/511299285.db2.gz KLLSOIICYLMXML-ZDUSSCGKSA-N 1 1 364.423 2.728 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000291726411 511312644 /nfs/dbraw/zinc/31/26/44/511312644.db2.gz HXIJLSLYPDYSSF-KDOFPFPSSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000283465905 511377380 /nfs/dbraw/zinc/37/73/80/511377380.db2.gz ZDAAWUDSBZWFIZ-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272030841 511406545 /nfs/dbraw/zinc/40/65/45/511406545.db2.gz PDSDUMXUPOATAZ-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272030841 511406550 /nfs/dbraw/zinc/40/65/50/511406550.db2.gz PDSDUMXUPOATAZ-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000295454960 511411827 /nfs/dbraw/zinc/41/18/27/511411827.db2.gz PKEFJTNHJSTISB-OAHLLOKOSA-N 1 1 373.453 2.891 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000298848542 511430304 /nfs/dbraw/zinc/43/03/04/511430304.db2.gz JNKAXRBKQPPYEW-UHFFFAOYSA-N 1 1 369.421 2.651 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000272260122 511483846 /nfs/dbraw/zinc/48/38/46/511483846.db2.gz UYIVZEXPWSBZCG-DOMZBBRYSA-N 1 1 355.385 2.875 20 5 FFBDMO C[C@H]1C[C@H](N(C)Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000363355217 511498954 /nfs/dbraw/zinc/49/89/54/511498954.db2.gz IFPYLARFENUJIE-DOTOQJQBSA-N 1 1 357.458 2.813 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365588062 511546040 /nfs/dbraw/zinc/54/60/40/511546040.db2.gz UENKQNZMYJPZRG-KYJSFNMBSA-N 1 1 357.410 2.813 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CO)c1ccc(Cl)cc1 ZINC000296409049 511731479 /nfs/dbraw/zinc/73/14/79/511731479.db2.gz UHUOLXWVMOWHSJ-SJORKVTESA-N 1 1 350.802 2.947 20 5 FFBDMO C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CC2)C1 ZINC000296715266 511866876 /nfs/dbraw/zinc/86/68/76/511866876.db2.gz MKEOIGBTRNTUCP-CYBMUJFWSA-N 1 1 357.414 2.561 20 5 FFBDMO COc1cc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c([N+](=O)[O-])cc1C ZINC000327690745 511881246 /nfs/dbraw/zinc/88/12/46/511881246.db2.gz JIODGCVBNTXDEI-QGZVFWFLSA-N 1 1 350.463 2.596 20 5 FFBDMO CN(C)C(=O)O[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000296758747 511885482 /nfs/dbraw/zinc/88/54/82/511885482.db2.gz PDMTUVBKAPXTFW-HNNXBMFYSA-N 1 1 374.397 2.565 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293353974 511935006 /nfs/dbraw/zinc/93/50/06/511935006.db2.gz KXMZRIYPIUGQTA-XPTSAGLGSA-N 1 1 357.332 2.826 20 5 FFBDMO Cc1cc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000364112862 511965394 /nfs/dbraw/zinc/96/53/94/511965394.db2.gz WTSKJQJEXWQKQF-INIZCTEOSA-N 1 1 369.469 2.668 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2cn[nH]c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275032402 512021558 /nfs/dbraw/zinc/02/15/58/512021558.db2.gz APSDUUKCYGOWAH-SECBINFHSA-N 1 1 356.329 2.821 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000293697116 512055332 /nfs/dbraw/zinc/05/53/32/512055332.db2.gz MYQQGYANNGFEEG-CQSZACIVSA-N 1 1 361.442 2.940 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000364404780 512106885 /nfs/dbraw/zinc/10/68/85/512106885.db2.gz PCFCPYZMRVSISL-RHSMWYFYSA-N 1 1 354.410 2.630 20 5 FFBDMO O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000367475452 512520130 /nfs/dbraw/zinc/52/01/30/512520130.db2.gz YRPDFPBQXWQPRT-INIZCTEOSA-N 1 1 370.409 2.844 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000375984532 512601477 /nfs/dbraw/zinc/60/14/77/512601477.db2.gz MGKOCZZMQZXYSO-LJQANCHMSA-N 1 1 368.437 2.655 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000375984532 512601482 /nfs/dbraw/zinc/60/14/82/512601482.db2.gz MGKOCZZMQZXYSO-LJQANCHMSA-N 1 1 368.437 2.655 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCn3c[nH+]cc3C2)n1 ZINC000371888128 512619174 /nfs/dbraw/zinc/61/91/74/512619174.db2.gz MNDRSCVZDOESRB-LBPRGKRZSA-N 1 1 354.370 2.559 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000374015518 512623817 /nfs/dbraw/zinc/62/38/17/512623817.db2.gz VZJLRBJVHHBXER-VKJFTORMSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000374169848 512690299 /nfs/dbraw/zinc/69/02/99/512690299.db2.gz GURCWZVDKSGFST-KKBFJZEXSA-N 1 1 361.442 2.795 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H](COC)C2)c([N+](=O)[O-])c1 ZINC000372090117 512712430 /nfs/dbraw/zinc/71/24/30/512712430.db2.gz ZDQYUWZFSIVWKN-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@@H](COC)C2)c([N+](=O)[O-])c1 ZINC000372090117 512712435 /nfs/dbraw/zinc/71/24/35/512712435.db2.gz ZDQYUWZFSIVWKN-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000374347078 512780938 /nfs/dbraw/zinc/78/09/38/512780938.db2.gz ASOXSQFJOAUYAG-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCN(c2cnccn2)CC1 ZINC000378558632 512822642 /nfs/dbraw/zinc/82/26/42/512822642.db2.gz IQOLDJJONAGJQR-GQCTYLIASA-N 1 1 353.426 2.999 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000379933348 512871984 /nfs/dbraw/zinc/87/19/84/512871984.db2.gz ADKQIWUKUYHLPS-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000382009667 512876367 /nfs/dbraw/zinc/87/63/67/512876367.db2.gz MTXQVNILKBBGJS-CZUORRHYSA-N 1 1 354.410 2.570 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000368364993 512915624 /nfs/dbraw/zinc/91/56/24/512915624.db2.gz OORUGWSGCSLVBP-YJBOKZPZSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000368364993 512915627 /nfs/dbraw/zinc/91/56/27/512915627.db2.gz OORUGWSGCSLVBP-YJBOKZPZSA-N 1 1 357.410 2.813 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060921 512936539 /nfs/dbraw/zinc/93/65/39/512936539.db2.gz HDXUECYVQUFODX-ACJLOTCBSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060921 512936542 /nfs/dbraw/zinc/93/65/42/512936542.db2.gz HDXUECYVQUFODX-ACJLOTCBSA-N 1 1 363.414 2.505 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](CCC(=O)OC(C)(C)C)C1 ZINC000412060496 512937233 /nfs/dbraw/zinc/93/72/33/512937233.db2.gz FTJAGAJPCNQSNA-ZDUSSCGKSA-N 1 1 352.435 2.662 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](CCC(=O)OC(C)(C)C)C1 ZINC000412060496 512937238 /nfs/dbraw/zinc/93/72/38/512937238.db2.gz FTJAGAJPCNQSNA-ZDUSSCGKSA-N 1 1 352.435 2.662 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000412064324 512940020 /nfs/dbraw/zinc/94/00/20/512940020.db2.gz JVCIFIPEDBOPOU-GOSISDBHSA-N 1 1 363.414 2.507 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000412067143 512941924 /nfs/dbraw/zinc/94/19/24/512941924.db2.gz LXBJYEYLEMHALZ-SFHVURJKSA-N 1 1 363.414 2.507 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000407997439 512981273 /nfs/dbraw/zinc/98/12/73/512981273.db2.gz VXSLGMSXHCWDEI-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C[N@@H+]1C ZINC000408075639 512994777 /nfs/dbraw/zinc/99/47/77/512994777.db2.gz ZQSCELOCRODPTN-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C[N@H+]1C ZINC000408075639 512994779 /nfs/dbraw/zinc/99/47/79/512994779.db2.gz ZQSCELOCRODPTN-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000374778528 512998619 /nfs/dbraw/zinc/99/86/19/512998619.db2.gz JYMWLWAAWLTTOD-IHBAFOEMSA-N 1 1 356.426 2.772 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[NH2+]2)cc1 ZINC000374812252 513015833 /nfs/dbraw/zinc/01/58/33/513015833.db2.gz QQVNLWLUTWZCGM-QGZVFWFLSA-N 1 1 372.400 2.665 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429001791 513247729 /nfs/dbraw/zinc/24/77/29/513247729.db2.gz WZHFBRAJVKXBPV-BASYENTBSA-N 1 1 360.458 2.584 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](CCO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421403030 513249815 /nfs/dbraw/zinc/24/98/15/513249815.db2.gz WTQGWEVUZOZEQZ-HNNXBMFYSA-N 1 1 358.442 2.980 20 5 FFBDMO CO[C@@H](Cc1ccccc1)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450561485 513252522 /nfs/dbraw/zinc/25/25/22/513252522.db2.gz FWHODNXLEFAXHT-WMZOPIPTSA-N 1 1 356.426 2.734 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](C)C1 ZINC000429017073 513255125 /nfs/dbraw/zinc/25/51/25/513255125.db2.gz DSFCSUUIWBDWTF-LBTNJELSSA-N 1 1 361.442 2.623 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434179933 513256650 /nfs/dbraw/zinc/25/66/50/513256650.db2.gz ACJPQMYKJDAQLI-ZDUSSCGKSA-N 1 1 351.451 2.826 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000429208765 513306757 /nfs/dbraw/zinc/30/67/57/513306757.db2.gz MLFPGMKLAKEHSR-AWEZNQCLSA-N 1 1 372.425 2.882 20 5 FFBDMO COC(=O)c1ccccc1NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429243613 513313435 /nfs/dbraw/zinc/31/34/35/513313435.db2.gz BFXYUNMYIOXYFR-UHFFFAOYSA-N 1 1 371.393 2.845 20 5 FFBDMO CCOc1ccc(OCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000440497876 513335518 /nfs/dbraw/zinc/33/55/18/513335518.db2.gz WHLOURURHVPGEX-HNNXBMFYSA-N 1 1 372.425 2.954 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000450929606 513408763 /nfs/dbraw/zinc/40/87/63/513408763.db2.gz JTPCYRBSABCEMH-AWEZNQCLSA-N 1 1 357.414 2.588 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000434832370 513443327 /nfs/dbraw/zinc/44/33/27/513443327.db2.gz DIFYCFKDDKPOGF-UHFFFAOYSA-N 1 1 353.382 2.900 20 5 FFBDMO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000441358268 513551238 /nfs/dbraw/zinc/55/12/38/513551238.db2.gz VBPIHOAOPHWRNW-QYZOEREBSA-N 1 1 358.442 2.729 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000451265904 513636704 /nfs/dbraw/zinc/63/67/04/513636704.db2.gz ONYKDNKIMGUMGV-RTBURBONSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000451265904 513636705 /nfs/dbraw/zinc/63/67/05/513636705.db2.gz ONYKDNKIMGUMGV-RTBURBONSA-N 1 1 360.385 2.774 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@H]1C ZINC000413491318 513681600 /nfs/dbraw/zinc/68/16/00/513681600.db2.gz BBIUMJXWYNIRIW-OLZOCXBDSA-N 1 1 367.421 2.616 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@H]1C ZINC000413491317 513682154 /nfs/dbraw/zinc/68/21/54/513682154.db2.gz BBIUMJXWYNIRIW-CHWSQXEVSA-N 1 1 367.421 2.616 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000451339696 513686024 /nfs/dbraw/zinc/68/60/24/513686024.db2.gz IWEKXYVQTYSJTD-NUJGCVRESA-N 1 1 364.442 2.998 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1 ZINC000451341704 513688149 /nfs/dbraw/zinc/68/81/49/513688149.db2.gz LLBIFZGBWJZHNF-KURKYZTESA-N 1 1 361.442 2.939 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451341206 513688803 /nfs/dbraw/zinc/68/88/03/513688803.db2.gz KTIBYXRDXVPOMO-KBAYOESNSA-N 1 1 361.442 2.857 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451366212 513704191 /nfs/dbraw/zinc/70/41/91/513704191.db2.gz IAWOTBSXOAUDMQ-IZSNYMMISA-N 1 1 357.410 2.686 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccnn3-c3ccccc3)C2)nc1 ZINC000448339650 513738277 /nfs/dbraw/zinc/73/82/77/513738277.db2.gz PWCZCBAFWZAHRP-HNNXBMFYSA-N 1 1 364.409 2.862 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccnn3-c3ccccc3)C2)nc1 ZINC000448339650 513738284 /nfs/dbraw/zinc/73/82/84/513738284.db2.gz PWCZCBAFWZAHRP-HNNXBMFYSA-N 1 1 364.409 2.862 20 5 FFBDMO C[NH2+]CC1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000430925133 513783194 /nfs/dbraw/zinc/78/31/94/513783194.db2.gz KMJDRIXRSDBORL-UHFFFAOYSA-N 1 1 359.373 2.636 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCSC[C@H]2C2CCC2)c1 ZINC000419363173 513789102 /nfs/dbraw/zinc/78/91/02/513789102.db2.gz OPPSIOBOAPLGPR-WBVHZDCISA-N 1 1 352.456 2.552 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC[C@H]1C1CC1 ZINC000451656568 513893636 /nfs/dbraw/zinc/89/36/36/513893636.db2.gz UIHAPHHOYIBCBN-HNNXBMFYSA-N 1 1 365.455 2.759 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451730340 513943612 /nfs/dbraw/zinc/94/36/12/513943612.db2.gz OMXYQJBAPSJQKH-ZDUSSCGKSA-N 1 1 354.838 2.603 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccnn3C3CCCC3)C2)nc1 ZINC000449031330 514038624 /nfs/dbraw/zinc/03/86/24/514038624.db2.gz VGBBKISZIIULEK-AWEZNQCLSA-N 1 1 356.430 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccnn3C3CCCC3)C2)nc1 ZINC000449031330 514038626 /nfs/dbraw/zinc/03/86/26/514038626.db2.gz VGBBKISZIIULEK-AWEZNQCLSA-N 1 1 356.430 2.988 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]C3(C(=O)N(C)C)CC3)o2)c([N+](=O)[O-])c1 ZINC000414485908 514145106 /nfs/dbraw/zinc/14/51/06/514145106.db2.gz MGYOKLMKDYPRSY-UHFFFAOYSA-N 1 1 359.382 2.574 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1OC)CCC(F)(F)F ZINC000427209045 514150193 /nfs/dbraw/zinc/15/01/93/514150193.db2.gz LEKUEJGJWYHYDT-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000444246215 514166961 /nfs/dbraw/zinc/16/69/61/514166961.db2.gz YOIKVBYCHSLHQY-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000444246215 514166966 /nfs/dbraw/zinc/16/69/66/514166966.db2.gz YOIKVBYCHSLHQY-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000423620310 514186864 /nfs/dbraw/zinc/18/68/64/514186864.db2.gz WNFJKNNHOJSMIR-SFHVURJKSA-N 1 1 354.410 2.900 20 5 FFBDMO Cc1cccc(NCCNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])[nH+]1 ZINC000427396629 514203614 /nfs/dbraw/zinc/20/36/14/514203614.db2.gz DPKVSNUMTPTEKC-UHFFFAOYSA-N 1 1 355.398 2.714 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000444616214 514274358 /nfs/dbraw/zinc/27/43/58/514274358.db2.gz CDVDPERGTFXJLC-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438022927 514289949 /nfs/dbraw/zinc/28/99/49/514289949.db2.gz ZCODOCYHLWJOGL-FUHWJXTLSA-N 1 1 358.442 2.896 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714801 514300789 /nfs/dbraw/zinc/30/07/89/514300789.db2.gz FFOGYDJAUAXLSD-FZMZJTMJSA-N 1 1 357.332 2.974 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714801 514300796 /nfs/dbraw/zinc/30/07/96/514300796.db2.gz FFOGYDJAUAXLSD-FZMZJTMJSA-N 1 1 357.332 2.974 20 5 FFBDMO C[C@@H](CCCC[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000427940825 514350102 /nfs/dbraw/zinc/35/01/02/514350102.db2.gz MPQZWLJAEAZYIR-QMMMGPOBSA-N 1 1 370.258 2.697 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@H+]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000449783458 514352241 /nfs/dbraw/zinc/35/22/41/514352241.db2.gz PFRHCXROBSNEFI-QGZVFWFLSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000420944446 514392909 /nfs/dbraw/zinc/39/29/09/514392909.db2.gz QVAOGTRLRVIJRA-MNOVXSKESA-N 1 1 360.357 2.655 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000433144827 514398418 /nfs/dbraw/zinc/39/84/18/514398418.db2.gz DLQHQMJSACDSTE-MRXNPFEDSA-N 1 1 363.414 2.510 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2C[C@@]2(F)c2ccccc2)cc1[N+](=O)[O-] ZINC000424187284 514409839 /nfs/dbraw/zinc/40/98/39/514409839.db2.gz AQJGNEYCJVOVQA-PKOBYXMFSA-N 1 1 374.368 2.874 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433195932 514416589 /nfs/dbraw/zinc/41/65/89/514416589.db2.gz ZRGRLHFPFYSANA-AWEZNQCLSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433195932 514416591 /nfs/dbraw/zinc/41/65/91/514416591.db2.gz ZRGRLHFPFYSANA-AWEZNQCLSA-N 1 1 367.471 2.686 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445135658 514424138 /nfs/dbraw/zinc/42/41/38/514424138.db2.gz LRWOPIYREKXXLG-ZDUSSCGKSA-N 1 1 374.445 2.535 20 5 FFBDMO C[NH+](C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1ccc(F)cc1 ZINC000439108737 514494828 /nfs/dbraw/zinc/49/48/28/514494828.db2.gz UDQKIAKZQJCGRE-INIZCTEOSA-N 1 1 371.372 2.519 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000475108203 514560369 /nfs/dbraw/zinc/56/03/69/514560369.db2.gz MQYYKZQZWSXCAK-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000475108203 514560374 /nfs/dbraw/zinc/56/03/74/514560374.db2.gz MQYYKZQZWSXCAK-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000470693023 514576795 /nfs/dbraw/zinc/57/67/95/514576795.db2.gz JOPHYEAOMPPZPI-INIZCTEOSA-N 1 1 360.458 2.798 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cncn3Cc3ccccc3)CC2)n1 ZINC000489016416 514674156 /nfs/dbraw/zinc/67/41/56/514674156.db2.gz PHMVLRPPZFYBPS-UHFFFAOYSA-N 1 1 366.425 2.873 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000470957181 514692764 /nfs/dbraw/zinc/69/27/64/514692764.db2.gz FWSWAIOVBZXLOU-HNNXBMFYSA-N 1 1 371.441 2.809 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCCC[C@H]1C ZINC000479858257 514746580 /nfs/dbraw/zinc/74/65/80/514746580.db2.gz AUXVGQIPCCVPKS-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CNC(=O)C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000489221012 514757852 /nfs/dbraw/zinc/75/78/52/514757852.db2.gz CZFVSDNGVRMPPE-OAHLLOKOSA-N 1 1 363.458 2.978 20 5 FFBDMO Cc1cccc(C[N@@H+](C)CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)n1 ZINC000471192505 514790876 /nfs/dbraw/zinc/79/08/76/514790876.db2.gz WCWSBUXSGCARLU-UHFFFAOYSA-N 1 1 356.382 2.728 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000489360380 514816012 /nfs/dbraw/zinc/81/60/12/514816012.db2.gz YHMBILSPDVLMHA-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)CCc1ccc(Br)cc1 ZINC000475873958 514839111 /nfs/dbraw/zinc/83/91/11/514839111.db2.gz NBGXWPSPDAOSTB-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)CCc1ccc(Br)cc1 ZINC000475873958 514839107 /nfs/dbraw/zinc/83/91/07/514839107.db2.gz NBGXWPSPDAOSTB-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1Br ZINC000467069470 514886994 /nfs/dbraw/zinc/88/69/94/514886994.db2.gz RFJNPOOPZKHZND-UHFFFAOYSA-N 1 1 367.203 2.999 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])nn2C)cc1 ZINC000476071771 514907451 /nfs/dbraw/zinc/90/74/51/514907451.db2.gz IOFYNRVCFHMNOK-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO COCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H]1CC=CCC1 ZINC000485119525 514922778 /nfs/dbraw/zinc/92/27/78/514922778.db2.gz GIIJNTMMQJJREA-INIZCTEOSA-N 1 1 361.442 2.862 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnnn1CC1CC1 ZINC000471597768 514948413 /nfs/dbraw/zinc/94/84/13/514948413.db2.gz HCPYTWSRCAVIJY-ZDUSSCGKSA-N 1 1 362.459 2.652 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000498553580 514963872 /nfs/dbraw/zinc/96/38/72/514963872.db2.gz GLRMFRUHADSWCK-STQMWFEESA-N 1 1 369.849 2.958 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000467550645 515046259 /nfs/dbraw/zinc/04/62/59/515046259.db2.gz MCTQQWJCVGCQES-GOSISDBHSA-N 1 1 350.415 2.695 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC[N@H+]1C ZINC000462480372 515075208 /nfs/dbraw/zinc/07/52/08/515075208.db2.gz LUIANQHGYDWVFD-GDBMZVCRSA-N 1 1 356.426 2.885 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000467709060 515088811 /nfs/dbraw/zinc/08/88/11/515088811.db2.gz PCGGWMPECNXEMH-SUNKGSAMSA-N 1 1 367.833 2.614 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000476570282 515108779 /nfs/dbraw/zinc/10/87/79/515108779.db2.gz UKSUVSMCYFDUSD-LLVKDONJSA-N 1 1 368.397 2.622 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000509467393 515191722 /nfs/dbraw/zinc/19/17/22/515191722.db2.gz XAHDSFGYPUHULR-JVPBZIDWSA-N 1 1 369.421 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000509467393 515191731 /nfs/dbraw/zinc/19/17/31/515191731.db2.gz XAHDSFGYPUHULR-JVPBZIDWSA-N 1 1 369.421 2.896 20 5 FFBDMO CCCCOCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000481177575 515236821 /nfs/dbraw/zinc/23/68/21/515236821.db2.gz NRWPSWAXIZRVLY-UHFFFAOYSA-N 1 1 361.446 2.800 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000490667311 515276821 /nfs/dbraw/zinc/27/68/21/515276821.db2.gz DBFMUDMEJLZXAD-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000490667311 515276828 /nfs/dbraw/zinc/27/68/28/515276828.db2.gz DBFMUDMEJLZXAD-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CNc1c(C(=O)NC2CCN(c3ccc(C)c[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000462986735 515322300 /nfs/dbraw/zinc/32/23/00/515322300.db2.gz BSTZSRSOUGXKRF-UHFFFAOYSA-N 1 1 369.425 2.739 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490845 515347234 /nfs/dbraw/zinc/34/72/34/515347234.db2.gz HAYHZHZHALWEST-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490845 515347241 /nfs/dbraw/zinc/34/72/41/515347241.db2.gz HAYHZHZHALWEST-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000486145183 515351882 /nfs/dbraw/zinc/35/18/82/515351882.db2.gz NLRKKIXMDGLIFX-JGVFFNPUSA-N 1 1 362.249 2.631 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000486145183 515351889 /nfs/dbraw/zinc/35/18/89/515351889.db2.gz NLRKKIXMDGLIFX-JGVFFNPUSA-N 1 1 362.249 2.631 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000504771685 515371181 /nfs/dbraw/zinc/37/11/81/515371181.db2.gz XCSIEVLRDZIGHS-UHFFFAOYSA-N 1 1 363.337 2.613 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000510102083 515433805 /nfs/dbraw/zinc/43/38/05/515433805.db2.gz FNULPXKPGYDMRN-HNNXBMFYSA-N 1 1 371.397 2.843 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000510102083 515433816 /nfs/dbraw/zinc/43/38/16/515433816.db2.gz FNULPXKPGYDMRN-HNNXBMFYSA-N 1 1 371.397 2.843 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481714297 515435991 /nfs/dbraw/zinc/43/59/91/515435991.db2.gz NQZGTSPIJBFFKK-SJORKVTESA-N 1 1 369.421 2.821 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000477490131 515475491 /nfs/dbraw/zinc/47/54/91/515475491.db2.gz FKZBOYGMKVIJDI-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO C[C@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510231773 515475650 /nfs/dbraw/zinc/47/56/50/515475650.db2.gz ZIGDTZGKQLKOPV-GOEBONIOSA-N 1 1 356.426 2.953 20 5 FFBDMO C[C@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510259444 515486710 /nfs/dbraw/zinc/48/67/10/515486710.db2.gz QAZRFSQXWSLLOY-HOCLYGCPSA-N 1 1 356.426 2.953 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2Cc3ccc(O)cc3C3(CC3)C2)c1 ZINC000463427815 515492577 /nfs/dbraw/zinc/49/25/77/515492577.db2.gz WVJQQEFCRKIFET-KRWDZBQOSA-N 1 1 370.405 2.588 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000486478899 515500063 /nfs/dbraw/zinc/50/00/63/515500063.db2.gz BHXCSXPYLFBZKJ-OAHLLOKOSA-N 1 1 354.838 2.730 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486632038 515570696 /nfs/dbraw/zinc/57/06/96/515570696.db2.gz DESKSQXJJDOOPS-LBPRGKRZSA-N 1 1 355.385 2.510 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000500109342 515593802 /nfs/dbraw/zinc/59/38/02/515593802.db2.gz BOAADLOSVQQJQH-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO CCOc1cc(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000500122872 515601789 /nfs/dbraw/zinc/60/17/89/515601789.db2.gz QAYBRNPHBFVTLU-STQMWFEESA-N 1 1 365.430 2.557 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000494036220 515716276 /nfs/dbraw/zinc/71/62/76/515716276.db2.gz DEZNCQOWQQNQJD-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO CC(C)N(CC(F)(F)F)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511087730 515772864 /nfs/dbraw/zinc/77/28/64/515772864.db2.gz AQOUOKGHTIHHJD-UHFFFAOYSA-N 1 1 361.364 2.868 20 5 FFBDMO CC(C)N(CC(F)(F)F)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511087730 515772874 /nfs/dbraw/zinc/77/28/74/515772874.db2.gz AQOUOKGHTIHHJD-UHFFFAOYSA-N 1 1 361.364 2.868 20 5 FFBDMO CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494471204 515854978 /nfs/dbraw/zinc/85/49/78/515854978.db2.gz MBQKFCWDUGCIPC-SECBINFHSA-N 1 1 354.350 2.526 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000511368534 515879920 /nfs/dbraw/zinc/87/99/20/515879920.db2.gz FKXGSKGPWJMMND-ZDUSSCGKSA-N 1 1 369.425 2.622 20 5 FFBDMO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000474152233 515908176 /nfs/dbraw/zinc/90/81/76/515908176.db2.gz TZWLQGASRSYUCW-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501080023 515970994 /nfs/dbraw/zinc/97/09/94/515970994.db2.gz BPFWFSSPSJYFCE-LLVKDONJSA-N 1 1 357.208 2.573 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCCOC2)O1 ZINC000483360691 516049704 /nfs/dbraw/zinc/04/97/04/516049704.db2.gz WTPOTTUIZOECDC-GOSISDBHSA-N 1 1 350.415 2.634 20 5 FFBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000469996612 516067424 /nfs/dbraw/zinc/06/74/24/516067424.db2.gz PBASSNOBLMKARE-OCCSQVGLSA-N 1 1 362.348 2.997 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000507103095 516090510 /nfs/dbraw/zinc/09/05/10/516090510.db2.gz MOQZUBJYWCADLB-UHFFFAOYSA-N 1 1 356.426 2.704 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)CC[N@@H+](C)C1CC1 ZINC000474568727 516097780 /nfs/dbraw/zinc/09/77/80/516097780.db2.gz RWKQYDSCIWUHLV-NSHDSACASA-N 1 1 355.822 2.568 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000470170584 516161246 /nfs/dbraw/zinc/16/12/46/516161246.db2.gz XLDKBAZJJWKQKN-XSVZSIDJSA-N 1 1 373.453 2.569 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CCc2sccc2C1 ZINC000465748409 516246675 /nfs/dbraw/zinc/24/66/75/516246675.db2.gz GGOXKNZREAMVLE-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NCC[N@H+]1CCc2sccc2C1 ZINC000465748409 516246682 /nfs/dbraw/zinc/24/66/82/516246682.db2.gz GGOXKNZREAMVLE-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000488715900 516293101 /nfs/dbraw/zinc/29/31/01/516293101.db2.gz BRBPHCLHAMHVMF-ZENOOKHLSA-N 1 1 357.414 2.811 20 5 FFBDMO C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CCC2)C1 ZINC000488760726 516302368 /nfs/dbraw/zinc/30/23/68/516302368.db2.gz FGXOLRRXJCPCPH-ZDUSSCGKSA-N 1 1 357.414 2.955 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000497401300 516320066 /nfs/dbraw/zinc/32/00/66/516320066.db2.gz ZBLNGMAUZWOIOI-PKOBYXMFSA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000497427996 516322069 /nfs/dbraw/zinc/32/20/69/516322069.db2.gz HRUCCMQVDSJMKU-MSOLQXFVSA-N 1 1 371.462 2.901 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@@H]1C ZINC000497558324 516326366 /nfs/dbraw/zinc/32/63/66/516326366.db2.gz NZNYULTUHCWNQF-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO COc1ccc(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000517738097 516433162 /nfs/dbraw/zinc/43/31/62/516433162.db2.gz WGEZANITQNMRIB-UONOGXRCSA-N 1 1 364.446 2.523 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000558027892 516560002 /nfs/dbraw/zinc/56/00/02/516560002.db2.gz XFFMFBWSWPJWAP-QMTMVMCOSA-N 1 1 370.453 2.738 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1cccc2nsnc21)c1ccccc1[N+](=O)[O-] ZINC000540480107 516575725 /nfs/dbraw/zinc/57/57/25/516575725.db2.gz GNLFROQAUINNSM-JTQLQIEISA-N 1 1 357.395 2.889 20 5 FFBDMO COc1cc2[nH+]c(N(C)Cc3ccccc3[N+](=O)[O-])nc(N)c2cc1OC ZINC000518352121 516623337 /nfs/dbraw/zinc/62/33/37/516623337.db2.gz UUIOHWYDFFOYFS-UHFFFAOYSA-N 1 1 369.381 2.604 20 5 FFBDMO O=C(CC[N@H+]1CCC2(C1)Oc1ccccc1O2)Nc1ccc([N+](=O)[O-])cc1 ZINC000558182779 516633419 /nfs/dbraw/zinc/63/34/19/516633419.db2.gz QALYQHYTXVMXHE-UHFFFAOYSA-N 1 1 369.377 2.797 20 5 FFBDMO COC[C@H](C)[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000554934341 516705836 /nfs/dbraw/zinc/70/58/36/516705836.db2.gz IYWOOXYGUISWJN-VIFPVBQESA-N 1 1 364.183 2.666 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561746993 516745394 /nfs/dbraw/zinc/74/53/94/516745394.db2.gz QTPOWGAQKYPWDL-FCEWJHQRSA-N 1 1 374.485 2.976 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(CC)CC ZINC000536426727 516759196 /nfs/dbraw/zinc/75/91/96/516759196.db2.gz OYUBRDZAQUSDQY-CVEARBPZSA-N 1 1 351.447 2.672 20 5 FFBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])cn3C)cc2)C1 ZINC000524770151 516823984 /nfs/dbraw/zinc/82/39/84/516823984.db2.gz GACYYJSNTGBBSH-AWEZNQCLSA-N 1 1 372.425 2.906 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccco1 ZINC000514139754 516876978 /nfs/dbraw/zinc/87/69/78/516876978.db2.gz FYXQOVWSLONIEH-GFCCVEGCSA-N 1 1 369.324 2.822 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000536659631 516879344 /nfs/dbraw/zinc/87/93/44/516879344.db2.gz DFHPIUKEVFIEIK-IBGZPJMESA-N 1 1 355.394 2.957 20 5 FFBDMO CC[NH+](CC)CCOC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000555377744 516906213 /nfs/dbraw/zinc/90/62/13/516906213.db2.gz UMKKKZACELEODY-UHFFFAOYSA-N 1 1 351.447 2.623 20 5 FFBDMO C[N@H+](CCc1ccccc1O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000541391634 517026913 /nfs/dbraw/zinc/02/69/13/517026913.db2.gz VOQPVSOGBJKWLO-KRWDZBQOSA-N 1 1 355.394 2.580 20 5 FFBDMO C[N@@H+](CCc1ccccc1O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000541391634 517026920 /nfs/dbraw/zinc/02/69/20/517026920.db2.gz VOQPVSOGBJKWLO-KRWDZBQOSA-N 1 1 355.394 2.580 20 5 FFBDMO COC(=O)c1ccccc1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000537126364 517047470 /nfs/dbraw/zinc/04/74/70/517047470.db2.gz NXNBOFZNEPDOPN-GFCCVEGCSA-N 1 1 357.366 2.671 20 5 FFBDMO Cc1cnccc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000552063180 517057103 /nfs/dbraw/zinc/05/71/03/517057103.db2.gz RLHVHUPCVDTZQD-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000545174168 517086797 /nfs/dbraw/zinc/08/67/97/517086797.db2.gz OTDJRGYLQYQNPV-CYBMUJFWSA-N 1 1 367.833 2.784 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000537238647 517102945 /nfs/dbraw/zinc/10/29/45/517102945.db2.gz YJJNUMXYEUEEIX-UHFFFAOYSA-N 1 1 373.331 2.528 20 5 FFBDMO Cc1c(Br)c(NCC[N@H+]2CCCC[C@H]2C)ncc1[N+](=O)[O-] ZINC000541576235 517122058 /nfs/dbraw/zinc/12/20/58/517122058.db2.gz CXDLECDYTRZAGR-SNVBAGLBSA-N 1 1 357.252 2.769 20 5 FFBDMO Cc1c(Br)c(NCC[N@@H+]2CCCC[C@H]2C)ncc1[N+](=O)[O-] ZINC000541576235 517122065 /nfs/dbraw/zinc/12/20/65/517122065.db2.gz CXDLECDYTRZAGR-SNVBAGLBSA-N 1 1 357.252 2.769 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH+]([C@@H](C)CC(C)C)CC1 ZINC000552240710 517158916 /nfs/dbraw/zinc/15/89/16/517158916.db2.gz JESZCEUJVYCFLT-HNNXBMFYSA-N 1 1 369.487 2.644 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000555880038 517163812 /nfs/dbraw/zinc/16/38/12/517163812.db2.gz IEWPLZPDWLHSIM-HNNXBMFYSA-N 1 1 371.441 2.783 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000541820585 517232128 /nfs/dbraw/zinc/23/21/28/517232128.db2.gz FWCXNYQXPYIPLK-CQSZACIVSA-N 1 1 369.487 2.754 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000533045276 517268104 /nfs/dbraw/zinc/26/81/04/517268104.db2.gz VATUFGODFSETGS-LPHOPBHVSA-N 1 1 366.421 2.887 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000533045276 517268113 /nfs/dbraw/zinc/26/81/13/517268113.db2.gz VATUFGODFSETGS-LPHOPBHVSA-N 1 1 366.421 2.887 20 5 FFBDMO COc1ccc2c(c1)C[C@@H](C)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]2C ZINC000541988927 517325879 /nfs/dbraw/zinc/32/58/79/517325879.db2.gz CSZAUZCPFQDNST-KGLIPLIRSA-N 1 1 357.410 2.773 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)CC1(C)C ZINC000559620925 517347329 /nfs/dbraw/zinc/34/73/29/517347329.db2.gz UNWLRZNEWVXKHV-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)CC1(C)C ZINC000559620925 517347335 /nfs/dbraw/zinc/34/73/35/517347335.db2.gz UNWLRZNEWVXKHV-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000520441906 517394852 /nfs/dbraw/zinc/39/48/52/517394852.db2.gz BYUVFUPLCGZVRE-GUYCJALGSA-N 1 1 354.410 2.626 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2CNc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1 ZINC000515551775 517403528 /nfs/dbraw/zinc/40/35/28/517403528.db2.gz RLKLMHDATXSVMD-OKILXGFUSA-N 1 1 359.430 2.550 20 5 FFBDMO COC(=O)CCC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000533344962 517415297 /nfs/dbraw/zinc/41/52/97/517415297.db2.gz CGFINBOQGWJRLA-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO Cc1ccccc1CCNC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549174320 517438162 /nfs/dbraw/zinc/43/81/62/517438162.db2.gz WWMFPHGURPEYBJ-UHFFFAOYSA-N 1 1 355.438 2.736 20 5 FFBDMO Cc1ccccc1CCNC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549174320 517438166 /nfs/dbraw/zinc/43/81/66/517438166.db2.gz WWMFPHGURPEYBJ-UHFFFAOYSA-N 1 1 355.438 2.736 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccc(O)cc2C1 ZINC000533393862 517440601 /nfs/dbraw/zinc/44/06/01/517440601.db2.gz WZYPDPIBTNZSMT-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000533409433 517450956 /nfs/dbraw/zinc/45/09/56/517450956.db2.gz WTHRVMLOPLGPTL-HNNXBMFYSA-N 1 1 362.474 2.974 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C[C@H](C)OC)C(C)C)c([N+](=O)[O-])c1 ZINC000533429484 517458991 /nfs/dbraw/zinc/45/89/91/517458991.db2.gz CAQIRLYOFSYEBJ-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000546266955 517623399 /nfs/dbraw/zinc/62/33/99/517623399.db2.gz QBXSYDMPJNELAX-AWEZNQCLSA-N 1 1 370.409 2.891 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000553330560 517650008 /nfs/dbraw/zinc/65/00/08/517650008.db2.gz FUUSGYKIPGMLOQ-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000553330560 517650017 /nfs/dbraw/zinc/65/00/17/517650017.db2.gz FUUSGYKIPGMLOQ-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000560336514 517710179 /nfs/dbraw/zinc/71/01/79/517710179.db2.gz NZKGOHLRWPNWCD-HNNXBMFYSA-N 1 1 362.474 2.974 20 5 FFBDMO CC(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CCSCC1 ZINC000549851636 517745656 /nfs/dbraw/zinc/74/56/56/517745656.db2.gz BUYZLZAKKMACHO-UHFFFAOYSA-N 1 1 351.472 2.737 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000556933745 517757580 /nfs/dbraw/zinc/75/75/80/517757580.db2.gz LNIJUDFMTNAMAE-UHFFFAOYSA-N 1 1 356.426 2.513 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCC[N@H+]1CC=CCC1 ZINC000538820076 517793053 /nfs/dbraw/zinc/79/30/53/517793053.db2.gz QBHPPQDZCYBHEB-UHFFFAOYSA-N 1 1 355.847 2.718 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1 ZINC000538820076 517793068 /nfs/dbraw/zinc/79/30/68/517793068.db2.gz QBHPPQDZCYBHEB-UHFFFAOYSA-N 1 1 355.847 2.718 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920913 517846231 /nfs/dbraw/zinc/84/62/31/517846231.db2.gz ZPBUZUKKNPTTHY-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920913 517846238 /nfs/dbraw/zinc/84/62/38/517846238.db2.gz ZPBUZUKKNPTTHY-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1 ZINC000563391970 517875888 /nfs/dbraw/zinc/87/58/88/517875888.db2.gz CVXXPFJLJQOEFB-UHFFFAOYSA-N 1 1 361.442 2.698 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534694967 518004288 /nfs/dbraw/zinc/00/42/88/518004288.db2.gz GPUJKPKGLKETIO-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534694967 518004296 /nfs/dbraw/zinc/00/42/96/518004296.db2.gz GPUJKPKGLKETIO-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO NC(=O)c1ccc(N2CC[NH+](C/C=C\c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000522167835 518012798 /nfs/dbraw/zinc/01/27/98/518012798.db2.gz QXBBZLBNINBDEN-DAXSKMNVSA-N 1 1 366.421 2.529 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000522200998 518030461 /nfs/dbraw/zinc/03/04/61/518030461.db2.gz BBJGUZMIHRNKMQ-STQMWFEESA-N 1 1 369.849 2.862 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000522200997 518030603 /nfs/dbraw/zinc/03/06/03/518030603.db2.gz BBJGUZMIHRNKMQ-QWHCGFSZSA-N 1 1 369.849 2.862 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)[nH+]c1 ZINC000531014181 518101843 /nfs/dbraw/zinc/10/18/43/518101843.db2.gz FGAHYRLBCKXMBD-UHFFFAOYSA-N 1 1 354.366 2.698 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000531062785 518122840 /nfs/dbraw/zinc/12/28/40/518122840.db2.gz IBDLHLXCWCBLCY-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035615 518130827 /nfs/dbraw/zinc/13/08/27/518130827.db2.gz BSUGGUWVLXMAMD-GJZGRUSLSA-N 1 1 354.410 2.725 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035615 518130833 /nfs/dbraw/zinc/13/08/33/518130833.db2.gz BSUGGUWVLXMAMD-GJZGRUSLSA-N 1 1 354.410 2.725 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)ccc1OC(F)F ZINC000531142989 518152359 /nfs/dbraw/zinc/15/23/59/518152359.db2.gz TUMYEEZVTZMXEA-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO C[NH+](C)CCOc1cnccc1CNC/C=C/c1ccccc1[N+](=O)[O-] ZINC000584195034 518223198 /nfs/dbraw/zinc/22/31/98/518223198.db2.gz KDFZBJVFLUSXHV-FNORWQNLSA-N 1 1 356.426 2.733 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000566836451 518223781 /nfs/dbraw/zinc/22/37/81/518223781.db2.gz KBDIYFSTHWUJIU-KRWDZBQOSA-N 1 1 360.458 2.783 20 5 FFBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)C[C@H]21 ZINC000584710854 518441311 /nfs/dbraw/zinc/44/13/11/518441311.db2.gz KKIRLDYOSJRPIG-SJORKVTESA-N 1 1 354.410 2.566 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[C@@]4(C3)CCC[NH2+]C4)o2)c1 ZINC000579013503 518480930 /nfs/dbraw/zinc/48/09/30/518480930.db2.gz CQUZTDRSKRPVNX-IBGZPJMESA-N 1 1 356.426 2.868 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000570267152 518524715 /nfs/dbraw/zinc/52/47/15/518524715.db2.gz IUOKIMWHBGJRGY-OAHLLOKOSA-N 1 1 374.441 2.969 20 5 FFBDMO CO[C@H](C)c1nc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000564849580 518652461 /nfs/dbraw/zinc/65/24/61/518652461.db2.gz MIARISUAIOPKRC-LLVKDONJSA-N 1 1 364.427 2.877 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000586837134 518658485 /nfs/dbraw/zinc/65/84/85/518658485.db2.gz BTLUQHXRQAIUOD-UHFFFAOYSA-N 1 1 374.441 2.605 20 5 FFBDMO CN(C)c1noc([C@@H]2CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000588600588 518788633 /nfs/dbraw/zinc/78/86/33/518788633.db2.gz GDOHAWULFYCOEM-GTBONMDNSA-N 1 1 357.414 2.937 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000565170687 518822472 /nfs/dbraw/zinc/82/24/72/518822472.db2.gz JVJIBIOBXRRFHR-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO C[C@]1(NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000568011307 518830714 /nfs/dbraw/zinc/83/07/14/518830714.db2.gz JCOQRJPOQFOKEA-FQEVSTJZSA-N 1 1 369.421 2.754 20 5 FFBDMO CCc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000565559193 519017503 /nfs/dbraw/zinc/01/75/03/519017503.db2.gz SIQYREIKYIIJPJ-AWEZNQCLSA-N 1 1 367.453 2.932 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1 ZINC000589503488 519020121 /nfs/dbraw/zinc/02/01/21/519020121.db2.gz SGSKTFKGCKHWGV-ZDUSSCGKSA-N 1 1 364.398 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c1 ZINC000589503488 519020125 /nfs/dbraw/zinc/02/01/25/519020125.db2.gz SGSKTFKGCKHWGV-ZDUSSCGKSA-N 1 1 364.398 2.545 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000568544904 519093515 /nfs/dbraw/zinc/09/35/15/519093515.db2.gz WZFYWVPAXQFILR-CQSZACIVSA-N 1 1 372.347 2.976 20 5 FFBDMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000589859450 519095190 /nfs/dbraw/zinc/09/51/90/519095190.db2.gz HTSSCNUKXBBCAZ-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H](C)C1 ZINC000590174896 519167228 /nfs/dbraw/zinc/16/72/28/519167228.db2.gz DFXCIZNUWNMRSN-NEPJUHHUSA-N 1 1 361.364 2.501 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000566031626 519255025 /nfs/dbraw/zinc/25/50/25/519255025.db2.gz WJFPDIVPPZDQIA-UHFFFAOYSA-N 1 1 370.413 2.513 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601952 519284958 /nfs/dbraw/zinc/28/49/58/519284958.db2.gz UEMUGRPZNDPGHU-KXBFYZLASA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601952 519284965 /nfs/dbraw/zinc/28/49/65/519284965.db2.gz UEMUGRPZNDPGHU-KXBFYZLASA-N 1 1 366.421 2.975 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000577898265 519313835 /nfs/dbraw/zinc/31/38/35/519313835.db2.gz DEPPOSCJRJMPBR-MSOLQXFVSA-N 1 1 374.441 2.593 20 5 FFBDMO COC(=O)[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000590752235 519350037 /nfs/dbraw/zinc/35/00/37/519350037.db2.gz ICBQFDHITBZUIQ-HONMWMINSA-N 1 1 360.370 2.637 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000574852947 519364155 /nfs/dbraw/zinc/36/41/55/519364155.db2.gz NFVFNFAOSSZTCP-ZDUSSCGKSA-N 1 1 352.435 2.523 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000578290068 519513483 /nfs/dbraw/zinc/51/34/83/519513483.db2.gz PUPSMTLGWCOOPX-OAHLLOKOSA-N 1 1 350.463 2.899 20 5 FFBDMO COc1ccc(C[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H](C)CCCO)cc1 ZINC000602966940 519997037 /nfs/dbraw/zinc/99/70/37/519997037.db2.gz WSQJTAJVEIWVNI-CQSZACIVSA-N 1 1 362.430 2.500 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H](C)CCCO)cc1 ZINC000602966940 519997043 /nfs/dbraw/zinc/99/70/43/519997043.db2.gz WSQJTAJVEIWVNI-CQSZACIVSA-N 1 1 362.430 2.500 20 5 FFBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600007633 519999722 /nfs/dbraw/zinc/99/97/22/519999722.db2.gz WNHAGIXWBHGTCR-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997777 520012979 /nfs/dbraw/zinc/01/29/79/520012979.db2.gz QMTMYCXSDGZUHM-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997777 520012990 /nfs/dbraw/zinc/01/29/90/520012990.db2.gz QMTMYCXSDGZUHM-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[N@H+]4C[C@H](O)C[C@H]4C3)s2)cc1 ZINC000594614461 520056156 /nfs/dbraw/zinc/05/61/56/520056156.db2.gz WRGJIQLSZINCFF-JKSUJKDBSA-N 1 1 359.451 2.574 20 5 FFBDMO CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000603112310 520085265 /nfs/dbraw/zinc/08/52/65/520085265.db2.gz VVKPVXXKUTXMHT-DLBZAZTESA-N 1 1 373.409 2.570 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608784751 520128423 /nfs/dbraw/zinc/12/84/23/520128423.db2.gz QVPAZKXCVSYDOE-AWEZNQCLSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608784751 520128425 /nfs/dbraw/zinc/12/84/25/520128425.db2.gz QVPAZKXCVSYDOE-AWEZNQCLSA-N 1 1 360.370 2.562 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000600311845 520198312 /nfs/dbraw/zinc/19/83/12/520198312.db2.gz CLNSSABWPGQLCR-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)cc1SC ZINC000609129269 520200267 /nfs/dbraw/zinc/20/02/67/520200267.db2.gz NIPQXMMHESOHIA-GFCCVEGCSA-N 1 1 367.471 2.785 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc(O)cc2CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000609133377 520200915 /nfs/dbraw/zinc/20/09/15/520200915.db2.gz UHRPKPHOOURBJW-UHFFFAOYSA-N 1 1 355.394 2.730 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000609133340 520201892 /nfs/dbraw/zinc/20/18/92/520201892.db2.gz OBGYFMNTPBJTNO-UHFFFAOYSA-N 1 1 355.394 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000609133340 520201893 /nfs/dbraw/zinc/20/18/93/520201893.db2.gz OBGYFMNTPBJTNO-UHFFFAOYSA-N 1 1 355.394 2.648 20 5 FFBDMO C[C@@H](C[NH+]1CCCCC1)NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000594914041 520215435 /nfs/dbraw/zinc/21/54/35/520215435.db2.gz BRDULOMZQRRHRO-HNNXBMFYSA-N 1 1 357.458 2.959 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000609234155 520239787 /nfs/dbraw/zinc/23/97/87/520239787.db2.gz SZXPDEWFIAXIKX-SFHVURJKSA-N 1 1 355.394 2.657 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(N2CCOCC2)n1 ZINC000595031931 520264312 /nfs/dbraw/zinc/26/43/12/520264312.db2.gz FDZITLGCSCEIKV-CQSZACIVSA-N 1 1 372.425 2.686 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597944071 520342869 /nfs/dbraw/zinc/34/28/69/520342869.db2.gz BXIXLWMPDLXIKQ-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO CCN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597945545 520344573 /nfs/dbraw/zinc/34/45/73/520344573.db2.gz HYFJKDQNYHKUFI-LBPRGKRZSA-N 1 1 370.247 2.832 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000603756467 520355228 /nfs/dbraw/zinc/35/52/28/520355228.db2.gz QQEHUXYIZRTSEZ-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000609674923 520402616 /nfs/dbraw/zinc/40/26/16/520402616.db2.gz XNXKJMVRBOHLRV-OAHLLOKOSA-N 1 1 369.487 2.836 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](c2ccsc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000609673957 520403252 /nfs/dbraw/zinc/40/32/52/520403252.db2.gz SFCMRNMFSHLRNA-OAHLLOKOSA-N 1 1 369.468 2.546 20 5 FFBDMO CC(=O)N1CCCCC[C@@H]1C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595316076 520403509 /nfs/dbraw/zinc/40/35/09/520403509.db2.gz YTQMIUCVFBFOIM-MRXNPFEDSA-N 1 1 364.446 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000592479450 520407324 /nfs/dbraw/zinc/40/73/24/520407324.db2.gz ZQFOKSJASCDSOH-RDJZCZTQSA-N 1 1 360.458 2.696 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)n2)c1 ZINC000592492565 520417192 /nfs/dbraw/zinc/41/71/92/520417192.db2.gz AOLFLJXJFGSSBK-HZPDHXFCSA-N 1 1 371.441 2.856 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000609767259 520425502 /nfs/dbraw/zinc/42/55/02/520425502.db2.gz OQAHDGFANMPEEX-CYBMUJFWSA-N 1 1 357.366 2.975 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000592525608 520439339 /nfs/dbraw/zinc/43/93/39/520439339.db2.gz AUBDQKHSCBLPBM-RCLKMUNOSA-N 1 1 371.359 2.999 20 5 FFBDMO COc1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000604105512 520452106 /nfs/dbraw/zinc/45/21/06/520452106.db2.gz RHBDSDJCXQHXFK-CQSZACIVSA-N 1 1 364.446 2.667 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000598196122 520487383 /nfs/dbraw/zinc/48/73/83/520487383.db2.gz ZUADRTRGMPBYCZ-QGZVFWFLSA-N 1 1 368.437 2.687 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1F ZINC000598218079 520498943 /nfs/dbraw/zinc/49/89/43/520498943.db2.gz FDIGBFSKJPNXAJ-LBPRGKRZSA-N 1 1 365.405 2.879 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218875 520501008 /nfs/dbraw/zinc/50/10/08/520501008.db2.gz IIXIFWQNIPYJFP-OAHLLOKOSA-N 1 1 360.458 2.920 20 5 FFBDMO Cc1c(CNC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000595587318 520572361 /nfs/dbraw/zinc/57/23/61/520572361.db2.gz GKTQNYIEAZMJHO-GOSISDBHSA-N 1 1 368.437 2.977 20 5 FFBDMO CCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CC[N@@H+](C)C1 ZINC000592830325 520606867 /nfs/dbraw/zinc/60/68/67/520606867.db2.gz CVXXPZVDOBMGEI-KRWDZBQOSA-N 1 1 374.485 2.754 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000601068538 520621813 /nfs/dbraw/zinc/62/18/13/520621813.db2.gz GOYQBMOSNMHCKD-FQEVSTJZSA-N 1 1 370.405 2.813 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000598466759 520629344 /nfs/dbraw/zinc/62/93/44/520629344.db2.gz TZDDJZSUBGGPES-UHFFFAOYSA-N 1 1 360.414 2.699 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000598466964 520631269 /nfs/dbraw/zinc/63/12/69/520631269.db2.gz YELAFGKWXPDAIZ-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000592881950 520631591 /nfs/dbraw/zinc/63/15/91/520631591.db2.gz PJWQHYZINHASHR-CABCVRRESA-N 1 1 371.441 2.517 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000595706311 520664194 /nfs/dbraw/zinc/66/41/94/520664194.db2.gz YNJZJDVHZJIIQU-CQSZACIVSA-N 1 1 373.457 2.791 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595761038 520705328 /nfs/dbraw/zinc/70/53/28/520705328.db2.gz WDTMZBLQVKFLSJ-MEDUHNTESA-N 1 1 358.341 2.673 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@H](CC)CO1 ZINC000593059999 520715564 /nfs/dbraw/zinc/71/55/64/520715564.db2.gz VAWQTONCGXKLJK-ZIAGYGMSSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCN1CCOCC1)CC1CC1 ZINC000595808981 520739030 /nfs/dbraw/zinc/73/90/30/520739030.db2.gz QBJSOXUETWJDJL-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000598614586 520744318 /nfs/dbraw/zinc/74/43/18/520744318.db2.gz LTOAOYBEIWCOPI-XJKSGUPXSA-N 1 1 370.409 2.709 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000598620536 520748264 /nfs/dbraw/zinc/74/82/64/520748264.db2.gz YHWWAHNJYJVWJO-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595830352 520753269 /nfs/dbraw/zinc/75/32/69/520753269.db2.gz KRIVLCZAEMKGJG-JQWIXIFHSA-N 1 1 358.341 2.673 20 5 FFBDMO COc1ccc(OCC[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c([N+](=O)[O-])c1 ZINC000595908907 520813821 /nfs/dbraw/zinc/81/38/21/520813821.db2.gz JJIJIWUUSNXFPF-KDURUIRLSA-N 1 1 362.426 2.875 20 5 FFBDMO NC(=O)c1cc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000596065185 520889938 /nfs/dbraw/zinc/88/99/38/520889938.db2.gz FWYNTOFARVHQQQ-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000593320728 520907400 /nfs/dbraw/zinc/90/74/00/520907400.db2.gz FIHLTICZYFFFPB-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000593320728 520907406 /nfs/dbraw/zinc/90/74/06/520907406.db2.gz FIHLTICZYFFFPB-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COCC[N@@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596116946 520922225 /nfs/dbraw/zinc/92/22/25/520922225.db2.gz RVUZSPNHTHAHEK-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596116946 520922232 /nfs/dbraw/zinc/92/22/32/520922232.db2.gz RVUZSPNHTHAHEK-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO C[N@@H+](CCC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000601779308 520946961 /nfs/dbraw/zinc/94/69/61/520946961.db2.gz PHLNBCOHEFMWIU-LJQANCHMSA-N 1 1 363.458 2.573 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C[N@H+]1Cc1ccccc1 ZINC000596163475 520947650 /nfs/dbraw/zinc/94/76/50/520947650.db2.gz VMFJCWQTRWNBFJ-CZUORRHYSA-N 1 1 354.410 2.769 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598994719 520968265 /nfs/dbraw/zinc/96/82/65/520968265.db2.gz HSJMIJIPZNUGBX-QGZVFWFLSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596218887 520977745 /nfs/dbraw/zinc/97/77/45/520977745.db2.gz NGNUZEYLAQDVMC-SUMWQHHRSA-N 1 1 354.410 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000618288438 520983163 /nfs/dbraw/zinc/98/31/63/520983163.db2.gz PURCUXIFKJLTOG-ACJLOTCBSA-N 1 1 355.442 2.920 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000614517848 521005060 /nfs/dbraw/zinc/00/50/60/521005060.db2.gz BWTBAAPNIBTWLK-LZWOXQAQSA-N 1 1 371.441 2.616 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593463436 521009397 /nfs/dbraw/zinc/00/93/97/521009397.db2.gz VIIQRIMMHSRSFS-KRWDZBQOSA-N 1 1 369.469 2.749 20 5 FFBDMO CCc1nn(C)c(N2CC[C@@H]([N@@H+](C)CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596462834 521085843 /nfs/dbraw/zinc/08/58/43/521085843.db2.gz UVICJZPARVXYHO-MRXNPFEDSA-N 1 1 357.458 2.644 20 5 FFBDMO CN1CCN(C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000611408972 521139398 /nfs/dbraw/zinc/13/93/98/521139398.db2.gz JTTLBMGMJUTADF-NRFANRHFSA-N 1 1 368.481 2.716 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2CCCC[N@H+]2CCO)C(F)(F)F)cc1 ZINC000593712023 521169621 /nfs/dbraw/zinc/16/96/21/521169621.db2.gz GOTKWBYNNHLOMT-LSDHHAIUSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2CCCC[N@@H+]2CCO)C(F)(F)F)cc1 ZINC000593712023 521169631 /nfs/dbraw/zinc/16/96/31/521169631.db2.gz GOTKWBYNNHLOMT-LSDHHAIUSA-N 1 1 361.364 2.635 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)c1 ZINC000593721642 521175395 /nfs/dbraw/zinc/17/53/95/521175395.db2.gz WPHJHBPPGCPCQH-AWEZNQCLSA-N 1 1 373.457 2.607 20 5 FFBDMO COC(=O)c1ccc(-c2ccc(CC[NH+]3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000596636674 521182112 /nfs/dbraw/zinc/18/21/12/521182112.db2.gz QHKHLTPGMOJJQA-UHFFFAOYSA-N 1 1 370.405 2.923 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000593750924 521192126 /nfs/dbraw/zinc/19/21/26/521192126.db2.gz CXQHUCQLMFDHAR-AEFFLSMTSA-N 1 1 371.412 2.738 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O ZINC000611526049 521202950 /nfs/dbraw/zinc/20/29/50/521202950.db2.gz FLPSVEIIURSWLD-UKRRQHHQSA-N 1 1 350.415 2.595 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O ZINC000611526049 521202954 /nfs/dbraw/zinc/20/29/54/521202954.db2.gz FLPSVEIIURSWLD-UKRRQHHQSA-N 1 1 350.415 2.595 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000611543826 521212253 /nfs/dbraw/zinc/21/22/53/521212253.db2.gz KCXDUPVNHHGEIO-SWLSCSKDSA-N 1 1 367.471 2.546 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000611543826 521212256 /nfs/dbraw/zinc/21/22/56/521212256.db2.gz KCXDUPVNHHGEIO-SWLSCSKDSA-N 1 1 367.471 2.546 20 5 FFBDMO COCCC1CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000599507532 521265900 /nfs/dbraw/zinc/26/59/00/521265900.db2.gz YHQCTIDFHKEZCN-ZDUSSCGKSA-N 1 1 365.430 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCC[C@H]3[NH+]3CCOCC3)c2c1 ZINC000611711366 521292127 /nfs/dbraw/zinc/29/21/27/521292127.db2.gz LCTYZJQHXCKTJQ-DLBZAZTESA-N 1 1 357.414 2.593 20 5 FFBDMO CC1(C)[C@H](c2cccc(F)c2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599629784 521342568 /nfs/dbraw/zinc/34/25/68/521342568.db2.gz MHPFWEWUHGKZAV-SJORKVTESA-N 1 1 362.405 2.559 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])n1 ZINC000602481693 521371089 /nfs/dbraw/zinc/37/10/89/521371089.db2.gz CTQRBOLFCYRHCI-MJGOQNOKSA-N 1 1 369.469 2.815 20 5 FFBDMO COc1cc(C[N@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000594065507 521384636 /nfs/dbraw/zinc/38/46/36/521384636.db2.gz REZOSJGHUHETIN-JTQLQIEISA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000594065507 521384641 /nfs/dbraw/zinc/38/46/41/521384641.db2.gz REZOSJGHUHETIN-JTQLQIEISA-N 1 1 360.357 2.593 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594073191 521389725 /nfs/dbraw/zinc/38/97/25/521389725.db2.gz CKRPEIMVNZSKRM-MELADBBJSA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594073191 521389730 /nfs/dbraw/zinc/38/97/30/521389730.db2.gz CKRPEIMVNZSKRM-MELADBBJSA-N 1 1 364.446 2.831 20 5 FFBDMO COCCN1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602533403 521398823 /nfs/dbraw/zinc/39/88/23/521398823.db2.gz XVMIMBSAUIUZKA-UHFFFAOYSA-N 1 1 361.364 2.814 20 5 FFBDMO CC[C@H](C)NC(=O)[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602585278 521424960 /nfs/dbraw/zinc/42/49/60/521424960.db2.gz COIXJGVOZAZJEE-JGVFFNPUSA-N 1 1 364.265 2.812 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@H+]1C ZINC000607688858 521430353 /nfs/dbraw/zinc/43/03/53/521430353.db2.gz YRGSADQOVQSAEQ-JKSUJKDBSA-N 1 1 363.461 2.754 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000602639760 521451308 /nfs/dbraw/zinc/45/13/08/521451308.db2.gz ZNITZOCDFHVURL-UHFFFAOYSA-N 1 1 366.361 2.671 20 5 FFBDMO COC[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@@H]1CCCO1 ZINC000602642610 521452913 /nfs/dbraw/zinc/45/29/13/521452913.db2.gz DAHSZTWIEOFSLH-QWRGUYRKSA-N 1 1 365.249 2.702 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000594198701 521465115 /nfs/dbraw/zinc/46/51/15/521465115.db2.gz VCPGVBPGRAHVAS-HZPDHXFCSA-N 1 1 369.425 2.527 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597091984 521498272 /nfs/dbraw/zinc/49/82/72/521498272.db2.gz HULQDHKBQILLKA-WCQYABFASA-N 1 1 367.837 2.969 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597105078 521509501 /nfs/dbraw/zinc/50/95/01/521509501.db2.gz VYUWPAAJCQLOQU-SNVBAGLBSA-N 1 1 355.826 2.636 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CCC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000602780796 521529713 /nfs/dbraw/zinc/52/97/13/521529713.db2.gz SAGKIMRKFKBXAZ-INIZCTEOSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)C[C@@H](O)C(F)(F)F ZINC000602806005 521544052 /nfs/dbraw/zinc/54/40/52/521544052.db2.gz KPQPQKDQOYOVKD-CQSZACIVSA-N 1 1 372.347 2.525 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccccc1)C[C@@H](O)C(F)(F)F ZINC000602806005 521544057 /nfs/dbraw/zinc/54/40/57/521544057.db2.gz KPQPQKDQOYOVKD-CQSZACIVSA-N 1 1 372.347 2.525 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000602808860 521546103 /nfs/dbraw/zinc/54/61/03/521546103.db2.gz FGXGHVCYZDOGHH-IGOJGBNBSA-N 1 1 371.485 2.846 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](Cn4ccnn4)C3)cs2)c1 ZINC000597173167 521554753 /nfs/dbraw/zinc/55/47/53/521554753.db2.gz FQGSFOMVJGRBCX-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@@H+](Cc2ccccc2)C[C@H](C)C1 ZINC000602838363 521561751 /nfs/dbraw/zinc/56/17/51/521561751.db2.gz CYZNXBCUCNAVAB-MRXNPFEDSA-N 1 1 357.458 2.554 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000619527046 521752446 /nfs/dbraw/zinc/75/24/46/521752446.db2.gz FUPHZHHPJJXARY-INIZCTEOSA-N 1 1 374.416 2.741 20 5 FFBDMO C[C@@H](c1ccc(-c2nn[nH]n2)cc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000824764549 607942959 /nfs/dbraw/zinc/94/29/59/607942959.db2.gz XFWOLUUOBSIMEG-LBPRGKRZSA-N 1 1 350.382 2.894 20 5 FFBDMO C[C@@H](c1ccc(-c2nn[nH]n2)cc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000824764549 607942960 /nfs/dbraw/zinc/94/29/60/607942960.db2.gz XFWOLUUOBSIMEG-LBPRGKRZSA-N 1 1 350.382 2.894 20 5 FFBDMO Cc1ccnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC001164899729 721521434 /nfs/dbraw/zinc/52/14/34/721521434.db2.gz LYRBLYQERJPRDH-WBVHZDCISA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[NH+](Cc4ccsc4)CC3)c2c1 ZINC000016880013 727827630 /nfs/dbraw/zinc/82/76/30/727827630.db2.gz NYHKECHZVNNNSG-UHFFFAOYSA-N 1 1 357.439 2.781 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000125230975 728680862 /nfs/dbraw/zinc/68/08/62/728680862.db2.gz HWVCHPCJQRLABC-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO Cc1cnc(CC[N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)s1 ZINC000165202442 728971663 /nfs/dbraw/zinc/97/16/63/728971663.db2.gz RFPULNISTNIXNQ-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO Cc1cnc(CC[N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)s1 ZINC000165202442 728971665 /nfs/dbraw/zinc/97/16/65/728971665.db2.gz RFPULNISTNIXNQ-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000177217143 729132040 /nfs/dbraw/zinc/13/20/40/729132040.db2.gz BULPMNRHOGKEAH-HNNXBMFYSA-N 1 1 351.384 2.714 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000177217143 729132041 /nfs/dbraw/zinc/13/20/41/729132041.db2.gz BULPMNRHOGKEAH-HNNXBMFYSA-N 1 1 351.384 2.714 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000245431404 729569968 /nfs/dbraw/zinc/56/99/68/729569968.db2.gz ASEBSZALYGYAPA-OLZOCXBDSA-N 1 1 368.865 2.849 20 5 FFBDMO C[N@H+]1CCN(CCNc2cccc(Br)c2[N+](=O)[O-])CC1(C)C ZINC000856751959 730354880 /nfs/dbraw/zinc/35/48/80/730354880.db2.gz QYBFDVGPUDGJJI-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000859532908 730457924 /nfs/dbraw/zinc/45/79/24/730457924.db2.gz CDAJBDPNOPUIEL-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000859532908 730457925 /nfs/dbraw/zinc/45/79/25/730457925.db2.gz CDAJBDPNOPUIEL-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3Cl)CC2)c1 ZINC000860186935 730485464 /nfs/dbraw/zinc/48/54/64/730485464.db2.gz GBYWHBOILMJHLT-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000863295308 730765386 /nfs/dbraw/zinc/76/53/86/730765386.db2.gz XIDKYSIKYGFDTF-IXDOHACOSA-N 1 1 361.467 2.838 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000864611048 730865175 /nfs/dbraw/zinc/86/51/75/730865175.db2.gz ZRYKAGYBNREPDM-GFCCVEGCSA-N 1 1 370.247 2.500 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769508688 737537304 /nfs/dbraw/zinc/53/73/04/737537304.db2.gz UQGIEANHWWKCIS-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769508688 737537308 /nfs/dbraw/zinc/53/73/08/737537308.db2.gz UQGIEANHWWKCIS-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000865955585 731015382 /nfs/dbraw/zinc/01/53/82/731015382.db2.gz HILXMGIOXLZXFQ-NSHDSACASA-N 1 1 360.241 2.937 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCS(=O)(=O)CC1CC1 ZINC000872047395 731723628 /nfs/dbraw/zinc/72/36/28/731723628.db2.gz AWAJKNZOHWDJPA-NSHDSACASA-N 1 1 358.485 2.792 20 5 FFBDMO O=C1NCC2(CC[NH+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)O1 ZINC000877460690 732365355 /nfs/dbraw/zinc/36/53/55/732365355.db2.gz SEKNJFSEPMCODU-UHFFFAOYSA-N 1 1 359.304 2.688 20 5 FFBDMO NC(=O)[C@@H](F)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000879043622 732636181 /nfs/dbraw/zinc/63/61/81/732636181.db2.gz JMDFJIAPIPOQBB-ZDUSSCGKSA-N 1 1 363.311 2.649 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000880435217 732907675 /nfs/dbraw/zinc/90/76/75/732907675.db2.gz KGUYBUYTQIPRKJ-OCCSQVGLSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CC(C)(C)O ZINC000782031805 738681668 /nfs/dbraw/zinc/68/16/68/738681668.db2.gz MBGRYHWJULIUBJ-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000886032627 733741793 /nfs/dbraw/zinc/74/17/93/733741793.db2.gz KETBSQZMNPJCCP-UHFFFAOYSA-N 1 1 350.419 2.821 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]1(C)CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886192419 733758107 /nfs/dbraw/zinc/75/81/07/733758107.db2.gz VGEQFRNUSAJKDS-QGZVFWFLSA-N 1 1 350.419 2.727 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]1(C)CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886192419 733758111 /nfs/dbraw/zinc/75/81/11/733758111.db2.gz VGEQFRNUSAJKDS-QGZVFWFLSA-N 1 1 350.419 2.727 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000886592676 733807492 /nfs/dbraw/zinc/80/74/92/733807492.db2.gz ZVZIKYZCCBSHGD-ZDUSSCGKSA-N 1 1 364.789 2.856 20 5 FFBDMO C[C@H](C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928092558 738820085 /nfs/dbraw/zinc/82/00/85/738820085.db2.gz SZWPUUGGPHAJCN-IUIKQTSFSA-N 1 1 367.446 2.533 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102352 738824880 /nfs/dbraw/zinc/82/48/80/738824880.db2.gz HTSSBSKXVNLSKS-AAEUAGOBSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102352 738824886 /nfs/dbraw/zinc/82/48/86/738824886.db2.gz HTSSBSKXVNLSKS-AAEUAGOBSA-N 1 1 355.847 2.558 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)C1 ZINC000897826194 735281044 /nfs/dbraw/zinc/28/10/44/735281044.db2.gz VAUXOWMCXWLPML-XVKPBYJWSA-N 1 1 362.188 2.817 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C[C@@H](C)O1 ZINC000749880937 735757881 /nfs/dbraw/zinc/75/78/81/735757881.db2.gz YHAHACKFRKVIQJ-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932770 735937045 /nfs/dbraw/zinc/93/70/45/735937045.db2.gz FQHSWAFJBJFSSY-MFKMUULPSA-N 1 1 361.240 2.647 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932770 735937051 /nfs/dbraw/zinc/93/70/51/735937051.db2.gz FQHSWAFJBJFSSY-MFKMUULPSA-N 1 1 361.240 2.647 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000752246172 735970850 /nfs/dbraw/zinc/97/08/50/735970850.db2.gz FQQUDHJVAHMTJA-LLVKDONJSA-N 1 1 363.867 2.565 20 5 FFBDMO CC(C)OCCC[N@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752790737 736012833 /nfs/dbraw/zinc/01/28/33/736012833.db2.gz CPVJCZLULJLRRV-UHFFFAOYSA-N 1 1 350.419 2.541 20 5 FFBDMO CC(C)OCCC[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752790737 736012834 /nfs/dbraw/zinc/01/28/34/736012834.db2.gz CPVJCZLULJLRRV-UHFFFAOYSA-N 1 1 350.419 2.541 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000755012017 736226586 /nfs/dbraw/zinc/22/65/86/736226586.db2.gz CNLUUOPLFUWDBX-SCZZXKLOSA-N 1 1 374.210 2.709 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756919325 736373462 /nfs/dbraw/zinc/37/34/62/736373462.db2.gz ADRMRXQIABYIDE-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc3c(c2)CCS3(=O)=O)c1 ZINC000757692461 736419978 /nfs/dbraw/zinc/41/99/78/736419978.db2.gz HKCAEYLEKFMQDB-UHFFFAOYSA-N 1 1 366.826 2.868 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000906939496 736562714 /nfs/dbraw/zinc/56/27/14/736562714.db2.gz DCYFEJVQROUMRH-YPMHNXCESA-N 1 1 351.834 2.922 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760874716 736676308 /nfs/dbraw/zinc/67/63/08/736676308.db2.gz ZFEHTEQBSXZQSV-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO CCC[C@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000766700064 737253681 /nfs/dbraw/zinc/25/36/81/737253681.db2.gz LVORTAAJBYWNAO-INIZCTEOSA-N 1 1 366.487 2.724 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C(C)(C)C1 ZINC000767128934 737294607 /nfs/dbraw/zinc/29/46/07/737294607.db2.gz ODJUGWZPMMCMCO-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C(C)(C)C1 ZINC000767128934 737294611 /nfs/dbraw/zinc/29/46/11/737294611.db2.gz ODJUGWZPMMCMCO-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999708 737588898 /nfs/dbraw/zinc/58/88/98/737588898.db2.gz FRNRHPJTZLIGFO-FUHWJXTLSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999708 737588899 /nfs/dbraw/zinc/58/88/99/737588899.db2.gz FRNRHPJTZLIGFO-FUHWJXTLSA-N 1 1 350.415 2.826 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000771508624 737731668 /nfs/dbraw/zinc/73/16/68/737731668.db2.gz IPXCVWRYPUIGAH-LBPRGKRZSA-N 1 1 363.443 2.594 20 5 FFBDMO CC[C@@H](CSC)[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000773260626 737886188 /nfs/dbraw/zinc/88/61/88/737886188.db2.gz YNJKHTPLOSQVLX-ZDUSSCGKSA-N 1 1 352.460 2.868 20 5 FFBDMO COC(=O)CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774888250 738036754 /nfs/dbraw/zinc/03/67/54/738036754.db2.gz VJLOCHQAALLICY-UHFFFAOYSA-N 1 1 351.359 2.668 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388931 738135360 /nfs/dbraw/zinc/13/53/60/738135360.db2.gz RZBIUCSXAJRUKU-BRSBDYLESA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388931 738135363 /nfs/dbraw/zinc/13/53/63/738135363.db2.gz RZBIUCSXAJRUKU-BRSBDYLESA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388931 738135368 /nfs/dbraw/zinc/13/53/68/738135368.db2.gz RZBIUCSXAJRUKU-BRSBDYLESA-N 1 1 367.877 2.818 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000923278907 738265722 /nfs/dbraw/zinc/26/57/22/738265722.db2.gz XOPMOOJSMJNOQR-QWHCGFSZSA-N 1 1 357.332 2.922 20 5 FFBDMO CNC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2Br)CCCC1 ZINC000929981471 739044523 /nfs/dbraw/zinc/04/45/23/739044523.db2.gz QBNGCNJZAPPMIH-UHFFFAOYSA-N 1 1 356.220 2.506 20 5 FFBDMO Cc1cn2c(nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc2=O)s1 ZINC000930439367 739108841 /nfs/dbraw/zinc/10/88/41/739108841.db2.gz GSTBJAGXISOIQN-UHFFFAOYSA-N 1 1 358.423 2.647 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787304900 739124999 /nfs/dbraw/zinc/12/49/99/739124999.db2.gz SWTJWWFBKXUQRS-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO CCOCC[NH+]1CCN(c2ccc(C)c(Br)c2[N+](=O)[O-])CC1 ZINC000787897723 739185514 /nfs/dbraw/zinc/18/55/14/739185514.db2.gz AJCWJNLXPVZXBZ-UHFFFAOYSA-N 1 1 372.263 2.824 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000788566624 739259547 /nfs/dbraw/zinc/25/95/47/739259547.db2.gz XYGCGILXMQTNCC-UHFFFAOYSA-N 1 1 359.373 2.743 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000788566624 739259549 /nfs/dbraw/zinc/25/95/49/739259549.db2.gz XYGCGILXMQTNCC-UHFFFAOYSA-N 1 1 359.373 2.743 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932017562 739373627 /nfs/dbraw/zinc/37/36/27/739373627.db2.gz WGBWHVIHDHJGND-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000789763863 739386134 /nfs/dbraw/zinc/38/61/34/739386134.db2.gz RFHDTOFJYGDUQV-LBPRGKRZSA-N 1 1 372.263 2.510 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000790912656 739512187 /nfs/dbraw/zinc/51/21/87/739512187.db2.gz XXEXAOOPHYJDFG-GHMZBOCLSA-N 1 1 357.813 2.871 20 5 FFBDMO C[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000791938547 739618309 /nfs/dbraw/zinc/61/83/09/739618309.db2.gz MBPQVODAPMRPMA-LBPRGKRZSA-N 1 1 351.359 2.811 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ncc1Br ZINC000794217156 739864357 /nfs/dbraw/zinc/86/43/57/739864357.db2.gz FGAVHPLGXMXQMY-SNVBAGLBSA-N 1 1 373.251 2.603 20 5 FFBDMO C[C@@H](NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000935311925 739930703 /nfs/dbraw/zinc/93/07/03/739930703.db2.gz GPVMFGRERUELMC-GFCCVEGCSA-N 1 1 351.834 2.947 20 5 FFBDMO CCc1ccc(N2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)cc1Cl ZINC000796136874 740106127 /nfs/dbraw/zinc/10/61/27/740106127.db2.gz ZXNLBBGPTAIXNU-UHFFFAOYSA-N 1 1 363.849 2.829 20 5 FFBDMO Cn1nc(Br)cc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000802658396 740716091 /nfs/dbraw/zinc/71/60/91/740716091.db2.gz YSMHFRDSDQEMHO-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO Cc1ccc(N2CC[N@@H+](CCO)C(C)(C)C2)c([N+](=O)[O-])c1Br ZINC000804631435 740890654 /nfs/dbraw/zinc/89/06/54/740890654.db2.gz UWGAEIDQYHRHHT-UHFFFAOYSA-N 1 1 372.263 2.559 20 5 FFBDMO Cc1ccc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1Br ZINC000804641232 740891343 /nfs/dbraw/zinc/89/13/43/740891343.db2.gz NZGKQOBUGDOUBV-UHFFFAOYSA-N 1 1 358.236 2.800 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000806950414 741097698 /nfs/dbraw/zinc/09/76/98/741097698.db2.gz NNNQNKBIOLFADK-AWEZNQCLSA-N 1 1 354.838 2.922 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)n(C)c1C ZINC000812757905 741650485 /nfs/dbraw/zinc/65/04/85/741650485.db2.gz XKKCMIKNZNHQTD-UHFFFAOYSA-N 1 1 351.790 2.972 20 5 FFBDMO Cc1cccc(Cl)c1C[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001000673520 742093397 /nfs/dbraw/zinc/09/33/97/742093397.db2.gz FZXXHFXZPCZXHI-RHSMWYFYSA-N 1 1 363.845 2.562 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@H]1CCC[N@H+]1C ZINC000817292261 742118849 /nfs/dbraw/zinc/11/88/49/742118849.db2.gz SCQNKSBOEBBGRS-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@H](CCO)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000817297474 742120194 /nfs/dbraw/zinc/12/01/94/742120194.db2.gz REPBZZNGEBJIEN-ZDUSSCGKSA-N 1 1 353.394 2.547 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000817676528 742195131 /nfs/dbraw/zinc/19/51/31/742195131.db2.gz IMHOTVUBXUYUMU-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO Cc1nc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)sc1Br ZINC000819338966 742378063 /nfs/dbraw/zinc/37/80/63/742378063.db2.gz FJGDUDAXKPIGQV-NSHDSACASA-N 1 1 372.244 2.945 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000820131716 742466144 /nfs/dbraw/zinc/46/61/44/742466144.db2.gz IPJQFQGZPSCXRK-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643705 742927671 /nfs/dbraw/zinc/92/76/71/742927671.db2.gz RMRKGRKHQWHMFL-KLHDSHLOSA-N 1 1 351.834 2.522 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H]1C ZINC000826633223 743411499 /nfs/dbraw/zinc/41/14/99/743411499.db2.gz QJXXYZXEYRHWEL-PHIMTYICSA-N 1 1 362.352 2.554 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]21 ZINC000827254389 743542510 /nfs/dbraw/zinc/54/25/10/743542510.db2.gz PCVXXYFWNPEZTG-HZMBPMFUSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827286684 743548501 /nfs/dbraw/zinc/54/85/01/743548501.db2.gz HXMGZOPXZXTHMY-DGCLKSJQSA-N 1 1 369.874 2.893 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000828958861 745146453 /nfs/dbraw/zinc/14/64/53/745146453.db2.gz JIMTZECDEUAYGJ-HZPDHXFCSA-N 1 1 351.834 2.876 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000830019983 745295470 /nfs/dbraw/zinc/29/54/70/745295470.db2.gz AEFLQVVWDGXYRQ-KBPBESRZSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000830019983 745295475 /nfs/dbraw/zinc/29/54/75/745295475.db2.gz AEFLQVVWDGXYRQ-KBPBESRZSA-N 1 1 367.496 2.626 20 5 FFBDMO O=C(NCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F ZINC000831538729 745544338 /nfs/dbraw/zinc/54/43/38/745544338.db2.gz HBZWYTFEIJQEMD-ZDUSSCGKSA-N 1 1 359.348 2.843 20 5 FFBDMO O=C(CC[N@H+]1CCSC[C@H]1C1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000831778965 745582974 /nfs/dbraw/zinc/58/29/74/745582974.db2.gz ZCPDJCXELDNXPB-HNNXBMFYSA-N 1 1 353.419 2.890 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCN(CC(F)(F)F)CC1 ZINC000832625342 745728457 /nfs/dbraw/zinc/72/84/57/745728457.db2.gz TZLUQDUZPLBGEP-OAHLLOKOSA-N 1 1 361.364 2.587 20 5 FFBDMO COC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000832744666 745748519 /nfs/dbraw/zinc/74/85/19/745748519.db2.gz GFQTXENAYLNFAU-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000832744666 745748522 /nfs/dbraw/zinc/74/85/22/745748522.db2.gz GFQTXENAYLNFAU-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO Cc1nn(CCC(=O)OC[C@@H]2CCCC[N@@H+]2C(C)C)c(C)c1[N+](=O)[O-] ZINC000837493809 746459302 /nfs/dbraw/zinc/45/93/02/746459302.db2.gz PNZVLXAHVNXTQU-HNNXBMFYSA-N 1 1 352.435 2.604 20 5 FFBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839568219 746858294 /nfs/dbraw/zinc/85/82/94/746858294.db2.gz KTZVYFWGNFEBTG-MEDUHNTESA-N 1 1 355.822 2.670 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000839643770 746880494 /nfs/dbraw/zinc/88/04/94/746880494.db2.gz SXSNGFMIFXLDEY-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO CC(C)[N@@H+](C)CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000839865698 746946885 /nfs/dbraw/zinc/94/68/85/746946885.db2.gz YTMPYXJOIZYSMS-CYBMUJFWSA-N 1 1 351.300 2.794 20 5 FFBDMO [NH3+]CCc1ccc(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000841031929 747259304 /nfs/dbraw/zinc/25/93/04/747259304.db2.gz CGJDPISLLQQPKD-UHFFFAOYSA-N 1 1 351.353 2.987 20 5 FFBDMO [NH3+][C@H]1CCO[C@H](C2CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)C1 ZINC000841104798 747270954 /nfs/dbraw/zinc/27/09/54/747270954.db2.gz SQBLGKCSZNKNSC-YOEHRIQHSA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652786 747649787 /nfs/dbraw/zinc/64/97/87/747649787.db2.gz YLMVYJHHMLNNJE-PWSUYJOCSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652786 747649789 /nfs/dbraw/zinc/64/97/89/747649789.db2.gz YLMVYJHHMLNNJE-PWSUYJOCSA-N 1 1 373.862 2.639 20 5 FFBDMO [NH3+]CCCCCCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000842919671 747720760 /nfs/dbraw/zinc/72/07/60/747720760.db2.gz MOTCGROPMWQXPF-UHFFFAOYSA-N 1 1 370.258 2.699 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437600 748029592 /nfs/dbraw/zinc/02/95/92/748029592.db2.gz ODFUAHQHNGXEPL-GOEBONIOSA-N 1 1 351.353 2.821 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437600 748029600 /nfs/dbraw/zinc/02/96/00/748029600.db2.gz ODFUAHQHNGXEPL-GOEBONIOSA-N 1 1 351.353 2.821 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000844757403 748091990 /nfs/dbraw/zinc/09/19/90/748091990.db2.gz KBTIOWOPLXZGOH-OAHLLOKOSA-N 1 1 352.341 2.525 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@@]3(CC3(F)F)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000844757403 748091999 /nfs/dbraw/zinc/09/19/99/748091999.db2.gz KBTIOWOPLXZGOH-OAHLLOKOSA-N 1 1 352.341 2.525 20 5 FFBDMO COc1cc(C(=O)OC[C@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000845739277 748317606 /nfs/dbraw/zinc/31/76/06/748317606.db2.gz QQMXMZPCYCBOIG-LLVKDONJSA-N 1 1 352.387 2.642 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422560 749856993 /nfs/dbraw/zinc/85/69/93/749856993.db2.gz FLELHZMGHJSVSH-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422560 749856998 /nfs/dbraw/zinc/85/69/98/749856998.db2.gz FLELHZMGHJSVSH-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CC1=CCCOC1 ZINC000852518025 749881817 /nfs/dbraw/zinc/88/18/17/749881817.db2.gz AZUCGITZBMHYER-LLVKDONJSA-N 1 1 353.806 2.854 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1=CCCOC1 ZINC000852518025 749881826 /nfs/dbraw/zinc/88/18/26/749881826.db2.gz AZUCGITZBMHYER-LLVKDONJSA-N 1 1 353.806 2.854 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C2 ZINC000854739866 750362811 /nfs/dbraw/zinc/36/28/11/750362811.db2.gz YKNGKQBQCXIJKF-INIZCTEOSA-N 1 1 353.369 2.631 20 5 FFBDMO CN(CC(C)(C)C[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000890881536 960759683 /nfs/dbraw/zinc/75/96/83/960759683.db2.gz YILXJBVBMKMFNN-UHFFFAOYSA-N 1 1 359.430 2.645 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000872286588 1013200898 /nfs/dbraw/zinc/20/08/98/1013200898.db2.gz LULZHGRLEBQOKL-IEBWSBKVSA-N 1 1 361.442 2.719 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000134135083 962273783 /nfs/dbraw/zinc/27/37/83/962273783.db2.gz VDDQBDAWTZFCLV-HNNXBMFYSA-N 1 1 360.458 2.640 20 5 FFBDMO C[N@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1cc(=S)cc2[nH]c3ccccc3nc1-2 ZINC001270474261 965148954 /nfs/dbraw/zinc/14/89/54/965148954.db2.gz WZUXJVRKIFNWIM-TXEJJXNPSA-N 1 1 350.447 2.926 20 5 FFBDMO C[N@@H+]1C[C@H]2C[C@@H](C1)N2C(=O)c1cc(=S)cc2[nH]c3ccccc3nc1-2 ZINC001270474261 965148959 /nfs/dbraw/zinc/14/89/59/965148959.db2.gz WZUXJVRKIFNWIM-TXEJJXNPSA-N 1 1 350.447 2.926 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001167642414 967120310 /nfs/dbraw/zinc/12/03/10/967120310.db2.gz XKCIWGGXADQDHL-SFHVURJKSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167642414 967120313 /nfs/dbraw/zinc/12/03/13/967120313.db2.gz XKCIWGGXADQDHL-SFHVURJKSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167642414 967120318 /nfs/dbraw/zinc/12/03/18/967120318.db2.gz XKCIWGGXADQDHL-SFHVURJKSA-N 1 1 357.458 2.696 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901223 968104724 /nfs/dbraw/zinc/10/47/24/968104724.db2.gz AHXFCSGMUBLMCX-HOCLYGCPSA-N 1 1 373.457 2.919 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901223 968104728 /nfs/dbraw/zinc/10/47/28/968104728.db2.gz AHXFCSGMUBLMCX-HOCLYGCPSA-N 1 1 373.457 2.919 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@@H+](CCCn1c(=O)oc3ccc([N+](=O)[O-])cc31)C2 ZINC001176803456 1013778085 /nfs/dbraw/zinc/77/80/85/1013778085.db2.gz HECNDFPARXBVRF-YVEFUNNKSA-N 1 1 363.439 2.578 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@@H+]1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000102392951 968439408 /nfs/dbraw/zinc/43/94/08/968439408.db2.gz PJSYPLVOJJXGAN-CYBMUJFWSA-N 1 1 372.360 2.818 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@H+]1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000102392951 968439418 /nfs/dbraw/zinc/43/94/18/968439418.db2.gz PJSYPLVOJJXGAN-CYBMUJFWSA-N 1 1 372.360 2.818 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2cnn(C)c2)C1 ZINC000875054486 1013958826 /nfs/dbraw/zinc/95/88/26/1013958826.db2.gz UNRULVSPQBWPSS-ROUUACIJSA-N 1 1 371.441 2.781 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000892962937 970444747 /nfs/dbraw/zinc/44/47/47/970444747.db2.gz QIMUVSPQHSBKEJ-QWHCGFSZSA-N 1 1 362.382 2.540 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000892962936 970444882 /nfs/dbraw/zinc/44/48/82/970444882.db2.gz QIMUVSPQHSBKEJ-OLZOCXBDSA-N 1 1 362.382 2.540 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C(N)=O)(N2CCCCC2)CC1 ZINC000895552674 970734451 /nfs/dbraw/zinc/73/44/51/970734451.db2.gz POMUHPIASZNKGN-UHFFFAOYSA-N 1 1 374.485 2.517 20 5 FFBDMO C[C@H](CNC(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897064529 973214784 /nfs/dbraw/zinc/21/47/84/973214784.db2.gz YZWKKIVIQPHWLT-LSDHHAIUSA-N 1 1 360.458 2.824 20 5 FFBDMO Cc1ncccc1OC[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000842173443 976714369 /nfs/dbraw/zinc/71/43/69/976714369.db2.gz PSEPUHRJAQKREQ-ROUUACIJSA-N 1 1 357.410 2.875 20 5 FFBDMO O=C(C[N@@H+](CC1CC1)C1CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000796577299 1014374151 /nfs/dbraw/zinc/37/41/51/1014374151.db2.gz NXVCAQSEPKTFMF-UHFFFAOYSA-N 1 1 372.469 2.508 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2cccc(F)c2Cl)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001481896926 977742172 /nfs/dbraw/zinc/74/21/72/977742172.db2.gz HZZWFJJBPLVOJP-TZMCWYRMSA-N 1 1 369.824 2.663 20 5 FFBDMO CCCCC[NH2+]C[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001105423318 979414527 /nfs/dbraw/zinc/41/45/27/979414527.db2.gz NWQDWSMUPGWNPX-MLYOOKFZSA-N 1 1 359.470 2.648 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000877822955 1014740401 /nfs/dbraw/zinc/74/04/01/1014740401.db2.gz VMRQIVDOJUJEQS-ZDUSSCGKSA-N 1 1 364.398 2.627 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000156448534 984333424 /nfs/dbraw/zinc/33/34/24/984333424.db2.gz PGTGQOLTQUKYKZ-HZPDHXFCSA-N 1 1 359.430 2.946 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000764313179 984423095 /nfs/dbraw/zinc/42/30/95/984423095.db2.gz DQSCNSYSPWTRQJ-SFHVURJKSA-N 1 1 354.410 2.660 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878652013 1015150463 /nfs/dbraw/zinc/15/04/63/1015150463.db2.gz KNEKXNJQRDWQAO-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000765795033 985859756 /nfs/dbraw/zinc/85/97/56/985859756.db2.gz DQUPNFUDPUDLQT-KRWDZBQOSA-N 1 1 372.469 2.942 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)CC1 ZINC000879248328 1015436708 /nfs/dbraw/zinc/43/67/08/1015436708.db2.gz LCBUCBVMFGBQIN-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000194488063 989299827 /nfs/dbraw/zinc/29/98/27/989299827.db2.gz YVSQOQBHGDDXJC-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000194488063 989299837 /nfs/dbraw/zinc/29/98/37/989299837.db2.gz YVSQOQBHGDDXJC-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153909622 989762823 /nfs/dbraw/zinc/76/28/23/989762823.db2.gz ZHDFYIVZRVYCAM-KXBFYZLASA-N 1 1 372.421 2.940 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000879419996 1015523135 /nfs/dbraw/zinc/52/31/35/1015523135.db2.gz RGIZYICYQZNXON-XKQJLSEDSA-N 1 1 365.405 2.688 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643770 990149050 /nfs/dbraw/zinc/14/90/50/990149050.db2.gz SBIRWYOKMODPOC-MUIFIZLQSA-N 1 1 357.410 2.615 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035704397 990528494 /nfs/dbraw/zinc/52/84/94/990528494.db2.gz MGDZTPKYRBXLIU-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO Cc1ccccc1CCC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035707795 990529617 /nfs/dbraw/zinc/52/96/17/990529617.db2.gz RDHVLPWFDZUIDN-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000195322090 990838054 /nfs/dbraw/zinc/83/80/54/990838054.db2.gz MAIJTSXGWFFTMH-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000180187496 991449465 /nfs/dbraw/zinc/44/94/65/991449465.db2.gz ALUAMKVJKPPKEB-MJGOQNOKSA-N 1 1 368.437 2.836 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184481554 992779079 /nfs/dbraw/zinc/77/90/79/992779079.db2.gz BRQKVODVEXURBL-ZBFHGGJFSA-N 1 1 368.437 2.960 20 5 FFBDMO Cn1cc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810848504 994954584 /nfs/dbraw/zinc/95/45/84/994954584.db2.gz VSJLCJMOPDGURP-JKSUJKDBSA-N 1 1 370.409 2.779 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)c1 ZINC000811800115 995257966 /nfs/dbraw/zinc/25/79/66/995257966.db2.gz KFAWENPSTXGYCN-GOSISDBHSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)c1 ZINC000811800115 995257974 /nfs/dbraw/zinc/25/79/74/995257974.db2.gz KFAWENPSTXGYCN-GOSISDBHSA-N 1 1 352.398 2.868 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000888833180 1015959010 /nfs/dbraw/zinc/95/90/10/1015959010.db2.gz XXKCOZICDDGXQF-UKRRQHHQSA-N 1 1 362.430 2.942 20 5 FFBDMO COCCC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813171362 995633923 /nfs/dbraw/zinc/63/39/23/995633923.db2.gz IYNYALMETCGXBN-KRWDZBQOSA-N 1 1 362.426 2.919 20 5 FFBDMO COCCC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCC1 ZINC000813171362 995633927 /nfs/dbraw/zinc/63/39/27/995633927.db2.gz IYNYALMETCGXBN-KRWDZBQOSA-N 1 1 362.426 2.919 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000823981543 996772306 /nfs/dbraw/zinc/77/23/06/996772306.db2.gz ZLFFQTLOWCSMEM-XJKSGUPXSA-N 1 1 369.425 2.962 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823988560 996773049 /nfs/dbraw/zinc/77/30/49/996773049.db2.gz WUWQGIFWHKRKHJ-MRXNPFEDSA-N 1 1 369.425 2.915 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825393749 997359270 /nfs/dbraw/zinc/35/92/70/997359270.db2.gz KOMGUPJLSRQRQR-JKIFEVAISA-N 1 1 363.458 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000844423458 997878713 /nfs/dbraw/zinc/87/87/13/997878713.db2.gz SNZCNUKTDHEYFU-GOSISDBHSA-N 1 1 370.409 2.862 20 5 FFBDMO C[C@@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844727830 998099796 /nfs/dbraw/zinc/09/97/96/998099796.db2.gz IKYPWSOVVXFXPY-ZIAGYGMSSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844727830 998099806 /nfs/dbraw/zinc/09/98/06/998099806.db2.gz IKYPWSOVVXFXPY-ZIAGYGMSSA-N 1 1 367.450 2.764 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)CC[C@@H]2CCCC[N@H+]2C)c1 ZINC000845165718 998392236 /nfs/dbraw/zinc/39/22/36/998392236.db2.gz SRDYYLYYOKVAHS-HNNXBMFYSA-N 1 1 364.398 2.689 20 5 FFBDMO Cc1cccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c1 ZINC001000150443 1016244846 /nfs/dbraw/zinc/24/48/46/1016244846.db2.gz QKOICWBXOGYYLQ-QZTJIDSGSA-N 1 1 357.454 2.521 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000803856324 1016244893 /nfs/dbraw/zinc/24/48/93/1016244893.db2.gz OOAFTMBPZVIGLA-CQSZACIVSA-N 1 1 374.397 2.953 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000803856045 1016247373 /nfs/dbraw/zinc/24/73/73/1016247373.db2.gz LYYAEWLWLSWVCZ-CQSZACIVSA-N 1 1 374.397 2.953 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)C1 ZINC000823755231 999074606 /nfs/dbraw/zinc/07/46/06/999074606.db2.gz MLELOTUWOTXSJN-ZETCQYMHSA-N 1 1 350.177 2.722 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2C[C@@]3(C)CN(C)C[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755631 999074711 /nfs/dbraw/zinc/07/47/11/999074711.db2.gz UZBUEFWPCLERTO-RTBURBONSA-N 1 1 360.458 2.505 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1CN[C@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC000734000520 999169795 /nfs/dbraw/zinc/16/97/95/999169795.db2.gz QRKYNJITGXCYHE-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1CN[C@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000734000520 999169797 /nfs/dbraw/zinc/16/97/97/999169797.db2.gz QRKYNJITGXCYHE-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1CCCCCC1 ZINC000741028313 999705026 /nfs/dbraw/zinc/70/50/26/999705026.db2.gz FJIWBCKLHUPIBL-CYBMUJFWSA-N 1 1 374.397 2.953 20 5 FFBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000742167801 999760490 /nfs/dbraw/zinc/76/04/90/999760490.db2.gz XVWIDTYFFCKLAQ-HNNXBMFYSA-N 1 1 373.409 2.572 20 5 FFBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000742167801 999760493 /nfs/dbraw/zinc/76/04/93/999760493.db2.gz XVWIDTYFFCKLAQ-HNNXBMFYSA-N 1 1 373.409 2.572 20 5 FFBDMO O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363316 999870251 /nfs/dbraw/zinc/87/02/51/999870251.db2.gz NTKJEZCWKNCZDO-HUYLIWGRSA-N 1 1 371.481 2.994 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@H]1C ZINC000766558003 1000012912 /nfs/dbraw/zinc/01/29/12/1000012912.db2.gz YEFJWXFUIXNQFO-MNOVXSKESA-N 1 1 364.402 2.675 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@H]1CNC(=O)OC(C)(C)C ZINC001169006447 1000015091 /nfs/dbraw/zinc/01/50/91/1000015091.db2.gz IHVGHETWZLSZTQ-QKPAOTATSA-N 1 1 355.479 2.915 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169010585 1000015263 /nfs/dbraw/zinc/01/52/63/1000015263.db2.gz DVBRXITVXODCRJ-KLHDSHLOSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169010308 1000015308 /nfs/dbraw/zinc/01/53/08/1000015308.db2.gz COSOLORFHOAUDC-XUWVNRHRSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]12CCC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011024 1000015394 /nfs/dbraw/zinc/01/53/94/1000015394.db2.gz HJVQLCGPXUFKPK-MPGHIAIKSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC[C@@H]2C1 ZINC001169010587 1000015439 /nfs/dbraw/zinc/01/54/39/1000015439.db2.gz DVBRXITVXODCRJ-WCVJEAGWSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@@H]2C[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010289 1000015457 /nfs/dbraw/zinc/01/54/57/1000015457.db2.gz CFLZMLIHLKPAHY-WCVJEAGWSA-N 1 1 353.463 2.763 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCn3cnc(COc4cccnc4)c3C2)C1 ZINC001169018392 1000017244 /nfs/dbraw/zinc/01/72/44/1000017244.db2.gz AYLRYSOYPLOASX-HZPDHXFCSA-N 1 1 371.441 2.508 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)CN1c1cccc(F)c1 ZINC001169018879 1000017332 /nfs/dbraw/zinc/01/73/32/1000017332.db2.gz CWPGKPOHYMLZIA-QOKNQOGYSA-N 1 1 361.417 2.700 20 5 FFBDMO Cc1cccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)c1 ZINC001169020004 1000017624 /nfs/dbraw/zinc/01/76/24/1000017624.db2.gz HMWCLFIDEQDHFD-FUHIMQAGSA-N 1 1 357.454 2.869 20 5 FFBDMO CCOCc1nn(CC2CC2)c2c1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169024572 1000017810 /nfs/dbraw/zinc/01/78/10/1000017810.db2.gz XFCKRTPOOVYIKZ-HOTGVXAUSA-N 1 1 362.474 2.633 20 5 FFBDMO O=C1N(CC2CC2)c2ccccc2[C@]12CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169026747 1000018101 /nfs/dbraw/zinc/01/81/01/1000018101.db2.gz NTDYIXVYNAKWSE-CBGDNZLLSA-N 1 1 369.465 2.832 20 5 FFBDMO CCn1cc(C[N@@H+](Cc2c(C)nn(C)c2C)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cn1 ZINC001169026337 1000018193 /nfs/dbraw/zinc/01/81/93/1000018193.db2.gz KYJPNWYJRCLXOU-SJLPKXTDSA-N 1 1 374.489 2.701 20 5 FFBDMO C[N@@H+]1CCc2c(NCC3CCC4(CCC(=O)N4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001169295586 1000038780 /nfs/dbraw/zinc/03/87/80/1000038780.db2.gz WZSNSBYOYKFZEK-UHFFFAOYSA-N 1 1 372.469 2.834 20 5 FFBDMO C[N@H+]1CCc2c(NCC3CCC4(CCC(=O)N4)CC3)ccc([N+](=O)[O-])c2C1 ZINC001169295586 1000038782 /nfs/dbraw/zinc/03/87/82/1000038782.db2.gz WZSNSBYOYKFZEK-UHFFFAOYSA-N 1 1 372.469 2.834 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000846172417 1000215528 /nfs/dbraw/zinc/21/55/28/1000215528.db2.gz MCIMNFABSHDUGE-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000768501264 1000268930 /nfs/dbraw/zinc/26/89/30/1000268930.db2.gz HTUWXCSYZJYUMM-QFBILLFUSA-N 1 1 355.442 2.832 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000746635138 1001663755 /nfs/dbraw/zinc/66/37/55/1001663755.db2.gz CRWFVLLZTYVUKU-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NCC[N@H+]1CCCC[C@@H]1C ZINC000746716065 1001733054 /nfs/dbraw/zinc/73/30/54/1001733054.db2.gz IDFYTLKWJUXFQA-NSHDSACASA-N 1 1 366.374 2.576 20 5 FFBDMO O=C1OCCN1[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000826995070 1016548720 /nfs/dbraw/zinc/54/87/20/1016548720.db2.gz QMKCNYXQOPISTF-ZDUSSCGKSA-N 1 1 357.366 2.881 20 5 FFBDMO O=C1OCCN1[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000826995331 1016545651 /nfs/dbraw/zinc/54/56/51/1016545651.db2.gz ULKWFEVJCGGQSO-OAHLLOKOSA-N 1 1 357.366 2.881 20 5 FFBDMO Cn1c(=O)ccc2c1CCC[C@@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182666396 1001989775 /nfs/dbraw/zinc/98/97/75/1001989775.db2.gz OBLVLOXYAPYVPY-ZDUSSCGKSA-N 1 1 354.366 2.602 20 5 FFBDMO O=C1OCCN1[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000826995179 1016552657 /nfs/dbraw/zinc/55/26/57/1016552657.db2.gz QZFDUSQVZWIPGP-HNNXBMFYSA-N 1 1 357.366 2.881 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000789517248 1002119601 /nfs/dbraw/zinc/11/96/01/1002119601.db2.gz ASLMDEYFUQKYAK-CQSZACIVSA-N 1 1 359.430 2.591 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1CCNC1=O ZINC001183011919 1002121910 /nfs/dbraw/zinc/12/19/10/1002121910.db2.gz NFEBSXBHCRGHOT-INIZCTEOSA-N 1 1 362.433 2.837 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[NH+](Cc2ccccc2)CC1 ZINC001184579617 1002651574 /nfs/dbraw/zinc/65/15/74/1002651574.db2.gz BTFCCZLZZVUJAR-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170356036 1003123241 /nfs/dbraw/zinc/12/32/41/1003123241.db2.gz UTDANAVADDMQJE-KGLIPLIRSA-N 1 1 350.415 2.810 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345853 1003134250 /nfs/dbraw/zinc/13/42/50/1003134250.db2.gz MZYFFZWUTCYGAL-SCLBCKFNSA-N 1 1 350.415 2.810 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000804561406 1003726704 /nfs/dbraw/zinc/72/67/04/1003726704.db2.gz DYVUPFZWBIGUPM-UHFFFAOYSA-N 1 1 359.342 2.787 20 5 FFBDMO C[N@@H+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000804719908 1003799976 /nfs/dbraw/zinc/79/99/76/1003799976.db2.gz JWQBZCFASZTFLZ-OAHLLOKOSA-N 1 1 356.382 2.866 20 5 FFBDMO C[N@H+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000804719908 1003799981 /nfs/dbraw/zinc/79/99/81/1003799981.db2.gz JWQBZCFASZTFLZ-OAHLLOKOSA-N 1 1 356.382 2.866 20 5 FFBDMO CCC1([NH2+]Cc2ccc(C)cc2C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001273757231 1004446263 /nfs/dbraw/zinc/44/62/63/1004446263.db2.gz WLAVDIIXAQNNED-QZTJIDSGSA-N 1 1 359.470 2.829 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000101905875 1004950842 /nfs/dbraw/zinc/95/08/42/1004950842.db2.gz QDNDLNDVYMFKLR-AWEZNQCLSA-N 1 1 359.430 2.530 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000101905875 1004950849 /nfs/dbraw/zinc/95/08/49/1004950849.db2.gz QDNDLNDVYMFKLR-AWEZNQCLSA-N 1 1 359.430 2.530 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776583028 1005954493 /nfs/dbraw/zinc/95/44/93/1005954493.db2.gz YQCPWEIBFLBEKX-HNAYVOBHSA-N 1 1 372.421 2.940 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000776585680 1005976520 /nfs/dbraw/zinc/97/65/20/1005976520.db2.gz ZEAUOYGFPNSRPY-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000776585680 1005976525 /nfs/dbraw/zinc/97/65/25/1005976525.db2.gz ZEAUOYGFPNSRPY-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000813828101 1006047169 /nfs/dbraw/zinc/04/71/69/1006047169.db2.gz ZOUUWSJRDVILMR-RHSMWYFYSA-N 1 1 368.437 2.878 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c(OC(F)F)c1 ZINC000853688551 1006504961 /nfs/dbraw/zinc/50/49/61/1006504961.db2.gz QJYSYBKIDSZZKH-UHFFFAOYSA-N 1 1 371.384 2.887 20 5 FFBDMO COCCn1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815616729 1006712756 /nfs/dbraw/zinc/71/27/56/1006712756.db2.gz WWOQNWUVIRHRML-WBMJQRKESA-N 1 1 359.430 2.748 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171105 1032168006 /nfs/dbraw/zinc/16/80/06/1032168006.db2.gz OLSJDBSXFDNCBQ-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171105 1032168007 /nfs/dbraw/zinc/16/80/07/1032168007.db2.gz OLSJDBSXFDNCBQ-CJNGLKHVSA-N 1 1 363.414 2.730 20 5 FFBDMO CO[C@@H]1CCCC[C@@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093070 1006898852 /nfs/dbraw/zinc/89/88/52/1006898852.db2.gz ZSVKEDRVXUFXFL-OKZBNKHCSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@@H]1CCCC[C@@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093070 1006898861 /nfs/dbraw/zinc/89/88/61/1006898861.db2.gz ZSVKEDRVXUFXFL-OKZBNKHCSA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000776768292 1007058195 /nfs/dbraw/zinc/05/81/95/1007058195.db2.gz LKIOXNWRWWNKFE-IBGZPJMESA-N 1 1 370.384 2.943 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000776768292 1007058205 /nfs/dbraw/zinc/05/82/05/1007058205.db2.gz LKIOXNWRWWNKFE-IBGZPJMESA-N 1 1 370.384 2.943 20 5 FFBDMO O=Cc1ccc([N+](=O)[O-])c(OCc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC000817579313 1007655619 /nfs/dbraw/zinc/65/56/19/1007655619.db2.gz BHIKKTUZIMUPPT-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nc1 ZINC000858012369 1008276869 /nfs/dbraw/zinc/27/68/69/1008276869.db2.gz GCPIIEHKLCNOFV-HNNXBMFYSA-N 1 1 358.354 2.860 20 5 FFBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nc1 ZINC000858012369 1008276872 /nfs/dbraw/zinc/27/68/72/1008276872.db2.gz GCPIIEHKLCNOFV-HNNXBMFYSA-N 1 1 358.354 2.860 20 5 FFBDMO Nc1ccc(N2CC[NH+](Cc3cc4ccccc4[nH]3)CC2)c([N+](=O)[O-])c1 ZINC000858821427 1008430171 /nfs/dbraw/zinc/43/01/71/1008430171.db2.gz ICBGLVMRUIBWAE-UHFFFAOYSA-N 1 1 351.410 2.981 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000859209153 1008487546 /nfs/dbraw/zinc/48/75/46/1008487546.db2.gz XIQKJBLTNWYNCX-OAHLLOKOSA-N 1 1 357.410 2.589 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859586180 1008578177 /nfs/dbraw/zinc/57/81/77/1008578177.db2.gz IOGGSZBDWWFBDD-FQEVSTJZSA-N 1 1 372.421 2.966 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000859616032 1008590300 /nfs/dbraw/zinc/59/03/00/1008590300.db2.gz DGWDZBSWJSZLIT-HNNXBMFYSA-N 1 1 369.421 2.542 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000886432146 1008677953 /nfs/dbraw/zinc/67/79/53/1008677953.db2.gz PLJHMLCFJWXQDN-SFHVURJKSA-N 1 1 358.394 2.935 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000886432146 1008677962 /nfs/dbraw/zinc/67/79/62/1008677962.db2.gz PLJHMLCFJWXQDN-SFHVURJKSA-N 1 1 358.394 2.935 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000805804292 1008800075 /nfs/dbraw/zinc/80/00/75/1008800075.db2.gz OYCZSADTBVKUFC-KBPBESRZSA-N 1 1 365.430 2.961 20 5 FFBDMO COc1cc(Cc2noc([C@H]3C[C@H](C)CC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823147155 1008920290 /nfs/dbraw/zinc/92/02/90/1008920290.db2.gz WRRHSOVUIBCHIA-ZWNOBZJWSA-N 1 1 362.386 2.646 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001178757189 1009117443 /nfs/dbraw/zinc/11/74/43/1009117443.db2.gz LHSVBIMYNGTQSJ-LBPRGKRZSA-N 1 1 354.838 2.633 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001178757189 1009117450 /nfs/dbraw/zinc/11/74/50/1009117450.db2.gz LHSVBIMYNGTQSJ-LBPRGKRZSA-N 1 1 354.838 2.633 20 5 FFBDMO C[C@@H](COC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1c1ccncc1)[N+](=O)[O-] ZINC000860777047 1009148357 /nfs/dbraw/zinc/14/83/57/1009148357.db2.gz JTXZMJZLOGHGSA-ZYSHUDEJSA-N 1 1 369.421 2.506 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C2CC2)c1 ZINC000860780370 1009149859 /nfs/dbraw/zinc/14/98/59/1009149859.db2.gz JLQMPYUFZDVZGU-KRWDZBQOSA-N 1 1 356.382 2.558 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C2CC2)c1 ZINC000860780370 1009149864 /nfs/dbraw/zinc/14/98/64/1009149864.db2.gz JLQMPYUFZDVZGU-KRWDZBQOSA-N 1 1 356.382 2.558 20 5 FFBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)nc2)cc1[N+](=O)[O-] ZINC000130484162 1009340109 /nfs/dbraw/zinc/34/01/09/1009340109.db2.gz LHLRBZYCQYMGTO-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000130603942 1009351112 /nfs/dbraw/zinc/35/11/12/1009351112.db2.gz PTURDEMWPHHYKG-UHFFFAOYSA-N 1 1 371.441 2.862 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000862631963 1009910289 /nfs/dbraw/zinc/91/02/89/1009910289.db2.gz ZFNXANRXJZCWKU-AWEZNQCLSA-N 1 1 362.386 2.640 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000889623032 1010032112 /nfs/dbraw/zinc/03/21/12/1010032112.db2.gz RPFFDCBIXOTFLZ-WMLDXEAASA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865733141 1010852132 /nfs/dbraw/zinc/85/21/32/1010852132.db2.gz QMUTZMHKEMNYTL-UHFFFAOYSA-N 1 1 361.373 2.977 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H](C[C@H]4CCOC4)C3)n2)c1 ZINC000773255395 1010898555 /nfs/dbraw/zinc/89/85/55/1010898555.db2.gz AINXNQCOBYUTHX-HZPDHXFCSA-N 1 1 371.441 2.949 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000866194337 1010949107 /nfs/dbraw/zinc/94/91/07/1010949107.db2.gz HYXZJRDPSYTAQE-MRXNPFEDSA-N 1 1 354.366 2.524 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000866194337 1010949109 /nfs/dbraw/zinc/94/91/09/1010949109.db2.gz HYXZJRDPSYTAQE-MRXNPFEDSA-N 1 1 354.366 2.524 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000866204233 1010950822 /nfs/dbraw/zinc/95/08/22/1010950822.db2.gz BGBWGBYTMIMUDX-WBVHZDCISA-N 1 1 353.426 2.891 20 5 FFBDMO COc1ccc(CN(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1C ZINC000867945961 1011127892 /nfs/dbraw/zinc/12/78/92/1011127892.db2.gz AWXYKRIGHBCLSS-IBGZPJMESA-N 1 1 357.410 2.744 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](Oc3cnccn3)C1)CC2 ZINC001172914034 1012096538 /nfs/dbraw/zinc/09/65/38/1012096538.db2.gz YCBUBEMZOWCYPQ-AEFFLSMTSA-N 1 1 354.410 2.786 20 5 FFBDMO O=C1CCC[C@]2(CCC[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)N1 ZINC001172910544 1012123575 /nfs/dbraw/zinc/12/35/75/1012123575.db2.gz YWRLWKLMWMCXQE-FXAWDEMLSA-N 1 1 357.454 2.977 20 5 FFBDMO CN1C(=O)CC[C@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@H]21 ZINC001172912326 1012124738 /nfs/dbraw/zinc/12/47/38/1012124738.db2.gz KTESXICHUNMFKP-JENIJYKNSA-N 1 1 357.454 2.785 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC[NH2+]2)cc1 ZINC000870137892 1012184628 /nfs/dbraw/zinc/18/46/28/1012184628.db2.gz DWJDBCSPWHAYAC-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000870138566 1012184816 /nfs/dbraw/zinc/18/48/16/1012184816.db2.gz MPWRKDMXMLWWRX-CPNNPKEDSA-N 1 1 367.405 2.790 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2nccnc2Cl)c1F ZINC001173177097 1012319019 /nfs/dbraw/zinc/31/90/19/1012319019.db2.gz OIJAVNHGPGPWBL-VIFPVBQESA-N 1 1 354.769 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@](O)(CF)CC2)c1F ZINC001173180154 1012323272 /nfs/dbraw/zinc/32/32/72/1012323272.db2.gz ITYXVFXDQMKBII-SJCJKPOMSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[N@H+]3CCCC[C@H]3C2)c1F ZINC001173189894 1012330780 /nfs/dbraw/zinc/33/07/80/1012330780.db2.gz OIEMHPVDASRDTC-KGLIPLIRSA-N 1 1 351.422 2.844 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)Cc2cc(C)nn2C)c1F ZINC001173189839 1012332435 /nfs/dbraw/zinc/33/24/35/1012332435.db2.gz MXZHXKOFXGMZDZ-GFCCVEGCSA-N 1 1 350.394 2.847 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192457 1012336377 /nfs/dbraw/zinc/33/63/77/1012336377.db2.gz LDFMQNNHLZSCTN-SCLBCKFNSA-N 1 1 351.422 2.701 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2c1cnn2C ZINC001173220719 1012350575 /nfs/dbraw/zinc/35/05/75/1012350575.db2.gz BUVZUAGKQMYRQU-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO Cc1ccccc1[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1 ZINC000870893712 1012624768 /nfs/dbraw/zinc/62/47/68/1012624768.db2.gz TWYCMWLTYQZCET-ICSRJNTNSA-N 1 1 369.421 2.677 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)[C@@](C)(N)c2cccc([N+](=O)[O-])c2)C1 ZINC000870920329 1012637216 /nfs/dbraw/zinc/63/72/16/1012637216.db2.gz CTFQDUONBQXZMU-SLGAXEFGSA-N 1 1 374.485 2.633 20 5 FFBDMO C[N@@H+]1CC[C@@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000928558995 1019022804 /nfs/dbraw/zinc/02/28/04/1019022804.db2.gz ZYNNZWHEOVWJIM-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO C[N@H+]1CC[C@@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000928558995 1019022822 /nfs/dbraw/zinc/02/28/22/1019022822.db2.gz ZYNNZWHEOVWJIM-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000801841725 1019442100 /nfs/dbraw/zinc/44/21/00/1019442100.db2.gz ASXQWNBBAUMZJH-UHFFFAOYSA-N 1 1 369.356 2.740 20 5 FFBDMO CCC1(C)CC[NH+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000725776767 1020256490 /nfs/dbraw/zinc/25/64/90/1020256490.db2.gz ANYKVCNYSFYNGF-IBGZPJMESA-N 1 1 374.441 2.831 20 5 FFBDMO COC(=O)CC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777953757 1020305631 /nfs/dbraw/zinc/30/56/31/1020305631.db2.gz LTYNNTKJRILYJD-UHFFFAOYSA-N 1 1 358.398 2.691 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777954788 1020327555 /nfs/dbraw/zinc/32/75/55/1020327555.db2.gz PYUFNPOGCFSWFA-INIZCTEOSA-N 1 1 371.441 2.654 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](Cc3nccs3)C2)nc1-c1ccncc1 ZINC000902650244 1020373644 /nfs/dbraw/zinc/37/36/44/1020373644.db2.gz YOQQOMFDEDYICS-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](Cc3nccs3)C2)nc1-c1ccncc1 ZINC000902650244 1020373655 /nfs/dbraw/zinc/37/36/55/1020373655.db2.gz YOQQOMFDEDYICS-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1[C@H]1CCCOC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000828904066 1032898437 /nfs/dbraw/zinc/89/84/37/1032898437.db2.gz BFBSPVSJLMVKIF-GUYCJALGSA-N 1 1 365.405 2.954 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1 ZINC000931433699 1020463364 /nfs/dbraw/zinc/46/33/64/1020463364.db2.gz FKXZWEJUYCRKSA-AEGPPILISA-N 1 1 357.414 2.589 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000726590881 1020491705 /nfs/dbraw/zinc/49/17/05/1020491705.db2.gz WRCUOPJOGIJKNQ-ZDUSSCGKSA-N 1 1 372.360 2.818 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@H+]1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000726590881 1020491707 /nfs/dbraw/zinc/49/17/07/1020491707.db2.gz WRCUOPJOGIJKNQ-ZDUSSCGKSA-N 1 1 372.360 2.818 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932134629 1020714409 /nfs/dbraw/zinc/71/44/09/1020714409.db2.gz LYNUISPEWWTMMH-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933080539 1020953798 /nfs/dbraw/zinc/95/37/98/1020953798.db2.gz YXABQERTJWAIEV-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1ccccc1N1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000934176039 1021158272 /nfs/dbraw/zinc/15/82/72/1021158272.db2.gz NIHPPEULTKDCKM-IBGZPJMESA-N 1 1 371.437 2.849 20 5 FFBDMO Cc1nn(CN2CCC(C[N@@H+](C)C(C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749953201 1021162520 /nfs/dbraw/zinc/16/25/20/1021162520.db2.gz CHDXOOUROUXTIU-UHFFFAOYSA-N 1 1 360.462 2.658 20 5 FFBDMO Cc1nn(CN2CCC(C[N@H+](C)C(C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749953201 1021162523 /nfs/dbraw/zinc/16/25/23/1021162523.db2.gz CHDXOOUROUXTIU-UHFFFAOYSA-N 1 1 360.462 2.658 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)n1 ZINC001116351696 1021176043 /nfs/dbraw/zinc/17/60/43/1021176043.db2.gz ISHFVUOFCWVLBW-ROUUACIJSA-N 1 1 356.426 2.908 20 5 FFBDMO O=C(NC1CC1)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001116443034 1021219839 /nfs/dbraw/zinc/21/98/39/1021219839.db2.gz CICDVHOTRIJJJU-NSHDSACASA-N 1 1 369.368 2.687 20 5 FFBDMO O=C(NC1CC1)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001116443034 1021219842 /nfs/dbraw/zinc/21/98/42/1021219842.db2.gz CICDVHOTRIJJJU-NSHDSACASA-N 1 1 369.368 2.687 20 5 FFBDMO COc1ccc(C[N@@H+](CCCO)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000934504559 1021264698 /nfs/dbraw/zinc/26/46/98/1021264698.db2.gz AJZUPGDBCQCCKV-IBGZPJMESA-N 1 1 360.410 2.521 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000750095463 1021338305 /nfs/dbraw/zinc/33/83/05/1021338305.db2.gz YUKCXNWHXKVDQT-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000934836651 1021422026 /nfs/dbraw/zinc/42/20/26/1021422026.db2.gz DVHAJHVNDJPWSD-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934840513 1021424457 /nfs/dbraw/zinc/42/44/57/1021424457.db2.gz FXJOBENBFZHDIU-SJORKVTESA-N 1 1 373.453 2.623 20 5 FFBDMO Cc1cc(C)cc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c1 ZINC001040701199 1022954363 /nfs/dbraw/zinc/95/43/63/1022954363.db2.gz WKCRSJJHYRVCLH-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000754219511 1023442135 /nfs/dbraw/zinc/44/21/35/1023442135.db2.gz SKSNIHCKQLBXRM-CYBMUJFWSA-N 1 1 362.430 2.605 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000754219511 1023442137 /nfs/dbraw/zinc/44/21/37/1023442137.db2.gz SKSNIHCKQLBXRM-CYBMUJFWSA-N 1 1 362.430 2.605 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@@H]1C ZINC000754225188 1023443201 /nfs/dbraw/zinc/44/32/01/1023443201.db2.gz PUFPTURFJGJRPU-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@@H]1C ZINC000754225188 1023443203 /nfs/dbraw/zinc/44/32/03/1023443203.db2.gz PUFPTURFJGJRPU-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC001122823393 1023496486 /nfs/dbraw/zinc/49/64/86/1023496486.db2.gz ZAPYHYJMFZTFSL-LSDHHAIUSA-N 1 1 364.494 2.582 20 5 FFBDMO Cc1ccccc1CCC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001121087434 1023598140 /nfs/dbraw/zinc/59/81/40/1023598140.db2.gz IDCZBMQGPOSTSY-JGQKGBITSA-N 1 1 371.481 2.610 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@H]2CCC[N@@H+]2C)n1C ZINC001121374997 1023736389 /nfs/dbraw/zinc/73/63/89/1023736389.db2.gz KGBQVCOJRYADSF-MRXNPFEDSA-N 1 1 358.446 2.905 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@H]2CCC[N@H+]2C)n1C ZINC001121374997 1023736391 /nfs/dbraw/zinc/73/63/91/1023736391.db2.gz KGBQVCOJRYADSF-MRXNPFEDSA-N 1 1 358.446 2.905 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000756980459 1023776294 /nfs/dbraw/zinc/77/62/94/1023776294.db2.gz SHIVJWOQYRWUMF-CQSZACIVSA-N 1 1 360.458 2.877 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000089934703 1025874842 /nfs/dbraw/zinc/87/48/42/1025874842.db2.gz VEDODVQDMXZBSQ-GASCZTMLSA-N 1 1 374.441 2.791 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246230740 1025899874 /nfs/dbraw/zinc/89/98/74/1025899874.db2.gz GBAXXMSLKISJGD-WMLDXEAASA-N 1 1 363.458 2.503 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246378479 1026081292 /nfs/dbraw/zinc/08/12/92/1026081292.db2.gz ZHDFYIVZRVYCAM-HNAYVOBHSA-N 1 1 372.421 2.940 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000838139388 1026225299 /nfs/dbraw/zinc/22/52/99/1026225299.db2.gz PNSFCBUBRXUIFJ-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839635003 1026768886 /nfs/dbraw/zinc/76/88/86/1026768886.db2.gz FMAWLLVNTAXMMV-CRAIPNDOSA-N 1 1 373.384 2.870 20 5 FFBDMO CC[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC(C)(C)C1 ZINC000840184557 1027002853 /nfs/dbraw/zinc/00/28/53/1027002853.db2.gz QAJFMDQKYJMURK-UHFFFAOYSA-N 1 1 360.414 2.831 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1C[C@@H](C)[N@H+](Cc2ccccc2)C[C@H]1C ZINC001158523590 1027051422 /nfs/dbraw/zinc/05/14/22/1027051422.db2.gz MHVVUUQMGARVTF-HUUCEWRRSA-N 1 1 356.426 2.636 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC[C@H](CO)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001158920249 1027192638 /nfs/dbraw/zinc/19/26/38/1027192638.db2.gz YIAQITKFTOEPBY-ROJDOSBLSA-N 1 1 356.426 2.785 20 5 FFBDMO CCOC(=O)C1=C(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[NH2+]C1 ZINC001159459543 1027398317 /nfs/dbraw/zinc/39/83/17/1027398317.db2.gz NACHYPYVCDZENK-UHFFFAOYSA-N 1 1 368.393 2.879 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001160097831 1027589090 /nfs/dbraw/zinc/58/90/90/1027589090.db2.gz KNMXLXVNVODENF-IEBWSBKVSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160097831 1027589101 /nfs/dbraw/zinc/58/91/01/1027589101.db2.gz KNMXLXVNVODENF-IEBWSBKVSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160097831 1027589113 /nfs/dbraw/zinc/58/91/13/1027589113.db2.gz KNMXLXVNVODENF-IEBWSBKVSA-N 1 1 357.454 2.607 20 5 FFBDMO [NH3+]CCc1cn(-c2ccc(-c3ccccc3[N+](=O)[O-])nn2)c2ccncc12 ZINC001160951239 1027940236 /nfs/dbraw/zinc/94/02/36/1027940236.db2.gz AUFXGIASBCQRHI-UHFFFAOYSA-N 1 1 360.377 2.892 20 5 FFBDMO Cc1ccccc1C[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000957547594 1028323473 /nfs/dbraw/zinc/32/34/73/1028323473.db2.gz KWQVSWSFCWTDNQ-RTBURBONSA-N 1 1 371.481 2.865 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCc5ccccc5[C@@H]4C3)cnc2c1 ZINC001155091025 1028574192 /nfs/dbraw/zinc/57/41/92/1028574192.db2.gz ICCDEQCWROTWFE-IBGZPJMESA-N 1 1 361.405 2.957 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-] ZINC001164145997 1029184589 /nfs/dbraw/zinc/18/45/89/1029184589.db2.gz LNTCBVAYDNVDNT-CYBMUJFWSA-N 1 1 362.430 2.620 20 5 FFBDMO COc1ncc([N+](=O)[O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)n1 ZINC001164486407 1029292122 /nfs/dbraw/zinc/29/21/22/1029292122.db2.gz NXIBBNPFEFKSLE-OWCLPIDISA-N 1 1 369.425 2.716 20 5 FFBDMO COc1ncc([N+](=O)[O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)n1 ZINC001164486405 1029292930 /nfs/dbraw/zinc/29/29/30/1029292930.db2.gz NXIBBNPFEFKSLE-BZUAXINKSA-N 1 1 369.425 2.716 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cccc(C(F)F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494805 1029298075 /nfs/dbraw/zinc/29/80/75/1029298075.db2.gz TXJSACIZPFZHAT-HUUCEWRRSA-N 1 1 367.396 2.666 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C(C)(C)C1 ZINC001156837486 1029370113 /nfs/dbraw/zinc/37/01/13/1029370113.db2.gz UXNDLPMTOWWNAL-HNNXBMFYSA-N 1 1 351.422 2.858 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1cc([N+](=O)[O-])cc[n+]1[O-] ZINC001165180687 1029435486 /nfs/dbraw/zinc/43/54/86/1029435486.db2.gz DJOKKRVZWNATSW-CRAIPNDOSA-N 1 1 356.426 2.575 20 5 FFBDMO Cc1ccc(-c2ccc(N3C[C@H]4CCC[N@H+](C)[C@@H]4C3)nn2)cc1[N+](=O)[O-] ZINC001157269197 1029530012 /nfs/dbraw/zinc/53/00/12/1029530012.db2.gz ASLXSVVQUDUPGZ-CRAIPNDOSA-N 1 1 353.426 2.891 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@]2(CCCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782506209 1029724250 /nfs/dbraw/zinc/72/42/50/1029724250.db2.gz CDBSSJJJGXRTSA-GOSISDBHSA-N 1 1 365.405 2.955 20 5 FFBDMO Cc1nn(C[NH+]2CCC(Oc3cnccn3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000782893153 1029848228 /nfs/dbraw/zinc/84/82/28/1029848228.db2.gz KNHQRUTUJGITQB-UHFFFAOYSA-N 1 1 368.397 2.544 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ncc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001165200069 1029887151 /nfs/dbraw/zinc/88/71/51/1029887151.db2.gz AXTLKXFJIPZBKG-UONOGXRCSA-N 1 1 371.397 2.997 20 5 FFBDMO CC(C)(C(=O)O[C@H]1CCC[N@@H+](Cc2ccccc2)C1)n1cc([N+](=O)[O-])cn1 ZINC000783441070 1030097458 /nfs/dbraw/zinc/09/74/58/1030097458.db2.gz RPSMYKZOXNFJOG-KRWDZBQOSA-N 1 1 372.425 2.734 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](Cn1nc(C)c3cc([N+](=O)[O-])cnc31)CC2 ZINC000783981403 1030387348 /nfs/dbraw/zinc/38/73/48/1030387348.db2.gz VJPNMDNVPBWSFM-UHFFFAOYSA-N 1 1 367.409 2.715 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000842621123 1030839275 /nfs/dbraw/zinc/83/92/75/1030839275.db2.gz XTVVKGGYPJXOIO-JKSUJKDBSA-N 1 1 372.425 2.806 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000842621123 1030839292 /nfs/dbraw/zinc/83/92/92/1030839292.db2.gz XTVVKGGYPJXOIO-JKSUJKDBSA-N 1 1 372.425 2.806 20 5 FFBDMO C[C@]1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000799014539 1031614611 /nfs/dbraw/zinc/61/46/11/1031614611.db2.gz IFUCXYUREGTXDC-HXUWFJFHSA-N 1 1 369.421 2.942 20 5 FFBDMO C[C@]1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000799014539 1031614617 /nfs/dbraw/zinc/61/46/17/1031614617.db2.gz IFUCXYUREGTXDC-HXUWFJFHSA-N 1 1 369.421 2.942 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000799153841 1031669674 /nfs/dbraw/zinc/66/96/74/1031669674.db2.gz AXONWFPFLWTVEB-BIMQEMHKSA-N 1 1 373.457 2.867 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cc(F)ccc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530772 1031788655 /nfs/dbraw/zinc/78/86/55/1031788655.db2.gz QONAUQBJTBOIBV-GDBMZVCRSA-N 1 1 367.396 2.539 20 5 FFBDMO Nc1cc2nc3ccccc3nc2cc1NC(=O)c1cnc(C[NH3+])s1 ZINC001218858749 1033382213 /nfs/dbraw/zinc/38/22/13/1033382213.db2.gz GGTFBOSRXHZAGK-UHFFFAOYSA-N 1 1 350.407 2.533 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000830838114 1033813491 /nfs/dbraw/zinc/81/34/91/1033813491.db2.gz JOWWGQDRRCRQQD-MRXNPFEDSA-N 1 1 366.437 2.650 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C)[N@H+](CCOC)[C@@H](C)C1 ZINC000831822703 1034309249 /nfs/dbraw/zinc/30/92/49/1034309249.db2.gz LMJFFVOXCRFMOS-OKILXGFUSA-N 1 1 364.446 2.730 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3cccnc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001225633444 1034344967 /nfs/dbraw/zinc/34/49/67/1034344967.db2.gz RVQKYKVAAXMVJG-LESCRADOSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3cccnc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225633444 1034344977 /nfs/dbraw/zinc/34/49/77/1034344977.db2.gz RVQKYKVAAXMVJG-LESCRADOSA-N 1 1 353.378 2.743 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]1[N@H+]2C ZINC001228759046 1036308066 /nfs/dbraw/zinc/30/80/66/1036308066.db2.gz RQRDYGMUCDVLFD-SPGJAERMSA-N 1 1 354.790 2.794 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3cc(Br)cc([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001229140401 1036518504 /nfs/dbraw/zinc/51/85/04/1036518504.db2.gz AIXFSYVBMPSQOB-FZZIBODNSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cc(Br)cc([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001229140401 1036518510 /nfs/dbraw/zinc/51/85/10/1036518510.db2.gz AIXFSYVBMPSQOB-FZZIBODNSA-N 1 1 355.188 2.540 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3c(C)cc(F)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001229200108 1036548263 /nfs/dbraw/zinc/54/82/63/1036548263.db2.gz CUVJDIIHPGWXFK-TTZDDIAXSA-N 1 1 352.362 2.588 20 5 FFBDMO CC(=O)Cc1c(F)c(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)ccc1[N+](=O)[O-] ZINC001230796013 1037361747 /nfs/dbraw/zinc/36/17/47/1037361747.db2.gz GGQSATHDZJVCOP-IVWMJMPLSA-N 1 1 350.390 2.975 20 5 FFBDMO Cc1nc(-c2ccccc2)n(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1 ZINC001256060025 1038349706 /nfs/dbraw/zinc/34/97/06/1038349706.db2.gz TYTAEUCHCBTLEK-UHFFFAOYSA-N 1 1 367.413 2.653 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@@H]3CCCN(C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256085211 1038371340 /nfs/dbraw/zinc/37/13/40/1038371340.db2.gz LSIBMBZDGGGKCU-HNNXBMFYSA-N 1 1 362.474 2.504 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCC(=O)[C@H](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093258 1038379183 /nfs/dbraw/zinc/37/91/83/1038379183.db2.gz IWVGGPLQZFXDJQ-CQSZACIVSA-N 1 1 361.442 2.873 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](CO)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256094254 1038379935 /nfs/dbraw/zinc/37/99/35/1038379935.db2.gz WKTZUANCYQFWIM-OAHLLOKOSA-N 1 1 363.458 2.667 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCO[C@H](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101622 1038387304 /nfs/dbraw/zinc/38/73/04/1038387304.db2.gz PTAUPCKVWZBOOQ-IBGZPJMESA-N 1 1 363.458 2.929 20 5 FFBDMO Cc1sc(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258132378 1039207889 /nfs/dbraw/zinc/20/78/89/1039207889.db2.gz TVZKMPOVPIPNIC-AOOOYVTPSA-N 1 1 352.416 2.666 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@@H]3CC[C@@H](C)CN3)CC2)ccc1[N+](=O)[O-] ZINC001246111251 1039245216 /nfs/dbraw/zinc/24/52/16/1039245216.db2.gz IPBGZKHFIYZNTA-ZBFHGGJFSA-N 1 1 362.474 2.550 20 5 FFBDMO COc1cc(N2CCC(NC[C@@H]3CC[C@@H](C)C[NH2+]3)CC2)ccc1[N+](=O)[O-] ZINC001246111251 1039245230 /nfs/dbraw/zinc/24/52/30/1039245230.db2.gz IPBGZKHFIYZNTA-ZBFHGGJFSA-N 1 1 362.474 2.550 20 5 FFBDMO CN(C)c1cccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC001248210572 1040174124 /nfs/dbraw/zinc/17/41/24/1040174124.db2.gz SRDWBBDWZCILNK-INIZCTEOSA-N 1 1 353.382 2.953 20 5 FFBDMO Cn1ncc2ccc(-c3noc([C@H]([NH3+])Cc4cccc([N+](=O)[O-])c4)n3)cc21 ZINC001248209794 1040174777 /nfs/dbraw/zinc/17/47/77/1040174777.db2.gz XDAWBQIONMHIRJ-OAHLLOKOSA-N 1 1 364.365 2.774 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553321 1040793913 /nfs/dbraw/zinc/79/39/13/1040793913.db2.gz VAFVKUUTJKZTQE-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553321 1040793926 /nfs/dbraw/zinc/79/39/26/1040793926.db2.gz VAFVKUUTJKZTQE-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO COc1cc(O[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ccn1 ZINC001254605391 1040834673 /nfs/dbraw/zinc/83/46/73/1040834673.db2.gz BNQXGHOGWQDNMU-FUHWJXTLSA-N 1 1 355.394 2.619 20 5 FFBDMO COc1ccnc(N([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)c1 ZINC001254610555 1040840451 /nfs/dbraw/zinc/84/04/51/1040840451.db2.gz KXWHRSATCLBPEK-GOSISDBHSA-N 1 1 368.437 2.724 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001262652524 1041776340 /nfs/dbraw/zinc/77/63/40/1041776340.db2.gz ISXNBCQMDFCIPY-GFCCVEGCSA-N 1 1 370.247 2.500 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC001309742319 1043505201 /nfs/dbraw/zinc/50/52/01/1043505201.db2.gz NDFMODMDYMMLFL-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001312380989 1044104659 /nfs/dbraw/zinc/10/46/59/1044104659.db2.gz NNPPDLDNXDAGFG-CQSZACIVSA-N 1 1 354.838 2.574 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cccc3ccccc32)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480105 1044663027 /nfs/dbraw/zinc/66/30/27/1044663027.db2.gz BDEANLURLOATTP-QZTJIDSGSA-N 1 1 353.422 2.634 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001318633323 1044779979 /nfs/dbraw/zinc/77/99/79/1044779979.db2.gz SYBOBPMTOSAQRL-CZUORRHYSA-N 1 1 365.861 2.832 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2C(=O)OCCn2cc([N+](=O)[O-])cn2)c1 ZINC001319351906 1045120436 /nfs/dbraw/zinc/12/04/36/1045120436.db2.gz VPZCNQNDJOEZHZ-SFHVURJKSA-N 1 1 372.425 2.698 20 5 FFBDMO Cc1cccc(C[N@H+]2CCCC[C@H]2C(=O)OCCn2cc([N+](=O)[O-])cn2)c1 ZINC001319351906 1045120439 /nfs/dbraw/zinc/12/04/39/1045120439.db2.gz VPZCNQNDJOEZHZ-SFHVURJKSA-N 1 1 372.425 2.698 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001319691114 1045240952 /nfs/dbraw/zinc/24/09/52/1045240952.db2.gz NAAVHYQBGHARSX-QZTJIDSGSA-N 1 1 372.400 2.979 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]CC(=O)NCC(C)C)o2)c([N+](=O)[O-])c1 ZINC001319952116 1045312563 /nfs/dbraw/zinc/31/25/63/1045312563.db2.gz YCHYJSJELJNIMD-UHFFFAOYSA-N 1 1 361.398 2.725 20 5 FFBDMO CCc1nn(C)c(N2CCC[N@@H+](Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC001320506261 1045421363 /nfs/dbraw/zinc/42/13/63/1045421363.db2.gz DRDBCJXJEGJMCZ-UHFFFAOYSA-N 1 1 357.458 2.911 20 5 FFBDMO Cc1ccc(C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(Cl)c1 ZINC001282294976 1045483715 /nfs/dbraw/zinc/48/37/15/1045483715.db2.gz JXWFIVXMIZCHBD-GDBMZVCRSA-N 1 1 367.877 2.888 20 5 FFBDMO CN(CC(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1)c1ccccc1[N+](=O)[O-] ZINC001287947051 1047376912 /nfs/dbraw/zinc/37/69/12/1047376912.db2.gz MBEGCCNMOFOMOV-QGZVFWFLSA-N 1 1 374.485 2.944 20 5 FFBDMO CC(C)[N@@H+](C)CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001541604309 1071126093 /nfs/dbraw/zinc/12/60/93/1071126093.db2.gz OZQPALQBTCDAMX-UHFFFAOYSA-N 1 1 358.446 2.794 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001342093198 1050687021 /nfs/dbraw/zinc/68/70/21/1050687021.db2.gz ZOBZQNCYVRCBOM-GFCCVEGCSA-N 1 1 355.341 2.507 20 5 FFBDMO C[C@H](NC(=O)[C@@]1([NH+](C)C)COc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC001303552583 1051385385 /nfs/dbraw/zinc/38/53/85/1051385385.db2.gz KHSHATNSWDLZSO-XOBRGWDASA-N 1 1 369.421 2.708 20 5 FFBDMO C[N@@H+](CCC(C)(C)C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001307874215 1052358806 /nfs/dbraw/zinc/35/88/06/1052358806.db2.gz KMSHAXMWCLDOKR-UHFFFAOYSA-N 1 1 362.474 2.611 20 5 FFBDMO COc1ccc(COC(=O)c2ccn(-c3cc[nH+]cc3)n2)cc1[N+](=O)[O-] ZINC001343824372 1052438948 /nfs/dbraw/zinc/43/89/48/1052438948.db2.gz XZABDVGWXHAMSP-UHFFFAOYSA-N 1 1 354.322 2.541 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC001309059994 1052547640 /nfs/dbraw/zinc/54/76/40/1052547640.db2.gz KGVTURDNGKIXRU-HUUCEWRRSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001336570423 1054068087 /nfs/dbraw/zinc/06/80/87/1054068087.db2.gz TZBLCDHSJFGOKG-CHWSQXEVSA-N 1 1 374.441 2.991 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccncc2)cc1[N+](=O)[O-] ZINC001352243237 1055303048 /nfs/dbraw/zinc/30/30/48/1055303048.db2.gz UENXEFUJBXQIKZ-GOSISDBHSA-N 1 1 368.437 2.969 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccncc2)cc1[N+](=O)[O-] ZINC001352243237 1055303065 /nfs/dbraw/zinc/30/30/65/1055303065.db2.gz UENXEFUJBXQIKZ-GOSISDBHSA-N 1 1 368.437 2.969 20 5 FFBDMO CCn1c(CCc2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@@H+](CC)CC1 ZINC001356592621 1055602576 /nfs/dbraw/zinc/60/25/76/1055602576.db2.gz SGORBJGYJQGDKZ-UHFFFAOYSA-N 1 1 372.473 2.523 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC001339317274 1056323352 /nfs/dbraw/zinc/32/33/52/1056323352.db2.gz MFLUBWLKUGMFDL-LNSITVRQSA-N 1 1 351.834 2.637 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001544800937 1071694291 /nfs/dbraw/zinc/69/42/91/1071694291.db2.gz NWGITZHFLSMTDI-INIZCTEOSA-N 1 1 351.422 2.999 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1cnn(-c2cc[nH+]cc2)c1 ZINC001519093354 1058621355 /nfs/dbraw/zinc/62/13/55/1058621355.db2.gz XTJBWITUDMAGAO-UHFFFAOYSA-N 1 1 357.757 2.759 20 5 FFBDMO CC[N@H+]1CCC[C@H]1Cn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001502281605 1058808641 /nfs/dbraw/zinc/80/86/41/1058808641.db2.gz KDOURYFIHRZLNT-SFHVURJKSA-N 1 1 370.457 2.542 20 5 FFBDMO COc1ccc(CNCC2([NH+](C)C)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC001200723751 1059246651 /nfs/dbraw/zinc/24/66/51/1059246651.db2.gz JELQYAICCLXTOS-UHFFFAOYSA-N 1 1 355.438 2.792 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c1 ZINC000848478556 1060110384 /nfs/dbraw/zinc/11/03/84/1060110384.db2.gz JZSTZRNCYRESQA-MRXNPFEDSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c1 ZINC000848478556 1060110391 /nfs/dbraw/zinc/11/03/91/1060110391.db2.gz JZSTZRNCYRESQA-MRXNPFEDSA-N 1 1 352.398 2.949 20 5 FFBDMO CC[N@H+](CCc1nccs1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848482270 1060117432 /nfs/dbraw/zinc/11/74/32/1060117432.db2.gz KXFASTQGMFVSSQ-INIZCTEOSA-N 1 1 374.466 2.889 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848482270 1060117436 /nfs/dbraw/zinc/11/74/36/1060117436.db2.gz KXFASTQGMFVSSQ-INIZCTEOSA-N 1 1 374.466 2.889 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000848490239 1060145324 /nfs/dbraw/zinc/14/53/24/1060145324.db2.gz XUXSHLQLLNQREB-RDJZCZTQSA-N 1 1 365.380 2.989 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000848490239 1060145336 /nfs/dbraw/zinc/14/53/36/1060145336.db2.gz XUXSHLQLLNQREB-RDJZCZTQSA-N 1 1 365.380 2.989 20 5 FFBDMO C[C@@H](Cc1cccs1)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001459628812 1060785013 /nfs/dbraw/zinc/78/50/13/1060785013.db2.gz PZTDBXJDOIFXPI-ZDUSSCGKSA-N 1 1 368.480 2.993 20 5 FFBDMO C[C@@H](Cc1cccs1)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001459628812 1060785027 /nfs/dbraw/zinc/78/50/27/1060785027.db2.gz PZTDBXJDOIFXPI-ZDUSSCGKSA-N 1 1 368.480 2.993 20 5 FFBDMO Cc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)cn2cc[nH+]c12 ZINC001460478804 1061002311 /nfs/dbraw/zinc/00/23/11/1061002311.db2.gz DICGUJFATUTEKA-UHFFFAOYSA-N 1 1 368.349 2.965 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H](CO)c1ccccc1 ZINC001460693201 1061063343 /nfs/dbraw/zinc/06/33/43/1061063343.db2.gz RYWAFLYHLPDBRV-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H](CO)c1ccccc1 ZINC001460693201 1061063358 /nfs/dbraw/zinc/06/33/58/1061063358.db2.gz RYWAFLYHLPDBRV-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1cc([C@@H]2CCCC[N@@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837712 1061123280 /nfs/dbraw/zinc/12/32/80/1061123280.db2.gz YIRKRWGEUSLJEE-HOCLYGCPSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1cc([C@@H]2CCCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837712 1061123292 /nfs/dbraw/zinc/12/32/92/1061123292.db2.gz YIRKRWGEUSLJEE-HOCLYGCPSA-N 1 1 360.414 2.593 20 5 FFBDMO C[C@H]1CC[C@](CO)([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccccc21 ZINC001460944259 1061158686 /nfs/dbraw/zinc/15/86/86/1061158686.db2.gz FSPUJIQUCPSIRO-RNODOKPDSA-N 1 1 369.421 2.568 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@]1(CO)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC001460961606 1061167129 /nfs/dbraw/zinc/16/71/29/1061167129.db2.gz XSWQZDGVQOYXBZ-FQEVSTJZSA-N 1 1 369.421 2.907 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC001526656351 1061206144 /nfs/dbraw/zinc/20/61/44/1061206144.db2.gz PZENGRXWGLQVCU-RTBURBONSA-N 1 1 353.422 2.947 20 5 FFBDMO Cc1c(C[NH2+]Cc2cc(S(C)(=O)=O)ccc2F)cccc1[N+](=O)[O-] ZINC001461461081 1061325024 /nfs/dbraw/zinc/32/50/24/1061325024.db2.gz QNKBBFNNAYTJMA-UHFFFAOYSA-N 1 1 352.387 2.736 20 5 FFBDMO COc1ccnc(N2CC[NH+](Cc3c(C)ccc([N+](=O)[O-])c3C)CC2)c1 ZINC001461891410 1061440723 /nfs/dbraw/zinc/44/07/23/1061440723.db2.gz FFEILSLJTLKRFO-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[N@@H+](CCCO)C1 ZINC001476666328 1061455270 /nfs/dbraw/zinc/45/52/70/1061455270.db2.gz XTRCBDFNPSBJMH-LBPRGKRZSA-N 1 1 370.837 2.525 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001527560669 1061530381 /nfs/dbraw/zinc/53/03/81/1061530381.db2.gz JWAHECXFCVDSHZ-UHFFFAOYSA-N 1 1 373.457 2.547 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001462256094 1061558779 /nfs/dbraw/zinc/55/87/79/1061558779.db2.gz CATGIWBYDKTURJ-IBGZPJMESA-N 1 1 369.421 2.534 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001462256094 1061558797 /nfs/dbraw/zinc/55/87/97/1061558797.db2.gz CATGIWBYDKTURJ-IBGZPJMESA-N 1 1 369.421 2.534 20 5 FFBDMO NC(=O)OC[C@@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001462351033 1061589603 /nfs/dbraw/zinc/58/96/03/1061589603.db2.gz ZITSTUQHIWUYCX-CYBMUJFWSA-N 1 1 370.365 2.946 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001528151329 1061776279 /nfs/dbraw/zinc/77/62/79/1061776279.db2.gz AQFKBSTXNSIMIA-KBAYOESNSA-N 1 1 360.458 2.855 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC001478578285 1062054153 /nfs/dbraw/zinc/05/41/53/1062054153.db2.gz SPVKNCDXXVPRQV-CYBMUJFWSA-N 1 1 374.363 2.849 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@H]2CCC[N@@H+]2CC(C)C)c([N+](=O)[O-])c1 ZINC001465291125 1063040701 /nfs/dbraw/zinc/04/07/01/1063040701.db2.gz JZANQTJUSQSLCT-QGZVFWFLSA-N 1 1 362.474 2.942 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001440641110 1063323685 /nfs/dbraw/zinc/32/36/85/1063323685.db2.gz XENHDISBRMYEOO-JTQLQIEISA-N 1 1 372.828 2.964 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@H]2C[N@H+](C)CC2(C)C)cc1[N+](=O)[O-] ZINC001472025871 1064896929 /nfs/dbraw/zinc/89/69/29/1064896929.db2.gz HJYGFRLPJMBKIL-ZDUSSCGKSA-N 1 1 370.247 2.736 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC001472025488 1064897795 /nfs/dbraw/zinc/89/77/95/1064897795.db2.gz CCPOCWIPACFORG-AWEZNQCLSA-N 1 1 360.439 2.788 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001472581569 1065103325 /nfs/dbraw/zinc/10/33/25/1065103325.db2.gz ADBSSKOIIFVVKU-SNVBAGLBSA-N 1 1 355.341 2.505 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001472581569 1065103331 /nfs/dbraw/zinc/10/33/31/1065103331.db2.gz ADBSSKOIIFVVKU-SNVBAGLBSA-N 1 1 355.341 2.505 20 5 FFBDMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001472581568 1065103393 /nfs/dbraw/zinc/10/33/93/1065103393.db2.gz ADBSSKOIIFVVKU-JTQLQIEISA-N 1 1 355.341 2.505 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001472581568 1065103404 /nfs/dbraw/zinc/10/34/04/1065103404.db2.gz ADBSSKOIIFVVKU-JTQLQIEISA-N 1 1 355.341 2.505 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001472730614 1065136301 /nfs/dbraw/zinc/13/63/01/1065136301.db2.gz QTXADVJAYKCAKS-CYBMUJFWSA-N 1 1 373.413 2.863 20 5 FFBDMO Cc1nc(CC2CC[NH+]([C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC001473816201 1065375730 /nfs/dbraw/zinc/37/57/30/1065375730.db2.gz XWYBSCONBGOLJL-GFCCVEGCSA-N 1 1 373.413 2.568 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001473879669 1065402147 /nfs/dbraw/zinc/40/21/47/1065402147.db2.gz SWKQULHVTPPQBB-STQMWFEESA-N 1 1 358.398 2.985 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ncccc1C ZINC001473879787 1065402348 /nfs/dbraw/zinc/40/23/48/1065402348.db2.gz MPNUVFLTTAYWDE-CHWSQXEVSA-N 1 1 358.398 2.985 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(C[NH3+])[nH]c3c2)c1 ZINC001579392669 1078624957 /nfs/dbraw/zinc/62/49/57/1078624957.db2.gz DNLMPGLGVLNDMQ-UHFFFAOYSA-N 1 1 357.395 2.904 20 5 FFBDMO Cc1ccc(OCCN(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC001579728483 1078670914 /nfs/dbraw/zinc/67/09/14/1078670914.db2.gz UVFGXVBPDILVPW-LJQANCHMSA-N 1 1 357.410 2.615 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2)c1C ZINC001556824401 1075778885 /nfs/dbraw/zinc/77/88/85/1075778885.db2.gz FQJCEGAHCWRDEY-UHFFFAOYSA-N 1 1 352.354 2.627 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001557282224 1075833483 /nfs/dbraw/zinc/83/34/83/1075833483.db2.gz RXYGOPRXDIHHKV-HNNXBMFYSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001557282224 1075833486 /nfs/dbraw/zinc/83/34/86/1075833486.db2.gz RXYGOPRXDIHHKV-HNNXBMFYSA-N 1 1 364.402 2.614 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)n1 ZINC001559157234 1076130671 /nfs/dbraw/zinc/13/06/71/1076130671.db2.gz CJWDNBTYBUJZMX-UHFFFAOYSA-N 1 1 355.442 2.821 20 5 FFBDMO C[C@H]1CN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC001559166980 1076131585 /nfs/dbraw/zinc/13/15/85/1076131585.db2.gz LUQQZTQCEYJPDL-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC001559852555 1076196419 /nfs/dbraw/zinc/19/64/19/1076196419.db2.gz SQMADBUNLDTUOF-AWEZNQCLSA-N 1 1 372.263 2.950 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H]2CC3(CO2)CCCCC3)CC1 ZINC001559888602 1076199736 /nfs/dbraw/zinc/19/97/36/1076199736.db2.gz ANGJGBQNCPAUNG-INIZCTEOSA-N 1 1 360.458 2.851 20 5 FFBDMO C[C@H](O)C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC001559953129 1076206901 /nfs/dbraw/zinc/20/69/01/1076206901.db2.gz IFUDMXHXKJSILD-VIFPVBQESA-N 1 1 352.778 2.643 20 5 FFBDMO C[C@H](O)C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC001559953129 1076206904 /nfs/dbraw/zinc/20/69/04/1076206904.db2.gz IFUDMXHXKJSILD-VIFPVBQESA-N 1 1 352.778 2.643 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C[N@H+]1Cc1ccccc1 ZINC001566338702 1076948242 /nfs/dbraw/zinc/94/82/42/1076948242.db2.gz QCLCYRVGQOFNFO-UKRRQHHQSA-N 1 1 354.410 2.570 20 5 FFBDMO Cc1cc(C)cc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001568085217 1077070457 /nfs/dbraw/zinc/07/04/57/1077070457.db2.gz SSHVMTMIVXRWJY-RTBURBONSA-N 1 1 359.470 2.687 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCCC[N@H+]1C ZINC001585855719 1079505756 /nfs/dbraw/zinc/50/57/56/1079505756.db2.gz MKUDNGPTQJKGIS-WCQYABFASA-N 1 1 355.822 2.616 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC001586215144 1079576815 /nfs/dbraw/zinc/57/68/15/1079576815.db2.gz URBQPJXJKKEKFC-KDURUIRLSA-N 1 1 358.442 2.583 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055478 1079728656 /nfs/dbraw/zinc/72/86/56/1079728656.db2.gz RQAPGHDYCLIYBK-RHSMWYFYSA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055478 1079728660 /nfs/dbraw/zinc/72/86/60/1079728660.db2.gz RQAPGHDYCLIYBK-RHSMWYFYSA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1)[N@@H+](C)Cc1ccccc1 ZINC001589877125 1080825788 /nfs/dbraw/zinc/82/57/88/1080825788.db2.gz MBNSDAZKQTZRHF-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590075517 1080991441 /nfs/dbraw/zinc/99/14/41/1080991441.db2.gz FVLNMOACUZUYKS-LBPRGKRZSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590189136 1081079199 /nfs/dbraw/zinc/07/91/99/1081079199.db2.gz VJWSVSVQACSCJU-OKILXGFUSA-N 1 1 373.461 2.945 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001590227874 1081108016 /nfs/dbraw/zinc/10/80/16/1081108016.db2.gz TYEXLYDSSSQAKE-GUTXKFCHSA-N 1 1 371.445 2.617 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590260054 1081128507 /nfs/dbraw/zinc/12/85/07/1081128507.db2.gz LRBANQKIMFEIJD-NSHDSACASA-N 1 1 365.463 2.903 20 5 FFBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000093646634 250039201 /nfs/dbraw/zinc/03/92/01/250039201.db2.gz OJTOOUOATZAZCU-NNTYKDFWSA-N 1 1 352.456 2.896 20 5 FFBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000093646634 250039205 /nfs/dbraw/zinc/03/92/05/250039205.db2.gz OJTOOUOATZAZCU-NNTYKDFWSA-N 1 1 352.456 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639091 250040198 /nfs/dbraw/zinc/04/01/98/250040198.db2.gz YBZOQNDGQFZZMT-UKRRQHHQSA-N 1 1 351.447 2.774 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186822021 251270863 /nfs/dbraw/zinc/27/08/63/251270863.db2.gz VTUXEYGUZITVAG-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCSC2(CCOCC2)C1 ZINC000186822021 251270865 /nfs/dbraw/zinc/27/08/65/251270865.db2.gz VTUXEYGUZITVAG-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO Cc1cc(C)n(CCC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000272552852 252065998 /nfs/dbraw/zinc/06/59/98/252065998.db2.gz RQHSOJHFURBPJV-GOSISDBHSA-N 1 1 368.441 2.911 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccnc1Cl ZINC000273402700 252298791 /nfs/dbraw/zinc/29/87/91/252298791.db2.gz GQTLKGYRWBOCFF-LLVKDONJSA-N 1 1 369.830 2.768 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000033837140 208100938 /nfs/dbraw/zinc/10/09/38/208100938.db2.gz ICAFRERHFPMZMS-BWTRYIQHSA-N 1 1 351.406 2.889 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000276294469 256087664 /nfs/dbraw/zinc/08/76/64/256087664.db2.gz MHJQGPSNJNRFSZ-ZDUSSCGKSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)[C@H]2C1 ZINC000277262016 256177652 /nfs/dbraw/zinc/17/76/52/256177652.db2.gz LMAHMWCHWYPUNE-GWCFXTLKSA-N 1 1 368.231 2.524 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000278430108 256312088 /nfs/dbraw/zinc/31/20/88/256312088.db2.gz CYGFRFPWNGESIH-BBRMVZONSA-N 1 1 371.441 2.521 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000278726089 256341777 /nfs/dbraw/zinc/34/17/77/256341777.db2.gz LKYSBAUHXIGMGR-CQSZACIVSA-N 1 1 362.430 2.620 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000279204721 256392624 /nfs/dbraw/zinc/39/26/24/256392624.db2.gz ONEKNMLPEMFHMO-GOSISDBHSA-N 1 1 359.426 2.591 20 5 FFBDMO Cc1ccc(CNc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cc1[N+](=O)[O-] ZINC000278847047 256354307 /nfs/dbraw/zinc/35/43/07/256354307.db2.gz DRKDLMSAXSDMKV-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279068061 256377981 /nfs/dbraw/zinc/37/79/81/256377981.db2.gz AFDVCQPSQOVAFL-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279068061 256377982 /nfs/dbraw/zinc/37/79/82/256377982.db2.gz AFDVCQPSQOVAFL-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2ncnc3sc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000286264043 257028402 /nfs/dbraw/zinc/02/84/02/257028402.db2.gz WACCMDZBHQWFGI-PHIMTYICSA-N 1 1 351.432 2.511 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@H]2C1 ZINC000286492304 257039735 /nfs/dbraw/zinc/03/97/35/257039735.db2.gz TXFMIZAAQNCUHW-YOEHRIQHSA-N 1 1 366.421 2.823 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000286720109 257051472 /nfs/dbraw/zinc/05/14/72/257051472.db2.gz DZDRDQIESMUGSV-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO CC(=O)c1cc(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)ccc1[N+](=O)[O-] ZINC000286912503 257061689 /nfs/dbraw/zinc/06/16/89/257061689.db2.gz PPOFEFNRGURPNQ-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1CC(C)(C)O ZINC000289514835 257284917 /nfs/dbraw/zinc/28/49/17/257284917.db2.gz BXHDKFWNAYAEBP-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO NC(=O)c1ccnc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)c1[N+](=O)[O-] ZINC000290569808 257342552 /nfs/dbraw/zinc/34/25/52/257342552.db2.gz TYNJEFUYHJZAKP-UHFFFAOYSA-N 1 1 366.381 2.908 20 5 FFBDMO Cc1cc(CNC(=O)NCc2ccc([N+](=O)[O-])cc2)cc(N2CCCC2)[nH+]1 ZINC000290659056 257350367 /nfs/dbraw/zinc/35/03/67/257350367.db2.gz JIOWARDCIMMGNW-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000301145175 258028492 /nfs/dbraw/zinc/02/84/92/258028492.db2.gz AIFONBSYEGNFKK-CYBMUJFWSA-N 1 1 369.487 2.921 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1[N+](=O)[O-] ZINC000299460723 257996150 /nfs/dbraw/zinc/99/61/50/257996150.db2.gz YPAICDYBNOLKHE-CYBMUJFWSA-N 1 1 371.441 2.931 20 5 FFBDMO Cc1cc(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000302044766 258084331 /nfs/dbraw/zinc/08/43/31/258084331.db2.gz JXNAEXQIZIBVGB-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO C[C@@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1CCO ZINC000302345025 258099238 /nfs/dbraw/zinc/09/92/38/258099238.db2.gz ASUFLWHLFYCZRA-SECBINFHSA-N 1 1 367.755 2.770 20 5 FFBDMO C[C@@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1CCO ZINC000302345025 258099240 /nfs/dbraw/zinc/09/92/40/258099240.db2.gz ASUFLWHLFYCZRA-SECBINFHSA-N 1 1 367.755 2.770 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000302568637 258106390 /nfs/dbraw/zinc/10/63/90/258106390.db2.gz XXHTXVRDPQRFPF-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC000302635984 258107156 /nfs/dbraw/zinc/10/71/56/258107156.db2.gz KGPZOQWAAACSOA-CQSZACIVSA-N 1 1 367.471 2.675 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000302635984 258107157 /nfs/dbraw/zinc/10/71/57/258107157.db2.gz KGPZOQWAAACSOA-CQSZACIVSA-N 1 1 367.471 2.675 20 5 FFBDMO CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C[C@H](C)O ZINC000301428785 258049305 /nfs/dbraw/zinc/04/93/05/258049305.db2.gz FEGREVFYOMLCKL-NWDGAFQWSA-N 1 1 361.364 2.895 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301884069 258072466 /nfs/dbraw/zinc/07/24/66/258072466.db2.gz LJRFXFMTTPJLRQ-MJBXVCDLSA-N 1 1 369.487 2.777 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000331900399 258205215 /nfs/dbraw/zinc/20/52/15/258205215.db2.gz GWUCUGCCKBAICO-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NCC3=CC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000332055480 258211771 /nfs/dbraw/zinc/21/17/71/258211771.db2.gz NDZDUYLTQFCAIO-HNNXBMFYSA-N 1 1 372.469 2.823 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000332485928 258231899 /nfs/dbraw/zinc/23/18/99/258231899.db2.gz AWAGWPRYPZUFAR-STQMWFEESA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1C ZINC000332608925 258237177 /nfs/dbraw/zinc/23/71/77/258237177.db2.gz BEIAPZKVXFXAJR-YPMHNXCESA-N 1 1 360.439 2.931 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378192618 512631774 /nfs/dbraw/zinc/63/17/74/512631774.db2.gz UGJVYPACLFYAHK-STQMWFEESA-N 1 1 368.231 2.714 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000373055644 512151315 /nfs/dbraw/zinc/15/13/15/512151315.db2.gz FVSDIZIZDXHBNC-CQSZACIVSA-N 1 1 369.425 2.605 20 5 FFBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000065866108 506382235 /nfs/dbraw/zinc/38/22/35/506382235.db2.gz QYYKLQPSOQHJDJ-HNNXBMFYSA-N 1 1 368.437 2.570 20 5 FFBDMO C[NH+](C)[C@@H](C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000066046460 506416443 /nfs/dbraw/zinc/41/64/43/506416443.db2.gz VRTCATGMKCIIOW-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000054202847 506511504 /nfs/dbraw/zinc/51/15/04/506511504.db2.gz LMPOXWGSLHMWQP-CYBMUJFWSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000054202847 506511512 /nfs/dbraw/zinc/51/15/12/506511512.db2.gz LMPOXWGSLHMWQP-CYBMUJFWSA-N 1 1 358.373 2.980 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000041577872 506532949 /nfs/dbraw/zinc/53/29/49/506532949.db2.gz UOWDLRQZRFVFMQ-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2ccccc2C1 ZINC000054761452 506615684 /nfs/dbraw/zinc/61/56/84/506615684.db2.gz QKLCZARINNGGCZ-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO COC(=O)[C@H]1CCC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000066834572 506657741 /nfs/dbraw/zinc/65/77/41/506657741.db2.gz HKNKYNWBEQBXBS-AAEUAGOBSA-N 1 1 360.370 2.591 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000066834572 506657748 /nfs/dbraw/zinc/65/77/48/506657748.db2.gz HKNKYNWBEQBXBS-AAEUAGOBSA-N 1 1 360.370 2.591 20 5 FFBDMO O=C(NC1CC1)[C@H]([NH2+]CCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000010172887 506730916 /nfs/dbraw/zinc/73/09/16/506730916.db2.gz KTFUYCADOBTHJY-GOSISDBHSA-N 1 1 372.400 2.755 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000067446448 506885122 /nfs/dbraw/zinc/88/51/22/506885122.db2.gz YDSHKAVAMZZYSF-ZDUSSCGKSA-N 1 1 353.378 2.884 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000045428730 506966174 /nfs/dbraw/zinc/96/61/74/506966174.db2.gz RNTWFJOFYYOENN-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c2c(c1)COCO2 ZINC000375409672 512311614 /nfs/dbraw/zinc/31/16/14/512311614.db2.gz XTDGGIQZHTYIEE-GFCCVEGCSA-N 1 1 372.381 2.711 20 5 FFBDMO COc1ccc(CC(=O)NCCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000067905186 507046356 /nfs/dbraw/zinc/04/63/56/507046356.db2.gz YWDNDQVSSIKENZ-UHFFFAOYSA-N 1 1 363.458 2.917 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000068184705 507140619 /nfs/dbraw/zinc/14/06/19/507140619.db2.gz XEAPLLMVNNIJCA-IBGZPJMESA-N 1 1 369.421 2.754 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000057148227 507184936 /nfs/dbraw/zinc/18/49/36/507184936.db2.gz SCVHEPWTLFHNJR-HZSPNIEDSA-N 1 1 369.487 2.777 20 5 FFBDMO C[C@@H](CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[N@@H+](C)C1CC1 ZINC000057713364 507315128 /nfs/dbraw/zinc/31/51/28/507315128.db2.gz JADQBLIHSSIBRQ-HNNXBMFYSA-N 1 1 363.461 2.754 20 5 FFBDMO C[C@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000025631845 507516404 /nfs/dbraw/zinc/51/64/04/507516404.db2.gz YRMBRTZAXOMTOG-OAHLLOKOSA-N 1 1 369.421 2.537 20 5 FFBDMO C[C@@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000025632891 507517965 /nfs/dbraw/zinc/51/79/65/507517965.db2.gz IXJWELOMULQXOG-HNNXBMFYSA-N 1 1 369.421 2.537 20 5 FFBDMO COC(=O)[C@]1(C)C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425445125 513570193 /nfs/dbraw/zinc/57/01/93/513570193.db2.gz OPFHZCMQWUROTE-MEBBXXQBSA-N 1 1 371.231 2.988 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000061495118 507615801 /nfs/dbraw/zinc/61/58/01/507615801.db2.gz QPHNBLRBNWTMKD-MRXNPFEDSA-N 1 1 360.414 2.799 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[NH+](CCOc3ccccc3)CC2)nc2sccn21 ZINC000070790713 507638328 /nfs/dbraw/zinc/63/83/28/507638328.db2.gz RIADSQLHZKLLNU-UHFFFAOYSA-N 1 1 373.438 2.505 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000063483197 507737424 /nfs/dbraw/zinc/73/74/24/507737424.db2.gz CKBWWDRXSJJLLF-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000063483197 507737425 /nfs/dbraw/zinc/73/74/25/507737425.db2.gz CKBWWDRXSJJLLF-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1ccccc1N1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000051120992 507740591 /nfs/dbraw/zinc/74/05/91/507740591.db2.gz QOTFXIYSUQHKPE-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO CC[N@H+](Cc1ccc(OC)cc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051406162 507768841 /nfs/dbraw/zinc/76/88/41/507768841.db2.gz VBDWORKFHITATA-KRWDZBQOSA-N 1 1 360.410 2.865 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@H](c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000029536831 507782334 /nfs/dbraw/zinc/78/23/34/507782334.db2.gz OSGJICNXADHORM-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000029536831 507782337 /nfs/dbraw/zinc/78/23/37/507782337.db2.gz OSGJICNXADHORM-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(C(=O)NC2CC2)cc1 ZINC000052561184 507813968 /nfs/dbraw/zinc/81/39/68/507813968.db2.gz HCHGZNPNHIBPNG-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO CC(=O)c1ccc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643908 507853317 /nfs/dbraw/zinc/85/33/17/507853317.db2.gz LIZOKBMDPBKRFD-ROUUACIJSA-N 1 1 369.421 2.845 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000078454786 507872238 /nfs/dbraw/zinc/87/22/38/507872238.db2.gz VCVUUOXESSPTNO-INIZCTEOSA-N 1 1 360.458 2.798 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000107891508 507872966 /nfs/dbraw/zinc/87/29/66/507872966.db2.gz STIAYMQLRSDGTE-MRXNPFEDSA-N 1 1 363.461 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H]3CN3CCOCC3)co2)cc1 ZINC000089906137 507881303 /nfs/dbraw/zinc/88/13/03/507881303.db2.gz KGCKSSFSGNEORW-SFHVURJKSA-N 1 1 372.425 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]3CN3CCOCC3)co2)cc1 ZINC000089906137 507881305 /nfs/dbraw/zinc/88/13/05/507881305.db2.gz KGCKSSFSGNEORW-SFHVURJKSA-N 1 1 372.425 2.546 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000089923393 507883841 /nfs/dbraw/zinc/88/38/41/507883841.db2.gz ODFLULWFXRFLCB-LJQANCHMSA-N 1 1 368.437 2.898 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000108336564 507887465 /nfs/dbraw/zinc/88/74/65/507887465.db2.gz BSYAUIIRFYCGIO-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO Cc1cnc(NCc2ccc(C[NH+]3CCN(C)CC3)cc2)c([N+](=O)[O-])c1 ZINC000078630958 507891642 /nfs/dbraw/zinc/89/16/42/507891642.db2.gz KLNAUANOCDLIBE-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000108818995 507920029 /nfs/dbraw/zinc/92/00/29/507920029.db2.gz NLXRFVOHDFARJP-CHWSQXEVSA-N 1 1 373.457 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCN(CC(F)(F)F)CC2)cc1 ZINC000079482813 507966830 /nfs/dbraw/zinc/96/68/30/507966830.db2.gz VLNDLOOWIVLLRY-UHFFFAOYSA-N 1 1 361.364 2.934 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](CCCO)CC(C)(C)C)cccc1[N+](=O)[O-] ZINC000109747818 507984367 /nfs/dbraw/zinc/98/43/67/507984367.db2.gz OUKDITAXSYAVNE-UHFFFAOYSA-N 1 1 351.447 2.962 20 5 FFBDMO C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[N@@H+]1CCc2ccccc2C1 ZINC000110048670 508003370 /nfs/dbraw/zinc/00/33/70/508003370.db2.gz HXIOMAILIGEVKM-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2ccccc2C1 ZINC000110048670 508003372 /nfs/dbraw/zinc/00/33/72/508003372.db2.gz HXIOMAILIGEVKM-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO COC(=O)CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000074321136 508012051 /nfs/dbraw/zinc/01/20/51/508012051.db2.gz SJSXKYDSPGPNRN-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000079927693 508016554 /nfs/dbraw/zinc/01/65/54/508016554.db2.gz AEODEMXAFFDFST-BETUJISGSA-N 1 1 359.430 2.611 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000110356106 508023320 /nfs/dbraw/zinc/02/33/20/508023320.db2.gz PTHLVRLZDWVDHG-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000110594725 508036222 /nfs/dbraw/zinc/03/62/22/508036222.db2.gz VCOIMBDDVOKJOO-AWEZNQCLSA-N 1 1 356.426 2.887 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3c[nH]nc3-c3cccnc3)CC2)c1 ZINC000092048103 508037826 /nfs/dbraw/zinc/03/78/26/508037826.db2.gz MOAXVVWDHBXVDB-UHFFFAOYSA-N 1 1 364.409 2.702 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1 ZINC000110870867 508052313 /nfs/dbraw/zinc/05/23/13/508052313.db2.gz FHGMUNRHBXPDAI-UHFFFAOYSA-N 1 1 373.457 2.683 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000111239338 508080983 /nfs/dbraw/zinc/08/09/83/508080983.db2.gz GXZZUNAYIQDSQO-CYBMUJFWSA-N 1 1 355.394 2.883 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000111239338 508080984 /nfs/dbraw/zinc/08/09/84/508080984.db2.gz GXZZUNAYIQDSQO-CYBMUJFWSA-N 1 1 355.394 2.883 20 5 FFBDMO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CCC2 ZINC000111311413 508088869 /nfs/dbraw/zinc/08/88/69/508088869.db2.gz XACVAXQPJYVDAF-CQSZACIVSA-N 1 1 360.439 2.968 20 5 FFBDMO Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CCC2 ZINC000111311413 508088871 /nfs/dbraw/zinc/08/88/71/508088871.db2.gz XACVAXQPJYVDAF-CQSZACIVSA-N 1 1 360.439 2.968 20 5 FFBDMO C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000111480057 508103217 /nfs/dbraw/zinc/10/32/17/508103217.db2.gz ZMILJPGJYZMGOK-HNNXBMFYSA-N 1 1 356.426 2.915 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1O ZINC000080962236 508117741 /nfs/dbraw/zinc/11/77/41/508117741.db2.gz MISIRGLETGVNGK-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO Cc1ccc([C@@H]2CCC[C@@H]2[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075886703 508140478 /nfs/dbraw/zinc/14/04/78/508140478.db2.gz VBPIHOAOPHWRNW-FHWLQOOXSA-N 1 1 358.442 2.729 20 5 FFBDMO COc1ccc(C[N@H+](CCO)Cc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000093363718 508142746 /nfs/dbraw/zinc/14/27/46/508142746.db2.gz YYEYHAWCTPTRRH-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(C[N@@H+](CCO)Cc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000093363718 508142749 /nfs/dbraw/zinc/14/27/49/508142749.db2.gz YYEYHAWCTPTRRH-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC(C)(CO)CO ZINC000093502488 508146911 /nfs/dbraw/zinc/14/69/11/508146911.db2.gz LTMDVPSIHATEQT-UHFFFAOYSA-N 1 1 368.817 2.931 20 5 FFBDMO CC(=O)Nc1ccccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534766 508148143 /nfs/dbraw/zinc/14/81/43/508148143.db2.gz FVULVTLCALYBTF-OAHLLOKOSA-N 1 1 355.398 2.635 20 5 FFBDMO Cc1cccc([C@@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1C ZINC000075999871 508150302 /nfs/dbraw/zinc/15/03/02/508150302.db2.gz CDZSQJOJSNPEKF-HKUYNNGSSA-N 1 1 358.442 2.996 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000081363967 508167833 /nfs/dbraw/zinc/16/78/33/508167833.db2.gz HXHDWGDSCQYJST-INIZCTEOSA-N 1 1 374.485 2.999 20 5 FFBDMO C[N@H+](CC1CC1)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000081631140 508199246 /nfs/dbraw/zinc/19/92/46/508199246.db2.gz XQIJFZQYUGZUNY-INIZCTEOSA-N 1 1 360.458 2.587 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000081631140 508199249 /nfs/dbraw/zinc/19/92/49/508199249.db2.gz XQIJFZQYUGZUNY-INIZCTEOSA-N 1 1 360.458 2.587 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000076490164 508213342 /nfs/dbraw/zinc/21/33/42/508213342.db2.gz DYWIUZWJTYFHGC-RDTXWAMCSA-N 1 1 371.441 2.583 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000076494679 508213839 /nfs/dbraw/zinc/21/38/39/508213839.db2.gz KCRJZGKSXVGWCM-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000076494679 508213841 /nfs/dbraw/zinc/21/38/41/508213841.db2.gz KCRJZGKSXVGWCM-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1c[nH+]c(N(C)C)n1C ZINC000083738134 508256014 /nfs/dbraw/zinc/25/60/14/508256014.db2.gz ARFCELNEZKCSIB-UHFFFAOYSA-N 1 1 374.445 2.515 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000101956833 508261957 /nfs/dbraw/zinc/26/19/57/508261957.db2.gz UDSAECPBUSEPIP-NSHDSACASA-N 1 1 355.822 2.616 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114643274 508333545 /nfs/dbraw/zinc/33/35/45/508333545.db2.gz BHPXKJJIEZMVNR-GOSISDBHSA-N 1 1 353.422 2.918 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000115640058 508420622 /nfs/dbraw/zinc/42/06/22/508420622.db2.gz VDCCLMSEVGPAFL-PBHICJAKSA-N 1 1 364.446 2.853 20 5 FFBDMO COc1ccc(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)cc1[N+](=O)[O-] ZINC000156730029 508469409 /nfs/dbraw/zinc/46/94/09/508469409.db2.gz XJPSCMYLPGNHBK-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000157119641 508525999 /nfs/dbraw/zinc/52/59/99/508525999.db2.gz LRPCHFGOGCROIL-CRAIPNDOSA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@@H](CCS(C)(=O)=O)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134572914 508547868 /nfs/dbraw/zinc/54/78/68/508547868.db2.gz GOAHNRYOHWQYPA-NSHDSACASA-N 1 1 369.468 2.631 20 5 FFBDMO Cc1cc(=O)n(Cc2cn3cc(Br)ccc3[nH+]2)cc1[N+](=O)[O-] ZINC000128453405 508595462 /nfs/dbraw/zinc/59/54/62/508595462.db2.gz JCGHTLGLAJDOJS-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](O)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000157689277 508597528 /nfs/dbraw/zinc/59/75/28/508597528.db2.gz OTLLBBSCRGFELL-INIZCTEOSA-N 1 1 358.394 2.749 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000157689277 508597529 /nfs/dbraw/zinc/59/75/29/508597529.db2.gz OTLLBBSCRGFELL-INIZCTEOSA-N 1 1 358.394 2.749 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000153581555 508602532 /nfs/dbraw/zinc/60/25/32/508602532.db2.gz LTZXVXYXQGKPJV-JKSUJKDBSA-N 1 1 364.490 2.528 20 5 FFBDMO CN1CC[NH+](Cc2ccc(C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000118869157 508689189 /nfs/dbraw/zinc/68/91/89/508689189.db2.gz HEQJNFFGXMKUFB-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000119036180 508711532 /nfs/dbraw/zinc/71/15/32/508711532.db2.gz UNMXMMYRDXQWRK-BEFAXECRSA-N 1 1 368.437 2.915 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000154086512 508713906 /nfs/dbraw/zinc/71/39/06/508713906.db2.gz DTQKPJAORGWDIM-HOCLYGCPSA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000123822153 508743737 /nfs/dbraw/zinc/74/37/37/508743737.db2.gz QWWJLNYJTOPESM-AWEZNQCLSA-N 1 1 358.442 2.999 20 5 FFBDMO CC1CCN(C[C@H](O)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000158871914 508762345 /nfs/dbraw/zinc/76/23/45/508762345.db2.gz CIQYNACYRXVKCD-MOPGFXCFSA-N 1 1 361.486 2.598 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129778868 508765523 /nfs/dbraw/zinc/76/55/23/508765523.db2.gz CMIUPKJKCHUGME-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129778868 508765526 /nfs/dbraw/zinc/76/55/26/508765526.db2.gz CMIUPKJKCHUGME-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000123977975 508766468 /nfs/dbraw/zinc/76/64/68/508766468.db2.gz GICDPHFVCUAYNX-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000130730220 508837845 /nfs/dbraw/zinc/83/78/45/508837845.db2.gz OCEWOJOQKMLFTK-CZUORRHYSA-N 1 1 367.421 2.601 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000154866018 508872633 /nfs/dbraw/zinc/87/26/33/508872633.db2.gz SKHWNSKDDDJBCZ-MRXNPFEDSA-N 1 1 364.446 2.868 20 5 FFBDMO O=C(NCc1ccco1)[C@H]1CCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000124744016 508878415 /nfs/dbraw/zinc/87/84/15/508878415.db2.gz IPJXFCZZWDINLW-GOSISDBHSA-N 1 1 373.409 2.738 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(C(F)(F)F)cc3)CC2)n1 ZINC000124819255 508889273 /nfs/dbraw/zinc/88/92/73/508889273.db2.gz SBDJWHUIDYYLQH-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150864049 508910854 /nfs/dbraw/zinc/91/08/54/508910854.db2.gz SZEIADVYHFSSKX-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150864049 508910859 /nfs/dbraw/zinc/91/08/59/508910859.db2.gz SZEIADVYHFSSKX-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000120090230 508925983 /nfs/dbraw/zinc/92/59/83/508925983.db2.gz LOJMHLQHYSOPHM-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1CCOC ZINC000120262190 508960403 /nfs/dbraw/zinc/96/04/03/508960403.db2.gz ZLCKVFXEPXIQAV-HNNXBMFYSA-N 1 1 364.446 2.786 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000120657729 509040022 /nfs/dbraw/zinc/04/00/22/509040022.db2.gz FSVCBBZGPPYXPH-QGZVFWFLSA-N 1 1 360.458 2.701 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000160924376 509049060 /nfs/dbraw/zinc/04/90/60/509049060.db2.gz RAACVOPIQJTVPI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000161927636 509164974 /nfs/dbraw/zinc/16/49/74/509164974.db2.gz NZZAUIHXTMPWOB-CJNGLKHVSA-N 1 1 374.441 2.620 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)C(C)(C)C2)n1 ZINC000191804445 509189136 /nfs/dbraw/zinc/18/91/36/509189136.db2.gz IRRUFMTVIFMVGU-UHFFFAOYSA-N 1 1 371.441 2.548 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)n1 ZINC000191804445 509189143 /nfs/dbraw/zinc/18/91/43/509189143.db2.gz IRRUFMTVIFMVGU-UHFFFAOYSA-N 1 1 371.441 2.548 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000185489082 509202534 /nfs/dbraw/zinc/20/25/34/509202534.db2.gz MQERTBADZRWEQA-LBPRGKRZSA-N 1 1 358.427 2.582 20 5 FFBDMO CNS(=O)(=O)c1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266834962 509218769 /nfs/dbraw/zinc/21/87/69/509218769.db2.gz FIKLNUUZERGXDH-QWHCGFSZSA-N 1 1 363.439 2.915 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000248122462 509238837 /nfs/dbraw/zinc/23/88/37/509238837.db2.gz FWXBQMVUJQFKKJ-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000248122462 509238847 /nfs/dbraw/zinc/23/88/47/509238847.db2.gz FWXBQMVUJQFKKJ-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000248122462 509238856 /nfs/dbraw/zinc/23/88/56/509238856.db2.gz FWXBQMVUJQFKKJ-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000191992784 509281922 /nfs/dbraw/zinc/28/19/22/509281922.db2.gz URHOUCZHHLDDBR-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO O=C(NC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1)C1CC1 ZINC000179157864 509293868 /nfs/dbraw/zinc/29/38/68/509293868.db2.gz CBFBQGUMQRQDGF-UHFFFAOYSA-N 1 1 370.409 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](C4OCCO4)C3)co2)cc1 ZINC000179184161 509308081 /nfs/dbraw/zinc/30/80/81/509308081.db2.gz NRCHKNSNBRCEBT-AWEZNQCLSA-N 1 1 359.382 2.835 20 5 FFBDMO COCCO[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000179335641 509381745 /nfs/dbraw/zinc/38/17/45/509381745.db2.gz MEQLBIDWGWJUOA-QGZVFWFLSA-N 1 1 361.398 2.877 20 5 FFBDMO COCCO[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000179335641 509381753 /nfs/dbraw/zinc/38/17/53/509381753.db2.gz MEQLBIDWGWJUOA-QGZVFWFLSA-N 1 1 361.398 2.877 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000267276379 509423668 /nfs/dbraw/zinc/42/36/68/509423668.db2.gz UHCRAJVONBJKLG-LSDHHAIUSA-N 1 1 360.458 2.904 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000185938379 509437529 /nfs/dbraw/zinc/43/75/29/509437529.db2.gz BNONDLCJFYFDKF-ILXRZTDVSA-N 1 1 364.446 2.766 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H]1CC[N@H+](CC)C[C@@H]1C ZINC000173256896 509483321 /nfs/dbraw/zinc/48/33/21/509483321.db2.gz GVPRHDCWBZJQQA-BBRMVZONSA-N 1 1 369.487 2.508 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000189298187 509507856 /nfs/dbraw/zinc/50/78/56/509507856.db2.gz JREIMLMRCMWELA-KRWDZBQOSA-N 1 1 356.422 2.998 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183029260 509556550 /nfs/dbraw/zinc/55/65/50/509556550.db2.gz CLVYCIKZBKRTBV-KBPBESRZSA-N 1 1 367.471 2.526 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000192707291 509606607 /nfs/dbraw/zinc/60/66/07/509606607.db2.gz STGGKVIMXMAJIM-QGZVFWFLSA-N 1 1 360.410 2.613 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000264661642 509631181 /nfs/dbraw/zinc/63/11/81/509631181.db2.gz SHKWKEKJURDRNM-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000249286378 509646920 /nfs/dbraw/zinc/64/69/20/509646920.db2.gz LREYSRGJQDMBAE-MNZLEMJZSA-N 1 1 357.458 2.538 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000249414175 509675552 /nfs/dbraw/zinc/67/55/52/509675552.db2.gz GCQYBJXYJDXULF-IMJJTQAJSA-N 1 1 364.446 2.766 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000249414175 509675562 /nfs/dbraw/zinc/67/55/62/509675562.db2.gz GCQYBJXYJDXULF-IMJJTQAJSA-N 1 1 364.446 2.766 20 5 FFBDMO CCCNC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000179924030 509675546 /nfs/dbraw/zinc/67/55/46/509675546.db2.gz LEQFLROTGOIFNV-UHFFFAOYSA-N 1 1 371.384 2.934 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1C ZINC000173667909 509709352 /nfs/dbraw/zinc/70/93/52/509709352.db2.gz JQIZYUOBFLULIS-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO O=C(c1cc(N2CCC(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000264805437 509715560 /nfs/dbraw/zinc/71/55/60/509715560.db2.gz CXOOYLRXTFILLU-UHFFFAOYSA-N 1 1 369.425 2.938 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189723648 509721396 /nfs/dbraw/zinc/72/13/96/509721396.db2.gz YORINFGROGLUSP-QGZVFWFLSA-N 1 1 368.437 2.914 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000268099100 509755043 /nfs/dbraw/zinc/75/50/43/509755043.db2.gz ASOOFFUYXKDJJT-ZDUSSCGKSA-N 1 1 364.402 2.519 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H](O)COCc1ccccc1 ZINC000177070452 509852541 /nfs/dbraw/zinc/85/25/41/509852541.db2.gz GUOPJHHOKCCLKB-INIZCTEOSA-N 1 1 371.393 2.746 20 5 FFBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H](O)COCc1ccccc1 ZINC000177070452 509852550 /nfs/dbraw/zinc/85/25/50/509852550.db2.gz GUOPJHHOKCCLKB-INIZCTEOSA-N 1 1 371.393 2.746 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1SC ZINC000177073637 509854929 /nfs/dbraw/zinc/85/49/29/509854929.db2.gz VURIHQHJSWRKDB-MNOVXSKESA-N 1 1 365.455 2.680 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268474556 509954143 /nfs/dbraw/zinc/95/41/43/509954143.db2.gz JDANDBFOPYEHEY-NSHDSACASA-N 1 1 357.252 2.920 20 5 FFBDMO C[C@@]([NH2+]CCOc1cccc([N+](=O)[O-])c1)(C(N)=O)c1cccc(Cl)c1 ZINC000177406429 510041547 /nfs/dbraw/zinc/04/15/47/510041547.db2.gz MCWLSFKHWHCIHN-KRWDZBQOSA-N 1 1 363.801 2.617 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000174346947 510071033 /nfs/dbraw/zinc/07/10/33/510071033.db2.gz PAHTYBFDNHQLLF-JLJPHGGASA-N 1 1 354.472 2.941 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000180724414 510074591 /nfs/dbraw/zinc/07/45/91/510074591.db2.gz QXNSEPSQROWBMY-ZDUSSCGKSA-N 1 1 374.466 2.881 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000174411711 510101905 /nfs/dbraw/zinc/10/19/05/510101905.db2.gz KXXJYULOXDTIDE-AWEZNQCLSA-N 1 1 373.457 2.911 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000174526098 510161360 /nfs/dbraw/zinc/16/13/60/510161360.db2.gz ICNIFBROMZCDNS-ZIAGYGMSSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CCN(C2CCC2)CC1 ZINC000269001131 510185563 /nfs/dbraw/zinc/18/55/63/510185563.db2.gz LMJBIDAPUXVMQS-CQSZACIVSA-N 1 1 360.458 2.918 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)cs1 ZINC000265760802 510215212 /nfs/dbraw/zinc/21/52/12/510215212.db2.gz JUECEDWMOBRPBH-IRXDYDNUSA-N 1 1 361.467 2.629 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000269091043 510231379 /nfs/dbraw/zinc/23/13/79/510231379.db2.gz LAHYQIPGLPIXIU-ZWNOBZJWSA-N 1 1 355.236 2.673 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1 ZINC000194183568 510253312 /nfs/dbraw/zinc/25/33/12/510253312.db2.gz BAYJMXZEOYJAND-UHFFFAOYSA-N 1 1 354.410 2.831 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC000174738453 510283398 /nfs/dbraw/zinc/28/33/98/510283398.db2.gz RYFKKCFKKGWBLO-HOTGVXAUSA-N 1 1 350.806 2.643 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782394 510307406 /nfs/dbraw/zinc/30/74/06/510307406.db2.gz RYRGAODWMDIWLJ-CJNGLKHVSA-N 1 1 359.430 2.807 20 5 FFBDMO CCOC(=O)[C@H](C)[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000190843240 510369947 /nfs/dbraw/zinc/36/99/47/510369947.db2.gz AWGYBSSFUQGFPQ-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000190843240 510369953 /nfs/dbraw/zinc/36/99/53/510369953.db2.gz AWGYBSSFUQGFPQ-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCC[C@@H]1O ZINC000181424466 510401865 /nfs/dbraw/zinc/40/18/65/510401865.db2.gz JJWOKJULEMPVBO-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCC[C@@H]1O ZINC000181424466 510401874 /nfs/dbraw/zinc/40/18/74/510401874.db2.gz JJWOKJULEMPVBO-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000175037492 510451547 /nfs/dbraw/zinc/45/15/47/510451547.db2.gz RFDAARZQRIDTCS-DLBZAZTESA-N 1 1 372.469 2.894 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000171920532 510452638 /nfs/dbraw/zinc/45/26/38/510452638.db2.gz GQMOIIADDAALNZ-AWEZNQCLSA-N 1 1 359.348 2.968 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000194653606 510465892 /nfs/dbraw/zinc/46/58/92/510465892.db2.gz NXVSYCAZYJHFED-GOSISDBHSA-N 1 1 369.421 2.884 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266241815 510478995 /nfs/dbraw/zinc/47/89/95/510478995.db2.gz HGYNXSJUIYXFFZ-OLZOCXBDSA-N 1 1 357.332 2.970 20 5 FFBDMO CC(C)(C)OC(=O)C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000269635369 510491372 /nfs/dbraw/zinc/49/13/72/510491372.db2.gz HCRGLHJIDJFUSX-INIZCTEOSA-N 1 1 350.415 2.682 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246653359 510602786 /nfs/dbraw/zinc/60/27/86/510602786.db2.gz JKNIMFFTAQNWCI-CHWSQXEVSA-N 1 1 350.419 2.699 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2CCC2CCCCC2)c1 ZINC000246732936 510641366 /nfs/dbraw/zinc/64/13/66/510641366.db2.gz GHNBWRONIIIFGP-FUHWJXTLSA-N 1 1 350.463 2.977 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC[C@@H]2Cn2c(C)nc3ccccc32)c1[N+](=O)[O-] ZINC000270024862 510642349 /nfs/dbraw/zinc/64/23/49/510642349.db2.gz AHIWMTFDBZPYSQ-CYBMUJFWSA-N 1 1 368.397 2.589 20 5 FFBDMO COc1ccc(OCC[N@H+](C)C2CC[NH+](C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000266534653 510643138 /nfs/dbraw/zinc/64/31/38/510643138.db2.gz NRRBBEQUCAQNEJ-UHFFFAOYSA-N 1 1 351.447 2.787 20 5 FFBDMO COc1ccc(OCC[N@H+](C)C2CCN(C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000266534653 510643142 /nfs/dbraw/zinc/64/31/42/510643142.db2.gz NRRBBEQUCAQNEJ-UHFFFAOYSA-N 1 1 351.447 2.787 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C2CCN(C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000266534653 510643144 /nfs/dbraw/zinc/64/31/44/510643144.db2.gz NRRBBEQUCAQNEJ-UHFFFAOYSA-N 1 1 351.447 2.787 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)[C@@H](C)C1 ZINC000246787356 510674808 /nfs/dbraw/zinc/67/48/08/510674808.db2.gz MJGLHZHQYKHUHG-JSGCOSHPSA-N 1 1 369.487 2.832 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172423313 510720136 /nfs/dbraw/zinc/72/01/36/510720136.db2.gz PXOLSUTVVJWPQJ-UHFFFAOYSA-N 1 1 362.386 2.594 20 5 FFBDMO COc1ccc(CNC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000266685895 510729112 /nfs/dbraw/zinc/72/91/12/510729112.db2.gz DLKYZUXPJGSSHN-HNNXBMFYSA-N 1 1 364.446 2.619 20 5 FFBDMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1cccc([N+](=O)[O-])c1 ZINC000175749381 510769845 /nfs/dbraw/zinc/76/98/45/510769845.db2.gz SLALJMKNPADOAE-IBGZPJMESA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1cccc([N+](=O)[O-])c1 ZINC000175749381 510769852 /nfs/dbraw/zinc/76/98/52/510769852.db2.gz SLALJMKNPADOAE-IBGZPJMESA-N 1 1 369.421 2.502 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182190858 510805241 /nfs/dbraw/zinc/80/52/41/510805241.db2.gz XSQHAFXZJKPYRE-MRXNPFEDSA-N 1 1 360.410 2.654 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000182193825 510807399 /nfs/dbraw/zinc/80/73/99/510807399.db2.gz LDQAQDAADJNGLO-GOSISDBHSA-N 1 1 370.405 2.829 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000247069444 510825090 /nfs/dbraw/zinc/82/50/90/510825090.db2.gz UTPWFSWXVHGRIE-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000247069444 510825095 /nfs/dbraw/zinc/82/50/95/510825095.db2.gz UTPWFSWXVHGRIE-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000185445793 510846531 /nfs/dbraw/zinc/84/65/31/510846531.db2.gz ACSHSMIDNNQRIO-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000185445793 510846532 /nfs/dbraw/zinc/84/65/32/510846532.db2.gz ACSHSMIDNNQRIO-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000185445793 510846534 /nfs/dbraw/zinc/84/65/34/510846534.db2.gz ACSHSMIDNNQRIO-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000185445793 510846536 /nfs/dbraw/zinc/84/65/36/510846536.db2.gz ACSHSMIDNNQRIO-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO COc1cc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000247220590 510853028 /nfs/dbraw/zinc/85/30/28/510853028.db2.gz MHGPJHSWEVKVNP-AAEUAGOBSA-N 1 1 371.384 2.873 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000360306198 510894487 /nfs/dbraw/zinc/89/44/87/510894487.db2.gz SWLRGOVHKKUYKE-AWEZNQCLSA-N 1 1 357.414 2.537 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)C1 ZINC000293925717 510901359 /nfs/dbraw/zinc/90/13/59/510901359.db2.gz PWSLZSASJVOIQW-FQEVSTJZSA-N 1 1 366.421 2.825 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277684189 510969603 /nfs/dbraw/zinc/96/96/03/510969603.db2.gz IXBLRBUQGGRYQJ-CQSZACIVSA-N 1 1 365.433 2.544 20 5 FFBDMO COCC[N@H+]1CC[C@@H](NC(=O)c2cccc3c(=O)c4ccccc4[nH]c23)C1 ZINC000277684189 510969607 /nfs/dbraw/zinc/96/96/07/510969607.db2.gz IXBLRBUQGGRYQJ-CQSZACIVSA-N 1 1 365.433 2.544 20 5 FFBDMO CN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285608394 510976662 /nfs/dbraw/zinc/97/66/62/510976662.db2.gz VQDKBRFGTFTBGI-PBWFPOADSA-N 1 1 366.849 2.744 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n1 ZINC000285651503 510995286 /nfs/dbraw/zinc/99/52/86/510995286.db2.gz MIQCLRLJRGLHOC-CQSZACIVSA-N 1 1 363.349 2.591 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n1 ZINC000285651503 510995292 /nfs/dbraw/zinc/99/52/92/510995292.db2.gz MIQCLRLJRGLHOC-CQSZACIVSA-N 1 1 363.349 2.591 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000286348313 511023087 /nfs/dbraw/zinc/02/30/87/511023087.db2.gz FJUJMJBFHZJIAG-SAYFZHNOSA-N 1 1 356.382 2.500 20 5 FFBDMO Cc1ccc(CN2CCC([NH+]3CCN(C(C)C)CC3)CC2)cc1[N+](=O)[O-] ZINC000271184713 511112216 /nfs/dbraw/zinc/11/22/16/511112216.db2.gz DLBLSYSSGNTKFR-UHFFFAOYSA-N 1 1 360.502 2.894 20 5 FFBDMO CCOC(=O)C1(O)CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000271199103 511117025 /nfs/dbraw/zinc/11/70/25/511117025.db2.gz OUEGTSZLMMYXCT-UHFFFAOYSA-N 1 1 374.393 2.745 20 5 FFBDMO C[C@H](NCC1([NH+]2CCCCC2)CCOCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294611029 511119698 /nfs/dbraw/zinc/11/96/98/511119698.db2.gz DSGHYJMNLHSDKN-HNNXBMFYSA-N 1 1 362.474 2.863 20 5 FFBDMO Cc1cc([C@@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)oc1C ZINC000282876955 511144076 /nfs/dbraw/zinc/14/40/76/511144076.db2.gz VNPKKBPNQZOKQM-GFCCVEGCSA-N 1 1 352.412 2.929 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NC2CC[NH+](C3CCCC3)CC2)s1 ZINC000271398225 511190567 /nfs/dbraw/zinc/19/05/67/511190567.db2.gz NGMGWBJCEGRHOW-UHFFFAOYSA-N 1 1 373.500 2.879 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000295081154 511274784 /nfs/dbraw/zinc/27/47/84/511274784.db2.gz IFTSOZQSFIEDBR-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000295086471 511277413 /nfs/dbraw/zinc/27/74/13/511277413.db2.gz WEHRWERVOHPAFS-HNNXBMFYSA-N 1 1 361.442 2.748 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)CC23CCOCC3)cn1 ZINC000295108539 511284814 /nfs/dbraw/zinc/28/48/14/511284814.db2.gz IEDSCLMWRWKCJN-MRXNPFEDSA-N 1 1 374.416 2.864 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1cccc(C(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271734959 511304315 /nfs/dbraw/zinc/30/43/15/511304315.db2.gz NTEYCLVKAGHUDT-CYBMUJFWSA-N 1 1 370.409 2.586 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280355270 511434020 /nfs/dbraw/zinc/43/40/20/511434020.db2.gz JJSVBVYEDBWTGN-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000280403031 511453773 /nfs/dbraw/zinc/45/37/73/511453773.db2.gz INOIAEBSYWMZHB-CALCHBBNSA-N 1 1 355.442 2.688 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000295628479 511465032 /nfs/dbraw/zinc/46/50/32/511465032.db2.gz FQWUVILROIIUMY-UHFFFAOYSA-N 1 1 361.442 2.859 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC[N@H+](C2CCC2)C1 ZINC000292173569 511493202 /nfs/dbraw/zinc/49/32/02/511493202.db2.gz DXBCGQDBIFSGNG-CQSZACIVSA-N 1 1 374.441 2.862 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000280510801 511493585 /nfs/dbraw/zinc/49/35/85/511493585.db2.gz NNDWQAODCNDJLB-MRXNPFEDSA-N 1 1 373.409 2.531 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280558366 511510903 /nfs/dbraw/zinc/51/09/03/511510903.db2.gz UTOULCANDSLATP-ABAIWWIYSA-N 1 1 369.824 2.873 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000299222119 511556266 /nfs/dbraw/zinc/55/62/66/511556266.db2.gz IOJFTQSEYZHURT-NVXWUHKLSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccnc(OC(F)F)c2)c([N+](=O)[O-])cc1OC ZINC000283994821 511569350 /nfs/dbraw/zinc/56/93/50/511569350.db2.gz MEGQEXTYCRMWKW-UHFFFAOYSA-N 1 1 369.324 2.898 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000284076756 511597485 /nfs/dbraw/zinc/59/74/85/511597485.db2.gz RXCPKTZTEQNVAP-UHFFFAOYSA-N 1 1 366.437 2.900 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1c[nH+]c2c1C[C@H](C)[C@@H](C)C2 ZINC000296049961 511602766 /nfs/dbraw/zinc/60/27/66/511602766.db2.gz UBMOCWSCONHSMU-RYUDHWBXSA-N 1 1 358.398 2.809 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)NC1CCCCCCC1 ZINC000365821743 511669064 /nfs/dbraw/zinc/66/90/64/511669064.db2.gz RDGDPWVILFPRNI-UHFFFAOYSA-N 1 1 363.462 2.657 20 5 FFBDMO COc1cc(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350340286 511783464 /nfs/dbraw/zinc/78/34/64/511783464.db2.gz NTDZWVMAGYVCNX-PBHICJAKSA-N 1 1 360.370 2.579 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388261 511799843 /nfs/dbraw/zinc/79/98/43/511799843.db2.gz KOPBTYOSAQJPCY-CRAIPNDOSA-N 1 1 373.413 2.558 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388261 511799850 /nfs/dbraw/zinc/79/98/50/511799850.db2.gz KOPBTYOSAQJPCY-CRAIPNDOSA-N 1 1 373.413 2.558 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cccc1[N+](=O)[O-] ZINC000293076026 511830462 /nfs/dbraw/zinc/83/04/62/511830462.db2.gz VWUXABDMORVWTR-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cccc1[N+](=O)[O-] ZINC000293076026 511830463 /nfs/dbraw/zinc/83/04/63/511830463.db2.gz VWUXABDMORVWTR-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cccc1[N+](=O)[O-] ZINC000293076026 511830468 /nfs/dbraw/zinc/83/04/68/511830468.db2.gz VWUXABDMORVWTR-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000293076026 511830471 /nfs/dbraw/zinc/83/04/71/511830471.db2.gz VWUXABDMORVWTR-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000293076026 511830473 /nfs/dbraw/zinc/83/04/73/511830473.db2.gz VWUXABDMORVWTR-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366199332 511896671 /nfs/dbraw/zinc/89/66/71/511896671.db2.gz GKZBWHACVKFNKU-GOEBONIOSA-N 1 1 354.410 2.773 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293353962 511934681 /nfs/dbraw/zinc/93/46/81/511934681.db2.gz KXMZRIYPIUGQTA-LKFCYVNXSA-N 1 1 357.332 2.826 20 5 FFBDMO Cc1noc(C)c1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274836977 511958842 /nfs/dbraw/zinc/95/88/42/511958842.db2.gz NNLINJUMABTZQM-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)C2)C1 ZINC000293648796 512038310 /nfs/dbraw/zinc/03/83/10/512038310.db2.gz GTIAXIAGGCELGB-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000366478910 512045060 /nfs/dbraw/zinc/04/50/60/512045060.db2.gz FURRPZNGEFAKSK-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000366478910 512045065 /nfs/dbraw/zinc/04/50/65/512045065.db2.gz FURRPZNGEFAKSK-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO O=C1N[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]2CO1 ZINC000293680032 512049007 /nfs/dbraw/zinc/04/90/07/512049007.db2.gz AIUMIQJCSOXDSH-MFKMUULPSA-N 1 1 359.304 2.544 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]2CO1 ZINC000293680032 512049012 /nfs/dbraw/zinc/04/90/12/512049012.db2.gz AIUMIQJCSOXDSH-MFKMUULPSA-N 1 1 359.304 2.544 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000293697112 512055253 /nfs/dbraw/zinc/05/52/53/512055253.db2.gz MYQQGYANNGFEEG-AWEZNQCLSA-N 1 1 361.442 2.940 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@H]1CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411214224 512523732 /nfs/dbraw/zinc/52/37/32/512523732.db2.gz DYXGQJISWUTUEE-SFHVURJKSA-N 1 1 360.458 2.874 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411214224 512523736 /nfs/dbraw/zinc/52/37/36/512523736.db2.gz DYXGQJISWUTUEE-SFHVURJKSA-N 1 1 360.458 2.874 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(c2ccccn2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000378258584 512661862 /nfs/dbraw/zinc/66/18/62/512661862.db2.gz ISWPHODNANQSSB-UHFFFAOYSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000372013913 512678851 /nfs/dbraw/zinc/67/88/51/512678851.db2.gz ROPQQEGSHFURNJ-HNNXBMFYSA-N 1 1 354.410 2.726 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411588815 512704445 /nfs/dbraw/zinc/70/44/45/512704445.db2.gz MSJNQVBGLQKCDF-DLBZAZTESA-N 1 1 371.462 2.934 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411588815 512704448 /nfs/dbraw/zinc/70/44/48/512704448.db2.gz MSJNQVBGLQKCDF-DLBZAZTESA-N 1 1 371.462 2.934 20 5 FFBDMO CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000378406442 512742795 /nfs/dbraw/zinc/74/27/95/512742795.db2.gz UONIMWCDACWSTO-GDBMZVCRSA-N 1 1 371.441 2.626 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000374301616 512753544 /nfs/dbraw/zinc/75/35/44/512753544.db2.gz KKVJQGDKDAHADR-RTBURBONSA-N 1 1 353.422 2.741 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000368074646 512791099 /nfs/dbraw/zinc/79/10/99/512791099.db2.gz OQGBKEDJBPOFLB-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000368074646 512791102 /nfs/dbraw/zinc/79/11/02/512791102.db2.gz OQGBKEDJBPOFLB-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000370162096 512796907 /nfs/dbraw/zinc/79/69/07/512796907.db2.gz NLUHUNMLIITXJN-HNNXBMFYSA-N 1 1 354.410 2.524 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC000412060134 512937614 /nfs/dbraw/zinc/93/76/14/512937614.db2.gz DZBYMHPXGHJUJK-CQSZACIVSA-N 1 1 352.435 2.625 20 5 FFBDMO O=[N+]([O-])c1ccc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC000397484430 512946733 /nfs/dbraw/zinc/94/67/33/512946733.db2.gz AJVBFDYSFFYBAP-UHFFFAOYSA-N 1 1 373.428 2.851 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370582885 513003285 /nfs/dbraw/zinc/00/32/85/513003285.db2.gz LAIPKZQVADUZIC-QGZVFWFLSA-N 1 1 368.437 2.974 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000372903375 513096967 /nfs/dbraw/zinc/09/69/67/513096967.db2.gz ZGDIYJKRAAVNRP-CYBMUJFWSA-N 1 1 353.394 2.811 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000428553613 513128268 /nfs/dbraw/zinc/12/82/68/513128268.db2.gz XOPGYSPXHMSWAM-QGZVFWFLSA-N 1 1 359.357 2.553 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H](C)[NH+]1CCOCC1 ZINC000450313996 513137021 /nfs/dbraw/zinc/13/70/21/513137021.db2.gz SPHICFDTXLEGPV-CHWSQXEVSA-N 1 1 362.455 2.661 20 5 FFBDMO Cc1nn(C)c(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000428669514 513159032 /nfs/dbraw/zinc/15/90/32/513159032.db2.gz WDYGHKQJBZWORM-OAHLLOKOSA-N 1 1 361.471 2.666 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000439930082 513212764 /nfs/dbraw/zinc/21/27/64/513212764.db2.gz LPRHFXKOVWMZBQ-OAHLLOKOSA-N 1 1 350.419 2.797 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000412701408 513234016 /nfs/dbraw/zinc/23/40/16/513234016.db2.gz TZZRXVLAIBUSPE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000412701408 513234018 /nfs/dbraw/zinc/23/40/18/513234018.db2.gz TZZRXVLAIBUSPE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000428992588 513242805 /nfs/dbraw/zinc/24/28/05/513242805.db2.gz BHAUZZYUBWEZOP-KEYYUXOJSA-N 1 1 371.441 2.807 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](O)CO ZINC000421410934 513253139 /nfs/dbraw/zinc/25/31/39/513253139.db2.gz PVXUERLSTPGZDF-OAHLLOKOSA-N 1 1 350.440 2.887 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])C[C@@H]21 ZINC000450795724 513344626 /nfs/dbraw/zinc/34/46/26/513344626.db2.gz REUTXJAFJLOLNH-APWZRJJASA-N 1 1 351.406 2.966 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cncc(Br)c3)nc2c1 ZINC000446839301 513348013 /nfs/dbraw/zinc/34/80/13/513348013.db2.gz RIMODYFAKGUKCW-UHFFFAOYSA-N 1 1 362.187 2.918 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425000634 513360420 /nfs/dbraw/zinc/36/04/20/513360420.db2.gz ISVYHONWRMNOTD-QFBILLFUSA-N 1 1 351.406 2.941 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccc2)CC1)Nc1ncc([N+](=O)[O-])cc1F ZINC000413168587 513496389 /nfs/dbraw/zinc/49/63/89/513496389.db2.gz WWTWTGNJBMCPLX-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000435060476 513501058 /nfs/dbraw/zinc/50/10/58/513501058.db2.gz LGVWRFVUWVIYOR-UHFFFAOYSA-N 1 1 373.400 2.739 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000435060476 513501063 /nfs/dbraw/zinc/50/10/63/513501063.db2.gz LGVWRFVUWVIYOR-UHFFFAOYSA-N 1 1 373.400 2.739 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1nccc2ccc([N+](=O)[O-])cc21 ZINC000413211727 513523528 /nfs/dbraw/zinc/52/35/28/513523528.db2.gz XCPQVKKSBUPKPD-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO CCC[N@@H+](Cc1c(F)cccc1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441279918 513528625 /nfs/dbraw/zinc/52/86/25/513528625.db2.gz PUMGUPKBNXFAMK-CYBMUJFWSA-N 1 1 370.812 2.857 20 5 FFBDMO CCC[N@H+](Cc1c(F)cccc1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441279918 513528635 /nfs/dbraw/zinc/52/86/35/513528635.db2.gz PUMGUPKBNXFAMK-CYBMUJFWSA-N 1 1 370.812 2.857 20 5 FFBDMO C[N@@H+]1CCO[C@H](CN(CC2CC2)c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413239177 513540810 /nfs/dbraw/zinc/54/08/10/513540810.db2.gz MCDBZHGWBIXVIO-HNNXBMFYSA-N 1 1 356.426 2.690 20 5 FFBDMO C[N@H+]1CCO[C@H](CN(CC2CC2)c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413239177 513540818 /nfs/dbraw/zinc/54/08/18/513540818.db2.gz MCDBZHGWBIXVIO-HNNXBMFYSA-N 1 1 356.426 2.690 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CCCO1 ZINC000413262294 513555543 /nfs/dbraw/zinc/55/55/43/513555543.db2.gz JRKYXCNKVMAIQA-LLVKDONJSA-N 1 1 362.352 2.921 20 5 FFBDMO COC(=O)[C@]1(C)C[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000425445125 513570188 /nfs/dbraw/zinc/57/01/88/513570188.db2.gz OPFHZCMQWUROTE-MEBBXXQBSA-N 1 1 371.231 2.988 20 5 FFBDMO CCCC[N@@H+](C)CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000447815206 513579555 /nfs/dbraw/zinc/57/95/55/513579555.db2.gz DVNHHBUIGJNLLZ-UHFFFAOYSA-N 1 1 350.463 2.571 20 5 FFBDMO CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2OC)CC[N@H+]1CCOC ZINC000430202445 513586925 /nfs/dbraw/zinc/58/69/25/513586925.db2.gz CTDNGRFRDJNTRA-QGZVFWFLSA-N 1 1 351.447 2.536 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CN1CCOCC1)c1ccccc1 ZINC000430211498 513589926 /nfs/dbraw/zinc/58/99/26/513589926.db2.gz ALKCQPNCJHSXDR-IBGZPJMESA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC000435629701 513643729 /nfs/dbraw/zinc/64/37/29/513643729.db2.gz USVMVVUQPHTKMQ-INIZCTEOSA-N 1 1 367.471 2.670 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282849 513650183 /nfs/dbraw/zinc/65/01/83/513650183.db2.gz MDGWHMCHYJQVFP-LPHOPBHVSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282849 513650190 /nfs/dbraw/zinc/65/01/90/513650190.db2.gz MDGWHMCHYJQVFP-LPHOPBHVSA-N 1 1 360.385 2.903 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451340597 513686371 /nfs/dbraw/zinc/68/63/71/513686371.db2.gz JVXPUFXOVAKAGL-SZXPJGKVSA-N 1 1 361.442 2.937 20 5 FFBDMO CNC(=O)c1ccc(N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000413539042 513705018 /nfs/dbraw/zinc/70/50/18/513705018.db2.gz YLEHCBDCAKPNQA-OAHLLOKOSA-N 1 1 368.437 2.665 20 5 FFBDMO CC[C@@]1(O)CC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000425913690 513797117 /nfs/dbraw/zinc/79/71/17/513797117.db2.gz HCNLGULAFQXMRE-MRXNPFEDSA-N 1 1 360.357 2.594 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436246762 513806561 /nfs/dbraw/zinc/80/65/61/513806561.db2.gz MFVKXDHPKQURHP-UHFFFAOYSA-N 1 1 364.380 2.755 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCCO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000442971767 513831743 /nfs/dbraw/zinc/83/17/43/513831743.db2.gz YKIYTMUCEGZFQB-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000451566724 513838107 /nfs/dbraw/zinc/83/81/07/513838107.db2.gz OURZFUABTVMZFQ-WBMJQRKESA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000451566724 513838113 /nfs/dbraw/zinc/83/81/13/513838113.db2.gz OURZFUABTVMZFQ-WBMJQRKESA-N 1 1 365.430 2.677 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2nccnc2C)CC1 ZINC000443060554 513859400 /nfs/dbraw/zinc/85/94/00/513859400.db2.gz GLYDTPARDYLBLI-NTCAYCPXSA-N 1 1 353.426 2.919 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@@H]4C3)o2)cc1 ZINC000451714592 513933236 /nfs/dbraw/zinc/93/32/36/513933236.db2.gz SIBCTDXKSSOTIX-FMKPAKJESA-N 1 1 358.398 2.628 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448925122 513972328 /nfs/dbraw/zinc/97/23/28/513972328.db2.gz MCMSKMNNXXINOF-HNNXBMFYSA-N 1 1 369.425 2.527 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C ZINC000451780051 513975823 /nfs/dbraw/zinc/97/58/23/513975823.db2.gz MRLDKTZXDNKDSR-GFCCVEGCSA-N 1 1 357.838 2.916 20 5 FFBDMO COc1ccc(CN[C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422947968 513988042 /nfs/dbraw/zinc/98/80/42/513988042.db2.gz RHSOOZTZMNKITJ-JXFKEZNVSA-N 1 1 369.421 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000451963709 514098197 /nfs/dbraw/zinc/09/81/97/514098197.db2.gz IURGVNBELQKNLI-WBVHZDCISA-N 1 1 352.456 2.554 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000451981006 514108035 /nfs/dbraw/zinc/10/80/35/514108035.db2.gz RUNOMMRMMFRRTK-KRWDZBQOSA-N 1 1 365.455 2.761 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451981006 514108039 /nfs/dbraw/zinc/10/80/39/514108039.db2.gz RUNOMMRMMFRRTK-KRWDZBQOSA-N 1 1 365.455 2.761 20 5 FFBDMO Cn1ncc2c1CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000414467583 514135819 /nfs/dbraw/zinc/13/58/19/514135819.db2.gz BPMMALWGEKHWQL-UHFFFAOYSA-N 1 1 352.341 2.878 20 5 FFBDMO Cn1ncc2c1CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000414467583 514135827 /nfs/dbraw/zinc/13/58/27/514135827.db2.gz BPMMALWGEKHWQL-UHFFFAOYSA-N 1 1 352.341 2.878 20 5 FFBDMO C[C@]12C[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452041573 514155932 /nfs/dbraw/zinc/15/59/32/514155932.db2.gz JTCQTRAYJFRDOR-OYHXCVFBSA-N 1 1 373.409 2.630 20 5 FFBDMO O=[N+]([O-])c1cccc2c(NC[C@@]3([NH+]4CCOCC4)CCSC3)ccnc21 ZINC000432340574 514165267 /nfs/dbraw/zinc/16/52/67/514165267.db2.gz NANRNASGQWPYDO-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000423620308 514187008 /nfs/dbraw/zinc/18/70/08/514187008.db2.gz WNFJKNNHOJSMIR-GOSISDBHSA-N 1 1 354.410 2.900 20 5 FFBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449455037 514217217 /nfs/dbraw/zinc/21/72/17/514217217.db2.gz QDEHKNKMTXWWEV-GOSISDBHSA-N 1 1 350.415 2.730 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000444444959 514231217 /nfs/dbraw/zinc/23/12/17/514231217.db2.gz GEBCQPSKLWESIQ-JTQLQIEISA-N 1 1 354.370 2.611 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000449542635 514247609 /nfs/dbraw/zinc/24/76/09/514247609.db2.gz QUYKEFHRFITTCE-BEFAXECRSA-N 1 1 360.410 2.767 20 5 FFBDMO CCc1ccc([C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000427919945 514345889 /nfs/dbraw/zinc/34/58/89/514345889.db2.gz CKMZYKHHGAMOCJ-SFHVURJKSA-N 1 1 357.410 2.896 20 5 FFBDMO C[C@H]1CN(CCO)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787949 514354271 /nfs/dbraw/zinc/35/42/71/514354271.db2.gz WWDGXOMLTKCTEV-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1C[N@H+](CCO)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787949 514354279 /nfs/dbraw/zinc/35/42/79/514354279.db2.gz WWDGXOMLTKCTEV-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449787949 514354283 /nfs/dbraw/zinc/35/42/83/514354283.db2.gz WWDGXOMLTKCTEV-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420938479 514388756 /nfs/dbraw/zinc/38/87/56/514388756.db2.gz AWYVRSDJBZDBOM-GXTWGEPZSA-N 1 1 362.348 2.999 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000420949386 514396988 /nfs/dbraw/zinc/39/69/88/514396988.db2.gz VLRCYHXPXMLUKI-VXGBXAGGSA-N 1 1 374.384 2.698 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NC/C=C\c3ccccc3[N+](=O)[O-])cc2C1 ZINC000433197083 514416623 /nfs/dbraw/zinc/41/66/23/514416623.db2.gz PIVPOHRIMWMKCT-HYXAFXHYSA-N 1 1 366.421 2.564 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NC/C=C\c3ccccc3[N+](=O)[O-])cc2C1 ZINC000433197083 514416625 /nfs/dbraw/zinc/41/66/25/514416625.db2.gz PIVPOHRIMWMKCT-HYXAFXHYSA-N 1 1 366.421 2.564 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC(OC(C)(C)C)C1 ZINC000421018290 514440588 /nfs/dbraw/zinc/44/05/88/514440588.db2.gz WSIVPUZYKCTTCH-UHFFFAOYSA-N 1 1 361.442 2.762 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC(OC(C)(C)C)C1 ZINC000421018290 514440596 /nfs/dbraw/zinc/44/05/96/514440596.db2.gz WSIVPUZYKCTTCH-UHFFFAOYSA-N 1 1 361.442 2.762 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000449964771 514444716 /nfs/dbraw/zinc/44/47/16/514444716.db2.gz KANRDJBFLGIYGZ-MRXNPFEDSA-N 1 1 361.442 2.891 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000421034561 514450778 /nfs/dbraw/zinc/45/07/78/514450778.db2.gz YSAKRWMPWLRACV-AWEZNQCLSA-N 1 1 363.439 2.566 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000438955533 514471668 /nfs/dbraw/zinc/47/16/68/514471668.db2.gz UMJRAEZEMMMXMO-CYBMUJFWSA-N 1 1 373.450 2.523 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000438955533 514471676 /nfs/dbraw/zinc/47/16/76/514471676.db2.gz UMJRAEZEMMMXMO-CYBMUJFWSA-N 1 1 373.450 2.523 20 5 FFBDMO CC[C@@H](C)[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079621 514490644 /nfs/dbraw/zinc/49/06/44/514490644.db2.gz UVZPLHGMJJZMRQ-PBHICJAKSA-N 1 1 372.473 2.769 20 5 FFBDMO CC[C@@H](C)[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079621 514490648 /nfs/dbraw/zinc/49/06/48/514490648.db2.gz UVZPLHGMJJZMRQ-PBHICJAKSA-N 1 1 372.473 2.769 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000439484472 514561872 /nfs/dbraw/zinc/56/18/72/514561872.db2.gz DXQDFFCXOQUGRM-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000439484472 514561878 /nfs/dbraw/zinc/56/18/78/514561878.db2.gz DXQDFFCXOQUGRM-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000439484838 514562571 /nfs/dbraw/zinc/56/25/71/514562571.db2.gz FTFLJRHNYIJMST-RDTXWAMCSA-N 1 1 350.415 2.948 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000439485732 514564360 /nfs/dbraw/zinc/56/43/60/514564360.db2.gz UOGXGTOPEJHNRW-SFHVURJKSA-N 1 1 350.415 2.695 20 5 FFBDMO COCC[N@@H+](C)CCCNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000450255051 514567588 /nfs/dbraw/zinc/56/75/88/514567588.db2.gz AIFFREFHYLLQHH-UHFFFAOYSA-N 1 1 350.444 2.520 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000461607836 514663840 /nfs/dbraw/zinc/66/38/40/514663840.db2.gz JZRFADMXTJXWJJ-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@](C)(OC)CC2)cc1[N+](=O)[O-] ZINC000475559684 514714194 /nfs/dbraw/zinc/71/41/94/514714194.db2.gz FHARAVZLUXNTMO-GOSISDBHSA-N 1 1 366.414 2.538 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3nc4ccc(F)cc4o3)C2)nc1 ZINC000466939402 514836482 /nfs/dbraw/zinc/83/64/82/514836482.db2.gz JNOMMAZHQLBPCU-LBPRGKRZSA-N 1 1 357.345 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3nc4ccc(F)cc4o3)C2)nc1 ZINC000466939402 514836491 /nfs/dbraw/zinc/83/64/91/514836491.db2.gz JNOMMAZHQLBPCU-LBPRGKRZSA-N 1 1 357.345 2.957 20 5 FFBDMO CN(C)c1cc(NC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)cc[nH+]1 ZINC000480190236 514872564 /nfs/dbraw/zinc/87/25/64/514872564.db2.gz MDAGUSZDVANLKC-UHFFFAOYSA-N 1 1 353.338 2.562 20 5 FFBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000489677467 514934169 /nfs/dbraw/zinc/93/41/69/514934169.db2.gz MOZQIVJMRVVAFO-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC[C@H]1C ZINC000498711317 515036251 /nfs/dbraw/zinc/03/62/51/515036251.db2.gz SYBGJLSVFUIZMJ-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000476474787 515063346 /nfs/dbraw/zinc/06/33/46/515063346.db2.gz ZWGNJUUNZLUDNM-RDJZCZTQSA-N 1 1 355.394 2.779 20 5 FFBDMO CC[NH+](CC)CCOC1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000490063815 515087454 /nfs/dbraw/zinc/08/74/54/515087454.db2.gz YQFBXUBGOXAWEQ-UHFFFAOYSA-N 1 1 365.474 2.926 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)O1 ZINC000509294655 515113367 /nfs/dbraw/zinc/11/33/67/515113367.db2.gz PXACTGVPQDSBPH-MGPQQGTHSA-N 1 1 369.412 2.947 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000456382430 515143874 /nfs/dbraw/zinc/14/38/74/515143874.db2.gz OULFOKUAMUDTCN-LBPRGKRZSA-N 1 1 357.357 2.753 20 5 FFBDMO COc1c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000476696906 515161931 /nfs/dbraw/zinc/16/19/31/515161931.db2.gz VVZAFWUDJXDZOG-WMLDXEAASA-N 1 1 369.421 2.854 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000476948045 515260782 /nfs/dbraw/zinc/26/07/82/515260782.db2.gz BLMZCGUFTZJJID-UHFFFAOYSA-N 1 1 361.442 2.768 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254803 515285839 /nfs/dbraw/zinc/28/58/39/515285839.db2.gz VRWYRMOLZGLQIN-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)C[N@H+]1CCCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254803 515285845 /nfs/dbraw/zinc/28/58/45/515285845.db2.gz VRWYRMOLZGLQIN-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254803 515285855 /nfs/dbraw/zinc/28/58/55/515285855.db2.gz VRWYRMOLZGLQIN-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000468254803 515285862 /nfs/dbraw/zinc/28/58/62/515285862.db2.gz VRWYRMOLZGLQIN-MRXNPFEDSA-N 1 1 362.474 2.532 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@]3(CCCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000477051875 515303485 /nfs/dbraw/zinc/30/34/85/515303485.db2.gz RBZSOYHJYGJXED-MJGOQNOKSA-N 1 1 359.426 2.593 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510849 515356042 /nfs/dbraw/zinc/35/60/42/515356042.db2.gz NTGCSIJXIZNIIR-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510849 515356053 /nfs/dbraw/zinc/35/60/53/515356053.db2.gz NTGCSIJXIZNIIR-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3ncc([N+](=O)[O-])cc3C)CC2)c1 ZINC000481838975 515482926 /nfs/dbraw/zinc/48/29/26/515482926.db2.gz RRSVSEZOQSCOFF-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000468749178 515502233 /nfs/dbraw/zinc/50/22/33/515502233.db2.gz JEOYXINFRHFZDV-CQSZACIVSA-N 1 1 351.447 2.665 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[NH+]3CCC3)cc2[N+](=O)[O-])C1 ZINC000505424861 515530723 /nfs/dbraw/zinc/53/07/23/515530723.db2.gz HGRBCHUAHVUIFG-GASCZTMLSA-N 1 1 360.458 2.513 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505483661 515550452 /nfs/dbraw/zinc/55/04/52/515550452.db2.gz KYBFCAOVEUSNLV-GOSISDBHSA-N 1 1 353.422 2.873 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC[N@H+]2C2CC2)c1 ZINC000482047138 515557320 /nfs/dbraw/zinc/55/73/20/515557320.db2.gz WAZRZHZECOTURE-MAUKXSAKSA-N 1 1 370.409 2.639 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492831439 515565965 /nfs/dbraw/zinc/56/59/65/515565965.db2.gz NVSOCSVKSPQONR-ZBFHGGJFSA-N 1 1 359.426 2.579 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000500097580 515588791 /nfs/dbraw/zinc/58/87/91/515588791.db2.gz JDCGJEGZNVZFPC-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505627287 515614735 /nfs/dbraw/zinc/61/47/35/515614735.db2.gz BXKANRXTAPVJIS-VXGBXAGGSA-N 1 1 373.400 2.772 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C[C@H]1C ZINC000493891584 515678806 /nfs/dbraw/zinc/67/88/06/515678806.db2.gz OEJLICDPQHHOSB-HUUCEWRRSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1cnn(C)c1)CC(C)C ZINC000459594761 515679649 /nfs/dbraw/zinc/67/96/49/515679649.db2.gz LTOVGBSBFKBWOY-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1cnn(C)c1)CC(C)C ZINC000459594761 515679653 /nfs/dbraw/zinc/67/96/53/515679653.db2.gz LTOVGBSBFKBWOY-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH+]2CC(CC(N)=O)C2)cc1[N+](=O)[O-] ZINC000459624271 515702486 /nfs/dbraw/zinc/70/24/86/515702486.db2.gz SQFURGYLQASLLG-UHFFFAOYSA-N 1 1 354.410 2.670 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000459640048 515715543 /nfs/dbraw/zinc/71/55/43/515715543.db2.gz WZSZRAKPUIBKJU-NSHDSACASA-N 1 1 360.439 2.854 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000459728268 515773450 /nfs/dbraw/zinc/77/34/50/515773450.db2.gz ZFHQRRATNKQRJX-HNNXBMFYSA-N 1 1 363.414 2.784 20 5 FFBDMO CO[C@@H]1C[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000459780959 515800864 /nfs/dbraw/zinc/80/08/64/515800864.db2.gz MCRGSLCHNPLBSM-GVDBMIGSSA-N 1 1 356.426 2.965 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459812628 515823380 /nfs/dbraw/zinc/82/33/80/515823380.db2.gz RZHREPVHYGZXIU-CHWSQXEVSA-N 1 1 365.430 2.831 20 5 FFBDMO COC(=O)COc1ccc(CNc2ccc3c(c2)C[N@H+](C)C3)cc1[N+](=O)[O-] ZINC000473989262 515833151 /nfs/dbraw/zinc/83/31/51/515833151.db2.gz KSOXXMCJCSKHJA-UHFFFAOYSA-N 1 1 371.393 2.704 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CCOC)C1 ZINC000506353602 515857247 /nfs/dbraw/zinc/85/72/47/515857247.db2.gz FPFJLQXMOOYIDM-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000487515032 515887174 /nfs/dbraw/zinc/88/71/74/515887174.db2.gz OBKGLVHGTDVWAU-UHFFFAOYSA-N 1 1 355.385 2.654 20 5 FFBDMO C[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000511471403 515917802 /nfs/dbraw/zinc/91/78/02/515917802.db2.gz AORYDJHUBHUQQH-JKSUJKDBSA-N 1 1 362.474 2.899 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704657 515931851 /nfs/dbraw/zinc/93/18/51/515931851.db2.gz TTYXLELRFKXRNM-ROUUACIJSA-N 1 1 359.426 2.591 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704657 515931857 /nfs/dbraw/zinc/93/18/57/515931857.db2.gz TTYXLELRFKXRNM-ROUUACIJSA-N 1 1 359.426 2.591 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000464820543 515972198 /nfs/dbraw/zinc/97/21/98/515972198.db2.gz FQBZTXYZDQUHEH-QFBILLFUSA-N 1 1 361.442 2.619 20 5 FFBDMO COc1c(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000474410320 516034089 /nfs/dbraw/zinc/03/40/89/516034089.db2.gz HSWVFGQUXQXXDT-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCC[C@H]1C ZINC000487992115 516067470 /nfs/dbraw/zinc/06/74/70/516067470.db2.gz XBICEWLWNKIBTM-CJNGLKHVSA-N 1 1 365.430 2.679 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1C ZINC000487992118 516067731 /nfs/dbraw/zinc/06/77/31/516067731.db2.gz XBICEWLWNKIBTM-XJKSGUPXSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000495181090 516091715 /nfs/dbraw/zinc/09/17/15/516091715.db2.gz BTBYDRUJCWNAGZ-GFCCVEGCSA-N 1 1 372.347 2.650 20 5 FFBDMO CCOCC[N@H+]1CCN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@@H]1CC ZINC000470123312 516129026 /nfs/dbraw/zinc/12/90/26/516129026.db2.gz DVCFFYSDBNMUNG-HNNXBMFYSA-N 1 1 368.409 2.699 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000470162923 516153896 /nfs/dbraw/zinc/15/38/96/516153896.db2.gz IISRYBDNEYOPFX-KRWDZBQOSA-N 1 1 356.426 2.683 20 5 FFBDMO C[NH+](C)CCN(Cc1ccccc1F)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507302443 516164568 /nfs/dbraw/zinc/16/45/68/516164568.db2.gz JAUJOISYNBAPSA-UHFFFAOYSA-N 1 1 361.373 2.644 20 5 FFBDMO COc1c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474779230 516192281 /nfs/dbraw/zinc/19/22/81/516192281.db2.gz FMJUDTFRAKUNSW-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO C[N@@H+](CC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000501729338 516207472 /nfs/dbraw/zinc/20/74/72/516207472.db2.gz LEKPWNPLOLWQHR-GDBMZVCRSA-N 1 1 367.496 2.606 20 5 FFBDMO C[N@@H+](CC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1 ZINC000501729340 516207639 /nfs/dbraw/zinc/20/76/39/516207639.db2.gz LEKPWNPLOLWQHR-HOCLYGCPSA-N 1 1 367.496 2.606 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000465616468 516210479 /nfs/dbraw/zinc/21/04/79/516210479.db2.gz SOYCZFMRGPXIEE-UHFFFAOYSA-N 1 1 370.453 2.959 20 5 FFBDMO CC(=O)c1ccc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000484090087 516295410 /nfs/dbraw/zinc/29/54/10/516295410.db2.gz YSUPVTYNSMXGHM-FQEVSTJZSA-N 1 1 369.421 2.846 20 5 FFBDMO CC(C)c1ccc(C[C@@H]2CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000460984256 516297001 /nfs/dbraw/zinc/29/70/01/516297001.db2.gz VNBDAOQICXQLJM-PXNSSMCTSA-N 1 1 372.469 2.840 20 5 FFBDMO O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000517559691 516363164 /nfs/dbraw/zinc/36/31/64/516363164.db2.gz BZVPNTOBBIKMJX-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000531388795 516445577 /nfs/dbraw/zinc/44/55/77/516445577.db2.gz CVOMBFKJRMAUAF-PBHICJAKSA-N 1 1 356.426 2.574 20 5 FFBDMO COC(=O)c1cc(NC(=O)N[C@H](C)C[N@@H+](C)C(C)C)c(C)c([N+](=O)[O-])c1 ZINC000517786014 516452879 /nfs/dbraw/zinc/45/28/79/516452879.db2.gz GXWAKUCCXJIYRC-LLVKDONJSA-N 1 1 366.418 2.540 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000518462266 516670453 /nfs/dbraw/zinc/67/04/53/516670453.db2.gz XWTVORWYCAUNKQ-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000561721658 516732130 /nfs/dbraw/zinc/73/21/30/516732130.db2.gz VKVUDDDZKWVUPT-KRWDZBQOSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000544392828 516739260 /nfs/dbraw/zinc/73/92/60/516739260.db2.gz BFBMFHMWOUIOFE-KOLCDFICSA-N 1 1 357.252 2.980 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNC(=O)c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000518680822 516740307 /nfs/dbraw/zinc/74/03/07/516740307.db2.gz YEZLAJLIKFAWGR-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNC(=O)c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000518680822 516740315 /nfs/dbraw/zinc/74/03/15/516740315.db2.gz YEZLAJLIKFAWGR-HNNXBMFYSA-N 1 1 369.421 2.746 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cc(F)c(F)c(F)c2)cc1 ZINC000544599395 516831324 /nfs/dbraw/zinc/83/13/24/516831324.db2.gz RMOKHJXMPQQAOZ-UHFFFAOYSA-N 1 1 374.340 2.576 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](C3CC3)C2)nc1OCc1ccccc1 ZINC000558649127 516859831 /nfs/dbraw/zinc/85/98/31/516859831.db2.gz LHDHHQRSGDGPEY-MRXNPFEDSA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NCc1ccc(C(=O)N2CC[NH+](C)CC2)cc1 ZINC000555322338 516881252 /nfs/dbraw/zinc/88/12/52/516881252.db2.gz WJAJCFOZDHYBSF-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(Cc4ncc[nH]4)CC3)o2)c1 ZINC000536670856 516885308 /nfs/dbraw/zinc/88/53/08/516885308.db2.gz NROTUYLMLFNNLM-UHFFFAOYSA-N 1 1 367.409 2.896 20 5 FFBDMO CC[C@H](C)[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847117 516957868 /nfs/dbraw/zinc/95/78/68/516957868.db2.gz RWTLQNRVAJETRE-KSSFIOAISA-N 1 1 370.457 2.825 20 5 FFBDMO CC[C@H](C)[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847117 516957874 /nfs/dbraw/zinc/95/78/74/516957874.db2.gz RWTLQNRVAJETRE-KSSFIOAISA-N 1 1 370.457 2.825 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000558834892 516964757 /nfs/dbraw/zinc/96/47/57/516964757.db2.gz NCSWOXRUZZTXOF-INIZCTEOSA-N 1 1 358.446 2.650 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCN(C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000552068738 517061950 /nfs/dbraw/zinc/06/19/50/517061950.db2.gz JPSKPWIXDSRUOZ-HNNXBMFYSA-N 1 1 359.382 2.526 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCN(C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000552068738 517061959 /nfs/dbraw/zinc/06/19/59/517061959.db2.gz JPSKPWIXDSRUOZ-HNNXBMFYSA-N 1 1 359.382 2.526 20 5 FFBDMO COC1(CC[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCC1 ZINC000559150698 517101884 /nfs/dbraw/zinc/10/18/84/517101884.db2.gz ZEKMUNDKPMBPSJ-UHFFFAOYSA-N 1 1 373.457 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1C ZINC000515100458 517211641 /nfs/dbraw/zinc/21/16/41/517211641.db2.gz WIKCTBIRGHGPAG-ZIAGYGMSSA-N 1 1 369.487 2.753 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C1 ZINC000541815862 517229069 /nfs/dbraw/zinc/22/90/69/517229069.db2.gz BPJRFMLLNTZBEK-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2C[C@@H](C)S[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000532969378 517229407 /nfs/dbraw/zinc/22/94/07/517229407.db2.gz COTPVVUQFQRFCR-TXEJJXNPSA-N 1 1 353.444 2.758 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000537615561 517258860 /nfs/dbraw/zinc/25/88/60/517258860.db2.gz YEBSVMGZIFETFK-LJQANCHMSA-N 1 1 355.394 2.957 20 5 FFBDMO Cc1cccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000533056427 517270971 /nfs/dbraw/zinc/27/09/71/517270971.db2.gz OSYCCSQBRTYLKY-GDBMZVCRSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1cccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000533056427 517270977 /nfs/dbraw/zinc/27/09/77/517270977.db2.gz OSYCCSQBRTYLKY-GDBMZVCRSA-N 1 1 369.425 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000552513152 517291421 /nfs/dbraw/zinc/29/14/21/517291421.db2.gz ILTQCICOILRBLE-MAUKXSAKSA-N 1 1 360.385 2.963 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)sc2C1 ZINC000520223815 517308216 /nfs/dbraw/zinc/30/82/16/517308216.db2.gz XGSFCOBJPNBLPY-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)sc2C1 ZINC000520223815 517308222 /nfs/dbraw/zinc/30/82/22/517308222.db2.gz XGSFCOBJPNBLPY-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000533312689 517400677 /nfs/dbraw/zinc/40/06/77/517400677.db2.gz NQNRUCONUIBKRL-PBHICJAKSA-N 1 1 358.442 2.725 20 5 FFBDMO COC(=O)CCC1CC[NH+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000533344866 517416125 /nfs/dbraw/zinc/41/61/25/517416125.db2.gz YDFOWDQEIYMLRH-UHFFFAOYSA-N 1 1 363.414 2.507 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000556521441 517476371 /nfs/dbraw/zinc/47/63/71/517476371.db2.gz WVKAUKSAYNDZNK-GDBMZVCRSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542404966 517542848 /nfs/dbraw/zinc/54/28/48/517542848.db2.gz CQCAWXXSPBUPSW-ZWNOBZJWSA-N 1 1 369.874 2.939 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCNc2cccc(C)[nH+]2)c1 ZINC000538427447 517614605 /nfs/dbraw/zinc/61/46/05/517614605.db2.gz UDIWOPDEEQKTMR-UHFFFAOYSA-N 1 1 358.398 2.604 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000560275425 517672408 /nfs/dbraw/zinc/67/24/08/517672408.db2.gz VBBOPQKRCZQAKQ-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000542716194 517701246 /nfs/dbraw/zinc/70/12/46/517701246.db2.gz CSFJDPDBINJOBB-ZDUSSCGKSA-N 1 1 350.394 2.930 20 5 FFBDMO CCN(C(=O)c1[nH]nc(C)c1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477127 517748000 /nfs/dbraw/zinc/74/80/00/517748000.db2.gz SDHYWDXZIUJTIZ-HOCLYGCPSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477127 517748007 /nfs/dbraw/zinc/74/80/07/517748007.db2.gz SDHYWDXZIUJTIZ-HOCLYGCPSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477127 517748017 /nfs/dbraw/zinc/74/80/17/517748017.db2.gz SDHYWDXZIUJTIZ-HOCLYGCPSA-N 1 1 371.441 2.924 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749776 517764033 /nfs/dbraw/zinc/76/40/33/517764033.db2.gz GBGFXWLJHBIFHZ-HNNXBMFYSA-N 1 1 363.458 2.776 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000521587562 517788111 /nfs/dbraw/zinc/78/81/11/517788111.db2.gz FSJNPZORUSAXSI-UHFFFAOYSA-N 1 1 371.393 2.705 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)n1 ZINC000542865474 517788671 /nfs/dbraw/zinc/78/86/71/517788671.db2.gz ICQMSEWEQUFNEW-QZTJIDSGSA-N 1 1 370.453 2.902 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000557024156 517809874 /nfs/dbraw/zinc/80/98/74/517809874.db2.gz QOOAHVUIHKBLIL-HNNXBMFYSA-N 1 1 359.357 2.553 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000521835461 517865478 /nfs/dbraw/zinc/86/54/78/517865478.db2.gz KIXPYIKMCQPGET-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000521835461 517865485 /nfs/dbraw/zinc/86/54/85/517865485.db2.gz KIXPYIKMCQPGET-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000560595093 517919972 /nfs/dbraw/zinc/91/99/72/517919972.db2.gz NTMBYKNMHUZJOB-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000560595093 517919981 /nfs/dbraw/zinc/91/99/81/517919981.db2.gz NTMBYKNMHUZJOB-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO CCNc1ccc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534585587 517955166 /nfs/dbraw/zinc/95/51/66/517955166.db2.gz BGHHFEIBKWPZHL-QGZVFWFLSA-N 1 1 354.410 2.943 20 5 FFBDMO CCNc1ccc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534585587 517955179 /nfs/dbraw/zinc/95/51/79/517955179.db2.gz BGHHFEIBKWPZHL-QGZVFWFLSA-N 1 1 354.410 2.943 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[NH+](C)C[C@H]1C ZINC000550317246 517992630 /nfs/dbraw/zinc/99/26/30/517992630.db2.gz IZYTWFAQMLLBIZ-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000517087424 518018079 /nfs/dbraw/zinc/01/80/79/518018079.db2.gz QETXPKMIUFXJHA-GOEBONIOSA-N 1 1 360.458 2.655 20 5 FFBDMO COC(=O)c1cccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000539381392 518018181 /nfs/dbraw/zinc/01/81/81/518018181.db2.gz WAAYKDJFMOOPDT-GFCCVEGCSA-N 1 1 357.366 2.671 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000522200996 518029900 /nfs/dbraw/zinc/02/99/00/518029900.db2.gz BBJGUZMIHRNKMQ-OLZOCXBDSA-N 1 1 369.849 2.862 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000547274866 518049132 /nfs/dbraw/zinc/04/91/32/518049132.db2.gz GDRDUBUHGMPWAU-UHFFFAOYSA-N 1 1 368.231 2.739 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)c1 ZINC000560833928 518052386 /nfs/dbraw/zinc/05/23/86/518052386.db2.gz FFUVGBPGEJVTCE-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1 ZINC000560833928 518052396 /nfs/dbraw/zinc/05/23/96/518052396.db2.gz FFUVGBPGEJVTCE-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557525119 518054339 /nfs/dbraw/zinc/05/43/39/518054339.db2.gz CZTRGRHMZVGDCT-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557525119 518054352 /nfs/dbraw/zinc/05/43/52/518054352.db2.gz CZTRGRHMZVGDCT-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](CCOC(C)C)CC1 ZINC000557539884 518061976 /nfs/dbraw/zinc/06/19/76/518061976.db2.gz KLCFGLQKSMKXGO-UHFFFAOYSA-N 1 1 364.446 2.732 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)C2)C1 ZINC000563733603 518097171 /nfs/dbraw/zinc/09/71/71/518097171.db2.gz ODVIAVSIKKVCGB-OAHLLOKOSA-N 1 1 357.332 2.781 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000543476706 518112143 /nfs/dbraw/zinc/11/21/43/518112143.db2.gz TZXHBOVOQKCFPL-ZBFHGGJFSA-N 1 1 352.431 2.711 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000543476703 518112190 /nfs/dbraw/zinc/11/21/90/518112190.db2.gz TZXHBOVOQKCFPL-GDBMZVCRSA-N 1 1 352.431 2.711 20 5 FFBDMO C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCCC[C@@H]1C ZINC000535371127 518177019 /nfs/dbraw/zinc/17/70/19/518177019.db2.gz FEGMICBIGZKLSS-UONOGXRCSA-N 1 1 358.442 2.998 20 5 FFBDMO C[C@H](C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000578594913 518281045 /nfs/dbraw/zinc/28/10/45/518281045.db2.gz GIOKMVCDWDFJFN-ZDUSSCGKSA-N 1 1 370.409 2.837 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331053 518284529 /nfs/dbraw/zinc/28/45/29/518284529.db2.gz AOTCZYHJOLPYCO-QGZVFWFLSA-N 1 1 362.474 2.569 20 5 FFBDMO Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC000567192392 518398498 /nfs/dbraw/zinc/39/84/98/518398498.db2.gz RXOHCRZJTNYTRY-UHFFFAOYSA-N 1 1 358.446 2.701 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000567207132 518405443 /nfs/dbraw/zinc/40/54/43/518405443.db2.gz GWXOAQIESFZKPX-KBPBESRZSA-N 1 1 373.457 2.743 20 5 FFBDMO Cc1cc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)cc(N2CCCC2)[nH+]1 ZINC000579020077 518483744 /nfs/dbraw/zinc/48/37/44/518483744.db2.gz IBLUJUNJFSXRQY-UHFFFAOYSA-N 1 1 355.398 2.532 20 5 FFBDMO CCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000567366550 518488491 /nfs/dbraw/zinc/48/84/91/518488491.db2.gz BQZZOXBOBXYIBL-UHFFFAOYSA-N 1 1 354.426 2.714 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430136 518517445 /nfs/dbraw/zinc/51/74/45/518517445.db2.gz LKKBNSFZWQDLHP-ZFWWWQNUSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430136 518517453 /nfs/dbraw/zinc/51/74/53/518517453.db2.gz LKKBNSFZWQDLHP-ZFWWWQNUSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430133 518517606 /nfs/dbraw/zinc/51/76/06/518517606.db2.gz LKKBNSFZWQDLHP-DZGCQCFKSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430133 518517612 /nfs/dbraw/zinc/51/76/12/518517612.db2.gz LKKBNSFZWQDLHP-DZGCQCFKSA-N 1 1 352.431 2.841 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000567541549 518575637 /nfs/dbraw/zinc/57/56/37/518575637.db2.gz FDDPGRFOINMXNQ-WBVHZDCISA-N 1 1 360.385 2.963 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)[C@@H]2C1 ZINC000585783609 518596057 /nfs/dbraw/zinc/59/60/57/518596057.db2.gz KQEBSEGZCLRTHT-IAGOWNOFSA-N 1 1 372.400 2.705 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000579276178 518602758 /nfs/dbraw/zinc/60/27/58/518602758.db2.gz GEGUFJCFNQAHCG-OAHLLOKOSA-N 1 1 367.764 2.649 20 5 FFBDMO Cc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c(Br)cc1[N+](=O)[O-] ZINC000579298795 518613316 /nfs/dbraw/zinc/61/33/16/518613316.db2.gz SOUQUXCYVHHUPZ-UHFFFAOYSA-N 1 1 366.219 2.715 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000570479337 518626402 /nfs/dbraw/zinc/62/64/02/518626402.db2.gz GLEGKGSTZQVCMD-UHFFFAOYSA-N 1 1 357.838 2.864 20 5 FFBDMO CC(C)[C@H](O)C1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000586791524 518644729 /nfs/dbraw/zinc/64/47/29/518644729.db2.gz RYHACIBZQBXGBO-SJORKVTESA-N 1 1 358.442 2.804 20 5 FFBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000588023659 518704712 /nfs/dbraw/zinc/70/47/12/518704712.db2.gz UCTYLORSMAGPHS-LJQANCHMSA-N 1 1 359.401 2.807 20 5 FFBDMO O=C(C[N@H+]1CCSC2(CCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000570661408 518717995 /nfs/dbraw/zinc/71/79/95/518717995.db2.gz OWWVKJJLIIHNFB-UHFFFAOYSA-N 1 1 361.467 2.846 20 5 FFBDMO Cc1cc(CNc2cccc(C(N)=O)c2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000573890560 518883176 /nfs/dbraw/zinc/88/31/76/518883176.db2.gz USURDSQHQQQVSY-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579849774 518886568 /nfs/dbraw/zinc/88/65/68/518886568.db2.gz AWSGGHJYVXLCKD-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO CCC(CC)[C@@H](CNc1c([N+](=O)[O-])nc(C)n1CC)[NH+]1CCOCC1 ZINC000577167804 518946214 /nfs/dbraw/zinc/94/62/14/518946214.db2.gz BSQIJOMPLLBQSZ-OAHLLOKOSA-N 1 1 353.467 2.669 20 5 FFBDMO COCc1nc(C[NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cs1 ZINC000589348876 518985211 /nfs/dbraw/zinc/98/52/11/518985211.db2.gz QJURSINSASHZAL-NSHDSACASA-N 1 1 364.427 2.705 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000577662798 519191368 /nfs/dbraw/zinc/19/13/68/519191368.db2.gz VXOROTZCSDCYAW-UHFFFAOYSA-N 1 1 370.453 2.903 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000590556007 519264248 /nfs/dbraw/zinc/26/42/48/519264248.db2.gz WILITNIINYTQKL-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000590581007 519273762 /nfs/dbraw/zinc/27/37/62/519273762.db2.gz GJPQAKNCGDGIEW-RYUDHWBXSA-N 1 1 367.833 2.955 20 5 FFBDMO Cc1c(Br)c(N2CCC[N@@H+](C(C)C)CC2)ncc1[N+](=O)[O-] ZINC000574677083 519274594 /nfs/dbraw/zinc/27/45/94/519274594.db2.gz YJGGYVBQPULDDA-UHFFFAOYSA-N 1 1 357.252 2.981 20 5 FFBDMO Cc1c(Br)c(N2CCC[N@H+](C(C)C)CC2)ncc1[N+](=O)[O-] ZINC000574677083 519274601 /nfs/dbraw/zinc/27/46/01/519274601.db2.gz YJGGYVBQPULDDA-UHFFFAOYSA-N 1 1 357.252 2.981 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590599093 519283944 /nfs/dbraw/zinc/28/39/44/519283944.db2.gz AAJCNIQSDXBRAU-JKSUJKDBSA-N 1 1 357.410 2.609 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601504 519283968 /nfs/dbraw/zinc/28/39/68/519283968.db2.gz CZDBIMNIDVTUHO-DYVFJYSZSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601504 519283975 /nfs/dbraw/zinc/28/39/75/519283975.db2.gz CZDBIMNIDVTUHO-DYVFJYSZSA-N 1 1 371.441 2.781 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](C[C@H]4CCCC[C@@H]4O)CC3)nc2c1 ZINC000577956280 519340394 /nfs/dbraw/zinc/34/03/94/519340394.db2.gz XOJBFEKOJQWGHE-KDOFPFPSSA-N 1 1 373.457 2.534 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000580771130 519350507 /nfs/dbraw/zinc/35/05/07/519350507.db2.gz XDQOTUGJFYPYIL-OAHLLOKOSA-N 1 1 361.490 2.554 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCCOC(C)C ZINC000569175566 519414726 /nfs/dbraw/zinc/41/47/26/519414726.db2.gz PKWKGRLQBQKIFU-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000574975309 519433297 /nfs/dbraw/zinc/43/32/97/519433297.db2.gz KIFKGJUYRBHQBC-UHFFFAOYSA-N 1 1 369.412 2.994 20 5 FFBDMO O=[N+]([O-])c1ccc2ccnc(N3CCC[N@@H+](C[C@@H]4CCCO4)CC3)c2c1 ZINC000591138806 519527301 /nfs/dbraw/zinc/52/73/01/519527301.db2.gz ZZPLCEQKKJPYEA-KRWDZBQOSA-N 1 1 356.426 2.834 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000584035933 519557879 /nfs/dbraw/zinc/55/78/79/519557879.db2.gz LGAPSXCQEKSPBO-SNVBAGLBSA-N 1 1 358.345 2.754 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000584035933 519557887 /nfs/dbraw/zinc/55/78/87/519557887.db2.gz LGAPSXCQEKSPBO-SNVBAGLBSA-N 1 1 358.345 2.754 20 5 FFBDMO Cn1cc(CN[C@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591282627 519574284 /nfs/dbraw/zinc/57/42/84/519574284.db2.gz IASHVDHQGBVYSH-INIZCTEOSA-N 1 1 355.442 2.760 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccns1 ZINC000602882774 519946182 /nfs/dbraw/zinc/94/61/82/519946182.db2.gz KKDWJFRRZGTRQB-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1ccns1 ZINC000602882774 519946192 /nfs/dbraw/zinc/94/61/92/519946192.db2.gz KKDWJFRRZGTRQB-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO CC(C)(C)n1nnc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000594512570 520009172 /nfs/dbraw/zinc/00/91/72/520009172.db2.gz WFQPFENUWANJTO-UKRRQHHQSA-N 1 1 358.446 2.837 20 5 FFBDMO CN(C)CC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000591742772 520019697 /nfs/dbraw/zinc/01/96/97/520019697.db2.gz DTIDRCMANPDTIC-INIZCTEOSA-N 1 1 350.463 2.879 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594551508 520023067 /nfs/dbraw/zinc/02/30/67/520023067.db2.gz FLTBQCAUUYHFLJ-YXJHDRRASA-N 1 1 360.458 2.837 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594551508 520023070 /nfs/dbraw/zinc/02/30/70/520023070.db2.gz FLTBQCAUUYHFLJ-YXJHDRRASA-N 1 1 360.458 2.837 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000591750342 520023280 /nfs/dbraw/zinc/02/32/80/520023280.db2.gz NGUXBZWTOUFUGY-JTQLQIEISA-N 1 1 374.290 2.681 20 5 FFBDMO CC1(C)[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@H]1[NH+]1CCOCC1 ZINC000603112311 520085314 /nfs/dbraw/zinc/08/53/14/520085314.db2.gz VVKPVXXKUTXMHT-IAGOWNOFSA-N 1 1 373.409 2.570 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OCC(=O)NC ZINC000608781917 520125891 /nfs/dbraw/zinc/12/58/91/520125891.db2.gz DORAEWHVVNKGPJ-MRXNPFEDSA-N 1 1 357.410 2.961 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608836182 520139606 /nfs/dbraw/zinc/13/96/06/520139606.db2.gz NDFQMCOSAKMQIW-SJLPKXTDSA-N 1 1 355.442 2.712 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600227767 520141016 /nfs/dbraw/zinc/14/10/16/520141016.db2.gz GBOLPAFDAJEUHA-MRXNPFEDSA-N 1 1 361.442 2.887 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000608855976 520145352 /nfs/dbraw/zinc/14/53/52/520145352.db2.gz BBNLZWGUVRZUIP-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@H+](CCCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000608855976 520145359 /nfs/dbraw/zinc/14/53/59/520145359.db2.gz BBNLZWGUVRZUIP-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000608855976 520145365 /nfs/dbraw/zinc/14/53/65/520145365.db2.gz BBNLZWGUVRZUIP-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594788154 520158343 /nfs/dbraw/zinc/15/83/43/520158343.db2.gz FXZXZFUEDSXCDX-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000600252565 520159314 /nfs/dbraw/zinc/15/93/14/520159314.db2.gz JXSDGOWMIRRWRH-QGZVFWFLSA-N 1 1 356.426 2.906 20 5 FFBDMO Cc1sc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594854473 520190332 /nfs/dbraw/zinc/19/03/32/520190332.db2.gz LWYJAGGPOPMPFH-LBPRGKRZSA-N 1 1 373.500 2.650 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000600312018 520198678 /nfs/dbraw/zinc/19/86/78/520198678.db2.gz DHUDJKJBYLLUHR-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)o2)cc1 ZINC000609157365 520212492 /nfs/dbraw/zinc/21/24/92/520212492.db2.gz GMLIDIQXFDNMEZ-OAHLLOKOSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](n4ccnc4)C3)o2)cc1 ZINC000609157365 520212504 /nfs/dbraw/zinc/21/25/04/520212504.db2.gz GMLIDIQXFDNMEZ-OAHLLOKOSA-N 1 1 354.370 2.678 20 5 FFBDMO Cc1nn(Cc2ccc(C[NH+]3CCOCC3)cc2)c2ncc([N+](=O)[O-])cc12 ZINC000603322828 520214705 /nfs/dbraw/zinc/21/47/05/520214705.db2.gz VHNYGIXXYQIYLH-UHFFFAOYSA-N 1 1 367.409 2.528 20 5 FFBDMO O=[N+]([O-])c1ccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c(F)c1 ZINC000594975856 520237509 /nfs/dbraw/zinc/23/75/09/520237509.db2.gz VZOQVDXGURLHRT-GOSISDBHSA-N 1 1 359.401 2.590 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000597853487 520282771 /nfs/dbraw/zinc/28/27/71/520282771.db2.gz AZPBODXGORVEGY-HNNXBMFYSA-N 1 1 363.458 2.909 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(N)=O)cs1 ZINC000595082863 520285409 /nfs/dbraw/zinc/28/54/09/520285409.db2.gz QLAGLGNVNUTYNE-JTQLQIEISA-N 1 1 366.468 2.811 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1OC ZINC000597922529 520324860 /nfs/dbraw/zinc/32/48/60/520324860.db2.gz FQCPGQCPJKYOHV-GFCCVEGCSA-N 1 1 365.430 2.605 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597944073 520343200 /nfs/dbraw/zinc/34/32/00/520343200.db2.gz BXIXLWMPDLXIKQ-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc3c(c2)OC(F)(F)O3)c([N+](=O)[O-])cc1O ZINC000592372531 520356534 /nfs/dbraw/zinc/35/65/34/520356534.db2.gz HOSCRHUHMPRDAR-UHFFFAOYSA-N 1 1 368.292 2.920 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613180182 520371674 /nfs/dbraw/zinc/37/16/74/520371674.db2.gz KISYEDGMSZXJII-INIZCTEOSA-N 1 1 354.410 2.801 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613180182 520371683 /nfs/dbraw/zinc/37/16/83/520371683.db2.gz KISYEDGMSZXJII-INIZCTEOSA-N 1 1 354.410 2.801 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cs1 ZINC000609620421 520383650 /nfs/dbraw/zinc/38/36/50/520383650.db2.gz KYVRDPDAGYDLPJ-SFHVURJKSA-N 1 1 361.467 2.773 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000609620421 520383655 /nfs/dbraw/zinc/38/36/55/520383655.db2.gz KYVRDPDAGYDLPJ-SFHVURJKSA-N 1 1 361.467 2.773 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609731936 520416637 /nfs/dbraw/zinc/41/66/37/520416637.db2.gz QLADZQFQJRRKLK-GFCCVEGCSA-N 1 1 355.822 2.570 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492579 520417053 /nfs/dbraw/zinc/41/70/53/520417053.db2.gz AXYQFCXKWFQABD-OWCLPIDISA-N 1 1 360.458 2.633 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604105762 520452285 /nfs/dbraw/zinc/45/22/85/520452285.db2.gz XQARYGNLMCUFGU-ZIAGYGMSSA-N 1 1 364.446 2.523 20 5 FFBDMO CO[C@H](C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)C1CCC1 ZINC000595434169 520467697 /nfs/dbraw/zinc/46/76/97/520467697.db2.gz YYIJFSQWDLHFKG-GOSISDBHSA-N 1 1 373.457 2.798 20 5 FFBDMO C[N@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000598195179 520487508 /nfs/dbraw/zinc/48/75/08/520487508.db2.gz LOTAZSAKFJXIKJ-KRWDZBQOSA-N 1 1 369.421 2.689 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000598195179 520487512 /nfs/dbraw/zinc/48/75/12/520487512.db2.gz LOTAZSAKFJXIKJ-KRWDZBQOSA-N 1 1 369.421 2.689 20 5 FFBDMO Cc1noc(C[NH2+][C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000595476754 520494870 /nfs/dbraw/zinc/49/48/70/520494870.db2.gz OVPYGNUVNWALDH-BBRMVZONSA-N 1 1 352.341 2.704 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996195 520499143 /nfs/dbraw/zinc/49/91/43/520499143.db2.gz XPVFFKARRNVCCO-CJNGLKHVSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996195 520499149 /nfs/dbraw/zinc/49/91/49/520499149.db2.gz XPVFFKARRNVCCO-CJNGLKHVSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996195 520499159 /nfs/dbraw/zinc/49/91/59/520499159.db2.gz XPVFFKARRNVCCO-CJNGLKHVSA-N 1 1 371.441 2.751 20 5 FFBDMO COc1cc(C[NH2+][C@@H](c2cccnc2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000595499863 520510205 /nfs/dbraw/zinc/51/02/05/520510205.db2.gz OLWSPFCZQUQIBJ-KRWDZBQOSA-N 1 1 363.389 2.987 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595523524 520526708 /nfs/dbraw/zinc/52/67/08/520526708.db2.gz RTOXDOCHIWOZFN-INIZCTEOSA-N 1 1 360.458 2.844 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2nsc3ccccc23)CC1 ZINC000595523998 520527004 /nfs/dbraw/zinc/52/70/04/520527004.db2.gz OSYGWHSCVMGOQV-UHFFFAOYSA-N 1 1 369.450 2.964 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000604446363 520565307 /nfs/dbraw/zinc/56/53/07/520565307.db2.gz ZAWOIBHAQGLHCH-UBHSHLNASA-N 1 1 367.833 2.759 20 5 FFBDMO C[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000600994443 520581003 /nfs/dbraw/zinc/58/10/03/520581003.db2.gz AHLBNGNFSRZSTR-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000600994443 520581011 /nfs/dbraw/zinc/58/10/11/520581011.db2.gz AHLBNGNFSRZSTR-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000598466531 520630153 /nfs/dbraw/zinc/63/01/53/520630153.db2.gz OPVQTQDCUVWZMY-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105313 520638438 /nfs/dbraw/zinc/63/84/38/520638438.db2.gz ZJXQDWMNXYGUKH-CQSZACIVSA-N 1 1 354.410 2.886 20 5 FFBDMO O=C1NCCCN1C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601132413 520652567 /nfs/dbraw/zinc/65/25/67/520652567.db2.gz FQYKKAUCRHPCQW-UHFFFAOYSA-N 1 1 355.398 2.527 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508047 520666136 /nfs/dbraw/zinc/66/61/36/520666136.db2.gz BURAJHWHSDWOLL-QGZVFWFLSA-N 1 1 357.385 2.667 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508675 520666513 /nfs/dbraw/zinc/66/65/13/520666513.db2.gz HFDUSSPZVHMPSR-QGZVFWFLSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc2nccc(N3CCC([N@H+]4CCCOCC4)CC3)c2c1 ZINC000601174217 520671826 /nfs/dbraw/zinc/67/18/26/520671826.db2.gz RTSSLJIPVWVZTL-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC4(CCC4)S(=O)(=O)CC3)c2c1 ZINC000601175994 520672468 /nfs/dbraw/zinc/67/24/68/520672468.db2.gz MQMXKJYOIYFABG-UHFFFAOYSA-N 1 1 361.423 2.691 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@](O)(C2CC2)C1 ZINC000595752087 520700071 /nfs/dbraw/zinc/70/00/71/520700071.db2.gz SCEAAYIRRBNOKB-SGTLLEGYSA-N 1 1 358.398 2.943 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598560083 520705693 /nfs/dbraw/zinc/70/56/93/520705693.db2.gz KNMRMMQGEJOVHU-OAHLLOKOSA-N 1 1 361.442 2.845 20 5 FFBDMO CC[C@@H]1[C@@H](C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC[N@H+]1C ZINC000601258816 520711991 /nfs/dbraw/zinc/71/19/91/520711991.db2.gz OIILETMWOMJRMX-ZWKOTPCHSA-N 1 1 361.442 2.695 20 5 FFBDMO CC[C@@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000593056397 520713959 /nfs/dbraw/zinc/71/39/59/520713959.db2.gz HXJLVXPYIQZRIE-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@@H](CC)CO1 ZINC000593058087 520715800 /nfs/dbraw/zinc/71/58/00/520715800.db2.gz JAMFXVQJTJECKV-DZGCQCFKSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(Cn4cnnc4)CC3)co2)cc1 ZINC000593078126 520728456 /nfs/dbraw/zinc/72/84/56/520728456.db2.gz UVXCWLFZIKHOJN-UHFFFAOYSA-N 1 1 368.397 2.754 20 5 FFBDMO C[N@@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@@H](c2ccccc2)C1 ZINC000610930366 520908694 /nfs/dbraw/zinc/90/86/94/520908694.db2.gz DQSUPMMCWJQOBH-GOSISDBHSA-N 1 1 369.421 2.855 20 5 FFBDMO C[N@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@@H](c2ccccc2)C1 ZINC000610930366 520908700 /nfs/dbraw/zinc/90/87/00/520908700.db2.gz DQSUPMMCWJQOBH-GOSISDBHSA-N 1 1 369.421 2.855 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000598916623 520915356 /nfs/dbraw/zinc/91/53/56/520915356.db2.gz HICOGKHWKOJRGT-HNNXBMFYSA-N 1 1 361.789 2.822 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000599004902 520974409 /nfs/dbraw/zinc/97/44/09/520974409.db2.gz VFTIQSGBJPZRPC-QGZVFWFLSA-N 1 1 362.474 2.949 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cn1 ZINC000611140062 521005604 /nfs/dbraw/zinc/00/56/04/521005604.db2.gz REMRNULWOVUASD-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000596282310 521007200 /nfs/dbraw/zinc/00/72/00/521007200.db2.gz VFSQXNJGQJMMRE-GXFFZTMASA-N 1 1 353.806 2.565 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1c(Br)cccc1[N+](=O)[O-] ZINC000599081003 521021559 /nfs/dbraw/zinc/02/15/59/521021559.db2.gz RNZFMPSWJROURB-VXGBXAGGSA-N 1 1 368.231 2.714 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)c(F)c1 ZINC000593496997 521033491 /nfs/dbraw/zinc/03/34/91/521033491.db2.gz ZFLWGULRBAOVRR-ROUUACIJSA-N 1 1 372.400 2.609 20 5 FFBDMO C[NH+](C)CCCC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611274250 521073233 /nfs/dbraw/zinc/07/32/33/521073233.db2.gz KXAFBJONZMRLGS-UHFFFAOYSA-N 1 1 363.458 2.920 20 5 FFBDMO COc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(F)cc1[N+](=O)[O-] ZINC000596514358 521108903 /nfs/dbraw/zinc/10/89/03/521108903.db2.gz KFTMMLJNTPFWTL-IAGOWNOFSA-N 1 1 365.405 2.798 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCN(Cc3ccc4c(c3)C[NH2+]CC4)CC2)c1 ZINC000593727054 521178229 /nfs/dbraw/zinc/17/82/29/521178229.db2.gz BJCBWXLYATYPDF-UHFFFAOYSA-N 1 1 352.438 2.563 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772760 521207024 /nfs/dbraw/zinc/20/70/24/521207024.db2.gz ZNFGYSFPJDNOOQ-QEJZJMRPSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772760 521207030 /nfs/dbraw/zinc/20/70/30/521207030.db2.gz ZNFGYSFPJDNOOQ-QEJZJMRPSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772760 521207041 /nfs/dbraw/zinc/20/70/41/521207041.db2.gz ZNFGYSFPJDNOOQ-QEJZJMRPSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-] ZINC000593772760 521207046 /nfs/dbraw/zinc/20/70/46/521207046.db2.gz ZNFGYSFPJDNOOQ-QEJZJMRPSA-N 1 1 371.441 2.750 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000611543824 521212083 /nfs/dbraw/zinc/21/20/83/521212083.db2.gz KCXDUPVNHHGEIO-DOMZBBRYSA-N 1 1 367.471 2.546 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000611543824 521212089 /nfs/dbraw/zinc/21/20/89/521212089.db2.gz KCXDUPVNHHGEIO-DOMZBBRYSA-N 1 1 367.471 2.546 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000611554934 521217458 /nfs/dbraw/zinc/21/74/58/521217458.db2.gz CJWKJWYKDQNEHI-YRGRVCCFSA-N 1 1 362.348 2.997 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611578016 521232083 /nfs/dbraw/zinc/23/20/83/521232083.db2.gz MLZUPDNHBHTULJ-ZDUSSCGKSA-N 1 1 357.357 2.935 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614715 521249455 /nfs/dbraw/zinc/24/94/55/521249455.db2.gz CLMDHNWBGLIFOZ-NWDGAFQWSA-N 1 1 355.341 2.553 20 5 FFBDMO C[C@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2sccc2C1 ZINC000611700540 521287406 /nfs/dbraw/zinc/28/74/06/521287406.db2.gz AQPRVUUUVOUMFO-GFCCVEGCSA-N 1 1 369.450 2.880 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552847 521293060 /nfs/dbraw/zinc/29/30/60/521293060.db2.gz JURYIFSFXPEOAC-KGLIPLIRSA-N 1 1 365.455 2.902 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH+](CC2CCSCC2)CC1 ZINC000602447761 521351901 /nfs/dbraw/zinc/35/19/01/521351901.db2.gz PPIZIFNZTPZCBF-UHFFFAOYSA-N 1 1 355.485 2.557 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCCC2)O1 ZINC000594058296 521378543 /nfs/dbraw/zinc/37/85/43/521378543.db2.gz RLHPVRQWPFRBJT-NVXWUHKLSA-N 1 1 364.442 2.758 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000599668512 521381291 /nfs/dbraw/zinc/38/12/91/521381291.db2.gz GPVCKCGLGHCVDM-UHFFFAOYSA-N 1 1 363.458 2.550 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594100870 521404789 /nfs/dbraw/zinc/40/47/89/521404789.db2.gz TUASBGNGQTYHAY-SOUVJXGZSA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594100870 521404794 /nfs/dbraw/zinc/40/47/94/521404794.db2.gz TUASBGNGQTYHAY-SOUVJXGZSA-N 1 1 364.446 2.831 20 5 FFBDMO C[C@](O)(C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(F)(F)F ZINC000602577408 521419307 /nfs/dbraw/zinc/41/93/07/521419307.db2.gz NSDREYOVEFNQIS-QMMMGPOBSA-N 1 1 363.155 2.822 20 5 FFBDMO COC(=O)C1C[C@H](C)[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000599711023 521419562 /nfs/dbraw/zinc/41/95/62/521419562.db2.gz TZARDPBBGUKEDX-RYUDHWBXSA-N 1 1 374.397 2.807 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](Cc3ccncc3)C1)OCCO2 ZINC000611983712 521419975 /nfs/dbraw/zinc/41/99/75/521419975.db2.gz CXFBAFAVSKHSNS-HNNXBMFYSA-N 1 1 355.394 2.826 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCCCS1(=O)=O ZINC000602605265 521434091 /nfs/dbraw/zinc/43/40/91/521434091.db2.gz XNNNQBVEVAOVSB-GFCCVEGCSA-N 1 1 366.361 2.671 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632106 521448528 /nfs/dbraw/zinc/44/85/28/521448528.db2.gz VOPBXQDGMXXZJO-WFBYXXMGSA-N 1 1 357.332 2.699 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632106 521448535 /nfs/dbraw/zinc/44/85/35/521448535.db2.gz VOPBXQDGMXXZJO-WFBYXXMGSA-N 1 1 357.332 2.699 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c([N+](=O)[O-])n1 ZINC000602691198 521481770 /nfs/dbraw/zinc/48/17/70/521481770.db2.gz OCEYCHATQBAPRO-GFCCVEGCSA-N 1 1 362.352 2.509 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c([N+](=O)[O-])n1 ZINC000602691198 521481774 /nfs/dbraw/zinc/48/17/74/521481774.db2.gz OCEYCHATQBAPRO-GFCCVEGCSA-N 1 1 362.352 2.509 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000602705869 521488047 /nfs/dbraw/zinc/48/80/47/521488047.db2.gz NLEMFUJEWMVWKA-NSHDSACASA-N 1 1 355.320 2.727 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]2N1 ZINC000602711489 521491975 /nfs/dbraw/zinc/49/19/75/521491975.db2.gz ZUNYBYNPPIJPIX-ZWNOBZJWSA-N 1 1 357.332 2.714 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597089484 521494811 /nfs/dbraw/zinc/49/48/11/521494811.db2.gz BJEJODVUNXJKAX-NSHDSACASA-N 1 1 355.826 2.778 20 5 FFBDMO C[N@@H+](CCCCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C1CC1 ZINC000597090823 521496666 /nfs/dbraw/zinc/49/66/66/521496666.db2.gz SFGDYRUZSJKNPL-UHFFFAOYSA-N 1 1 355.826 2.826 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599832237 521499206 /nfs/dbraw/zinc/49/92/06/521499206.db2.gz TWQVNJLAWYSYLK-CYBMUJFWSA-N 1 1 357.414 2.949 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000602794602 521536900 /nfs/dbraw/zinc/53/69/00/521536900.db2.gz JJFZJMPRKUXEBX-HNNXBMFYSA-N 1 1 354.414 2.614 20 5 FFBDMO COc1ccc([C@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cc1Br ZINC000602802056 521540835 /nfs/dbraw/zinc/54/08/35/521540835.db2.gz OMKYWAZBUBMCEW-VIFPVBQESA-N 1 1 369.219 2.950 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)c1 ZINC000602810741 521548348 /nfs/dbraw/zinc/54/83/48/521548348.db2.gz IJXBOEHPEOWMGM-OAHLLOKOSA-N 1 1 354.414 2.553 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@](F)(CO)C3)o2)c([N+](=O)[O-])c1 ZINC000619846847 521902612 /nfs/dbraw/zinc/90/26/12/521902612.db2.gz ANVFAIJMICNRPT-KRWDZBQOSA-N 1 1 350.346 2.770 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@](F)(CO)C3)o2)c([N+](=O)[O-])c1 ZINC000619846847 521902623 /nfs/dbraw/zinc/90/26/23/521902623.db2.gz ANVFAIJMICNRPT-KRWDZBQOSA-N 1 1 350.346 2.770 20 5 FFBDMO COCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000485396633 561318380 /nfs/dbraw/zinc/31/83/80/561318380.db2.gz XOWUVJNAFBNZOZ-HNNXBMFYSA-N 1 1 360.389 2.929 20 5 FFBDMO Nc1cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164627833 719083602 /nfs/dbraw/zinc/08/36/02/719083602.db2.gz RBRFFDBINKJHQH-CRAIPNDOSA-N 1 1 353.426 2.673 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727323 720348331 /nfs/dbraw/zinc/34/83/31/720348331.db2.gz SUNFDVAHRDOQTI-ZIAGYGMSSA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1c(C)c(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)ncc1[N+](=O)[O-] ZINC001164728998 720396122 /nfs/dbraw/zinc/39/61/22/720396122.db2.gz UQTKTTMJIOJYQB-DLBZAZTESA-N 1 1 353.426 2.855 20 5 FFBDMO Cc1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001164901701 721512414 /nfs/dbraw/zinc/51/24/14/721512414.db2.gz YDLPQNDFWUKPEQ-DOTOQJQBSA-N 1 1 372.400 2.779 20 5 FFBDMO Cc1ccnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC001164899727 721521521 /nfs/dbraw/zinc/52/15/21/721521521.db2.gz LYRBLYQERJPRDH-NVXWUHKLSA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[NH+](Cc4cccs4)CC3)c2c1 ZINC000022365946 727837466 /nfs/dbraw/zinc/83/74/66/727837466.db2.gz IPJAXMFKOZKKHX-UHFFFAOYSA-N 1 1 357.439 2.781 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)CNC(=O)OC(C)(C)C ZINC000171956566 729016752 /nfs/dbraw/zinc/01/67/52/729016752.db2.gz MHDBLAVDIVRVPL-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)CNC(=O)OC(C)(C)C ZINC000171956566 729016756 /nfs/dbraw/zinc/01/67/56/729016756.db2.gz MHDBLAVDIVRVPL-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO Cn1cc([C@@H]2CSCC[N@@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000191161946 729414764 /nfs/dbraw/zinc/41/47/64/729414764.db2.gz RDADNEOXYJGGIE-KRWDZBQOSA-N 1 1 362.455 2.887 20 5 FFBDMO Cn1cc([C@@H]2CSCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000191161946 729414765 /nfs/dbraw/zinc/41/47/65/729414765.db2.gz RDADNEOXYJGGIE-KRWDZBQOSA-N 1 1 362.455 2.887 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000856282372 730320933 /nfs/dbraw/zinc/32/09/33/730320933.db2.gz VISMCUQYTGYVJA-UHFFFAOYSA-N 1 1 354.426 2.650 20 5 FFBDMO C[C@@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000925167367 738484679 /nfs/dbraw/zinc/48/46/79/738484679.db2.gz BVYCFPQPSSROPY-KCXAZCMYSA-N 1 1 364.471 2.535 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000874838226 732106380 /nfs/dbraw/zinc/10/63/80/732106380.db2.gz OJLIFQPRFAEFHP-ZIAGYGMSSA-N 1 1 368.231 2.666 20 5 FFBDMO Cn1cc(C[NH+]2CCC(COc3ccc(Cl)nc3)CC2)c([N+](=O)[O-])n1 ZINC000877484500 732371152 /nfs/dbraw/zinc/37/11/52/732371152.db2.gz IGKPBQHNLFRDPB-UHFFFAOYSA-N 1 1 365.821 2.668 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000879560713 732723270 /nfs/dbraw/zinc/72/32/70/732723270.db2.gz IFHZXQDTTFTUMD-OLZOCXBDSA-N 1 1 365.455 2.617 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880007625 732817961 /nfs/dbraw/zinc/81/79/61/732817961.db2.gz KLJOBWSLOXQBEA-ZDUSSCGKSA-N 1 1 360.439 2.812 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880007625 732817963 /nfs/dbraw/zinc/81/79/63/732817963.db2.gz KLJOBWSLOXQBEA-ZDUSSCGKSA-N 1 1 360.439 2.812 20 5 FFBDMO COc1ccccc1[C@@H]1CSCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000880174852 732859902 /nfs/dbraw/zinc/85/99/02/732859902.db2.gz RSDGPCXBMGOPBW-INIZCTEOSA-N 1 1 362.455 2.980 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000886025941 733741248 /nfs/dbraw/zinc/74/12/48/733741248.db2.gz MTMJKSBFAFWZJN-CQSZACIVSA-N 1 1 350.419 2.821 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000886025941 733741250 /nfs/dbraw/zinc/74/12/50/733741250.db2.gz MTMJKSBFAFWZJN-CQSZACIVSA-N 1 1 350.419 2.821 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000928094115 738821745 /nfs/dbraw/zinc/82/17/45/738821745.db2.gz ZTAKZFPYWZZLPF-GXTWGEPZSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928094115 738821750 /nfs/dbraw/zinc/82/17/50/738821750.db2.gz ZTAKZFPYWZZLPF-GXTWGEPZSA-N 1 1 369.874 2.866 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])OCCC[NH+]1CCOCC1 ZINC000751641487 735902531 /nfs/dbraw/zinc/90/25/31/735902531.db2.gz QOXKUJAUJGDTFJ-UHFFFAOYSA-N 1 1 374.846 2.606 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000752246173 735970931 /nfs/dbraw/zinc/97/09/31/735970931.db2.gz FQQUDHJVAHMTJA-NSHDSACASA-N 1 1 363.867 2.565 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] ZINC000754507470 736166129 /nfs/dbraw/zinc/16/61/29/736166129.db2.gz CLDWLGLIIXYBDL-INIZCTEOSA-N 1 1 354.378 2.570 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C[C@H]2C1 ZINC000907804439 736669710 /nfs/dbraw/zinc/66/97/10/736669710.db2.gz DYFPFGDALKDNHV-OCAPTIKFSA-N 1 1 362.188 2.674 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000765734529 737150829 /nfs/dbraw/zinc/15/08/29/737150829.db2.gz JVVRDBGIUWZCIP-NEPJUHHUSA-N 1 1 354.838 2.872 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cccc4nsnc43)C2)nc1 ZINC000766894038 737272409 /nfs/dbraw/zinc/27/24/09/737272409.db2.gz IJEQJFJVGGILHJ-LBPRGKRZSA-N 1 1 356.411 2.681 20 5 FFBDMO O=C1OC[C@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000769483191 737534319 /nfs/dbraw/zinc/53/43/19/737534319.db2.gz GVQYZHQSXZGNGO-CQSZACIVSA-N 1 1 359.407 2.960 20 5 FFBDMO O=C1OC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000769483191 737534324 /nfs/dbraw/zinc/53/43/24/737534324.db2.gz GVQYZHQSXZGNGO-CQSZACIVSA-N 1 1 359.407 2.960 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000917007624 737735907 /nfs/dbraw/zinc/73/59/07/737735907.db2.gz BDFWYHTWHVFHPD-UHFFFAOYSA-N 1 1 363.311 2.624 20 5 FFBDMO CC(C)[N@H+]1CCCN(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)CC1 ZINC000774627659 738007019 /nfs/dbraw/zinc/00/70/19/738007019.db2.gz PUEXXCDZANQBNE-UHFFFAOYSA-N 1 1 351.838 2.972 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)CC[C@H]21 ZINC000774640374 738008772 /nfs/dbraw/zinc/00/87/72/738008772.db2.gz RXUYTFNSPRDOGN-BLLLJJGKSA-N 1 1 363.849 2.972 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776590748 738212246 /nfs/dbraw/zinc/21/22/46/738212246.db2.gz KGAMYCXIJCWFLW-PBHICJAKSA-N 1 1 350.415 2.684 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000923285260 738266568 /nfs/dbraw/zinc/26/65/68/738266568.db2.gz BEIIYNFJPCLCQC-UONOGXRCSA-N 1 1 367.833 2.712 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785728804 738991727 /nfs/dbraw/zinc/99/17/27/738991727.db2.gz JDYSBZSRINWGEL-QWRGUYRKSA-N 1 1 369.805 2.603 20 5 FFBDMO CN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCC[N@@H+](C)C1 ZINC000929832133 739026434 /nfs/dbraw/zinc/02/64/34/739026434.db2.gz AUKFFWSUWKODAI-LLVKDONJSA-N 1 1 358.345 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[NH+]2CCC3(CC2)COCCO3)c1 ZINC000931705273 739314473 /nfs/dbraw/zinc/31/44/73/739314473.db2.gz DUOKDENWJNGQJF-UHFFFAOYSA-N 1 1 371.231 2.739 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[NH+](CC(C)C)CC1 ZINC000790263059 739430644 /nfs/dbraw/zinc/43/06/44/739430644.db2.gz LSWBSZRLCQPTAC-UHFFFAOYSA-N 1 1 355.822 2.813 20 5 FFBDMO Cc1cccc(NCCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])[nH+]1 ZINC000790746437 739490071 /nfs/dbraw/zinc/49/00/71/739490071.db2.gz SUUFXYPKUMZDDI-UHFFFAOYSA-N 1 1 366.780 2.862 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCSC[C@@H]1C ZINC000934301828 739763232 /nfs/dbraw/zinc/76/32/32/739763232.db2.gz UJPHHJREDRTFGV-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2C[C@@H]3CSC[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000934775144 739838155 /nfs/dbraw/zinc/83/81/55/739838155.db2.gz WSJFJOXQWGSGJE-PXAZEXFGSA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2C[C@@H]3CSC[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000934775144 739838162 /nfs/dbraw/zinc/83/81/62/739838162.db2.gz WSJFJOXQWGSGJE-PXAZEXFGSA-N 1 1 365.455 2.617 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000796165936 740110592 /nfs/dbraw/zinc/11/05/92/740110592.db2.gz WKGCTKNPPANCEB-AWEZNQCLSA-N 1 1 351.403 2.574 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000797076852 740209997 /nfs/dbraw/zinc/20/99/97/740209997.db2.gz JXJYFYIIHCPAEO-CQSZACIVSA-N 1 1 350.415 2.525 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000803509925 740806012 /nfs/dbraw/zinc/80/60/12/740806012.db2.gz NBXFEMBESKSYKW-UHFFFAOYSA-N 1 1 356.806 2.794 20 5 FFBDMO CC(C)(C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000805614433 740991818 /nfs/dbraw/zinc/99/18/18/740991818.db2.gz PQCALANEXPOFTP-UHFFFAOYSA-N 1 1 369.805 2.604 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000808133139 741191393 /nfs/dbraw/zinc/19/13/93/741191393.db2.gz MZBVWYJJKOZDDR-UHFFFAOYSA-N 1 1 351.476 2.524 20 5 FFBDMO CN(CCCN(C)c1nc2ccc([N+](=O)[O-])cc2s1)CC[NH+](C)C ZINC000808133139 741191395 /nfs/dbraw/zinc/19/13/95/741191395.db2.gz MZBVWYJJKOZDDR-UHFFFAOYSA-N 1 1 351.476 2.524 20 5 FFBDMO Cc1cc(Cl)c(S(=O)(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000809861092 741357219 /nfs/dbraw/zinc/35/72/19/741357219.db2.gz NOPTVYKFHHFZRM-NSHDSACASA-N 1 1 363.867 2.564 20 5 FFBDMO CCO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1n1cccn1 ZINC000815166947 741908353 /nfs/dbraw/zinc/90/83/53/741908353.db2.gz MXJVTHFXULKJHC-ARFHVFGLSA-N 1 1 350.806 2.953 20 5 FFBDMO Cc1cc(NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)cn2cc[nH+]c12 ZINC000818055967 742233566 /nfs/dbraw/zinc/23/35/66/742233566.db2.gz JDBLYUVVQBCOCQ-UHFFFAOYSA-N 1 1 354.351 2.808 20 5 FFBDMO C[N@@H+](CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1)CC1CCCCCC1 ZINC001029964483 742823959 /nfs/dbraw/zinc/82/39/59/742823959.db2.gz LEQOLIFKDBTUHJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@H+](CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CCCCCC1 ZINC001029964483 742823965 /nfs/dbraw/zinc/82/39/65/742823965.db2.gz LEQOLIFKDBTUHJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@@H+](CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CCCCCC1 ZINC001029964483 742823970 /nfs/dbraw/zinc/82/39/70/742823970.db2.gz LEQOLIFKDBTUHJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503871 742928659 /nfs/dbraw/zinc/92/86/59/742928659.db2.gz ZXLRLIPQCVBAEH-AEFFLSMTSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503871 742928661 /nfs/dbraw/zinc/92/86/61/742928661.db2.gz ZXLRLIPQCVBAEH-AEFFLSMTSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1cc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)cs1 ZINC001035186660 742944311 /nfs/dbraw/zinc/94/43/11/742944311.db2.gz IRORNAYSAYUMGB-HZPDHXFCSA-N 1 1 363.483 2.536 20 5 FFBDMO Cc1cc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cs1 ZINC001035186660 742944315 /nfs/dbraw/zinc/94/43/15/742944315.db2.gz IRORNAYSAYUMGB-HZPDHXFCSA-N 1 1 363.483 2.536 20 5 FFBDMO Cc1cc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cs1 ZINC001035186660 742944334 /nfs/dbraw/zinc/94/43/34/742944334.db2.gz IRORNAYSAYUMGB-HZPDHXFCSA-N 1 1 363.483 2.536 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NC[C@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000823724455 742969729 /nfs/dbraw/zinc/96/97/29/742969729.db2.gz ZEVFBPAERCXZMX-ZDUSSCGKSA-N 1 1 369.849 2.643 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2cccc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325398 743510477 /nfs/dbraw/zinc/51/04/77/743510477.db2.gz BOPQLMXUBMJBAB-BASLNEPJSA-N 1 1 365.861 2.770 20 5 FFBDMO CCS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000827580979 743605285 /nfs/dbraw/zinc/60/52/85/743605285.db2.gz YBHFHRHBEVVMAN-UHFFFAOYSA-N 1 1 367.254 2.959 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000830673530 745402953 /nfs/dbraw/zinc/40/29/53/745402953.db2.gz DRZZABRACPPNQB-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000830673530 745402956 /nfs/dbraw/zinc/40/29/56/745402956.db2.gz DRZZABRACPPNQB-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CO[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1(C)C ZINC000831544206 745544582 /nfs/dbraw/zinc/54/45/82/745544582.db2.gz VGZPMERIHMXJJY-AWEZNQCLSA-N 1 1 355.822 2.934 20 5 FFBDMO CO[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1(C)C ZINC000831544206 745544586 /nfs/dbraw/zinc/54/45/86/745544586.db2.gz VGZPMERIHMXJJY-AWEZNQCLSA-N 1 1 355.822 2.934 20 5 FFBDMO CCn1cc([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000832309173 745675167 /nfs/dbraw/zinc/67/51/67/745675167.db2.gz FRRZCBGFNZHCMS-JTQLQIEISA-N 1 1 351.794 2.754 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)[C@@H]1CCCO1 ZINC000839589581 746865135 /nfs/dbraw/zinc/86/51/35/746865135.db2.gz HWELQJXWZBIQRZ-YPMHNXCESA-N 1 1 359.220 2.641 20 5 FFBDMO CC(C)[N@@H+](C)CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000839865700 746947085 /nfs/dbraw/zinc/94/70/85/746947085.db2.gz YTMPYXJOIZYSMS-ZDUSSCGKSA-N 1 1 351.300 2.794 20 5 FFBDMO CC(C)Oc1cc(C(=O)OCC[NH+]2CCSCC2)ccc1[N+](=O)[O-] ZINC000840650087 747147817 /nfs/dbraw/zinc/14/78/17/747147817.db2.gz YWIZUGSTKSXGRV-UHFFFAOYSA-N 1 1 354.428 2.588 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000844903118 748132630 /nfs/dbraw/zinc/13/26/30/748132630.db2.gz SRMUBSFWYXBIAS-CKEIUWERSA-N 1 1 353.850 2.967 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848510493 748946268 /nfs/dbraw/zinc/94/62/68/748946268.db2.gz TXEPIJRAFUUAEN-OLZOCXBDSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000851864788 749709792 /nfs/dbraw/zinc/70/97/92/749709792.db2.gz KFRCJVSNRLBBPI-PWSUYJOCSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000851864788 749709796 /nfs/dbraw/zinc/70/97/96/749709796.db2.gz KFRCJVSNRLBBPI-PWSUYJOCSA-N 1 1 354.407 2.626 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CCO ZINC000852455081 749863588 /nfs/dbraw/zinc/86/35/88/749863588.db2.gz DMQMQMAVTHEEAA-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CCO ZINC000852455081 749863594 /nfs/dbraw/zinc/86/35/94/749863594.db2.gz DMQMQMAVTHEEAA-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C2 ZINC000854739867 750362898 /nfs/dbraw/zinc/36/28/98/750362898.db2.gz YKNGKQBQCXIJKF-MRXNPFEDSA-N 1 1 353.369 2.631 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1F ZINC000855054890 750419112 /nfs/dbraw/zinc/41/91/12/750419112.db2.gz AOYPOZQOFDDIPU-RYUDHWBXSA-N 1 1 353.369 2.928 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266636 971206357 /nfs/dbraw/zinc/20/63/57/971206357.db2.gz SDWBLSUVVNNLHX-NVXWUHKLSA-N 1 1 357.410 2.844 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266636 971206360 /nfs/dbraw/zinc/20/63/60/971206360.db2.gz SDWBLSUVVNNLHX-NVXWUHKLSA-N 1 1 357.410 2.844 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000248894321 959811741 /nfs/dbraw/zinc/81/17/41/959811741.db2.gz SYRLSGNTKNCUSP-SUMWQHHRSA-N 1 1 357.385 2.984 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872281721 1013201192 /nfs/dbraw/zinc/20/11/92/1013201192.db2.gz YLIOHUBPBWPKIM-RDJZCZTQSA-N 1 1 364.442 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(OC[C@@H]3CCCCO3)CC2)c1 ZINC000176211303 965568827 /nfs/dbraw/zinc/56/88/27/965568827.db2.gz CSEGADVUXOJZCA-SFHVURJKSA-N 1 1 374.441 2.952 20 5 FFBDMO Cn1ccc([C@@H]2CCC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC001176252181 1013670184 /nfs/dbraw/zinc/67/01/84/1013670184.db2.gz DYHBUPBNLVKLBU-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1ccc([C@@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC001176252181 1013670192 /nfs/dbraw/zinc/67/01/92/1013670192.db2.gz DYHBUPBNLVKLBU-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000874827006 1013910687 /nfs/dbraw/zinc/91/06/87/1013910687.db2.gz AGCGJLCENFUWCS-PMACEKPBSA-N 1 1 361.445 2.990 20 5 FFBDMO C[N@@H+](Cc1ccccc1C1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985425843 974052466 /nfs/dbraw/zinc/05/24/66/974052466.db2.gz LDFKBIXQBXRWMZ-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO C[N@H+](Cc1ccccc1C1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425843 974052472 /nfs/dbraw/zinc/05/24/72/974052472.db2.gz LDFKBIXQBXRWMZ-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO C[N@@H+](Cc1ccccc1C1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425843 974052484 /nfs/dbraw/zinc/05/24/84/974052484.db2.gz LDFKBIXQBXRWMZ-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)CN(C)c3ccccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000899511754 977200250 /nfs/dbraw/zinc/20/02/50/977200250.db2.gz IRMVYPUKFNVVLP-UHFFFAOYSA-N 1 1 371.441 2.777 20 5 FFBDMO C[C@@]1(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CCN(Cc2ccccc2)C1 ZINC000877496420 1014600481 /nfs/dbraw/zinc/60/04/81/1014600481.db2.gz SGUCWOKIOXIVLM-QLOJAFMTSA-N 1 1 369.469 2.997 20 5 FFBDMO Cn1cc(C[N@@H+]2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)c([N+](=O)[O-])n1 ZINC000877658781 1014664776 /nfs/dbraw/zinc/66/47/76/1014664776.db2.gz XJOSGQFVIYRYRA-INIZCTEOSA-N 1 1 357.414 2.644 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)c([N+](=O)[O-])n1 ZINC000877658781 1014664782 /nfs/dbraw/zinc/66/47/82/1014664782.db2.gz XJOSGQFVIYRYRA-INIZCTEOSA-N 1 1 357.414 2.644 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687088 1014677627 /nfs/dbraw/zinc/67/76/27/1014677627.db2.gz DBINMQBFJGUUFV-ROUUACIJSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687088 1014677636 /nfs/dbraw/zinc/67/76/36/1014677636.db2.gz DBINMQBFJGUUFV-ROUUACIJSA-N 1 1 354.410 2.599 20 5 FFBDMO O=C1NCCC12CC[NH+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CC2 ZINC000877782879 1014726080 /nfs/dbraw/zinc/72/60/80/1014726080.db2.gz SDLHQDDNXLHGDX-UHFFFAOYSA-N 1 1 372.450 2.820 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000878286179 1014965895 /nfs/dbraw/zinc/96/58/95/1014965895.db2.gz KIVJQCXFWCXKHH-SJORKVTESA-N 1 1 362.405 2.827 20 5 FFBDMO C[C@@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000912814265 984126436 /nfs/dbraw/zinc/12/64/36/984126436.db2.gz UURMYGPZWQICSI-LRDDRELGSA-N 1 1 359.430 2.664 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000045873486 984544946 /nfs/dbraw/zinc/54/49/46/984544946.db2.gz HVCWUQOLACMJHD-UHFFFAOYSA-N 1 1 370.453 2.913 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000046404140 984675853 /nfs/dbraw/zinc/67/58/53/984675853.db2.gz MTZIWWANKPLJLG-UHFFFAOYSA-N 1 1 368.437 2.918 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000765071412 984953573 /nfs/dbraw/zinc/95/35/73/984953573.db2.gz WHIMASPBCVPTBN-KRWDZBQOSA-N 1 1 374.441 2.870 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084587 984956973 /nfs/dbraw/zinc/95/69/73/984956973.db2.gz WEDJSFZCPNKNSV-FZKQIMNGSA-N 1 1 354.414 2.990 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761294534 985132836 /nfs/dbraw/zinc/13/28/36/985132836.db2.gz XHRHCXHTHDJAMR-INIZCTEOSA-N 1 1 357.458 2.874 20 5 FFBDMO Cc1nn(CN2CC[C@H](C3CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761294534 985132845 /nfs/dbraw/zinc/13/28/45/985132845.db2.gz XHRHCXHTHDJAMR-INIZCTEOSA-N 1 1 357.458 2.874 20 5 FFBDMO Cc1nn(CN2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000173531940 985858021 /nfs/dbraw/zinc/85/80/21/985858021.db2.gz MZOSAEQGHOFBBZ-HNNXBMFYSA-N 1 1 357.458 2.962 20 5 FFBDMO COC(=O)/C=C\c1ccc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])c1 ZINC000914572058 987791369 /nfs/dbraw/zinc/79/13/69/987791369.db2.gz NFTNKYGDGVCUEC-VURMDHGXSA-N 1 1 370.409 2.968 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC2)CC1 ZINC000879248615 1015437155 /nfs/dbraw/zinc/43/71/55/1015437155.db2.gz RDAAMMFCICAZNH-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO Cc1cc(C)c(C[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001005379847 989743762 /nfs/dbraw/zinc/74/37/62/989743762.db2.gz XZYLUQMIYZPCSY-IEBWSBKVSA-N 1 1 359.470 2.700 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c1 ZINC000154429274 990238737 /nfs/dbraw/zinc/23/87/37/990238737.db2.gz BEFQZYZZWWFTNH-WOJBJXKFSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)cc1 ZINC000879500095 1015563997 /nfs/dbraw/zinc/56/39/97/1015563997.db2.gz OOAYYCKZDCNQRJ-MSOLQXFVSA-N 1 1 354.410 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H]2CC[N@@H+]2C2CCOCC2)c1 ZINC000922950854 990764620 /nfs/dbraw/zinc/76/46/20/990764620.db2.gz PYZDGKNAEUWKMJ-HNNXBMFYSA-N 1 1 371.384 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@@H]2CC[N@H+]2C2CCOCC2)c1 ZINC000922950854 990764627 /nfs/dbraw/zinc/76/46/27/990764627.db2.gz PYZDGKNAEUWKMJ-HNNXBMFYSA-N 1 1 371.384 2.539 20 5 FFBDMO C[NH+](C)CC[C@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)C(C)(C)C ZINC001598215505 990878192 /nfs/dbraw/zinc/87/81/92/990878192.db2.gz ZGQVMCRPFAYPQM-INIZCTEOSA-N 1 1 367.446 2.514 20 5 FFBDMO CC1(C)[C@@H](c2ccccc2F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000879638862 1015621232 /nfs/dbraw/zinc/62/12/32/1015621232.db2.gz GHEKIKRNSSAKRJ-GDBMZVCRSA-N 1 1 362.405 2.559 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2ccnn2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000879685305 1015638203 /nfs/dbraw/zinc/63/82/03/1015638203.db2.gz GETCHUAKCTUVIV-SNVBAGLBSA-N 1 1 370.356 2.832 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880032065 1015738670 /nfs/dbraw/zinc/73/86/70/1015738670.db2.gz YIKNRRZIGDYMGS-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1 ZINC000810052461 994678376 /nfs/dbraw/zinc/67/83/76/994678376.db2.gz ZJHXJMPPGANHTI-AZUAARDMSA-N 1 1 353.422 2.765 20 5 FFBDMO COc1cc([N+](=O)[O-])cnc1NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001132747131 995102191 /nfs/dbraw/zinc/10/21/91/995102191.db2.gz AOYHJUPRKLVLSX-HNNXBMFYSA-N 1 1 370.409 2.849 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001132801141 995143300 /nfs/dbraw/zinc/14/33/00/995143300.db2.gz JVPGUTLUPTXHAX-UXLLHSPISA-N 1 1 374.485 2.901 20 5 FFBDMO CCOC1CC(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000813172419 995633738 /nfs/dbraw/zinc/63/37/38/995633738.db2.gz LLRVPWLOYBNUJC-NXYGQSRBSA-N 1 1 362.426 2.918 20 5 FFBDMO CCOC1CC(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000813172419 995633740 /nfs/dbraw/zinc/63/37/40/995633740.db2.gz LLRVPWLOYBNUJC-NXYGQSRBSA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1ccccc1C[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1 ZINC001054264657 1015996183 /nfs/dbraw/zinc/99/61/83/1015996183.db2.gz NZXDIRWFIDZRER-WOJBJXKFSA-N 1 1 365.433 2.792 20 5 FFBDMO Cc1ccccc1C[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001054264657 1015996188 /nfs/dbraw/zinc/99/61/88/1015996188.db2.gz NZXDIRWFIDZRER-WOJBJXKFSA-N 1 1 365.433 2.792 20 5 FFBDMO Cc1ccccc1C[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1 ZINC001054264657 1015996192 /nfs/dbraw/zinc/99/61/92/1015996192.db2.gz NZXDIRWFIDZRER-WOJBJXKFSA-N 1 1 365.433 2.792 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000826752361 1016046516 /nfs/dbraw/zinc/04/65/16/1016046516.db2.gz ZAYJUYNUIWGHFT-ZYSHUDEJSA-N 1 1 357.454 2.937 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000826750583 1016059661 /nfs/dbraw/zinc/05/96/61/1016059661.db2.gz GZDFMFCAZUHCFE-HNNXBMFYSA-N 1 1 363.433 2.905 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000823993521 996773885 /nfs/dbraw/zinc/77/38/85/996773885.db2.gz GZVSGYWELHXKBG-INIZCTEOSA-N 1 1 369.425 2.963 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000732165176 998498160 /nfs/dbraw/zinc/49/81/60/998498160.db2.gz CTWKVROQQZJTEA-QGZVFWFLSA-N 1 1 372.469 2.894 20 5 FFBDMO Cn1cc(CN2CCCC[C@]3(CC[NH2+]C3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000903959476 1016333010 /nfs/dbraw/zinc/33/30/10/1016333010.db2.gz IQVZTBXVHQJGKG-HXUWFJFHSA-N 1 1 369.469 2.961 20 5 FFBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000737422758 999716573 /nfs/dbraw/zinc/71/65/73/999716573.db2.gz LACVDWOOKHUAFY-UHFFFAOYSA-N 1 1 358.417 2.992 20 5 FFBDMO CC(C)(C)c1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086082840 999754678 /nfs/dbraw/zinc/75/46/78/999754678.db2.gz FPFMFHBGXIVTRN-BZZMCLGOSA-N 1 1 359.470 2.634 20 5 FFBDMO O=C(C[N@H+]1CCC2(CCCC2)C1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000744419780 999855028 /nfs/dbraw/zinc/85/50/28/999855028.db2.gz ARFULEOSLDIBBS-UHFFFAOYSA-N 1 1 372.469 2.510 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169010584 1000015342 /nfs/dbraw/zinc/01/53/42/1000015342.db2.gz DVBRXITVXODCRJ-JJXSEGSLSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169010306 1000015401 /nfs/dbraw/zinc/01/54/01/1000015401.db2.gz COSOLORFHOAUDC-KLHDSHLOSA-N 1 1 353.463 2.763 20 5 FFBDMO CCOC(=O)C[N@H+](Cc1ccc(OC)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038243 1000016972 /nfs/dbraw/zinc/01/69/72/1000016972.db2.gz XIBAIIKFMDZTGD-JKSUJKDBSA-N 1 1 350.415 2.506 20 5 FFBDMO CCOC(=O)C[N@@H+](Cc1ccc(OC)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169038243 1000016974 /nfs/dbraw/zinc/01/69/74/1000016974.db2.gz XIBAIIKFMDZTGD-JKSUJKDBSA-N 1 1 350.415 2.506 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)CN1c1cccc(F)c1 ZINC001169018877 1000017177 /nfs/dbraw/zinc/01/71/77/1000017177.db2.gz CWPGKPOHYMLZIA-GMBSWORKSA-N 1 1 361.417 2.700 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)s1 ZINC001169020112 1000017511 /nfs/dbraw/zinc/01/75/11/1000017511.db2.gz IHYJSKMSQPNCNN-HDMKZQKVSA-N 1 1 363.483 2.931 20 5 FFBDMO Cc1ccc(O[C@@H]2C[C@@H]3CN([C@H]4CC[C@H](C[N+](=O)[O-])C4)CC[N@H+]3C2)cc1 ZINC001169026357 1000018069 /nfs/dbraw/zinc/01/80/69/1000018069.db2.gz LHCGIBCMNLZYTE-PNYFIKQUSA-N 1 1 359.470 2.578 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169026219 1000018094 /nfs/dbraw/zinc/01/80/94/1000018094.db2.gz VYDZSLOGBDCAFH-OGWHTMIXSA-N 1 1 361.442 2.529 20 5 FFBDMO O=C(c1ccc(Cl)cc1)N1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049642 1000018658 /nfs/dbraw/zinc/01/86/58/1000018658.db2.gz XENIIFWDLLEVAN-PBHICJAKSA-N 1 1 365.861 2.933 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767122802 1000100295 /nfs/dbraw/zinc/10/02/95/1000100295.db2.gz ISOCEGXNDOEINH-OAHLLOKOSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(F)cc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767122802 1000100297 /nfs/dbraw/zinc/10/02/97/1000100297.db2.gz ISOCEGXNDOEINH-OAHLLOKOSA-N 1 1 367.421 2.615 20 5 FFBDMO CCCc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001000674194 1016423597 /nfs/dbraw/zinc/42/35/97/1016423597.db2.gz MGQHBEXQGUWINE-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCCc1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000674194 1016423605 /nfs/dbraw/zinc/42/36/05/1016423605.db2.gz MGQHBEXQGUWINE-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCCc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000674194 1016423611 /nfs/dbraw/zinc/42/36/11/1016423611.db2.gz MGQHBEXQGUWINE-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO C[C@@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000770671272 1000871701 /nfs/dbraw/zinc/87/17/01/1000871701.db2.gz QGAKMKYXIVNYFF-CQSZACIVSA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000770671272 1000871708 /nfs/dbraw/zinc/87/17/08/1000871708.db2.gz QGAKMKYXIVNYFF-CQSZACIVSA-N 1 1 372.425 2.833 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cn1 ZINC000771301095 1001069522 /nfs/dbraw/zinc/06/95/22/1001069522.db2.gz SCNRVOOIYIAKLL-UHFFFAOYSA-N 1 1 355.358 2.583 20 5 FFBDMO CCCCCC[C@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000785862697 1001498287 /nfs/dbraw/zinc/49/82/87/1001498287.db2.gz CYXKBVCHIDEZHN-HNNXBMFYSA-N 1 1 365.478 2.903 20 5 FFBDMO Nc1ccc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000786575346 1001611038 /nfs/dbraw/zinc/61/10/38/1001611038.db2.gz JRAORKONBYSVPX-UHFFFAOYSA-N 1 1 359.405 2.550 20 5 FFBDMO Cc1cc(F)ccc1[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000746669442 1001681920 /nfs/dbraw/zinc/68/19/20/1001681920.db2.gz CLPAQVNUVQOFET-RHSMWYFYSA-N 1 1 360.389 2.657 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1 ZINC000774847683 1002883174 /nfs/dbraw/zinc/88/31/74/1002883174.db2.gz WOXYLNMJXQKVLC-ZDUSSCGKSA-N 1 1 357.370 2.981 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1 ZINC000774847683 1002883184 /nfs/dbraw/zinc/88/31/84/1002883184.db2.gz WOXYLNMJXQKVLC-ZDUSSCGKSA-N 1 1 357.370 2.981 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1F ZINC001185413706 1002949188 /nfs/dbraw/zinc/94/91/88/1002949188.db2.gz WXTVBQKSQXCUBX-QWHCGFSZSA-N 1 1 373.450 2.584 20 5 FFBDMO COC(=O)CC[C@H]1CC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352802 1003121612 /nfs/dbraw/zinc/12/16/12/1003121612.db2.gz QQPBAYFSRSSACT-KGLIPLIRSA-N 1 1 350.415 2.810 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341983 1003129543 /nfs/dbraw/zinc/12/95/43/1003129543.db2.gz LHANOAOVCCIOQZ-CABCVRRESA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341983 1003129551 /nfs/dbraw/zinc/12/95/51/1003129551.db2.gz LHANOAOVCCIOQZ-CABCVRRESA-N 1 1 374.441 2.509 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCOC[C@H](C3CCC3)C2)nc1-c1ccncc1 ZINC000793747753 1003491770 /nfs/dbraw/zinc/49/17/70/1003491770.db2.gz SWYNJULGRRXSKH-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCOC[C@H](C3CCC3)C2)nc1-c1ccncc1 ZINC000793747753 1003491774 /nfs/dbraw/zinc/49/17/74/1003491774.db2.gz SWYNJULGRRXSKH-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO COc1cccc(C[NH+]2CCN(Cc3ccc([N+](=O)[O-])cc3OC)CC2)c1 ZINC001197076750 1004073077 /nfs/dbraw/zinc/07/30/77/1004073077.db2.gz GVKCPQQSOQRMQY-UHFFFAOYSA-N 1 1 371.437 2.930 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805776972 1004129310 /nfs/dbraw/zinc/12/93/10/1004129310.db2.gz XGUHLJNGIOGXGW-IAGOWNOFSA-N 1 1 365.430 2.619 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)N(Cc1ccc(C[NH+]3CCOCC3)cc1)CC2 ZINC001193130007 1004382797 /nfs/dbraw/zinc/38/27/97/1004382797.db2.gz OHCDQWHDJVKJCI-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2cnccn2)C1 ZINC001198166070 1004518756 /nfs/dbraw/zinc/51/87/56/1004518756.db2.gz XYPCSSZZRBZJFU-AWEZNQCLSA-N 1 1 355.398 2.511 20 5 FFBDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194731788 1004796099 /nfs/dbraw/zinc/79/60/99/1004796099.db2.gz GBLJOGATABMJPT-MFKMUULPSA-N 1 1 366.805 2.891 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326371 1016971062 /nfs/dbraw/zinc/97/10/62/1016971062.db2.gz ZLXJPKBKVUGPAS-SJFSSXKUSA-N 1 1 371.481 2.994 20 5 FFBDMO COc1ccc(CC(=O)OC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000851467248 1005889505 /nfs/dbraw/zinc/88/95/05/1005889505.db2.gz SFLPNNNKULZKBK-KRWDZBQOSA-N 1 1 370.405 2.964 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000851936438 1005924341 /nfs/dbraw/zinc/92/43/41/1005924341.db2.gz MZXJOOXLIIXBQX-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000851936438 1005924343 /nfs/dbraw/zinc/92/43/43/1005924343.db2.gz MZXJOOXLIIXBQX-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1 ZINC000852094638 1005940922 /nfs/dbraw/zinc/94/09/22/1005940922.db2.gz MPYAZVSVMRBMMP-DLBZAZTESA-N 1 1 374.368 2.828 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852298950 1005966263 /nfs/dbraw/zinc/96/62/63/1005966263.db2.gz IVIACUXNDNSLMR-NSHDSACASA-N 1 1 369.381 2.576 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852298950 1005966270 /nfs/dbraw/zinc/96/62/70/1005966270.db2.gz IVIACUXNDNSLMR-NSHDSACASA-N 1 1 369.381 2.576 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000776594198 1006009580 /nfs/dbraw/zinc/00/95/80/1006009580.db2.gz YIVGBAOCERKHGZ-VQTJNVASSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)cc1 ZINC000776594198 1006009589 /nfs/dbraw/zinc/00/95/89/1006009589.db2.gz YIVGBAOCERKHGZ-VQTJNVASSA-N 1 1 354.406 2.802 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000813828100 1006047032 /nfs/dbraw/zinc/04/70/32/1006047032.db2.gz ZOUUWSJRDVILMR-PBHICJAKSA-N 1 1 368.437 2.878 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]12 ZINC000852496934 1006055396 /nfs/dbraw/zinc/05/53/96/1006055396.db2.gz SKSKMGHBXRSDAI-TVFCKZIOSA-N 1 1 362.426 2.682 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000110872592 1006189656 /nfs/dbraw/zinc/18/96/56/1006189656.db2.gz BGXFOPKHBREEPL-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000882979990 1006585874 /nfs/dbraw/zinc/58/58/74/1006585874.db2.gz VIHLOYJCFHAXDG-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000854570036 1006896572 /nfs/dbraw/zinc/89/65/72/1006896572.db2.gz NTYOQVBTRSYOHI-KGAUPUERSA-N 1 1 373.453 2.710 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC001189720836 1007221929 /nfs/dbraw/zinc/22/19/29/1007221929.db2.gz YICDQVCMPRGFFA-UHFFFAOYSA-N 1 1 369.487 2.612 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000817490501 1007618042 /nfs/dbraw/zinc/61/80/42/1007618042.db2.gz FXGXRGZLUWGDBW-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856671002 1007941889 /nfs/dbraw/zinc/94/18/89/1007941889.db2.gz LHMDZBNEDXZTQD-FZKQIMNGSA-N 1 1 360.414 2.671 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H](O)c2ccnn2C)CC1 ZINC000856800801 1007980109 /nfs/dbraw/zinc/98/01/09/1007980109.db2.gz WAVHVZDPNPOIJX-IBGZPJMESA-N 1 1 374.441 2.673 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000819275536 1008097827 /nfs/dbraw/zinc/09/78/27/1008097827.db2.gz WVMUDIRSGWFRGN-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000819275536 1008097834 /nfs/dbraw/zinc/09/78/34/1008097834.db2.gz WVMUDIRSGWFRGN-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000819275536 1008097841 /nfs/dbraw/zinc/09/78/41/1008097841.db2.gz WVMUDIRSGWFRGN-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO CCC(=O)c1ccc(N2CCC(C)([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000858764697 1008418671 /nfs/dbraw/zinc/41/86/71/1008418671.db2.gz UPXFRLOZYNBLNM-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c1 ZINC000859588738 1008581876 /nfs/dbraw/zinc/58/18/76/1008581876.db2.gz JMXNTQRDVNZUJQ-FQEVSTJZSA-N 1 1 370.405 2.865 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3ncccn3)C2)c2c(c1)COCO2 ZINC000886676768 1008812145 /nfs/dbraw/zinc/81/21/45/1008812145.db2.gz LRKLOCYZXSPSBH-ZDUSSCGKSA-N 1 1 356.382 2.631 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3ncccn3)C2)c2c(c1)COCO2 ZINC000886676768 1008812157 /nfs/dbraw/zinc/81/21/57/1008812157.db2.gz LRKLOCYZXSPSBH-ZDUSSCGKSA-N 1 1 356.382 2.631 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3ncccn3)C2)c([N+](=O)[O-])c1 ZINC000886681140 1008817670 /nfs/dbraw/zinc/81/76/70/1008817670.db2.gz SRAPOVQUEURKIU-AWEZNQCLSA-N 1 1 358.398 2.652 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cc2ccccc2o1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458631 1008995167 /nfs/dbraw/zinc/99/51/67/1008995167.db2.gz PCLRFVINWLMICH-IAGOWNOFSA-N 1 1 359.426 2.864 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000823286714 1009007126 /nfs/dbraw/zinc/00/71/26/1009007126.db2.gz RADSFFIIIHXODO-UHFFFAOYSA-N 1 1 358.398 2.694 20 5 FFBDMO C[N@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000823633059 1009148160 /nfs/dbraw/zinc/14/81/60/1009148160.db2.gz BMEMIJSWYLSOGB-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000823633059 1009148168 /nfs/dbraw/zinc/14/81/68/1009148168.db2.gz BMEMIJSWYLSOGB-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000823950710 1009276364 /nfs/dbraw/zinc/27/63/64/1009276364.db2.gz JZRQWMGEVCLYAU-UHFFFAOYSA-N 1 1 371.397 2.956 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)CC1 ZINC000865539664 1010809675 /nfs/dbraw/zinc/80/96/75/1010809675.db2.gz UHZQGNRHETWISC-CYBMUJFWSA-N 1 1 360.389 2.504 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H](O)[C@H](F)CC3)CC2)c(F)c1 ZINC001173010152 1012178778 /nfs/dbraw/zinc/17/87/78/1012178778.db2.gz NCXLQIAVZKAYIZ-CZUORRHYSA-N 1 1 373.375 2.637 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@H]1C ZINC001173195868 1012338147 /nfs/dbraw/zinc/33/81/47/1012338147.db2.gz JUEOHMNMIDBDAF-FRRDWIJNSA-N 1 1 368.405 2.947 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880035 1012617174 /nfs/dbraw/zinc/61/71/74/1012617174.db2.gz UAXPCIURHHILEK-IEBWSBKVSA-N 1 1 373.384 2.508 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870905692 1012626786 /nfs/dbraw/zinc/62/67/86/1012626786.db2.gz BWARNVHEVVKUDY-WOJBJXKFSA-N 1 1 369.421 2.543 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001275748154 1012955431 /nfs/dbraw/zinc/95/54/31/1012955431.db2.gz IBKMLGQIQHCHBM-AWEZNQCLSA-N 1 1 356.426 2.885 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1CCCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291119 1017271941 /nfs/dbraw/zinc/27/19/41/1017271941.db2.gz KPGQQEUHIYLNEE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](CC1CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291119 1017271946 /nfs/dbraw/zinc/27/19/46/1017271946.db2.gz KPGQQEUHIYLNEE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291119 1017271954 /nfs/dbraw/zinc/27/19/54/1017271954.db2.gz KPGQQEUHIYLNEE-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000827925956 1019011716 /nfs/dbraw/zinc/01/17/16/1019011716.db2.gz FJLXYUXPPAXMNC-MRXNPFEDSA-N 1 1 373.434 2.809 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801836644 1019434290 /nfs/dbraw/zinc/43/42/90/1019434290.db2.gz POWUJVISLNVLMR-TZMCWYRMSA-N 1 1 372.400 2.881 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000802132013 1019780902 /nfs/dbraw/zinc/78/09/02/1019780902.db2.gz UKOWKJWLUXUULG-CQSZACIVSA-N 1 1 368.405 2.664 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)c1 ZINC001048525169 1020275832 /nfs/dbraw/zinc/27/58/32/1020275832.db2.gz NXSGNNHMBAAMMU-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525169 1020275836 /nfs/dbraw/zinc/27/58/36/1020275836.db2.gz NXSGNNHMBAAMMU-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525169 1020275840 /nfs/dbraw/zinc/27/58/40/1020275840.db2.gz NXSGNNHMBAAMMU-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)c2)c1 ZINC000777956284 1020329981 /nfs/dbraw/zinc/32/99/81/1020329981.db2.gz DIHRUJFDVIJDMZ-GOSISDBHSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@@H](n4ccnc4)C3)c2)c1 ZINC000777956284 1020329988 /nfs/dbraw/zinc/32/99/88/1020329988.db2.gz DIHRUJFDVIJDMZ-GOSISDBHSA-N 1 1 352.398 2.949 20 5 FFBDMO C[C@H]1CCC[C@H]([N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726586207 1020488766 /nfs/dbraw/zinc/48/87/66/1020488766.db2.gz IPFBARIZDAXWIR-KBPBESRZSA-N 1 1 360.414 2.831 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)c1 ZINC000931795691 1020590574 /nfs/dbraw/zinc/59/05/74/1020590574.db2.gz IAXGMIUNLUDZFS-QUCCMNQESA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)c1 ZINC000931795691 1020590579 /nfs/dbraw/zinc/59/05/79/1020590579.db2.gz IAXGMIUNLUDZFS-QUCCMNQESA-N 1 1 364.405 2.999 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](C2CCOCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000933082652 1020955450 /nfs/dbraw/zinc/95/54/50/1020955450.db2.gz YCOCKRFBKYZBLO-QGZVFWFLSA-N 1 1 373.453 2.623 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000749674185 1021019055 /nfs/dbraw/zinc/01/90/55/1021019055.db2.gz GDWFLNDCXPTGNS-FQEVSTJZSA-N 1 1 364.405 2.872 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000749674185 1021019062 /nfs/dbraw/zinc/01/90/62/1021019062.db2.gz GDWFLNDCXPTGNS-FQEVSTJZSA-N 1 1 364.405 2.872 20 5 FFBDMO Cc1cccc(NC[C@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)n1 ZINC001116351694 1021175755 /nfs/dbraw/zinc/17/57/55/1021175755.db2.gz ISHFVUOFCWVLBW-QZTJIDSGSA-N 1 1 356.426 2.908 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c1 ZINC000934268176 1021182825 /nfs/dbraw/zinc/18/28/25/1021182825.db2.gz HUPNVVBJILCONI-CVEARBPZSA-N 1 1 373.375 2.645 20 5 FFBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1 ZINC001117726943 1021841566 /nfs/dbraw/zinc/84/15/66/1021841566.db2.gz KIDHXMAIMLYEQV-MQVJKMGUSA-N 1 1 369.425 2.633 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000192829798 1024285841 /nfs/dbraw/zinc/28/58/41/1024285841.db2.gz JFQHYUSZLNYSCH-WBVHZDCISA-N 1 1 355.394 2.779 20 5 FFBDMO CC(C)(C[NH2+]Cc1ccsc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540870 1024884761 /nfs/dbraw/zinc/88/47/61/1024884761.db2.gz YCSGZRRCCLBZAY-HZPDHXFCSA-N 1 1 365.499 2.768 20 5 FFBDMO C[N@@H+](CCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)Cc1ccccc1 ZINC000837351046 1025739999 /nfs/dbraw/zinc/73/99/99/1025739999.db2.gz NIWCAXQVARCVJK-UHFFFAOYSA-N 1 1 358.350 2.612 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)C1 ZINC000840086531 1026951143 /nfs/dbraw/zinc/95/11/43/1026951143.db2.gz MQRRNQWXYGQGKM-IBGZPJMESA-N 1 1 355.442 2.834 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1)C(N)=O ZINC000840106862 1026957655 /nfs/dbraw/zinc/95/76/55/1026957655.db2.gz CKLYEGZFTJQJLI-ZDUSSCGKSA-N 1 1 359.430 2.516 20 5 FFBDMO CO[C@H]1CC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1(C)C ZINC000840122959 1026968935 /nfs/dbraw/zinc/96/89/35/1026968935.db2.gz FXYSELOZIBPUQT-INIZCTEOSA-N 1 1 362.430 2.541 20 5 FFBDMO CO[C@H]1CC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1(C)C ZINC000840122959 1026968939 /nfs/dbraw/zinc/96/89/39/1026968939.db2.gz FXYSELOZIBPUQT-INIZCTEOSA-N 1 1 362.430 2.541 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000840184321 1027002210 /nfs/dbraw/zinc/00/22/10/1027002210.db2.gz NOYGVUFXGCCAJW-SFHVURJKSA-N 1 1 358.398 2.691 20 5 FFBDMO CC[N@H+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C(C)(C)C1 ZINC001158561951 1027060485 /nfs/dbraw/zinc/06/04/85/1027060485.db2.gz UJGVSHWCORXIKI-UHFFFAOYSA-N 1 1 367.759 2.978 20 5 FFBDMO O=C(CCC[NH+]1CCN(c2cccc([N+](=O)[O-])n2)CC1)c1ccc(F)cc1 ZINC001158809421 1027142612 /nfs/dbraw/zinc/14/26/12/1027142612.db2.gz XLUCAHJJRLXMMA-UHFFFAOYSA-N 1 1 372.400 2.914 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2cc3ccccc3o2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097021 1027587939 /nfs/dbraw/zinc/58/79/39/1027587939.db2.gz FGLWZNPPWBZSPN-QZTJIDSGSA-N 1 1 369.421 2.736 20 5 FFBDMO O=C(NCCC1=CC[N@H+](Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097021 1027587957 /nfs/dbraw/zinc/58/79/57/1027587957.db2.gz FGLWZNPPWBZSPN-QZTJIDSGSA-N 1 1 369.421 2.736 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097021 1027587971 /nfs/dbraw/zinc/58/79/71/1027587971.db2.gz FGLWZNPPWBZSPN-QZTJIDSGSA-N 1 1 369.421 2.736 20 5 FFBDMO CSc1nc(Cl)nc(NCC[NH+]2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC001160748991 1027857136 /nfs/dbraw/zinc/85/71/36/1027857136.db2.gz GQQIIQSWQDDSKT-UHFFFAOYSA-N 1 1 367.809 2.903 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CCCC1CCC1)CC2 ZINC000957547751 1028323833 /nfs/dbraw/zinc/32/38/33/1028323833.db2.gz OPTOWGNVWZDTSB-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO C[N@H+]1CCC[C@@](C)(Nc2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C1 ZINC001162336422 1028508563 /nfs/dbraw/zinc/50/85/63/1028508563.db2.gz BCENBYPLFOMNOD-LLVKDONJSA-N 1 1 353.732 2.953 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000780764282 1028798504 /nfs/dbraw/zinc/79/85/04/1028798504.db2.gz JLBRHAZZYOKAOU-ICSRJNTNSA-N 1 1 366.421 2.915 20 5 FFBDMO CN(C)C(=O)CC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000781144130 1029015635 /nfs/dbraw/zinc/01/56/35/1029015635.db2.gz DIYFFQHOLQHYEK-UHFFFAOYSA-N 1 1 371.441 2.606 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC[N@@H+](Cc4ccncc4)CC3)cnc2c1 ZINC001163827422 1029081453 /nfs/dbraw/zinc/08/14/53/1029081453.db2.gz SOTJBKBXFSWQKE-UHFFFAOYSA-N 1 1 364.409 2.645 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC001163884913 1029103501 /nfs/dbraw/zinc/10/35/01/1029103501.db2.gz NOHXHTAPESBRMG-BETUJISGSA-N 1 1 351.422 2.953 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1ccc([N+](=O)[O-])c(N)n1 ZINC001156341064 1029155019 /nfs/dbraw/zinc/15/50/19/1029155019.db2.gz AXOVQHZQXBIURK-YOEHRIQHSA-N 1 1 355.442 2.919 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000781585729 1029290681 /nfs/dbraw/zinc/29/06/81/1029290681.db2.gz IAETVQPVCUYNON-AUUYWEPGSA-N 1 1 372.425 2.833 20 5 FFBDMO Cc1cc(C)c(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001164490699 1029294891 /nfs/dbraw/zinc/29/48/91/1029294891.db2.gz SHSSPFVJGOGYFX-SJLPKXTDSA-N 1 1 359.470 2.653 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(F)cc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490376 1029296128 /nfs/dbraw/zinc/29/61/28/1029296128.db2.gz GYUPFEYEMZNLJV-UKRRQHHQSA-N 1 1 369.824 2.520 20 5 FFBDMO CC(C)(C)c1ccc(C[NH+]2CCN(c3cc([N+](=O)[O-])cc[n+]3[O-])CC2)cc1 ZINC001165097089 1029386933 /nfs/dbraw/zinc/38/69/33/1029386933.db2.gz DCPLZZALXBDYEG-UHFFFAOYSA-N 1 1 370.453 2.848 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3nc(Cl)nc4ccc([N+](=O)[O-])cc43)C[C@H]2C1 ZINC001157688681 1029645841 /nfs/dbraw/zinc/64/58/41/1029645841.db2.gz FOCUIMQXGIOAMC-TXEJJXNPSA-N 1 1 361.833 2.969 20 5 FFBDMO CSc1nc(Cl)nc(N2CC[N@@H+](C)CC23CCCC3)c1[N+](=O)[O-] ZINC001158409814 1029821659 /nfs/dbraw/zinc/82/16/59/1029821659.db2.gz BCZFOAPOVDUMDU-UHFFFAOYSA-N 1 1 357.867 2.825 20 5 FFBDMO COc1nc(C)c(NCc2ccc(C[NH+]3CCOCC3)cc2)cc1[N+](=O)[O-] ZINC001165384492 1029962672 /nfs/dbraw/zinc/96/26/72/1029962672.db2.gz KWXAOGZPOSGSEE-UHFFFAOYSA-N 1 1 372.425 2.751 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001142221485 1030181292 /nfs/dbraw/zinc/18/12/92/1030181292.db2.gz FGGBLTJMDFYMNU-ZIAGYGMSSA-N 1 1 371.441 2.835 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC([C@@H]4CCOC4)CC3)n2)c1 ZINC000784005597 1030409706 /nfs/dbraw/zinc/40/97/06/1030409706.db2.gz PHQNKWLWVXUPQW-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO C/C(=C\C(=O)N1CCCC[C@H]1C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784027115 1030425829 /nfs/dbraw/zinc/42/58/29/1030425829.db2.gz RSIDFSCDDZVJHH-IDCODDLRSA-N 1 1 373.453 2.711 20 5 FFBDMO CCN(CC(=O)OC(C)(C)C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167025621 1030616119 /nfs/dbraw/zinc/61/61/19/1030616119.db2.gz MZMYIFWOPDWWTI-CMDGGOBGSA-N 1 1 350.419 2.690 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC001534856212 1069693140 /nfs/dbraw/zinc/69/31/40/1069693140.db2.gz AJBRGQFJWFFFCJ-RHSMWYFYSA-N 1 1 368.437 2.796 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Cl)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001149932974 1031622012 /nfs/dbraw/zinc/62/20/12/1031622012.db2.gz UHUAVHMJRBZEGO-CQSZACIVSA-N 1 1 361.785 2.741 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](c4ccccn4)C3)n2)cc1 ZINC000799155905 1031671521 /nfs/dbraw/zinc/67/15/21/1031671521.db2.gz PPXPUCCAVAWLCP-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](c2ccccn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000799191051 1031688191 /nfs/dbraw/zinc/68/81/91/1031688191.db2.gz HZKQZUNDPHDUNR-CYBMUJFWSA-N 1 1 358.373 2.947 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001138093725 1033733562 /nfs/dbraw/zinc/73/35/62/1033733562.db2.gz WCCKJKZBMWOQGT-SECBINFHSA-N 1 1 358.801 2.572 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)cc1 ZINC000832054958 1034523150 /nfs/dbraw/zinc/52/31/50/1034523150.db2.gz ZAFVAEOXYNSIEM-NJAFHUGGSA-N 1 1 362.426 2.636 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226167326 1034555604 /nfs/dbraw/zinc/55/56/04/1034555604.db2.gz HWGLDVXIGMUPIB-KBXCAEBGSA-N 1 1 369.421 2.983 20 5 FFBDMO O=[N+]([O-])c1cccc(O)c1OC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226334008 1034633041 /nfs/dbraw/zinc/63/30/41/1034633041.db2.gz QHBVXFNJFOBDGU-MRXNPFEDSA-N 1 1 358.394 2.970 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cc3Cl)C[C@H]1[N@H+]2C ZINC001226761789 1034826335 /nfs/dbraw/zinc/82/63/35/1034826335.db2.gz FSJMLKBQUGWHBN-GMZLATJGSA-N 1 1 354.790 2.794 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ncc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001227111947 1034939159 /nfs/dbraw/zinc/93/91/59/1034939159.db2.gz ULISROCDVOQZOW-LRDDRELGSA-N 1 1 358.354 2.797 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](F)C1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001139785525 1035232467 /nfs/dbraw/zinc/23/24/67/1035232467.db2.gz VOJOWWLFHKJLAS-GFCCVEGCSA-N 1 1 363.311 2.664 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2c3ccccc3c([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001229422630 1036665408 /nfs/dbraw/zinc/66/54/08/1036665408.db2.gz CVTYCPSZINVUFC-GFCCVEGCSA-N 1 1 361.354 2.756 20 5 FFBDMO COc1c(O[C@@H]2CCC[N@@H+](C)C2)c2nccc3c4ccccc4n(c32)c1=O ZINC001234719062 1037154791 /nfs/dbraw/zinc/15/47/91/1037154791.db2.gz XRQSJYNZSMKDGZ-CYBMUJFWSA-N 1 1 363.417 2.920 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cccc(Cl)c3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001230915313 1037406104 /nfs/dbraw/zinc/40/61/04/1037406104.db2.gz PNXZYKSFSXJVPU-MEDZGJRSSA-N 1 1 354.790 2.794 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H](C)[C@@H](O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092915 1038377246 /nfs/dbraw/zinc/37/72/46/1038377246.db2.gz BAVBIQLQVUHDCF-KSSFIOAISA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](CCO)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100982 1038384020 /nfs/dbraw/zinc/38/40/20/1038384020.db2.gz XDINVAOYTIGVLU-HNNXBMFYSA-N 1 1 363.458 2.667 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H]4CN(C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100864 1038385229 /nfs/dbraw/zinc/38/52/29/1038385229.db2.gz RHHGCIFOZYNJAW-KXBFYZLASA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@H]4C[N@H+](C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100864 1038385241 /nfs/dbraw/zinc/38/52/41/1038385241.db2.gz RHHGCIFOZYNJAW-KXBFYZLASA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@H]4C[N@@H+](C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100864 1038385248 /nfs/dbraw/zinc/38/52/48/1038385248.db2.gz RHHGCIFOZYNJAW-KXBFYZLASA-N 1 1 374.485 2.598 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346744 1038486409 /nfs/dbraw/zinc/48/64/09/1038486409.db2.gz KYXCKOTXOOSSSN-RDJZCZTQSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346744 1038486416 /nfs/dbraw/zinc/48/64/16/1038486416.db2.gz KYXCKOTXOOSSSN-RDJZCZTQSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cccc(Cc2nnc(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c1[N+](=O)[O-] ZINC001258101846 1039172062 /nfs/dbraw/zinc/17/20/62/1039172062.db2.gz NKCYENDXOAJJDN-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1cccc(Cc2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c1[N+](=O)[O-] ZINC001258101846 1039172069 /nfs/dbraw/zinc/17/20/69/1039172069.db2.gz NKCYENDXOAJJDN-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO O=C(NCCCN[C@H]1CCC[NH2+]C1)c1c2ccccc2nc2ccccc21 ZINC001246482675 1039365694 /nfs/dbraw/zinc/36/56/94/1039365694.db2.gz HXXJZRFJXXTHDD-INIZCTEOSA-N 1 1 362.477 2.850 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001246879258 1039515397 /nfs/dbraw/zinc/51/53/97/1039515397.db2.gz NVMNJJJHBNLINN-SCWSEQNSSA-N 1 1 351.450 2.999 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001537668758 1070230935 /nfs/dbraw/zinc/23/09/35/1070230935.db2.gz VMLIMGSHUAKADK-UHFFFAOYSA-N 1 1 356.426 2.792 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001248442356 1040277995 /nfs/dbraw/zinc/27/79/95/1040277995.db2.gz XFJIMINYCICVAN-STQMWFEESA-N 1 1 361.398 2.774 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2CCCC[C@H]2C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001248442356 1040278011 /nfs/dbraw/zinc/27/80/11/1040278011.db2.gz XFJIMINYCICVAN-STQMWFEESA-N 1 1 361.398 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001213444734 1040559987 /nfs/dbraw/zinc/55/99/87/1040559987.db2.gz QKFZAXYFKDIQLH-MRXNPFEDSA-N 1 1 367.471 2.670 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC001254479693 1040744505 /nfs/dbraw/zinc/74/45/05/1040744505.db2.gz HWLIDPOPHJSTBW-KSSFIOAISA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001254557530 1040796501 /nfs/dbraw/zinc/79/65/01/1040796501.db2.gz QEHCZLKHAIHWRR-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001254557530 1040796513 /nfs/dbraw/zinc/79/65/13/1040796513.db2.gz QEHCZLKHAIHWRR-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO COCCN1CC[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cccnc21 ZINC001254557332 1040797116 /nfs/dbraw/zinc/79/71/16/1040797116.db2.gz PPODURYJSAAUIJ-MRXNPFEDSA-N 1 1 370.453 2.889 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(Cl)nn2)CC1 ZINC001254563645 1040800703 /nfs/dbraw/zinc/80/07/03/1040800703.db2.gz ACPAUFGPZACRIH-ZDUSSCGKSA-N 1 1 361.833 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1C[C@H]3CN(Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596681 1040824362 /nfs/dbraw/zinc/82/43/62/1040824362.db2.gz QETVJCVPVMIFKN-UEXGIBASSA-N 1 1 364.449 2.521 20 5 FFBDMO CC(C)C(=O)N1CCC[C@@]12CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599055 1040830487 /nfs/dbraw/zinc/83/04/87/1040830487.db2.gz JWXGCJJTWCCQJH-QUCCMNQESA-N 1 1 357.454 2.785 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254610635 1040839875 /nfs/dbraw/zinc/83/98/75/1040839875.db2.gz LWUUXAVMBHRENC-BHYGNILZSA-N 1 1 359.426 2.613 20 5 FFBDMO Cc1nccnc1O[C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611800 1040841929 /nfs/dbraw/zinc/84/19/29/1040841929.db2.gz TUQCUNWPNNYOSK-QZTJIDSGSA-N 1 1 354.410 2.704 20 5 FFBDMO COC(=O)Cc1ccc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC001261261263 1041109913 /nfs/dbraw/zinc/10/99/13/1041109913.db2.gz OCVHACXNFNGMJI-OAHLLOKOSA-N 1 1 372.425 2.503 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)[C@@H]2C1 ZINC001262826959 1041880692 /nfs/dbraw/zinc/88/06/92/1041880692.db2.gz UFBXPGHMMCGYMV-HOSYDEDBSA-N 1 1 357.332 2.684 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001263037001 1042054023 /nfs/dbraw/zinc/05/40/23/1042054023.db2.gz MYFGGVHNFWWLAM-OAHLLOKOSA-N 1 1 370.457 2.578 20 5 FFBDMO COc1ccc(OC(=O)c2cnn(-c3cc[nH+]cc3)c2C)cc1[N+](=O)[O-] ZINC001263471837 1042331118 /nfs/dbraw/zinc/33/11/18/1042331118.db2.gz OPKXLUWDOZVWRR-UHFFFAOYSA-N 1 1 354.322 2.712 20 5 FFBDMO CSc1cccc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-] ZINC001263619611 1042404377 /nfs/dbraw/zinc/40/43/77/1042404377.db2.gz AJYQYZPVQOURTQ-ZDUSSCGKSA-N 1 1 366.439 2.727 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)cc1F ZINC001264774369 1042821859 /nfs/dbraw/zinc/82/18/59/1042821859.db2.gz VRSXAHAWEDBZCJ-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO C[C@@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1)c1ccccc1[N+](=O)[O-] ZINC001538849593 1070504788 /nfs/dbraw/zinc/50/47/88/1070504788.db2.gz IUUWQQAIHJMBEH-ZDUSSCGKSA-N 1 1 351.366 2.709 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC001318410083 1045293494 /nfs/dbraw/zinc/29/34/94/1045293494.db2.gz PJBLPJVEQNEUNY-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC001318410083 1045293499 /nfs/dbraw/zinc/29/34/99/1045293499.db2.gz PJBLPJVEQNEUNY-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC001320602481 1045434969 /nfs/dbraw/zinc/43/49/69/1045434969.db2.gz REGTYICFUQJDLC-UHFFFAOYSA-N 1 1 373.800 2.786 20 5 FFBDMO C[N@H+](Cc1ccc(C(N)=O)cc1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC001320602481 1045434972 /nfs/dbraw/zinc/43/49/72/1045434972.db2.gz REGTYICFUQJDLC-UHFFFAOYSA-N 1 1 373.800 2.786 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC001320950267 1045500124 /nfs/dbraw/zinc/50/01/24/1045500124.db2.gz DUGVGSKMSCVQSU-CABZTGNLSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC001320950267 1045500127 /nfs/dbraw/zinc/50/01/27/1045500127.db2.gz DUGVGSKMSCVQSU-CABZTGNLSA-N 1 1 357.204 2.741 20 5 FFBDMO CC(C)Oc1nc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC001326835928 1047107763 /nfs/dbraw/zinc/10/77/63/1047107763.db2.gz CIDFEHMDBUKPHQ-AWEZNQCLSA-N 1 1 359.430 2.970 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)n1C ZINC001328539355 1048346804 /nfs/dbraw/zinc/34/68/04/1048346804.db2.gz UACNPCCUASDLRM-UHFFFAOYSA-N 1 1 361.793 2.603 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001342093199 1050686696 /nfs/dbraw/zinc/68/66/96/1050686696.db2.gz ZOBZQNCYVRCBOM-LBPRGKRZSA-N 1 1 355.341 2.507 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001343485658 1052259856 /nfs/dbraw/zinc/25/98/56/1052259856.db2.gz SRBSXUKLYCCWSQ-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001343485658 1052259864 /nfs/dbraw/zinc/25/98/64/1052259864.db2.gz SRBSXUKLYCCWSQ-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO COC(=O)C(C)(C)C[N@@H+](CC(C)C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001308033042 1052388298 /nfs/dbraw/zinc/38/82/98/1052388298.db2.gz NFVMNNUYRQPBRX-INIZCTEOSA-N 1 1 352.431 2.785 20 5 FFBDMO COC(=O)c1ccc2c(c1)OCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001308147786 1052417629 /nfs/dbraw/zinc/41/76/29/1052417629.db2.gz BLINSBNLYSGXJF-UHFFFAOYSA-N 1 1 372.377 2.655 20 5 FFBDMO COC(=O)c1ccc2c(c1)OCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001308147786 1052417633 /nfs/dbraw/zinc/41/76/33/1052417633.db2.gz BLINSBNLYSGXJF-UHFFFAOYSA-N 1 1 372.377 2.655 20 5 FFBDMO Cc1cc(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)cc([N+](=O)[O-])c1 ZINC001345489506 1052471074 /nfs/dbraw/zinc/47/10/74/1052471074.db2.gz STWADWSGAHOEBW-CQSZACIVSA-N 1 1 362.430 2.620 20 5 FFBDMO CCc1ccc(S(=O)(=O)NCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC001309015862 1052539676 /nfs/dbraw/zinc/53/96/76/1052539676.db2.gz KCQNBLVQZGLLKF-CQSZACIVSA-N 1 1 369.487 2.700 20 5 FFBDMO Cc1c(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001336104223 1053772187 /nfs/dbraw/zinc/77/21/87/1053772187.db2.gz CQWCOEZGDZJOQE-UHFFFAOYSA-N 1 1 351.366 2.756 20 5 FFBDMO Cn1nc(C2CC2)cc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001348544564 1054779803 /nfs/dbraw/zinc/77/98/03/1054779803.db2.gz WEZYKCCSTGKJGS-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO Cn1nc(C2CC2)cc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001348544564 1054779816 /nfs/dbraw/zinc/77/98/16/1054779816.db2.gz WEZYKCCSTGKJGS-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cccc(N2CCOCC2)n1 ZINC001352017858 1055124343 /nfs/dbraw/zinc/12/43/43/1055124343.db2.gz YHHOPQWQPYSTGP-UHFFFAOYSA-N 1 1 362.817 2.770 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001349833943 1055492750 /nfs/dbraw/zinc/49/27/50/1055492750.db2.gz NYGNNSDUIWXAQT-ROUUACIJSA-N 1 1 358.442 2.679 20 5 FFBDMO C[C@H]1C[N@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@@H](C)CO1 ZINC001350499280 1055802757 /nfs/dbraw/zinc/80/27/57/1055802757.db2.gz FBHZKIPVLZSNMF-QWRGUYRKSA-N 1 1 365.821 2.713 20 5 FFBDMO C[C@H]1C[N@@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@@H](C)CO1 ZINC001350499280 1055802771 /nfs/dbraw/zinc/80/27/71/1055802771.db2.gz FBHZKIPVLZSNMF-QWRGUYRKSA-N 1 1 365.821 2.713 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+]2C)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001350505353 1055805628 /nfs/dbraw/zinc/80/56/28/1055805628.db2.gz WYKBPTMXVBDQPW-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@H]2CCC[N@H+]2C)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001350505353 1055805642 /nfs/dbraw/zinc/80/56/42/1055805642.db2.gz WYKBPTMXVBDQPW-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO C[C@H](c1nnc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)n1C)[N+](=O)[O-] ZINC001339541939 1056564757 /nfs/dbraw/zinc/56/47/57/1056564757.db2.gz NGULZRXXTDXTFV-HUUCEWRRSA-N 1 1 364.494 2.634 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC001545105638 1071733812 /nfs/dbraw/zinc/73/38/12/1071733812.db2.gz MSGPALLXPWJZKR-ZFWWWQNUSA-N 1 1 354.410 2.869 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175127 1058488360 /nfs/dbraw/zinc/48/83/60/1058488360.db2.gz MGWDXLNTBBRXBT-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175127 1058488365 /nfs/dbraw/zinc/48/83/65/1058488365.db2.gz MGWDXLNTBBRXBT-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001545660247 1071828336 /nfs/dbraw/zinc/82/83/36/1071828336.db2.gz VPPJYFXJFNHIIM-AWEZNQCLSA-N 1 1 372.473 2.788 20 5 FFBDMO C[C@@H](C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC001520069482 1059373394 /nfs/dbraw/zinc/37/33/94/1059373394.db2.gz RAYRNTCJXCILSU-IUODEOHRSA-N 1 1 366.389 2.634 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC001520129939 1059417057 /nfs/dbraw/zinc/41/70/57/1059417057.db2.gz XEIZKAUHCJOMQZ-OLZOCXBDSA-N 1 1 350.419 2.940 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@@H+]1CC=CCC1 ZINC001515363981 1059619859 /nfs/dbraw/zinc/61/98/59/1059619859.db2.gz WMZDEDYGZWQHJO-UHFFFAOYSA-N 1 1 356.430 2.571 20 5 FFBDMO CC(C)C(=O)NC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848474191 1060089080 /nfs/dbraw/zinc/08/90/80/1060089080.db2.gz AGUPOMGTXCQFFX-UHFFFAOYSA-N 1 1 371.441 2.652 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000848478481 1060110202 /nfs/dbraw/zinc/11/02/02/1060110202.db2.gz NYMVISCJJPZYKL-DOTOQJQBSA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000848478481 1060110213 /nfs/dbraw/zinc/11/02/13/1060110213.db2.gz NYMVISCJJPZYKL-DOTOQJQBSA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000848488181 1060136759 /nfs/dbraw/zinc/13/67/59/1060136759.db2.gz CCYFLEWDXXQJRW-MJGOQNOKSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000848488181 1060136767 /nfs/dbraw/zinc/13/67/67/1060136767.db2.gz CCYFLEWDXXQJRW-MJGOQNOKSA-N 1 1 373.453 2.617 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1 ZINC000848587542 1060317370 /nfs/dbraw/zinc/31/73/70/1060317370.db2.gz JHXFRLKGRDFVCU-CYBMUJFWSA-N 1 1 371.384 2.757 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(NCCc3cn4c([nH+]3)CCCC4)c2c1 ZINC001458099228 1060513309 /nfs/dbraw/zinc/51/33/09/1060513309.db2.gz MFZNMGAFCYQABG-UHFFFAOYSA-N 1 1 367.409 2.761 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1nc2ccccn2c1[N+](=O)[O-] ZINC001458470281 1060597168 /nfs/dbraw/zinc/59/71/68/1060597168.db2.gz UHMUAQYSBTVHNA-UHFFFAOYSA-N 1 1 354.414 2.596 20 5 FFBDMO C[C@H]1[C@H](Nc2c3ccc(Br)cc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001458615568 1060634591 /nfs/dbraw/zinc/63/45/91/1060634591.db2.gz RWBAJUOLWPVNOH-JOYOIKCWSA-N 1 1 365.231 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNc3cccc(C[N@@H+]4CC[C@@H](O)C4)c3)nc2c1 ZINC001462277373 1061566390 /nfs/dbraw/zinc/56/63/90/1061566390.db2.gz VIWNOMWYHGQMJX-MRXNPFEDSA-N 1 1 368.393 2.915 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC001440828717 1063360807 /nfs/dbraw/zinc/36/08/07/1063360807.db2.gz RSUPPUWNVUCVIW-PHIMTYICSA-N 1 1 373.812 2.616 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC001466676406 1063517623 /nfs/dbraw/zinc/51/76/23/1063517623.db2.gz FSQGWQXMRQFHRD-CQSZACIVSA-N 1 1 368.409 2.699 20 5 FFBDMO Cc1cc(NC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC001467530857 1063771390 /nfs/dbraw/zinc/77/13/90/1063771390.db2.gz YJLZMGCYVAYTCE-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001467548689 1063777942 /nfs/dbraw/zinc/77/79/42/1063777942.db2.gz UNSJGDYHXKYREI-KGLIPLIRSA-N 1 1 370.409 2.733 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001468184121 1063939797 /nfs/dbraw/zinc/93/97/97/1063939797.db2.gz WTQZPDBWRVIOLD-KRWDZBQOSA-N 1 1 351.834 2.735 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CCC1(C)C ZINC001470651207 1064398051 /nfs/dbraw/zinc/39/80/51/1064398051.db2.gz VOPAWCWHAVIYSB-UHFFFAOYSA-N 1 1 356.426 2.887 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001472035795 1064902336 /nfs/dbraw/zinc/90/23/36/1064902336.db2.gz OMOAISDYMJKZJF-CQSZACIVSA-N 1 1 353.850 2.979 20 5 FFBDMO O=[N+]([O-])CCN(Cc1ccncc1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001473501367 1065274314 /nfs/dbraw/zinc/27/43/14/1065274314.db2.gz HXXHICPSKHRNPJ-FQEVSTJZSA-N 1 1 354.454 2.825 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@H](O)CC2)o1 ZINC001473513145 1065275617 /nfs/dbraw/zinc/27/56/17/1065275617.db2.gz NSEBHENDGLBQKN-NSHDSACASA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@H](O)CC2)o1 ZINC001473513145 1065275622 /nfs/dbraw/zinc/27/56/22/1065275622.db2.gz NSEBHENDGLBQKN-NSHDSACASA-N 1 1 352.778 2.645 20 5 FFBDMO Cc1cc(C)cc(NC(=O)C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001473714231 1065327991 /nfs/dbraw/zinc/32/79/91/1065327991.db2.gz OJHIBWWEHSQKOR-LJQANCHMSA-N 1 1 357.410 2.647 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001582803924 1079110229 /nfs/dbraw/zinc/11/02/29/1079110229.db2.gz CRGZZUNGMMLCCN-ZDUSSCGKSA-N 1 1 357.418 2.594 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001585139410 1079430165 /nfs/dbraw/zinc/43/01/65/1079430165.db2.gz VXFPLIDFBVSEOH-CQSZACIVSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)CSc1ccccc1[N+](=O)[O-] ZINC001585139410 1079430169 /nfs/dbraw/zinc/43/01/69/1079430169.db2.gz VXFPLIDFBVSEOH-CQSZACIVSA-N 1 1 351.472 2.876 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)C(C)(C)CN1C(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC001585804829 1079502205 /nfs/dbraw/zinc/50/22/05/1079502205.db2.gz HOBFSVUQAWIALS-UHFFFAOYSA-N 1 1 371.441 2.833 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CCc3cc[nH+]c(N)c3C2)cc1C ZINC001559301339 1076148279 /nfs/dbraw/zinc/14/82/79/1076148279.db2.gz UZCWJKCSHYZWHF-UHFFFAOYSA-N 1 1 356.382 2.620 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001559753923 1076187752 /nfs/dbraw/zinc/18/77/52/1076187752.db2.gz XUPROBMXIIYKKT-NOZJJQNGSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC001560034136 1076214783 /nfs/dbraw/zinc/21/47/83/1076214783.db2.gz MZTXCADGFVXBGX-CQSZACIVSA-N 1 1 361.364 2.932 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001561474303 1076381329 /nfs/dbraw/zinc/38/13/29/1076381329.db2.gz ATOXSZNSVCBZEX-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H](CNC(=O)NCc1c[nH+]c2n1CCCC2)c1ccccc1[N+](=O)[O-] ZINC001564732825 1076656707 /nfs/dbraw/zinc/65/67/07/1076656707.db2.gz QSMOKPLWTAIGME-ZDUSSCGKSA-N 1 1 357.414 2.731 20 5 FFBDMO Cc1cc(C)c(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c(C)c1 ZINC001567998319 1077065114 /nfs/dbraw/zinc/06/51/14/1077065114.db2.gz IFFPYVMOHOMTDQ-SJLPKXTDSA-N 1 1 359.470 2.796 20 5 FFBDMO CCC[N@H+]1CCC[C@H](C(=O)NCCCNc2ccc(C)cc2[N+](=O)[O-])C1 ZINC001586524874 1079645561 /nfs/dbraw/zinc/64/55/61/1079645561.db2.gz LXFKZLXEWVPULY-INIZCTEOSA-N 1 1 362.474 2.943 20 5 FFBDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589903150 1080852980 /nfs/dbraw/zinc/85/29/80/1080852980.db2.gz RVBQLPAAYQDZPV-LLVKDONJSA-N 1 1 358.427 2.899 20 5 FFBDMO COc1ccc(C[NH2+][C@@H](C)CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000273584440 255766465 /nfs/dbraw/zinc/76/64/65/255766465.db2.gz NKMRMPZDCAPIHF-ZDUSSCGKSA-N 1 1 364.423 2.555 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H](N4CCCC4)C3)o2)c1 ZINC000104685471 250182290 /nfs/dbraw/zinc/18/22/90/250182290.db2.gz NQZWORHQQOJNPC-KRWDZBQOSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H](N4CCCC4)C3)o2)c1 ZINC000104685471 250182293 /nfs/dbraw/zinc/18/22/93/250182293.db2.gz NQZWORHQQOJNPC-KRWDZBQOSA-N 1 1 356.426 2.962 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000106786914 250290339 /nfs/dbraw/zinc/29/03/39/250290339.db2.gz VKUZMTKSZQSXQU-AWEZNQCLSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186809122 251266756 /nfs/dbraw/zinc/26/67/56/251266756.db2.gz MABKMLNLSLXYBU-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186809122 251266759 /nfs/dbraw/zinc/26/67/59/251266759.db2.gz MABKMLNLSLXYBU-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000264602708 251320818 /nfs/dbraw/zinc/32/08/18/251320818.db2.gz NUFYBAPOCBCDPJ-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000264602708 251320823 /nfs/dbraw/zinc/32/08/23/251320823.db2.gz NUFYBAPOCBCDPJ-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCNc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000272573408 252071235 /nfs/dbraw/zinc/07/12/35/252071235.db2.gz WJHXRMVXFWLKAY-SFHVURJKSA-N 1 1 366.425 2.905 20 5 FFBDMO CCC[N@H+]1CC[C@H](CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272493738 252051145 /nfs/dbraw/zinc/05/11/45/252051145.db2.gz FINBPQBHNFXJQE-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000272524640 252060345 /nfs/dbraw/zinc/06/03/45/252060345.db2.gz LWWMBWKVONSHPY-YQVWRLOYSA-N 1 1 358.442 2.949 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272548481 252064579 /nfs/dbraw/zinc/06/45/79/252064579.db2.gz QRHBPORYMGQBPX-GOSISDBHSA-N 1 1 374.441 2.593 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272551354 252066322 /nfs/dbraw/zinc/06/63/22/252066322.db2.gz RIVYAZDWBLASMF-QZTJIDSGSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000272668362 252096686 /nfs/dbraw/zinc/09/66/86/252096686.db2.gz IGPRLCWYOWBAGN-JTQLQIEISA-N 1 1 368.231 2.738 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])cn3)cc2)C[C@H](C)O1 ZINC000273181619 252242406 /nfs/dbraw/zinc/24/24/06/252242406.db2.gz OGYWUTUQSDTHDL-OKILXGFUSA-N 1 1 357.414 2.606 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2cnn(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000273439772 252306985 /nfs/dbraw/zinc/30/69/85/252306985.db2.gz ZGRXIFOVVWTMHW-VIFPVBQESA-N 1 1 356.329 2.789 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000275828468 256051947 /nfs/dbraw/zinc/05/19/47/256051947.db2.gz ICJYWZONQSMYQO-HAQNSBGRSA-N 1 1 360.357 2.940 20 5 FFBDMO Cc1cncc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000275985048 256064085 /nfs/dbraw/zinc/06/40/85/256064085.db2.gz FJYLGBZEICBKGG-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO C[C@H]1CC[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000276472984 256103280 /nfs/dbraw/zinc/10/32/80/256103280.db2.gz ZDRALMGMUIXFTC-DZGCQCFKSA-N 1 1 359.430 2.551 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000278748840 256343990 /nfs/dbraw/zinc/34/39/90/256343990.db2.gz UQQGSPWFMDPBSA-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(c3c([N+](=O)[O-])cc(C(F)(F)F)cc3[N+](=O)[O-])C[C@H]2C1 ZINC000278858609 256355458 /nfs/dbraw/zinc/35/54/58/256355458.db2.gz YBWMVMJKHATJIF-DTORHVGOSA-N 1 1 360.292 2.520 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000280628568 256543785 /nfs/dbraw/zinc/54/37/85/256543785.db2.gz XEENFRYNHJCTCB-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc2c(c1)OCC(=O)N2 ZINC000286001909 257015229 /nfs/dbraw/zinc/01/52/29/257015229.db2.gz ISTALMKZCJGXMX-NSHDSACASA-N 1 1 357.366 2.785 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000286205976 257025637 /nfs/dbraw/zinc/02/56/37/257025637.db2.gz MPJXSHLJFMAUJG-UHFFFAOYSA-N 1 1 372.410 2.883 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000286645757 257047552 /nfs/dbraw/zinc/04/75/52/257047552.db2.gz CCMOZRQUNAPQGZ-GFCCVEGCSA-N 1 1 370.438 2.878 20 5 FFBDMO C[N@H+](CCn1cc(Br)cn1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000288742017 257222830 /nfs/dbraw/zinc/22/28/30/257222830.db2.gz HKVDBLNKNZSHDB-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1cc(Br)cn1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000288742017 257222831 /nfs/dbraw/zinc/22/28/31/257222831.db2.gz HKVDBLNKNZSHDB-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)[C@H](C)C1 ZINC000290044470 257312674 /nfs/dbraw/zinc/31/26/74/257312674.db2.gz ZYIJXYFLNIGFKA-CJNGLKHVSA-N 1 1 358.446 2.557 20 5 FFBDMO Cc1cc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290267294 257323171 /nfs/dbraw/zinc/32/31/71/257323171.db2.gz BMPMPSBVWZEXAM-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000291176892 257389833 /nfs/dbraw/zinc/38/98/33/257389833.db2.gz FFQYVYPNHDNSPW-GFCCVEGCSA-N 1 1 368.340 2.848 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000291176892 257389834 /nfs/dbraw/zinc/38/98/34/257389834.db2.gz FFQYVYPNHDNSPW-GFCCVEGCSA-N 1 1 368.340 2.848 20 5 FFBDMO C[C@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC[N@H+](C2CCC2)C1 ZINC000295967813 257655456 /nfs/dbraw/zinc/65/54/56/257655456.db2.gz NPMTVOSSHGBMOB-CQSZACIVSA-N 1 1 370.457 2.701 20 5 FFBDMO C[C@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295387619 257630557 /nfs/dbraw/zinc/63/05/57/257630557.db2.gz RECPLVVOMDHWME-SCLBCKFNSA-N 1 1 369.425 2.684 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000301183344 258032015 /nfs/dbraw/zinc/03/20/15/258032015.db2.gz IRUQXEKSXUGNRY-OAHLLOKOSA-N 1 1 352.866 2.855 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000302549938 258106100 /nfs/dbraw/zinc/10/61/00/258106100.db2.gz VWQJNQHXJJGBRU-UMVBOHGHSA-N 1 1 364.402 2.581 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302759780 258110054 /nfs/dbraw/zinc/11/00/54/258110054.db2.gz JVBCLTNEWWLPIJ-INIZCTEOSA-N 1 1 370.409 2.853 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c(F)c1 ZINC000301813349 258068720 /nfs/dbraw/zinc/06/87/20/258068720.db2.gz ZASJORFGALWGCP-OAHLLOKOSA-N 1 1 363.364 2.704 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301835356 258070077 /nfs/dbraw/zinc/07/00/77/258070077.db2.gz LCRKVZYVRVKOEX-WMZOPIPTSA-N 1 1 354.410 2.812 20 5 FFBDMO COc1cc(NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000301871891 258072214 /nfs/dbraw/zinc/07/22/14/258072214.db2.gz DBDNXTJIPYMXLV-BETUJISGSA-N 1 1 367.446 2.912 20 5 FFBDMO COc1cc(NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000301871891 258072216 /nfs/dbraw/zinc/07/22/16/258072216.db2.gz DBDNXTJIPYMXLV-BETUJISGSA-N 1 1 367.446 2.912 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000332109102 258214469 /nfs/dbraw/zinc/21/44/69/258214469.db2.gz AIGQOMPQCCWSHK-XHSDSOJGSA-N 1 1 360.458 2.871 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[NH+](C3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000332423059 258229848 /nfs/dbraw/zinc/22/98/48/258229848.db2.gz RTDNNTNMHKZGIC-UHFFFAOYSA-N 1 1 363.462 2.778 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(S(C)(=O)=O)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000409868799 512157842 /nfs/dbraw/zinc/15/78/42/512157842.db2.gz FVBHHDPKHRBURY-LLVKDONJSA-N 1 1 352.387 2.988 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1C ZINC000032441110 506254075 /nfs/dbraw/zinc/25/40/75/506254075.db2.gz WIKCTBIRGHGPAG-KGLIPLIRSA-N 1 1 369.487 2.753 20 5 FFBDMO CC(=O)NCC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000052848838 506263884 /nfs/dbraw/zinc/26/38/84/506263884.db2.gz DXGSRIMWOBVHNU-GFCCVEGCSA-N 1 1 373.413 2.554 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c1 ZINC000371065724 512201454 /nfs/dbraw/zinc/20/14/54/512201454.db2.gz XNFVAUQEFNCSAM-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c1 ZINC000371065724 512201457 /nfs/dbraw/zinc/20/14/57/512201457.db2.gz XNFVAUQEFNCSAM-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1c(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000366958580 512269516 /nfs/dbraw/zinc/26/95/16/512269516.db2.gz AKGKKUVGWXZTRE-INIZCTEOSA-N 1 1 370.365 2.728 20 5 FFBDMO Cc1c(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000366958580 512269520 /nfs/dbraw/zinc/26/95/20/512269520.db2.gz AKGKKUVGWXZTRE-INIZCTEOSA-N 1 1 370.365 2.728 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000065910504 506391085 /nfs/dbraw/zinc/39/10/85/506391085.db2.gz XBCFONVICDEIKT-UHFFFAOYSA-N 1 1 352.410 2.653 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)CC[N@@H+](C)C1CCCCC1 ZINC000065971377 506403765 /nfs/dbraw/zinc/40/37/65/506403765.db2.gz DTGABOWTWCXFLF-UHFFFAOYSA-N 1 1 369.487 2.788 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](c1cccs1)[NH+](C)C ZINC000038629159 506440295 /nfs/dbraw/zinc/44/02/95/506440295.db2.gz BUBWQCSCFYOWLX-ZDUSSCGKSA-N 1 1 369.468 2.546 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000054626142 506590609 /nfs/dbraw/zinc/59/06/09/506590609.db2.gz QDPOKYHCZPVJHZ-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000009983132 506721158 /nfs/dbraw/zinc/72/11/58/506721158.db2.gz OARUZQQSCAHQMS-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO C[N@@H+](CCNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000067282104 506817838 /nfs/dbraw/zinc/81/78/38/506817838.db2.gz ZVDKFBNSIMMVQQ-UHFFFAOYSA-N 1 1 374.363 2.626 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000067416674 506871450 /nfs/dbraw/zinc/87/14/50/506871450.db2.gz NCQMMKBHDKALIM-TZMCWYRMSA-N 1 1 373.413 2.554 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000067416674 506871454 /nfs/dbraw/zinc/87/14/54/506871454.db2.gz NCQMMKBHDKALIM-TZMCWYRMSA-N 1 1 373.413 2.554 20 5 FFBDMO C[N@@H+](CCCNC(=O)CNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000067706408 506983219 /nfs/dbraw/zinc/98/32/19/506983219.db2.gz QGIBFKQTGFOGJR-UHFFFAOYSA-N 1 1 356.426 2.645 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000067707647 506984242 /nfs/dbraw/zinc/98/42/42/506984242.db2.gz QTNLPQYWRZUJAG-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO C[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000067707647 506984245 /nfs/dbraw/zinc/98/42/45/506984245.db2.gz QTNLPQYWRZUJAG-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2cccc([N+](=O)[O-])c2)cn1 ZINC000056344642 506992747 /nfs/dbraw/zinc/99/27/47/506992747.db2.gz ZMBFGCFDWZAQTE-UHFFFAOYSA-N 1 1 352.354 2.806 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCOc1cccc(C)c1 ZINC000015100179 507019377 /nfs/dbraw/zinc/01/93/77/507019377.db2.gz SMNSCBHHRZKRRK-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCOc1cccc(C)c1 ZINC000015100179 507019387 /nfs/dbraw/zinc/01/93/87/507019387.db2.gz SMNSCBHHRZKRRK-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCOc1ccc(F)cc1 ZINC000015101419 507020780 /nfs/dbraw/zinc/02/07/80/507020780.db2.gz SXYVMGSHPAJRDQ-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCOc1ccc(F)cc1 ZINC000015101419 507020786 /nfs/dbraw/zinc/02/07/86/507020786.db2.gz SXYVMGSHPAJRDQ-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO Cc1nc2ccccc2nc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000046874061 507215149 /nfs/dbraw/zinc/21/51/49/507215149.db2.gz NAFXITBRHQHKOP-UHFFFAOYSA-N 1 1 364.409 2.564 20 5 FFBDMO Cc1cccc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)c1[N+](=O)[O-] ZINC000022462003 507294609 /nfs/dbraw/zinc/29/46/09/507294609.db2.gz USRBRRZBSGWFEX-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000047434123 507332215 /nfs/dbraw/zinc/33/22/15/507332215.db2.gz ARJUPIYGEHBCLU-BETUJISGSA-N 1 1 367.471 2.546 20 5 FFBDMO O=C(NC1CC1)[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000068951190 507367713 /nfs/dbraw/zinc/36/77/13/507367713.db2.gz OOGPVDWNTCEWAJ-SFHVURJKSA-N 1 1 373.384 2.722 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCN(C)c2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000069089002 507402496 /nfs/dbraw/zinc/40/24/96/507402496.db2.gz MNZDUEAEIOPHJE-UHFFFAOYSA-N 1 1 354.410 2.510 20 5 FFBDMO CN(C(=O)C[N@H+]1CCN(C)c2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000069089002 507402499 /nfs/dbraw/zinc/40/24/99/507402499.db2.gz MNZDUEAEIOPHJE-UHFFFAOYSA-N 1 1 354.410 2.510 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000069389223 507478758 /nfs/dbraw/zinc/47/87/58/507478758.db2.gz YFDANXDLQBJPBS-HNNXBMFYSA-N 1 1 364.446 2.537 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000048245043 507487673 /nfs/dbraw/zinc/48/76/73/507487673.db2.gz HZIKQGLLBQVXCB-UHFFFAOYSA-N 1 1 372.400 2.583 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[NH+]1CCOCC1 ZINC000048316792 507500096 /nfs/dbraw/zinc/50/00/96/507500096.db2.gz KSCGAXKZMWRLKY-HNNXBMFYSA-N 1 1 374.441 2.553 20 5 FFBDMO CNc1ccc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000026356197 507580656 /nfs/dbraw/zinc/58/06/56/507580656.db2.gz YLCTYPWFUWQWLF-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000026729820 507605834 /nfs/dbraw/zinc/60/58/34/507605834.db2.gz XHEPSXYRCZCZDP-ZDUSSCGKSA-N 1 1 354.410 2.552 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](CCO)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000071079875 507692720 /nfs/dbraw/zinc/69/27/20/507692720.db2.gz LVIYXZMVALVYCP-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000063728040 507765201 /nfs/dbraw/zinc/76/52/01/507765201.db2.gz JBFHBFHVHDOJNJ-UHFFFAOYSA-N 1 1 358.442 2.882 20 5 FFBDMO C[N@H+](CCCOc1ccccc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029855487 507793349 /nfs/dbraw/zinc/79/33/49/507793349.db2.gz ZXRSHSMWIUROJV-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO C[N@@H+](CCCOc1ccccc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000029855487 507793352 /nfs/dbraw/zinc/79/33/52/507793352.db2.gz ZXRSHSMWIUROJV-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO O=C(NCC1([NH+]2CCSCC2)CCCC1)c1ccc([N+](=O)[O-])s1 ZINC000031960376 507822519 /nfs/dbraw/zinc/82/25/19/507822519.db2.gz FRJULMVGCYOCNX-UHFFFAOYSA-N 1 1 355.485 2.748 20 5 FFBDMO CC[NH+](CC)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072803518 507855521 /nfs/dbraw/zinc/85/55/21/507855521.db2.gz GBSYUKNNWJSSIG-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000107889472 507872768 /nfs/dbraw/zinc/87/27/68/507872768.db2.gz FDSYULLZVVXMRP-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO O=c1[nH]cnc2cc(N[C@H]3CC[N@@H+](Cc4ccccc4)C3)c([N+](=O)[O-])cc21 ZINC000072991019 507881656 /nfs/dbraw/zinc/88/16/56/507881656.db2.gz KPIWAXMWUJLJCR-AWEZNQCLSA-N 1 1 365.393 2.518 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000078641663 507891861 /nfs/dbraw/zinc/89/18/61/507891861.db2.gz JLWAWXSFOYOZQZ-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000108395294 507892326 /nfs/dbraw/zinc/89/23/26/507892326.db2.gz WYACXZKEUYWJGN-QGZVFWFLSA-N 1 1 361.442 2.765 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000108818993 507920404 /nfs/dbraw/zinc/92/04/04/507920404.db2.gz NLXRFVOHDFARJP-STQMWFEESA-N 1 1 373.457 2.957 20 5 FFBDMO CCc1nn(C)c(N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091730779 508005594 /nfs/dbraw/zinc/00/55/94/508005594.db2.gz ROIMUJUWPAIFOS-INIZCTEOSA-N 1 1 357.458 2.992 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NC[C@@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000110651189 508039412 /nfs/dbraw/zinc/03/94/12/508039412.db2.gz WFDDCNBKCWLWLC-CABCVRRESA-N 1 1 360.458 2.513 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000074764294 508053292 /nfs/dbraw/zinc/05/32/92/508053292.db2.gz VMVPFDWMESNAAN-UHFFFAOYSA-N 1 1 360.458 2.797 20 5 FFBDMO COc1cc(CN2CCC(CC[NH+](C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000092381114 508066790 /nfs/dbraw/zinc/06/67/90/508066790.db2.gz YRJOIBVWCKCYFZ-UHFFFAOYSA-N 1 1 351.447 2.776 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112075076 508148745 /nfs/dbraw/zinc/14/87/45/508148745.db2.gz DFJWOUWXVSPFKB-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000112079817 508149622 /nfs/dbraw/zinc/14/96/22/508149622.db2.gz KACPCQVOPIFIFM-ZDUSSCGKSA-N 1 1 359.430 2.702 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000093754532 508153477 /nfs/dbraw/zinc/15/34/77/508153477.db2.gz DYADWXGSSXENTO-CYBMUJFWSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000093754532 508153479 /nfs/dbraw/zinc/15/34/79/508153479.db2.gz DYADWXGSSXENTO-CYBMUJFWSA-N 1 1 373.247 2.842 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081293692 508157436 /nfs/dbraw/zinc/15/74/36/508157436.db2.gz AQRMSWYMUWBNDJ-INIZCTEOSA-N 1 1 360.458 2.778 20 5 FFBDMO CCC[N@H+](C)C[C@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000081569868 508191633 /nfs/dbraw/zinc/19/16/33/508191633.db2.gz AXRHQBUURLCIJU-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000081569868 508191635 /nfs/dbraw/zinc/19/16/35/508191635.db2.gz AXRHQBUURLCIJU-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CNC(=O)c1ccc(N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000076691252 508241740 /nfs/dbraw/zinc/24/17/40/508241740.db2.gz FPJXFOWQYVHZOK-OAHLLOKOSA-N 1 1 368.437 2.665 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@H](C)O1 ZINC000085456940 508309548 /nfs/dbraw/zinc/30/95/48/508309548.db2.gz AHAJRVYAZGPOCG-OKILXGFUSA-N 1 1 374.441 2.695 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000085457680 508309726 /nfs/dbraw/zinc/30/97/26/508309726.db2.gz GBBUOUVPRBXRJW-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000103411185 508310557 /nfs/dbraw/zinc/31/05/57/508310557.db2.gz HGGKWTITQBORKU-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000103411185 508310559 /nfs/dbraw/zinc/31/05/59/508310559.db2.gz HGGKWTITQBORKU-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000114459514 508316138 /nfs/dbraw/zinc/31/61/38/508316138.db2.gz RCNQARJNFKIDOW-CVEARBPZSA-N 1 1 365.430 2.557 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087104109 508337039 /nfs/dbraw/zinc/33/70/39/508337039.db2.gz JWFJXADCQKQFEM-KRWDZBQOSA-N 1 1 360.458 2.927 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000115270347 508380016 /nfs/dbraw/zinc/38/00/16/508380016.db2.gz IITJRRMKTWHOEW-CRAIPNDOSA-N 1 1 363.458 2.770 20 5 FFBDMO C[NH+]1CCN(C(=O)Cc2cccc(NCc3ccccc3[N+](=O)[O-])c2)CC1 ZINC000152434446 508445952 /nfs/dbraw/zinc/44/59/52/508445952.db2.gz AYPKBKVDCAIQIC-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CCc1nccs1 ZINC000157485787 508572068 /nfs/dbraw/zinc/57/20/68/508572068.db2.gz CHESFOUPKWMZRD-UHFFFAOYSA-N 1 1 362.411 2.524 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CCc1nccs1 ZINC000158042703 508648882 /nfs/dbraw/zinc/64/88/82/508648882.db2.gz WHRHSWHNXGEBNO-NSHDSACASA-N 1 1 364.427 2.561 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCc1nccs1 ZINC000158042703 508648885 /nfs/dbraw/zinc/64/88/85/508648885.db2.gz WHRHSWHNXGEBNO-NSHDSACASA-N 1 1 364.427 2.561 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@]3(CCOC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000153854856 508663206 /nfs/dbraw/zinc/66/32/06/508663206.db2.gz PFUYLJJSRMAOFT-INIZCTEOSA-N 1 1 358.341 2.817 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+](C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000123399595 508681173 /nfs/dbraw/zinc/68/11/73/508681173.db2.gz DBCSGOUSBBMDJY-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000123399595 508681179 /nfs/dbraw/zinc/68/11/79/508681179.db2.gz DBCSGOUSBBMDJY-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(-n4ccnc4)cc3)C2)nc1 ZINC000118866043 508688051 /nfs/dbraw/zinc/68/80/51/508688051.db2.gz NTDPNJNHCNGKAK-MRXNPFEDSA-N 1 1 364.409 2.862 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@H](C)C1 ZINC000158418556 508701258 /nfs/dbraw/zinc/70/12/58/508701258.db2.gz YLQFHDVUSLADMN-ZBFHGGJFSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(N)=O ZINC000123719626 508729114 /nfs/dbraw/zinc/72/91/14/508729114.db2.gz KRNYSNMRCWRECG-OAHLLOKOSA-N 1 1 357.410 2.912 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000139285751 508787009 /nfs/dbraw/zinc/78/70/09/508787009.db2.gz KCPOBMAKPXXSLJ-UHFFFAOYSA-N 1 1 363.439 2.525 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124188409 508794631 /nfs/dbraw/zinc/79/46/31/508794631.db2.gz HEOHYKIAKFFWAO-PWSUYJOCSA-N 1 1 370.247 2.912 20 5 FFBDMO C[N@H+](CCOCc1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000154650802 508826766 /nfs/dbraw/zinc/82/67/66/508826766.db2.gz JFLBFKDJOQYHKT-LJQANCHMSA-N 1 1 369.421 2.849 20 5 FFBDMO C[N@@H+](CCOCc1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000154650802 508826768 /nfs/dbraw/zinc/82/67/68/508826768.db2.gz JFLBFKDJOQYHKT-LJQANCHMSA-N 1 1 369.421 2.849 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccnn2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000131338449 508917733 /nfs/dbraw/zinc/91/77/33/508917733.db2.gz VPJCBSUQJCFTAX-UHFFFAOYSA-N 1 1 374.319 2.568 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000155082849 508919164 /nfs/dbraw/zinc/91/91/64/508919164.db2.gz SUNBLNHTUSFDNZ-YJBOKZPZSA-N 1 1 360.458 2.730 20 5 FFBDMO O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000160001988 508923457 /nfs/dbraw/zinc/92/34/57/508923457.db2.gz HGIBJGCOMKZESA-CYBMUJFWSA-N 1 1 363.805 2.538 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125272206 508958180 /nfs/dbraw/zinc/95/81/80/508958180.db2.gz LQPTZMHGJSUKKZ-SNVBAGLBSA-N 1 1 357.332 2.828 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000156321375 509159992 /nfs/dbraw/zinc/15/99/92/509159992.db2.gz CSMOOTNPRSLFMV-QGZVFWFLSA-N 1 1 370.409 2.780 20 5 FFBDMO CNC(=O)c1ccc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000185484256 509198849 /nfs/dbraw/zinc/19/88/49/509198849.db2.gz UFSNTZIXZYMVTG-CYBMUJFWSA-N 1 1 374.466 2.899 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000248008555 509214617 /nfs/dbraw/zinc/21/46/17/509214617.db2.gz QLNPDCZVFROJDF-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cc(CN2CC[N@H+]3CCCC[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000172804780 509247121 /nfs/dbraw/zinc/24/71/21/509247121.db2.gz WQOIQSNQUGJUEW-CYBMUJFWSA-N 1 1 371.384 2.875 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000172824852 509256644 /nfs/dbraw/zinc/25/66/44/509256644.db2.gz ZHFWWAIWYYWAOJ-UHFFFAOYSA-N 1 1 368.437 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C(C)C)CC2)cc1SC ZINC000264130616 509344179 /nfs/dbraw/zinc/34/41/79/509344179.db2.gz KSZXSDLKJKKPIT-UHFFFAOYSA-N 1 1 367.471 2.882 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCC2)cc1SC ZINC000264134104 509346177 /nfs/dbraw/zinc/34/61/77/509346177.db2.gz FLQZZDXQPJYMJX-UHFFFAOYSA-N 1 1 367.471 2.930 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000185838018 509378406 /nfs/dbraw/zinc/37/84/06/509378406.db2.gz JNIJYKWZJMJAOO-CMPLNLGQSA-N 1 1 352.822 2.673 20 5 FFBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248604805 509385298 /nfs/dbraw/zinc/38/52/98/509385298.db2.gz FCOBEKFUDLGRNR-XHDPSFHLSA-N 1 1 354.838 2.776 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3c(C)nn(C)c3C)CC2)ccc1[N+](=O)[O-] ZINC000267193592 509388398 /nfs/dbraw/zinc/38/83/98/509388398.db2.gz HXBXYOUQGSYQHX-UHFFFAOYSA-N 1 1 373.457 2.666 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@H](C)CC1 ZINC000192183807 509392128 /nfs/dbraw/zinc/39/21/28/509392128.db2.gz GEJFHINQROUUTA-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCCO)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000176238056 509395177 /nfs/dbraw/zinc/39/51/77/509395177.db2.gz BHSNUJULRGOMHQ-UHFFFAOYSA-N 1 1 373.240 2.983 20 5 FFBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226688516 509402087 /nfs/dbraw/zinc/40/20/87/509402087.db2.gz BOFUMBBLBGSZQA-HUUCEWRRSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226688516 509402091 /nfs/dbraw/zinc/40/20/91/509402091.db2.gz BOFUMBBLBGSZQA-HUUCEWRRSA-N 1 1 369.425 2.812 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000267436094 509481390 /nfs/dbraw/zinc/48/13/90/509481390.db2.gz ACWOBVAAFXFMJH-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000267457867 509494853 /nfs/dbraw/zinc/49/48/53/509494853.db2.gz ISDPXNZRVZPVNT-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000267482039 509509449 /nfs/dbraw/zinc/50/94/49/509509449.db2.gz JNGUAXLOTFPEOO-UHFFFAOYSA-N 1 1 367.203 2.682 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183018827 509551205 /nfs/dbraw/zinc/55/12/05/509551205.db2.gz OKONZCAESCBHFO-RYUDHWBXSA-N 1 1 373.500 2.588 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183022433 509553212 /nfs/dbraw/zinc/55/32/12/509553212.db2.gz AIGUOKOHBCUSGD-MFKMUULPSA-N 1 1 357.357 2.608 20 5 FFBDMO COc1cccc(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000186164269 509553646 /nfs/dbraw/zinc/55/36/46/509553646.db2.gz CWFPJCAXKGRMDG-HXUWFJFHSA-N 1 1 371.437 2.677 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000165737227 509582891 /nfs/dbraw/zinc/58/28/91/509582891.db2.gz PGONMSQWZXEDCJ-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000165737227 509582900 /nfs/dbraw/zinc/58/29/00/509582900.db2.gz PGONMSQWZXEDCJ-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC[N@H+]1C[C@H](C)O ZINC000249063840 509588922 /nfs/dbraw/zinc/58/89/22/509588922.db2.gz JYMLAMBSZSCVLZ-GJZGRUSLSA-N 1 1 364.446 2.521 20 5 FFBDMO CC[NH+]1CCN(CCCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192666028 509589246 /nfs/dbraw/zinc/58/92/46/509589246.db2.gz UVMXMDIULIDOBC-HXUWFJFHSA-N 1 1 360.502 2.980 20 5 FFBDMO CS(=O)(=O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237309521 509617473 /nfs/dbraw/zinc/61/74/73/509617473.db2.gz RXZJJOSRHCSGFK-UHFFFAOYSA-N 1 1 358.803 2.642 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@@H]1CO ZINC000192757938 509630836 /nfs/dbraw/zinc/63/08/36/509630836.db2.gz HHEGDZJKFPFUFO-QGZVFWFLSA-N 1 1 373.457 2.688 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000186586931 509788348 /nfs/dbraw/zinc/78/83/48/509788348.db2.gz KHGUZKPBQCCCEC-NSHGMRRFSA-N 1 1 374.529 2.922 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180185682 509799267 /nfs/dbraw/zinc/79/92/67/509799267.db2.gz JBDQKEITVBCAMV-INIZCTEOSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180185682 509799279 /nfs/dbraw/zinc/79/92/79/509799279.db2.gz JBDQKEITVBCAMV-INIZCTEOSA-N 1 1 360.357 2.594 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000268231964 509827513 /nfs/dbraw/zinc/82/75/13/509827513.db2.gz SIUUPBGPXHSAJX-TVQRCGJNSA-N 1 1 368.231 2.570 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O ZINC000189936636 509840173 /nfs/dbraw/zinc/84/01/73/509840173.db2.gz ACMBOHICQJGXAA-ZBFHGGJFSA-N 1 1 363.458 2.635 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453901 509943817 /nfs/dbraw/zinc/94/38/17/509943817.db2.gz ROSABGVFFJKBRH-QAPCUYQASA-N 1 1 360.458 2.506 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](c4cc[nH]n4)C3)n2)cc1 ZINC000193590776 509981209 /nfs/dbraw/zinc/98/12/09/509981209.db2.gz GFBQRXOWKMQYBU-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)n2)cc1 ZINC000193590776 509981218 /nfs/dbraw/zinc/98/12/18/509981218.db2.gz GFBQRXOWKMQYBU-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000245537499 509989034 /nfs/dbraw/zinc/98/90/34/509989034.db2.gz ZTAXNAQGPNYNKP-WOJBJXKFSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCO[C@]3(CCc4ccccc43)C2)c1 ZINC000245537499 509989038 /nfs/dbraw/zinc/98/90/38/509989038.db2.gz ZTAXNAQGPNYNKP-WOJBJXKFSA-N 1 1 354.406 2.802 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000177350239 510009058 /nfs/dbraw/zinc/00/90/58/510009058.db2.gz KATSTGFNDTUMHJ-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193784498 510068777 /nfs/dbraw/zinc/06/87/77/510068777.db2.gz CUWIXLUBOVGEIP-INIZCTEOSA-N 1 1 354.410 2.550 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193833470 510091824 /nfs/dbraw/zinc/09/18/24/510091824.db2.gz OILKDZZDXHDXFB-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CCN(C2CCC2)CC1 ZINC000269001129 510186105 /nfs/dbraw/zinc/18/61/05/510186105.db2.gz LMJBIDAPUXVMQS-AWEZNQCLSA-N 1 1 360.458 2.918 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000265775136 510223942 /nfs/dbraw/zinc/22/39/42/510223942.db2.gz PKNAETOLDXDELM-UHFFFAOYSA-N 1 1 371.422 2.505 20 5 FFBDMO COc1cc(C[N@@H+](C)CC(C)(C)CN2CCOCC2)c([N+](=O)[O-])cc1F ZINC000184269120 510229804 /nfs/dbraw/zinc/22/98/04/510229804.db2.gz FLPITAIIIYNJSA-UHFFFAOYSA-N 1 1 369.437 2.533 20 5 FFBDMO COc1cc(CN(C)CC(C)(C)C[NH+]2CCOCC2)c([N+](=O)[O-])cc1F ZINC000184269120 510229811 /nfs/dbraw/zinc/22/98/11/510229811.db2.gz FLPITAIIIYNJSA-UHFFFAOYSA-N 1 1 369.437 2.533 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279329 510321815 /nfs/dbraw/zinc/32/18/15/510321815.db2.gz OBEMGRMNQIMBLR-MLGOLLRUSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279329 510321819 /nfs/dbraw/zinc/32/18/19/510321819.db2.gz OBEMGRMNQIMBLR-MLGOLLRUSA-N 1 1 364.833 2.927 20 5 FFBDMO O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CC[NH+](C2CCC2)CC1 ZINC000269298575 510328967 /nfs/dbraw/zinc/32/89/67/510328967.db2.gz XIUUQFZGAVAUKC-UHFFFAOYSA-N 1 1 368.231 2.668 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000190838205 510367199 /nfs/dbraw/zinc/36/71/99/510367199.db2.gz MVNOYGXIRZMZSD-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000190838205 510367208 /nfs/dbraw/zinc/36/72/08/510367208.db2.gz MVNOYGXIRZMZSD-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000246309553 510420606 /nfs/dbraw/zinc/42/06/06/510420606.db2.gz FZADILRLDLVJNZ-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000246309553 510420615 /nfs/dbraw/zinc/42/06/15/510420615.db2.gz FZADILRLDLVJNZ-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000171873169 510423511 /nfs/dbraw/zinc/42/35/11/510423511.db2.gz PPZJULSRLGODQD-GFCCVEGCSA-N 1 1 351.451 2.511 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269496515 510435891 /nfs/dbraw/zinc/43/58/91/510435891.db2.gz KISFEUAFEIVELK-AEFFLSMTSA-N 1 1 372.469 2.796 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000190995689 510457326 /nfs/dbraw/zinc/45/73/26/510457326.db2.gz BQGOSSBTUVTUCG-CQSZACIVSA-N 1 1 363.458 2.635 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000178224287 510496542 /nfs/dbraw/zinc/49/65/42/510496542.db2.gz YKPQEDGBNNRRSS-OAHLLOKOSA-N 1 1 355.442 2.592 20 5 FFBDMO CCc1nc([C@@H](C)[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000184749972 510498771 /nfs/dbraw/zinc/49/87/71/510498771.db2.gz UUAHZZRCHXHGNS-NEPJUHHUSA-N 1 1 351.428 2.704 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000266456551 510598205 /nfs/dbraw/zinc/59/82/05/510598205.db2.gz YBLVIRJNMMORAK-UHFFFAOYSA-N 1 1 357.370 2.659 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000246660943 510605952 /nfs/dbraw/zinc/60/59/52/510605952.db2.gz JAWPXYWBNHCTRJ-IEBWSBKVSA-N 1 1 356.422 2.899 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000266555097 510655909 /nfs/dbraw/zinc/65/59/09/510655909.db2.gz PMTIQNYOSXJHSY-INIZCTEOSA-N 1 1 356.426 2.907 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000181915682 510657319 /nfs/dbraw/zinc/65/73/19/510657319.db2.gz ZGQWUVITVCSOHD-SJORKVTESA-N 1 1 364.442 2.758 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181952436 510676390 /nfs/dbraw/zinc/67/63/90/510676390.db2.gz STLODMCIXKGSGD-LLVKDONJSA-N 1 1 357.357 2.610 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246812587 510689542 /nfs/dbraw/zinc/68/95/42/510689542.db2.gz NJYNWJUTOZPPFZ-ZRGWGRIASA-N 1 1 372.469 2.871 20 5 FFBDMO CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000246850052 510709500 /nfs/dbraw/zinc/70/95/00/510709500.db2.gz ZTXWGCZHPKVOAW-CJNGLKHVSA-N 1 1 358.398 2.982 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)n1 ZINC000191578732 510735651 /nfs/dbraw/zinc/73/56/51/510735651.db2.gz MKQIUIBNCGMQTB-INIZCTEOSA-N 1 1 371.441 2.596 20 5 FFBDMO CCC(CC)[C@H](CNc1c([N+](=O)[O-])c(C)nn1CC)[NH+]1CCOCC1 ZINC000195343865 510793263 /nfs/dbraw/zinc/79/32/63/510793263.db2.gz BPERUGNKVXVDJW-HNNXBMFYSA-N 1 1 353.467 2.669 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000195422671 510820545 /nfs/dbraw/zinc/82/05/45/510820545.db2.gz DGFUBARPCHTOPU-UHFFFAOYSA-N 1 1 354.815 2.812 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182296463 510845658 /nfs/dbraw/zinc/84/56/58/510845658.db2.gz QRMLLJIYZBAMSG-HOCLYGCPSA-N 1 1 360.414 2.512 20 5 FFBDMO Cn1c(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])nc2ccccc2c1=O ZINC000285389339 510887644 /nfs/dbraw/zinc/88/76/44/510887644.db2.gz SIXVTIRVVFIVKI-UHFFFAOYSA-N 1 1 352.394 2.516 20 5 FFBDMO Cn1c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])nc2ccccc2c1=O ZINC000285389339 510887650 /nfs/dbraw/zinc/88/76/50/510887650.db2.gz SIXVTIRVVFIVKI-UHFFFAOYSA-N 1 1 352.394 2.516 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285428160 510902813 /nfs/dbraw/zinc/90/28/13/510902813.db2.gz HHYJMMLNHYCFEF-FKEKPDDDSA-N 1 1 360.458 2.789 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285428160 510902819 /nfs/dbraw/zinc/90/28/19/510902819.db2.gz HHYJMMLNHYCFEF-FKEKPDDDSA-N 1 1 360.458 2.789 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000364527094 510915976 /nfs/dbraw/zinc/91/59/76/510915976.db2.gz JTKUQFOLHOCPEZ-LJHODMEESA-N 1 1 357.410 2.813 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285566306 510958795 /nfs/dbraw/zinc/95/87/95/510958795.db2.gz RYLBOOWCZPPJST-FKEKPDDDSA-N 1 1 360.458 2.789 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)N2C ZINC000285566306 510958803 /nfs/dbraw/zinc/95/88/03/510958803.db2.gz RYLBOOWCZPPJST-FKEKPDDDSA-N 1 1 360.458 2.789 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000270869638 511010319 /nfs/dbraw/zinc/01/03/19/511010319.db2.gz JKFWOTLRVPOTIU-UHFFFAOYSA-N 1 1 369.487 2.795 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+](C)C(C)C ZINC000271028311 511062003 /nfs/dbraw/zinc/06/20/03/511062003.db2.gz OMXXVRNVSXEBDO-UHFFFAOYSA-N 1 1 369.487 2.793 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279754780 511203355 /nfs/dbraw/zinc/20/33/55/511203355.db2.gz CYJTXPJSHSDKDJ-UHFFFAOYSA-N 1 1 368.796 2.983 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1)C1CC1 ZINC000271454072 511209818 /nfs/dbraw/zinc/20/98/18/511209818.db2.gz FAVGCHHYVXISQP-CEWLAPEOSA-N 1 1 373.497 2.883 20 5 FFBDMO COc1ccccc1CNC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271616972 511264282 /nfs/dbraw/zinc/26/42/82/511264282.db2.gz LXLDUYXFPDOPGR-KGLIPLIRSA-N 1 1 357.410 2.959 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295233316 511330501 /nfs/dbraw/zinc/33/05/01/511330501.db2.gz BXNQYSBMYYRIFG-CYBMUJFWSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CCC2)C1 ZINC000292109566 511468192 /nfs/dbraw/zinc/46/81/92/511468192.db2.gz GWXJTCIQSPCILP-CQSZACIVSA-N 1 1 371.441 2.951 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292131622 511476657 /nfs/dbraw/zinc/47/66/57/511476657.db2.gz LFTUAXIRVUJDKL-SJKOYZFVSA-N 1 1 366.849 2.603 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292131616 511477238 /nfs/dbraw/zinc/47/72/38/511477238.db2.gz LFTUAXIRVUJDKL-PXAZEXFGSA-N 1 1 366.849 2.603 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000295751053 511504186 /nfs/dbraw/zinc/50/41/86/511504186.db2.gz XIKIQPNEBHPJNY-QWHCGFSZSA-N 1 1 366.377 2.517 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000292280852 511534986 /nfs/dbraw/zinc/53/49/86/511534986.db2.gz SWCMSHPJDFEOBD-GOSISDBHSA-N 1 1 373.384 2.531 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000292280852 511534987 /nfs/dbraw/zinc/53/49/87/511534987.db2.gz SWCMSHPJDFEOBD-GOSISDBHSA-N 1 1 373.384 2.531 20 5 FFBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587671 511545671 /nfs/dbraw/zinc/54/56/71/511545671.db2.gz QWYPPTKQJXNJKX-IFXJQAMLSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587671 511545676 /nfs/dbraw/zinc/54/56/76/511545676.db2.gz QWYPPTKQJXNJKX-IFXJQAMLSA-N 1 1 366.421 2.962 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)COCC(F)(F)F ZINC000292417855 511590062 /nfs/dbraw/zinc/59/00/62/511590062.db2.gz KLYODPIVFXXDRI-NSHDSACASA-N 1 1 356.728 2.620 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)COCC(F)(F)F ZINC000292417855 511590058 /nfs/dbraw/zinc/59/00/58/511590058.db2.gz KLYODPIVFXXDRI-NSHDSACASA-N 1 1 356.728 2.620 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3nncn3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000284081444 511598034 /nfs/dbraw/zinc/59/80/34/511598034.db2.gz LKQLUVHHUFKSFR-CYBMUJFWSA-N 1 1 372.385 2.809 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000284081444 511598039 /nfs/dbraw/zinc/59/80/39/511598039.db2.gz LKQLUVHHUFKSFR-CYBMUJFWSA-N 1 1 372.385 2.809 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562306 511629166 /nfs/dbraw/zinc/62/91/66/511629166.db2.gz LLLIARJLBOAOFQ-STQMWFEESA-N 1 1 373.413 2.533 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000363561414 511629467 /nfs/dbraw/zinc/62/94/67/511629467.db2.gz YZDUZENNIFBOLH-LSDHHAIUSA-N 1 1 371.441 2.528 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@H](CSC)C2)c([N+](=O)[O-])c1 ZINC000292537807 511634215 /nfs/dbraw/zinc/63/42/15/511634215.db2.gz XMBBITRZESBAEX-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H](CSC)C2)c([N+](=O)[O-])c1 ZINC000292537807 511634221 /nfs/dbraw/zinc/63/42/21/511634221.db2.gz XMBBITRZESBAEX-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000292556902 511642091 /nfs/dbraw/zinc/64/20/91/511642091.db2.gz XRLQPALCEKWILU-AEFFLSMTSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000292556902 511642093 /nfs/dbraw/zinc/64/20/93/511642093.db2.gz XRLQPALCEKWILU-AEFFLSMTSA-N 1 1 357.410 2.813 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000284216434 511646868 /nfs/dbraw/zinc/64/68/68/511646868.db2.gz TUDLWNLDNCTKQN-DAYGRLMNSA-N 1 1 364.490 2.965 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)NCCC1CCCCC1 ZINC000365854027 511688798 /nfs/dbraw/zinc/68/87/98/511688798.db2.gz PNYBZUWNYXCVDE-UHFFFAOYSA-N 1 1 363.462 2.515 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000301709665 511699973 /nfs/dbraw/zinc/69/99/73/511699973.db2.gz XAJPUIQJXMCKSN-ZDUSSCGKSA-N 1 1 362.430 2.850 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@H]4CCn5cc[nH+]c5C4)n3)c2c1 ZINC000350181467 511736813 /nfs/dbraw/zinc/73/68/13/511736813.db2.gz JAHKDAYPCSCCEP-NSHDSACASA-N 1 1 364.365 2.976 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000284550287 511768644 /nfs/dbraw/zinc/76/86/44/511768644.db2.gz HHLDLYHSLCXYIK-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312028941 511781573 /nfs/dbraw/zinc/78/15/73/511781573.db2.gz YJELIIFHCHARRM-HNNXBMFYSA-N 1 1 354.410 2.641 20 5 FFBDMO COc1cc(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350340289 511783453 /nfs/dbraw/zinc/78/34/53/511783453.db2.gz NTDZWVMAGYVCNX-YOEHRIQHSA-N 1 1 360.370 2.579 20 5 FFBDMO COc1c(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000350402012 511802867 /nfs/dbraw/zinc/80/28/67/511802867.db2.gz RRQDZJNPNZZUDP-SUMWQHHRSA-N 1 1 360.370 2.579 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000293084293 511834859 /nfs/dbraw/zinc/83/48/59/511834859.db2.gz OZXMFXJUWOITJL-SFHVURJKSA-N 1 1 367.421 2.793 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000366141307 511863072 /nfs/dbraw/zinc/86/30/72/511863072.db2.gz BHVPSNVEHBNFQX-BLLLJJGKSA-N 1 1 360.439 2.864 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3C[N@H+](Cc4ccccc4)CCO3)n2)o1 ZINC000351153377 511968026 /nfs/dbraw/zinc/96/80/26/511968026.db2.gz YEYJBNGAQYFFDS-AWEZNQCLSA-N 1 1 356.338 2.811 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3C[N@@H+](Cc4ccccc4)CCO3)n2)o1 ZINC000351153377 511968033 /nfs/dbraw/zinc/96/80/33/511968033.db2.gz YEYJBNGAQYFFDS-AWEZNQCLSA-N 1 1 356.338 2.811 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000293525672 511997298 /nfs/dbraw/zinc/99/72/98/511997298.db2.gz WKOLZZZJTVAOJU-TUAOUCFPSA-N 1 1 354.838 2.600 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000281912245 512009082 /nfs/dbraw/zinc/00/90/82/512009082.db2.gz JACLQGLKSQJNNC-XJKSGUPXSA-N 1 1 362.430 2.942 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285140536 512014522 /nfs/dbraw/zinc/01/45/22/512014522.db2.gz LVNRDMPMENXDMS-KBXCAEBGSA-N 1 1 370.453 2.594 20 5 FFBDMO CCC(=O)c1ccc(N2CC[C@H](N3CC[NH+](C)CC3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000366430491 512020185 /nfs/dbraw/zinc/02/01/85/512020185.db2.gz NMSOXBARGMXMJL-WBVHZDCISA-N 1 1 374.485 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275078749 512034735 /nfs/dbraw/zinc/03/47/35/512034735.db2.gz CNZMLXQCIXFIEK-NEPJUHHUSA-N 1 1 359.348 2.965 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000275099844 512040309 /nfs/dbraw/zinc/04/03/09/512040309.db2.gz KOSKITCCOGWOBW-JTQLQIEISA-N 1 1 365.739 2.749 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000377949981 512524735 /nfs/dbraw/zinc/52/47/35/512524735.db2.gz NMQUOFTVTKEEBQ-UHFFFAOYSA-N 1 1 354.414 2.783 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)CCCc1cc(-c2ccccc2)n[nH]1 ZINC000377949981 512524739 /nfs/dbraw/zinc/52/47/39/512524739.db2.gz NMQUOFTVTKEEBQ-UHFFFAOYSA-N 1 1 354.414 2.783 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000411597840 512709178 /nfs/dbraw/zinc/70/91/78/512709178.db2.gz VZADRDXRTLUSGJ-RBUKOAKNSA-N 1 1 353.422 2.947 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@H](COC)C2)c([N+](=O)[O-])c1 ZINC000372090116 512711544 /nfs/dbraw/zinc/71/15/44/512711544.db2.gz ZDQYUWZFSIVWKN-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@H](COC)C2)c([N+](=O)[O-])c1 ZINC000372090116 512711547 /nfs/dbraw/zinc/71/15/47/512711547.db2.gz ZDQYUWZFSIVWKN-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000378500976 512793120 /nfs/dbraw/zinc/79/31/20/512793120.db2.gz YUDQABAYLNGUKL-IUODEOHRSA-N 1 1 353.369 2.629 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(=NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000388556242 512896953 /nfs/dbraw/zinc/89/69/53/512896953.db2.gz YLDJMBLOMDMQDI-HNNXBMFYSA-N 1 1 351.410 2.827 20 5 FFBDMO NC(=O)c1ccc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000390708094 512910357 /nfs/dbraw/zinc/91/03/57/512910357.db2.gz SXSAVGPIUFEUCI-INIZCTEOSA-N 1 1 354.410 2.770 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])c2cnccc21)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372605513 512966445 /nfs/dbraw/zinc/96/64/45/512966445.db2.gz ICKJFMIJTMAJIZ-INIZCTEOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)CC3(C)C)cc2[N+](=O)[O-])C1 ZINC000408051458 512990386 /nfs/dbraw/zinc/99/03/86/512990386.db2.gz PERWUGNNXCUMNR-HNNXBMFYSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC3(C)C)cc2[N+](=O)[O-])C1 ZINC000408051458 512990391 /nfs/dbraw/zinc/99/03/91/512990391.db2.gz PERWUGNNXCUMNR-HNNXBMFYSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C ZINC000408071514 512993889 /nfs/dbraw/zinc/99/38/89/512993889.db2.gz QCDKOZICPCBOHH-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000408071514 512993891 /nfs/dbraw/zinc/99/38/91/512993891.db2.gz QCDKOZICPCBOHH-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000372769181 513036230 /nfs/dbraw/zinc/03/62/30/513036230.db2.gz WJDQRRBRQQPOCD-OLZOCXBDSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000450417561 513185245 /nfs/dbraw/zinc/18/52/45/513185245.db2.gz JVJVYYYSMXEZKN-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000450417561 513185252 /nfs/dbraw/zinc/18/52/52/513185252.db2.gz JVJVYYYSMXEZKN-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CCN(c4[nH]cc[nH+]4)CC3)n2)cc1 ZINC000450481082 513214280 /nfs/dbraw/zinc/21/42/80/513214280.db2.gz CSYMIGUPGVTOPM-UHFFFAOYSA-N 1 1 356.411 2.768 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000450500785 513223853 /nfs/dbraw/zinc/22/38/53/513223853.db2.gz OEASKYBKAHKMOK-STQMWFEESA-N 1 1 357.414 2.540 20 5 FFBDMO Cc1nc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC000450537580 513240489 /nfs/dbraw/zinc/24/04/89/513240489.db2.gz DZGPVLMVAWHSSJ-DLBZAZTESA-N 1 1 353.426 2.652 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020144 513258368 /nfs/dbraw/zinc/25/83/68/513258368.db2.gz MQHBXDXHCUTVDK-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@H]1N1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020144 513258378 /nfs/dbraw/zinc/25/83/78/513258378.db2.gz MQHBXDXHCUTVDK-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@H]1N1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020144 513258385 /nfs/dbraw/zinc/25/83/85/513258385.db2.gz MQHBXDXHCUTVDK-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1ccc2c(c1)OCO2)c1ccccc1[N+](=O)[O-] ZINC000429261359 513318383 /nfs/dbraw/zinc/31/83/83/513318383.db2.gz ASXAXQKPNIMFSW-UHFFFAOYSA-N 1 1 357.366 2.787 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000434425225 513320472 /nfs/dbraw/zinc/32/04/72/513320472.db2.gz NTNITVJZABOXRF-GOSISDBHSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000450929607 513409456 /nfs/dbraw/zinc/40/94/56/513409456.db2.gz JTPCYRBSABCEMH-CQSZACIVSA-N 1 1 357.414 2.588 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413087959 513436829 /nfs/dbraw/zinc/43/68/29/513436829.db2.gz ZYWYIKLORGZCJF-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)c2C[C@H]1C ZINC000451006130 513453219 /nfs/dbraw/zinc/45/32/19/513453219.db2.gz ZXTWUYXRJRMXSY-CHWSQXEVSA-N 1 1 354.410 2.751 20 5 FFBDMO COc1ccccc1[C@@H]([NH3+])C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000429993661 513522096 /nfs/dbraw/zinc/52/20/96/513522096.db2.gz UFQIUDUDTPOCID-GOSISDBHSA-N 1 1 372.425 2.530 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000422033689 513536706 /nfs/dbraw/zinc/53/67/06/513536706.db2.gz HYUYOLKHGRGFSF-ZDUSSCGKSA-N 1 1 367.424 2.987 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1[N+](=O)[O-] ZINC000430086294 513548009 /nfs/dbraw/zinc/54/80/09/513548009.db2.gz DEYRRRAPOLIKOJ-GOEBONIOSA-N 1 1 370.352 2.624 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)cc1[N+](=O)[O-] ZINC000430086294 513548013 /nfs/dbraw/zinc/54/80/13/513548013.db2.gz DEYRRRAPOLIKOJ-GOEBONIOSA-N 1 1 370.352 2.624 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425424103 513559020 /nfs/dbraw/zinc/55/90/20/513559020.db2.gz RUNJZTNMKVSZEA-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1)C(N)=O ZINC000451213244 513598301 /nfs/dbraw/zinc/59/83/01/513598301.db2.gz DNCOXWANUYJPAN-GFCCVEGCSA-N 1 1 359.430 2.585 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1)C(N)=O ZINC000451213244 513598306 /nfs/dbraw/zinc/59/83/06/513598306.db2.gz DNCOXWANUYJPAN-GFCCVEGCSA-N 1 1 359.430 2.585 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000451430616 513747993 /nfs/dbraw/zinc/74/79/93/513747993.db2.gz YCBHJHSWOBHVIA-BMGDILEWSA-N 1 1 361.442 2.857 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451523804 513806727 /nfs/dbraw/zinc/80/67/27/513806727.db2.gz DHQYKFGJRPEQME-GDZNZVCISA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451523804 513806737 /nfs/dbraw/zinc/80/67/37/513806737.db2.gz DHQYKFGJRPEQME-GDZNZVCISA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000426068456 513839382 /nfs/dbraw/zinc/83/93/82/513839382.db2.gz YHYBJVIRRUYHLJ-MFKMUULPSA-N 1 1 374.363 2.896 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCSC[C@H]1C1CC1 ZINC000451658928 513894712 /nfs/dbraw/zinc/89/47/12/513894712.db2.gz YXTHLXFRIIYHBQ-HNNXBMFYSA-N 1 1 363.439 2.720 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000413956764 513900044 /nfs/dbraw/zinc/90/00/44/513900044.db2.gz OHPJJCXFBZTTRM-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000413956764 513900046 /nfs/dbraw/zinc/90/00/46/513900046.db2.gz OHPJJCXFBZTTRM-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431495427 513911448 /nfs/dbraw/zinc/91/14/48/513911448.db2.gz JHIWEFPKLPDWEY-XPTSAGLGSA-N 1 1 368.231 2.570 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000448821736 513915032 /nfs/dbraw/zinc/91/50/32/513915032.db2.gz HRSZSSOFXOOKEV-CQSZACIVSA-N 1 1 371.441 2.835 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000427018797 514092950 /nfs/dbraw/zinc/09/29/50/514092950.db2.gz CWSZJGHFBXHKNP-FUHWJXTLSA-N 1 1 355.394 2.779 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CCC[C@@]4(CC[NH2+]C4)C3)o2)c1 ZINC000420386757 514122915 /nfs/dbraw/zinc/12/29/15/514122915.db2.gz VOSVCFBYWYZIES-IBGZPJMESA-N 1 1 356.426 2.868 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@H]1c1ccccc1 ZINC000452010799 514134953 /nfs/dbraw/zinc/13/49/53/514134953.db2.gz WFOCZKRHYOJPJL-ROUUACIJSA-N 1 1 370.405 2.992 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414467946 514136211 /nfs/dbraw/zinc/13/62/11/514136211.db2.gz CEZMSYFRPXCXJU-GOSISDBHSA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414467946 514136217 /nfs/dbraw/zinc/13/62/17/514136217.db2.gz CEZMSYFRPXCXJU-GOSISDBHSA-N 1 1 356.426 2.996 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCN(CC(F)(F)F)CC1 ZINC000452032747 514149185 /nfs/dbraw/zinc/14/91/85/514149185.db2.gz BEWBJUFJDJMDOC-UHFFFAOYSA-N 1 1 361.364 2.932 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC2)s1 ZINC000420605418 514198199 /nfs/dbraw/zinc/19/81/99/514198199.db2.gz VKXPJQMMLSCQEH-UHFFFAOYSA-N 1 1 374.466 2.640 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000452121715 514205923 /nfs/dbraw/zinc/20/59/23/514205923.db2.gz KUQPZBSSNPROOY-SLEUVZQESA-N 1 1 365.405 2.545 20 5 FFBDMO C[C@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000452172809 514229527 /nfs/dbraw/zinc/22/95/27/514229527.db2.gz ZELRZILKVWILHX-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423959595 514309688 /nfs/dbraw/zinc/30/96/88/514309688.db2.gz CLSKKZRLGXDLDJ-GUYCJALGSA-N 1 1 372.450 2.644 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000449743892 514331426 /nfs/dbraw/zinc/33/14/26/514331426.db2.gz BXHLHKIDEOXFSP-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000427920239 514345978 /nfs/dbraw/zinc/34/59/78/514345978.db2.gz AUVQPJRTCVWQCP-CQSZACIVSA-N 1 1 372.425 2.512 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420948802 514396725 /nfs/dbraw/zinc/39/67/25/514396725.db2.gz OFFBVIJLQQBHDI-QWHCGFSZSA-N 1 1 362.348 2.999 20 5 FFBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCSC1 ZINC000433185650 514409395 /nfs/dbraw/zinc/40/93/95/514409395.db2.gz FTSBZIMEFBASEB-ZDUSSCGKSA-N 1 1 350.444 2.815 20 5 FFBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCSC1 ZINC000433185650 514409403 /nfs/dbraw/zinc/40/94/03/514409403.db2.gz FTSBZIMEFBASEB-ZDUSSCGKSA-N 1 1 350.444 2.815 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@@H]1CCC[N@H+]1C ZINC000420994433 514429690 /nfs/dbraw/zinc/42/96/90/514429690.db2.gz CDQFXFDDXJBCGC-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000475105392 514559526 /nfs/dbraw/zinc/55/95/26/514559526.db2.gz CCNQGFHDTFXGRP-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000475105392 514559532 /nfs/dbraw/zinc/55/95/32/514559532.db2.gz CCNQGFHDTFXGRP-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000458209738 514630913 /nfs/dbraw/zinc/63/09/13/514630913.db2.gz KRCOJIAGIUUPBJ-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1ccc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)nc1 ZINC000453442111 514643321 /nfs/dbraw/zinc/64/33/21/514643321.db2.gz XXKCZSCXEYFHSJ-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO CC(C)C[N@H+](Cc1cnn(C)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000453626083 514735426 /nfs/dbraw/zinc/73/54/26/514735426.db2.gz RUPKYUVAFWMNQK-UHFFFAOYSA-N 1 1 360.414 2.853 20 5 FFBDMO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000453626083 514735432 /nfs/dbraw/zinc/73/54/32/514735432.db2.gz RUPKYUVAFWMNQK-UHFFFAOYSA-N 1 1 360.414 2.853 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000502713890 514748418 /nfs/dbraw/zinc/74/84/18/514748418.db2.gz UBODHGIHWNEDSC-HNNXBMFYSA-N 1 1 369.487 2.836 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000458438343 514799339 /nfs/dbraw/zinc/79/93/39/514799339.db2.gz UNHCIMCSIGFQMD-QGZVFWFLSA-N 1 1 362.474 2.949 20 5 FFBDMO Cc1cc(N(C)CCCN2CC[NH+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461976078 514814493 /nfs/dbraw/zinc/81/44/93/514814493.db2.gz ZOWVTSCQEXPYJU-UHFFFAOYSA-N 1 1 374.407 2.996 20 5 FFBDMO CNc1nc(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000456031610 514914383 /nfs/dbraw/zinc/91/43/83/514914383.db2.gz IJUOFMZJECJZQT-AWEZNQCLSA-N 1 1 361.446 2.558 20 5 FFBDMO Cc1c(CNC(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000503102970 514920564 /nfs/dbraw/zinc/92/05/64/514920564.db2.gz IOWDMQJOXXQLFC-UHFFFAOYSA-N 1 1 368.437 2.929 20 5 FFBDMO COCCOc1cc2c(cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C)OCO2 ZINC000480471557 514969513 /nfs/dbraw/zinc/96/95/13/514969513.db2.gz PBRIIRVBXFMHFZ-UHFFFAOYSA-N 1 1 374.393 2.947 20 5 FFBDMO CCc1cc(N[C@@H]2CCn3cc[nH+]c3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489931990 515037574 /nfs/dbraw/zinc/03/75/74/515037574.db2.gz ZXOBWFZMIDLSAZ-OAHLLOKOSA-N 1 1 364.409 2.660 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000456324519 515091935 /nfs/dbraw/zinc/09/19/35/515091935.db2.gz XOCWYOLLJFDIAP-NDNKKMJESA-N 1 1 367.833 2.757 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000503702944 515125280 /nfs/dbraw/zinc/12/52/80/515125280.db2.gz RSFSGNRUTIFDBE-ZBFHGGJFSA-N 1 1 360.385 2.963 20 5 FFBDMO COC(=O)[C@]1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000504568742 515331492 /nfs/dbraw/zinc/33/14/92/515331492.db2.gz UGVPKEZKZZZQIY-QLJPJBMISA-N 1 1 358.341 2.827 20 5 FFBDMO COC(=O)[C@]1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000504568742 515331500 /nfs/dbraw/zinc/33/15/00/515331500.db2.gz UGVPKEZKZZZQIY-QLJPJBMISA-N 1 1 358.341 2.827 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000491092902 515376058 /nfs/dbraw/zinc/37/60/58/515376058.db2.gz UHSLDLODYWSQFC-UHFFFAOYSA-N 1 1 355.460 2.528 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000468488083 515382893 /nfs/dbraw/zinc/38/28/93/515382893.db2.gz PBJLIEOQDOORSS-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[N@@H+](CCNc1nc2sccn2c1[N+](=O)[O-])CCC(F)(F)F ZINC000491832429 515472381 /nfs/dbraw/zinc/47/23/81/515472381.db2.gz QHZKXYDBEXZVDV-UHFFFAOYSA-N 1 1 351.354 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC[NH+]2CCN(c3cccc(Cl)c3)CC2)cn1 ZINC000481834295 515480575 /nfs/dbraw/zinc/48/05/75/515480575.db2.gz BXDNAPNTNUILMR-UHFFFAOYSA-N 1 1 361.833 2.877 20 5 FFBDMO C[C@H](C[NH+]1CCCCCC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468747127 515500646 /nfs/dbraw/zinc/50/06/46/515500646.db2.gz JCWOKYBFZNVLMX-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000468749177 515502017 /nfs/dbraw/zinc/50/20/17/515502017.db2.gz JEOYXINFRHFZDV-AWEZNQCLSA-N 1 1 351.447 2.665 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146112 515506740 /nfs/dbraw/zinc/50/67/40/515506740.db2.gz YCINQAZKALPDKW-QUCCMNQESA-N 1 1 355.438 2.995 20 5 FFBDMO COCC[N@H+]1CC[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146112 515506752 /nfs/dbraw/zinc/50/67/52/515506752.db2.gz YCINQAZKALPDKW-QUCCMNQESA-N 1 1 355.438 2.995 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492828501 515566073 /nfs/dbraw/zinc/56/60/73/515566073.db2.gz JDPVGYFEHIQEBL-AWEZNQCLSA-N 1 1 357.414 2.909 20 5 FFBDMO O=c1cc2c(n[nH]1)CC[N@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000482283078 515634767 /nfs/dbraw/zinc/63/47/67/515634767.db2.gz YQLWJIZPHHLZLD-UHFFFAOYSA-N 1 1 352.350 2.909 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000459550125 515640882 /nfs/dbraw/zinc/64/08/82/515640882.db2.gz SUBJFKSZYSEUOP-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO COC[C@@H]1C[C@@H](OC)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000493579595 515645406 /nfs/dbraw/zinc/64/54/06/515645406.db2.gz OSKJKBOLXWLHQN-JKSUJKDBSA-N 1 1 361.398 2.528 20 5 FFBDMO O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505759433 515659386 /nfs/dbraw/zinc/65/93/86/515659386.db2.gz ZTZIMMHQKYDILF-GOSISDBHSA-N 1 1 355.394 2.867 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1cnn(C)c1)CC(C)C ZINC000459600450 515685012 /nfs/dbraw/zinc/68/50/12/515685012.db2.gz TUQXJPDBKFPYMS-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1cnn(C)c1)CC(C)C ZINC000459600450 515685016 /nfs/dbraw/zinc/68/50/16/515685016.db2.gz TUQXJPDBKFPYMS-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000487039886 515730704 /nfs/dbraw/zinc/73/07/04/515730704.db2.gz VMHTYHISAHRTPR-UHFFFAOYSA-N 1 1 368.865 2.964 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1[C@@H]1C[C@@H]1c1ccccc1 ZINC000478255363 515755094 /nfs/dbraw/zinc/75/50/94/515755094.db2.gz OICYGHRRVWAOSP-KVSKMBFKSA-N 1 1 369.396 2.981 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COCc1ccccc1F ZINC000511068312 515764453 /nfs/dbraw/zinc/76/44/53/515764453.db2.gz ZKYQESKOXKFHPY-KRWDZBQOSA-N 1 1 362.401 2.786 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N[C@H]1CCOc2ccccc21 ZINC000511076517 515769897 /nfs/dbraw/zinc/76/98/97/515769897.db2.gz XXNIJAUTMDZQDA-KRWDZBQOSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N[C@H]1CCOc2ccccc21 ZINC000511076517 515769904 /nfs/dbraw/zinc/76/99/04/515769904.db2.gz XXNIJAUTMDZQDA-KRWDZBQOSA-N 1 1 369.421 2.709 20 5 FFBDMO COc1ccccc1CNC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511089772 515775078 /nfs/dbraw/zinc/77/50/78/515775078.db2.gz HGYKGVUZTFOJRF-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO COc1ccccc1CNC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511089772 515775088 /nfs/dbraw/zinc/77/50/88/515775088.db2.gz HGYKGVUZTFOJRF-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)c(F)c1 ZINC000478387038 515802587 /nfs/dbraw/zinc/80/25/87/515802587.db2.gz QXFLKTQZQMAGTI-PXNSSMCTSA-N 1 1 373.428 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2CO)c(F)c1 ZINC000478387038 515802589 /nfs/dbraw/zinc/80/25/89/515802589.db2.gz QXFLKTQZQMAGTI-PXNSSMCTSA-N 1 1 373.428 2.707 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459790338 515808685 /nfs/dbraw/zinc/80/86/85/515808685.db2.gz GQHPCLCIKWMCJS-DOTOQJQBSA-N 1 1 361.442 2.715 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459790338 515808693 /nfs/dbraw/zinc/80/86/93/515808693.db2.gz GQHPCLCIKWMCJS-DOTOQJQBSA-N 1 1 361.442 2.715 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C3(CC3)C2)cc1OC ZINC000494683635 515922578 /nfs/dbraw/zinc/92/25/78/515922578.db2.gz WHLQXCYGDIJTOW-SCLBCKFNSA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C3(CC3)C2)cc1OC ZINC000494683635 515922587 /nfs/dbraw/zinc/92/25/87/515922587.db2.gz WHLQXCYGDIJTOW-SCLBCKFNSA-N 1 1 364.442 2.985 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704655 515933000 /nfs/dbraw/zinc/93/30/00/515933000.db2.gz TTYXLELRFKXRNM-MSOLQXFVSA-N 1 1 359.426 2.591 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704655 515933007 /nfs/dbraw/zinc/93/30/07/515933007.db2.gz TTYXLELRFKXRNM-MSOLQXFVSA-N 1 1 359.426 2.591 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])c(OC)c2)[C@H](C)C1 ZINC000469789546 515968081 /nfs/dbraw/zinc/96/80/81/515968081.db2.gz YUHBGXAFAWJMQL-NVXWUHKLSA-N 1 1 365.474 2.830 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000464820542 515972564 /nfs/dbraw/zinc/97/25/64/515972564.db2.gz FQBZTXYZDQUHEH-LPHOPBHVSA-N 1 1 361.442 2.619 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1)c1nccs1 ZINC000474357583 516007858 /nfs/dbraw/zinc/00/78/58/516007858.db2.gz UQCNRCNXGMENOZ-LBPRGKRZSA-N 1 1 365.411 2.844 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000460118566 516031598 /nfs/dbraw/zinc/03/15/98/516031598.db2.gz VLRVZPPGPLYTHU-ZDUSSCGKSA-N 1 1 352.435 2.523 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000495181693 516092076 /nfs/dbraw/zinc/09/20/76/516092076.db2.gz DMOPVSYDEUZPBV-ZDUSSCGKSA-N 1 1 374.363 2.897 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000470131167 516134682 /nfs/dbraw/zinc/13/46/82/516134682.db2.gz FSCHRMJYMOIHEC-OWQGQXMQSA-N 1 1 355.394 2.941 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@@H+](C)C1CC1 ZINC000455354549 516143066 /nfs/dbraw/zinc/14/30/66/516143066.db2.gz GBESQJBJMABEHI-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000470164356 516156817 /nfs/dbraw/zinc/15/68/17/516156817.db2.gz UGKTWDHUFSVFTD-CQSZACIVSA-N 1 1 354.410 2.890 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2ncc(F)cn2)CC1 ZINC000470209041 516172357 /nfs/dbraw/zinc/17/23/57/516172357.db2.gz WYRPOOAXNMNUBI-NTEUORMPSA-N 1 1 357.389 2.749 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1(CCO)CCOCC1 ZINC000495466151 516173393 /nfs/dbraw/zinc/17/33/93/516173393.db2.gz WWODENXAISTQLJ-UHFFFAOYSA-N 1 1 352.431 2.745 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000512165849 516180801 /nfs/dbraw/zinc/18/08/01/516180801.db2.gz REUCWANGEYQTGB-GFCCVEGCSA-N 1 1 359.213 2.848 20 5 FFBDMO Cc1cccc(NCCNc2ncc(Br)cc2[N+](=O)[O-])[nH+]1 ZINC000474773453 516190357 /nfs/dbraw/zinc/19/03/57/516190357.db2.gz GQBIVUWDSNESNY-UHFFFAOYSA-N 1 1 352.192 2.980 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000460811547 516254575 /nfs/dbraw/zinc/25/45/75/516254575.db2.gz HNHBLMJXKAHDIN-KRWDZBQOSA-N 1 1 357.410 2.565 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340097 516416813 /nfs/dbraw/zinc/41/68/13/516416813.db2.gz YKFRFJUBDVQKPX-OAHLLOKOSA-N 1 1 361.442 2.625 20 5 FFBDMO C[C@@H]1COc2ccccc2C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000543875431 516475137 /nfs/dbraw/zinc/47/51/37/516475137.db2.gz BBBMCBVNSIKDQP-RHSMWYFYSA-N 1 1 358.394 2.618 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCN(c3cc[nH+]cc3Br)C2)nc1 ZINC000561283189 516500482 /nfs/dbraw/zinc/50/04/82/516500482.db2.gz PINUQKKXMCAOFD-JTQLQIEISA-N 1 1 364.203 2.838 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000561382980 516552923 /nfs/dbraw/zinc/55/29/23/516552923.db2.gz UUNNAULHDPYWDZ-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1 ZINC000540476640 516573946 /nfs/dbraw/zinc/57/39/46/516573946.db2.gz BTKSHCGQLGXNFJ-KRWDZBQOSA-N 1 1 361.373 2.958 20 5 FFBDMO CCc1ccc([C@@H]2CCC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000513400945 516606343 /nfs/dbraw/zinc/60/63/43/516606343.db2.gz IGAWCINNALTFLK-MJGOQNOKSA-N 1 1 358.442 2.594 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000536076581 516620998 /nfs/dbraw/zinc/62/09/98/516620998.db2.gz HXMWJYWQNRKAFR-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000536076581 516621004 /nfs/dbraw/zinc/62/10/04/516621004.db2.gz HXMWJYWQNRKAFR-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000513467896 516636776 /nfs/dbraw/zinc/63/67/76/516636776.db2.gz ZGXQYJAAWMKDCM-GOSISDBHSA-N 1 1 355.442 2.664 20 5 FFBDMO Cn1cc(C[N@H+](C)[C@@H]2CCN(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513467896 516636786 /nfs/dbraw/zinc/63/67/86/516636786.db2.gz ZGXQYJAAWMKDCM-GOSISDBHSA-N 1 1 355.442 2.664 20 5 FFBDMO Cn1cc(C[N@@H+](C)[C@@H]2CCN(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513467896 516636793 /nfs/dbraw/zinc/63/67/93/516636793.db2.gz ZGXQYJAAWMKDCM-GOSISDBHSA-N 1 1 355.442 2.664 20 5 FFBDMO C[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000518457903 516667875 /nfs/dbraw/zinc/66/78/75/516667875.db2.gz VWEZYQUXUOYYQJ-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000518457903 516667884 /nfs/dbraw/zinc/66/78/84/516667884.db2.gz VWEZYQUXUOYYQJ-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000551583040 516772695 /nfs/dbraw/zinc/77/26/95/516772695.db2.gz JEKBYPQWYZFOPG-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000518786365 516773345 /nfs/dbraw/zinc/77/33/45/516773345.db2.gz YTYDEGSSGRPEOG-ZDUSSCGKSA-N 1 1 363.414 2.708 20 5 FFBDMO CCc1ccc([C@@H](CO)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000514076546 516852785 /nfs/dbraw/zinc/85/27/85/516852785.db2.gz ZWHWGFVBWWXOFQ-GOSISDBHSA-N 1 1 358.394 2.847 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000514098398 516861797 /nfs/dbraw/zinc/86/17/97/516861797.db2.gz GOWHRWNYJABYSY-SOLBZPMBSA-N 1 1 355.442 2.634 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212112 516905309 /nfs/dbraw/zinc/90/53/09/516905309.db2.gz BGRPBSFYODNNDO-NSHDSACASA-N 1 1 357.357 2.610 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000519560238 517046147 /nfs/dbraw/zinc/04/61/47/517046147.db2.gz OYSVUUIBHVAPJM-UHFFFAOYSA-N 1 1 370.409 2.783 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552056621 517055633 /nfs/dbraw/zinc/05/56/33/517055633.db2.gz LTXZPHLFZYBNHN-QGZVFWFLSA-N 1 1 370.453 2.950 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N(C)[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000525521509 517066834 /nfs/dbraw/zinc/06/68/34/517066834.db2.gz FNRGESWEXNJCAR-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2nnc(-c3ccco3)o2)cc1[N+](=O)[O-] ZINC000537176854 517069583 /nfs/dbraw/zinc/06/95/83/517069583.db2.gz APGBPMYXPKGKAD-NSHDSACASA-N 1 1 371.353 2.836 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000562399791 517081870 /nfs/dbraw/zinc/08/18/70/517081870.db2.gz JFHBXFGVTYQVRW-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO CCC[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000541741421 517194647 /nfs/dbraw/zinc/19/46/47/517194647.db2.gz SJYYBEGNDCAKNS-INIZCTEOSA-N 1 1 363.439 2.895 20 5 FFBDMO COc1ccc(CC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000532991009 517241431 /nfs/dbraw/zinc/24/14/31/517241431.db2.gz CVSQWZHDWXAWST-DOTOQJQBSA-N 1 1 373.453 2.621 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000533048146 517267211 /nfs/dbraw/zinc/26/72/11/517267211.db2.gz JSNRHVVWLGOUAT-ZDUSSCGKSA-N 1 1 363.414 2.564 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC000559563178 517317918 /nfs/dbraw/zinc/31/79/18/517317918.db2.gz DGWBXIPRBJQFTQ-VIFPVBQESA-N 1 1 370.247 2.878 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000548979761 517337670 /nfs/dbraw/zinc/33/76/70/517337670.db2.gz ZHCIBCYBDLGGHL-GOSISDBHSA-N 1 1 370.453 2.964 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000515524026 517392410 /nfs/dbraw/zinc/39/24/10/517392410.db2.gz UDRARHFPUDWUPH-OKILXGFUSA-N 1 1 369.487 2.550 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000515709235 517451848 /nfs/dbraw/zinc/45/18/48/517451848.db2.gz PCUQUOHUVRMTNS-UHFFFAOYSA-N 1 1 373.450 2.667 20 5 FFBDMO COc1ccc(CN2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556507487 517468121 /nfs/dbraw/zinc/46/81/21/517468121.db2.gz CBPCVXVVDWDYKI-SFHVURJKSA-N 1 1 355.438 2.962 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000556565022 517495506 /nfs/dbraw/zinc/49/55/06/517495506.db2.gz XSSYAYKWDJHIJV-WBVHZDCISA-N 1 1 360.458 2.826 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000527089999 517497787 /nfs/dbraw/zinc/49/77/87/517497787.db2.gz JLPDEUBJCPMLGG-IAGOWNOFSA-N 1 1 362.430 2.668 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3ccc(O)cc3C2)c([N+](=O)[O-])c1 ZINC000533531168 517508897 /nfs/dbraw/zinc/50/88/97/517508897.db2.gz QVZMQYNXRMNUOT-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000538262763 517527776 /nfs/dbraw/zinc/52/77/76/517527776.db2.gz HZWLVNFSFVNEPQ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000538262763 517527783 /nfs/dbraw/zinc/52/77/83/517527783.db2.gz HZWLVNFSFVNEPQ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]([NH2+]Cc1ccccc1)c1ccco1 ZINC000553214996 517581356 /nfs/dbraw/zinc/58/13/56/517581356.db2.gz RHZKZYUCZBKTKC-MRXNPFEDSA-N 1 1 368.393 2.787 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000516158267 517590862 /nfs/dbraw/zinc/59/08/62/517590862.db2.gz SEKFVQXAAWWZHE-KGLIPLIRSA-N 1 1 364.446 2.666 20 5 FFBDMO CC[N@@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000542505845 517598228 /nfs/dbraw/zinc/59/82/28/517598228.db2.gz NNUBIKUOTFOAPO-NSHDSACASA-N 1 1 357.252 2.769 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000542505845 517598236 /nfs/dbraw/zinc/59/82/36/517598236.db2.gz NNUBIKUOTFOAPO-NSHDSACASA-N 1 1 357.252 2.769 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553456 517615229 /nfs/dbraw/zinc/61/52/29/517615229.db2.gz BDTFBUOTBGYNOP-RHSMWYFYSA-N 1 1 351.447 2.527 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553456 517615239 /nfs/dbraw/zinc/61/52/39/517615239.db2.gz BDTFBUOTBGYNOP-RHSMWYFYSA-N 1 1 351.447 2.527 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000560250897 517659013 /nfs/dbraw/zinc/65/90/13/517659013.db2.gz QVAZZKHLMCOXIY-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000560250897 517659021 /nfs/dbraw/zinc/65/90/21/517659021.db2.gz QVAZZKHLMCOXIY-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCS(=O)(=O)C1 ZINC000538717268 517744476 /nfs/dbraw/zinc/74/44/76/517744476.db2.gz PBYAXDGEYXZDLW-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCS(=O)(=O)C1 ZINC000538717268 517744485 /nfs/dbraw/zinc/74/44/85/517744485.db2.gz PBYAXDGEYXZDLW-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CC1(C)C[N@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000534146217 517761494 /nfs/dbraw/zinc/76/14/94/517761494.db2.gz SPVBHOUTXWXVGA-UHFFFAOYSA-N 1 1 356.426 2.601 20 5 FFBDMO CC1(C)C[N@@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000534146217 517761499 /nfs/dbraw/zinc/76/14/99/517761499.db2.gz SPVBHOUTXWXVGA-UHFFFAOYSA-N 1 1 356.426 2.601 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538791498 517781395 /nfs/dbraw/zinc/78/13/95/517781395.db2.gz ADRPXEZOQUWHEJ-YJBOKZPZSA-N 1 1 356.426 2.996 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@H](C)O1 ZINC000534256503 517808505 /nfs/dbraw/zinc/80/85/05/517808505.db2.gz QMAXMXOQPOXZSI-OKILXGFUSA-N 1 1 374.441 2.695 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543031785 517874197 /nfs/dbraw/zinc/87/41/97/517874197.db2.gz CJPSCYYTJOKVFQ-NSHDSACASA-N 1 1 357.252 2.626 20 5 FFBDMO CC[N@@H+](CCC1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1)CC(C)C ZINC000539098924 517910690 /nfs/dbraw/zinc/91/06/90/517910690.db2.gz OUVCXTMQYAVMPC-UHFFFAOYSA-N 1 1 351.495 2.871 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1 ZINC000557198081 517915065 /nfs/dbraw/zinc/91/50/65/517915065.db2.gz ADQAWEUFBOJEEV-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)c1 ZINC000557198081 517915075 /nfs/dbraw/zinc/91/50/75/517915075.db2.gz ADQAWEUFBOJEEV-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000516950035 517934185 /nfs/dbraw/zinc/93/41/85/517934185.db2.gz UWCOKEMFHCNBRH-GOSISDBHSA-N 1 1 350.415 2.885 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1 ZINC000554113725 518065972 /nfs/dbraw/zinc/06/59/72/518065972.db2.gz UZBZMQFNSPGZBU-SUNYJGFJSA-N 1 1 361.442 2.796 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c21 ZINC000543435062 518088655 /nfs/dbraw/zinc/08/86/55/518088655.db2.gz CTVYKKKYZQINBC-XJKSGUPXSA-N 1 1 353.426 2.991 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000543437359 518090317 /nfs/dbraw/zinc/09/03/17/518090317.db2.gz UBVMRRDKWLVVFD-NWDGAFQWSA-N 1 1 369.263 2.981 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000522651381 518140577 /nfs/dbraw/zinc/14/05/77/518140577.db2.gz NTVBZYMPKQIEBO-ZIAGYGMSSA-N 1 1 367.833 2.760 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1C ZINC000531141304 518152836 /nfs/dbraw/zinc/15/28/36/518152836.db2.gz QCCGODROAOLRSH-ZFWWWQNUSA-N 1 1 359.430 2.949 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000584175258 518214977 /nfs/dbraw/zinc/21/49/77/518214977.db2.gz PRGFOCVRJYDGQU-HNNXBMFYSA-N 1 1 369.425 2.882 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](N2CCOCC2)C1 ZINC000567120313 518361169 /nfs/dbraw/zinc/36/11/69/518361169.db2.gz BJMGPUQZLKMVBQ-SFHVURJKSA-N 1 1 363.458 2.679 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](N2CCOCC2)C1 ZINC000567120313 518361174 /nfs/dbraw/zinc/36/11/74/518361174.db2.gz BJMGPUQZLKMVBQ-SFHVURJKSA-N 1 1 363.458 2.679 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([NH+]2CCOCC2)C1 ZINC000567120313 518361181 /nfs/dbraw/zinc/36/11/81/518361181.db2.gz BJMGPUQZLKMVBQ-SFHVURJKSA-N 1 1 363.458 2.679 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000584546734 518392530 /nfs/dbraw/zinc/39/25/30/518392530.db2.gz OHUNVSZCASWJQF-GFCCVEGCSA-N 1 1 355.822 2.570 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000570237833 518508972 /nfs/dbraw/zinc/50/89/72/518508972.db2.gz MPBKRKRRYPBSND-LLVKDONJSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000570237833 518508977 /nfs/dbraw/zinc/50/89/77/518508977.db2.gz MPBKRKRRYPBSND-LLVKDONJSA-N 1 1 370.247 2.832 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000567625036 518620222 /nfs/dbraw/zinc/62/02/22/518620222.db2.gz CKLLBHJYVLUOEE-FPMFFAJLSA-N 1 1 367.833 2.711 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000576514326 518628696 /nfs/dbraw/zinc/62/86/96/518628696.db2.gz MSNFDAPOXQLGRB-SNVBAGLBSA-N 1 1 358.236 2.816 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H]1CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483364 518702823 /nfs/dbraw/zinc/70/28/23/518702823.db2.gz MTSIFRQFFIEUEC-CABCVRRESA-N 1 1 361.364 2.899 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483364 518702831 /nfs/dbraw/zinc/70/28/31/518702831.db2.gz MTSIFRQFFIEUEC-CABCVRRESA-N 1 1 361.364 2.899 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000588034060 518706821 /nfs/dbraw/zinc/70/68/21/518706821.db2.gz AYYOVJUDPRNBJQ-CQSZACIVSA-N 1 1 365.430 2.603 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000576869841 518803211 /nfs/dbraw/zinc/80/32/11/518803211.db2.gz DHJVPQSZBYLZIZ-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)OC2(CCC2)C1 ZINC000579948489 518933712 /nfs/dbraw/zinc/93/37/12/518933712.db2.gz HMOPAJVLQCWSAF-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164130 518934969 /nfs/dbraw/zinc/93/49/69/518934969.db2.gz FHMNGIAGYHHVBK-APWZRJJASA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164130 518934978 /nfs/dbraw/zinc/93/49/78/518934978.db2.gz FHMNGIAGYHHVBK-APWZRJJASA-N 1 1 366.421 2.975 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589187594 518944191 /nfs/dbraw/zinc/94/41/91/518944191.db2.gz BCCPRWHRCSTQOU-UKRRQHHQSA-N 1 1 350.415 2.882 20 5 FFBDMO CC(C)(C)c1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000577271011 518999198 /nfs/dbraw/zinc/99/91/98/518999198.db2.gz MYNCIIAZDMWKCH-CQSZACIVSA-N 1 1 356.430 2.764 20 5 FFBDMO CC(C)(C)c1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000577271011 518999201 /nfs/dbraw/zinc/99/92/01/518999201.db2.gz MYNCIIAZDMWKCH-CQSZACIVSA-N 1 1 356.430 2.764 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])nc(C)n3CC)CC2)cc1 ZINC000571318753 519036797 /nfs/dbraw/zinc/03/67/97/519036797.db2.gz MTBMRGALDBQHGI-UHFFFAOYSA-N 1 1 373.457 2.841 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680772 519199611 /nfs/dbraw/zinc/19/96/11/519199611.db2.gz SVNIBFLAHZULNZ-CRAIPNDOSA-N 1 1 358.398 2.689 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680772 519199617 /nfs/dbraw/zinc/19/96/17/519199617.db2.gz SVNIBFLAHZULNZ-CRAIPNDOSA-N 1 1 358.398 2.689 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000590446473 519236013 /nfs/dbraw/zinc/23/60/13/519236013.db2.gz VOBVPFYNTLEUHX-ZWNOBZJWSA-N 1 1 355.847 2.503 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000566247892 519392658 /nfs/dbraw/zinc/39/26/58/519392658.db2.gz ZBEDWDRUEQGVQI-INIZCTEOSA-N 1 1 371.393 2.531 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc2ncccc2c1[N+](=O)[O-] ZINC000575036030 519463224 /nfs/dbraw/zinc/46/32/24/519463224.db2.gz NSOXNCOHNCMXMZ-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000581213263 519579284 /nfs/dbraw/zinc/57/92/84/519579284.db2.gz YBGNYAITGNVNLH-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cc([N+](=O)[O-])c1C ZINC000578435070 519591141 /nfs/dbraw/zinc/59/11/41/519591141.db2.gz KZDNBXVXJGEOIW-QGZVFWFLSA-N 1 1 373.384 2.838 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H](c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602857359 519929159 /nfs/dbraw/zinc/92/91/59/519929159.db2.gz VDZAVFXGAKNYMI-MRXNPFEDSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602857359 519929165 /nfs/dbraw/zinc/92/91/65/519929165.db2.gz VDZAVFXGAKNYMI-MRXNPFEDSA-N 1 1 354.410 2.832 20 5 FFBDMO CCn1nc(C)c(C[N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])c1C ZINC000602926440 519976870 /nfs/dbraw/zinc/97/68/70/519976870.db2.gz QVRMSVKWJMKBAT-UHFFFAOYSA-N 1 1 362.430 2.947 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600007466 519998494 /nfs/dbraw/zinc/99/84/94/519998494.db2.gz SRSUZFYUONTLAL-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO COc1cc(C[NH2+][C@H]2CCOc3c(OC)cccc32)c([N+](=O)[O-])cc1O ZINC000594524495 520014216 /nfs/dbraw/zinc/01/42/16/520014216.db2.gz ZBZCMYRQXLCCFJ-ZDUSSCGKSA-N 1 1 360.366 2.931 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCCF)CC1 ZINC000600076046 520032411 /nfs/dbraw/zinc/03/24/11/520032411.db2.gz JMXNQAIXCHFDSY-UHFFFAOYSA-N 1 1 355.435 2.824 20 5 FFBDMO O=C(NC1CC1)c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594604474 520051022 /nfs/dbraw/zinc/05/10/22/520051022.db2.gz ZORZQZBNOXUCOE-RDJZCZTQSA-N 1 1 358.442 2.916 20 5 FFBDMO CCn1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000616785234 520137757 /nfs/dbraw/zinc/13/77/57/520137757.db2.gz FGEAAHNNMUKECA-ZDUSSCGKSA-N 1 1 360.414 2.884 20 5 FFBDMO CCn1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000616785234 520137762 /nfs/dbraw/zinc/13/77/62/520137762.db2.gz FGEAAHNNMUKECA-ZDUSSCGKSA-N 1 1 360.414 2.884 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000600230076 520140280 /nfs/dbraw/zinc/14/02/80/520140280.db2.gz ZBWYDDPDQLPYNF-CQSZACIVSA-N 1 1 357.414 2.608 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594790572 520157616 /nfs/dbraw/zinc/15/76/16/520157616.db2.gz NHBWGDCKLUZWNV-CYBMUJFWSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000609029910 520180176 /nfs/dbraw/zinc/18/01/76/520180176.db2.gz KKRRTOYRUCXFOH-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000600298134 520189472 /nfs/dbraw/zinc/18/94/72/520189472.db2.gz GVNAZJSJWZYVMS-HNNXBMFYSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000600298134 520189482 /nfs/dbraw/zinc/18/94/82/520189482.db2.gz GVNAZJSJWZYVMS-HNNXBMFYSA-N 1 1 373.384 2.747 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000597710362 520190478 /nfs/dbraw/zinc/19/04/78/520190478.db2.gz LCZYVACZSIUOFI-IBGZPJMESA-N 1 1 361.442 2.940 20 5 FFBDMO COCCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595016761 520259143 /nfs/dbraw/zinc/25/91/43/520259143.db2.gz WOJGJVLCTUNKBG-ZDUSSCGKSA-N 1 1 361.398 2.874 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(N2CCOCC2)n1 ZINC000595031928 520263042 /nfs/dbraw/zinc/26/30/42/520263042.db2.gz FDZITLGCSCEIKV-AWEZNQCLSA-N 1 1 372.425 2.686 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCc3ccc(O)cc3CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000609449502 520315477 /nfs/dbraw/zinc/31/54/77/520315477.db2.gz YXVNFVUQBWPHTJ-IBGZPJMESA-N 1 1 367.405 2.507 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCc3ccc(O)cc3CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000609449502 520315483 /nfs/dbraw/zinc/31/54/83/520315483.db2.gz YXVNFVUQBWPHTJ-IBGZPJMESA-N 1 1 367.405 2.507 20 5 FFBDMO O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[NH+](C2CCC2)CC1 ZINC000609594536 520370777 /nfs/dbraw/zinc/37/07/77/520370777.db2.gz GNNKEUZHRVXLJS-UHFFFAOYSA-N 1 1 358.442 2.505 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cs1 ZINC000609620420 520382488 /nfs/dbraw/zinc/38/24/88/520382488.db2.gz KYVRDPDAGYDLPJ-GOSISDBHSA-N 1 1 361.467 2.773 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000609620420 520382494 /nfs/dbraw/zinc/38/24/94/520382494.db2.gz KYVRDPDAGYDLPJ-GOSISDBHSA-N 1 1 361.467 2.773 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493521 520416120 /nfs/dbraw/zinc/41/61/20/520416120.db2.gz UBORCMQXIKAKSB-HOTGVXAUSA-N 1 1 360.458 2.553 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000613295146 520432852 /nfs/dbraw/zinc/43/28/52/520432852.db2.gz SCCAKPVFZPNSEC-HNNXBMFYSA-N 1 1 362.430 2.540 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(CO[C@@H]2CC[NH2+]C2)CC1 ZINC000600762508 520455096 /nfs/dbraw/zinc/45/50/96/520455096.db2.gz CWWQJDGXXPSVLT-GOSISDBHSA-N 1 1 363.458 2.584 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2ccccn2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595500480 520509569 /nfs/dbraw/zinc/50/95/69/520509569.db2.gz JRBKZNZBPUPFFO-INIZCTEOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2ccccn2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595500480 520509575 /nfs/dbraw/zinc/50/95/75/520509575.db2.gz JRBKZNZBPUPFFO-INIZCTEOSA-N 1 1 366.421 2.759 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000604482637 520573904 /nfs/dbraw/zinc/57/39/04/520573904.db2.gz YDDDJHNUNFESSO-UHFFFAOYSA-N 1 1 363.414 2.660 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](CO)Cc1ccccc1 ZINC000595597590 520581461 /nfs/dbraw/zinc/58/14/61/520581461.db2.gz SIGRENMLAXDZOO-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](CO)Cc1ccccc1 ZINC000595597590 520581466 /nfs/dbraw/zinc/58/14/66/520581466.db2.gz SIGRENMLAXDZOO-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO O=C(C[N@@H+]1CCC2(C1)CCCCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610216119 520587130 /nfs/dbraw/zinc/58/71/30/520587130.db2.gz MPUKKIODAYCRCU-UHFFFAOYSA-N 1 1 361.398 2.918 20 5 FFBDMO O=C(C[N@H+]1CCC2(C1)CCCCC2)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000610216119 520587132 /nfs/dbraw/zinc/58/71/32/520587132.db2.gz MPUKKIODAYCRCU-UHFFFAOYSA-N 1 1 361.398 2.918 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000595636248 520613872 /nfs/dbraw/zinc/61/38/72/520613872.db2.gz QVJNINDUBRCWHA-FMSGJZPZSA-N 1 1 367.833 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000595636248 520613877 /nfs/dbraw/zinc/61/38/77/520613877.db2.gz QVJNINDUBRCWHA-FMSGJZPZSA-N 1 1 367.833 2.668 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000610310602 520631766 /nfs/dbraw/zinc/63/17/66/520631766.db2.gz KTIMYSWOZQLUBT-INIZCTEOSA-N 1 1 356.426 2.527 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc([N+](=O)[O-])c1 ZINC000592883467 520635042 /nfs/dbraw/zinc/63/50/42/520635042.db2.gz ZTGORKQEKPPAPT-MJGOQNOKSA-N 1 1 353.422 2.978 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000598508526 520666955 /nfs/dbraw/zinc/66/69/55/520666955.db2.gz CILYIJMVGXPTMZ-CQSZACIVSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000598508526 520666959 /nfs/dbraw/zinc/66/69/59/520666959.db2.gz CILYIJMVGXPTMZ-CQSZACIVSA-N 1 1 373.384 2.747 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCOC[C@@H]3[C@H]3CCCC[C@H]3O)c2c1 ZINC000601164261 520669061 /nfs/dbraw/zinc/66/90/61/520669061.db2.gz RFBXFYJKRIJVOT-NIKGAXFTSA-N 1 1 357.410 2.899 20 5 FFBDMO CNc1c(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511936 520671667 /nfs/dbraw/zinc/67/16/67/520671667.db2.gz VCJKIROMJQEUEC-OAHLLOKOSA-N 1 1 354.410 2.641 20 5 FFBDMO CNc1c(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511936 520671674 /nfs/dbraw/zinc/67/16/74/520671674.db2.gz VCJKIROMJQEUEC-OAHLLOKOSA-N 1 1 354.410 2.641 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)c1 ZINC000593019725 520688059 /nfs/dbraw/zinc/68/80/59/520688059.db2.gz JLQFILSUOJIJGM-LLVKDONJSA-N 1 1 358.350 2.961 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595788324 520725965 /nfs/dbraw/zinc/72/59/65/520725965.db2.gz JCKGWSIWZNQEEC-QAPCUYQASA-N 1 1 361.442 2.839 20 5 FFBDMO Cn1ncc(Br)c1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000601291610 520727265 /nfs/dbraw/zinc/72/72/65/520727265.db2.gz HEGXNZYFVOVYTI-GFCCVEGCSA-N 1 1 351.204 2.868 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000598610160 520740219 /nfs/dbraw/zinc/74/02/19/520740219.db2.gz DZPRIRXFFFXPDS-STQMWFEESA-N 1 1 362.430 2.841 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000598614584 520744681 /nfs/dbraw/zinc/74/46/81/520744681.db2.gz LTOAOYBEIWCOPI-CZUORRHYSA-N 1 1 370.409 2.709 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900785 520808602 /nfs/dbraw/zinc/80/86/02/520808602.db2.gz LFQWOIBPDUZOLK-GDBMZVCRSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000593188463 520813381 /nfs/dbraw/zinc/81/33/81/520813381.db2.gz IAVSDAZCYPKBCI-HBNTYKKESA-N 1 1 370.247 2.910 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2nc3ccccc3s2)CC1 ZINC000610782911 520841965 /nfs/dbraw/zinc/84/19/65/520841965.db2.gz ZUKBJEUONFIDEY-UHFFFAOYSA-N 1 1 372.454 2.532 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](CC)C2CCCCC2)n1 ZINC000593250466 520857155 /nfs/dbraw/zinc/85/71/55/520857155.db2.gz NZAWRTBPTOZTJP-UHFFFAOYSA-N 1 1 351.451 2.586 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)c1 ZINC000593323949 520910892 /nfs/dbraw/zinc/91/08/92/520910892.db2.gz UJBZSLXPBTWVQZ-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)c1 ZINC000593323949 520910899 /nfs/dbraw/zinc/91/08/99/520910899.db2.gz UJBZSLXPBTWVQZ-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)c1 ZINC000593324019 520911829 /nfs/dbraw/zinc/91/18/29/520911829.db2.gz VRCOHTKTARGFRT-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)c1 ZINC000593324019 520911832 /nfs/dbraw/zinc/91/18/32/520911832.db2.gz VRCOHTKTARGFRT-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596150990 520940611 /nfs/dbraw/zinc/94/06/11/520940611.db2.gz GWDIBOVKSOTSEH-MNOVXSKESA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596236440 520988288 /nfs/dbraw/zinc/98/82/88/520988288.db2.gz VVAVVEVENPRDAN-DYVFJYSZSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000596256891 520998013 /nfs/dbraw/zinc/99/80/13/520998013.db2.gz IDIGMUUTCXQDBQ-HNNXBMFYSA-N 1 1 368.437 2.652 20 5 FFBDMO CC[C@@H](C)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)CC1 ZINC000596259215 520998218 /nfs/dbraw/zinc/99/82/18/520998218.db2.gz UWDLONQMLPKVTP-LLVKDONJSA-N 1 1 355.822 2.955 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599072942 521015852 /nfs/dbraw/zinc/01/58/52/521015852.db2.gz LVRIDENDNMQZDI-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(C[NH+]1CCC2(CCOC2)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000611177600 521026596 /nfs/dbraw/zinc/02/65/96/521026596.db2.gz IITXJGCSNUXOTB-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO C[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593503941 521036838 /nfs/dbraw/zinc/03/68/38/521036838.db2.gz NFHFQXMXXQTCEP-AWEZNQCLSA-N 1 1 357.439 2.667 20 5 FFBDMO COc1cc(Cc2noc([C@H]3CCn4cc(C)[nH+]c4C3)n2)ccc1[N+](=O)[O-] ZINC000599144828 521053263 /nfs/dbraw/zinc/05/32/63/521053263.db2.gz UANHGRJOTUITQY-ZDUSSCGKSA-N 1 1 369.381 2.812 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000611253101 521060271 /nfs/dbraw/zinc/06/02/71/521060271.db2.gz YSVLSVGPKUEQLI-UHFFFAOYSA-N 1 1 374.393 2.885 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000611253101 521060277 /nfs/dbraw/zinc/06/02/77/521060277.db2.gz YSVLSVGPKUEQLI-UHFFFAOYSA-N 1 1 374.393 2.885 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1CC1 ZINC000611265168 521065603 /nfs/dbraw/zinc/06/56/03/521065603.db2.gz GCIXUCUFGLOMNS-UHFFFAOYSA-N 1 1 364.398 2.531 20 5 FFBDMO O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(Cl)c1 ZINC000596514957 521108298 /nfs/dbraw/zinc/10/82/98/521108298.db2.gz PPFBLQDXSRPZTK-ZIAGYGMSSA-N 1 1 352.822 2.699 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])c(OC)c1 ZINC000611561543 521221744 /nfs/dbraw/zinc/22/17/44/521221744.db2.gz DQAULHGSPNPNJU-MRXNPFEDSA-N 1 1 360.414 2.954 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)C1(F)F ZINC000599512318 521268588 /nfs/dbraw/zinc/26/85/88/521268588.db2.gz ICTZAWRPYWBJCV-TXEJJXNPSA-N 1 1 353.369 2.707 20 5 FFBDMO C[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)C1(F)F ZINC000599512318 521268605 /nfs/dbraw/zinc/26/86/05/521268605.db2.gz ICTZAWRPYWBJCV-TXEJJXNPSA-N 1 1 353.369 2.707 20 5 FFBDMO CC1(C)CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1CCO ZINC000615140411 521290191 /nfs/dbraw/zinc/29/01/91/521290191.db2.gz AHHPZJFTGGXMIH-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1CCO ZINC000615140411 521290199 /nfs/dbraw/zinc/29/01/99/521290199.db2.gz AHHPZJFTGGXMIH-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCN1CCO ZINC000615140411 521290203 /nfs/dbraw/zinc/29/02/03/521290203.db2.gz AHHPZJFTGGXMIH-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599576166 521308082 /nfs/dbraw/zinc/30/80/82/521308082.db2.gz KFDHMAMJDJGIBN-UWVGGRQHSA-N 1 1 356.220 2.570 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596843789 521327977 /nfs/dbraw/zinc/32/79/77/521327977.db2.gz VDINXCXHIMAJGV-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000599659914 521372038 /nfs/dbraw/zinc/37/20/38/521372038.db2.gz LSMQKTVMFWJUDU-NXEZZACHSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCCC2)O1 ZINC000594058294 521378018 /nfs/dbraw/zinc/37/80/18/521378018.db2.gz RLHPVRQWPFRBJT-DOTOQJQBSA-N 1 1 364.442 2.758 20 5 FFBDMO COC[C@H](C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCc2ccccc21 ZINC000599682862 521398177 /nfs/dbraw/zinc/39/81/77/521398177.db2.gz MHUKSMGVPWCPIY-KXBFYZLASA-N 1 1 371.437 2.781 20 5 FFBDMO CCCCN1CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602536272 521400966 /nfs/dbraw/zinc/40/09/66/521400966.db2.gz SRHARUZKKCTGEI-UHFFFAOYSA-N 1 1 361.490 2.813 20 5 FFBDMO O=C(C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)NC1CCCC1 ZINC000602538878 521401036 /nfs/dbraw/zinc/40/10/36/521401036.db2.gz ZNBFYEDAQBJLBQ-UHFFFAOYSA-N 1 1 362.249 2.567 20 5 FFBDMO CC(C)N1C[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1=O ZINC000602555566 521410473 /nfs/dbraw/zinc/41/04/73/521410473.db2.gz RIINWLYSGNDEKD-MRVPVSSYSA-N 1 1 362.249 2.518 20 5 FFBDMO COc1ccccc1COC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC000602597632 521431005 /nfs/dbraw/zinc/43/10/05/521431005.db2.gz WGFPYJORQKLZCP-UHFFFAOYSA-N 1 1 360.414 2.518 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594198647 521465523 /nfs/dbraw/zinc/46/55/23/521465523.db2.gz UGOKFLHPTHOFOL-HOTGVXAUSA-N 1 1 353.369 2.549 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594204009 521470194 /nfs/dbraw/zinc/47/01/94/521470194.db2.gz WJHNFRMIFVCGLA-WMZOPIPTSA-N 1 1 356.426 2.683 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2CC(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000602727968 521500614 /nfs/dbraw/zinc/50/06/14/521500614.db2.gz GONURIMYLXXIDK-UHFFFAOYSA-N 1 1 356.378 2.746 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC000597095660 521500805 /nfs/dbraw/zinc/50/08/05/521500805.db2.gz ZMGKERNUXWGRMH-QWRGUYRKSA-N 1 1 353.810 2.579 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC000597095661 521501187 /nfs/dbraw/zinc/50/11/87/521501187.db2.gz ZMGKERNUXWGRMH-WDEREUQCSA-N 1 1 353.810 2.579 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597101647 521508030 /nfs/dbraw/zinc/50/80/30/521508030.db2.gz KPKYGCYOUPLVDA-UHFFFAOYSA-N 1 1 366.809 2.937 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@H](O)C(F)(F)F ZINC000602743124 521510097 /nfs/dbraw/zinc/51/00/97/521510097.db2.gz IFEMVZLJLVNWKI-FBCQKBJTSA-N 1 1 363.155 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(O[C@H]4CCOC4)cc3)nc2c1 ZINC000597114913 521516769 /nfs/dbraw/zinc/51/67/69/521516769.db2.gz CNKHILDMIJGEQZ-INIZCTEOSA-N 1 1 368.393 2.929 20 5 FFBDMO COc1ccccc1C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000602763455 521520159 /nfs/dbraw/zinc/52/01/59/521520159.db2.gz ONLQCZTYMZEGIZ-KRWDZBQOSA-N 1 1 374.441 2.790 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000602783317 521529829 /nfs/dbraw/zinc/52/98/29/521529829.db2.gz OJYWCKPVCVCCKK-YYUOZPCZSA-N 1 1 350.444 2.530 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000602797719 521537645 /nfs/dbraw/zinc/53/76/45/521537645.db2.gz LDBCPJZNZDZKCI-UHFFFAOYSA-N 1 1 370.409 2.660 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825407 521554967 /nfs/dbraw/zinc/55/49/67/521554967.db2.gz SLOQMIALZQBOAL-QGZVFWFLSA-N 1 1 357.458 2.719 20 5 FFBDMO O=C(N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccc([N+](=O)[O-])[nH]1 ZINC000612285761 521561289 /nfs/dbraw/zinc/56/12/89/521561289.db2.gz DKJIIUWXJVTFSL-GVDBMIGSSA-N 1 1 368.437 2.953 20 5 FFBDMO CO[C@@]1(CO)CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597188812 521565198 /nfs/dbraw/zinc/56/51/98/521565198.db2.gz WUGDOAMAIINZMK-KRWDZBQOSA-N 1 1 363.439 2.692 20 5 FFBDMO CO[C@@]1(CO)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597188812 521565205 /nfs/dbraw/zinc/56/52/05/521565205.db2.gz WUGDOAMAIINZMK-KRWDZBQOSA-N 1 1 363.439 2.692 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCC([N@H+]4CC[C@@H](O)C4)CC3)o2)cc1 ZINC000597234451 521588743 /nfs/dbraw/zinc/58/87/43/521588743.db2.gz AERYGFQZENEDDZ-GOSISDBHSA-N 1 1 371.437 2.886 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](CC(N)=O)c1ccccc1 ZINC000619515866 521604715 /nfs/dbraw/zinc/60/47/15/521604715.db2.gz XEOREABVEBVZFC-SFHVURJKSA-N 1 1 357.410 2.912 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000619527047 521753213 /nfs/dbraw/zinc/75/32/13/521753213.db2.gz FUPHZHHPJJXARY-MRXNPFEDSA-N 1 1 374.416 2.741 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820092468 607467435 /nfs/dbraw/zinc/46/74/35/607467435.db2.gz MILPFZYPUVMGCH-CYBMUJFWSA-N 1 1 359.434 2.555 20 5 FFBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(-c3nn[nH]n3)cc2F)cc1[N+](=O)[O-] ZINC000826202138 609331253 /nfs/dbraw/zinc/33/12/53/609331253.db2.gz PJCFTLFAFUODSY-JTQLQIEISA-N 1 1 372.360 2.773 20 5 FFBDMO COc1cc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)ncc1[N+](=O)[O-] ZINC001164857952 720951926 /nfs/dbraw/zinc/95/19/26/720951926.db2.gz ILMOAZKBUHHEAR-ZDUSSCGKSA-N 1 1 374.445 2.616 20 5 FFBDMO COc1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)c([N+](=O)[O-])c1 ZINC001164862605 720956876 /nfs/dbraw/zinc/95/68/76/720956876.db2.gz WQYINMMQNQDMNK-CYBMUJFWSA-N 1 1 374.445 2.616 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nc(Cl)nc1N1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001164773597 721283869 /nfs/dbraw/zinc/28/38/69/721283869.db2.gz SASXYTUDHHCOAQ-UHFFFAOYSA-N 1 1 358.229 2.614 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164783323 721391390 /nfs/dbraw/zinc/39/13/90/721391390.db2.gz HJYXPIBKKLFFBN-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO Cc1c(C)c(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001164788843 721414333 /nfs/dbraw/zinc/41/43/33/721414333.db2.gz SDKVCAFDUTUPQX-ZIAGYGMSSA-N 1 1 359.455 2.631 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746662693 735502583 /nfs/dbraw/zinc/50/25/83/735502583.db2.gz GCTGOXKVZJOOGE-QWHCGFSZSA-N 1 1 369.849 2.611 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000113937405 728558404 /nfs/dbraw/zinc/55/84/04/728558404.db2.gz BVPBTALOLFVMPN-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000113937405 728558406 /nfs/dbraw/zinc/55/84/06/728558406.db2.gz BVPBTALOLFVMPN-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCNC(=O)OC(C)(C)C ZINC000125218478 728680615 /nfs/dbraw/zinc/68/06/15/728680615.db2.gz LWTACOJUXBTEIP-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000127269559 728705881 /nfs/dbraw/zinc/70/58/81/728705881.db2.gz YHUALRLNKFAUBD-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000127269559 728705882 /nfs/dbraw/zinc/70/58/82/728705882.db2.gz YHUALRLNKFAUBD-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO CC(C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCOCC1 ZINC000129091800 728710328 /nfs/dbraw/zinc/71/03/28/728710328.db2.gz JWGFELKEVIDNGP-UHFFFAOYSA-N 1 1 353.394 2.952 20 5 FFBDMO CC1(C)CC[C@H](CO)[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000856803394 730358940 /nfs/dbraw/zinc/35/89/40/730358940.db2.gz DUXZOUFEEKFPCU-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)CC[C@H](CO)[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000856803394 730358941 /nfs/dbraw/zinc/35/89/41/730358941.db2.gz DUXZOUFEEKFPCU-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000861349814 730603034 /nfs/dbraw/zinc/60/30/34/730603034.db2.gz VUJIKWNTCMTFHF-BZNIZROVSA-N 1 1 354.428 2.583 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000861374631 730606146 /nfs/dbraw/zinc/60/61/46/730606146.db2.gz VBVICJIYEDHHAE-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000925139034 738481280 /nfs/dbraw/zinc/48/12/80/738481280.db2.gz JDIPKXYXUQBFHD-DZGCQCFKSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@@H]1[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCS1(=O)=O ZINC000862511781 730705897 /nfs/dbraw/zinc/70/58/97/730705897.db2.gz AXRVBHKLJHRVPI-RDDDGLTNSA-N 1 1 353.227 2.567 20 5 FFBDMO CC(C)(CC[NH+]1CCOCC1)NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000912948325 737361948 /nfs/dbraw/zinc/36/19/48/737361948.db2.gz NJEVQAFDSZJFME-UHFFFAOYSA-N 1 1 373.812 2.618 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000863937743 730816764 /nfs/dbraw/zinc/81/67/64/730816764.db2.gz HEICLJCNJRFXQY-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1nn(C)cc1Br ZINC000866366699 731052276 /nfs/dbraw/zinc/05/22/76/731052276.db2.gz ADENCIKNEPKPLP-SECBINFHSA-N 1 1 371.210 2.951 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])CCC(F)(F)F ZINC000867787673 731226094 /nfs/dbraw/zinc/22/60/94/731226094.db2.gz PODGXJXWUUSBLM-UHFFFAOYSA-N 1 1 365.327 2.667 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)N1CCN(C)CC1 ZINC000872033407 731722619 /nfs/dbraw/zinc/72/26/19/731722619.db2.gz GRCLEUJSUHOTJM-UONOGXRCSA-N 1 1 352.504 2.603 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000874828666 732104447 /nfs/dbraw/zinc/10/44/47/732104447.db2.gz YDWCAOHAGXAPES-KBPBESRZSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878341256 732516759 /nfs/dbraw/zinc/51/67/59/732516759.db2.gz ZTTRZKVXQWPQBK-WDEREUQCSA-N 1 1 365.821 2.823 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928081580 738817839 /nfs/dbraw/zinc/81/78/39/738817839.db2.gz PJZUASSJQXAGGM-DZGCQCFKSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928081580 738817844 /nfs/dbraw/zinc/81/78/44/738817844.db2.gz PJZUASSJQXAGGM-DZGCQCFKSA-N 1 1 369.874 2.866 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH+]1CCC2(CC1)COCCO2 ZINC000895696118 735041491 /nfs/dbraw/zinc/04/14/91/735041491.db2.gz PSXKZKJCTZJBPC-UHFFFAOYSA-N 1 1 371.231 2.739 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCOCC2)c(OC(F)F)c1 ZINC000896522029 735172362 /nfs/dbraw/zinc/17/23/62/735172362.db2.gz MYESOGNDOLVHAK-CYBMUJFWSA-N 1 1 357.357 2.861 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@H](C4OCCO4)C3)c2c1 ZINC000905693057 736383507 /nfs/dbraw/zinc/38/35/07/736383507.db2.gz GXTOUYDSQAYORW-SNVBAGLBSA-N 1 1 351.384 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H](C4OCCO4)C3)c2c1 ZINC000905693057 736383512 /nfs/dbraw/zinc/38/35/12/736383512.db2.gz GXTOUYDSQAYORW-SNVBAGLBSA-N 1 1 351.384 2.524 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757729258 736423003 /nfs/dbraw/zinc/42/30/03/736423003.db2.gz LGXORFYFHCAQOI-ZUZCIYMTSA-N 1 1 352.822 2.530 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000906791356 736543923 /nfs/dbraw/zinc/54/39/23/736543923.db2.gz LCGAMOLJBKMBBK-MFKMUULPSA-N 1 1 354.838 2.633 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767123179 737293987 /nfs/dbraw/zinc/29/39/87/737293987.db2.gz MAWPLDFPRFAPBU-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767123179 737293991 /nfs/dbraw/zinc/29/39/91/737293991.db2.gz MAWPLDFPRFAPBU-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767124203 737294690 /nfs/dbraw/zinc/29/46/90/737294690.db2.gz XROIDMXJSJUGTM-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767124203 737294693 /nfs/dbraw/zinc/29/46/93/737294693.db2.gz XROIDMXJSJUGTM-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000770103069 737596775 /nfs/dbraw/zinc/59/67/75/737596775.db2.gz NIMJNCWYFVNSSY-CQSZACIVSA-N 1 1 352.866 2.773 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCS[C@H]4COCC[C@@H]43)c2)c1 ZINC000777963197 738335696 /nfs/dbraw/zinc/33/56/96/738335696.db2.gz IDFGLOMOXRFWEV-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCS[C@H]4COCC[C@@H]43)c2)c1 ZINC000777963197 738335699 /nfs/dbraw/zinc/33/56/99/738335699.db2.gz IDFGLOMOXRFWEV-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)C[C@H]1C ZINC000778009117 738342004 /nfs/dbraw/zinc/34/20/04/738342004.db2.gz KTLWDFOOYKDJJA-CHWSQXEVSA-N 1 1 373.450 2.536 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C[C@@H]1C ZINC000778287211 738369661 /nfs/dbraw/zinc/36/96/61/738369661.db2.gz IGQJZEXAKMGWCH-CMPLNLGQSA-N 1 1 363.443 2.544 20 5 FFBDMO C[C@@H](CO)[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788466197 739247699 /nfs/dbraw/zinc/24/76/99/739247699.db2.gz GRPIKIHOEXFZBD-NSHDSACASA-N 1 1 355.822 2.812 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)s1 ZINC000932663227 739487333 /nfs/dbraw/zinc/48/73/33/739487333.db2.gz HCDVOLYZCZMNCJ-JTQLQIEISA-N 1 1 353.425 2.889 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)s1 ZINC000932663227 739487335 /nfs/dbraw/zinc/48/73/35/739487335.db2.gz HCDVOLYZCZMNCJ-JTQLQIEISA-N 1 1 353.425 2.889 20 5 FFBDMO Cc1sc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000791685963 739592860 /nfs/dbraw/zinc/59/28/60/739592860.db2.gz BGYXHASSZPGLCZ-UHFFFAOYSA-N 1 1 355.460 2.538 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cn1 ZINC000933979817 739714572 /nfs/dbraw/zinc/71/45/72/739714572.db2.gz AOQJCLRZWHEPEI-QGZVFWFLSA-N 1 1 362.455 2.887 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCSC[C@H]1C ZINC000934301264 739763126 /nfs/dbraw/zinc/76/31/26/739763126.db2.gz SMROUBHAYLGOKF-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](Cc3nccs3)C2)c1 ZINC000934333678 739767214 /nfs/dbraw/zinc/76/72/14/739767214.db2.gz YTFLHVPVWUFNSL-GFCCVEGCSA-N 1 1 361.423 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@](O)(C(F)(F)F)CC3)c2c1 ZINC000795721287 740056629 /nfs/dbraw/zinc/05/66/29/740056629.db2.gz YSQXDGZKEPTRKV-AWEZNQCLSA-N 1 1 358.320 2.681 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@](O)(C(F)(F)F)CC3)c2c1 ZINC000795721287 740056632 /nfs/dbraw/zinc/05/66/32/740056632.db2.gz YSQXDGZKEPTRKV-AWEZNQCLSA-N 1 1 358.320 2.681 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CC(=O)Nc4ccc(Cl)c([N+](=O)[O-])c4)[C@H]1[C@H]3C2 ZINC000796329966 740132609 /nfs/dbraw/zinc/13/26/09/740132609.db2.gz LZWSRCLTKOGOGW-YOCWQBDXSA-N 1 1 365.817 2.542 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1C[N@@H+](C(C)C)CCO1 ZINC000802131522 740675461 /nfs/dbraw/zinc/67/54/61/740675461.db2.gz DUSFVDOOCAYODU-AWEZNQCLSA-N 1 1 368.455 2.973 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1C[N@H+](C(C)C)CCO1 ZINC000802131522 740675465 /nfs/dbraw/zinc/67/54/65/740675465.db2.gz DUSFVDOOCAYODU-AWEZNQCLSA-N 1 1 368.455 2.973 20 5 FFBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000802140870 740677728 /nfs/dbraw/zinc/67/77/28/740677728.db2.gz MOCWKRXMIYATQV-HIFRSBDPSA-N 1 1 368.455 2.728 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)C1 ZINC000809916386 741360481 /nfs/dbraw/zinc/36/04/81/741360481.db2.gz IOSYEIQHKOGWNX-LBPRGKRZSA-N 1 1 370.837 2.727 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CCCS(=O)(=O)C1 ZINC000811481667 741528211 /nfs/dbraw/zinc/52/82/11/741528211.db2.gz IXSOSZYFNDAOBO-JTQLQIEISA-N 1 1 353.227 2.568 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811502537 741530587 /nfs/dbraw/zinc/53/05/87/741530587.db2.gz XEJRNFMNUDHIIQ-SFHVURJKSA-N 1 1 351.422 2.808 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1c(F)cc(F)cc1F ZINC000819332646 742375902 /nfs/dbraw/zinc/37/59/02/742375902.db2.gz AMSGMGFYPDYENF-NSHDSACASA-N 1 1 356.300 2.542 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]CCc2ccccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034644395 742928318 /nfs/dbraw/zinc/92/83/18/742928318.db2.gz GAUQGJUBISHJMS-KCYZZUKISA-N 1 1 365.861 2.565 20 5 FFBDMO C[N@H+]1CC[C@@H](CC(=O)N[C@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)C1 ZINC000823593501 742942238 /nfs/dbraw/zinc/94/22/38/742942238.db2.gz AJJUJGDKKLMHSZ-LKFCYVNXSA-N 1 1 363.311 2.795 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCCC[N@H+]1CCO ZINC000824583199 743111266 /nfs/dbraw/zinc/11/12/66/743111266.db2.gz JHYDRLALDSZZLS-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCCC[N@@H+]1CCO ZINC000824583199 743111270 /nfs/dbraw/zinc/11/12/70/743111270.db2.gz JHYDRLALDSZZLS-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827286680 743548690 /nfs/dbraw/zinc/54/86/90/743548690.db2.gz HXMGZOPXZXTHMY-AAEUAGOBSA-N 1 1 369.874 2.893 20 5 FFBDMO CN(C)C(=O)O[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000830573798 745384283 /nfs/dbraw/zinc/38/42/83/745384283.db2.gz CDDCUHHYAUZDST-MRXNPFEDSA-N 1 1 351.403 2.526 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831965287 745612546 /nfs/dbraw/zinc/61/25/46/745612546.db2.gz VVXJTVPGFIZFJV-CYBMUJFWSA-N 1 1 354.838 2.603 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000839502884 746842017 /nfs/dbraw/zinc/84/20/17/746842017.db2.gz IEDPIEAYSRRDAM-TZMCWYRMSA-N 1 1 368.865 2.991 20 5 FFBDMO C[C@H](CO)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CCCC1 ZINC000839575266 746860129 /nfs/dbraw/zinc/86/01/29/746860129.db2.gz SWGNBHDGDIQLCZ-LLVKDONJSA-N 1 1 355.822 2.812 20 5 FFBDMO CCC[N@@H+](C)CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000839864101 746946460 /nfs/dbraw/zinc/94/64/60/746946460.db2.gz NLEDZLRIGWQMMX-CYBMUJFWSA-N 1 1 351.300 2.795 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCS(=O)(=O)C3CC3)o2)cc1 ZINC000840965225 747245247 /nfs/dbraw/zinc/24/52/47/747245247.db2.gz ZTYDJQRLIFBXEQ-UHFFFAOYSA-N 1 1 350.396 2.522 20 5 FFBDMO COc1cc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000848755106 749001075 /nfs/dbraw/zinc/00/10/75/749001075.db2.gz XRXDFSLGGHVIRS-RWMBFGLXSA-N 1 1 353.419 2.522 20 5 FFBDMO COc1cc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000848755106 749001081 /nfs/dbraw/zinc/00/10/81/749001081.db2.gz XRXDFSLGGHVIRS-RWMBFGLXSA-N 1 1 353.419 2.522 20 5 FFBDMO COC(=O)N(C)CC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000850390260 749357261 /nfs/dbraw/zinc/35/72/61/749357261.db2.gz SIGXFIHJLNIOAX-UHFFFAOYSA-N 1 1 350.400 2.506 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422562 749856600 /nfs/dbraw/zinc/85/66/00/749856600.db2.gz FLELHZMGHJSVSH-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422562 749856605 /nfs/dbraw/zinc/85/66/05/749856605.db2.gz FLELHZMGHJSVSH-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1c[nH+]cc1CCOc1cc([N+](=O)[O-])ccc1I ZINC000853690798 750136636 /nfs/dbraw/zinc/13/66/36/750136636.db2.gz RDUXPDBHBDFNLH-UHFFFAOYSA-N 1 1 373.150 2.554 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000896472142 971500479 /nfs/dbraw/zinc/50/04/79/971500479.db2.gz JRZXDDYRHTYNON-UKRRQHHQSA-N 1 1 372.425 2.626 20 5 FFBDMO C[N@H+]1CC[C@H](C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000896694348 971671059 /nfs/dbraw/zinc/67/10/59/971671059.db2.gz XOIOMMHAPIOTTM-HKUYNNGSSA-N 1 1 353.422 2.947 20 5 FFBDMO COc1nc(SC)nc(NCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC001167751654 971706691 /nfs/dbraw/zinc/70/66/91/971706691.db2.gz NATYYNDMBGEQEU-LLVKDONJSA-N 1 1 355.464 2.792 20 5 FFBDMO CN(C(=O)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000134896498 960100243 /nfs/dbraw/zinc/10/02/43/960100243.db2.gz WNZXZSBSQSZGGJ-DNVCBOLYSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134940052 960548358 /nfs/dbraw/zinc/54/83/58/960548358.db2.gz FTDYDGGAQKIUSB-YJBOKZPZSA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001174716780 1013287097 /nfs/dbraw/zinc/28/70/97/1013287097.db2.gz TVDKTCKFFUTPPQ-QLJPJBMISA-N 1 1 366.805 2.749 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001174716780 1013287103 /nfs/dbraw/zinc/28/71/03/1013287103.db2.gz TVDKTCKFFUTPPQ-QLJPJBMISA-N 1 1 366.805 2.749 20 5 FFBDMO COC[C@@]1(C(=O)OC(C)(C)C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001175240211 1013422363 /nfs/dbraw/zinc/42/23/63/1013422363.db2.gz YCGZFJMTQHRSHA-GOSISDBHSA-N 1 1 368.405 2.914 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC001175301196 1013425643 /nfs/dbraw/zinc/42/56/43/1013425643.db2.gz OPFHZCMQWUROTE-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC001175301196 1013425653 /nfs/dbraw/zinc/42/56/53/1013425653.db2.gz OPFHZCMQWUROTE-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO CC(C)C[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252137 963758792 /nfs/dbraw/zinc/75/87/92/963758792.db2.gz QXVZARVRTAPKRO-HNNXBMFYSA-N 1 1 366.437 2.725 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252137 963758804 /nfs/dbraw/zinc/75/88/04/963758804.db2.gz QXVZARVRTAPKRO-HNNXBMFYSA-N 1 1 366.437 2.725 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252137 963758811 /nfs/dbraw/zinc/75/88/11/963758811.db2.gz QXVZARVRTAPKRO-HNNXBMFYSA-N 1 1 366.437 2.725 20 5 FFBDMO CC(C)C[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252138 963759471 /nfs/dbraw/zinc/75/94/71/963759471.db2.gz QXVZARVRTAPKRO-OAHLLOKOSA-N 1 1 366.437 2.725 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252138 963759473 /nfs/dbraw/zinc/75/94/73/963759473.db2.gz QXVZARVRTAPKRO-OAHLLOKOSA-N 1 1 366.437 2.725 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000933252138 963759475 /nfs/dbraw/zinc/75/94/75/963759475.db2.gz QXVZARVRTAPKRO-OAHLLOKOSA-N 1 1 366.437 2.725 20 5 FFBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccsc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022063881 964189369 /nfs/dbraw/zinc/18/93/69/964189369.db2.gz NQOMJCYTTZDBIS-XMTFNYHQSA-N 1 1 371.462 2.817 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(NC[C@@H](c2ccco2)[NH+](C)C)c2ccccc21 ZINC000891485819 964375713 /nfs/dbraw/zinc/37/57/13/964375713.db2.gz VCVBNXUUYFADFQ-AWEZNQCLSA-N 1 1 356.382 2.755 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCN1C(=O)OC(C)(C)C ZINC000933468065 964424598 /nfs/dbraw/zinc/42/45/98/964424598.db2.gz QBKRQZHXFJPANS-HZPDHXFCSA-N 1 1 365.430 2.569 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2cnn(C)c2)C1 ZINC000875054485 1013959166 /nfs/dbraw/zinc/95/91/66/1013959166.db2.gz UNRULVSPQBWPSS-QZTJIDSGSA-N 1 1 371.441 2.781 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897067207 973217426 /nfs/dbraw/zinc/21/74/26/973217426.db2.gz HBESABIITNPIJM-OAGGEKHMSA-N 1 1 360.458 2.967 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)nc1-c1ccccc1 ZINC000897220655 973459090 /nfs/dbraw/zinc/45/90/90/973459090.db2.gz CWTIHFYUWAOSCH-SJORKVTESA-N 1 1 368.437 2.692 20 5 FFBDMO C[N@H+]1CC[C@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000897241989 973540176 /nfs/dbraw/zinc/54/01/76/973540176.db2.gz YVRXDJJURAHTJV-OALUTQOASA-N 1 1 353.422 2.947 20 5 FFBDMO COc1ccc(OCCn2cc(C[N@@H+](C)C(C)(C)C)nn2)c([N+](=O)[O-])c1 ZINC000905801383 980515292 /nfs/dbraw/zinc/51/52/92/980515292.db2.gz BTDJQSJFIBYSDT-UHFFFAOYSA-N 1 1 363.418 2.504 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000877820907 1014739814 /nfs/dbraw/zinc/73/98/14/1014739814.db2.gz KEYRNMDGQCVSBK-ZDUSSCGKSA-N 1 1 366.414 2.777 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@@H](C)C1 ZINC000910295968 981902540 /nfs/dbraw/zinc/90/25/40/981902540.db2.gz QOXMRKIKDSEQIA-INIZCTEOSA-N 1 1 374.485 2.754 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@]12CC[N@@H+](C1)CCC2 ZINC000897592911 982361295 /nfs/dbraw/zinc/36/12/95/982361295.db2.gz XFTHSIOHHPJDNX-HNNXBMFYSA-N 1 1 357.332 2.716 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000913273144 984226092 /nfs/dbraw/zinc/22/60/92/984226092.db2.gz DGDJOXDBNIXPRD-KDURUIRLSA-N 1 1 361.442 2.796 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000764890124 984772996 /nfs/dbraw/zinc/77/29/96/984772996.db2.gz FHIGDHHXWXWDFI-UHFFFAOYSA-N 1 1 373.457 2.839 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084589 984956544 /nfs/dbraw/zinc/95/65/44/984956544.db2.gz WEDJSFZCPNKNSV-SCLBCKFNSA-N 1 1 354.414 2.990 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000060962151 985095618 /nfs/dbraw/zinc/09/56/18/985095618.db2.gz IPSIBJNFBZZVCQ-LBPRGKRZSA-N 1 1 364.402 2.806 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000170647133 985104421 /nfs/dbraw/zinc/10/44/21/985104421.db2.gz MBGQBJJRALNNRH-CQSZACIVSA-N 1 1 365.430 2.820 20 5 FFBDMO C/C(=C/C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785437976 985320520 /nfs/dbraw/zinc/32/05/20/985320520.db2.gz ACWOCUIEIIFOKC-UGEDRFTOSA-N 1 1 373.453 2.710 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000323971228 986388889 /nfs/dbraw/zinc/38/88/89/986388889.db2.gz CBLAKALVQIYVEF-HNNXBMFYSA-N 1 1 368.437 2.771 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000153094819 987633669 /nfs/dbraw/zinc/63/36/69/987633669.db2.gz GCNQDMWMHNKHCL-UHFFFAOYSA-N 1 1 356.426 2.817 20 5 FFBDMO CC(=O)OC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000153354122 987898877 /nfs/dbraw/zinc/89/88/77/987898877.db2.gz FOKBLMYQPMHZLS-LLVKDONJSA-N 1 1 360.370 2.733 20 5 FFBDMO O=C(NC[C@@H]1C[N@H+]2CCN1CCC2)c1cc2ccccc2c2cccnc12 ZINC000670409949 988697865 /nfs/dbraw/zinc/69/78/65/988697865.db2.gz XSXANHMJORZBCM-QGZVFWFLSA-N 1 1 360.461 2.508 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000879244860 1015435476 /nfs/dbraw/zinc/43/54/76/1015435476.db2.gz UBUWDCXREMWAQX-AZUAARDMSA-N 1 1 369.421 2.756 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000193846218 989089910 /nfs/dbraw/zinc/08/99/10/989089910.db2.gz VGOKDHPDOKDUMX-AWEZNQCLSA-N 1 1 359.382 2.763 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C12CCC2 ZINC000763236642 989249217 /nfs/dbraw/zinc/24/92/17/989249217.db2.gz RMGLPYVMHMUEKB-HZPDHXFCSA-N 1 1 359.430 2.885 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000174847728 990247553 /nfs/dbraw/zinc/24/75/53/990247553.db2.gz ZJDQTTRAEGYMOV-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO Cc1cccc(C)c1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001034816964 990277396 /nfs/dbraw/zinc/27/73/96/990277396.db2.gz XFRUFLRJEPNQGK-UYAOXDASSA-N 1 1 367.449 2.875 20 5 FFBDMO COc1cc(CN2CC[C@H]3[C@H]2CCC[N@H+]3C)c([N+](=O)[O-])cc1OC(F)F ZINC000880133372 1015763993 /nfs/dbraw/zinc/76/39/93/1015763993.db2.gz SXMQCEWTGSBQJW-QWHCGFSZSA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810621018 994843057 /nfs/dbraw/zinc/84/30/57/994843057.db2.gz FAMXGRCEFYETKN-LBPRGKRZSA-N 1 1 355.354 2.531 20 5 FFBDMO CCOc1cc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000810846302 994954529 /nfs/dbraw/zinc/95/45/29/994954529.db2.gz IROBERZTOZKVKJ-CHWSQXEVSA-N 1 1 364.398 2.786 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000888833176 1015958940 /nfs/dbraw/zinc/95/89/40/1015958940.db2.gz XXKCOZICDDGXQF-DZGCQCFKSA-N 1 1 362.430 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000747832278 995596137 /nfs/dbraw/zinc/59/61/37/995596137.db2.gz PAFWYKOXLZZKJV-CVEARBPZSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cn2ccccc2n1 ZINC000813173314 995634658 /nfs/dbraw/zinc/63/46/58/995634658.db2.gz YQFOWROZANJSGY-INIZCTEOSA-N 1 1 366.377 2.674 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cn2ccccc2n1 ZINC000813173314 995634663 /nfs/dbraw/zinc/63/46/63/995634663.db2.gz YQFOWROZANJSGY-INIZCTEOSA-N 1 1 366.377 2.674 20 5 FFBDMO CN(C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000823979791 996771305 /nfs/dbraw/zinc/77/13/05/996771305.db2.gz CTIGBVHIVGVKJX-INIZCTEOSA-N 1 1 369.425 2.915 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000824827938 997118552 /nfs/dbraw/zinc/11/85/52/997118552.db2.gz JUAUQOQEVCDOIO-UONOGXRCSA-N 1 1 371.359 2.746 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)CC[C@H]21 ZINC000827277679 1016124277 /nfs/dbraw/zinc/12/42/77/1016124277.db2.gz OFLVQJLQUYSQLA-FOIQADDNSA-N 1 1 361.445 2.848 20 5 FFBDMO COc1cc(C(=O)OC[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000845814018 998665363 /nfs/dbraw/zinc/66/53/63/998665363.db2.gz JHBOWGMQDUMCHC-ZJUUUORDSA-N 1 1 374.340 2.702 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000803856322 1016245031 /nfs/dbraw/zinc/24/50/31/1016245031.db2.gz OOAFTMBPZVIGLA-AWEZNQCLSA-N 1 1 374.397 2.953 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000738088455 999616268 /nfs/dbraw/zinc/61/62/68/999616268.db2.gz DWMPHNLCIFVUJA-UHFFFAOYSA-N 1 1 362.430 2.512 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC000741032427 999701886 /nfs/dbraw/zinc/70/18/86/999701886.db2.gz FNRSMSXTAOPDOC-KGLIPLIRSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169011327 1000015300 /nfs/dbraw/zinc/01/53/00/1000015300.db2.gz JWLVDVSZWXCLND-CAOSSQGBSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169011328 1000015328 /nfs/dbraw/zinc/01/53/28/1000015328.db2.gz JWLVDVSZWXCLND-FXUDXRNXSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC[C@@H]21 ZINC001169010723 1000015409 /nfs/dbraw/zinc/01/54/09/1000015409.db2.gz FUIAMHHSKRWEKK-FPCVCCKLSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCCC[N@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011392 1000015647 /nfs/dbraw/zinc/01/56/47/1000015647.db2.gz KDAJAMMPHBZCJR-GJZGRUSLSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036857 1000016748 /nfs/dbraw/zinc/01/67/48/1000016748.db2.gz QIJDEHQFRWOMBH-LMINUHAASA-N 1 1 353.463 2.952 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036869 1000016785 /nfs/dbraw/zinc/01/67/85/1000016785.db2.gz QIJDEHQFRWOMBH-RBZJEDDUSA-N 1 1 353.463 2.952 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCn3cnc(COc4cccnc4)c3C2)C1 ZINC001169018390 1000017237 /nfs/dbraw/zinc/01/72/37/1000017237.db2.gz AYLRYSOYPLOASX-HOTGVXAUSA-N 1 1 371.441 2.508 20 5 FFBDMO C/C(=C\C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785814311 1001487846 /nfs/dbraw/zinc/48/78/46/1001487846.db2.gz ACWOCUIEIIFOKC-MDJJKAFGSA-N 1 1 373.453 2.710 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000746665833 1001680618 /nfs/dbraw/zinc/68/06/18/1001680618.db2.gz GTXKJMCWYHXOAB-DZGCQCFKSA-N 1 1 367.450 2.559 20 5 FFBDMO O=C1N(C[N@@H+]2CCOCC3(CCCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000774656024 1002330321 /nfs/dbraw/zinc/33/03/21/1002330321.db2.gz ATJUBKGXHVBOPO-UHFFFAOYSA-N 1 1 374.441 2.687 20 5 FFBDMO O=C1N(C[N@H+]2CCOCC3(CCCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000774656024 1002330332 /nfs/dbraw/zinc/33/03/32/1002330332.db2.gz ATJUBKGXHVBOPO-UHFFFAOYSA-N 1 1 374.441 2.687 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc([N+](=O)[O-])cc(C)c3F)CC2)c1 ZINC000790849171 1002498460 /nfs/dbraw/zinc/49/84/60/1002498460.db2.gz GUORKZQLNSOWLK-UHFFFAOYSA-N 1 1 358.373 2.708 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)CCNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170329755 1003115851 /nfs/dbraw/zinc/11/58/51/1003115851.db2.gz TWBJSLPLYGXOLT-ZDUSSCGKSA-N 1 1 367.446 2.991 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170354373 1003121808 /nfs/dbraw/zinc/12/18/08/1003121808.db2.gz JVJNEBXINALODY-HIFRSBDPSA-N 1 1 350.415 2.762 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000792869767 1003205344 /nfs/dbraw/zinc/20/53/44/1003205344.db2.gz DIDDYRCIBXVFIL-KRWDZBQOSA-N 1 1 357.366 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000792869767 1003205350 /nfs/dbraw/zinc/20/53/50/1003205350.db2.gz DIDDYRCIBXVFIL-KRWDZBQOSA-N 1 1 357.366 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCOC[C@H](C4CCC4)C3)n2)cc1 ZINC000793743969 1003488958 /nfs/dbraw/zinc/48/89/58/1003488958.db2.gz OYQQIZWBALTKGT-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCOC[C@H](C4CCC4)C3)n2)cc1 ZINC000793743969 1003488963 /nfs/dbraw/zinc/48/89/63/1003488963.db2.gz OYQQIZWBALTKGT-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001001401011 1016782478 /nfs/dbraw/zinc/78/24/78/1016782478.db2.gz XEVIHDHNTQNPBP-RTBURBONSA-N 1 1 359.470 2.803 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@H](C)C1 ZINC000804380258 1003642164 /nfs/dbraw/zinc/64/21/64/1003642164.db2.gz VMTGYQTWHCNUHF-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@H](C)C1 ZINC000804380258 1003642170 /nfs/dbraw/zinc/64/21/70/1003642170.db2.gz VMTGYQTWHCNUHF-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000804815267 1003861537 /nfs/dbraw/zinc/86/15/37/1003861537.db2.gz QFQFFEMQBDNLLN-FUNVUKJBSA-N 1 1 365.405 2.972 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000805774450 1004127852 /nfs/dbraw/zinc/12/78/52/1004127852.db2.gz KYJKJMCDRDDACA-MRXNPFEDSA-N 1 1 365.430 2.964 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805777058 1004129177 /nfs/dbraw/zinc/12/91/77/1004129177.db2.gz YQGLURAAPUWPQQ-SJORKVTESA-N 1 1 365.430 2.619 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC001192672282 1004232820 /nfs/dbraw/zinc/23/28/20/1004232820.db2.gz FXZCNTJHJSIICZ-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO Cc1noc(CN2CCC[N@@H+](Cc3ccccc3)CCOCC2)c1[N+](=O)[O-] ZINC001198141263 1004494131 /nfs/dbraw/zinc/49/41/31/1004494131.db2.gz XVHMLQTXWYQUHV-UHFFFAOYSA-N 1 1 374.441 2.616 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCO1 ZINC000851035709 1005858084 /nfs/dbraw/zinc/85/80/84/1005858084.db2.gz WILNYIBUWIKHOO-JLSDUUJJSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCO1 ZINC000851035709 1005858085 /nfs/dbraw/zinc/85/80/85/1005858085.db2.gz WILNYIBUWIKHOO-JLSDUUJJSA-N 1 1 362.426 2.918 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)O[C@@H]1CC[N@@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000776557934 1005928695 /nfs/dbraw/zinc/92/86/95/1005928695.db2.gz KWWKOAAFDSKELD-GOSISDBHSA-N 1 1 369.421 2.853 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC001134279390 1006258692 /nfs/dbraw/zinc/25/86/92/1006258692.db2.gz NTPFJBMSVNEEBP-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC001134279390 1006258698 /nfs/dbraw/zinc/25/86/98/1006258698.db2.gz NTPFJBMSVNEEBP-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1cc(C)c(C[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c(C)c1 ZINC001050517619 1017035723 /nfs/dbraw/zinc/03/57/23/1017035723.db2.gz WWPUDFQLHSAPMY-IEBWSBKVSA-N 1 1 371.481 2.701 20 5 FFBDMO O=[N+]([O-])c1c(F)nccc1NCc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000882171579 1006311756 /nfs/dbraw/zinc/31/17/56/1006311756.db2.gz GISARMXKQCJVRD-OAHLLOKOSA-N 1 1 360.389 2.698 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000747958772 1006354019 /nfs/dbraw/zinc/35/40/19/1006354019.db2.gz DCUPAQWZJPIDEX-KGLIPLIRSA-N 1 1 367.450 2.559 20 5 FFBDMO CC1C[C@H]2CC[C@@H](C1)[N@@H+]2CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853605218 1006471248 /nfs/dbraw/zinc/47/12/48/1006471248.db2.gz IBVMXSOVSVMADX-NBZMYEQFSA-N 1 1 372.425 2.582 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)CC1 ZINC000816952851 1007274087 /nfs/dbraw/zinc/27/40/87/1007274087.db2.gz SVZIEHXBSJQYPX-DNVCBOLYSA-N 1 1 372.469 2.607 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856671004 1007942895 /nfs/dbraw/zinc/94/28/95/1007942895.db2.gz LHMDZBNEDXZTQD-UGSOOPFHSA-N 1 1 360.414 2.671 20 5 FFBDMO Cc1nn(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c2ncc([N+](=O)[O-])cc12 ZINC000819901716 1008246656 /nfs/dbraw/zinc/24/66/56/1008246656.db2.gz DUXRDLRSANEENS-KRWDZBQOSA-N 1 1 371.441 2.887 20 5 FFBDMO C[C@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000820308209 1008315381 /nfs/dbraw/zinc/31/53/81/1008315381.db2.gz HWEKCSXSEKNVOC-CQSZACIVSA-N 1 1 363.433 2.999 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001136354943 1008346831 /nfs/dbraw/zinc/34/68/31/1008346831.db2.gz DUXOYAAHJGNURE-UHFFFAOYSA-N 1 1 360.458 2.905 20 5 FFBDMO CCN1CC[NH+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000858463010 1008364670 /nfs/dbraw/zinc/36/46/70/1008364670.db2.gz SJBJWUXYOBZKKC-UHFFFAOYSA-N 1 1 370.453 2.505 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)C1 ZINC000886136307 1008582556 /nfs/dbraw/zinc/58/25/56/1008582556.db2.gz KRMHRJPHQJYKQI-SFHVURJKSA-N 1 1 362.430 2.823 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)C1 ZINC000886136307 1008582572 /nfs/dbraw/zinc/58/25/72/1008582572.db2.gz KRMHRJPHQJYKQI-SFHVURJKSA-N 1 1 362.430 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3ncccn3)C2)c2c(c1)COCO2 ZINC000886676767 1008812694 /nfs/dbraw/zinc/81/26/94/1008812694.db2.gz LRKLOCYZXSPSBH-CYBMUJFWSA-N 1 1 356.382 2.631 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3ncccn3)C2)c2c(c1)COCO2 ZINC000886676767 1008812711 /nfs/dbraw/zinc/81/27/11/1008812711.db2.gz LRKLOCYZXSPSBH-CYBMUJFWSA-N 1 1 356.382 2.631 20 5 FFBDMO Cc1[nH]c(CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001178441862 1008975017 /nfs/dbraw/zinc/97/50/17/1008975017.db2.gz YGMIVCQKMFBLNJ-UHFFFAOYSA-N 1 1 352.778 2.673 20 5 FFBDMO Cc1ccc(F)cc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178458471 1008994816 /nfs/dbraw/zinc/99/48/16/1008994816.db2.gz INNLZOOYYCXRFS-IAGOWNOFSA-N 1 1 351.422 2.566 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCCCC(F)(F)F)[C@@H]1CC1[N+](=O)[O-] ZINC001178458671 1008995418 /nfs/dbraw/zinc/99/54/18/1008995418.db2.gz RGTJPEFAJDQELT-CHWSQXEVSA-N 1 1 353.385 2.650 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823600174 1009136888 /nfs/dbraw/zinc/13/68/88/1009136888.db2.gz YWFHAFFTZCPFKK-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823600174 1009136892 /nfs/dbraw/zinc/13/68/92/1009136892.db2.gz YWFHAFFTZCPFKK-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823962327 1009281842 /nfs/dbraw/zinc/28/18/42/1009281842.db2.gz RLVWQKSMMFTGQX-GUYCJALGSA-N 1 1 369.425 2.819 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000130595032 1009352451 /nfs/dbraw/zinc/35/24/51/1009352451.db2.gz PEZVCFFQUGLVQS-UHFFFAOYSA-N 1 1 371.441 2.862 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccco2)c1[N+](=O)[O-] ZINC001180112367 1009568398 /nfs/dbraw/zinc/56/83/98/1009568398.db2.gz IQWGUVRYGWVMNJ-ZFWWWQNUSA-N 1 1 362.382 2.990 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889158581 1009843981 /nfs/dbraw/zinc/84/39/81/1009843981.db2.gz OTZNPRPDFSQIRI-LRDDRELGSA-N 1 1 356.426 2.742 20 5 FFBDMO C[C@H](CNC(=O)OC(C)(C)C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001181101421 1009969367 /nfs/dbraw/zinc/96/93/67/1009969367.db2.gz BGVOLWZTDXKDKN-SNVBAGLBSA-N 1 1 350.375 2.739 20 5 FFBDMO C[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCC(C)(C)C1 ZINC000794688345 1010474558 /nfs/dbraw/zinc/47/45/58/1010474558.db2.gz YKPFAOIYBFZVLJ-DNVCBOLYSA-N 1 1 374.441 2.830 20 5 FFBDMO C[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCC(C)(C)C1 ZINC000794688346 1010475006 /nfs/dbraw/zinc/47/50/06/1010475006.db2.gz YKPFAOIYBFZVLJ-HNAYVOBHSA-N 1 1 374.441 2.830 20 5 FFBDMO Cn1cc([C@@H](O)C[C@@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000865650289 1010835485 /nfs/dbraw/zinc/83/54/85/1010835485.db2.gz BDCCKEMGXVAXHG-LIRRHRJNSA-N 1 1 367.409 2.969 20 5 FFBDMO C[N@@H+]1CCc2c(NCc3ccc(-n4cccn4)nc3)ccc([N+](=O)[O-])c2C1 ZINC001171433893 1010908497 /nfs/dbraw/zinc/90/84/97/1010908497.db2.gz ALWWUUONWBYGJC-UHFFFAOYSA-N 1 1 364.409 2.776 20 5 FFBDMO C[N@H+]1CCc2c(NCc3ccc(-n4cccn4)nc3)ccc([N+](=O)[O-])c2C1 ZINC001171433893 1010908502 /nfs/dbraw/zinc/90/85/02/1010908502.db2.gz ALWWUUONWBYGJC-UHFFFAOYSA-N 1 1 364.409 2.776 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@H](CO)[C@@H](C(F)(F)F)C1)CC2 ZINC001172905632 1012076756 /nfs/dbraw/zinc/07/67/56/1012076756.db2.gz UBCIZLZZUGQZLQ-FMKPAKJESA-N 1 1 358.360 2.945 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@]1(C)O ZINC001173009263 1012176652 /nfs/dbraw/zinc/17/66/52/1012176652.db2.gz ANYPJDBSCVRIHW-XIKOKIGWSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1O ZINC001173010221 1012179568 /nfs/dbraw/zinc/17/95/68/1012179568.db2.gz OAAAXZNQKIHBSE-BZNIZROVSA-N 1 1 355.385 2.545 20 5 FFBDMO CC(C)(N)C(C)(C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010416 1012179605 /nfs/dbraw/zinc/17/96/05/1012179605.db2.gz VDBFTIRESQVODZ-UHFFFAOYSA-N 1 1 356.417 2.947 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[NH2+]2)cc1 ZINC000870140036 1012187689 /nfs/dbraw/zinc/18/76/89/1012187689.db2.gz ULZZLGRVORXYQZ-KRWDZBQOSA-N 1 1 359.357 2.529 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H]4OCC[C@@H]4C3)CC2)c(F)c1 ZINC001173015434 1012187769 /nfs/dbraw/zinc/18/77/69/1012187769.db2.gz QCNRIJFFDAAGMO-PXAZEXFGSA-N 1 1 367.396 2.953 20 5 FFBDMO Cn1ncc2c1C[N@@H+](C1CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC1)C2 ZINC001173018278 1012189688 /nfs/dbraw/zinc/18/96/88/1012189688.db2.gz QZYLQMUJAFBGLJ-UHFFFAOYSA-N 1 1 363.368 2.591 20 5 FFBDMO Cn1ncc2c1C[N@H+](C1CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC1)C2 ZINC001173018278 1012189698 /nfs/dbraw/zinc/18/96/98/1012189698.db2.gz QZYLQMUJAFBGLJ-UHFFFAOYSA-N 1 1 363.368 2.591 20 5 FFBDMO C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@H]1CCCOC1 ZINC001173020475 1012192863 /nfs/dbraw/zinc/19/28/63/1012192863.db2.gz SAPVSOLAVISIHO-ZDUSSCGKSA-N 1 1 355.385 2.953 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC001173229111 1012363992 /nfs/dbraw/zinc/36/39/92/1012363992.db2.gz PZQUSEGKGZKMQL-BHYGNILZSA-N 1 1 353.422 2.807 20 5 FFBDMO C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000870873416 1012615185 /nfs/dbraw/zinc/61/51/85/1012615185.db2.gz CSIAIUJQUYUPRF-DJKXOVBDSA-N 1 1 369.421 2.757 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880036 1012617244 /nfs/dbraw/zinc/61/72/44/1012617244.db2.gz UAXPCIURHHILEK-MJGOQNOKSA-N 1 1 373.384 2.508 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000827925797 1019005071 /nfs/dbraw/zinc/00/50/71/1019005071.db2.gz CQJPKRPYDXLBSR-IPMKNSEASA-N 1 1 367.405 2.577 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801836641 1019433422 /nfs/dbraw/zinc/43/34/22/1019433422.db2.gz POWUJVISLNVLMR-GXTWGEPZSA-N 1 1 372.400 2.881 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1Cc1ccccc1 ZINC000801921039 1019512915 /nfs/dbraw/zinc/51/29/15/1019512915.db2.gz WONIHUNTUVTPNN-TZMCWYRMSA-N 1 1 372.400 2.709 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc(OCC(N)=O)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000725796716 1020260931 /nfs/dbraw/zinc/26/09/31/1020260931.db2.gz PFNADUFSVPKMPT-UHFFFAOYSA-N 1 1 357.410 2.870 20 5 FFBDMO COc1cc(C[NH+]2CCC(Cc3noc(C)n3)CC2)c([N+](=O)[O-])cc1F ZINC000932244612 1020755286 /nfs/dbraw/zinc/75/52/86/1020755286.db2.gz IPNPHVUEBKGDGB-UHFFFAOYSA-N 1 1 364.377 2.889 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000749647561 1021017298 /nfs/dbraw/zinc/01/72/98/1021017298.db2.gz NWGNFVWEEYHAGB-FQEVSTJZSA-N 1 1 355.438 2.882 20 5 FFBDMO COc1ccc(C[N@@H+](CCCO)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000934504561 1021265065 /nfs/dbraw/zinc/26/50/65/1021265065.db2.gz AJZUPGDBCQCCKV-LJQANCHMSA-N 1 1 360.410 2.521 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000778395836 1021911340 /nfs/dbraw/zinc/91/13/40/1021911340.db2.gz VRXHFHGCWGSZDY-CQSZACIVSA-N 1 1 369.406 2.516 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000778395836 1021911343 /nfs/dbraw/zinc/91/13/43/1021911343.db2.gz VRXHFHGCWGSZDY-CQSZACIVSA-N 1 1 369.406 2.516 20 5 FFBDMO CCC(C)(C)c1cc([N+](=O)[O-])c(O[C@H]2CC[NH2+]CC(=O)C2)c([N+](=O)[O-])c1 ZINC001218193847 1033041786 /nfs/dbraw/zinc/04/17/86/1033041786.db2.gz ITTOWYJVQCJAJO-ZDUSSCGKSA-N 1 1 365.386 2.891 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3nccs3)C2)nc1-c1ccncc1 ZINC001119391599 1022735237 /nfs/dbraw/zinc/73/52/37/1022735237.db2.gz FBJHGHUVTONOPG-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3nccs3)C2)nc1-c1ccncc1 ZINC001119391599 1022735244 /nfs/dbraw/zinc/73/52/44/1022735244.db2.gz FBJHGHUVTONOPG-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO O=C(OCc1cccnc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001119396145 1022739006 /nfs/dbraw/zinc/73/90/06/1022739006.db2.gz DIXHEQGUARBXFP-MRXNPFEDSA-N 1 1 355.394 2.945 20 5 FFBDMO COc1cc(CNCC[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000779121724 1022837612 /nfs/dbraw/zinc/83/76/12/1022837612.db2.gz XNNUBSMJNZBRPK-GFCCVEGCSA-N 1 1 373.400 2.821 20 5 FFBDMO COc1cc(C[NH2+]CCN2CCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000779121724 1022837633 /nfs/dbraw/zinc/83/76/33/1022837633.db2.gz XNNUBSMJNZBRPK-GFCCVEGCSA-N 1 1 373.400 2.821 20 5 FFBDMO C[N@@H+](C1CCCC1)C(C)(C)C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000779123195 1022845336 /nfs/dbraw/zinc/84/53/36/1022845336.db2.gz ZSNKYZZGWUHMSM-UHFFFAOYSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350656 1033114942 /nfs/dbraw/zinc/11/49/42/1033114942.db2.gz QZTFXIFXSSZUCD-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829350656 1033114948 /nfs/dbraw/zinc/11/49/48/1033114948.db2.gz QZTFXIFXSSZUCD-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@H+](C3CCC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001161178068 1033120559 /nfs/dbraw/zinc/12/05/59/1033120559.db2.gz ZGDNXQOLSWQEHV-HNNXBMFYSA-N 1 1 353.426 2.821 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001122803271 1023483746 /nfs/dbraw/zinc/48/37/46/1023483746.db2.gz WWWUHVQWZOUNSC-WMLDXEAASA-N 1 1 372.425 2.554 20 5 FFBDMO CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001122822980 1023495784 /nfs/dbraw/zinc/49/57/84/1023495784.db2.gz MMKUMGGZSBWJMW-HNNXBMFYSA-N 1 1 366.510 2.828 20 5 FFBDMO CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC001122823392 1023496689 /nfs/dbraw/zinc/49/66/89/1023496689.db2.gz ZAPYHYJMFZTFSL-HUUCEWRRSA-N 1 1 364.494 2.582 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@H](C3CCOCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000754786536 1023517615 /nfs/dbraw/zinc/51/76/15/1023517615.db2.gz VROQFGMDRFJRBZ-INIZCTEOSA-N 1 1 374.441 2.543 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000755676488 1023622548 /nfs/dbraw/zinc/62/25/48/1023622548.db2.gz AIBWXOLTQIDJCN-KAPURRDVSA-N 1 1 362.426 2.898 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN(c3cc[nH+]c(N4CCCCC4)n3)CC2)cc1 ZINC000779429233 1023834176 /nfs/dbraw/zinc/83/41/76/1023834176.db2.gz TVIHEBBNOUGXPT-UHFFFAOYSA-N 1 1 368.441 2.702 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@@H]2C1 ZINC001124004204 1024218219 /nfs/dbraw/zinc/21/82/19/1024218219.db2.gz UWAMOBIPLHOQMG-USXIJHARSA-N 1 1 366.421 2.727 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000195466301 1025023015 /nfs/dbraw/zinc/02/30/15/1025023015.db2.gz LOISGXXESSNQRP-IYBDPMFKSA-N 1 1 364.465 2.724 20 5 FFBDMO COC(=O)c1cc(C(=O)OC[C@@H]2CCCC[N@H+]2C(C)C)cc([N+](=O)[O-])c1 ZINC000837342875 1025734241 /nfs/dbraw/zinc/73/42/41/1025734241.db2.gz CBJIKTHIMXYQGR-HNNXBMFYSA-N 1 1 364.398 2.801 20 5 FFBDMO CCCc1[nH]nc(C(=O)O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000837700489 1025971163 /nfs/dbraw/zinc/97/11/63/1025971163.db2.gz UZRZTKBPJQPKQN-AWEZNQCLSA-N 1 1 358.398 2.702 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3F)cc2)CC1 ZINC000839250495 1026632628 /nfs/dbraw/zinc/63/26/28/1026632628.db2.gz JTFAIFGGZJSIGJ-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO C[N@@H+](C1CN(c2ccc3c(ccc(Cl)c3[N+](=O)[O-])n2)C1)[C@H]1CCOC1 ZINC001158731280 1027116183 /nfs/dbraw/zinc/11/61/83/1027116183.db2.gz JQPCXIPCIBJIBL-NSHDSACASA-N 1 1 362.817 2.706 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2cccc(Cl)c2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160098323 1027588975 /nfs/dbraw/zinc/58/89/75/1027588975.db2.gz YDCBJLLEDARWOL-IAGOWNOFSA-N 1 1 363.845 2.644 20 5 FFBDMO O=C(NCCC1=CC[N@H+](Cc2cccc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160098323 1027588987 /nfs/dbraw/zinc/58/89/87/1027588987.db2.gz YDCBJLLEDARWOL-IAGOWNOFSA-N 1 1 363.845 2.644 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2cccc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160098323 1027588991 /nfs/dbraw/zinc/58/89/91/1027588991.db2.gz YDCBJLLEDARWOL-IAGOWNOFSA-N 1 1 363.845 2.644 20 5 FFBDMO CCCc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001160097832 1027589761 /nfs/dbraw/zinc/58/97/61/1027589761.db2.gz KOKLUZBIJUPKGR-WOJBJXKFSA-N 1 1 371.481 2.943 20 5 FFBDMO CCCc1ccc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160097832 1027589762 /nfs/dbraw/zinc/58/97/62/1027589762.db2.gz KOKLUZBIJUPKGR-WOJBJXKFSA-N 1 1 371.481 2.943 20 5 FFBDMO CCCc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160097832 1027589764 /nfs/dbraw/zinc/58/97/64/1027589764.db2.gz KOKLUZBIJUPKGR-WOJBJXKFSA-N 1 1 371.481 2.943 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(N[C@H]3CCC[C@@H]3[NH+]3CCOCC3)nn2)cc1 ZINC001160722882 1027825732 /nfs/dbraw/zinc/82/57/32/1027825732.db2.gz DJVROAJCCSMHMB-ROUUACIJSA-N 1 1 369.425 2.717 20 5 FFBDMO COc1cc2ncnc(NCc3[nH+]cn4ccccc34)c2cc1[N+](=O)[O-] ZINC001161684084 1028280131 /nfs/dbraw/zinc/28/01/31/1028280131.db2.gz CUYNBBCHPMUTRS-UHFFFAOYSA-N 1 1 350.338 2.806 20 5 FFBDMO COc1cc(C)nc(N2CC[N@@H+]3CCc4ccccc4[C@H]3C2)c1[N+](=O)[O-] ZINC001155091091 1028573935 /nfs/dbraw/zinc/57/39/35/1028573935.db2.gz JHZWFCMEKDTREN-MRXNPFEDSA-N 1 1 354.410 2.726 20 5 FFBDMO COc1cc(C)nc(N2CC[N@H+]3CCc4ccccc4[C@H]3C2)c1[N+](=O)[O-] ZINC001155091091 1028573948 /nfs/dbraw/zinc/57/39/48/1028573948.db2.gz JHZWFCMEKDTREN-MRXNPFEDSA-N 1 1 354.410 2.726 20 5 FFBDMO C[NH+](C)C=Cc1cc(NC(=N)c2cnc3ccc(F)cn32)ncc1[N+](=O)[O-] ZINC001162676964 1028619089 /nfs/dbraw/zinc/61/90/89/1028619089.db2.gz RKNQAZJJYWUUGS-AATRIKPKSA-N 1 1 369.360 2.746 20 5 FFBDMO CCOc1nc(N[C@@H](C[NH+]2CCOCC2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC001162880911 1028692562 /nfs/dbraw/zinc/69/25/62/1028692562.db2.gz NRCXZFSIUJVOKI-AWEZNQCLSA-N 1 1 352.435 2.547 20 5 FFBDMO Cc1cc(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)c(N)c([N+](=O)[O-])c1 ZINC000781384786 1029181445 /nfs/dbraw/zinc/18/14/45/1029181445.db2.gz VKBQOSVZXRSYOZ-UHFFFAOYSA-N 1 1 369.425 2.719 20 5 FFBDMO O=C(NCCC1(C[NH2+]CCC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494628 1029296857 /nfs/dbraw/zinc/29/68/57/1029296857.db2.gz PHFKSTDGPDAONW-IAGOWNOFSA-N 1 1 351.491 2.888 20 5 FFBDMO C[N@@H+]1CCc2c(NCC(=O)N3CCc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001164597606 1029339513 /nfs/dbraw/zinc/33/95/13/1029339513.db2.gz CYWZVVZATMJWRJ-UHFFFAOYSA-N 1 1 366.421 2.584 20 5 FFBDMO C[N@H+]1CCc2c(NCC(=O)N3CCc4ccccc43)ccc([N+](=O)[O-])c2C1 ZINC001164597606 1029339527 /nfs/dbraw/zinc/33/95/27/1029339527.db2.gz CYWZVVZATMJWRJ-UHFFFAOYSA-N 1 1 366.421 2.584 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000782286569 1029640130 /nfs/dbraw/zinc/64/01/30/1029640130.db2.gz BYBBVHWORANLFL-OAHLLOKOSA-N 1 1 352.398 2.565 20 5 FFBDMO O=c1[nH]ccc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000695455158 1029890268 /nfs/dbraw/zinc/89/02/68/1029890268.db2.gz MOGFGFGDUZUJFU-JKSUJKDBSA-N 1 1 354.410 2.654 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001142221309 1030181133 /nfs/dbraw/zinc/18/11/33/1030181133.db2.gz AFWKWANNAOEVMQ-ZIAGYGMSSA-N 1 1 351.422 2.903 20 5 FFBDMO COc1ccc2c(c1)CC[N@@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=O)CC2 ZINC000783979295 1030381528 /nfs/dbraw/zinc/38/15/28/1030381528.db2.gz DHGMMOXNCUULAL-UHFFFAOYSA-N 1 1 369.377 2.570 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](Cn1c3cc([N+](=O)[O-])ccc3oc1=O)CC2 ZINC000783979295 1030381550 /nfs/dbraw/zinc/38/15/50/1030381550.db2.gz DHGMMOXNCUULAL-UHFFFAOYSA-N 1 1 369.377 2.570 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@@H]3CCCOC3)n2)c1 ZINC000842616429 1030826542 /nfs/dbraw/zinc/82/65/42/1030826542.db2.gz ORMKIKGISRKJBW-WBVHZDCISA-N 1 1 357.414 2.702 20 5 FFBDMO C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@](C)(O)c1ccccc1 ZINC000842626299 1030844513 /nfs/dbraw/zinc/84/45/13/1030844513.db2.gz OCSJZNHNBKPKBC-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000797341831 1031076650 /nfs/dbraw/zinc/07/66/50/1031076650.db2.gz GZLIXSVRFRGIHP-KRWDZBQOSA-N 1 1 372.425 2.635 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCN(c2ncccc2F)CC1 ZINC000797520870 1031144773 /nfs/dbraw/zinc/14/47/73/1031144773.db2.gz NWJVMKDUGSMYOH-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCN(c2ncccc2F)CC1 ZINC000797520870 1031144781 /nfs/dbraw/zinc/14/47/81/1031144781.db2.gz NWJVMKDUGSMYOH-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO O=C(CCN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000843363261 1031356275 /nfs/dbraw/zinc/35/62/75/1031356275.db2.gz UVFASRNUZDALMQ-CZUORRHYSA-N 1 1 364.421 2.527 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1 ZINC001204640315 1031397101 /nfs/dbraw/zinc/39/71/01/1031397101.db2.gz HORXICALXPDIKY-CYBMUJFWSA-N 1 1 366.414 2.864 20 5 FFBDMO C[C@H]([NH2+]Cc1cc([O-])ccc1[N+](=O)[O-])c1ccc(N2CCNC2=O)cc1 ZINC000829751728 1033321269 /nfs/dbraw/zinc/32/12/69/1033321269.db2.gz NRYUIFKERXQLST-LBPRGKRZSA-N 1 1 356.382 2.681 20 5 FFBDMO COc1cc(CO[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])cc1OC ZINC001223907637 1033639589 /nfs/dbraw/zinc/63/95/89/1033639589.db2.gz ULAMXUKDXLRTFV-IVWMJMPLSA-N 1 1 350.415 2.859 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1OC[C@@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC001225492054 1034277099 /nfs/dbraw/zinc/27/70/99/1034277099.db2.gz VELIDUNONZVJDA-KRWDZBQOSA-N 1 1 358.394 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001225492054 1034277120 /nfs/dbraw/zinc/27/71/20/1034277120.db2.gz VELIDUNONZVJDA-KRWDZBQOSA-N 1 1 358.394 2.970 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCOc2ccccc21 ZINC000831896728 1034389918 /nfs/dbraw/zinc/38/99/18/1034389918.db2.gz WMLKJEOQMCXYEE-MRXNPFEDSA-N 1 1 373.384 2.935 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3Cl)C[C@H]1[N@H+]2C ZINC001225788184 1034406447 /nfs/dbraw/zinc/40/64/47/1034406447.db2.gz KJFALQNLMSIGJX-HTTKSJEASA-N 1 1 354.790 2.794 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(OC2CCN(c3cc[nH+]cc3)CC2)[nH]1 ZINC001228241646 1036009806 /nfs/dbraw/zinc/00/98/06/1036009806.db2.gz DEFVTYKMJQMYOJ-UHFFFAOYSA-N 1 1 367.365 2.686 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C2 ZINC001228660608 1036239049 /nfs/dbraw/zinc/23/90/49/1036239049.db2.gz HZRHFUUCQDEXLF-WDNDVIMCSA-N 1 1 368.455 2.781 20 5 FFBDMO Cc1nc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381708 1036644566 /nfs/dbraw/zinc/64/45/66/1036644566.db2.gz ORLXIVTZVLOQLE-MUJYYYPQSA-N 1 1 370.409 2.973 20 5 FFBDMO Cc1nc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381708 1036644572 /nfs/dbraw/zinc/64/45/72/1036644572.db2.gz ORLXIVTZVLOQLE-MUJYYYPQSA-N 1 1 370.409 2.973 20 5 FFBDMO C[C@H](CON)Oc1nc2ccc(NC(=O)C[NH+](C)C)cc2c2ccccc21 ZINC001229806776 1036909756 /nfs/dbraw/zinc/90/97/56/1036909756.db2.gz AVFAVKORCHWOOC-CYBMUJFWSA-N 1 1 368.437 2.546 20 5 FFBDMO CC[N@@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2I)C1 ZINC001229836429 1036926828 /nfs/dbraw/zinc/92/68/28/1036926828.db2.gz UVPVJFODNGZNGA-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])ccc2I)C1 ZINC001229836429 1036926835 /nfs/dbraw/zinc/92/68/35/1036926835.db2.gz UVPVJFODNGZNGA-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@H+](Cc3ccccc3)C2)c(Cl)n1 ZINC001229919315 1036980312 /nfs/dbraw/zinc/98/03/12/1036980312.db2.gz KIEDPMNWPIQMLA-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c(Cl)n1 ZINC001229919315 1036980326 /nfs/dbraw/zinc/98/03/26/1036980326.db2.gz KIEDPMNWPIQMLA-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO Cc1c(Br)cnc(O[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001230037119 1037046727 /nfs/dbraw/zinc/04/67/27/1037046727.db2.gz GMIHLFPMVXDCGV-VIFPVBQESA-N 1 1 353.176 2.651 20 5 FFBDMO CC(=O)Nc1ccc(C(C)=O)c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC001234682848 1037139105 /nfs/dbraw/zinc/13/91/05/1037139105.db2.gz XNCKHQXKVVQMNG-WDNDVIMCSA-N 1 1 361.398 2.760 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@](C)(O)[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093512 1038378990 /nfs/dbraw/zinc/37/89/90/1038378990.db2.gz MWWYEWBFBSKCOM-KUHUBIRLSA-N 1 1 363.458 2.665 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc([C@@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@@H](C)O1 ZINC001258090112 1039164066 /nfs/dbraw/zinc/16/40/66/1039164066.db2.gz CSNOMFQBRDQYNQ-GLKRBJQHSA-N 1 1 372.385 2.816 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1-c1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258154636 1039233893 /nfs/dbraw/zinc/23/38/93/1039233893.db2.gz XFKNPCMMFODJER-TXEJJXNPSA-N 1 1 364.377 2.744 20 5 FFBDMO Cc1cc(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc([N+](=O)[O-])c1C ZINC001258161743 1039241695 /nfs/dbraw/zinc/24/16/95/1039241695.db2.gz LYJUMGPQUMECHK-BETUJISGSA-N 1 1 360.414 2.913 20 5 FFBDMO C[NH+]1CCN(c2ccc3nc(-c4ncc(Cl)cc4[N+](=O)[O-])[nH]c3c2)CC1 ZINC001251787402 1039299981 /nfs/dbraw/zinc/29/99/81/1039299981.db2.gz IBYIXXVPPCAKAP-UHFFFAOYSA-N 1 1 372.816 2.938 20 5 FFBDMO Nc1cc2nc3ccccc3nc2cc1Nc1ccnc(N2CC[NH2+]CC2)c1 ZINC001210269125 1039459484 /nfs/dbraw/zinc/45/94/84/1039459484.db2.gz NXTFUCYITMRUAR-UHFFFAOYSA-N 1 1 371.448 2.913 20 5 FFBDMO c1cc2n(n1)[C@@H](c1nc(-c3ccc4ccc5cccnc5c4n3)no1)C[NH2+]C2 ZINC001247129351 1039624184 /nfs/dbraw/zinc/62/41/84/1039624184.db2.gz ALZUHQBTWGACCO-MRXNPFEDSA-N 1 1 369.388 2.722 20 5 FFBDMO COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247639996 1039854827 /nfs/dbraw/zinc/85/48/27/1039854827.db2.gz LFRDZKXYAIHEMQ-CYBMUJFWSA-N 1 1 363.377 2.786 20 5 FFBDMO COc1ncc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)cc1C ZINC001247673929 1039881721 /nfs/dbraw/zinc/88/17/21/1039881721.db2.gz ROKDXNABHDHLMN-ZDUSSCGKSA-N 1 1 355.354 2.599 20 5 FFBDMO CC(C)(C)N1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254479964 1040744318 /nfs/dbraw/zinc/74/43/18/1040744318.db2.gz RXKJBZHNANDBLU-UHFFFAOYSA-N 1 1 360.458 2.506 20 5 FFBDMO CC(C)(C)N1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O ZINC001254479964 1040744335 /nfs/dbraw/zinc/74/43/35/1040744335.db2.gz RXKJBZHNANDBLU-UHFFFAOYSA-N 1 1 360.458 2.506 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC(N3CC([NH+]4CCC(F)CC4)C3)CC2)cc1 ZINC001254479726 1040744528 /nfs/dbraw/zinc/74/45/28/1040744528.db2.gz JJNZMXCKKSFLLA-UHFFFAOYSA-N 1 1 362.449 2.682 20 5 FFBDMO O=C1CC[C@@]2(CCC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)O1 ZINC001254481091 1040746619 /nfs/dbraw/zinc/74/66/19/1040746619.db2.gz RKDXBNUKDREEEK-LJQANCHMSA-N 1 1 359.426 2.735 20 5 FFBDMO COC(=O)CC[C@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480161 1040748218 /nfs/dbraw/zinc/74/82/18/1040748218.db2.gz WQCOAIDYONJFQR-HNNXBMFYSA-N 1 1 361.442 2.839 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553323 1040794622 /nfs/dbraw/zinc/79/46/22/1040794622.db2.gz VAFVKUUTJKZTQE-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553323 1040794638 /nfs/dbraw/zinc/79/46/38/1040794638.db2.gz VAFVKUUTJKZTQE-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560821 1040796447 /nfs/dbraw/zinc/79/64/47/1040796447.db2.gz HNPSRMWQAWVNSF-GOEBONIOSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560821 1040796460 /nfs/dbraw/zinc/79/64/60/1040796460.db2.gz HNPSRMWQAWVNSF-GOEBONIOSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOCc1ncn2c1C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CCC2 ZINC001254596587 1040825918 /nfs/dbraw/zinc/82/59/18/1040825918.db2.gz PDWJQUGQOMNQHD-QGZVFWFLSA-N 1 1 356.426 2.701 20 5 FFBDMO CCC[NH+](CCC)CCN1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254602509 1040833143 /nfs/dbraw/zinc/83/31/43/1040833143.db2.gz FZURHIMKULZOGR-OAQYLSRUSA-N 1 1 374.529 2.802 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1c1ccccc1 ZINC001254605365 1040835209 /nfs/dbraw/zinc/83/52/09/1040835209.db2.gz BMOMYFNJIKNFGO-VAMGGRTRSA-N 1 1 366.417 2.951 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001255176290 1041181925 /nfs/dbraw/zinc/18/19/25/1041181925.db2.gz UKKCSKWFXXXGRY-UHFFFAOYSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc(F)cc1[N+](=O)[O-] ZINC001261585324 1041319836 /nfs/dbraw/zinc/31/98/36/1041319836.db2.gz WJAYQEQNORTPCM-INIZCTEOSA-N 1 1 354.378 2.570 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001310265027 1043659507 /nfs/dbraw/zinc/65/95/07/1043659507.db2.gz ZXARSYAFBUZUIB-TZMCWYRMSA-N 1 1 370.862 2.950 20 5 FFBDMO COC(=O)C[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC001319716686 1045250687 /nfs/dbraw/zinc/25/06/87/1045250687.db2.gz ZFUIQJFDKVPJBR-UHFFFAOYSA-N 1 1 360.414 2.626 20 5 FFBDMO COC(=O)C[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC001319716686 1045250692 /nfs/dbraw/zinc/25/06/92/1045250692.db2.gz ZFUIQJFDKVPJBR-UHFFFAOYSA-N 1 1 360.414 2.626 20 5 FFBDMO Cc1c(C(=O)OCc2ccc([N+](=O)[O-])cc2F)cnn1-c1cc[nH+]cc1 ZINC001320066951 1045341787 /nfs/dbraw/zinc/34/17/87/1045341787.db2.gz ICIMJTGVSOTHJS-UHFFFAOYSA-N 1 1 356.313 2.980 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC001322221608 1046002066 /nfs/dbraw/zinc/00/20/66/1046002066.db2.gz HJAFDULSYLSOLF-YJBOKZPZSA-N 1 1 374.437 2.906 20 5 FFBDMO CS[C@H]1CC[C@@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219763 1046422806 /nfs/dbraw/zinc/42/28/06/1046422806.db2.gz BNMPVRMWWBQKLC-KGLIPLIRSA-N 1 1 358.485 2.584 20 5 FFBDMO CS[C@H]1CC[C@@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219763 1046422812 /nfs/dbraw/zinc/42/28/12/1046422812.db2.gz BNMPVRMWWBQKLC-KGLIPLIRSA-N 1 1 358.485 2.584 20 5 FFBDMO CC[N@H+]1CCC[C@H](CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC001325874427 1046671091 /nfs/dbraw/zinc/67/10/91/1046671091.db2.gz PSSGMDGXGFYNIE-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCC2CC2)(c2ccccc2)CC1 ZINC001328127975 1048191551 /nfs/dbraw/zinc/19/15/51/1048191551.db2.gz MMNIWJFWWSLVAV-RTBURBONSA-N 1 1 371.481 2.602 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC001333391580 1048877521 /nfs/dbraw/zinc/87/75/21/1048877521.db2.gz OSIRJRUNMQPUFW-CQSZACIVSA-N 1 1 371.441 2.970 20 5 FFBDMO COc1cc(C[NH+]2CC(CC3CCOCC3)C2)c([N+](=O)[O-])cc1OC ZINC001334382770 1049401323 /nfs/dbraw/zinc/40/13/23/1049401323.db2.gz BBAPDBVPKOAKKD-UHFFFAOYSA-N 1 1 350.415 2.861 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001295041978 1049869170 /nfs/dbraw/zinc/86/91/70/1049869170.db2.gz UOPXWWABZDBXJG-JTQLQIEISA-N 1 1 372.828 2.677 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001301801315 1050987422 /nfs/dbraw/zinc/98/74/22/1050987422.db2.gz DLGNUTQKBOBFOW-INIZCTEOSA-N 1 1 361.785 2.741 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001342591587 1051196755 /nfs/dbraw/zinc/19/67/55/1051196755.db2.gz NHZJHFHYFOQRMC-QGZVFWFLSA-N 1 1 372.425 2.555 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001340876874 1051210083 /nfs/dbraw/zinc/21/00/83/1051210083.db2.gz AXMBHAZAMUBKAE-NVXWUHKLSA-N 1 1 372.473 2.737 20 5 FFBDMO C[C@H](CNC(=O)[C@H]1[NH2+]CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC001341429229 1051784658 /nfs/dbraw/zinc/78/46/58/1051784658.db2.gz QNTOVKUUYDZQKH-ACJLOTCBSA-N 1 1 355.394 2.538 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](CC(C)C)C[C@H](O)c1ccc(F)cc1 ZINC001307478773 1052311373 /nfs/dbraw/zinc/31/13/73/1052311373.db2.gz JYNPVLFTWLJGGC-KRWDZBQOSA-N 1 1 364.421 2.930 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3Br)C[C@@H]2C1 ZINC001307986922 1052376941 /nfs/dbraw/zinc/37/69/41/1052376941.db2.gz FZTYHDUFXUTGHA-YPMHNXCESA-N 1 1 354.248 2.741 20 5 FFBDMO COC(=O)C(C)(C)C[N@@H+](CC(C)C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001308033043 1052388983 /nfs/dbraw/zinc/38/89/83/1052388983.db2.gz NFVMNNUYRQPBRX-MRXNPFEDSA-N 1 1 352.431 2.785 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO ZINC001308140007 1052415252 /nfs/dbraw/zinc/41/52/52/1052415252.db2.gz IXTRLTFLSGXLDB-CABCVRRESA-N 1 1 374.268 2.933 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001345747826 1052599543 /nfs/dbraw/zinc/59/95/43/1052599543.db2.gz YXXYFZPPSUMILG-HNNXBMFYSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336024906 1053714781 /nfs/dbraw/zinc/71/47/81/1053714781.db2.gz MLJMCRWJQXNFPC-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC001348603380 1054815519 /nfs/dbraw/zinc/81/55/19/1054815519.db2.gz CMGPKJOLJRFTBZ-UHFFFAOYSA-N 1 1 355.398 2.597 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176668 1055184734 /nfs/dbraw/zinc/18/47/34/1055184734.db2.gz BXVLQIZKDDWJTR-SPOJGYOESA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176668 1055184739 /nfs/dbraw/zinc/18/47/39/1055184739.db2.gz BXVLQIZKDDWJTR-SPOJGYOESA-N 1 1 361.442 2.612 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000847253514 1055320818 /nfs/dbraw/zinc/32/08/18/1055320818.db2.gz GUJLENLJUISXIK-KBPBESRZSA-N 1 1 362.386 2.558 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432320 1056384078 /nfs/dbraw/zinc/38/40/78/1056384078.db2.gz IZPKNQAPOHPLPU-ZDUSSCGKSA-N 1 1 368.397 2.758 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001544800939 1071694200 /nfs/dbraw/zinc/69/42/00/1071694200.db2.gz NWGITZHFLSMTDI-MRXNPFEDSA-N 1 1 351.422 2.999 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)OCc1ccc(C[NH+]2CCOCC2)cc1 ZINC001520461796 1059703390 /nfs/dbraw/zinc/70/33/90/1059703390.db2.gz GRINSQVJEJCFHS-UHFFFAOYSA-N 1 1 370.405 2.713 20 5 FFBDMO CCCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCn1cc[nH+]c1C ZINC001547085642 1071911406 /nfs/dbraw/zinc/91/14/06/1071911406.db2.gz ZHFXCWBEBOCSMN-UHFFFAOYSA-N 1 1 369.429 2.905 20 5 FFBDMO C[N@@H+]1CCCC[C@@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC001355068626 1059853407 /nfs/dbraw/zinc/85/34/07/1059853407.db2.gz KOBDCUANLPTHOG-MRVPVSSYSA-N 1 1 362.249 2.633 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC001355068626 1059853426 /nfs/dbraw/zinc/85/34/26/1059853426.db2.gz KOBDCUANLPTHOG-MRVPVSSYSA-N 1 1 362.249 2.633 20 5 FFBDMO C[N@@H+](CCc1nccc(C(F)(F)F)n1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001355083153 1059871231 /nfs/dbraw/zinc/87/12/31/1059871231.db2.gz DCIAMDXCJGFKCB-ZDUSSCGKSA-N 1 1 370.331 2.612 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)OCCO1 ZINC000848484455 1060129651 /nfs/dbraw/zinc/12/96/51/1060129651.db2.gz LGJMKVSUQZSCTM-INIZCTEOSA-N 1 1 372.425 2.891 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(OC2CCC2)CC1 ZINC000848488053 1060136436 /nfs/dbraw/zinc/13/64/36/1060136436.db2.gz FKDUGIBXUYLUAI-IBGZPJMESA-N 1 1 373.453 2.902 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1CN1CC[C@H](c3ccc([N+](=O)[O-])cc3)C1=O)CCOCC2 ZINC000848489098 1060143001 /nfs/dbraw/zinc/14/30/01/1060143001.db2.gz JCZROMWSYNDSHK-MAUKXSAKSA-N 1 1 373.453 2.759 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489553 1060148752 /nfs/dbraw/zinc/14/87/52/1060148752.db2.gz NXFQMCCLLUIAKN-MSOLQXFVSA-N 1 1 361.442 2.758 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489553 1060148758 /nfs/dbraw/zinc/14/87/58/1060148758.db2.gz NXFQMCCLLUIAKN-MSOLQXFVSA-N 1 1 361.442 2.758 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1c(Br)cccc1[N+](=O)[O-] ZINC001458418245 1060585359 /nfs/dbraw/zinc/58/53/59/1060585359.db2.gz YJFWZMHJHIUCLN-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO CN(CCCNc1c(Br)cccc1[N+](=O)[O-])CC[NH+](C)C ZINC001458418245 1060585378 /nfs/dbraw/zinc/58/53/78/1060585378.db2.gz YJFWZMHJHIUCLN-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO C[C@H]1[C@@H](Nc2c3ccc(Br)cc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001458615563 1060634631 /nfs/dbraw/zinc/63/46/31/1060634631.db2.gz RWBAJUOLWPVNOH-CABZTGNLSA-N 1 1 365.231 2.832 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001460845738 1061126284 /nfs/dbraw/zinc/12/62/84/1061126284.db2.gz NFELLXJEZXUHEI-NSHDSACASA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001460845738 1061126288 /nfs/dbraw/zinc/12/62/88/1061126288.db2.gz NFELLXJEZXUHEI-NSHDSACASA-N 1 1 370.247 2.658 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC001461688003 1061378232 /nfs/dbraw/zinc/37/82/32/1061378232.db2.gz QDRJZWAJUJQULL-IBGZPJMESA-N 1 1 352.394 2.778 20 5 FFBDMO CC[N@H+](CCC(F)(F)F)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC001461909369 1061446458 /nfs/dbraw/zinc/44/64/58/1061446458.db2.gz WFERFNNLXJQOAQ-UHFFFAOYSA-N 1 1 364.320 2.921 20 5 FFBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC001461909369 1061446463 /nfs/dbraw/zinc/44/64/63/1061446463.db2.gz WFERFNNLXJQOAQ-UHFFFAOYSA-N 1 1 364.320 2.921 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001479476664 1062454062 /nfs/dbraw/zinc/45/40/62/1062454062.db2.gz NAPCDZOZGWIFTF-RDJZCZTQSA-N 1 1 360.458 2.826 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC001464398479 1062590861 /nfs/dbraw/zinc/59/08/61/1062590861.db2.gz IMYWZMCDJVYILH-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001532594692 1063126823 /nfs/dbraw/zinc/12/68/23/1063126823.db2.gz SRZSRZKHOCKOMC-AWEZNQCLSA-N 1 1 356.426 2.887 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C ZINC001466685103 1063521993 /nfs/dbraw/zinc/52/19/93/1063521993.db2.gz ZKIRUIMKZAPANT-UHFFFAOYSA-N 1 1 358.826 2.646 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC001467805778 1063858487 /nfs/dbraw/zinc/85/84/87/1063858487.db2.gz RLIPGOSYKDVCSW-LBPRGKRZSA-N 1 1 352.822 2.577 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001471788191 1064788997 /nfs/dbraw/zinc/78/89/97/1064788997.db2.gz KFRTXRTUBYHRDT-UHFFFAOYSA-N 1 1 371.422 2.907 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC001472025489 1064896740 /nfs/dbraw/zinc/89/67/40/1064896740.db2.gz CCPOCWIPACFORG-CQSZACIVSA-N 1 1 360.439 2.788 20 5 FFBDMO C[C@@H]1C[NH+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H](C)C1O ZINC001473631395 1065303185 /nfs/dbraw/zinc/30/31/85/1065303185.db2.gz RTAHSEYSQGDHHU-NXEZZACHSA-N 1 1 366.805 2.747 20 5 FFBDMO COCC[N@H+](CCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1OC ZINC001473868752 1065399522 /nfs/dbraw/zinc/39/95/22/1065399522.db2.gz WIHQCWYJKKCCIX-UHFFFAOYSA-N 1 1 368.430 2.784 20 5 FFBDMO COCC[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1OC ZINC001473868752 1065399527 /nfs/dbraw/zinc/39/95/27/1065399527.db2.gz WIHQCWYJKKCCIX-UHFFFAOYSA-N 1 1 368.430 2.784 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2cncn2C(C)(C)C)C1 ZINC001473896399 1065411074 /nfs/dbraw/zinc/41/10/74/1065411074.db2.gz CLRUBLVNMLXSDX-HNNXBMFYSA-N 1 1 360.462 2.931 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001558316374 1075978772 /nfs/dbraw/zinc/97/87/72/1075978772.db2.gz XFAXTOXKZQSKQB-QGZVFWFLSA-N 1 1 373.457 2.784 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1ncc([N+](=O)[O-])c2ccccc21)C(C)C ZINC001559198372 1076134030 /nfs/dbraw/zinc/13/40/30/1076134030.db2.gz MMRKFKIIOCFCFM-INIZCTEOSA-N 1 1 360.414 2.732 20 5 FFBDMO CC[C@]1(C)CCC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001559563253 1076173463 /nfs/dbraw/zinc/17/34/63/1076173463.db2.gz RUDXKBUFUOHHLV-HXUWFJFHSA-N 1 1 374.485 2.756 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC001560077492 1076222810 /nfs/dbraw/zinc/22/28/10/1076222810.db2.gz ODUGDNFBXCDJTP-DOMZBBRYSA-N 1 1 354.248 2.883 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090371 1076224543 /nfs/dbraw/zinc/22/45/43/1076224543.db2.gz RJRGRXNMCQNGHW-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090371 1076224546 /nfs/dbraw/zinc/22/45/46/1076224546.db2.gz RJRGRXNMCQNGHW-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1noc(CN2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)c1[N+](=O)[O-] ZINC001560126965 1076231747 /nfs/dbraw/zinc/23/17/47/1076231747.db2.gz VAFQUAXBZNUJJC-APWZRJJASA-N 1 1 356.426 2.845 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CCCC[N@H+]1CCO ZINC001560841076 1076303305 /nfs/dbraw/zinc/30/33/05/1076303305.db2.gz IHSRIFZVUXUXHX-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CCCC[N@@H+]1CCO ZINC001560841076 1076303307 /nfs/dbraw/zinc/30/33/07/1076303307.db2.gz IHSRIFZVUXUXHX-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO C[NH+](C)Cc1ccc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001566926329 1076989178 /nfs/dbraw/zinc/98/91/78/1076989178.db2.gz BUWYGLPQGRNTPV-UHFFFAOYSA-N 1 1 351.790 2.875 20 5 FFBDMO O=C(NCCC1CC[NH+](CC2CCC3(CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001568125989 1077072877 /nfs/dbraw/zinc/07/28/77/1077072877.db2.gz LNHBACFUCMEBKF-QZTJIDSGSA-N 1 1 363.502 2.840 20 5 FFBDMO O=C(NC1(C[NH2+]CCCc2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570796263 1077231958 /nfs/dbraw/zinc/23/19/58/1077231958.db2.gz KHBNRZDVSJDXNZ-QZTJIDSGSA-N 1 1 359.470 2.693 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3C)CC[NH2+]2)cc1 ZINC001586889375 1079701207 /nfs/dbraw/zinc/70/12/07/1079701207.db2.gz WHBJFAQZTUGJJJ-KRWDZBQOSA-N 1 1 373.384 2.838 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000041902264 249383947 /nfs/dbraw/zinc/38/39/47/249383947.db2.gz XRWFMOSHJLRWDX-UHFFFAOYSA-N 1 1 354.410 2.646 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccncc1)C1CC1 ZINC000093222155 250024366 /nfs/dbraw/zinc/02/43/66/250024366.db2.gz KJTCAXQEXVKGDE-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](CCn4cc([N+](=O)[O-])cn4)C3)nc2c1 ZINC000181141422 251245959 /nfs/dbraw/zinc/24/59/59/251245959.db2.gz BONVUXFTVZULTM-AWEZNQCLSA-N 1 1 354.414 2.856 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272470411 252045549 /nfs/dbraw/zinc/04/55/49/252045549.db2.gz AFPATKFGHWACMD-HKUYNNGSSA-N 1 1 366.421 2.783 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272860075 252149864 /nfs/dbraw/zinc/14/98/64/252149864.db2.gz IFDQXQWILVDYAR-SNVBAGLBSA-N 1 1 357.332 2.994 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(S(N)(=O)=O)c1 ZINC000272891930 252158631 /nfs/dbraw/zinc/15/86/31/252158631.db2.gz XYFZETIBZVAULZ-MRXNPFEDSA-N 1 1 367.402 2.622 20 5 FFBDMO O=C(CC[N@H+]1CCOC2(CCCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000273169138 252238627 /nfs/dbraw/zinc/23/86/27/252238627.db2.gz DJUKYGCLMBJXOV-UHFFFAOYSA-N 1 1 351.378 2.708 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](N3CCCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000285706844 257000870 /nfs/dbraw/zinc/00/08/70/257000870.db2.gz WENXHQLBWCYLER-GOEBONIOSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](N3CCCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000285706844 257000871 /nfs/dbraw/zinc/00/08/71/257000871.db2.gz WENXHQLBWCYLER-GOEBONIOSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(CC[N@H+]1CCCC2(CCOCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000275459384 256010419 /nfs/dbraw/zinc/01/04/19/256010419.db2.gz JRUGYNDJOBVMHC-UHFFFAOYSA-N 1 1 365.405 2.955 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000276037068 256067480 /nfs/dbraw/zinc/06/74/80/256067480.db2.gz SDDNPIRBQAGSCM-HKUYNNGSSA-N 1 1 366.421 2.611 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277381739 256191946 /nfs/dbraw/zinc/19/19/46/256191946.db2.gz WJJUKNHJBWLWDU-SKDRFNHKSA-N 1 1 368.231 2.570 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000277749905 256234839 /nfs/dbraw/zinc/23/48/39/256234839.db2.gz IZFMWWBFQWHGJU-ZDUSSCGKSA-N 1 1 374.445 2.535 20 5 FFBDMO O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000278139432 256281336 /nfs/dbraw/zinc/28/13/36/256281336.db2.gz NHNDRUVTEZNIHU-ZDUSSCGKSA-N 1 1 371.441 2.742 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000278373167 256305236 /nfs/dbraw/zinc/30/52/36/256305236.db2.gz RURJZDISMAOKHV-CYBMUJFWSA-N 1 1 369.849 2.787 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000278569909 256326479 /nfs/dbraw/zinc/32/64/79/256326479.db2.gz XEFBOBNBIPATSI-QJPKHSJYSA-N 1 1 373.453 2.710 20 5 FFBDMO C[C@H](CO)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1CCC1 ZINC000280494459 256525111 /nfs/dbraw/zinc/52/51/11/256525111.db2.gz MNQFBWMIVCTQSK-GFCCVEGCSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936522 257012053 /nfs/dbraw/zinc/01/20/53/257012053.db2.gz LZFVDNGBBGPDGH-KBXCAEBGSA-N 1 1 372.425 2.545 20 5 FFBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936522 257012054 /nfs/dbraw/zinc/01/20/54/257012054.db2.gz LZFVDNGBBGPDGH-KBXCAEBGSA-N 1 1 372.425 2.545 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000286128381 257021685 /nfs/dbraw/zinc/02/16/85/257021685.db2.gz HEGXLIJKCVKZAG-XJKSGUPXSA-N 1 1 374.441 2.538 20 5 FFBDMO CN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286278047 257029043 /nfs/dbraw/zinc/02/90/43/257029043.db2.gz QYEBQPADUOOBTM-NNQSOWQGSA-N 1 1 351.834 2.874 20 5 FFBDMO C[N@H+](Cc1ccccc1)C1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000286307898 257030197 /nfs/dbraw/zinc/03/01/97/257030197.db2.gz KAFKBXUWYOZYQQ-UHFFFAOYSA-N 1 1 365.393 2.564 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000286307898 257030198 /nfs/dbraw/zinc/03/01/98/257030198.db2.gz KAFKBXUWYOZYQQ-UHFFFAOYSA-N 1 1 365.393 2.564 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC000286857152 257058728 /nfs/dbraw/zinc/05/87/28/257058728.db2.gz MREJXVMGTLGMSI-OLZOCXBDSA-N 1 1 362.430 2.841 20 5 FFBDMO O=C([C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1)N1CCCC1 ZINC000287296261 257082198 /nfs/dbraw/zinc/08/21/98/257082198.db2.gz IUWGGORBYKBLQE-OAHLLOKOSA-N 1 1 370.409 2.694 20 5 FFBDMO CCc1nn(C)c(NCc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)c1[N+](=O)[O-] ZINC000288278936 257169181 /nfs/dbraw/zinc/16/91/81/257169181.db2.gz ZVMKFKCQAXKQEU-AWEZNQCLSA-N 1 1 373.457 2.724 20 5 FFBDMO CCc1nn(C)c(NCc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)c1[N+](=O)[O-] ZINC000288278936 257169183 /nfs/dbraw/zinc/16/91/83/257169183.db2.gz ZVMKFKCQAXKQEU-AWEZNQCLSA-N 1 1 373.457 2.724 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)c1 ZINC000289950475 257308164 /nfs/dbraw/zinc/30/81/64/257308164.db2.gz QDJXXHQQOVTENL-OAHLLOKOSA-N 1 1 354.370 2.597 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)c1 ZINC000289950475 257308165 /nfs/dbraw/zinc/30/81/65/257308165.db2.gz QDJXXHQQOVTENL-OAHLLOKOSA-N 1 1 354.370 2.597 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000299437729 257994459 /nfs/dbraw/zinc/99/44/59/257994459.db2.gz HYUOBDHKCJIWQA-ZDUSSCGKSA-N 1 1 371.441 2.788 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000299727288 258020639 /nfs/dbraw/zinc/02/06/39/258020639.db2.gz VESNAXOUJOREPI-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000302510192 258104569 /nfs/dbraw/zinc/10/45/69/258104569.db2.gz NTDYGWTULWEGOR-YRGRVCCFSA-N 1 1 354.838 2.721 20 5 FFBDMO Cc1nc(N[C@@H](C[NH+]2CCN(C)CC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301626805 258059615 /nfs/dbraw/zinc/05/96/15/258059615.db2.gz HOSXESOOAGFMTL-KRWDZBQOSA-N 1 1 355.442 2.699 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(N[C@H]3CCC[N@@H+](Cc4ccccc4)C3)nn21 ZINC000301946207 258077455 /nfs/dbraw/zinc/07/74/55/258077455.db2.gz XKAOWWFQOFCMFT-HNNXBMFYSA-N 1 1 352.398 2.714 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000097617978 132230160 /nfs/dbraw/zinc/23/01/60/132230160.db2.gz TZCQSZPQMPCKGK-HOTGVXAUSA-N 1 1 374.485 2.855 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000366653806 512125414 /nfs/dbraw/zinc/12/54/14/512125414.db2.gz NSQFDURTQVRRIK-AGIUHOORSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000366653806 512125419 /nfs/dbraw/zinc/12/54/19/512125419.db2.gz NSQFDURTQVRRIK-AGIUHOORSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000032369504 506246357 /nfs/dbraw/zinc/24/63/57/506246357.db2.gz LQMIMCKPVNLXDO-HNNXBMFYSA-N 1 1 369.421 2.537 20 5 FFBDMO O=C1C[C@H](c2ccccc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000052836996 506259807 /nfs/dbraw/zinc/25/98/07/506259807.db2.gz NBUVUKUYEZADMQ-LJQANCHMSA-N 1 1 369.421 2.927 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000032540306 506263757 /nfs/dbraw/zinc/26/37/57/506263757.db2.gz INFFOEPGKSYLEP-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000032540306 506263759 /nfs/dbraw/zinc/26/37/59/506263759.db2.gz INFFOEPGKSYLEP-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO O=C(C[N@@H+]1CC[C@]2(C1)CCCOC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000375302710 512257599 /nfs/dbraw/zinc/25/75/99/512257599.db2.gz LKZHOGFOEIIPFJ-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@]2(C1)CCCOC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000375302710 512257605 /nfs/dbraw/zinc/25/76/05/512257605.db2.gz LKZHOGFOEIIPFJ-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@@H+]1CC[C@]2(C1)CCCOC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375302865 512257855 /nfs/dbraw/zinc/25/78/55/512257855.db2.gz MCKVVZQBEIIDIF-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@]2(C1)CCCOC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375302865 512257857 /nfs/dbraw/zinc/25/78/57/512257857.db2.gz MCKVVZQBEIIDIF-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000371231547 512280598 /nfs/dbraw/zinc/28/05/98/512280598.db2.gz PIARUMCMEGJTNI-YOEHRIQHSA-N 1 1 366.368 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000371231547 512280604 /nfs/dbraw/zinc/28/06/04/512280604.db2.gz PIARUMCMEGJTNI-YOEHRIQHSA-N 1 1 366.368 2.658 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000053721429 506435202 /nfs/dbraw/zinc/43/52/02/506435202.db2.gz WYFYAXIHQBTPIL-AWEZNQCLSA-N 1 1 357.414 2.804 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000066377699 506501063 /nfs/dbraw/zinc/50/10/63/506501063.db2.gz JXEBVYCAEYMYPY-NUJGCVRESA-N 1 1 363.458 2.547 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000054645298 506594258 /nfs/dbraw/zinc/59/42/58/506594258.db2.gz OHJGVWIPZNNPHU-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO Cc1ccc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043148056 506708989 /nfs/dbraw/zinc/70/89/89/506708989.db2.gz KKIVHZADLCFMNF-KBPBESRZSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1ccc(NC(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043148051 506709113 /nfs/dbraw/zinc/70/91/13/506709113.db2.gz KKIVHZADLCFMNF-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1ccc(NC(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043148051 506709114 /nfs/dbraw/zinc/70/91/14/506709114.db2.gz KKIVHZADLCFMNF-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO O=C(N=c1[nH]c(C[NH+]2CCCCC2)cs1)c1csc([N+](=O)[O-])c1 ZINC000044313098 506834108 /nfs/dbraw/zinc/83/41/08/506834108.db2.gz QXABTMNIFWWQBN-UHFFFAOYSA-N 1 1 352.441 2.773 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000056039337 506916315 /nfs/dbraw/zinc/91/63/15/506916315.db2.gz UXSSTIRBTZEOKS-UHFFFAOYSA-N 1 1 355.394 2.722 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCOc1ccc(F)cc1 ZINC000015101418 507020063 /nfs/dbraw/zinc/02/00/63/507020063.db2.gz ZDWOGASVNSBRPP-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCOc1ccc(F)cc1 ZINC000015101418 507020069 /nfs/dbraw/zinc/02/00/69/507020069.db2.gz ZDWOGASVNSBRPP-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO C[NH+](C)CCN(Cc1ccccc1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068311184 507181344 /nfs/dbraw/zinc/18/13/44/507181344.db2.gz SYSXZKKUYBJJJM-UHFFFAOYSA-N 1 1 367.409 2.675 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000375435097 512325678 /nfs/dbraw/zinc/32/56/78/512325678.db2.gz WXWIWAJAHLQZAE-CYBMUJFWSA-N 1 1 371.397 2.673 20 5 FFBDMO COc1cc(C)c(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1OC ZINC000022811177 507313716 /nfs/dbraw/zinc/31/37/16/507313716.db2.gz KCUVUGJPXDJXER-UHFFFAOYSA-N 1 1 372.425 2.638 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])cc1OC(F)F ZINC000069249904 507446198 /nfs/dbraw/zinc/44/61/98/507446198.db2.gz KKIDNUQIKMNXSR-GFCCVEGCSA-N 1 1 360.357 2.942 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])cc1OC(F)F ZINC000069249904 507446207 /nfs/dbraw/zinc/44/62/07/507446207.db2.gz KKIDNUQIKMNXSR-GFCCVEGCSA-N 1 1 360.357 2.942 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(=O)c2ccccc2)CC1 ZINC000025826514 507536776 /nfs/dbraw/zinc/53/67/76/507536776.db2.gz WENYOBHUAAPKJR-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000061624322 507628909 /nfs/dbraw/zinc/62/89/09/507628909.db2.gz JELYJNJSHFRYGO-UHFFFAOYSA-N 1 1 366.377 2.784 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)COc1ccccc1[N+](=O)[O-] ZINC000061624307 507629261 /nfs/dbraw/zinc/62/92/61/507629261.db2.gz HTUGWDSVPKLXJX-UHFFFAOYSA-N 1 1 366.377 2.784 20 5 FFBDMO Cc1ccc(OCC[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000027689413 507677423 /nfs/dbraw/zinc/67/74/23/507677423.db2.gz PQAMUQDZUJTHCI-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000027689413 507677429 /nfs/dbraw/zinc/67/74/29/507677429.db2.gz PQAMUQDZUJTHCI-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ncc([N+](=O)[O-])c(N)n1 ZINC000071954946 507728571 /nfs/dbraw/zinc/72/85/71/507728571.db2.gz OKSPTSIMRLAMCQ-CYBMUJFWSA-N 1 1 356.430 2.954 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000029208024 507768558 /nfs/dbraw/zinc/76/85/58/507768558.db2.gz SSTVYBSVJQNOCD-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000052242173 507803973 /nfs/dbraw/zinc/80/39/73/507803973.db2.gz OYXGJAFFAOAGKF-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000072663467 507839343 /nfs/dbraw/zinc/83/93/43/507839343.db2.gz ZVNTVRCBTXKXAG-BZPMIXESSA-N 1 1 361.398 2.915 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000072861824 507865694 /nfs/dbraw/zinc/86/56/94/507865694.db2.gz GSZDWZXFFVFREV-CYBMUJFWSA-N 1 1 351.428 2.720 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000072932699 507874082 /nfs/dbraw/zinc/87/40/82/507874082.db2.gz MMCNFBYGOKDNJY-UHFFFAOYSA-N 1 1 357.370 2.739 20 5 FFBDMO NC(=O)c1ccc(N2CC[NH+](C/C=C/c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000078574697 507884777 /nfs/dbraw/zinc/88/47/77/507884777.db2.gz QXBBZLBNINBDEN-QPJJXVBHSA-N 1 1 366.421 2.529 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000108340220 507888331 /nfs/dbraw/zinc/88/83/31/507888331.db2.gz ZKHITWLDVKQRJE-INIZCTEOSA-N 1 1 363.461 2.613 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000078897469 507915265 /nfs/dbraw/zinc/91/52/65/507915265.db2.gz KJHRZXJAGBCCQE-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO CC(C)CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC[NH+](C)CC1 ZINC000074139566 507992198 /nfs/dbraw/zinc/99/21/98/507992198.db2.gz ZVKRMSTXNQXMRU-UHFFFAOYSA-N 1 1 359.430 2.664 20 5 FFBDMO COc1cc(C[NH+]2CCC([C@@H](C)O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000111287095 508086740 /nfs/dbraw/zinc/08/67/40/508086740.db2.gz NTECCIOIZFFUNR-SNVBAGLBSA-N 1 1 360.357 2.798 20 5 FFBDMO COCC[N@@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093005465 508113718 /nfs/dbraw/zinc/11/37/18/508113718.db2.gz FBQWSUYPWSPCQA-UHFFFAOYSA-N 1 1 354.790 2.949 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[NH+]2Cc3ccccc3-c3ccccc3C2)c1 ZINC000075683526 508128343 /nfs/dbraw/zinc/12/83/43/508128343.db2.gz CETHJKQKRUNKOT-GOSISDBHSA-N 1 1 364.405 2.835 20 5 FFBDMO COCCOc1ccccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534660 508148309 /nfs/dbraw/zinc/14/83/09/508148309.db2.gz CUCRCMAWBAJGSE-INIZCTEOSA-N 1 1 372.425 2.701 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000081572985 508191691 /nfs/dbraw/zinc/19/16/91/508191691.db2.gz TVKWZTJFTUNZDY-CQSZACIVSA-N 1 1 359.430 2.809 20 5 FFBDMO O=C(NCC1(C[NH+]2CCOCC2)CCCCC1)c1ccc([N+](=O)[O-])s1 ZINC000081667374 508203438 /nfs/dbraw/zinc/20/34/38/508203438.db2.gz IQBDIHAARQSLCO-UHFFFAOYSA-N 1 1 367.471 2.669 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000112699516 508210580 /nfs/dbraw/zinc/21/05/80/508210580.db2.gz VOPWXPWCNBFZJQ-OAHLLOKOSA-N 1 1 363.458 2.848 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000114467896 508318665 /nfs/dbraw/zinc/31/86/65/508318665.db2.gz YUFYNVGWXPWFNC-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000114467896 508318667 /nfs/dbraw/zinc/31/86/67/508318667.db2.gz YUFYNVGWXPWFNC-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616514 508379572 /nfs/dbraw/zinc/37/95/72/508379572.db2.gz DXOAVSFATGKKAL-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616514 508379574 /nfs/dbraw/zinc/37/95/74/508379574.db2.gz DXOAVSFATGKKAL-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO CC[N@H+]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152294445 508417239 /nfs/dbraw/zinc/41/72/39/508417239.db2.gz NAFBEPGKHCLLOZ-GFCCVEGCSA-N 1 1 370.247 2.500 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121819393 508424945 /nfs/dbraw/zinc/42/49/45/508424945.db2.gz QQFVUHJLUNAZKK-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121819393 508424949 /nfs/dbraw/zinc/42/49/49/508424949.db2.gz QQFVUHJLUNAZKK-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H](O)C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668625 508490534 /nfs/dbraw/zinc/49/05/34/508490534.db2.gz NGVQRVTYZJITOK-SDDRHHMPSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](O)C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668625 508490539 /nfs/dbraw/zinc/49/05/39/508490539.db2.gz NGVQRVTYZJITOK-SDDRHHMPSA-N 1 1 355.822 2.811 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000116756599 508554888 /nfs/dbraw/zinc/55/48/88/508554888.db2.gz RDSGSWQWOVSSBX-AWEZNQCLSA-N 1 1 367.833 2.618 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)cc1SC ZINC000153712550 508632717 /nfs/dbraw/zinc/63/27/17/508632717.db2.gz ALHYWABMTZEHMY-CQSZACIVSA-N 1 1 367.471 2.738 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)cc1SC ZINC000153712550 508632720 /nfs/dbraw/zinc/63/27/20/508632720.db2.gz ALHYWABMTZEHMY-CQSZACIVSA-N 1 1 367.471 2.738 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1SC ZINC000123207318 508652046 /nfs/dbraw/zinc/65/20/46/508652046.db2.gz SLUFCUOHQUGOLZ-RYUDHWBXSA-N 1 1 367.471 2.880 20 5 FFBDMO CC(=O)c1ccc(OC[C@H](O)C[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000153845019 508660818 /nfs/dbraw/zinc/66/08/18/508660818.db2.gz CJHCMUYROYKJHO-QGZVFWFLSA-N 1 1 358.394 2.669 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1cnn(C)c1 ZINC000371458238 512413512 /nfs/dbraw/zinc/41/35/12/512413512.db2.gz JXSAAUQJQXIBIB-WMZOPIPTSA-N 1 1 374.441 2.815 20 5 FFBDMO C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000119221005 508750890 /nfs/dbraw/zinc/75/08/90/508750890.db2.gz YXMVTFZVOQHWMA-INIZCTEOSA-N 1 1 370.453 2.957 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000123897485 508754917 /nfs/dbraw/zinc/75/49/17/508754917.db2.gz WUGIBFBYAQTXEI-SKDRFNHKSA-N 1 1 368.231 2.712 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000144317433 508837288 /nfs/dbraw/zinc/83/72/88/508837288.db2.gz BKVSKLKRIXHOCY-JTQLQIEISA-N 1 1 373.331 2.502 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1CCOC ZINC000130937862 508867800 /nfs/dbraw/zinc/86/78/00/508867800.db2.gz DWZSTBQTLCMNQF-HNNXBMFYSA-N 1 1 374.441 2.649 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cc(Br)cs1 ZINC000131188542 508897126 /nfs/dbraw/zinc/89/71/26/508897126.db2.gz PEDSURXLEYGOFD-UHFFFAOYSA-N 1 1 372.244 2.713 20 5 FFBDMO Cc1sc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000124899535 508902673 /nfs/dbraw/zinc/90/26/73/508902673.db2.gz AJSBWQYURJVQNU-OLZOCXBDSA-N 1 1 373.500 2.601 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+](CCCO)[C@H]1CCCc2ccccc21 ZINC000159871062 508904079 /nfs/dbraw/zinc/90/40/79/508904079.db2.gz FEHFGWSFOGTRTO-IBGZPJMESA-N 1 1 371.437 2.519 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120058647 508918858 /nfs/dbraw/zinc/91/88/58/508918858.db2.gz ZTBSXGKZNGLNPN-HDICACEKSA-N 1 1 360.502 2.628 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155138002 508932052 /nfs/dbraw/zinc/93/20/52/508932052.db2.gz SLORYHVQIPAHNS-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155138002 508932053 /nfs/dbraw/zinc/93/20/53/508932053.db2.gz SLORYHVQIPAHNS-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000120242591 508956645 /nfs/dbraw/zinc/95/66/45/508956645.db2.gz ULMIKCCQDNJJMC-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])c(N2CCCC2)[nH+]1 ZINC000120421904 508992326 /nfs/dbraw/zinc/99/23/26/508992326.db2.gz ZMHRSNKZMZFFTC-UHFFFAOYSA-N 1 1 356.382 2.534 20 5 FFBDMO C[C@@]1(CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCC[N@H+]1Cc1ccccc1 ZINC000160795149 509034238 /nfs/dbraw/zinc/03/42/38/509034238.db2.gz ITSUQWHOMYRWGE-IBGZPJMESA-N 1 1 369.425 2.555 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(OC(F)(F)F)c1 ZINC000132580916 509048227 /nfs/dbraw/zinc/04/82/27/509048227.db2.gz BNIHPIWTMMFFPY-UHFFFAOYSA-N 1 1 371.315 2.787 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000121012716 509110120 /nfs/dbraw/zinc/11/01/20/509110120.db2.gz KPCQBXPRDTZJFX-HNNXBMFYSA-N 1 1 371.441 2.727 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)n1 ZINC000133120503 509119160 /nfs/dbraw/zinc/11/91/60/509119160.db2.gz HDBCORSBCJZHQD-CYBMUJFWSA-N 1 1 350.806 2.988 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000121142510 509137293 /nfs/dbraw/zinc/13/72/93/509137293.db2.gz OVHFKANFQQPYBI-UHFFFAOYSA-N 1 1 358.236 2.736 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000126854869 509138544 /nfs/dbraw/zinc/13/85/44/509138544.db2.gz WRKMBYVTEQJAAS-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000126854869 509138549 /nfs/dbraw/zinc/13/85/49/509138549.db2.gz WRKMBYVTEQJAAS-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185493499 509205505 /nfs/dbraw/zinc/20/55/05/509205505.db2.gz HQVCUOVUSKXFRS-SCLBCKFNSA-N 1 1 353.382 2.560 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000185497525 509207146 /nfs/dbraw/zinc/20/71/46/509207146.db2.gz MGKGLZGKJKENPA-CYBMUJFWSA-N 1 1 374.466 2.634 20 5 FFBDMO Cc1cc(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000172750400 509210549 /nfs/dbraw/zinc/21/05/49/509210549.db2.gz LZDIGSUGQVPHJK-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NCCC[N@H+]1CCc2ccccc2C1 ZINC000172769938 509225649 /nfs/dbraw/zinc/22/56/49/509225649.db2.gz WGMNHIWOOZQWEK-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO CC[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000182450101 509244490 /nfs/dbraw/zinc/24/44/90/509244490.db2.gz BXBBBGAWJMGZNX-HNNXBMFYSA-N 1 1 367.427 2.714 20 5 FFBDMO CC(C)(O)C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182472032 509255268 /nfs/dbraw/zinc/25/52/68/509255268.db2.gz XNPHGFBUTCIZJK-KRWDZBQOSA-N 1 1 374.437 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)o2)cc1 ZINC000266920027 509259657 /nfs/dbraw/zinc/25/96/57/509259657.db2.gz LPYZYWOJMDGIRM-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO CCOc1cc(NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)ncn1 ZINC000185666440 509295135 /nfs/dbraw/zinc/29/51/35/509295135.db2.gz JXUNQDBGZUSEGS-UHFFFAOYSA-N 1 1 357.414 2.860 20 5 FFBDMO C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697402 509310793 /nfs/dbraw/zinc/31/07/93/509310793.db2.gz ZUKWNLUWLYRZKR-HUUCEWRRSA-N 1 1 360.458 2.776 20 5 FFBDMO C[C@H](C[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000248461068 509332936 /nfs/dbraw/zinc/33/29/36/509332936.db2.gz OUYCLKPUDCHDFI-DOMZBBRYSA-N 1 1 360.439 2.892 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000248461068 509332939 /nfs/dbraw/zinc/33/29/39/509332939.db2.gz OUYCLKPUDCHDFI-DOMZBBRYSA-N 1 1 360.439 2.892 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000248478463 509338228 /nfs/dbraw/zinc/33/82/28/509338228.db2.gz ZGQWUVITVCSOHD-IAGOWNOFSA-N 1 1 364.442 2.758 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000248476489 509338828 /nfs/dbraw/zinc/33/88/28/509338828.db2.gz YHXLUNLNINXNMU-ROUUACIJSA-N 1 1 356.422 2.824 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3C)CC2)c1 ZINC000163140321 509344019 /nfs/dbraw/zinc/34/40/19/509344019.db2.gz YNAHHRGYMWXBPJ-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192176015 509390044 /nfs/dbraw/zinc/39/00/44/509390044.db2.gz OFEQTCRIXCNVLJ-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000229973446 509431247 /nfs/dbraw/zinc/43/12/47/509431247.db2.gz JODBIPFOZHJHBQ-CHWSQXEVSA-N 1 1 350.419 2.845 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000163885006 509436614 /nfs/dbraw/zinc/43/66/14/509436614.db2.gz MUHUECGMMKKNGI-HNNXBMFYSA-N 1 1 358.442 2.753 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc[nH+]c(N(C)C)c2)cc1OC ZINC000267316971 509444826 /nfs/dbraw/zinc/44/48/26/509444826.db2.gz OVPCSIXTOJMOAV-UHFFFAOYSA-N 1 1 360.370 2.715 20 5 FFBDMO CN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000182870556 509468213 /nfs/dbraw/zinc/46/82/13/509468213.db2.gz LXMBCYISDPMVJI-GFCCVEGCSA-N 1 1 357.863 2.893 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 ZINC000173353223 509549340 /nfs/dbraw/zinc/54/93/40/509549340.db2.gz LILSXLFDWVYFNM-QFBILLFUSA-N 1 1 369.425 2.861 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000268120188 509767547 /nfs/dbraw/zinc/76/75/47/509767547.db2.gz KREZYWINYIDATD-GJZGRUSLSA-N 1 1 352.822 2.674 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180170766 509790831 /nfs/dbraw/zinc/79/08/31/509790831.db2.gz UZUJYEKQINDYBV-YPMHNXCESA-N 1 1 374.384 2.983 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000268183532 509800785 /nfs/dbraw/zinc/80/07/85/509800785.db2.gz LXOGJEQWMGNUEF-ZANVPECISA-N 1 1 357.332 2.826 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000176987502 509801859 /nfs/dbraw/zinc/80/18/59/509801859.db2.gz BCMXWLFMFANMPG-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177011080 509816788 /nfs/dbraw/zinc/81/67/88/509816788.db2.gz AMFUSPSGNCNLQE-JTQLQIEISA-N 1 1 368.231 2.571 20 5 FFBDMO CN(C(=O)C[N@@H+](Cc1ccccc1)CC(C)(C)O)c1ccc([N+](=O)[O-])cc1 ZINC000180219366 509818484 /nfs/dbraw/zinc/81/84/84/509818484.db2.gz UXWOTZOYZSLGIJ-UHFFFAOYSA-N 1 1 371.437 2.831 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000189936275 509838153 /nfs/dbraw/zinc/83/81/53/509838153.db2.gz STSHOZNOURCABY-HNNXBMFYSA-N 1 1 365.474 2.659 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000183601606 509881010 /nfs/dbraw/zinc/88/10/10/509881010.db2.gz FDCQRCNRTCRCCL-OAHLLOKOSA-N 1 1 355.398 2.776 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CCC(OC)CC1 ZINC000265205018 509920719 /nfs/dbraw/zinc/92/07/19/509920719.db2.gz KOLXFOPGSHABLX-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO COC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000190081154 509927270 /nfs/dbraw/zinc/92/72/70/509927270.db2.gz AFNBHUYPKIIASW-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000245468177 509954156 /nfs/dbraw/zinc/95/41/56/509954156.db2.gz ZVNTVRCBTXKXAG-MBNYWOFBSA-N 1 1 361.398 2.915 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnc(N3CCOCC3)s2)c(Cl)c1 ZINC000183804267 509983728 /nfs/dbraw/zinc/98/37/28/509983728.db2.gz VKFBGUQQJZQBDU-UHFFFAOYSA-N 1 1 368.846 2.831 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000193766316 510058533 /nfs/dbraw/zinc/05/85/33/510058533.db2.gz XRXKHKNBSYWOIO-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000193813045 510083394 /nfs/dbraw/zinc/08/33/94/510083394.db2.gz XKJVGNGSELAXNC-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC000193823596 510086311 /nfs/dbraw/zinc/08/63/11/510086311.db2.gz VTOOZZIKUQCEGS-UHFFFAOYSA-N 1 1 357.414 2.642 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261864695 510093088 /nfs/dbraw/zinc/09/30/88/510093088.db2.gz WQUDMJXRZMISPB-GUYCJALGSA-N 1 1 372.450 2.644 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261864698 510093705 /nfs/dbraw/zinc/09/37/05/510093705.db2.gz WQUDMJXRZMISPB-SUMWQHHRSA-N 1 1 372.450 2.644 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC[C@H]21 ZINC000245706209 510098241 /nfs/dbraw/zinc/09/82/41/510098241.db2.gz DHWCIFDAUQDTRA-XJKSGUPXSA-N 1 1 354.410 2.699 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000261906326 510110105 /nfs/dbraw/zinc/11/01/05/510110105.db2.gz GZYWHBKLSRCPQO-QGZVFWFLSA-N 1 1 373.384 2.919 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000245727714 510111667 /nfs/dbraw/zinc/11/16/67/510111667.db2.gz DWEBMEDYAGHEMA-OCCSQVGLSA-N 1 1 360.382 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000245727714 510111673 /nfs/dbraw/zinc/11/16/73/510111673.db2.gz DWEBMEDYAGHEMA-OCCSQVGLSA-N 1 1 360.382 2.903 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245747718 510123919 /nfs/dbraw/zinc/12/39/19/510123919.db2.gz NEXZDZKYNBWMQE-YJBOKZPZSA-N 1 1 356.426 2.996 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CCC(N)=O)Cc1ccccc1 ZINC000177643198 510175706 /nfs/dbraw/zinc/17/57/06/510175706.db2.gz QFLUITJRILNQQB-UHFFFAOYSA-N 1 1 357.410 2.871 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCC(N)=O)Cc1ccccc1 ZINC000177643198 510175714 /nfs/dbraw/zinc/17/57/14/510175714.db2.gz QFLUITJRILNQQB-UHFFFAOYSA-N 1 1 357.410 2.871 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000245873998 510181697 /nfs/dbraw/zinc/18/16/97/510181697.db2.gz AIGUOKOHBCUSGD-GXFFZTMASA-N 1 1 357.357 2.608 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000245882411 510185261 /nfs/dbraw/zinc/18/52/61/510185261.db2.gz IITARBGUGPMJJC-BBRMVZONSA-N 1 1 354.410 2.699 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1 ZINC000245929014 510213823 /nfs/dbraw/zinc/21/38/23/510213823.db2.gz IPEAQTFDEDSXDG-UYAOXDASSA-N 1 1 372.469 2.887 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CC2(O)CCCCCC2)c([N+](=O)[O-])c1 ZINC000187363820 510220320 /nfs/dbraw/zinc/22/03/20/510220320.db2.gz HSSMOQNZWJQDHO-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO CCCO[C@@H]1CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000246016828 510250980 /nfs/dbraw/zinc/25/09/80/510250980.db2.gz KBRIBVHRNLJJMP-MSOLQXFVSA-N 1 1 361.442 2.981 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1CN1CCCC1 ZINC000171708304 510322237 /nfs/dbraw/zinc/32/22/37/510322237.db2.gz IUVGNSAWTBPEDZ-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000171708304 510322242 /nfs/dbraw/zinc/32/22/42/510322242.db2.gz IUVGNSAWTBPEDZ-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000265976807 510335314 /nfs/dbraw/zinc/33/53/14/510335314.db2.gz CBLWPFRAHHJDQF-INIZCTEOSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181384222 510383726 /nfs/dbraw/zinc/38/37/26/510383726.db2.gz HEQBQSQEXSRFFN-LBPRGKRZSA-N 1 1 352.387 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(O)(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000194706397 510488650 /nfs/dbraw/zinc/48/86/50/510488650.db2.gz LJVMQZZSWINYEG-UHFFFAOYSA-N 1 1 357.366 2.987 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](CO)c1ccccc1 ZINC000269628914 510489986 /nfs/dbraw/zinc/48/99/86/510489986.db2.gz VUFUXKIEGJUEAN-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000181642998 510518480 /nfs/dbraw/zinc/51/84/80/510518480.db2.gz KIRWGOWTMCOJNK-MRXNPFEDSA-N 1 1 360.435 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000181642998 510518486 /nfs/dbraw/zinc/51/84/86/510518486.db2.gz KIRWGOWTMCOJNK-MRXNPFEDSA-N 1 1 360.435 2.858 20 5 FFBDMO COc1ccc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181675439 510534253 /nfs/dbraw/zinc/53/42/53/510534253.db2.gz KRPPUPZSWBOKND-HIFRSBDPSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000188009220 510547595 /nfs/dbraw/zinc/54/75/95/510547595.db2.gz QUNZQBPLYFRETG-MEDUHNTESA-N 1 1 355.822 2.670 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000246557759 510554768 /nfs/dbraw/zinc/55/47/68/510554768.db2.gz KKPFGRXNODKAOL-IAGOWNOFSA-N 1 1 373.409 2.739 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1C[C@@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000246557759 510554774 /nfs/dbraw/zinc/55/47/74/510554774.db2.gz KKPFGRXNODKAOL-IAGOWNOFSA-N 1 1 373.409 2.739 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[N@@H+](C)CC12CCCCC2 ZINC000175313163 510583840 /nfs/dbraw/zinc/58/38/40/510583840.db2.gz LTTRWFUKOGNCMH-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000175313163 510583843 /nfs/dbraw/zinc/58/38/43/510583843.db2.gz LTTRWFUKOGNCMH-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC[C@H]2Cn2c(C)nc3ccccc32)c1[N+](=O)[O-] ZINC000270024865 510643047 /nfs/dbraw/zinc/64/30/47/510643047.db2.gz AHIWMTFDBZPYSQ-ZDUSSCGKSA-N 1 1 368.397 2.589 20 5 FFBDMO COc1ccc([C@@H]2CCCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000246801945 510681918 /nfs/dbraw/zinc/68/19/18/510681918.db2.gz VNMKFJPFVAOCNP-MJGOQNOKSA-N 1 1 374.441 2.778 20 5 FFBDMO COc1ccc(CNC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000266685899 510729015 /nfs/dbraw/zinc/72/90/15/510729015.db2.gz DLKYZUXPJGSSHN-OAHLLOKOSA-N 1 1 364.446 2.619 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182063189 510735974 /nfs/dbraw/zinc/73/59/74/510735974.db2.gz QDDSAHUTUMPKOC-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182063189 510735981 /nfs/dbraw/zinc/73/59/81/510735981.db2.gz QDDSAHUTUMPKOC-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000270389080 510788441 /nfs/dbraw/zinc/78/84/41/510788441.db2.gz AHYSWJDDRBRUDA-CJNGLKHVSA-N 1 1 357.414 2.617 20 5 FFBDMO CCc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000247531746 510864749 /nfs/dbraw/zinc/86/47/49/510864749.db2.gz OGSLSUSBVGTMMU-LXZKKBNFSA-N 1 1 362.430 2.781 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC000364452918 510874315 /nfs/dbraw/zinc/87/43/15/510874315.db2.gz XPWZHBZQRDAQFE-LJQANCHMSA-N 1 1 353.378 2.569 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000360306199 510895717 /nfs/dbraw/zinc/89/57/17/510895717.db2.gz SWLRGOVHKKUYKE-CQSZACIVSA-N 1 1 357.414 2.537 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000270607713 510922678 /nfs/dbraw/zinc/92/26/78/510922678.db2.gz DWFFNIBEBHYFFG-QFBILLFUSA-N 1 1 373.384 2.674 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000282394876 510959095 /nfs/dbraw/zinc/95/90/95/510959095.db2.gz XPHDCCNQKOGWRX-AWEZNQCLSA-N 1 1 367.471 2.546 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000364601366 510964229 /nfs/dbraw/zinc/96/42/29/510964229.db2.gz HAJWKJPTUXWPAF-UHFFFAOYSA-N 1 1 370.335 2.823 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000361035445 510983859 /nfs/dbraw/zinc/98/38/59/510983859.db2.gz ZQBGNAVEJWZFSK-AUUYWEPGSA-N 1 1 368.437 2.939 20 5 FFBDMO COCc1ccccc1CNC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483269 510996396 /nfs/dbraw/zinc/99/63/96/510996396.db2.gz PCCYOBPTPGQLBL-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1ccccc1CNC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282483269 510996401 /nfs/dbraw/zinc/99/64/01/510996401.db2.gz PCCYOBPTPGQLBL-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO CC(C)[NH+]1CCC(N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000294233115 510998611 /nfs/dbraw/zinc/99/86/11/510998611.db2.gz BJASZNWHEYVONB-UHFFFAOYSA-N 1 1 371.441 2.930 20 5 FFBDMO Cc1c(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000270845058 511002745 /nfs/dbraw/zinc/00/27/45/511002745.db2.gz FTWHVPQLJLNPDI-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)ccc1Br ZINC000271138875 511093817 /nfs/dbraw/zinc/09/38/17/511093817.db2.gz BLGWJYCBDHNFNK-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](C3OCCO3)C2)ccc1Br ZINC000271138875 511093821 /nfs/dbraw/zinc/09/38/21/511093821.db2.gz BLGWJYCBDHNFNK-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@@H](O)C3)o2)c(Cl)c1 ZINC000294679612 511140477 /nfs/dbraw/zinc/14/04/77/511140477.db2.gz BLCMWQFTBFAFGU-LBPRGKRZSA-N 1 1 352.774 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC[C@@H](O)C3)o2)c(Cl)c1 ZINC000294679612 511140484 /nfs/dbraw/zinc/14/04/84/511140484.db2.gz BLCMWQFTBFAFGU-LBPRGKRZSA-N 1 1 352.774 2.701 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000271471815 511215882 /nfs/dbraw/zinc/21/58/82/511215882.db2.gz YYHXMIBYMRTMHW-CYBMUJFWSA-N 1 1 357.414 2.955 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(-n2cc[nH+]c2C)nc1 ZINC000365188697 511307613 /nfs/dbraw/zinc/30/76/13/511307613.db2.gz FEXJZAHHIOYYJU-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000291998187 511423586 /nfs/dbraw/zinc/42/35/86/511423586.db2.gz NSFOJSFPIDJNAH-CYBMUJFWSA-N 1 1 367.446 2.852 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272215348 511468269 /nfs/dbraw/zinc/46/82/69/511468269.db2.gz QVFCPHGZOPYFQZ-UHFFFAOYSA-N 1 1 354.313 2.521 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292131618 511476541 /nfs/dbraw/zinc/47/65/41/511476541.db2.gz LFTUAXIRVUJDKL-SJCJKPOMSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1ccc(NC(=O)Cn2c[nH+]c3c2C[C@@H](C)[C@H](C)C3)c([N+](=O)[O-])c1 ZINC000295716648 511493838 /nfs/dbraw/zinc/49/38/38/511493838.db2.gz GOFGPWQJLSZOIB-VXGBXAGGSA-N 1 1 358.398 2.809 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000299086630 511510087 /nfs/dbraw/zinc/51/00/87/511510087.db2.gz SWHGESNOULEQPW-CVEARBPZSA-N 1 1 358.442 2.552 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)c3ccccc3[N+](=O)[O-])c2)CCO1 ZINC000299203977 511551283 /nfs/dbraw/zinc/55/12/83/511551283.db2.gz AVXTYBKSMLTUIH-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)c3ccccc3[N+](=O)[O-])c2)CCO1 ZINC000299203977 511551286 /nfs/dbraw/zinc/55/12/86/511551286.db2.gz AVXTYBKSMLTUIH-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c1[N+](=O)[O-] ZINC000299460726 511644555 /nfs/dbraw/zinc/64/45/55/511644555.db2.gz YPAICDYBNOLKHE-ZDUSSCGKSA-N 1 1 371.441 2.931 20 5 FFBDMO COc1ccc([C@@H](CCO)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000284230526 511651243 /nfs/dbraw/zinc/65/12/43/511651243.db2.gz VATQDNMPIFNBQB-MRXNPFEDSA-N 1 1 361.354 2.725 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCCCNc2ccc(C)c[nH+]2)c1 ZINC000284249499 511656090 /nfs/dbraw/zinc/65/60/90/511656090.db2.gz COZIWLVBTWMWML-UHFFFAOYSA-N 1 1 358.398 2.929 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318217 511682144 /nfs/dbraw/zinc/68/21/44/511682144.db2.gz AXCHPEWEMUIPBT-NVXWUHKLSA-N 1 1 363.414 2.575 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318217 511682149 /nfs/dbraw/zinc/68/21/49/511682149.db2.gz AXCHPEWEMUIPBT-NVXWUHKLSA-N 1 1 363.414 2.575 20 5 FFBDMO COCC[C@H]1COCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365849933 511686258 /nfs/dbraw/zinc/68/62/58/511686258.db2.gz SYGTVVINYGTRIJ-INIZCTEOSA-N 1 1 361.398 2.530 20 5 FFBDMO COCC[C@H]1COCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365849933 511686265 /nfs/dbraw/zinc/68/62/65/511686265.db2.gz SYGTVVINYGTRIJ-INIZCTEOSA-N 1 1 361.398 2.530 20 5 FFBDMO C[C@@]12CC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000284346497 511691731 /nfs/dbraw/zinc/69/17/31/511691731.db2.gz CMSNOQQVOHNBIB-GXTWGEPZSA-N 1 1 358.225 2.709 20 5 FFBDMO C[C@@]12CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]1C2(Cl)Cl ZINC000284346497 511691739 /nfs/dbraw/zinc/69/17/39/511691739.db2.gz CMSNOQQVOHNBIB-GXTWGEPZSA-N 1 1 358.225 2.709 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](O)C12CCCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000292747215 511705641 /nfs/dbraw/zinc/70/56/41/511705641.db2.gz NOTKRUCOAIOBRD-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](O)C12CCCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000292747215 511705648 /nfs/dbraw/zinc/70/56/48/511705648.db2.gz NOTKRUCOAIOBRD-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO Cc1cc(OCc2nc([C@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348703 511787140 /nfs/dbraw/zinc/78/71/40/511787140.db2.gz GWZNFBDUFZDXNI-CRAIPNDOSA-N 1 1 374.397 2.791 20 5 FFBDMO Cc1cc(OCc2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348703 511787145 /nfs/dbraw/zinc/78/71/45/511787145.db2.gz GWZNFBDUFZDXNI-CRAIPNDOSA-N 1 1 374.397 2.791 20 5 FFBDMO CCOc1ccc(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350381693 511797371 /nfs/dbraw/zinc/79/73/71/511797371.db2.gz FEUGGKRVAUTMBJ-YJBOKZPZSA-N 1 1 374.397 2.969 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388266 511798985 /nfs/dbraw/zinc/79/89/85/511798985.db2.gz KOPBTYOSAQJPCY-YJBOKZPZSA-N 1 1 373.413 2.558 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388266 511798990 /nfs/dbraw/zinc/79/89/90/511798990.db2.gz KOPBTYOSAQJPCY-YJBOKZPZSA-N 1 1 373.413 2.558 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000293015927 511807617 /nfs/dbraw/zinc/80/76/17/511807617.db2.gz KEZDEBRHUPHINE-IBGZPJMESA-N 1 1 363.458 2.962 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000274517046 511861011 /nfs/dbraw/zinc/86/10/11/511861011.db2.gz MNPHGFGWSWKOMX-UHFFFAOYSA-N 1 1 368.455 2.580 20 5 FFBDMO C[C@H]1CN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000293159653 511863635 /nfs/dbraw/zinc/86/36/35/511863635.db2.gz CHKIPYUIBVXCPY-OAHLLOKOSA-N 1 1 360.458 2.653 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)n1 ZINC000284826055 511886762 /nfs/dbraw/zinc/88/67/62/511886762.db2.gz JWQTZJJCFAXNPY-WMLDXEAASA-N 1 1 358.446 2.551 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293336678 511929107 /nfs/dbraw/zinc/92/91/07/511929107.db2.gz YMCNZIDTIDEJKZ-QGZVFWFLSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000281682174 511929834 /nfs/dbraw/zinc/92/98/34/511929834.db2.gz USBQMQWRPAMMRB-HZPDHXFCSA-N 1 1 361.442 2.615 20 5 FFBDMO Cc1ccnc(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)c1[N+](=O)[O-] ZINC000285020048 511971187 /nfs/dbraw/zinc/97/11/87/511971187.db2.gz UYCMJKBVKYGCOT-WMLDXEAASA-N 1 1 358.446 2.551 20 5 FFBDMO CC[N@H+](CCOCCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281924287 512013012 /nfs/dbraw/zinc/01/30/12/512013012.db2.gz AJPCMORUBZNUCI-UHFFFAOYSA-N 1 1 351.428 2.549 20 5 FFBDMO CC[N@@H+](CCOCCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281924287 512013014 /nfs/dbraw/zinc/01/30/14/512013014.db2.gz AJPCMORUBZNUCI-UHFFFAOYSA-N 1 1 351.428 2.549 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCn3c(Cc4ccccc4)nnc3C2)cc1 ZINC000377854352 512484897 /nfs/dbraw/zinc/48/48/97/512484897.db2.gz DGLZBZUQDMPIAT-UHFFFAOYSA-N 1 1 363.421 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCn3c(Cc4ccccc4)nnc3C2)cc1 ZINC000377854352 512484902 /nfs/dbraw/zinc/48/49/02/512484902.db2.gz DGLZBZUQDMPIAT-UHFFFAOYSA-N 1 1 363.421 2.835 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771683 512498598 /nfs/dbraw/zinc/49/85/98/512498598.db2.gz ILLYWIRJUYZEMR-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771683 512498601 /nfs/dbraw/zinc/49/86/01/512498601.db2.gz ILLYWIRJUYZEMR-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOC[C@H]2CC(C)C)c([N+](=O)[O-])c1 ZINC000411277650 512557725 /nfs/dbraw/zinc/55/77/25/512557725.db2.gz IVKZNWKZSMWYHL-CQSZACIVSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOC[C@@H]2CC(C)C)c([N+](=O)[O-])c1 ZINC000411277648 512557862 /nfs/dbraw/zinc/55/78/62/512557862.db2.gz IVKZNWKZSMWYHL-AWEZNQCLSA-N 1 1 365.430 2.679 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCOC[C@H]3[C@H]3CCCO3)o2)c1 ZINC000367571798 512564200 /nfs/dbraw/zinc/56/42/00/512564200.db2.gz BZGBAPJVVIFROO-DLBZAZTESA-N 1 1 373.409 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOC[C@H]3[C@H]3CCCO3)o2)c1 ZINC000367571798 512564204 /nfs/dbraw/zinc/56/42/04/512564204.db2.gz BZGBAPJVVIFROO-DLBZAZTESA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000369708255 512565240 /nfs/dbraw/zinc/56/52/40/512565240.db2.gz AQFLDBIPRADGPC-INIZCTEOSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ccc([C@H](C)NCC(=O)NC2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000411475211 512653102 /nfs/dbraw/zinc/65/31/02/512653102.db2.gz NJHVQHPXABDNTJ-HNNXBMFYSA-N 1 1 362.474 2.543 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CC(N2CCCCC2)C1 ZINC000370131672 512783185 /nfs/dbraw/zinc/78/31/85/512783185.db2.gz LANIQWLLXSTZHN-MXWWQKGMSA-N 1 1 360.458 2.918 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC1CC([NH+]2CCCCC2)C1 ZINC000370131672 512783189 /nfs/dbraw/zinc/78/31/89/512783189.db2.gz LANIQWLLXSTZHN-MXWWQKGMSA-N 1 1 360.458 2.918 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000376483653 512838312 /nfs/dbraw/zinc/83/83/12/512838312.db2.gz FZAGFKXJGLDFIV-CYBMUJFWSA-N 1 1 358.398 2.807 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(N3CCC[C@@H](c4[nH+]cc5n4CCCC5)C3)nn21 ZINC000374491980 512857522 /nfs/dbraw/zinc/85/75/22/512857522.db2.gz JPEXLDJBOAEIKC-CYBMUJFWSA-N 1 1 367.413 2.554 20 5 FFBDMO C[C@]1(CNC(=O)c2cccc([N+](=O)[O-])c2N)CCC[N@H+]1Cc1ccccc1 ZINC000397919618 512950243 /nfs/dbraw/zinc/95/02/43/512950243.db2.gz PCRURJYWWQGKBI-HXUWFJFHSA-N 1 1 368.437 2.962 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[NH2+]2)cc1 ZINC000374812251 513015363 /nfs/dbraw/zinc/01/53/63/513015363.db2.gz QQVNLWLUTWZCGM-KRWDZBQOSA-N 1 1 372.400 2.665 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000368610446 513023967 /nfs/dbraw/zinc/02/39/67/513023967.db2.gz CHEVBCSSYJJOJF-HOCLYGCPSA-N 1 1 354.410 2.881 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000368610444 513024606 /nfs/dbraw/zinc/02/46/06/513024606.db2.gz CHEVBCSSYJJOJF-GDBMZVCRSA-N 1 1 354.410 2.881 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1F ZINC000412299952 513029209 /nfs/dbraw/zinc/02/92/09/513029209.db2.gz HTOJCYNREKGXAT-HNNXBMFYSA-N 1 1 367.421 2.522 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000412371749 513056763 /nfs/dbraw/zinc/05/67/63/513056763.db2.gz YQOCRIFTQOZLOO-HLULTAIVSA-N 1 1 357.454 2.887 20 5 FFBDMO Cc1nc(NCC2([N@H+]3CCOC(C)(C)C3)CCCCC2)ncc1[N+](=O)[O-] ZINC000450325524 513145259 /nfs/dbraw/zinc/14/52/59/513145259.db2.gz DMZBBDWTYWKZAV-UHFFFAOYSA-N 1 1 363.462 2.919 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000439697706 513166757 /nfs/dbraw/zinc/16/67/57/513166757.db2.gz QCHKVPYRPREYJL-AWEZNQCLSA-N 1 1 359.430 2.711 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000439697706 513166762 /nfs/dbraw/zinc/16/67/62/513166762.db2.gz QCHKVPYRPREYJL-AWEZNQCLSA-N 1 1 359.430 2.711 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000439697706 513166768 /nfs/dbraw/zinc/16/67/68/513166768.db2.gz QCHKVPYRPREYJL-AWEZNQCLSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C1CCN(C)CC1 ZINC000450423263 513188403 /nfs/dbraw/zinc/18/84/03/513188403.db2.gz WZPMYUZVYPRDRF-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CCN1C1CC[NH+](C)CC1 ZINC000450423263 513188408 /nfs/dbraw/zinc/18/84/08/513188408.db2.gz WZPMYUZVYPRDRF-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000433957460 513198176 /nfs/dbraw/zinc/19/81/76/513198176.db2.gz AVCVCZUFTGMHLM-SFHVURJKSA-N 1 1 358.442 2.679 20 5 FFBDMO Cn1ccnc1[C@H](NC1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000421367276 513238616 /nfs/dbraw/zinc/23/86/16/513238616.db2.gz DKIIBXXTBLCPDO-LEOMRAHMSA-N 1 1 357.458 2.880 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044408 513266400 /nfs/dbraw/zinc/26/64/00/513266400.db2.gz UHWNZPVDCTYUHB-QMTMVMCOSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044408 513266405 /nfs/dbraw/zinc/26/64/05/513266405.db2.gz UHWNZPVDCTYUHB-QMTMVMCOSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044408 513266411 /nfs/dbraw/zinc/26/64/11/513266411.db2.gz UHWNZPVDCTYUHB-QMTMVMCOSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc(NC[C@H]2CCC[N@H+]2CCCO)c(Br)cc1[N+](=O)[O-] ZINC000450601659 513268870 /nfs/dbraw/zinc/26/88/70/513268870.db2.gz ZCGCTCWFAMQPAP-GFCCVEGCSA-N 1 1 372.263 2.924 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c1 ZINC000446899636 513358804 /nfs/dbraw/zinc/35/88/04/513358804.db2.gz JYBGAKFVTZRUPN-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO C[N@H+]1CCN(CCNc2ccc(Br)cc2[N+](=O)[O-])CC1(C)C ZINC000440647638 513370567 /nfs/dbraw/zinc/37/05/67/513370567.db2.gz HXQXBXUPEKOKMB-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000421739253 513397252 /nfs/dbraw/zinc/39/72/52/513397252.db2.gz AAAVMLJQFXJFDQ-MRXNPFEDSA-N 1 1 363.458 2.688 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccncc1Cl ZINC000421844707 513450847 /nfs/dbraw/zinc/45/08/47/513450847.db2.gz UIGGOSPRWLTYJM-LLVKDONJSA-N 1 1 369.830 2.768 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)o2)cc1 ZINC000441205332 513513015 /nfs/dbraw/zinc/51/30/15/513513015.db2.gz OGZIFMWTPNFVLU-GJZGRUSLSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)o2)cc1 ZINC000441205334 513513217 /nfs/dbraw/zinc/51/32/17/513513217.db2.gz OGZIFMWTPNFVLU-HUUCEWRRSA-N 1 1 358.398 2.893 20 5 FFBDMO C[N@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000425373400 513533868 /nfs/dbraw/zinc/53/38/68/513533868.db2.gz PWIVZQOYMUCDOH-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000425373400 513533874 /nfs/dbraw/zinc/53/38/74/513533874.db2.gz PWIVZQOYMUCDOH-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CC[NH+](Cc4cccc(F)c4)CC3)nc2c1 ZINC000447677162 513540011 /nfs/dbraw/zinc/54/00/11/513540011.db2.gz FAEFHGSOBDHYDX-UHFFFAOYSA-N 1 1 355.373 2.932 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000441438329 513568030 /nfs/dbraw/zinc/56/80/30/513568030.db2.gz JMKKKFVKAHQLBA-IEBWSBKVSA-N 1 1 364.442 2.758 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000451215950 513599393 /nfs/dbraw/zinc/59/93/93/513599393.db2.gz KIKGUIWHZJWMKN-UHFFFAOYSA-N 1 1 361.442 2.796 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000419007412 513714380 /nfs/dbraw/zinc/71/43/80/513714380.db2.gz RMTYSHRCJLIIKA-LSDHHAIUSA-N 1 1 356.426 2.548 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@H]3O)o2)cc1 ZINC000451413367 513733718 /nfs/dbraw/zinc/73/37/18/513733718.db2.gz GYWMJTHVVZRYPU-ARFHVFGLSA-N 1 1 358.398 2.770 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451545454 513824229 /nfs/dbraw/zinc/82/42/29/513824229.db2.gz RBCWNEFVYIAMFH-CXAGYDPISA-N 1 1 365.430 2.679 20 5 FFBDMO O=c1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc2ccccn12 ZINC000451554059 513830491 /nfs/dbraw/zinc/83/04/91/513830491.db2.gz YWUWKWYRMLQBNM-MRXNPFEDSA-N 1 1 364.405 2.982 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](C)C1)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436426710 513852054 /nfs/dbraw/zinc/85/20/54/513852054.db2.gz XXBOSNMGUVYIPU-ZDUSSCGKSA-N 1 1 367.424 2.844 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)C1CCCCC1 ZINC000448805001 513907047 /nfs/dbraw/zinc/90/70/47/513907047.db2.gz LVWSDKNYFZAKGG-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO COC(=O)c1cnc([C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000414069234 513962436 /nfs/dbraw/zinc/96/24/36/513962436.db2.gz BNEPXVAERYEGDX-SNVBAGLBSA-N 1 1 351.384 2.568 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@@H](CO)CC(C)(C)C ZINC000451791518 513983223 /nfs/dbraw/zinc/98/32/23/513983223.db2.gz QAXLMMDXGCFFDC-CQSZACIVSA-N 1 1 365.430 2.622 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431943343 514048103 /nfs/dbraw/zinc/04/81/03/514048103.db2.gz VRGJUDGJLHOTPZ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414325614 514048887 /nfs/dbraw/zinc/04/88/87/514048887.db2.gz MLMXKPFEUASLIO-SNVBAGLBSA-N 1 1 361.427 2.831 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CCN2CCOCC2)Cc2ccco2)cc1 ZINC000452052007 514163453 /nfs/dbraw/zinc/16/34/53/514163453.db2.gz VEJYTGIJLDFHFD-UHFFFAOYSA-N 1 1 359.426 2.565 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nn(C)cc1Br ZINC000449483134 514224780 /nfs/dbraw/zinc/22/47/80/514224780.db2.gz GPRCQGKFEVIMII-SNVBAGLBSA-N 1 1 353.220 2.812 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000414656226 514225179 /nfs/dbraw/zinc/22/51/79/514225179.db2.gz ICFFGNRCKLKNCR-MRXNPFEDSA-N 1 1 356.382 2.782 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438022928 514289721 /nfs/dbraw/zinc/28/97/21/514289721.db2.gz ZCODOCYHLWJOGL-SJLPKXTDSA-N 1 1 358.442 2.896 20 5 FFBDMO C[C@H](Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000433095518 514379656 /nfs/dbraw/zinc/37/96/56/514379656.db2.gz YLUBMWDXBNJHAP-ZDUSSCGKSA-N 1 1 354.410 2.611 20 5 FFBDMO C[C@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000433095518 514379663 /nfs/dbraw/zinc/37/96/63/514379663.db2.gz YLUBMWDXBNJHAP-ZDUSSCGKSA-N 1 1 354.410 2.611 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000415130632 514459165 /nfs/dbraw/zinc/45/91/65/514459165.db2.gz XMAIGQJVSPGSNQ-LPHOPBHVSA-N 1 1 363.458 2.712 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450257542 514568072 /nfs/dbraw/zinc/56/80/72/514568072.db2.gz MCVNBNAXBHXKEN-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO COc1cc(C[NH2+]Cc2ncccc2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000475335997 514626066 /nfs/dbraw/zinc/62/60/66/514626066.db2.gz NQETVEYLUJALNR-UHFFFAOYSA-N 1 1 369.324 2.638 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2CCC(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000475708884 514771624 /nfs/dbraw/zinc/77/16/24/514771624.db2.gz IYDKILTXOZTFPD-UHFFFAOYSA-N 1 1 358.341 2.624 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000479937363 514783441 /nfs/dbraw/zinc/78/34/41/514783441.db2.gz CKDXNMBDWSRFLI-QWHCGFSZSA-N 1 1 369.849 2.816 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000489315717 514792891 /nfs/dbraw/zinc/79/28/91/514792891.db2.gz REZQVKYPECBJOV-WFASDCNBSA-N 1 1 369.849 2.814 20 5 FFBDMO Cc1cc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cn2cc[nH+]c12 ZINC000502887835 514829630 /nfs/dbraw/zinc/82/96/30/514829630.db2.gz LZCAYQSKTLJHMP-UHFFFAOYSA-N 1 1 362.349 2.989 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H]1C ZINC000498555471 514966402 /nfs/dbraw/zinc/96/64/02/514966402.db2.gz QTCVJEMRQKOVCQ-HOTGVXAUSA-N 1 1 374.485 2.752 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)c21 ZINC000480506437 514979970 /nfs/dbraw/zinc/97/99/70/514979970.db2.gz OJQUMCSISVCBOB-INIZCTEOSA-N 1 1 363.421 2.894 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458645591 514984833 /nfs/dbraw/zinc/98/48/33/514984833.db2.gz XPLOMMGFAGOTSG-HNNXBMFYSA-N 1 1 368.865 2.915 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000467469420 515016406 /nfs/dbraw/zinc/01/64/06/515016406.db2.gz WFLDTSRVEDPFLR-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CCn3cc[nH+]c3C2)ncc1[N+](=O)[O-] ZINC000489914299 515029732 /nfs/dbraw/zinc/02/97/32/515029732.db2.gz IYMNXKBQVIVGRY-SECBINFHSA-N 1 1 352.192 2.684 20 5 FFBDMO COc1c(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)cccc1[N+](=O)[O-] ZINC000476451801 515053063 /nfs/dbraw/zinc/05/30/63/515053063.db2.gz JONIMSGEXOZLFI-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000490626216 515266074 /nfs/dbraw/zinc/26/60/74/515266074.db2.gz IFXOVWSFGYXSEL-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000456692600 515356928 /nfs/dbraw/zinc/35/69/28/515356928.db2.gz LXOOKTGALYNVDU-UHFFFAOYSA-N 1 1 365.478 2.853 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000468459451 515368257 /nfs/dbraw/zinc/36/82/57/515368257.db2.gz ILKYCMVTPBKMBI-INIZCTEOSA-N 1 1 372.425 2.699 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000468473558 515374137 /nfs/dbraw/zinc/37/41/37/515374137.db2.gz YEIKWWJJYHTLBR-KRWDZBQOSA-N 1 1 358.442 2.855 20 5 FFBDMO CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c(OCC)c2)CC[N@H+]1CCOC ZINC000499640866 515395860 /nfs/dbraw/zinc/39/58/60/515395860.db2.gz KKLHCUWMYPWHES-MRXNPFEDSA-N 1 1 351.447 2.931 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486596293 515552797 /nfs/dbraw/zinc/55/27/97/515552797.db2.gz GEAWPUMKTVXPCL-LBPRGKRZSA-N 1 1 355.385 2.606 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457027739 515592970 /nfs/dbraw/zinc/59/29/70/515592970.db2.gz PSPSACIZWULCMK-QGZVFWFLSA-N 1 1 361.348 2.589 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000500122177 515599834 /nfs/dbraw/zinc/59/98/34/515599834.db2.gz OALMKLUFYQOBMM-VXGBXAGGSA-N 1 1 367.471 2.880 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000457110644 515657428 /nfs/dbraw/zinc/65/74/28/515657428.db2.gz HZDUORODRDHWOM-LBPRGKRZSA-N 1 1 370.247 2.912 20 5 FFBDMO Cn1c(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000500302984 515660084 /nfs/dbraw/zinc/66/00/84/515660084.db2.gz LYLKKHPDJITYRA-CYBMUJFWSA-N 1 1 362.455 2.637 20 5 FFBDMO COc1ccc(C[NH+]2CC(C)(CO)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000459619919 515698198 /nfs/dbraw/zinc/69/81/98/515698198.db2.gz JTNSHTCNFICHNB-UHFFFAOYSA-N 1 1 372.421 2.997 20 5 FFBDMO COc1cc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cc([N+](=O)[O-])c1OC ZINC000505935798 515729397 /nfs/dbraw/zinc/72/93/97/515729397.db2.gz PYOFQEQJYWRTLF-UHFFFAOYSA-N 1 1 374.397 2.594 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nnc(C(C)(C)C)[nH]1 ZINC000459682969 515741338 /nfs/dbraw/zinc/74/13/38/515741338.db2.gz TZMAFDBMZGQSEO-NSHDSACASA-N 1 1 360.418 2.517 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000487091150 515754841 /nfs/dbraw/zinc/75/48/41/515754841.db2.gz ZETOPVILTNXGLF-KRWDZBQOSA-N 1 1 353.422 2.889 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459812631 515823720 /nfs/dbraw/zinc/82/37/20/515823720.db2.gz RZHREPVHYGZXIU-OLZOCXBDSA-N 1 1 365.430 2.831 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459818738 515827879 /nfs/dbraw/zinc/82/78/79/515827879.db2.gz YNLACTPQWUMUCG-OLZOCXBDSA-N 1 1 365.430 2.831 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000494707811 515934027 /nfs/dbraw/zinc/93/40/27/515934027.db2.gz KYMHTPVUYCNCEN-INIZCTEOSA-N 1 1 350.415 2.873 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000511601300 515957650 /nfs/dbraw/zinc/95/76/50/515957650.db2.gz ZRSXDOISVVACAM-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000501081085 515970689 /nfs/dbraw/zinc/97/06/89/515970689.db2.gz FSHFUCSCMIXAHC-UHFFFAOYSA-N 1 1 369.219 2.741 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000483183939 515973130 /nfs/dbraw/zinc/97/31/30/515973130.db2.gz OJJVKKFDZKNXIC-UHFFFAOYSA-N 1 1 361.398 2.628 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+](CC2CC2)CC2CCC2)cc1 ZINC000483260469 516006706 /nfs/dbraw/zinc/00/67/06/516006706.db2.gz CCEBABPHTCDVKH-UHFFFAOYSA-N 1 1 352.456 2.881 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474583856 516107801 /nfs/dbraw/zinc/10/78/01/516107801.db2.gz VWQYXCSXZWUBBG-UHFFFAOYSA-N 1 1 355.822 2.570 20 5 FFBDMO C[NH+](C)CCN(Cc1cccc(F)c1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507311891 516167510 /nfs/dbraw/zinc/16/75/10/516167510.db2.gz IENAKAVPXWOCGG-UHFFFAOYSA-N 1 1 361.373 2.644 20 5 FFBDMO COc1cc(N2CC[NH+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)CC2)ncn1 ZINC000470207180 516171698 /nfs/dbraw/zinc/17/16/98/516171698.db2.gz BUGRYXCLKXHPRQ-GDNBJRDFSA-N 1 1 369.425 2.619 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000488708656 516290591 /nfs/dbraw/zinc/29/05/91/516290591.db2.gz IEJBHFVBWTXSPM-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CCOC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000488741184 516297970 /nfs/dbraw/zinc/29/79/70/516297970.db2.gz BLZCGOZKVSEBHT-PMUMKWKESA-N 1 1 361.442 2.938 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000557639657 516353599 /nfs/dbraw/zinc/35/35/99/516353599.db2.gz SBFBJSLDKKPBOG-CVEARBPZSA-N 1 1 370.409 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](COC(F)F)C1 ZINC000512822154 516373589 /nfs/dbraw/zinc/37/35/89/516373589.db2.gz FMOOSQJKISBABA-GFCCVEGCSA-N 1 1 357.357 2.793 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637302 516559797 /nfs/dbraw/zinc/55/97/97/516559797.db2.gz RUTNNNZVMUTTGM-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637302 516559802 /nfs/dbraw/zinc/55/98/02/516559802.db2.gz RUTNNNZVMUTTGM-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000554746483 516617739 /nfs/dbraw/zinc/61/77/39/516617739.db2.gz ZGVVQFKEKSBYHW-MRXNPFEDSA-N 1 1 359.426 2.533 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536158456 516658453 /nfs/dbraw/zinc/65/84/53/516658453.db2.gz RLCYRHCETANAEJ-GOSISDBHSA-N 1 1 362.474 2.947 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000513571769 516675881 /nfs/dbraw/zinc/67/58/81/516675881.db2.gz GWJCFYONJQMVDO-KRWDZBQOSA-N 1 1 368.437 2.788 20 5 FFBDMO COc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)c1OC ZINC000558397491 516719773 /nfs/dbraw/zinc/71/97/73/516719773.db2.gz JZJOZBRZPMYZQV-UHFFFAOYSA-N 1 1 372.425 2.638 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000561746954 516746001 /nfs/dbraw/zinc/74/60/01/516746001.db2.gz PKYREHZJSOSVTR-SQWLQELKSA-N 1 1 361.442 2.796 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000524721346 516801427 /nfs/dbraw/zinc/80/14/27/516801427.db2.gz QPSOOTMGPGGGCO-HZPDHXFCSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000524721345 516802517 /nfs/dbraw/zinc/80/25/17/516802517.db2.gz QPSOOTMGPGGGCO-HOTGVXAUSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000551821241 516889484 /nfs/dbraw/zinc/88/94/84/516889484.db2.gz JCEGMQHFOXBBRM-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO COc1cccc(NCC[NH+]2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000548445262 516989223 /nfs/dbraw/zinc/98/92/23/516989223.db2.gz DHTLUINILPHVLO-UHFFFAOYSA-N 1 1 356.426 2.838 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000525554726 517074085 /nfs/dbraw/zinc/07/40/85/517074085.db2.gz PEUUTBNRAOYPTK-LRDDRELGSA-N 1 1 362.455 2.808 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000545156316 517075227 /nfs/dbraw/zinc/07/52/27/517075227.db2.gz NKNRYGGJVLTEIM-UHFFFAOYSA-N 1 1 351.422 2.954 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444488 517112910 /nfs/dbraw/zinc/11/29/10/517112910.db2.gz RSHCLIMNMKTWTG-ZFWWWQNUSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444488 517112917 /nfs/dbraw/zinc/11/29/17/517112917.db2.gz RSHCLIMNMKTWTG-ZFWWWQNUSA-N 1 1 371.441 2.781 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000552190218 517132088 /nfs/dbraw/zinc/13/20/88/517132088.db2.gz CWKCLRQDWNYIFS-KGLIPLIRSA-N 1 1 350.415 2.861 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCN(Cc2ccco2)CC1 ZINC000532768139 517135438 /nfs/dbraw/zinc/13/54/38/517135438.db2.gz SFKNHIWGWIDDNB-UHFFFAOYSA-N 1 1 372.425 2.643 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000545476803 517257929 /nfs/dbraw/zinc/25/79/29/517257929.db2.gz KBAIEZXIVJDHIP-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)n1 ZINC000541935031 517299863 /nfs/dbraw/zinc/29/98/63/517299863.db2.gz HKEODWNFEOMPIZ-ROUUACIJSA-N 1 1 370.453 2.902 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+](C)C1 ZINC000559570115 517319595 /nfs/dbraw/zinc/31/95/95/517319595.db2.gz QCJVXMLENBYCHJ-LLVKDONJSA-N 1 1 370.247 2.737 20 5 FFBDMO CCc1ccc([C@@H](CO)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000541983502 517321597 /nfs/dbraw/zinc/32/15/97/517321597.db2.gz GSGKTIJIKNVVMK-MRXNPFEDSA-N 1 1 357.410 2.727 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000559638651 517356500 /nfs/dbraw/zinc/35/65/00/517356500.db2.gz HAFKHROVCNLYJP-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO COC1CCC([N@@H+](C)CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000533298874 517391439 /nfs/dbraw/zinc/39/14/39/517391439.db2.gz NUFAIAUVSZRZFG-UHFFFAOYSA-N 1 1 363.414 2.782 20 5 FFBDMO NC(=O)[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000542234172 517452105 /nfs/dbraw/zinc/45/21/05/517452105.db2.gz OREXCLYJENMLEU-AWEZNQCLSA-N 1 1 367.327 2.800 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000533447570 517468778 /nfs/dbraw/zinc/46/87/78/517468778.db2.gz JQMWOFNZELFBSN-GXTWGEPZSA-N 1 1 368.865 2.991 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1C ZINC000533447355 517469526 /nfs/dbraw/zinc/46/95/26/517469526.db2.gz GKHCPFIEUZOVQO-CZUORRHYSA-N 1 1 359.430 2.949 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1C ZINC000533447354 517470062 /nfs/dbraw/zinc/47/00/62/517470062.db2.gz GKHCPFIEUZOVQO-CJNGLKHVSA-N 1 1 359.430 2.949 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000520834942 517528757 /nfs/dbraw/zinc/52/87/57/517528757.db2.gz SGUKFXJQYGBWPK-HNNXBMFYSA-N 1 1 354.410 2.751 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000520834942 517528768 /nfs/dbraw/zinc/52/87/68/517528768.db2.gz SGUKFXJQYGBWPK-HNNXBMFYSA-N 1 1 354.410 2.751 20 5 FFBDMO COc1cccc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000553171116 517557230 /nfs/dbraw/zinc/55/72/30/517557230.db2.gz NQJZDEGSLCLVCW-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cc(-n4ccnc4)cs3)C2)nc1 ZINC000542466684 517582033 /nfs/dbraw/zinc/58/20/33/517582033.db2.gz QIBUAGYWNZXSDF-CYBMUJFWSA-N 1 1 370.438 2.923 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000516158269 517590689 /nfs/dbraw/zinc/59/06/89/517590689.db2.gz SEKFVQXAAWWZHE-ZIAGYGMSSA-N 1 1 364.446 2.666 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@@H](C)O1 ZINC000549784502 517707800 /nfs/dbraw/zinc/70/78/00/517707800.db2.gz CABLXUZKSXBJMT-RBSFLKMASA-N 1 1 360.410 2.597 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000538717269 517743710 /nfs/dbraw/zinc/74/37/10/517743710.db2.gz PBYAXDGEYXZDLW-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000538717269 517743715 /nfs/dbraw/zinc/74/37/15/517743715.db2.gz PBYAXDGEYXZDLW-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553528240 517765964 /nfs/dbraw/zinc/76/59/64/517765964.db2.gz SKVILRLOFOPQJT-CYBMUJFWSA-N 1 1 361.442 2.858 20 5 FFBDMO C[C@H]1CC[C@]2(CC[N@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884303 517798749 /nfs/dbraw/zinc/79/87/49/517798749.db2.gz WTYKBEYIPNYXRJ-SGTLLEGYSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@H]1CC[C@]2(CC[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884303 517798757 /nfs/dbraw/zinc/79/87/57/517798757.db2.gz WTYKBEYIPNYXRJ-SGTLLEGYSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@H]1CC[C@@]2(CC[N@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884301 517799247 /nfs/dbraw/zinc/79/92/47/517799247.db2.gz WTYKBEYIPNYXRJ-KPZWWZAWSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884301 517799256 /nfs/dbraw/zinc/79/92/56/517799256.db2.gz WTYKBEYIPNYXRJ-KPZWWZAWSA-N 1 1 361.398 2.774 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCC[N@@H+]2CC=C(C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000560649087 517952949 /nfs/dbraw/zinc/95/29/49/517952949.db2.gz JVFFRJMQGAVCSQ-UHFFFAOYSA-N 1 1 363.462 2.849 20 5 FFBDMO C[C@H]1COc2ccccc2C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543188373 517956302 /nfs/dbraw/zinc/95/63/02/517956302.db2.gz YWZRDLKIFJWYCW-HOCLYGCPSA-N 1 1 358.394 2.618 20 5 FFBDMO CC(C)(CS(C)(=O)=O)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000547286251 518058726 /nfs/dbraw/zinc/05/87/26/518058726.db2.gz RUYBENJIBGIJCG-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F ZINC000522435561 518107076 /nfs/dbraw/zinc/10/70/76/518107076.db2.gz WUYJBAPKJHXHJL-CQSZACIVSA-N 1 1 373.450 2.667 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000563760520 518111846 /nfs/dbraw/zinc/11/18/46/518111846.db2.gz UPBCETPZIQFGKD-INIZCTEOSA-N 1 1 363.801 2.818 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000563848032 518147480 /nfs/dbraw/zinc/14/74/80/518147480.db2.gz TXLRPHPRVPJITL-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000575999719 518382148 /nfs/dbraw/zinc/38/21/48/518382148.db2.gz LMTKPAQQDQATOW-QGZVFWFLSA-N 1 1 371.441 2.783 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000584547547 518393403 /nfs/dbraw/zinc/39/34/03/518393403.db2.gz HGLQJOMBIQMINR-NVGCLXPQSA-N 1 1 367.396 2.604 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000567238922 518423336 /nfs/dbraw/zinc/42/33/36/518423336.db2.gz BGTZIKIVUTUYBX-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000570183745 518483242 /nfs/dbraw/zinc/48/32/42/518483242.db2.gz TUJOOQSJXAWHBR-FQEVSTJZSA-N 1 1 368.437 2.672 20 5 FFBDMO Nc1cccc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000576280422 518516359 /nfs/dbraw/zinc/51/63/59/518516359.db2.gz VMFYGESPYIAFKT-UHFFFAOYSA-N 1 1 366.425 2.766 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N[C@H](C)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000576322401 518535359 /nfs/dbraw/zinc/53/53/59/518535359.db2.gz ZCDIFCFKDBSPBY-OAHLLOKOSA-N 1 1 365.478 2.733 20 5 FFBDMO CCOc1cc(C[N@@H+](CC(C)(C)O)C2CCOCC2)ccc1[N+](=O)[O-] ZINC000573275189 518588650 /nfs/dbraw/zinc/58/86/50/518588650.db2.gz TZGLIMKALCTVMN-UHFFFAOYSA-N 1 1 352.431 2.745 20 5 FFBDMO C[C@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000570591087 518682361 /nfs/dbraw/zinc/68/23/61/518682361.db2.gz DQVRRWMYTQQORM-JKSUJKDBSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000573889413 518883136 /nfs/dbraw/zinc/88/31/36/518883136.db2.gz NKFMSPYWPOVYMF-KBPBESRZSA-N 1 1 363.414 2.518 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000565323081 518898531 /nfs/dbraw/zinc/89/85/31/518898531.db2.gz MNZRHUASPOXUSX-OAHLLOKOSA-N 1 1 371.441 2.727 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)c1 ZINC000577172051 518948321 /nfs/dbraw/zinc/94/83/21/518948321.db2.gz ZXNHQAGIARTYNT-GOSISDBHSA-N 1 1 373.384 2.919 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCCC[C@@H]1C ZINC000565502247 518988109 /nfs/dbraw/zinc/98/81/09/518988109.db2.gz ABTQXLHMEPZTKM-RYUDHWBXSA-N 1 1 355.385 2.795 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000583057225 519053549 /nfs/dbraw/zinc/05/35/49/519053549.db2.gz LDXZDONIXGXTSP-NXEZZACHSA-N 1 1 358.345 2.800 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000577597250 519159184 /nfs/dbraw/zinc/15/91/84/519159184.db2.gz WFFCVRQBHNPYMQ-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000577597250 519159189 /nfs/dbraw/zinc/15/91/89/519159189.db2.gz WFFCVRQBHNPYMQ-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC3(CCOCC3)[C@H]1C1CC1)OCCO2 ZINC000590378479 519210236 /nfs/dbraw/zinc/21/02/36/519210236.db2.gz LNGDHJRXESOTAW-GOSISDBHSA-N 1 1 360.410 2.757 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000590446468 519236197 /nfs/dbraw/zinc/23/61/97/519236197.db2.gz VOBVPFYNTLEUHX-GWCFXTLKSA-N 1 1 355.847 2.503 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCOC[C@H]2[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590566388 519268836 /nfs/dbraw/zinc/26/88/36/519268836.db2.gz ZRKUXBIHXYTAME-AEFFLSMTSA-N 1 1 361.442 2.653 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000590581005 519273342 /nfs/dbraw/zinc/27/33/42/519273342.db2.gz GJPQAKNCGDGIEW-NWDGAFQWSA-N 1 1 367.833 2.955 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590599085 519284073 /nfs/dbraw/zinc/28/40/73/519284073.db2.gz AAJCNIQSDXBRAU-HOTGVXAUSA-N 1 1 357.410 2.609 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590600926 519284568 /nfs/dbraw/zinc/28/45/68/519284568.db2.gz PIAKMJAOXMTCEC-HNNXBMFYSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000590600926 519284575 /nfs/dbraw/zinc/28/45/75/519284575.db2.gz PIAKMJAOXMTCEC-HNNXBMFYSA-N 1 1 354.410 2.832 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000568935200 519290217 /nfs/dbraw/zinc/29/02/17/519290217.db2.gz LSKXWICERRDFHY-NSHDSACASA-N 1 1 357.357 2.909 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000577952362 519339161 /nfs/dbraw/zinc/33/91/61/519339161.db2.gz GGZCGLGGKFQWBI-MRXNPFEDSA-N 1 1 373.434 2.768 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590806560 519380327 /nfs/dbraw/zinc/38/03/27/519380327.db2.gz RMMICKYRKJIOBK-QZTJIDSGSA-N 1 1 372.469 2.968 20 5 FFBDMO C[C@]1(NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000566320211 519431085 /nfs/dbraw/zinc/43/10/85/519431085.db2.gz ZTCXVRKPOIKDDP-FQEVSTJZSA-N 1 1 369.421 2.754 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H](C)C(=O)OC(C)(C)C)c1 ZINC000590972785 519465227 /nfs/dbraw/zinc/46/52/27/519465227.db2.gz PWFXDZHOJMOUSP-LBPRGKRZSA-N 1 1 366.414 2.791 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])CC1 ZINC000566460805 519506419 /nfs/dbraw/zinc/50/64/19/519506419.db2.gz UDTZSXPSVCLKQH-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])CC1 ZINC000566460805 519506431 /nfs/dbraw/zinc/50/64/31/519506431.db2.gz UDTZSXPSVCLKQH-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2ccnc(N3CCC[N@@H+](C[C@H]4CCCO4)CC3)c2c1 ZINC000591138807 519526430 /nfs/dbraw/zinc/52/64/30/519526430.db2.gz ZZPLCEQKKJPYEA-QGZVFWFLSA-N 1 1 356.426 2.834 20 5 FFBDMO CC(C)N(Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000602853301 519926617 /nfs/dbraw/zinc/92/66/17/519926617.db2.gz WXUSTARGOVRNRN-SFHVURJKSA-N 1 1 357.458 2.813 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000602857972 519932375 /nfs/dbraw/zinc/93/23/75/519932375.db2.gz ZPRJCOZDJLMYCF-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000602857972 519932386 /nfs/dbraw/zinc/93/23/86/519932386.db2.gz ZPRJCOZDJLMYCF-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO COC(=O)c1cnc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000616176878 519933228 /nfs/dbraw/zinc/93/32/28/519933228.db2.gz MVIRGVRMXSMVPF-GUTXKFCHSA-N 1 1 362.430 2.618 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602875313 519942000 /nfs/dbraw/zinc/94/20/00/519942000.db2.gz ZMKYUMDBCXYBKV-WMLDXEAASA-N 1 1 362.474 2.892 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]([C@H]2CCCO2)C2(CO)CCC2)c(F)c1 ZINC000602891464 519952282 /nfs/dbraw/zinc/95/22/82/519952282.db2.gz NKVBUOQXFGWCRE-CVEARBPZSA-N 1 1 356.369 2.673 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000599972441 519978973 /nfs/dbraw/zinc/97/89/73/519978973.db2.gz XPNGIMSYCFIIOY-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1C ZINC000594483932 519992871 /nfs/dbraw/zinc/99/28/71/519992871.db2.gz LFRNTHYRIAXOME-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594485149 519994154 /nfs/dbraw/zinc/99/41/54/519994154.db2.gz XJZYGDVAOOVVMP-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000602997287 520013140 /nfs/dbraw/zinc/01/31/40/520013140.db2.gz HBIBDXLGRJJDST-SZMVWBNQSA-N 1 1 361.442 2.857 20 5 FFBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](CCCF)CC1 ZINC000600077014 520031713 /nfs/dbraw/zinc/03/17/13/520031713.db2.gz UHBNTOXOERNIHW-INIZCTEOSA-N 1 1 351.422 2.667 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594602741 520048910 /nfs/dbraw/zinc/04/89/10/520048910.db2.gz SCUKZXCUFJBVPG-RYUDHWBXSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594602741 520048914 /nfs/dbraw/zinc/04/89/14/520048914.db2.gz SCUKZXCUFJBVPG-RYUDHWBXSA-N 1 1 355.236 2.603 20 5 FFBDMO CC1(C)[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1[NH+]1CCOCC1 ZINC000603112314 520085360 /nfs/dbraw/zinc/08/53/60/520085360.db2.gz VVKPVXXKUTXMHT-SJORKVTESA-N 1 1 373.409 2.570 20 5 FFBDMO C[C@]1(CO)C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@]1(C)CO ZINC000600202323 520120000 /nfs/dbraw/zinc/12/00/00/520120000.db2.gz CQDMGNABOFGPIA-KDURUIRLSA-N 1 1 360.410 2.668 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1C ZINC000594788953 520158895 /nfs/dbraw/zinc/15/88/95/520158895.db2.gz INZKRDIATRFDKZ-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1SC ZINC000592166972 520241784 /nfs/dbraw/zinc/24/17/84/520241784.db2.gz ARIRWZSFGQRJDG-NFAWXSAZSA-N 1 1 364.427 2.643 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000603401252 520246873 /nfs/dbraw/zinc/24/68/73/520246873.db2.gz KNKYFHBSICDLGW-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[NH+](C)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000600469391 520278098 /nfs/dbraw/zinc/27/80/98/520278098.db2.gz AKVHSJGNXWSACE-NSHDSACASA-N 1 1 372.212 2.657 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600470727 520278607 /nfs/dbraw/zinc/27/86/07/520278607.db2.gz IEPLCQXHPGDDRJ-QGZVFWFLSA-N 1 1 356.426 2.683 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600469861 520278809 /nfs/dbraw/zinc/27/88/09/520278809.db2.gz LSJMSAKYECIUPC-KRWDZBQOSA-N 1 1 359.426 2.691 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000600470893 520278919 /nfs/dbraw/zinc/27/89/19/520278919.db2.gz JOBZAGAWPVBHOJ-INIZCTEOSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000597861756 520288549 /nfs/dbraw/zinc/28/85/49/520288549.db2.gz WXLBVMSPIWIEJG-AWEZNQCLSA-N 1 1 357.414 2.588 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000603601895 520323195 /nfs/dbraw/zinc/32/31/95/520323195.db2.gz KOQPSHPOUZIXMK-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1cc(C(=O)NC[C@H]2CCCC[N@H+]2CC)c([N+](=O)[O-])cc1OC ZINC000609489436 520330349 /nfs/dbraw/zinc/33/03/49/520330349.db2.gz MRFZJJSMUWFHIP-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613178961 520371482 /nfs/dbraw/zinc/37/14/82/520371482.db2.gz HSMKOGJDEFINDG-MRXNPFEDSA-N 1 1 354.410 2.801 20 5 FFBDMO C[C@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000617263865 520403411 /nfs/dbraw/zinc/40/34/11/520403411.db2.gz HIVSCRIIWJRPJU-LBPRGKRZSA-N 1 1 351.428 2.720 20 5 FFBDMO O=C1Nc2ccccc2S[C@H]1CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000595421727 520459294 /nfs/dbraw/zinc/45/92/94/520459294.db2.gz BXYYOAGCJFMPIV-KRWDZBQOSA-N 1 1 370.434 2.851 20 5 FFBDMO O=C1Nc2ccccc2S[C@H]1CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000595421727 520459299 /nfs/dbraw/zinc/45/92/99/520459299.db2.gz BXYYOAGCJFMPIV-KRWDZBQOSA-N 1 1 370.434 2.851 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000598195962 520487474 /nfs/dbraw/zinc/48/74/74/520487474.db2.gz XUNDMHQNEUMEFI-INIZCTEOSA-N 1 1 368.437 2.566 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000598220067 520501319 /nfs/dbraw/zinc/50/13/19/520501319.db2.gz OUSFSLOWGRWPMK-HNNXBMFYSA-N 1 1 361.442 2.805 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218935 520501477 /nfs/dbraw/zinc/50/14/77/520501477.db2.gz JTCZIZDOIIHERB-HNNXBMFYSA-N 1 1 361.442 2.887 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](c1cccnc1)C(C)(C)CO ZINC000595498648 520509794 /nfs/dbraw/zinc/50/97/94/520509794.db2.gz HOEJHBRQWBXJAG-SFHVURJKSA-N 1 1 372.425 2.586 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2cccnc2)C(C)(C)CO)c1 ZINC000595498986 520510261 /nfs/dbraw/zinc/51/02/61/520510261.db2.gz JOSKBSMWEQILLL-QGZVFWFLSA-N 1 1 373.409 2.626 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000595505872 520517698 /nfs/dbraw/zinc/51/76/98/520517698.db2.gz ZQWBRMRLMOWWPA-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000595505872 520517702 /nfs/dbraw/zinc/51/77/02/520517702.db2.gz ZQWBRMRLMOWWPA-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000595505872 520517705 /nfs/dbraw/zinc/51/77/05/520517705.db2.gz ZQWBRMRLMOWWPA-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000595505872 520517708 /nfs/dbraw/zinc/51/77/08/520517708.db2.gz ZQWBRMRLMOWWPA-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccsc3[N+](=O)[O-])cc2)CC1 ZINC000604433478 520561592 /nfs/dbraw/zinc/56/15/92/520561592.db2.gz LCRJESMQGWFPGE-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598342194 520564382 /nfs/dbraw/zinc/56/43/82/520564382.db2.gz JYOGFPYXUUXYFF-CYBMUJFWSA-N 1 1 355.822 2.618 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000598343036 520567037 /nfs/dbraw/zinc/56/70/37/520567037.db2.gz RULDSAKRRGSDKH-ZDUSSCGKSA-N 1 1 360.439 2.932 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(C(=O)NC2CC2)cc1 ZINC000604472812 520570368 /nfs/dbraw/zinc/57/03/68/520570368.db2.gz PVAZHIPJCQRDSO-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+](CCOCCO)C1CCC1 ZINC000595593880 520579971 /nfs/dbraw/zinc/57/99/71/520579971.db2.gz BAVFQAOIAJKXIQ-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000600995202 520581807 /nfs/dbraw/zinc/58/18/07/520581807.db2.gz NNGPRGUOFMTNBA-INIZCTEOSA-N 1 1 367.421 2.601 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C(C)C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873668 520626778 /nfs/dbraw/zinc/62/67/78/520626778.db2.gz QGBMVNAQZXQKAX-MRXNPFEDSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C(C)C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873668 520626784 /nfs/dbraw/zinc/62/67/84/520626784.db2.gz QGBMVNAQZXQKAX-MRXNPFEDSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C(C)C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873668 520626791 /nfs/dbraw/zinc/62/67/91/520626791.db2.gz QGBMVNAQZXQKAX-MRXNPFEDSA-N 1 1 371.441 2.751 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)N(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105608 520638243 /nfs/dbraw/zinc/63/82/43/520638243.db2.gz DVCUZLAUNBHDDK-ZIAGYGMSSA-N 1 1 372.425 2.511 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000601132595 520652484 /nfs/dbraw/zinc/65/24/84/520652484.db2.gz KHESSUQUQOAREJ-JQWIXIFHSA-N 1 1 373.379 2.800 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cccc2c1OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000601149827 520661528 /nfs/dbraw/zinc/66/15/28/520661528.db2.gz QCBSATYQWHTVRI-LJQANCHMSA-N 1 1 358.394 2.753 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598509267 520669039 /nfs/dbraw/zinc/66/90/39/520669039.db2.gz KVWLMBFQQLPWHT-QGZVFWFLSA-N 1 1 368.437 2.788 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CO)c2sccc2C)c1 ZINC000593024233 520689624 /nfs/dbraw/zinc/68/96/24/520689624.db2.gz DCWYVBVEMGVEEZ-CYBMUJFWSA-N 1 1 350.396 2.575 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595743814 520692166 /nfs/dbraw/zinc/69/21/66/520692166.db2.gz RVUQHGYOGUYCMH-FTJFQDGESA-N 1 1 374.384 2.696 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@]2(CO)CC(C)C)c1 ZINC000593027074 520692327 /nfs/dbraw/zinc/69/23/27/520692327.db2.gz KMWCHIGLWYWGSN-SFHVURJKSA-N 1 1 350.415 2.754 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000610476245 520705271 /nfs/dbraw/zinc/70/52/71/520705271.db2.gz MZTJGLVFRZVSKW-GOSISDBHSA-N 1 1 363.458 2.680 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000598559959 520705665 /nfs/dbraw/zinc/70/56/65/520705665.db2.gz JQGGSBCGPYYLMV-CQSZACIVSA-N 1 1 356.426 2.928 20 5 FFBDMO Cc1cc(S(=O)(=O)N(CC[NH+](C)C)c2ccccc2)c([N+](=O)[O-])s1 ZINC000601327735 520742468 /nfs/dbraw/zinc/74/24/68/520742468.db2.gz ZOBSGTPZIFPYQQ-UHFFFAOYSA-N 1 1 369.468 2.722 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)n2c1CCCC2 ZINC000598632975 520753417 /nfs/dbraw/zinc/75/34/17/520753417.db2.gz HALSHARCNUZGKS-UHFFFAOYSA-N 1 1 373.409 2.818 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645372 520758273 /nfs/dbraw/zinc/75/82/73/520758273.db2.gz INKMWNICLQAOIZ-ZYHUDNBSSA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645372 520758279 /nfs/dbraw/zinc/75/82/79/520758279.db2.gz INKMWNICLQAOIZ-ZYHUDNBSSA-N 1 1 360.357 2.655 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C1CC1 ZINC000593130353 520769439 /nfs/dbraw/zinc/76/94/39/520769439.db2.gz OLHDIZQHTCUJIH-DLBZAZTESA-N 1 1 371.393 2.881 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000593188212 520811564 /nfs/dbraw/zinc/81/15/64/520811564.db2.gz YXEYODZNLONPBX-RBSFLKMASA-N 1 1 360.458 2.748 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907664 520813306 /nfs/dbraw/zinc/81/33/06/520813306.db2.gz CNPURSQRDLYKGW-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907664 520813313 /nfs/dbraw/zinc/81/33/13/520813313.db2.gz CNPURSQRDLYKGW-KDURUIRLSA-N 1 1 359.426 2.734 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000593188803 520813785 /nfs/dbraw/zinc/81/37/85/520813785.db2.gz QBULVCHSGGLTMK-GMTAPVOTSA-N 1 1 370.247 2.910 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@](C)(C(F)F)C1 ZINC000595915673 520820782 /nfs/dbraw/zinc/82/07/82/520820782.db2.gz JPXSSHCDUDGOAR-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@](C)(C(F)F)C1 ZINC000595915673 520820788 /nfs/dbraw/zinc/82/07/88/520820788.db2.gz JPXSSHCDUDGOAR-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596075974 520897381 /nfs/dbraw/zinc/89/73/81/520897381.db2.gz LMUMPWGFJGGDIV-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000593315999 520903121 /nfs/dbraw/zinc/90/31/21/520903121.db2.gz OKTRDCMNEGDRMU-CKEIUWERSA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596088648 520906697 /nfs/dbraw/zinc/90/66/97/520906697.db2.gz MUMLGSQUTRKNOV-XJKSGUPXSA-N 1 1 354.410 2.941 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000596135630 520933382 /nfs/dbraw/zinc/93/33/82/520933382.db2.gz YAJARSLEBVMBOV-CYBMUJFWSA-N 1 1 355.822 2.811 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000596135630 520933389 /nfs/dbraw/zinc/93/33/89/520933389.db2.gz YAJARSLEBVMBOV-CYBMUJFWSA-N 1 1 355.822 2.811 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cnc3C)C2)c1 ZINC000601848554 520985112 /nfs/dbraw/zinc/98/51/12/520985112.db2.gz AAUUMQUFJYENOT-INIZCTEOSA-N 1 1 354.410 2.611 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000611104575 520987191 /nfs/dbraw/zinc/98/71/91/520987191.db2.gz OXWYCNCHRJSWJY-CHWSQXEVSA-N 1 1 353.785 2.978 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000611104575 520987194 /nfs/dbraw/zinc/98/71/94/520987194.db2.gz OXWYCNCHRJSWJY-CHWSQXEVSA-N 1 1 353.785 2.978 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000596246110 520991132 /nfs/dbraw/zinc/99/11/32/520991132.db2.gz BQQZARCRBHEFTN-KRWDZBQOSA-N 1 1 368.437 2.958 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599083379 521022656 /nfs/dbraw/zinc/02/26/56/521022656.db2.gz KPQNIPAFZOFGPK-QWRGUYRKSA-N 1 1 368.231 2.714 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NC[C@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000599138646 521049858 /nfs/dbraw/zinc/04/98/58/521049858.db2.gz IIDYATCRAIOSOC-CQSZACIVSA-N 1 1 371.441 2.703 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CCCC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000599140262 521050890 /nfs/dbraw/zinc/05/08/90/521050890.db2.gz UAPLXMSTWKTSSF-NSHDSACASA-N 1 1 357.252 2.626 20 5 FFBDMO CC[NH+](CC)CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611254625 521060966 /nfs/dbraw/zinc/06/09/66/521060966.db2.gz QMJCOMCBNSQLFC-UHFFFAOYSA-N 1 1 363.458 2.920 20 5 FFBDMO C[C@H]1C[NH+](CCOC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000611339291 521105758 /nfs/dbraw/zinc/10/57/58/521105758.db2.gz PKMVPAHAQHEHQA-HOTGVXAUSA-N 1 1 363.458 2.689 20 5 FFBDMO CC(C)(C)Oc1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1[N+](=O)[O-] ZINC000596537916 521121436 /nfs/dbraw/zinc/12/14/36/521121436.db2.gz JUIZTAODQGDXBQ-MRXNPFEDSA-N 1 1 363.458 2.808 20 5 FFBDMO CC(C)(C)Oc1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-] ZINC000596537915 521122076 /nfs/dbraw/zinc/12/20/76/521122076.db2.gz JUIZTAODQGDXBQ-INIZCTEOSA-N 1 1 363.458 2.808 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(CO)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560806 521219486 /nfs/dbraw/zinc/21/94/86/521219486.db2.gz BKILJEATBOQXIR-LJQANCHMSA-N 1 1 366.421 2.742 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])c(OC)c1 ZINC000611561542 521220909 /nfs/dbraw/zinc/22/09/09/521220909.db2.gz DQAULHGSPNPNJU-INIZCTEOSA-N 1 1 360.414 2.954 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000596694809 521227454 /nfs/dbraw/zinc/22/74/54/521227454.db2.gz OBSYEIGKXRYJMT-SNVBAGLBSA-N 1 1 358.345 2.802 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000611583183 521236011 /nfs/dbraw/zinc/23/60/11/521236011.db2.gz LWRPCQVLPSZLNQ-OLZOCXBDSA-N 1 1 363.462 2.824 20 5 FFBDMO Cc1ccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611582222 521237196 /nfs/dbraw/zinc/23/71/96/521237196.db2.gz KGXLLNRUJXYLKT-UHFFFAOYSA-N 1 1 372.429 2.675 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)n1 ZINC000611615886 521250991 /nfs/dbraw/zinc/25/09/91/521250991.db2.gz FKPKWXMMVRTRFO-IYBDPMFKSA-N 1 1 362.474 2.932 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599512063 521268051 /nfs/dbraw/zinc/26/80/51/521268051.db2.gz YEVZPAMDYKCQJU-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO CC(C)[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000599550661 521291368 /nfs/dbraw/zinc/29/13/68/521291368.db2.gz XGYXOABTXBAOJD-LJQANCHMSA-N 1 1 357.458 2.634 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553445 521293671 /nfs/dbraw/zinc/29/36/71/521293671.db2.gz VAVNBEYRVHRMEA-KGLIPLIRSA-N 1 1 365.455 2.902 20 5 FFBDMO CNC(=O)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602475169 521365807 /nfs/dbraw/zinc/36/58/07/521365807.db2.gz XIPJSRSVZDLXPU-UHFFFAOYSA-N 1 1 359.348 2.962 20 5 FFBDMO CCN(C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000596900348 521367057 /nfs/dbraw/zinc/36/70/57/521367057.db2.gz MVBZBDKUBLPCSC-GFCCVEGCSA-N 1 1 371.235 2.915 20 5 FFBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H](CO)CC(F)(F)F)cc1Br ZINC000602578824 521421714 /nfs/dbraw/zinc/42/17/14/521421714.db2.gz HINJSRVTESGNJA-RXMQYKEDSA-N 1 1 363.155 2.822 20 5 FFBDMO CC(C)(O)CN1CCC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000602600337 521432597 /nfs/dbraw/zinc/43/25/97/521432597.db2.gz IDIOEEMIPTWDBP-UHFFFAOYSA-N 1 1 355.866 2.616 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000594198654 521465334 /nfs/dbraw/zinc/46/53/34/521465334.db2.gz UIHDLABNHTWJSU-STQMWFEESA-N 1 1 369.368 2.943 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](OCc3ccccn3)C2)c([N+](=O)[O-])cc1OC ZINC000602716658 521493190 /nfs/dbraw/zinc/49/31/90/521493190.db2.gz VRJRQFAAUUNMHO-MRXNPFEDSA-N 1 1 373.409 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](OCc3ccccn3)C2)c([N+](=O)[O-])cc1OC ZINC000602716658 521493199 /nfs/dbraw/zinc/49/31/99/521493199.db2.gz VRJRQFAAUUNMHO-MRXNPFEDSA-N 1 1 373.409 2.798 20 5 FFBDMO CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602719610 521495998 /nfs/dbraw/zinc/49/59/98/521495998.db2.gz ZTCFLEPMNMTNGL-ZDUSSCGKSA-N 1 1 374.363 2.801 20 5 FFBDMO CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602719610 521496001 /nfs/dbraw/zinc/49/60/01/521496001.db2.gz ZTCFLEPMNMTNGL-ZDUSSCGKSA-N 1 1 374.363 2.801 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597091993 521498248 /nfs/dbraw/zinc/49/82/48/521498248.db2.gz HULQDHKBQILLKA-YPMHNXCESA-N 1 1 367.837 2.969 20 5 FFBDMO Cn1cc(C[NH2+][C@@H]2CCOc3c(Br)cccc32)c([N+](=O)[O-])n1 ZINC000602825890 521555366 /nfs/dbraw/zinc/55/53/66/521555366.db2.gz LJABBTKQQSKPGF-GFCCVEGCSA-N 1 1 367.203 2.704 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2cccc(F)c2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000619783091 521870846 /nfs/dbraw/zinc/87/08/46/521870846.db2.gz QDCBGAOSNQWJLK-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2cccc(F)c2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000619783091 521870854 /nfs/dbraw/zinc/87/08/54/521870854.db2.gz QDCBGAOSNQWJLK-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000619864427 521908705 /nfs/dbraw/zinc/90/87/05/521908705.db2.gz OZJKWYBURAEOJN-LPHOPBHVSA-N 1 1 374.441 2.625 20 5 FFBDMO Cc1cccc2c(NCc3cccc([N+](=O)[O-])c3)c(-c3nn[nH]n3)c[nH+]c12 ZINC000822337656 599501736 /nfs/dbraw/zinc/50/17/36/599501736.db2.gz ZYXRZQJKZVKOBO-UHFFFAOYSA-N 1 1 361.365 2.666 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000820092469 607467401 /nfs/dbraw/zinc/46/74/01/607467401.db2.gz MILPFZYPUVMGCH-ZDUSSCGKSA-N 1 1 359.434 2.555 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)CC1 ZINC000821061030 606645457 /nfs/dbraw/zinc/64/54/57/606645457.db2.gz KLOYSFALBKUFAK-UHFFFAOYSA-N 1 1 373.461 2.723 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000826028461 607967786 /nfs/dbraw/zinc/96/77/86/607967786.db2.gz APOUIAIRWJQIHV-DOTOQJQBSA-N 1 1 365.397 2.632 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(-c2nn[nH]n2)c(F)c1 ZINC000826212310 609141490 /nfs/dbraw/zinc/14/14/90/609141490.db2.gz MNZVUSMJNBONIA-SNVBAGLBSA-N 1 1 372.360 2.773 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727317 720348889 /nfs/dbraw/zinc/34/88/89/720348889.db2.gz SUNFDVAHRDOQTI-KBPBESRZSA-N 1 1 359.817 2.891 20 5 FFBDMO COc1nc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC001164858631 720936507 /nfs/dbraw/zinc/93/65/07/720936507.db2.gz JPQGCMIFOJNGNL-ZDUSSCGKSA-N 1 1 374.445 2.616 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)c(Cl)c1 ZINC001164784899 721390730 /nfs/dbraw/zinc/39/07/30/721390730.db2.gz KBGUISIUVQNLFJ-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])c(N2CC[NH+](CCc3ccccn3)CC2)n1 ZINC001165053269 722011596 /nfs/dbraw/zinc/01/15/96/722011596.db2.gz DQKQXUXVKZNEFB-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746662694 735502591 /nfs/dbraw/zinc/50/25/91/735502591.db2.gz GCTGOXKVZJOOGE-STQMWFEESA-N 1 1 369.849 2.611 20 5 FFBDMO O=C1[C@H]([N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1CC(F)(F)F ZINC000130212735 728715946 /nfs/dbraw/zinc/71/59/46/728715946.db2.gz DDAYNJLPQRVMSO-CQSZACIVSA-N 1 1 357.332 2.722 20 5 FFBDMO O=C1[C@H]([N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1CC(F)(F)F ZINC000130212735 728715947 /nfs/dbraw/zinc/71/59/47/728715947.db2.gz DDAYNJLPQRVMSO-CQSZACIVSA-N 1 1 357.332 2.722 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000134611017 728731421 /nfs/dbraw/zinc/73/14/21/728731421.db2.gz PDNZNTFNKJFCIO-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC000134611017 728731422 /nfs/dbraw/zinc/73/14/22/728731422.db2.gz PDNZNTFNKJFCIO-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO C[C@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCSCC1 ZINC000179145508 729178932 /nfs/dbraw/zinc/17/89/32/729178932.db2.gz RUJIIPMBUYCMDX-LLVKDONJSA-N 1 1 357.863 2.644 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)c1 ZINC000179375210 729185202 /nfs/dbraw/zinc/18/52/02/729185202.db2.gz KPCSQEQJRCQSCY-LLVKDONJSA-N 1 1 358.341 2.781 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c1 ZINC000179375210 729185204 /nfs/dbraw/zinc/18/52/04/729185204.db2.gz KPCSQEQJRCQSCY-LLVKDONJSA-N 1 1 358.341 2.781 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246607879 729588476 /nfs/dbraw/zinc/58/84/76/729588476.db2.gz HPTORXQLSDURJJ-RHSMWYFYSA-N 1 1 350.415 2.684 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2CC[NH+](Cc3cccs3)CC2)cc1F ZINC000865413472 730951736 /nfs/dbraw/zinc/95/17/36/730951736.db2.gz JXPGAXBJEXYYDL-UHFFFAOYSA-N 1 1 351.403 2.610 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866841430 731107110 /nfs/dbraw/zinc/10/71/10/731107110.db2.gz BWZCCPCXVCWPOV-AWEZNQCLSA-N 1 1 351.422 2.761 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000866854648 731109196 /nfs/dbraw/zinc/10/91/96/731109196.db2.gz JGCVQWGVOUOELP-QWHCGFSZSA-N 1 1 373.450 2.536 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])cnc43)C2)n1 ZINC000872806086 731834241 /nfs/dbraw/zinc/83/42/41/731834241.db2.gz IREYRFOSVHZYFO-LBPRGKRZSA-N 1 1 358.427 2.860 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C[C@@H]1CCOC1 ZINC000878168897 732492198 /nfs/dbraw/zinc/49/21/98/732492198.db2.gz WYNRFXWFKRMXFS-JTQLQIEISA-N 1 1 352.778 2.767 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)o1 ZINC000878991189 732627727 /nfs/dbraw/zinc/62/77/27/732627727.db2.gz VSVOYSCVMUBRIB-GHMZBOCLSA-N 1 1 364.789 2.767 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cccc([N+](=O)[O-])c3Br)CC[C@@H]21 ZINC000879579076 732728492 /nfs/dbraw/zinc/72/84/92/732728492.db2.gz JOGUXXVIHKTPHR-AAEUAGOBSA-N 1 1 354.248 2.883 20 5 FFBDMO CN1C(=O)C[C@@H]([NH2+]Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000886169823 733756653 /nfs/dbraw/zinc/75/66/53/733756653.db2.gz JKPFJJFCRCXUSY-ZBFHGGJFSA-N 1 1 360.801 2.705 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269586 733767764 /nfs/dbraw/zinc/76/77/64/733767764.db2.gz ZMPFJTBNDAPFKV-TZMCWYRMSA-N 1 1 350.419 2.867 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269586 733767769 /nfs/dbraw/zinc/76/77/69/733767769.db2.gz ZMPFJTBNDAPFKV-TZMCWYRMSA-N 1 1 350.419 2.867 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827879 733845624 /nfs/dbraw/zinc/84/56/24/733845624.db2.gz SXXJBGPEVSLQMP-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827879 733845629 /nfs/dbraw/zinc/84/56/29/733845629.db2.gz SXXJBGPEVSLQMP-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(C3OCCO3)CC2)c1Br ZINC000719013736 734377221 /nfs/dbraw/zinc/37/72/21/734377221.db2.gz XWHAWMRFAHOHLN-UHFFFAOYSA-N 1 1 371.231 2.942 20 5 FFBDMO O=C(OCCC[NH+]1CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000750877653 735821652 /nfs/dbraw/zinc/82/16/52/735821652.db2.gz RVENDHFBQNIXPU-UHFFFAOYSA-N 1 1 350.396 2.689 20 5 FFBDMO CC[N@@H+](C[C@H]1CCOC1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764197672 737000892 /nfs/dbraw/zinc/00/08/92/737000892.db2.gz PQEPPNYUUJSXAO-VXGBXAGGSA-N 1 1 355.822 2.934 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910285588 737052799 /nfs/dbraw/zinc/05/27/99/737052799.db2.gz SGUFUOJAIJBKQL-LBPRGKRZSA-N 1 1 367.471 2.882 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000765451587 737120155 /nfs/dbraw/zinc/12/01/55/737120155.db2.gz ADJXSZWZNCVHHK-CYBMUJFWSA-N 1 1 370.247 2.658 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000769914409 737583706 /nfs/dbraw/zinc/58/37/06/737583706.db2.gz ZADDUJDXIURPOF-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000770687326 737653077 /nfs/dbraw/zinc/65/30/77/737653077.db2.gz IPKFQXRMKFNQKW-LKFCYVNXSA-N 1 1 369.830 2.960 20 5 FFBDMO COCCCOCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774637410 738008239 /nfs/dbraw/zinc/00/82/39/738008239.db2.gz BAUOWOSWPXOMPC-UHFFFAOYSA-N 1 1 356.810 2.540 20 5 FFBDMO COCCCOCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774637410 738008243 /nfs/dbraw/zinc/00/82/43/738008243.db2.gz BAUOWOSWPXOMPC-UHFFFAOYSA-N 1 1 356.810 2.540 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778247732 738366453 /nfs/dbraw/zinc/36/64/53/738366453.db2.gz OCHOVOWCBJAOKI-QWHCGFSZSA-N 1 1 355.385 2.923 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931284405 739237755 /nfs/dbraw/zinc/23/77/55/739237755.db2.gz RLMCNTRGCAUDDZ-UHFFFAOYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)CCN1 ZINC000931620758 739298787 /nfs/dbraw/zinc/29/87/87/739298787.db2.gz OGKHODCQWASTTN-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)CCN1 ZINC000931620758 739298789 /nfs/dbraw/zinc/29/87/89/739298789.db2.gz OGKHODCQWASTTN-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO CN(C(=O)CCc1c(Cl)cccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000932547520 739467690 /nfs/dbraw/zinc/46/76/90/739467690.db2.gz NAKLZJDWDMWEHF-ZDUSSCGKSA-N 1 1 351.834 2.876 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791408020 739560141 /nfs/dbraw/zinc/56/01/41/739560141.db2.gz PEMYJCACMCJLLT-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@H]1C ZINC000933368810 739611092 /nfs/dbraw/zinc/61/10/92/739611092.db2.gz LFUONBXSXPSPMP-CJNGLKHVSA-N 1 1 351.422 2.998 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933436615 739624865 /nfs/dbraw/zinc/62/48/65/739624865.db2.gz USEFGVWPLFOPOW-IUODEOHRSA-N 1 1 353.850 2.979 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000933440250 739626424 /nfs/dbraw/zinc/62/64/24/739626424.db2.gz CJVOLHRQAMPQPS-DTWKUNHWSA-N 1 1 358.801 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCSC[C@@H]1C1CC1 ZINC000933913506 739704013 /nfs/dbraw/zinc/70/40/13/739704013.db2.gz HWCZPLLZOUORBP-OAHLLOKOSA-N 1 1 365.455 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCSC[C@@H]1C1CC1 ZINC000933913506 739704018 /nfs/dbraw/zinc/70/40/18/739704018.db2.gz HWCZPLLZOUORBP-OAHLLOKOSA-N 1 1 365.455 2.759 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCSC[C@H]1C1CC1 ZINC000933913395 739704064 /nfs/dbraw/zinc/70/40/64/739704064.db2.gz BUXXPFXRIBICBI-ZBFHGGJFSA-N 1 1 352.456 2.552 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCSC[C@@H]1C1CC1 ZINC000933913391 739704170 /nfs/dbraw/zinc/70/41/70/739704170.db2.gz BUXXPFXRIBICBI-GOEBONIOSA-N 1 1 352.456 2.552 20 5 FFBDMO CC(C)[N@H+](CCc1nccs1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794636939 739913460 /nfs/dbraw/zinc/91/34/60/739913460.db2.gz QZUBPNVEIANGBZ-UHFFFAOYSA-N 1 1 362.411 2.870 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794636939 739913463 /nfs/dbraw/zinc/91/34/63/739913463.db2.gz QZUBPNVEIANGBZ-UHFFFAOYSA-N 1 1 362.411 2.870 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000809982022 741369331 /nfs/dbraw/zinc/36/93/31/741369331.db2.gz FOBHJCXRQWGUNY-QWRGUYRKSA-N 1 1 362.257 2.789 20 5 FFBDMO Cc1cccc(Cl)c1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985425335 741394447 /nfs/dbraw/zinc/39/44/47/741394447.db2.gz GFGPKHAXOQBSIX-RHSMWYFYSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1cccc(Cl)c1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425335 741394452 /nfs/dbraw/zinc/39/44/52/741394452.db2.gz GFGPKHAXOQBSIX-RHSMWYFYSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1cccc(Cl)c1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425335 741394456 /nfs/dbraw/zinc/39/44/56/741394456.db2.gz GFGPKHAXOQBSIX-RHSMWYFYSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000985426205 741394631 /nfs/dbraw/zinc/39/46/31/741394631.db2.gz NAMAKZAGZRGBIV-NVXWUHKLSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000985426205 741394634 /nfs/dbraw/zinc/39/46/34/741394634.db2.gz NAMAKZAGZRGBIV-NVXWUHKLSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000985426205 741394637 /nfs/dbraw/zinc/39/46/37/741394637.db2.gz NAMAKZAGZRGBIV-NVXWUHKLSA-N 1 1 365.861 2.736 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCSC1 ZINC000813171141 741684520 /nfs/dbraw/zinc/68/45/20/741684520.db2.gz DOZPYWZZKFFNND-HOCLYGCPSA-N 1 1 350.440 2.856 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCSC1 ZINC000813171141 741684521 /nfs/dbraw/zinc/68/45/21/741684521.db2.gz DOZPYWZZKFFNND-HOCLYGCPSA-N 1 1 350.440 2.856 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000813634296 741741700 /nfs/dbraw/zinc/74/17/00/741741700.db2.gz HZZKXJCXPSTGTC-MRXNPFEDSA-N 1 1 353.806 2.567 20 5 FFBDMO C[C@@H](C[N+](=O)[O-])OC(=O)c1ccccc1OCC[N@H+]1CCCC[C@@H]1C ZINC000814045108 741787783 /nfs/dbraw/zinc/78/77/83/741787783.db2.gz MTIWIMDSXLCWFA-GJZGRUSLSA-N 1 1 350.415 2.762 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000817310746 742122024 /nfs/dbraw/zinc/12/20/24/742122024.db2.gz LEQWYHREQUMUFW-LLVKDONJSA-N 1 1 371.235 2.915 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C2)C1 ZINC000820342969 742493446 /nfs/dbraw/zinc/49/34/46/742493446.db2.gz PEZDIYBOSFDDPO-QGZVFWFLSA-N 1 1 351.834 2.735 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC[C@@H]21 ZINC000827296189 743550059 /nfs/dbraw/zinc/55/00/59/743550059.db2.gz CUGGXENDNKZWTD-HZMBPMFUSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000829563815 745225840 /nfs/dbraw/zinc/22/58/40/745225840.db2.gz PJFLZIDQJNLGLX-QWHCGFSZSA-N 1 1 351.834 2.876 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000834595338 745864303 /nfs/dbraw/zinc/86/43/03/745864303.db2.gz XICGOTWODWZJOB-ZIAGYGMSSA-N 1 1 373.787 2.575 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc(Br)c([N+](=O)[O-])c3)C[C@@H]21 ZINC000836477682 746233819 /nfs/dbraw/zinc/23/38/19/746233819.db2.gz NRUQSIXZCXEUQM-RNCFNFMXSA-N 1 1 369.219 2.525 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000839106003 746775907 /nfs/dbraw/zinc/77/59/07/746775907.db2.gz ZGIAADXVXYTMFI-QAPCUYQASA-N 1 1 350.415 2.682 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000839183885 746797179 /nfs/dbraw/zinc/79/71/79/746797179.db2.gz PQIBWUQJVFHMBI-AWEZNQCLSA-N 1 1 353.394 2.954 20 5 FFBDMO CN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000839601115 746868452 /nfs/dbraw/zinc/86/84/52/746868452.db2.gz MHODZYKLGWKGSB-PBWFPOADSA-N 1 1 366.849 2.744 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)C1 ZINC000840085203 746995299 /nfs/dbraw/zinc/99/52/99/746995299.db2.gz BRCMXDQVYVGHCX-KRWDZBQOSA-N 1 1 363.849 2.973 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000844640411 748062148 /nfs/dbraw/zinc/06/21/48/748062148.db2.gz HIHULKSWUCLNLS-GMTAPVOTSA-N 1 1 370.247 2.910 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@]3(CC3(F)F)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000844757402 748091215 /nfs/dbraw/zinc/09/12/15/748091215.db2.gz KBTIOWOPLXZGOH-HNNXBMFYSA-N 1 1 352.341 2.525 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@]3(CC3(F)F)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000844757402 748091222 /nfs/dbraw/zinc/09/12/22/748091222.db2.gz KBTIOWOPLXZGOH-HNNXBMFYSA-N 1 1 352.341 2.525 20 5 FFBDMO Cn1cc([C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C2(CO)CCC2)cn1 ZINC000852073561 749767569 /nfs/dbraw/zinc/76/75/69/749767569.db2.gz UVCULOAOIWVDMC-MRXNPFEDSA-N 1 1 364.833 2.975 20 5 FFBDMO CCC[N@@H+]1Cc2cccc(NC(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000825652339 1013378882 /nfs/dbraw/zinc/37/88/82/1013378882.db2.gz GPMOEUNFNPWMAN-GOSISDBHSA-N 1 1 355.394 2.993 20 5 FFBDMO CCC[N@H+]1Cc2cccc(NC(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000825652339 1013378899 /nfs/dbraw/zinc/37/88/99/1013378899.db2.gz GPMOEUNFNPWMAN-GOSISDBHSA-N 1 1 355.394 2.993 20 5 FFBDMO CCC[N@@H+]1Cc2cccc(NC(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000825652340 1013379021 /nfs/dbraw/zinc/37/90/21/1013379021.db2.gz GPMOEUNFNPWMAN-SFHVURJKSA-N 1 1 355.394 2.993 20 5 FFBDMO CCC[N@H+]1Cc2cccc(NC(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000825652340 1013379037 /nfs/dbraw/zinc/37/90/37/1013379037.db2.gz GPMOEUNFNPWMAN-SFHVURJKSA-N 1 1 355.394 2.993 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258227 963311307 /nfs/dbraw/zinc/31/13/07/963311307.db2.gz YAVVBCZVBYJMFC-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121258227 963311320 /nfs/dbraw/zinc/31/13/20/963311320.db2.gz YAVVBCZVBYJMFC-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H](c2ccccc2)C1 ZINC000126428900 964281400 /nfs/dbraw/zinc/28/14/00/964281400.db2.gz JKUCTPINQUYXJZ-GOSISDBHSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H](c2ccccc2)C1 ZINC000126428900 964281415 /nfs/dbraw/zinc/28/14/15/964281415.db2.gz JKUCTPINQUYXJZ-GOSISDBHSA-N 1 1 357.385 2.792 20 5 FFBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000729475143 965876919 /nfs/dbraw/zinc/87/69/19/965876919.db2.gz QRNXUKZPAYNKDI-SFHVURJKSA-N 1 1 374.485 2.754 20 5 FFBDMO CC(C)[C@H](CC[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001167525380 966071293 /nfs/dbraw/zinc/07/12/93/966071293.db2.gz DPXJWWONPPLTLW-AWEZNQCLSA-N 1 1 369.466 2.700 20 5 FFBDMO CC(C)[C@H](CC[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001167525380 966071305 /nfs/dbraw/zinc/07/13/05/966071305.db2.gz DPXJWWONPPLTLW-AWEZNQCLSA-N 1 1 369.466 2.700 20 5 FFBDMO CN1CCc2c(-n3cc(CC[NH3+])c4cc(O)ccc43)ccc([N+](=O)[O-])c2C1 ZINC001167988445 966081147 /nfs/dbraw/zinc/08/11/47/966081147.db2.gz YCMXDHFQWBMKAY-UHFFFAOYSA-N 1 1 366.421 2.733 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Cc2nccs2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934334643 966292711 /nfs/dbraw/zinc/29/27/11/966292711.db2.gz DPEMISRPGBFEQH-ZDUSSCGKSA-N 1 1 372.450 2.505 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Cc2nccs2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934334643 966292718 /nfs/dbraw/zinc/29/27/18/966292718.db2.gz DPEMISRPGBFEQH-ZDUSSCGKSA-N 1 1 372.450 2.505 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000895005295 967150553 /nfs/dbraw/zinc/15/05/53/967150553.db2.gz WYXWEVQTOQVBML-CPSHHHPTSA-N 1 1 351.406 2.737 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)c(Cl)c1 ZINC001267241083 967381375 /nfs/dbraw/zinc/38/13/75/967381375.db2.gz JQNGFADHUKWBGM-BXUZGUMPSA-N 1 1 360.241 2.597 20 5 FFBDMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)c(Cl)c1 ZINC001267241083 967381382 /nfs/dbraw/zinc/38/13/82/967381382.db2.gz JQNGFADHUKWBGM-BXUZGUMPSA-N 1 1 360.241 2.597 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)c(Cl)c1 ZINC001267241083 967381389 /nfs/dbraw/zinc/38/13/89/967381389.db2.gz JQNGFADHUKWBGM-BXUZGUMPSA-N 1 1 360.241 2.597 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cn3cc(-c4ccccc4)cn3)CC2)n1 ZINC000782872472 969786840 /nfs/dbraw/zinc/78/68/40/969786840.db2.gz SQQCEYUPULGQLE-UHFFFAOYSA-N 1 1 352.398 2.949 20 5 FFBDMO CN1CCC[C@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)[nH]n1 ZINC000897139630 973377112 /nfs/dbraw/zinc/37/71/12/973377112.db2.gz OKOUJQWNQKIZFM-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n[nH]1 ZINC000897139630 973377119 /nfs/dbraw/zinc/37/71/19/973377119.db2.gz OKOUJQWNQKIZFM-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)n[nH]1 ZINC000897139630 973377127 /nfs/dbraw/zinc/37/71/27/973377127.db2.gz OKOUJQWNQKIZFM-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126245365 1014431463 /nfs/dbraw/zinc/43/14/63/1014431463.db2.gz WLOIEUPIRRVJOR-NSHDSACASA-N 1 1 364.402 2.582 20 5 FFBDMO CCc1ccc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001481998217 977905443 /nfs/dbraw/zinc/90/54/43/977905443.db2.gz OYOZLWMYCBYPPT-RTBURBONSA-N 1 1 359.470 2.633 20 5 FFBDMO COc1c(C)c[nH+]c(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000067226829 978012377 /nfs/dbraw/zinc/01/23/77/978012377.db2.gz MOIQHRIUZXLHMJ-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796601189 1014570236 /nfs/dbraw/zinc/57/02/36/1014570236.db2.gz IIYUAPRMWUIUKY-GOSISDBHSA-N 1 1 363.458 2.741 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1CCCCCC1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796601189 1014570241 /nfs/dbraw/zinc/57/02/41/1014570241.db2.gz IIYUAPRMWUIUKY-GOSISDBHSA-N 1 1 363.458 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000249107225 979414461 /nfs/dbraw/zinc/41/44/61/979414461.db2.gz QPNIVJNVDXWCPE-SLEUVZQESA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000249107225 979414467 /nfs/dbraw/zinc/41/44/67/979414467.db2.gz QPNIVJNVDXWCPE-SLEUVZQESA-N 1 1 374.397 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn(C[C@H]4CCCO4)nn3)C2)cc1 ZINC000877565359 1014629379 /nfs/dbraw/zinc/62/93/79/1014629379.db2.gz GCIZIAGUSHMIAE-QFBILLFUSA-N 1 1 371.441 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn(C[C@H]4CCCO4)nn3)C2)cc1 ZINC000877565359 1014629384 /nfs/dbraw/zinc/62/93/84/1014629384.db2.gz GCIZIAGUSHMIAE-QFBILLFUSA-N 1 1 371.441 2.745 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3ccn(C)n3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000905722645 980499892 /nfs/dbraw/zinc/49/98/92/980499892.db2.gz PQRXQBZZWWFSAD-UHFFFAOYSA-N 1 1 354.414 2.824 20 5 FFBDMO Cn1cc(C[N@@H+]2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)c([N+](=O)[O-])n1 ZINC000877658782 1014664655 /nfs/dbraw/zinc/66/46/55/1014664655.db2.gz XJOSGQFVIYRYRA-MRXNPFEDSA-N 1 1 357.414 2.644 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)c([N+](=O)[O-])n1 ZINC000877658782 1014664661 /nfs/dbraw/zinc/66/46/61/1014664661.db2.gz XJOSGQFVIYRYRA-MRXNPFEDSA-N 1 1 357.414 2.644 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877686910 1014678383 /nfs/dbraw/zinc/67/83/83/1014678383.db2.gz ATCVMPLETVOBRQ-RTBURBONSA-N 1 1 368.437 2.642 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687737 1014679340 /nfs/dbraw/zinc/67/93/40/1014679340.db2.gz LLVDIZIDJPNMAV-MSOLQXFVSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687737 1014679346 /nfs/dbraw/zinc/67/93/46/1014679346.db2.gz LLVDIZIDJPNMAV-MSOLQXFVSA-N 1 1 354.410 2.599 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000897535545 981638227 /nfs/dbraw/zinc/63/82/27/981638227.db2.gz AGHICEPDSRIGQO-WBAXXEDZSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@H]1CC2(CC([NH2+][C@@H](c3nccn3C)c3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000897778406 982513039 /nfs/dbraw/zinc/51/30/39/982513039.db2.gz GSJXFPMHBITBAI-CQLILNKWSA-N 1 1 356.426 2.965 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764988769 984902542 /nfs/dbraw/zinc/90/25/42/984902542.db2.gz DIQSVDXAYDZTCW-OAHLLOKOSA-N 1 1 371.441 2.545 20 5 FFBDMO CN(C)C(=O)c1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000060460881 984913365 /nfs/dbraw/zinc/91/33/65/984913365.db2.gz ZANSECODLRWGBW-UHFFFAOYSA-N 1 1 368.437 2.619 20 5 FFBDMO Cc1nn(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291350 985125086 /nfs/dbraw/zinc/12/50/86/985125086.db2.gz LXVKBRIJRHUHEG-INIZCTEOSA-N 1 1 357.458 2.874 20 5 FFBDMO Cc1cc(C)c(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC000997770794 985734540 /nfs/dbraw/zinc/73/45/40/985734540.db2.gz YVFYZFCKKCZFND-IEBWSBKVSA-N 1 1 359.470 2.605 20 5 FFBDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)Cn1nc(C)c([N+](=O)[O-])c1C ZINC000173511869 985852687 /nfs/dbraw/zinc/85/26/87/985852687.db2.gz MLOMZEMLNHNMLF-UHFFFAOYSA-N 1 1 372.473 2.999 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000173545903 985875366 /nfs/dbraw/zinc/87/53/66/985875366.db2.gz QZTQURRKUFMOHV-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913686440 986829340 /nfs/dbraw/zinc/82/93/40/986829340.db2.gz MAVCHALSOLCGIE-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913686440 986829357 /nfs/dbraw/zinc/82/93/57/986829357.db2.gz MAVCHALSOLCGIE-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000130290213 987629654 /nfs/dbraw/zinc/62/96/54/987629654.db2.gz JQKHBXNUNHHPBY-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000125843447 989015476 /nfs/dbraw/zinc/01/54/76/989015476.db2.gz RJBXXRSHKJVDQL-HNNXBMFYSA-N 1 1 360.458 2.783 20 5 FFBDMO C[N@H+](CCOc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917417410 990215174 /nfs/dbraw/zinc/21/51/74/990215174.db2.gz QRWGYEHTASNLAN-UHFFFAOYSA-N 1 1 353.382 2.822 20 5 FFBDMO C[N@@H+](CCOc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917417410 990215178 /nfs/dbraw/zinc/21/51/78/990215178.db2.gz QRWGYEHTASNLAN-UHFFFAOYSA-N 1 1 353.382 2.822 20 5 FFBDMO CCc1cccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c1 ZINC001034816917 990276046 /nfs/dbraw/zinc/27/60/46/990276046.db2.gz WBFRFCVITBYQFE-WOJBJXKFSA-N 1 1 367.449 2.820 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000194881065 990621088 /nfs/dbraw/zinc/62/10/88/990621088.db2.gz DQQMDZWZZPSJDO-YOEHRIQHSA-N 1 1 369.421 2.854 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000068964538 991554910 /nfs/dbraw/zinc/55/49/10/991554910.db2.gz WTGMSBILBVZYGG-GDBMZVCRSA-N 1 1 373.457 2.919 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000880030650 1015738444 /nfs/dbraw/zinc/73/84/44/1015738444.db2.gz AINMSBNCFIKRGE-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000880518463 1015861811 /nfs/dbraw/zinc/86/18/11/1015861811.db2.gz JQZACTMNCIPDBJ-JVPQYHMTSA-N 1 1 356.426 2.772 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)Cn2cc[nH+]c2C)cc1OC ZINC000810619336 994841218 /nfs/dbraw/zinc/84/12/18/994841218.db2.gz OPUACRWUYBOAAN-LLVKDONJSA-N 1 1 363.370 2.753 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810618786 994841786 /nfs/dbraw/zinc/84/17/86/994841786.db2.gz UNJZQTBLZMDVAC-GFCCVEGCSA-N 1 1 355.354 2.531 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)n2)c1 ZINC000747823574 995554238 /nfs/dbraw/zinc/55/42/38/995554238.db2.gz HEYTZARVOLHIPZ-CVEARBPZSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cccc2c1OCO2 ZINC000813170636 995632414 /nfs/dbraw/zinc/63/24/14/995632414.db2.gz IZWWJMVEWRCWRU-HNNXBMFYSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cccc2c1OCO2 ZINC000813170636 995632418 /nfs/dbraw/zinc/63/24/18/995632418.db2.gz IZWWJMVEWRCWRU-HNNXBMFYSA-N 1 1 370.361 2.755 20 5 FFBDMO CC(C)n1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813172127 995632447 /nfs/dbraw/zinc/63/24/47/995632447.db2.gz AEJORKJNAAPXHP-KRWDZBQOSA-N 1 1 358.398 2.804 20 5 FFBDMO CC(C)n1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813172127 995632450 /nfs/dbraw/zinc/63/24/50/995632450.db2.gz AEJORKJNAAPXHP-KRWDZBQOSA-N 1 1 358.398 2.804 20 5 FFBDMO Cc1cc(C)n(CCC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000813174378 995634539 /nfs/dbraw/zinc/63/45/39/995634539.db2.gz ZNAGFTCWOUUYGN-SFHVURJKSA-N 1 1 372.425 2.616 20 5 FFBDMO Cc1cc(C)n(CCC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000813174378 995634545 /nfs/dbraw/zinc/63/45/45/995634545.db2.gz ZNAGFTCWOUUYGN-SFHVURJKSA-N 1 1 372.425 2.616 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000823972909 996770397 /nfs/dbraw/zinc/77/03/97/996770397.db2.gz BEFQSXRBSWAFPD-WBMJQRKESA-N 1 1 359.430 2.658 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC[C@@H]21 ZINC000827268061 1016087970 /nfs/dbraw/zinc/08/79/70/1016087970.db2.gz QFZYCCXORCPEQT-RDJZCZTQSA-N 1 1 366.421 2.823 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000803728892 1016111901 /nfs/dbraw/zinc/11/19/01/1016111901.db2.gz DMYIDZCUXGVJAA-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000803728892 1016111907 /nfs/dbraw/zinc/11/19/07/1016111907.db2.gz DMYIDZCUXGVJAA-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO COc1ccc(C[N@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1F ZINC000731480674 997978795 /nfs/dbraw/zinc/97/87/95/997978795.db2.gz CWYRBMYTJWQNQT-QGZVFWFLSA-N 1 1 373.384 2.980 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1F ZINC000731480674 997978806 /nfs/dbraw/zinc/97/88/06/997978806.db2.gz CWYRBMYTJWQNQT-QGZVFWFLSA-N 1 1 373.384 2.980 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)[C@@H](Cc2ccccc2)C1 ZINC000844924983 998233103 /nfs/dbraw/zinc/23/31/03/998233103.db2.gz OMZYTZUCBGKKQD-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)[C@@H](Cc2ccccc2)C1 ZINC000844924983 998233117 /nfs/dbraw/zinc/23/31/17/998233117.db2.gz OMZYTZUCBGKKQD-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2C[C@]3(C)CN(C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755630 999074598 /nfs/dbraw/zinc/07/45/98/999074598.db2.gz UZBUEFWPCLERTO-OALUTQOASA-N 1 1 360.458 2.505 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1CN[C@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000734000833 999169816 /nfs/dbraw/zinc/16/98/16/999169816.db2.gz XXNKLPMJOPNEAN-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@]1(CO)CCCN(Cc2ccccc2)C1 ZINC000734000833 999169819 /nfs/dbraw/zinc/16/98/19/999169819.db2.gz XXNKLPMJOPNEAN-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO CC(C)[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCC1 ZINC000741013231 999700866 /nfs/dbraw/zinc/70/08/66/999700866.db2.gz FDGQKKMGXKZWGX-INIZCTEOSA-N 1 1 374.397 2.808 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741024617 999704355 /nfs/dbraw/zinc/70/43/55/999704355.db2.gz XOWZMIJNYZWACU-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741024617 999704357 /nfs/dbraw/zinc/70/43/57/999704357.db2.gz XOWZMIJNYZWACU-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCCn2cc[nH+]c2C(C)C)cc1[N+](=O)[O-] ZINC000744400797 999855374 /nfs/dbraw/zinc/85/53/74/999855374.db2.gz QAJBAFSCFSSBPP-UHFFFAOYSA-N 1 1 361.358 2.561 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2CCC[C@H]21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000744407311 999855601 /nfs/dbraw/zinc/85/56/01/999855601.db2.gz SOYKJRGVVYGDIX-QFBILLFUSA-N 1 1 372.469 2.508 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000745090070 999892046 /nfs/dbraw/zinc/89/20/46/999892046.db2.gz UNPRZFOHWOZOBV-BBRMVZONSA-N 1 1 363.414 2.585 20 5 FFBDMO CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169037964 1000016771 /nfs/dbraw/zinc/01/67/71/1000016771.db2.gz ULJUQMQQOIPVBR-QGTPRVQTSA-N 1 1 359.470 2.773 20 5 FFBDMO Nc1ccc(Br)c2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169038625 1000017037 /nfs/dbraw/zinc/01/70/37/1000017037.db2.gz JKRXFXNOTIKVGU-GHMZBOCLSA-N 1 1 354.248 2.835 20 5 FFBDMO Cc1cccc(CN2CC[C@]3(CC[N@H+]([C@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)C2=O)c1 ZINC001169020619 1000017553 /nfs/dbraw/zinc/01/75/53/1000017553.db2.gz JOJPMQHSHLIOGU-SVFBPWRDSA-N 1 1 371.481 2.865 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)CN1c1ccc(F)cc1 ZINC001169021548 1000017576 /nfs/dbraw/zinc/01/75/76/1000017576.db2.gz OWOZMSOXPPDABE-YJLNNSPDSA-N 1 1 361.417 2.700 20 5 FFBDMO CCn1ncc2c1C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169021685 1000017662 /nfs/dbraw/zinc/01/76/62/1000017662.db2.gz PKYRZNXQZPFUHB-BRWVUGGUSA-N 1 1 362.474 2.674 20 5 FFBDMO CCn1ncc2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169021685 1000017665 /nfs/dbraw/zinc/01/76/65/1000017665.db2.gz PKYRZNXQZPFUHB-BRWVUGGUSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCO[C@@]3(CCCN(c4ccccc4)C3)C2)C1 ZINC001169023980 1000017795 /nfs/dbraw/zinc/01/77/95/1000017795.db2.gz WHIDRJRIFODCBI-MISYRCLQSA-N 1 1 359.470 2.803 20 5 FFBDMO O=C1N(CC2CC2)c2ccccc2[C@]12CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169026748 1000018295 /nfs/dbraw/zinc/01/82/95/1000018295.db2.gz NTDYIXVYNAKWSE-CSODHUTKSA-N 1 1 369.465 2.832 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000766869232 1000082791 /nfs/dbraw/zinc/08/27/91/1000082791.db2.gz MQRMGDGUSQUKIL-SFHVURJKSA-N 1 1 364.348 2.975 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000766869232 1000082793 /nfs/dbraw/zinc/08/27/93/1000082793.db2.gz MQRMGDGUSQUKIL-SFHVURJKSA-N 1 1 364.348 2.975 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000767117227 1000100309 /nfs/dbraw/zinc/10/03/09/1000100309.db2.gz CDSCAIKMLPAHND-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000767117227 1000100310 /nfs/dbraw/zinc/10/03/10/1000100310.db2.gz CDSCAIKMLPAHND-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1cncnc1 ZINC001147433619 1000888522 /nfs/dbraw/zinc/88/85/22/1000888522.db2.gz VXZNEUITRYOBSB-UHFFFAOYSA-N 1 1 359.389 2.733 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395798 1001100324 /nfs/dbraw/zinc/10/03/24/1001100324.db2.gz MAAAMAFFMSRTRP-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395798 1001100331 /nfs/dbraw/zinc/10/03/31/1001100331.db2.gz MAAAMAFFMSRTRP-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)OC(=O)C[N@H+]2[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000785742833 1001474650 /nfs/dbraw/zinc/47/46/50/1001474650.db2.gz OYJYXBURUDWRHP-SCRDCRAPSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)OC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000785742833 1001474652 /nfs/dbraw/zinc/47/46/52/1001474652.db2.gz OYJYXBURUDWRHP-SCRDCRAPSA-N 1 1 363.414 2.646 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@H+]1CCc2ccccc2C1 ZINC000786761387 1001623378 /nfs/dbraw/zinc/62/33/78/1001623378.db2.gz PEZBIBJRCIHGMG-MRXNPFEDSA-N 1 1 368.437 2.744 20 5 FFBDMO Cc1nn(CN2CCC(c3[nH+]cc4n3CCCC4)CC2)c(C)c1[N+](=O)[O-] ZINC000788381851 1001797734 /nfs/dbraw/zinc/79/77/34/1001797734.db2.gz IEWPCKCEGQPSSS-UHFFFAOYSA-N 1 1 358.446 2.778 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NCc3ccc([N+](=O)[O-])c(Cl)c3)cc2C1 ZINC000789769079 1002183848 /nfs/dbraw/zinc/18/38/48/1002183848.db2.gz JWRIQKGSRRUJIG-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NCc3ccc([N+](=O)[O-])c(Cl)c3)cc2C1 ZINC000789769079 1002183852 /nfs/dbraw/zinc/18/38/52/1002183852.db2.gz JWRIQKGSRRUJIG-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000791357562 1002678338 /nfs/dbraw/zinc/67/83/38/1002678338.db2.gz FATGOTAHRATQQU-LBPRGKRZSA-N 1 1 366.437 2.947 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170356035 1003123363 /nfs/dbraw/zinc/12/33/63/1003123363.db2.gz UTDANAVADDMQJE-KBPBESRZSA-N 1 1 350.415 2.810 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@@H](C)C1 ZINC000804380215 1003642673 /nfs/dbraw/zinc/64/26/73/1003642673.db2.gz ULMONUHUXPKODQ-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@@H](C)C1 ZINC000804380215 1003642679 /nfs/dbraw/zinc/64/26/79/1003642679.db2.gz ULMONUHUXPKODQ-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(C[C@]1(O)CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001191521394 1003864303 /nfs/dbraw/zinc/86/43/03/1003864303.db2.gz QFYIIRGPRPUJPJ-OAQYLSRUSA-N 1 1 367.449 2.590 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC001197115629 1004091533 /nfs/dbraw/zinc/09/15/33/1004091533.db2.gz MYQSNRMPQVNNKF-UHFFFAOYSA-N 1 1 372.381 2.526 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001197253373 1004142488 /nfs/dbraw/zinc/14/24/88/1004142488.db2.gz BRJWGWYTAHDLHV-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001197253373 1004142494 /nfs/dbraw/zinc/14/24/94/1004142494.db2.gz BRJWGWYTAHDLHV-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000805801617 1004145148 /nfs/dbraw/zinc/14/51/48/1004145148.db2.gz MCGWPXQVQCWWRU-BBRMVZONSA-N 1 1 365.430 2.961 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC001192895332 1004313538 /nfs/dbraw/zinc/31/35/38/1004313538.db2.gz JWRRMBLTDGCTMA-UHFFFAOYSA-N 1 1 357.476 2.610 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCN(C[C@@H]2CCCO2)CC1 ZINC000850434500 1005815403 /nfs/dbraw/zinc/81/54/03/1005815403.db2.gz UKQYXDDELKCIGT-YOEHRIQHSA-N 1 1 363.458 2.897 20 5 FFBDMO CC1(C)OC[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)O1 ZINC000852205399 1005950743 /nfs/dbraw/zinc/95/07/43/1005950743.db2.gz ZNTRKYLCKQKFLA-BRWVUGGUSA-N 1 1 364.442 2.852 20 5 FFBDMO 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CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1cccnn1 ZINC001188678633 1006673191 /nfs/dbraw/zinc/67/31/91/1006673191.db2.gz WEEFYPAOJHIHCG-UHFFFAOYSA-N 1 1 359.389 2.733 20 5 FFBDMO C[C@@H]1[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000816468352 1007051604 /nfs/dbraw/zinc/05/16/04/1007051604.db2.gz FWSZBMFVKUVYBS-QAPCUYQASA-N 1 1 372.425 2.778 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]3C3CCOCC3)n2)c1 ZINC000776769392 1007058899 /nfs/dbraw/zinc/05/88/99/1007058899.db2.gz FJDCATSZGUTWRK-KRWDZBQOSA-N 1 1 357.414 2.702 20 5 FFBDMO CCOCCOC1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC001190356991 1007597605 /nfs/dbraw/zinc/59/76/05/1007597605.db2.gz ZINNKKCNPDGFFF-UHFFFAOYSA-N 1 1 356.394 2.760 20 5 FFBDMO N[C@@H](CCC[NH3+])Nc1cnc(Cl)nc1Sc1ccc([N+](=O)[O-])cc1 ZINC001170897276 1007896228 /nfs/dbraw/zinc/89/62/28/1007896228.db2.gz LIGRFFLAOPKBSC-GFCCVEGCSA-N 1 1 368.850 2.625 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805776971 1008515823 /nfs/dbraw/zinc/51/58/23/1008515823.db2.gz XGUHLJNGIOGXGW-DLBZAZTESA-N 1 1 365.430 2.619 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859586181 1008579295 /nfs/dbraw/zinc/57/92/95/1008579295.db2.gz IOGGSZBDWWFBDD-HXUWFJFHSA-N 1 1 372.421 2.966 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@](O)(c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000859587749 1008580639 /nfs/dbraw/zinc/58/06/39/1008580639.db2.gz OXDRBFZHVCBQFE-HXUWFJFHSA-N 1 1 369.421 2.907 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3C[C@@H](C)CC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823147149 1008919664 /nfs/dbraw/zinc/91/96/64/1008919664.db2.gz WRRHSOVUIBCHIA-GWCFXTLKSA-N 1 1 362.386 2.646 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cccc(Cl)c1F)[C@@H]1CC1[N+](=O)[O-] ZINC001178458330 1008994380 /nfs/dbraw/zinc/99/43/80/1008994380.db2.gz AXHBPIMALMTQRA-UKRRQHHQSA-N 1 1 371.840 2.911 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CC1[N+](=O)[O-] ZINC001178458794 1008995090 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IRRKNLRQHOQLQS-LBPRGKRZSA-N 1 1 363.418 2.747 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21)NC(=O)OC(C)(C)C ZINC000863335453 1010183173 /nfs/dbraw/zinc/18/31/73/1010183173.db2.gz IRRKNLRQHOQLQS-LBPRGKRZSA-N 1 1 363.418 2.747 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863504690 1010231920 /nfs/dbraw/zinc/23/19/20/1010231920.db2.gz XKSFXMWPEZTFFY-HNAYVOBHSA-N 1 1 374.441 2.626 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000715599263 1010353600 /nfs/dbraw/zinc/35/36/00/1010353600.db2.gz UIHIVPIMZOPOAC-ZDUSSCGKSA-N 1 1 361.348 2.877 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000715599263 1010353613 /nfs/dbraw/zinc/35/36/13/1010353613.db2.gz UIHIVPIMZOPOAC-ZDUSSCGKSA-N 1 1 361.348 2.877 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN([C@H]2CCC[C@H]2O)CC1 ZINC000866307114 1010974139 /nfs/dbraw/zinc/97/41/39/1010974139.db2.gz QYWXHECUQMJJTC-XVGQJIODSA-N 1 1 365.449 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Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000801903452 1019499387 /nfs/dbraw/zinc/49/93/87/1019499387.db2.gz DMPUIJSMTNWVKM-AWEZNQCLSA-N 1 1 372.400 2.711 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1Cc1ccccc1 ZINC000801921035 1019513409 /nfs/dbraw/zinc/51/34/09/1019513409.db2.gz WONIHUNTUVTPNN-JSGCOSHPSA-N 1 1 372.400 2.709 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)CC[C@H](O)c1ccccc1)C2 ZINC000930100427 1019869172 /nfs/dbraw/zinc/86/91/72/1019869172.db2.gz VQBYGNWNYISNTJ-XLIONFOSSA-N 1 1 356.422 2.828 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000902537725 1020266226 /nfs/dbraw/zinc/26/62/26/1020266226.db2.gz DJEXXCWCXNVUQC-OALUTQOASA-N 1 1 374.485 2.530 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777953283 1020306532 /nfs/dbraw/zinc/30/65/32/1020306532.db2.gz FUAZCTNYPZDAJJ-INIZCTEOSA-N 1 1 358.398 2.833 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777953283 1020306544 /nfs/dbraw/zinc/30/65/44/1020306544.db2.gz FUAZCTNYPZDAJJ-INIZCTEOSA-N 1 1 358.398 2.833 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccc(C4CCC4)cc3)C[C@@H]2C1 ZINC001048814468 1020522268 /nfs/dbraw/zinc/52/22/68/1020522268.db2.gz NBEARRNKQYGDQI-IYWMVGAKSA-N 1 1 369.465 2.510 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccc(C4CCC4)cc3)C[C@@H]2C1 ZINC001048814468 1020522275 /nfs/dbraw/zinc/52/22/75/1020522275.db2.gz NBEARRNKQYGDQI-IYWMVGAKSA-N 1 1 369.465 2.510 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccc(C4CCC4)cc3)C[C@@H]2C1 ZINC001048814468 1020522278 /nfs/dbraw/zinc/52/22/78/1020522278.db2.gz NBEARRNKQYGDQI-IYWMVGAKSA-N 1 1 369.465 2.510 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2cccc(N3CCOCC3)n2)cc([N+](=O)[O-])c1 ZINC000903151276 1020704946 /nfs/dbraw/zinc/70/49/46/1020704946.db2.gz CUDRPBVNBSTXGO-AWEZNQCLSA-N 1 1 372.425 2.686 20 5 FFBDMO Cn1ccc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000932136780 1020717149 /nfs/dbraw/zinc/71/71/49/1020717149.db2.gz QGCKUDVNTKKESR-AWEZNQCLSA-N 1 1 357.414 2.537 20 5 FFBDMO CCN1C[C@H](C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000749663476 1021017923 /nfs/dbraw/zinc/01/79/23/1021017923.db2.gz FUEGTQJNDFHKSF-PKOBYXMFSA-N 1 1 371.437 2.848 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])nc1 ZINC000934343793 1021204099 /nfs/dbraw/zinc/20/40/99/1021204099.db2.gz PLYVPNHFKIJCRI-YOEHRIQHSA-N 1 1 373.409 2.575 20 5 FFBDMO Cc1cccc(NCCNc2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])[nH+]1 ZINC000750172271 1021466815 /nfs/dbraw/zinc/46/68/15/1021466815.db2.gz YAJSFGLXVBSCQM-UHFFFAOYSA-N 1 1 361.358 2.531 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC2(CC2)CC1 ZINC001039583069 1022767276 /nfs/dbraw/zinc/76/72/76/1022767276.db2.gz BJZFLQPPQAEPBB-XMTFNYHQSA-N 1 1 361.486 2.687 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CCC2(CC2)CC1 ZINC001039583069 1022767291 /nfs/dbraw/zinc/76/72/91/1022767291.db2.gz BJZFLQPPQAEPBB-XMTFNYHQSA-N 1 1 361.486 2.687 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC2(CC2)CC1 ZINC001039583069 1022767299 /nfs/dbraw/zinc/76/72/99/1022767299.db2.gz BJZFLQPPQAEPBB-XMTFNYHQSA-N 1 1 361.486 2.687 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351112 1033113832 /nfs/dbraw/zinc/11/38/32/1033113832.db2.gz TZBSJMTUJHLVIZ-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351112 1033113840 /nfs/dbraw/zinc/11/38/40/1033113840.db2.gz TZBSJMTUJHLVIZ-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1cccc([N+](=O)[O-])c1 ZINC001120249138 1023282138 /nfs/dbraw/zinc/28/21/38/1023282138.db2.gz GARQODQUCPUNDB-VDZJLULYSA-N 1 1 368.437 2.967 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000754360886 1023460208 /nfs/dbraw/zinc/46/02/08/1023460208.db2.gz OMGZBCHTFGOQGY-LOBVBGPYSA-N 1 1 373.453 2.758 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1F ZINC000829456332 1033159955 /nfs/dbraw/zinc/15/99/55/1033159955.db2.gz UQERKIQPQJFXEG-ZDUSSCGKSA-N 1 1 367.396 2.985 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1[N+](=O)[O-] ZINC000192642007 1024239036 /nfs/dbraw/zinc/23/90/36/1024239036.db2.gz AMBJLVYYSMBETC-UHFFFAOYSA-N 1 1 358.354 2.964 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC001122066703 1024311147 /nfs/dbraw/zinc/31/11/47/1024311147.db2.gz OFTSBJFXAORSJN-QGZVFWFLSA-N 1 1 374.828 2.749 20 5 FFBDMO C[C@@H]1CC[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999356 1024419857 /nfs/dbraw/zinc/41/98/57/1024419857.db2.gz HMMVLAAOWMBCEW-BFUOFWGJSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999356 1024419862 /nfs/dbraw/zinc/41/98/62/1024419862.db2.gz HMMVLAAOWMBCEW-BFUOFWGJSA-N 1 1 374.441 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(OC[C@@H]4CCCO4)CC3)c2c1 ZINC000083630438 1025067084 /nfs/dbraw/zinc/06/70/84/1025067084.db2.gz ZDAVSXJTCPWODX-KRWDZBQOSA-N 1 1 360.414 2.562 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000837184889 1025639409 /nfs/dbraw/zinc/63/94/09/1025639409.db2.gz ORZGEPVTLWCQCP-MRXNPFEDSA-N 1 1 360.458 2.750 20 5 FFBDMO O=C(OCCC[NH+]1CCOCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000838382538 1026337770 /nfs/dbraw/zinc/33/77/70/1026337770.db2.gz ASNIWNMXFHPIGV-UHFFFAOYSA-N 1 1 371.393 2.536 20 5 FFBDMO O=C1C[C@]2(CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644083 1026771203 /nfs/dbraw/zinc/77/12/03/1026771203.db2.gz NTSPQZITMYPWFF-QUCCMNQESA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@]2(CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644083 1026771215 /nfs/dbraw/zinc/77/12/15/1026771215.db2.gz NTSPQZITMYPWFF-QUCCMNQESA-N 1 1 368.389 2.738 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC001141860917 1027058898 /nfs/dbraw/zinc/05/88/98/1027058898.db2.gz LMBUIVQOXJQCES-CYBMUJFWSA-N 1 1 356.426 2.887 20 5 FFBDMO O=[N+]([O-])c1ccnc(N[C@H]2CC[C@H](N3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC001159626110 1027448755 /nfs/dbraw/zinc/44/87/55/1027448755.db2.gz KCFQOYLEXFTFIE-QAQDUYKDSA-N 1 1 359.474 2.741 20 5 FFBDMO Cc1nn(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(C)c1[N+](=O)[O-] ZINC000795711877 1027923391 /nfs/dbraw/zinc/92/33/91/1027923391.db2.gz TUFIEQTYIGXKRQ-HXUWFJFHSA-N 1 1 369.469 2.964 20 5 FFBDMO CSc1nc(Cl)c([N+](=O)[O-])c(-n2cc(CC[NH3+])c3cnccc32)n1 ZINC001160944489 1027934433 /nfs/dbraw/zinc/93/44/33/1027934433.db2.gz NFZCXSOBMYGZHB-UHFFFAOYSA-N 1 1 364.818 2.600 20 5 FFBDMO C[C@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000249738780 1028285929 /nfs/dbraw/zinc/28/59/29/1028285929.db2.gz HQXZHSRFHXMAAO-OWCLPIDISA-N 1 1 360.458 2.505 20 5 FFBDMO CCc1cc(N[C@]2(C)CCC[N@@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001162338530 1028507350 /nfs/dbraw/zinc/50/73/50/1028507350.db2.gz BHYGDHIXMSWTJD-LJQANCHMSA-N 1 1 355.442 2.932 20 5 FFBDMO CO[C@H](C[NH+]1CCN(c2ncc([N+](=O)[O-])cc2F)CC1)c1ccccc1 ZINC001155714231 1028867318 /nfs/dbraw/zinc/86/73/18/1028867318.db2.gz DDOXWXXZEQANOF-QGZVFWFLSA-N 1 1 360.389 2.639 20 5 FFBDMO O=C(NC1CC[NH+](CCF)CC1)c1ccnc2c1ccc1cccnc12 ZINC001155819555 1028927068 /nfs/dbraw/zinc/92/70/68/1028927068.db2.gz WIXJUMQZJDQDMF-UHFFFAOYSA-N 1 1 352.413 2.947 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001155894204 1028964169 /nfs/dbraw/zinc/96/41/69/1028964169.db2.gz SHDSLIHJCBPEPE-IVSAIRAKSA-N 1 1 374.485 2.900 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cnc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC001165107417 1029395397 /nfs/dbraw/zinc/39/53/97/1029395397.db2.gz GPMGPWBUDOXIOM-MRXNPFEDSA-N 1 1 371.441 2.618 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@H]2C1 ZINC001157698038 1029647589 /nfs/dbraw/zinc/64/75/89/1029647589.db2.gz AUYBKOAPYQXDJR-GASCZTMLSA-N 1 1 371.416 2.969 20 5 FFBDMO O=C(NCCC[NH2+]Cc1ccc(-c2ccsc2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001157767338 1029659280 /nfs/dbraw/zinc/65/92/80/1029659280.db2.gz LITIKXQRJRWYEZ-IAGOWNOFSA-N 1 1 359.451 2.676 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2nccc(C)c2[N+](=O)[O-])c2ccccc12 ZINC001158236637 1029766274 /nfs/dbraw/zinc/76/62/74/1029766274.db2.gz NSOCWGWOBGEZMB-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2ccc([N+](=O)[O-])c(C)n2)c2ccccc12 ZINC001158235866 1029766357 /nfs/dbraw/zinc/76/63/57/1029766357.db2.gz DXGKEAURHLGXTC-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(NCC[C@H]2CCC[N@@H+](C)C2)cc1OC ZINC001165290440 1029932488 /nfs/dbraw/zinc/93/24/88/1029932488.db2.gz UOLBQWPKWGLLGN-GFCCVEGCSA-N 1 1 351.403 2.534 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCN(c2ncccc2F)CC1 ZINC000784408402 1030608751 /nfs/dbraw/zinc/60/87/51/1030608751.db2.gz RUNNBKMIUDGLBG-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@H]3CCCOC3)n2)c1 ZINC000842616427 1030826240 /nfs/dbraw/zinc/82/62/40/1030826240.db2.gz ORMKIKGISRKJBW-RDJZCZTQSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1CNC(=O)C1 ZINC001143296282 1031399367 /nfs/dbraw/zinc/39/93/67/1031399367.db2.gz BOYASFQRSGZQQU-HNNXBMFYSA-N 1 1 362.433 2.837 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cccc(Cl)c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530521 1031787788 /nfs/dbraw/zinc/78/77/88/1031787788.db2.gz BJHLVMKJLYKFOH-HZPDHXFCSA-N 1 1 365.861 2.914 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CN2CCOC2=O)C1 ZINC000830100915 1033462317 /nfs/dbraw/zinc/46/23/17/1033462317.db2.gz IRKZQSNQFJHLBM-CQSZACIVSA-N 1 1 363.414 2.656 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225712900 1034377949 /nfs/dbraw/zinc/37/79/49/1034377949.db2.gz LMIRIIPJGGDIKA-GMZLATJGSA-N 1 1 354.790 2.794 20 5 FFBDMO COC(=O)c1cc(OC)c(O[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC001226365516 1034653087 /nfs/dbraw/zinc/65/30/87/1034653087.db2.gz ZLERIXIUZQSVKW-CYBMUJFWSA-N 1 1 352.387 2.642 20 5 FFBDMO Cc1cc[nH+]c(N2CCC(Oc3ncc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)c1 ZINC001227110601 1034937481 /nfs/dbraw/zinc/93/74/81/1034937481.db2.gz BGHNYBVIGMSPSZ-UHFFFAOYSA-N 1 1 359.342 2.649 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O ZINC000832845047 1034998224 /nfs/dbraw/zinc/99/82/24/1034998224.db2.gz BUCMJEWTTFHHLL-NSHDSACASA-N 1 1 368.409 2.543 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229151940 1036526150 /nfs/dbraw/zinc/52/61/50/1036526150.db2.gz ITEYAKCHWABAGR-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2ccc(I)c([N+](=O)[O-])c2)C1 ZINC001229952177 1036996451 /nfs/dbraw/zinc/99/64/51/1036996451.db2.gz XHMLLLRECDDGPP-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H](c3n[nH]cc3NC(C)=O)C2)cc1[N+](=O)[O-] ZINC000501713420 1037057055 /nfs/dbraw/zinc/05/70/55/1037057055.db2.gz IGLBOHVEGUONEQ-AWEZNQCLSA-N 1 1 373.413 2.665 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2nc3c[nH]cc([N+](=O)[O-])c-3n2)C1 ZINC001230231707 1037163328 /nfs/dbraw/zinc/16/33/28/1037163328.db2.gz QDTVAZSPLRWHKD-OLZOCXBDSA-N 1 1 368.397 2.866 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2nc3c[nH]cc([N+](=O)[O-])c-3n2)C1 ZINC001230231706 1037163472 /nfs/dbraw/zinc/16/34/72/1037163472.db2.gz QDTVAZSPLRWHKD-CHWSQXEVSA-N 1 1 368.397 2.866 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](C)[C@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256092952 1038376714 /nfs/dbraw/zinc/37/67/14/1038376714.db2.gz CFALUFULMPRPMP-KBXCAEBGSA-N 1 1 363.458 2.665 20 5 FFBDMO CC[N@@H+](CCn1cccn1)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256100291 1038383794 /nfs/dbraw/zinc/38/37/94/1038383794.db2.gz DHGIYXOITIKYLB-UHFFFAOYSA-N 1 1 373.457 2.791 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(Cl)ccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258144471 1039222938 /nfs/dbraw/zinc/22/29/38/1039222938.db2.gz CIOGRMWHTBDNKR-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO C[C@@H]1CN[C@@H](C)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246694357 1039441807 /nfs/dbraw/zinc/44/18/07/1039441807.db2.gz VXUDFWTTZQJLFU-NWDGAFQWSA-N 1 1 354.401 2.524 20 5 FFBDMO C[C@@H]1CN[C@@H](C)C[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246694357 1039441814 /nfs/dbraw/zinc/44/18/14/1039441814.db2.gz VXUDFWTTZQJLFU-NWDGAFQWSA-N 1 1 354.401 2.524 20 5 FFBDMO COc1cccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c1OC ZINC001248209978 1040174691 /nfs/dbraw/zinc/17/46/91/1040174691.db2.gz HFLTUSYXHUHNCT-AWEZNQCLSA-N 1 1 370.365 2.905 20 5 FFBDMO [NH3+][C@]1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)CCCc2ccccc21 ZINC001248248052 1040191973 /nfs/dbraw/zinc/19/19/73/1040191973.db2.gz PZPUWZFJXQZKGQ-QGZVFWFLSA-N 1 1 355.329 2.718 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001213137862 1040273797 /nfs/dbraw/zinc/27/37/97/1040273797.db2.gz JLQYMONWQMJMSZ-MRXNPFEDSA-N 1 1 367.471 2.589 20 5 FFBDMO CCCNC(=O)[C@@H]1CCCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479314 1040744788 /nfs/dbraw/zinc/74/47/88/1040744788.db2.gz XJRXIDSVZYXSAE-IBGZPJMESA-N 1 1 374.485 2.944 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(c2nccc(Cl)n2)CC1 ZINC001254560248 1040797223 /nfs/dbraw/zinc/79/72/23/1040797223.db2.gz QNISRSPTZKHXPL-CYBMUJFWSA-N 1 1 361.833 2.791 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)N2CCCC2)C1 ZINC001254570066 1040804643 /nfs/dbraw/zinc/80/46/43/1040804643.db2.gz MHLDCNALSYFQTM-DOTOQJQBSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254595677 1040824687 /nfs/dbraw/zinc/82/46/87/1040824687.db2.gz XXSSWIDLHLTGIE-WCXIOVBPSA-N 1 1 359.426 2.517 20 5 FFBDMO Cc1noc([C@H]2CC[C@@H]3[C@@H](CC[N@H+]3[C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)O2)n1 ZINC001254595240 1040824878 /nfs/dbraw/zinc/82/48/78/1040824878.db2.gz HRULBHDSMMAXQC-BRSBDYLESA-N 1 1 370.409 2.748 20 5 FFBDMO Cc1noc([C@@H]2CC[C@@H]3[C@@H](CC[N@H+]3[C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)O2)n1 ZINC001254595248 1040825215 /nfs/dbraw/zinc/82/52/15/1040825215.db2.gz HRULBHDSMMAXQC-TVFCKZIOSA-N 1 1 370.409 2.748 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cn(CC)nc21 ZINC001254597145 1040827237 /nfs/dbraw/zinc/82/72/37/1040827237.db2.gz UTUUDVGPXOABHV-PKOBYXMFSA-N 1 1 370.453 2.914 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@@H]2COC ZINC001254599338 1040829733 /nfs/dbraw/zinc/82/97/33/1040829733.db2.gz YDQSJTNNKVBGDB-NVXWUHKLSA-N 1 1 356.426 2.524 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@@H]2COC ZINC001254599338 1040829739 /nfs/dbraw/zinc/82/97/39/1040829739.db2.gz YDQSJTNNKVBGDB-NVXWUHKLSA-N 1 1 356.426 2.524 20 5 FFBDMO COc1cccnc1O[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611011 1040839218 /nfs/dbraw/zinc/83/92/18/1040839218.db2.gz NVCCHTVFNWVVKD-SJORKVTESA-N 1 1 355.394 2.619 20 5 FFBDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)OC[C@H](C)[N+](=O)[O-])C1 ZINC000813115785 1041110440 /nfs/dbraw/zinc/11/04/40/1041110440.db2.gz ZOQAHWLWQNFVSS-AWEZNQCLSA-N 1 1 359.426 2.616 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)Cc4ccc(F)cc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001262662774 1041782299 /nfs/dbraw/zinc/78/22/99/1041782299.db2.gz NQNITEJTXHOAEJ-KDURUIRLSA-N 1 1 361.417 2.611 20 5 FFBDMO CSc1cccc(C(=O)OC[C@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-] ZINC001263619610 1042404170 /nfs/dbraw/zinc/40/41/70/1042404170.db2.gz AJYQYZPVQOURTQ-CYBMUJFWSA-N 1 1 366.439 2.727 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC001309634151 1043463582 /nfs/dbraw/zinc/46/35/82/1043463582.db2.gz JOOUMOGQGZIVBK-UHFFFAOYSA-N 1 1 369.487 2.707 20 5 FFBDMO Cc1cc(F)ccc1C[N@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C ZINC001317686685 1045119533 /nfs/dbraw/zinc/11/95/33/1045119533.db2.gz RNENYJLUQORZGA-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1cc(F)ccc1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001317686685 1045119535 /nfs/dbraw/zinc/11/95/35/1045119535.db2.gz RNENYJLUQORZGA-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1cc(F)ccc1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C ZINC001317686685 1045119537 /nfs/dbraw/zinc/11/95/37/1045119537.db2.gz RNENYJLUQORZGA-IAGOWNOFSA-N 1 1 351.422 2.516 20 5 FFBDMO Cc1noc([C@@H]([NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC001474763190 1045852498 /nfs/dbraw/zinc/85/24/98/1045852498.db2.gz ZHTAUKPMIISQOB-BZNIZROVSA-N 1 1 361.402 2.990 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001325785038 1046638520 /nfs/dbraw/zinc/63/85/20/1046638520.db2.gz ACCWSIVDFREIIG-LLVKDONJSA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001325785038 1046638526 /nfs/dbraw/zinc/63/85/26/1046638526.db2.gz ACCWSIVDFREIIG-LLVKDONJSA-N 1 1 357.204 2.885 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001290240848 1047949460 /nfs/dbraw/zinc/94/94/60/1047949460.db2.gz KLFGMIHGYPRULY-CQSZACIVSA-N 1 1 371.441 2.979 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001331552416 1047998896 /nfs/dbraw/zinc/99/88/96/1047998896.db2.gz FRJNUOOQOSILLZ-SFHVURJKSA-N 1 1 358.442 2.679 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3nccs3)C2)nc1-c1ccccn1 ZINC001332150890 1048269615 /nfs/dbraw/zinc/26/96/15/1048269615.db2.gz IICMJBOTOMLOCA-GFCCVEGCSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3nccs3)C2)nc1-c1ccccn1 ZINC001332150890 1048269623 /nfs/dbraw/zinc/26/96/23/1048269623.db2.gz IICMJBOTOMLOCA-GFCCVEGCSA-N 1 1 356.411 2.757 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC001328553231 1048351846 /nfs/dbraw/zinc/35/18/46/1048351846.db2.gz LHKCUNXDXAEKEC-CZUORRHYSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC001328553231 1048351859 /nfs/dbraw/zinc/35/18/59/1048351859.db2.gz LHKCUNXDXAEKEC-CZUORRHYSA-N 1 1 361.398 2.741 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCc1nccc(C(F)(F)F)n1 ZINC001333478082 1048924876 /nfs/dbraw/zinc/92/48/76/1048924876.db2.gz CVYPGGATUBSAJU-UHFFFAOYSA-N 1 1 370.331 2.957 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001330142526 1049057150 /nfs/dbraw/zinc/05/71/50/1049057150.db2.gz UFGQWELWPAWZRO-UHFFFAOYSA-N 1 1 366.421 2.678 20 5 FFBDMO CCO[C@@H]1COCC[C@H]1[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001334095343 1049246178 /nfs/dbraw/zinc/24/61/78/1049246178.db2.gz XLEOZOZBSQQJKE-TZMCWYRMSA-N 1 1 359.220 2.641 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001292799433 1049396583 /nfs/dbraw/zinc/39/65/83/1049396583.db2.gz IKSIRQHPAFPBEV-LLVKDONJSA-N 1 1 372.263 2.746 20 5 FFBDMO COc1cc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc([N+](=O)[O-])c1C ZINC001340978304 1051312030 /nfs/dbraw/zinc/31/20/30/1051312030.db2.gz CMYWGKVCHKPMAV-BGYRXZFFSA-N 1 1 373.453 2.860 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC001303575512 1051392765 /nfs/dbraw/zinc/39/27/65/1051392765.db2.gz ZOZQWTIKWJCQDU-AWEZNQCLSA-N 1 1 355.398 2.559 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001303800980 1051451057 /nfs/dbraw/zinc/45/10/57/1051451057.db2.gz KHPOSVGFDNCRIL-ZBFHGGJFSA-N 1 1 360.458 2.654 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001303802581 1051452284 /nfs/dbraw/zinc/45/22/84/1051452284.db2.gz ZLAZBNOHIFUZHB-ZYHUDNBSSA-N 1 1 374.363 2.624 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)c(Br)c1 ZINC001342950219 1051564520 /nfs/dbraw/zinc/56/45/20/1051564520.db2.gz NXIPTSHLLFUHBH-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c(Br)c1 ZINC001342950219 1051564532 /nfs/dbraw/zinc/56/45/32/1051564532.db2.gz NXIPTSHLLFUHBH-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO CCC[C@H](C)C(=O)NCC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001308414188 1052454911 /nfs/dbraw/zinc/45/49/11/1052454911.db2.gz ZPABRRHINRBLGF-NSHDSACASA-N 1 1 372.263 2.999 20 5 FFBDMO COc1ccc([C@H](C[NH+](C)C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335414555 1053346763 /nfs/dbraw/zinc/34/67/63/1053346763.db2.gz YUXPQRAPGUFFDG-RBUKOAKNSA-N 1 1 359.426 2.529 20 5 FFBDMO Cn1cc[nH+]c1CCNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC001336386466 1053959083 /nfs/dbraw/zinc/95/90/83/1053959083.db2.gz QAMRFTALDVOTDJ-UHFFFAOYSA-N 1 1 353.382 2.957 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC001336560213 1054062880 /nfs/dbraw/zinc/06/28/80/1054062880.db2.gz FBULVXIDCIYTAW-SUMWQHHRSA-N 1 1 358.442 2.725 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC001356499291 1055539066 /nfs/dbraw/zinc/53/90/66/1055539066.db2.gz PKQKZYJYDUXMGK-LBPRGKRZSA-N 1 1 359.348 2.772 20 5 FFBDMO C[C@@H]1C[N@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@H](C)CO1 ZINC001350499277 1055802677 /nfs/dbraw/zinc/80/26/77/1055802677.db2.gz FBHZKIPVLZSNMF-GHMZBOCLSA-N 1 1 365.821 2.713 20 5 FFBDMO C[C@@H]1C[N@@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@H](C)CO1 ZINC001350499277 1055802688 /nfs/dbraw/zinc/80/26/88/1055802688.db2.gz FBHZKIPVLZSNMF-GHMZBOCLSA-N 1 1 365.821 2.713 20 5 FFBDMO Cn1c([C@@H]2CCC[N@@H+]2C)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001350505352 1055805166 /nfs/dbraw/zinc/80/51/66/1055805166.db2.gz WYKBPTMXVBDQPW-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@@H]2CCC[N@H+]2C)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001350505352 1055805175 /nfs/dbraw/zinc/80/51/75/1055805175.db2.gz WYKBPTMXVBDQPW-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)[C@H](C)c1ccccc1 ZINC001473291476 1055956717 /nfs/dbraw/zinc/95/67/17/1055956717.db2.gz MPQNGHZDRJNYCH-OAHLLOKOSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)[C@H](C)c1ccccc1 ZINC001473291476 1055956727 /nfs/dbraw/zinc/95/67/27/1055956727.db2.gz MPQNGHZDRJNYCH-OAHLLOKOSA-N 1 1 357.410 2.897 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3C[N@H+]4CCC[C@@H]4CO3)o2)cc1 ZINC001200267437 1056189161 /nfs/dbraw/zinc/18/91/61/1056189161.db2.gz FYBIJGJDIHRLNH-AEFFLSMTSA-N 1 1 357.410 2.808 20 5 FFBDMO C[N@@H+](CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)CC(C)(C)C ZINC001544724831 1071682821 /nfs/dbraw/zinc/68/28/21/1071682821.db2.gz IEZGHXOLHQXVFF-UHFFFAOYSA-N 1 1 363.458 2.943 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175132 1058487551 /nfs/dbraw/zinc/48/75/51/1058487551.db2.gz MGWDXLNTBBRXBT-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175132 1058487557 /nfs/dbraw/zinc/48/75/57/1058487557.db2.gz MGWDXLNTBBRXBT-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@H]1C(C)(C)C ZINC001452608992 1059259348 /nfs/dbraw/zinc/25/93/48/1059259348.db2.gz OBPKPLCTLYLYAO-INIZCTEOSA-N 1 1 351.422 2.855 20 5 FFBDMO CN(CC(C)(C)C[NH2+]CC1CCC2(CC2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001505811295 1059405421 /nfs/dbraw/zinc/40/54/21/1059405421.db2.gz ASAXGZVQMBDUMG-HZPDHXFCSA-N 1 1 351.491 2.696 20 5 FFBDMO C[N@@H+](CC(=O)NCc1ccc(Br)cc1[N+](=O)[O-])CC(C)(C)C ZINC001455244451 1059736964 /nfs/dbraw/zinc/73/69/64/1059736964.db2.gz HOMQNMZFJWQCJU-UHFFFAOYSA-N 1 1 372.263 2.951 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001547207084 1071932098 /nfs/dbraw/zinc/93/20/98/1071932098.db2.gz HCNHHDDSNJHNBO-INIZCTEOSA-N 1 1 374.445 2.725 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848477210 1060098861 /nfs/dbraw/zinc/09/88/61/1060098861.db2.gz NFXOQSSBWJRKNU-OAHLLOKOSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000848484081 1060124461 /nfs/dbraw/zinc/12/44/61/1060124461.db2.gz FMXMQPILGKCBNV-GOSISDBHSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000848484081 1060124467 /nfs/dbraw/zinc/12/44/67/1060124467.db2.gz FMXMQPILGKCBNV-GOSISDBHSA-N 1 1 373.453 2.761 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](CN1CC[C@H](c3ccc([N+](=O)[O-])cc3)C1=O)C2 ZINC000848486931 1060133221 /nfs/dbraw/zinc/13/32/21/1060133221.db2.gz NVYTXDKDECWDPL-QPIRBTGLSA-N 1 1 373.453 2.759 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C[C@H]1C1CC1 ZINC000848489982 1060146239 /nfs/dbraw/zinc/14/62/39/1060146239.db2.gz UNVHKXCHAGVTCY-DLBZAZTESA-N 1 1 370.409 2.547 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC001458239175 1060547666 /nfs/dbraw/zinc/54/76/66/1060547666.db2.gz NCHDSTUFJRADAP-DLBZAZTESA-N 1 1 355.442 2.819 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC001458239187 1060547837 /nfs/dbraw/zinc/54/78/37/1060547837.db2.gz NCHDSTUFJRADAP-SJORKVTESA-N 1 1 355.442 2.819 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1C[C@H](C)OC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001459353112 1060749310 /nfs/dbraw/zinc/74/93/10/1060749310.db2.gz GGMWJKVGTUXTJQ-HNNXBMFYSA-N 1 1 363.458 2.831 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1C[C@H](C)OC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001459353112 1060749325 /nfs/dbraw/zinc/74/93/25/1060749325.db2.gz GGMWJKVGTUXTJQ-HNNXBMFYSA-N 1 1 363.458 2.831 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001460414169 1060986003 /nfs/dbraw/zinc/98/60/03/1060986003.db2.gz DQBTVZVHMFNDBK-UHFFFAOYSA-N 1 1 353.419 2.820 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001460624313 1061036081 /nfs/dbraw/zinc/03/60/81/1061036081.db2.gz ZWJGIZSBZOEGMV-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001460624313 1061036098 /nfs/dbraw/zinc/03/60/98/1061036098.db2.gz ZWJGIZSBZOEGMV-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001460845735 1061126202 /nfs/dbraw/zinc/12/62/02/1061126202.db2.gz NFELLXJEZXUHEI-LLVKDONJSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001460845735 1061126206 /nfs/dbraw/zinc/12/62/06/1061126206.db2.gz NFELLXJEZXUHEI-LLVKDONJSA-N 1 1 370.247 2.658 20 5 FFBDMO C[C@H]1CC[C@@](CO)([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccccc21 ZINC001460944257 1061158087 /nfs/dbraw/zinc/15/80/87/1061158087.db2.gz FSPUJIQUCPSIRO-RBZFPXEDSA-N 1 1 369.421 2.568 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@]12CCCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001460982697 1061177325 /nfs/dbraw/zinc/17/73/25/1061177325.db2.gz XOFKFUWRVINFOD-IBGZPJMESA-N 1 1 359.426 2.519 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@]12CCCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001460982697 1061177331 /nfs/dbraw/zinc/17/73/31/1061177331.db2.gz XOFKFUWRVINFOD-IBGZPJMESA-N 1 1 359.426 2.519 20 5 FFBDMO CC(C)(C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC001526620117 1061185133 /nfs/dbraw/zinc/18/51/33/1061185133.db2.gz GMTICYXATBKRMF-OAHLLOKOSA-N 1 1 362.426 2.669 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC001526656350 1061206569 /nfs/dbraw/zinc/20/65/69/1061206569.db2.gz PZENGRXWGLQVCU-RBUKOAKNSA-N 1 1 353.422 2.947 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1 ZINC001462174069 1061527017 /nfs/dbraw/zinc/52/70/17/1061527017.db2.gz MTXNBXZGPLPQHU-GOSISDBHSA-N 1 1 366.414 2.720 20 5 FFBDMO O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC001440765637 1063354426 /nfs/dbraw/zinc/35/44/26/1063354426.db2.gz ZBXUMVAEMJMZAU-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO COc1cccc(C(=O)N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)c1[N+](=O)[O-] ZINC001471911191 1064848909 /nfs/dbraw/zinc/84/89/09/1064848909.db2.gz ISWIIVPUQZRQSJ-UHFFFAOYSA-N 1 1 358.398 2.963 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH2+][C@@H]2Cc3cccc(O)c3C2)o1 ZINC001473380015 1065252238 /nfs/dbraw/zinc/25/22/38/1065252238.db2.gz OFVORKMHHYFBTO-GFCCVEGCSA-N 1 1 352.350 2.607 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@H]2COC[C@H]2OC)cc1OC ZINC001473535431 1065281785 /nfs/dbraw/zinc/28/17/85/1065281785.db2.gz LNDCYSDTRLFXAP-UVBSCNOISA-N 1 1 368.430 2.532 20 5 FFBDMO C[C@@H]([NH3+])c1nc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 ZINC001576177009 1078202265 /nfs/dbraw/zinc/20/22/65/1078202265.db2.gz IAASBFVBSYHVKS-MRVPVSSYSA-N 1 1 354.819 2.997 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[NH2+]Cc3ccc(F)cc32)c1 ZINC001579242721 1078599125 /nfs/dbraw/zinc/59/91/25/1078599125.db2.gz ZOQJDFZBPHSAKD-NSHDSACASA-N 1 1 359.357 2.881 20 5 FFBDMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001558999094 1076112166 /nfs/dbraw/zinc/11/21/66/1076112166.db2.gz ZGIQVJDSGKPIPN-JTQLQIEISA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001558999094 1076112169 /nfs/dbraw/zinc/11/21/69/1076112169.db2.gz ZGIQVJDSGKPIPN-JTQLQIEISA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001558998943 1076112494 /nfs/dbraw/zinc/11/24/94/1076112494.db2.gz VMPMZXZZPMSJMB-GFCCVEGCSA-N 1 1 351.834 2.876 20 5 FFBDMO CCc1cc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559200001 1076134092 /nfs/dbraw/zinc/13/40/92/1076134092.db2.gz JGYRDIFVZMNFSN-WMLDXEAASA-N 1 1 353.426 2.755 20 5 FFBDMO COc1cccc(C[NH+]2CCN(c3nc4sccn4c3[N+](=O)[O-])CC2)c1 ZINC001559261330 1076141557 /nfs/dbraw/zinc/14/15/57/1076141557.db2.gz TVUBBJIJJLAESK-UHFFFAOYSA-N 1 1 373.438 2.635 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOC[C@H]1CCOC1 ZINC001560312856 1076263172 /nfs/dbraw/zinc/26/31/72/1076263172.db2.gz WQXQUTKCJBDJRE-NSHDSACASA-N 1 1 359.220 2.500 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C[N@H+]1Cc1ccccc1 ZINC001566338700 1076947955 /nfs/dbraw/zinc/94/79/55/1076947955.db2.gz QCLCYRVGQOFNFO-DZGCQCFKSA-N 1 1 354.410 2.570 20 5 FFBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589198609 1080413645 /nfs/dbraw/zinc/41/36/45/1080413645.db2.gz GWNDBBBLPJKIPD-CQSZACIVSA-N 1 1 360.418 2.554 20 5 FFBDMO Cn1nc2c(cc1=O)C[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000093756321 250044075 /nfs/dbraw/zinc/04/40/75/250044075.db2.gz UQKABXQKXHPPIW-UHFFFAOYSA-N 1 1 366.377 2.507 20 5 FFBDMO Cn1nc2c(cc1=O)C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000093756321 250044080 /nfs/dbraw/zinc/04/40/80/250044080.db2.gz UQKABXQKXHPPIW-UHFFFAOYSA-N 1 1 366.377 2.507 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106891401 250296258 /nfs/dbraw/zinc/29/62/58/250296258.db2.gz AZNBMNWLDZCWHU-NSHDSACASA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@@H](O)C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262955 251119031 /nfs/dbraw/zinc/11/90/31/251119031.db2.gz YJZGQSCPYWGRFP-GRYCIOLGSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262955 251119035 /nfs/dbraw/zinc/11/90/35/251119035.db2.gz YJZGQSCPYWGRFP-GRYCIOLGSA-N 1 1 355.822 2.811 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(C4OCCO4)CC3)co2)cc1 ZINC000153459266 251141721 /nfs/dbraw/zinc/14/17/21/251141721.db2.gz POGWFFNZDXSDQZ-UHFFFAOYSA-N 1 1 359.382 2.835 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186839872 251272962 /nfs/dbraw/zinc/27/29/62/251272962.db2.gz QXIGGTSWCQTNML-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186839872 251272966 /nfs/dbraw/zinc/27/29/66/251272966.db2.gz QXIGGTSWCQTNML-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O ZINC000272295072 252003420 /nfs/dbraw/zinc/00/34/20/252003420.db2.gz FXBUIOXZWIOAQM-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O ZINC000272295072 252003423 /nfs/dbraw/zinc/00/34/23/252003423.db2.gz FXBUIOXZWIOAQM-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO CCn1cc(C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])cn1 ZINC000272433906 252037818 /nfs/dbraw/zinc/03/78/18/252037818.db2.gz NPSWHYVMIXGVHH-UHFFFAOYSA-N 1 1 370.356 2.754 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CCO)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272549573 252066660 /nfs/dbraw/zinc/06/66/60/252066660.db2.gz QYMVDTVZBROJEV-QGZVFWFLSA-N 1 1 358.442 2.950 20 5 FFBDMO C[C@@H]1C[C@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000272568330 252069734 /nfs/dbraw/zinc/06/97/34/252069734.db2.gz VJARECJRWDPNJW-XUWXXGDYSA-N 1 1 355.442 2.633 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000272637983 252088267 /nfs/dbraw/zinc/08/82/67/252088267.db2.gz XXZFFXKZMQFLEP-WMZOPIPTSA-N 1 1 360.458 2.653 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1=CC[N@@H+](C)CC1 ZINC000272958177 252175113 /nfs/dbraw/zinc/17/51/13/252175113.db2.gz NGDHFRPWNVUNNM-JTQLQIEISA-N 1 1 368.231 2.738 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000366649105 512122591 /nfs/dbraw/zinc/12/25/91/512122591.db2.gz CGNREDMQFOLABG-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([N+](=O)[O-])cc1OC ZINC000273196325 252247631 /nfs/dbraw/zinc/24/76/31/252247631.db2.gz QOCWTWWUSQSPHO-CQSZACIVSA-N 1 1 366.414 2.587 20 5 FFBDMO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[NH+]1CCCC1 ZINC000276059841 256069572 /nfs/dbraw/zinc/06/95/72/256069572.db2.gz KJODPBLNOZJWMO-OAHLLOKOSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000278037443 256269446 /nfs/dbraw/zinc/26/94/46/256269446.db2.gz HWCYUBQPZNNTCK-UHFFFAOYSA-N 1 1 371.393 2.747 20 5 FFBDMO CC(=O)Nc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC000278776418 256347097 /nfs/dbraw/zinc/34/70/97/256347097.db2.gz YTTQIYMQAJDMHH-UHFFFAOYSA-N 1 1 366.324 2.839 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000286116960 257021203 /nfs/dbraw/zinc/02/12/03/257021203.db2.gz UPBZIHOCPDBYHV-CJNGLKHVSA-N 1 1 350.415 2.977 20 5 FFBDMO COC(=O)c1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC000286575462 257043876 /nfs/dbraw/zinc/04/38/76/257043876.db2.gz WEUIDYQBXTYOMW-UHFFFAOYSA-N 1 1 371.393 2.820 20 5 FFBDMO Cc1nc2ccccn2c(=O)c1CC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000289404264 257279283 /nfs/dbraw/zinc/27/92/83/257279283.db2.gz OMCAXLNZOGYESL-UHFFFAOYSA-N 1 1 366.421 2.628 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000302065642 258085556 /nfs/dbraw/zinc/08/55/56/258085556.db2.gz CUUBVVIMABBLMX-UHFFFAOYSA-N 1 1 355.394 2.704 20 5 FFBDMO C[NH+]1CCN(CCC(C)(C)Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000302252948 258098120 /nfs/dbraw/zinc/09/81/20/258098120.db2.gz NPADJKPFJGLIIF-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO Cc1cc(N2CC[N@H+](CC(C)(C)O)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302512899 258104941 /nfs/dbraw/zinc/10/49/41/258104941.db2.gz TZMZQNRNCAMXAU-CQSZACIVSA-N 1 1 358.442 2.733 20 5 FFBDMO Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302512899 258104942 /nfs/dbraw/zinc/10/49/42/258104942.db2.gz TZMZQNRNCAMXAU-CQSZACIVSA-N 1 1 358.442 2.733 20 5 FFBDMO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665254 258107366 /nfs/dbraw/zinc/10/73/66/258107366.db2.gz PWNCDVJNGNVZRJ-MCIONIFRSA-N 1 1 369.487 2.777 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1Br ZINC000317301722 258115875 /nfs/dbraw/zinc/11/58/75/258115875.db2.gz MONWWBKHWFMQLP-GHMZBOCLSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1[NH+]1CCOCC1 ZINC000301566535 258056309 /nfs/dbraw/zinc/05/63/09/258056309.db2.gz KRDCMEHMLNQANL-IAQYHMDHSA-N 1 1 370.247 2.514 20 5 FFBDMO Cc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)ncc1[N+](=O)[O-] ZINC000301719977 258064709 /nfs/dbraw/zinc/06/47/09/258064709.db2.gz MDEMIHVKTZXYHK-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO Cc1nc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000301736147 258065843 /nfs/dbraw/zinc/06/58/43/258065843.db2.gz VCAKYMNXXNUSGO-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301891177 258072927 /nfs/dbraw/zinc/07/29/27/258072927.db2.gz ODDXHMQAIXQSFB-CYBMUJFWSA-N 1 1 369.487 2.921 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000330554594 258165580 /nfs/dbraw/zinc/16/55/80/258165580.db2.gz GIDZHFJTJWHNGW-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000330587741 258166322 /nfs/dbraw/zinc/16/63/22/258166322.db2.gz UATMFTKVUHIFKJ-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000032540313 506264462 /nfs/dbraw/zinc/26/44/62/506264462.db2.gz CWOZUUSWKNGVIQ-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000032540313 506264470 /nfs/dbraw/zinc/26/44/70/506264470.db2.gz CWOZUUSWKNGVIQ-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000053269871 506344928 /nfs/dbraw/zinc/34/49/28/506344928.db2.gz FDKBZFYSTHZNGZ-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000053269871 506344934 /nfs/dbraw/zinc/34/49/34/506344934.db2.gz FDKBZFYSTHZNGZ-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ccc(C(=O)NC3CC3)cc1[N+](=O)[O-])CC2 ZINC000375346333 512278540 /nfs/dbraw/zinc/27/85/40/512278540.db2.gz WVEJYSBNGPFTID-UHFFFAOYSA-N 1 1 358.442 2.552 20 5 FFBDMO Nc1ccc(C(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000053944834 506464812 /nfs/dbraw/zinc/46/48/12/506464812.db2.gz WRKOLHCSMNVSEJ-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO Nc1ccc(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000053944834 506464816 /nfs/dbraw/zinc/46/48/16/506464816.db2.gz WRKOLHCSMNVSEJ-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO C[N@H+](CCOc1ccccc1F)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375443 506850399 /nfs/dbraw/zinc/85/03/99/506850399.db2.gz OWMJWOTZINKUDY-QGZVFWFLSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccccc1F)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375443 506850403 /nfs/dbraw/zinc/85/04/03/506850403.db2.gz OWMJWOTZINKUDY-QGZVFWFLSA-N 1 1 373.384 2.850 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H](c1cccs1)[NH+](C)C ZINC000045797392 507021577 /nfs/dbraw/zinc/02/15/77/507021577.db2.gz UXDPWSIVCIWZEX-ZDUSSCGKSA-N 1 1 369.468 2.546 20 5 FFBDMO COC(=O)c1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000016565109 507096400 /nfs/dbraw/zinc/09/64/00/507096400.db2.gz GAQMQZGDPXBRHI-UHFFFAOYSA-N 1 1 355.394 2.704 20 5 FFBDMO CCOc1cc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000046859889 507210293 /nfs/dbraw/zinc/21/02/93/507210293.db2.gz XODXREMPIKAWDL-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO O=C(CN1CCC[N@@H+](Cc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000022421369 507292528 /nfs/dbraw/zinc/29/25/28/507292528.db2.gz DKNHITYDFZWVCN-UHFFFAOYSA-N 1 1 368.437 2.741 20 5 FFBDMO Cc1ccnc(NC(=O)C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000069012014 507381078 /nfs/dbraw/zinc/38/10/78/507381078.db2.gz IJNHZQVIABRMNA-UHFFFAOYSA-N 1 1 358.398 2.638 20 5 FFBDMO Cc1ccnc(NC(=O)C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000069012014 507381080 /nfs/dbraw/zinc/38/10/80/507381080.db2.gz IJNHZQVIABRMNA-UHFFFAOYSA-N 1 1 358.398 2.638 20 5 FFBDMO C[C@H]1C[NH+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])o2)C[C@H](C)O1 ZINC000048361434 507508599 /nfs/dbraw/zinc/50/85/99/507508599.db2.gz HVUUHXCJMVUAHQ-KBPBESRZSA-N 1 1 373.409 2.727 20 5 FFBDMO C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000025939328 507546338 /nfs/dbraw/zinc/54/63/38/507546338.db2.gz LLVJLHPSALIHPX-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1OC ZINC000051321799 507760912 /nfs/dbraw/zinc/76/09/12/507760912.db2.gz JJXYNDNGUOWSLR-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1OC ZINC000051321799 507760915 /nfs/dbraw/zinc/76/09/15/507760915.db2.gz JJXYNDNGUOWSLR-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000064312890 507789519 /nfs/dbraw/zinc/78/95/19/507789519.db2.gz SXJYBPSSZTUDMD-OWCLPIDISA-N 1 1 363.458 2.846 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000052488264 507810685 /nfs/dbraw/zinc/81/06/85/507810685.db2.gz BWXXQQLMKWQWMH-UHFFFAOYSA-N 1 1 369.487 2.555 20 5 FFBDMO C[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000089306331 507828176 /nfs/dbraw/zinc/82/81/76/507828176.db2.gz SYBSBHIGMLBCQA-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000089306331 507828177 /nfs/dbraw/zinc/82/81/77/507828177.db2.gz SYBSBHIGMLBCQA-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000072773052 507852101 /nfs/dbraw/zinc/85/21/01/507852101.db2.gz SQGABNGFOWOMBR-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000072773052 507852103 /nfs/dbraw/zinc/85/21/03/507852103.db2.gz SQGABNGFOWOMBR-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCN(C)c1ccccc1 ZINC000107683023 507862650 /nfs/dbraw/zinc/86/26/50/507862650.db2.gz HLVQWHGLSPGFBO-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN(C)c1ccccc1 ZINC000107683023 507862653 /nfs/dbraw/zinc/86/26/53/507862653.db2.gz HLVQWHGLSPGFBO-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000108333330 507887187 /nfs/dbraw/zinc/88/71/87/507887187.db2.gz JLSSEZRXECCMGJ-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)Cc1ccc(OC)cc1 ZINC000090548632 507926863 /nfs/dbraw/zinc/92/68/63/507926863.db2.gz SEDFHBGOXAIXCU-HNNXBMFYSA-N 1 1 359.426 2.718 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000090590330 507929183 /nfs/dbraw/zinc/92/91/83/507929183.db2.gz KPTQQLBHZCGUDB-INIZCTEOSA-N 1 1 363.801 2.563 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCN(c3ncnc4sccc43)CC2)cc1 ZINC000074158205 507992645 /nfs/dbraw/zinc/99/26/45/507992645.db2.gz RGGPOXHMZPMKII-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000079804446 508002524 /nfs/dbraw/zinc/00/25/24/508002524.db2.gz YXSHBZFLEHUGJL-VIFPVBQESA-N 1 1 356.220 2.570 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCC(N(C)S(C)(=O)=O)CC2)cc1[N+](=O)[O-] ZINC000092530216 508079538 /nfs/dbraw/zinc/07/95/38/508079538.db2.gz JZFFXUNQTSAPDT-UHFFFAOYSA-N 1 1 369.487 2.574 20 5 FFBDMO COc1ccc(OC)c(C[N@@H+](CCO)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000111271562 508085287 /nfs/dbraw/zinc/08/52/87/508085287.db2.gz GKMOVUWVMCKDPS-UHFFFAOYSA-N 1 1 360.410 2.649 20 5 FFBDMO C[C@H](CCO)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000093303084 508136758 /nfs/dbraw/zinc/13/67/58/508136758.db2.gz XTZBHVIPWZCHNU-MRXNPFEDSA-N 1 1 371.437 2.831 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000081364568 508167735 /nfs/dbraw/zinc/16/77/35/508167735.db2.gz IQQQRXIJBZWLAF-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000076496153 508214867 /nfs/dbraw/zinc/21/48/67/508214867.db2.gz YNEUWDDLYNZIAW-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000076496153 508214869 /nfs/dbraw/zinc/21/48/69/508214869.db2.gz YNEUWDDLYNZIAW-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO O=C(C[N@@H+](CCO)[C@@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000114192598 508298753 /nfs/dbraw/zinc/29/87/53/508298753.db2.gz LNRLISBDPHQQSC-QGZVFWFLSA-N 1 1 355.394 2.515 20 5 FFBDMO O=C(C[N@H+](CCO)[C@@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000114192598 508298755 /nfs/dbraw/zinc/29/87/55/508298755.db2.gz LNRLISBDPHQQSC-QGZVFWFLSA-N 1 1 355.394 2.515 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCc2ccccc2C1 ZINC000114489989 508320989 /nfs/dbraw/zinc/32/09/89/508320989.db2.gz QRCTXVQINQWKNM-GOSISDBHSA-N 1 1 365.433 2.973 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087135537 508339068 /nfs/dbraw/zinc/33/90/68/508339068.db2.gz ARCLBQHASRDIHD-LSDHHAIUSA-N 1 1 360.458 2.783 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088616522 508379605 /nfs/dbraw/zinc/37/96/05/508379605.db2.gz ACZFBMXREXZDPE-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088616522 508379607 /nfs/dbraw/zinc/37/96/07/508379607.db2.gz ACZFBMXREXZDPE-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000115270943 508380053 /nfs/dbraw/zinc/38/00/53/508380053.db2.gz MJGLHZHQYKHUHG-OCCSQVGLSA-N 1 1 369.487 2.832 20 5 FFBDMO CC1CCC([NH+]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)CC2)CC1 ZINC000115481143 508396654 /nfs/dbraw/zinc/39/66/54/508396654.db2.gz YFEWUTDNNLYKJA-UHFFFAOYSA-N 1 1 371.441 2.808 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000127335532 508434568 /nfs/dbraw/zinc/43/45/68/508434568.db2.gz SNTVBOPHMPAGNZ-ZIAGYGMSSA-N 1 1 351.472 2.876 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[NH+](CCOC(C)C)CC1 ZINC000127933439 508523462 /nfs/dbraw/zinc/52/34/62/508523462.db2.gz UGIJTMFYROEJHV-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341315 508593564 /nfs/dbraw/zinc/59/35/64/508593564.db2.gz LOERFPSHDCWJEX-HOCLYGCPSA-N 1 1 363.414 2.518 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000122861081 508597542 /nfs/dbraw/zinc/59/75/42/508597542.db2.gz JUCQJPLVUUECLW-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000153749916 508640794 /nfs/dbraw/zinc/64/07/94/508640794.db2.gz GHDNRFVBNOVTJL-IBGZPJMESA-N 1 1 374.485 2.610 20 5 FFBDMO CC(=O)c1ccc(OC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000153839633 508659991 /nfs/dbraw/zinc/65/99/91/508659991.db2.gz CHZQOXALHKFWKK-SFHVURJKSA-N 1 1 370.405 2.595 20 5 FFBDMO CC(=O)c1ccc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000153839633 508659994 /nfs/dbraw/zinc/65/99/94/508659994.db2.gz CHZQOXALHKFWKK-SFHVURJKSA-N 1 1 370.405 2.595 20 5 FFBDMO C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123492980 508695033 /nfs/dbraw/zinc/69/50/33/508695033.db2.gz UWPVULNMSRNPJZ-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000118973983 508698630 /nfs/dbraw/zinc/69/86/30/508698630.db2.gz VDRNOPZIPQEQMA-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000123662620 508722594 /nfs/dbraw/zinc/72/25/94/508722594.db2.gz WQUKWWNJSJWSGN-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000119156243 508737331 /nfs/dbraw/zinc/73/73/31/508737331.db2.gz XNTXWIVOJAIHAH-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(c4ncccn4)CC3)o2)cc1 ZINC000158810007 508755074 /nfs/dbraw/zinc/75/50/74/508755074.db2.gz VOZBYHBHYMNILZ-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137460075 508757017 /nfs/dbraw/zinc/75/70/17/508757017.db2.gz MYFGUFBVIRJSJQ-RDJZCZTQSA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137460136 508757061 /nfs/dbraw/zinc/75/70/61/508757061.db2.gz MYFGUFBVIRJSJQ-NVXWUHKLSA-N 1 1 369.421 2.753 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000137507003 508757957 /nfs/dbraw/zinc/75/79/57/508757957.db2.gz QWMWUBHEIMJBLQ-DZGCQCFKSA-N 1 1 371.441 2.663 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1Cc2ccccc2C1 ZINC000141272322 508813659 /nfs/dbraw/zinc/81/36/59/508813659.db2.gz YHLZXNORRWRYOA-UHFFFAOYSA-N 1 1 355.394 2.641 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000369458943 512419363 /nfs/dbraw/zinc/41/93/63/512419363.db2.gz SNGWOXXRYFTORW-KGLIPLIRSA-N 1 1 367.833 2.760 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1CC1 ZINC000143946223 508835771 /nfs/dbraw/zinc/83/57/71/508835771.db2.gz AZAOTWDHBAHZNM-UHFFFAOYSA-N 1 1 364.398 2.627 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000119833383 508872972 /nfs/dbraw/zinc/87/29/72/508872972.db2.gz HUBOQGXXFKTORG-KDOFPFPSSA-N 1 1 369.421 2.854 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000119852106 508876377 /nfs/dbraw/zinc/87/63/77/508876377.db2.gz ZUKVLCUDLWACMZ-GASCZTMLSA-N 1 1 364.446 2.832 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1csc(Br)c1 ZINC000159775437 508889620 /nfs/dbraw/zinc/88/96/20/508889620.db2.gz KICXRJLMWPMMIF-UHFFFAOYSA-N 1 1 372.244 2.713 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1csc(Br)c1 ZINC000159775437 508889625 /nfs/dbraw/zinc/88/96/25/508889625.db2.gz KICXRJLMWPMMIF-UHFFFAOYSA-N 1 1 372.244 2.713 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150863935 508910649 /nfs/dbraw/zinc/91/06/49/508910649.db2.gz DTJHUNUSILJYFI-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150863935 508910653 /nfs/dbraw/zinc/91/06/53/508910653.db2.gz DTJHUNUSILJYFI-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCc2sccc2C1 ZINC000131347091 508919907 /nfs/dbraw/zinc/91/99/07/508919907.db2.gz RLFAOJQAVVSADB-UHFFFAOYSA-N 1 1 371.462 2.989 20 5 FFBDMO Cc1nc2ccccn2c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000160491247 508993747 /nfs/dbraw/zinc/99/37/47/508993747.db2.gz AXKFGELEDJTTDS-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CCc2sccc2C1 ZINC000160513790 508997416 /nfs/dbraw/zinc/99/74/16/508997416.db2.gz STIBFHADXOXNSV-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCc2sccc2C1 ZINC000160513790 508997417 /nfs/dbraw/zinc/99/74/17/508997417.db2.gz STIBFHADXOXNSV-UHFFFAOYSA-N 1 1 374.466 2.556 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000155540550 509022297 /nfs/dbraw/zinc/02/22/97/509022297.db2.gz BUAWCHMKOYZQTH-IYBDPMFKSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000155540550 509022299 /nfs/dbraw/zinc/02/22/99/509022299.db2.gz BUAWCHMKOYZQTH-IYBDPMFKSA-N 1 1 363.461 2.706 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)CC1 ZINC000120727587 509053698 /nfs/dbraw/zinc/05/36/98/509053698.db2.gz LQZDMMFQWKIWPY-UHFFFAOYSA-N 1 1 370.247 2.834 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3cccs3)CC2)c([N+](=O)[O-])c1 ZINC000121454918 509174805 /nfs/dbraw/zinc/17/48/05/509174805.db2.gz JZOATFNIQFBDMT-UHFFFAOYSA-N 1 1 363.439 2.866 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000195694045 509215994 /nfs/dbraw/zinc/21/59/94/509215994.db2.gz PQCDNSFZZYFNDH-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248055180 509226924 /nfs/dbraw/zinc/22/69/24/509226924.db2.gz OHISILKNUUWCOI-IEBWSBKVSA-N 1 1 355.394 2.535 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000191891102 509232680 /nfs/dbraw/zinc/23/26/80/509232680.db2.gz SZHZFXSENZHWQU-MRXNPFEDSA-N 1 1 371.441 2.548 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000191891102 509232688 /nfs/dbraw/zinc/23/26/88/509232688.db2.gz SZHZFXSENZHWQU-MRXNPFEDSA-N 1 1 371.441 2.548 20 5 FFBDMO COC(=O)C[C@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccncc1 ZINC000191902960 509237674 /nfs/dbraw/zinc/23/76/74/509237674.db2.gz MEMSCDWFBKNTOV-SFHVURJKSA-N 1 1 359.382 2.567 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000182456330 509248456 /nfs/dbraw/zinc/24/84/56/509248456.db2.gz VINUVVPJKOKWNZ-NSHDSACASA-N 1 1 370.377 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000266959812 509278353 /nfs/dbraw/zinc/27/83/53/509278353.db2.gz WOOLULUMSVHYMB-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3N)cc2)CC1 ZINC000176036401 509286605 /nfs/dbraw/zinc/28/66/05/509286605.db2.gz MEEDCIWEORUCHA-UHFFFAOYSA-N 1 1 369.425 2.571 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000185719534 509322769 /nfs/dbraw/zinc/32/27/69/509322769.db2.gz CXMZWUNPSHEECM-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000185719534 509322776 /nfs/dbraw/zinc/32/27/76/509322776.db2.gz CXMZWUNPSHEECM-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000185719534 509322781 /nfs/dbraw/zinc/32/27/81/509322781.db2.gz CXMZWUNPSHEECM-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)ccc1OC(F)F ZINC000176207031 509378198 /nfs/dbraw/zinc/37/81/98/509378198.db2.gz RFVXGAPWSVSWNZ-UHFFFAOYSA-N 1 1 370.356 2.923 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)CCn1ccc([N+](=O)[O-])n1 ZINC000176224248 509388101 /nfs/dbraw/zinc/38/81/01/509388101.db2.gz XSJOCOBLYLJEIO-UHFFFAOYSA-N 1 1 354.414 2.746 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(Br)c1 ZINC000267276532 509423489 /nfs/dbraw/zinc/42/34/89/509423489.db2.gz UKGPCUDLZMPHKW-SECBINFHSA-N 1 1 352.192 2.859 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000248701138 509442659 /nfs/dbraw/zinc/44/26/59/509442659.db2.gz AFZKVOPMXUGHAO-DNVCBOLYSA-N 1 1 369.421 2.610 20 5 FFBDMO Cc1cc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000182824590 509444344 /nfs/dbraw/zinc/44/43/44/509444344.db2.gz MUCGNTFPBISQLZ-KGLIPLIRSA-N 1 1 360.458 2.868 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179453315 509450795 /nfs/dbraw/zinc/45/07/95/509450795.db2.gz VYHGXLHSHMKHEN-UHFFFAOYSA-N 1 1 355.398 2.672 20 5 FFBDMO C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182841589 509454855 /nfs/dbraw/zinc/45/48/55/509454855.db2.gz VNFJQGBDRFUPQC-VXGBXAGGSA-N 1 1 364.421 2.699 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000248898503 509536065 /nfs/dbraw/zinc/53/60/65/509536065.db2.gz UEKGQFYWMCULRP-SUMWQHHRSA-N 1 1 357.385 2.984 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000248907185 509539909 /nfs/dbraw/zinc/53/99/09/509539909.db2.gz UYOOUKDRAJTEKV-DNVCBOLYSA-N 1 1 369.421 2.610 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCOC1)C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000164858959 509541384 /nfs/dbraw/zinc/54/13/84/509541384.db2.gz LDCHBDWANIIMNK-LLVKDONJSA-N 1 1 353.806 2.688 20 5 FFBDMO COc1cc(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000186166048 509555883 /nfs/dbraw/zinc/55/58/83/509555883.db2.gz ULSPNXDCXYNLQI-FQEVSTJZSA-N 1 1 371.437 2.677 20 5 FFBDMO CCOc1cccc(NC[C@@H](C)CN2CC[NH+](CC)CC2)c1[N+](=O)[O-] ZINC000189444975 509579108 /nfs/dbraw/zinc/57/91/08/509579108.db2.gz UQLWVICYXNISEH-OAHLLOKOSA-N 1 1 350.463 2.679 20 5 FFBDMO CCOC(=O)C[C@H](C)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000183181438 509644159 /nfs/dbraw/zinc/64/41/59/509644159.db2.gz FTOTUKSTXCIOCB-ZDUSSCGKSA-N 1 1 360.414 2.769 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000192807976 509652057 /nfs/dbraw/zinc/65/20/57/509652057.db2.gz SIRDNWQOYDLZJU-CZUORRHYSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000249398025 509670826 /nfs/dbraw/zinc/67/08/26/509670826.db2.gz BNONDLCJFYFDKF-KFWWJZLASA-N 1 1 364.446 2.766 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1c1ccccc1 ZINC000180146815 509778792 /nfs/dbraw/zinc/77/87/92/509778792.db2.gz KAUABHDMDALFDP-WMZOPIPTSA-N 1 1 365.393 2.646 20 5 FFBDMO COc1cc(C[NH+]2CCC(C)(O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180165516 509789987 /nfs/dbraw/zinc/78/99/87/509789987.db2.gz JNRUKYIHEYVGLX-UHFFFAOYSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180185699 509798928 /nfs/dbraw/zinc/79/89/28/509798928.db2.gz JBDQKEITVBCAMV-MRXNPFEDSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180185699 509798934 /nfs/dbraw/zinc/79/89/34/509798934.db2.gz JBDQKEITVBCAMV-MRXNPFEDSA-N 1 1 360.357 2.594 20 5 FFBDMO C[C@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)C1 ZINC000252179142 509834017 /nfs/dbraw/zinc/83/40/17/509834017.db2.gz PQWOJKFYCBQVLY-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NCCNc2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000193333000 509870394 /nfs/dbraw/zinc/87/03/94/509870394.db2.gz SQAAVMYGCRRJPA-UHFFFAOYSA-N 1 1 372.429 2.512 20 5 FFBDMO O=C(C[N@H+](CCc1ccccc1)[C@@H]1CCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000177141726 509898402 /nfs/dbraw/zinc/89/84/02/509898402.db2.gz NYSRLWWCCOUBPM-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(C[N@@H+](CCc1ccccc1)[C@@H]1CCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000177141726 509898404 /nfs/dbraw/zinc/89/84/04/509898404.db2.gz NYSRLWWCCOUBPM-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O ZINC000190043581 509904605 /nfs/dbraw/zinc/90/46/05/509904605.db2.gz LEGIXEOTHLARCP-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[N@H+]1C1CC1 ZINC000177179055 509920463 /nfs/dbraw/zinc/92/04/63/509920463.db2.gz PAJMQTLKAIDHIC-ZIAGYGMSSA-N 1 1 358.442 2.550 20 5 FFBDMO Cc1nsc(N2CCC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000255871271 509937515 /nfs/dbraw/zinc/93/75/15/509937515.db2.gz LYPKSHDFFYFOFH-DAXSKMNVSA-N 1 1 359.455 2.980 20 5 FFBDMO Cc1nsc(N2CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000255871271 509937527 /nfs/dbraw/zinc/93/75/27/509937527.db2.gz LYPKSHDFFYFOFH-DAXSKMNVSA-N 1 1 359.455 2.980 20 5 FFBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000245457952 509946842 /nfs/dbraw/zinc/94/68/42/509946842.db2.gz CJCZLGBGKHJRLS-OGHNNQOOSA-N 1 1 366.849 2.930 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@H](N2CCOCC2)[C@@H](C)C1 ZINC000177226361 509947447 /nfs/dbraw/zinc/94/74/47/509947447.db2.gz DLIYXHHXNCPSQT-YJBOKZPZSA-N 1 1 363.458 2.535 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000268474552 509954289 /nfs/dbraw/zinc/95/42/89/509954289.db2.gz JDANDBFOPYEHEY-LLVKDONJSA-N 1 1 357.252 2.920 20 5 FFBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-] ZINC000190211307 510007525 /nfs/dbraw/zinc/00/75/25/510007525.db2.gz AUXAGGGJHYGFOS-MRXNPFEDSA-N 1 1 363.458 2.685 20 5 FFBDMO C[C@H]1CCCN(C(=O)C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000174241703 510020934 /nfs/dbraw/zinc/02/09/34/510020934.db2.gz NRLMFPPQROBWQC-HNNXBMFYSA-N 1 1 361.442 2.697 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000245670180 510074064 /nfs/dbraw/zinc/07/40/64/510074064.db2.gz RYKUPPNLPHJJEU-RTBURBONSA-N 1 1 368.437 2.882 20 5 FFBDMO CC[C@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000184006532 510084451 /nfs/dbraw/zinc/08/44/51/510084451.db2.gz ATSAMWYYNCNAHR-KRWDZBQOSA-N 1 1 368.437 2.795 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]21 ZINC000268936688 510146717 /nfs/dbraw/zinc/14/67/17/510146717.db2.gz OYIYIXGCKYHACO-WBMJQRKESA-N 1 1 366.849 2.874 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccccn1)C1CC1 ZINC000180868772 510153285 /nfs/dbraw/zinc/15/32/85/510153285.db2.gz WWEZXGZHPNIZJD-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000177612766 510160166 /nfs/dbraw/zinc/16/01/66/510160166.db2.gz QALQTFSUYHSXFB-OAHLLOKOSA-N 1 1 360.458 2.778 20 5 FFBDMO CC(C)N1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000265682231 510171953 /nfs/dbraw/zinc/17/19/53/510171953.db2.gz JPAKFGIOQHINOM-CYBMUJFWSA-N 1 1 360.439 2.817 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184195400 510186593 /nfs/dbraw/zinc/18/65/93/510186593.db2.gz NXWABUISGFEDER-CYBMUJFWSA-N 1 1 367.421 2.871 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184195400 510186599 /nfs/dbraw/zinc/18/65/99/510186599.db2.gz NXWABUISGFEDER-CYBMUJFWSA-N 1 1 367.421 2.871 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)[NH2+]Cc2ccccc21 ZINC000262301010 510236766 /nfs/dbraw/zinc/23/67/66/510236766.db2.gz XLYGSZPRFHNQMR-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289081 510242223 /nfs/dbraw/zinc/24/22/23/510242223.db2.gz NJANADIQNMNMSX-ZDUSSCGKSA-N 1 1 362.405 2.931 20 5 FFBDMO C[N@H+](CCc1ccc(Br)cc1)CCn1cc([N+](=O)[O-])cn1 ZINC000174852211 510344550 /nfs/dbraw/zinc/34/45/50/510344550.db2.gz DYAKXKUHCVWRBQ-UHFFFAOYSA-N 1 1 353.220 2.728 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246186648 510347225 /nfs/dbraw/zinc/34/72/25/510347225.db2.gz LLPXYKKWZXEULX-CJNGLKHVSA-N 1 1 357.414 2.876 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000194458516 510374774 /nfs/dbraw/zinc/37/47/74/510374774.db2.gz VMMBWENOLMDPOM-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404061 510392347 /nfs/dbraw/zinc/39/23/47/510392347.db2.gz RYTZDVKFBDRKQO-ZYHUDNBSSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404061 510392356 /nfs/dbraw/zinc/39/23/56/510392356.db2.gz RYTZDVKFBDRKQO-ZYHUDNBSSA-N 1 1 360.357 2.940 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCO1 ZINC000246319018 510423148 /nfs/dbraw/zinc/42/31/48/510423148.db2.gz HTDZOCCJFLSTMY-AEFFLSMTSA-N 1 1 352.431 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000194653595 510465637 /nfs/dbraw/zinc/46/56/37/510465637.db2.gz NXVSYCAZYJHFED-SFHVURJKSA-N 1 1 369.421 2.884 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000175130749 510497721 /nfs/dbraw/zinc/49/77/21/510497721.db2.gz OMLJYRJFIKNSHO-ZBFHGGJFSA-N 1 1 369.487 2.562 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000172164733 510577997 /nfs/dbraw/zinc/57/79/97/510577997.db2.gz WWUHAFMOMORZDA-TZMCWYRMSA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@H]1C ZINC000191401932 510642197 /nfs/dbraw/zinc/64/21/97/510642197.db2.gz FXXCQSXBELKSSU-CQSZACIVSA-N 1 1 364.446 2.521 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)n1 ZINC000191578746 510735012 /nfs/dbraw/zinc/73/50/12/510735012.db2.gz MKQIUIBNCGMQTB-MRXNPFEDSA-N 1 1 371.441 2.596 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1 ZINC000182063627 510735608 /nfs/dbraw/zinc/73/56/08/510735608.db2.gz SCMKMMVPWNFORQ-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172561604 510791869 /nfs/dbraw/zinc/79/18/69/510791869.db2.gz HHAGHBBDQIZSHV-UHFFFAOYSA-N 1 1 360.458 2.797 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCO1 ZINC000178857115 510807042 /nfs/dbraw/zinc/80/70/42/510807042.db2.gz LMFUQBCREJBPLI-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCO1 ZINC000178857115 510807048 /nfs/dbraw/zinc/80/70/48/510807048.db2.gz LMFUQBCREJBPLI-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO Cc1cc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)nc(N2CCCC2)n1 ZINC000294066227 510945804 /nfs/dbraw/zinc/94/58/04/510945804.db2.gz HLYVYBBSKKDSCU-ZDUSSCGKSA-N 1 1 356.430 2.726 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC([C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000364657562 510999499 /nfs/dbraw/zinc/99/94/99/510999499.db2.gz MRCJOUJJCKBXDL-GDBMZVCRSA-N 1 1 361.442 2.979 20 5 FFBDMO COCOc1ccc(OC)cc1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000271252187 511137802 /nfs/dbraw/zinc/13/78/02/511137802.db2.gz XEIGYCJYAWTEHH-UHFFFAOYSA-N 1 1 362.382 2.885 20 5 FFBDMO C[C@@H]1CN(c2c(Br)cncc2[N+](=O)[O-])CC[N@@H+](C2CC2)C1 ZINC000294877916 511206369 /nfs/dbraw/zinc/20/63/69/511206369.db2.gz FRQWACXZFHAGKT-JTQLQIEISA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@@H]1CN(c2c(Br)cncc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000294877916 511206374 /nfs/dbraw/zinc/20/63/74/511206374.db2.gz FRQWACXZFHAGKT-JTQLQIEISA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+]1C ZINC000294934727 511226713 /nfs/dbraw/zinc/22/67/13/511226713.db2.gz LEVDQBITTNXWDI-DOMZBBRYSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@@H+]1C ZINC000294934727 511226718 /nfs/dbraw/zinc/22/67/18/511226718.db2.gz LEVDQBITTNXWDI-DOMZBBRYSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@H+]1C ZINC000294934727 511226722 /nfs/dbraw/zinc/22/67/22/511226722.db2.gz LEVDQBITTNXWDI-DOMZBBRYSA-N 1 1 357.414 2.540 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000298356578 511256747 /nfs/dbraw/zinc/25/67/47/511256747.db2.gz CCRAWWXNKPEJGG-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000271615437 511264018 /nfs/dbraw/zinc/26/40/18/511264018.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000271615437 511264023 /nfs/dbraw/zinc/26/40/23/511264023.db2.gz DAQSBZYIOQKLKS-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CCNC(=O)c1cccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271669625 511281448 /nfs/dbraw/zinc/28/14/48/511281448.db2.gz ARULAAFVIPJGAZ-CYBMUJFWSA-N 1 1 370.409 2.634 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c([N+](=O)[O-])c1 ZINC000298555493 511326846 /nfs/dbraw/zinc/32/68/46/511326846.db2.gz OQJISBREAKFBJG-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c([N+](=O)[O-])c1 ZINC000298555493 511326851 /nfs/dbraw/zinc/32/68/51/511326851.db2.gz OQJISBREAKFBJG-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291938243 511398510 /nfs/dbraw/zinc/39/85/10/511398510.db2.gz TYEAEBXHLBFENQ-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291938243 511398516 /nfs/dbraw/zinc/39/85/16/511398516.db2.gz TYEAEBXHLBFENQ-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000280484329 511483051 /nfs/dbraw/zinc/48/30/51/511483051.db2.gz AHGBHRQFCMRISP-NRFANRHFSA-N 1 1 350.418 2.904 20 5 FFBDMO COc1ccc(NC(=O)Cn2c[nH+]c3c2C[C@@H](C)[C@@H](C)C3)c([N+](=O)[O-])c1 ZINC000295716643 511493398 /nfs/dbraw/zinc/49/33/98/511493398.db2.gz GOFGPWQJLSZOIB-NWDGAFQWSA-N 1 1 358.398 2.809 20 5 FFBDMO C[C@H]1C[C@@H](N(C)Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000363355219 511499511 /nfs/dbraw/zinc/49/95/11/511499511.db2.gz IFPYLARFENUJIE-RDJZCZTQSA-N 1 1 357.458 2.813 20 5 FFBDMO CC(C)([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000292249578 511521853 /nfs/dbraw/zinc/52/18/53/511521853.db2.gz XNWBSFOGSXQPGT-DLBZAZTESA-N 1 1 361.442 2.590 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194955 511547425 /nfs/dbraw/zinc/54/74/25/511547425.db2.gz MHHUBJVFHCIQHU-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194955 511547428 /nfs/dbraw/zinc/54/74/28/511547428.db2.gz MHHUBJVFHCIQHU-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292404052 511585009 /nfs/dbraw/zinc/58/50/09/511585009.db2.gz TZXFJGRHCBTETJ-GJZGRUSLSA-N 1 1 360.458 2.728 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C2CC2)O1 ZINC000280743865 511585165 /nfs/dbraw/zinc/58/51/65/511585165.db2.gz ZYYAGUAIMYYLQU-UGSOOPFHSA-N 1 1 356.426 2.995 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C2CC2)O1 ZINC000280743865 511585170 /nfs/dbraw/zinc/58/51/70/511585170.db2.gz ZYYAGUAIMYYLQU-UGSOOPFHSA-N 1 1 356.426 2.995 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000299420223 511629337 /nfs/dbraw/zinc/62/93/37/511629337.db2.gz WUMPFVJDRMAMTC-HZPDHXFCSA-N 1 1 365.430 2.557 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000281180444 511749809 /nfs/dbraw/zinc/74/98/09/511749809.db2.gz QUBBSDCGTJHGGV-VQIMIIECSA-N 1 1 369.421 2.613 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)c1 ZINC000350338567 511781961 /nfs/dbraw/zinc/78/19/61/511781961.db2.gz JQMHROLUCRMZET-CRAIPNDOSA-N 1 1 374.397 2.969 20 5 FFBDMO CNc1c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312569161 511785509 /nfs/dbraw/zinc/78/55/09/511785509.db2.gz ZERIVULDVMFDQS-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO CNc1c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312569159 511785815 /nfs/dbraw/zinc/78/58/15/511785815.db2.gz ZERIVULDVMFDQS-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO CNc1ccc(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350390455 511799621 /nfs/dbraw/zinc/79/96/21/511799621.db2.gz MDCYXRGYSAKSPY-YOEHRIQHSA-N 1 1 359.386 2.612 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000363937944 511861743 /nfs/dbraw/zinc/86/17/43/511861743.db2.gz MBFDZUJDXOUODW-HZPDHXFCSA-N 1 1 372.469 2.942 20 5 FFBDMO CN(C)C(=O)O[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000296758752 511884958 /nfs/dbraw/zinc/88/49/58/511884958.db2.gz PDMTUVBKAPXTFW-OAHLLOKOSA-N 1 1 374.397 2.565 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839751 511960073 /nfs/dbraw/zinc/96/00/73/511960073.db2.gz LTVBUGPOCDQLMQ-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839751 511960077 /nfs/dbraw/zinc/96/00/77/511960077.db2.gz LTVBUGPOCDQLMQ-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839751 511960082 /nfs/dbraw/zinc/96/00/82/511960082.db2.gz LTVBUGPOCDQLMQ-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO Cc1cnc(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC000285031285 511975046 /nfs/dbraw/zinc/97/50/46/511975046.db2.gz VOLJLZRRUKDJML-WMLDXEAASA-N 1 1 358.446 2.551 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000366382904 511991570 /nfs/dbraw/zinc/99/15/70/511991570.db2.gz BUXNARYJOAHEJI-WBVHZDCISA-N 1 1 358.442 2.896 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000281912234 512009427 /nfs/dbraw/zinc/00/94/27/512009427.db2.gz JACLQGLKSQJNNC-CJNGLKHVSA-N 1 1 362.430 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](c4ccncn4)C3)n2)cc1 ZINC000364358016 512098943 /nfs/dbraw/zinc/09/89/43/512098943.db2.gz HUSYJPHSSWWRGI-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](c4ccncn4)C3)n2)cc1 ZINC000364358016 512098946 /nfs/dbraw/zinc/09/89/46/512098946.db2.gz HUSYJPHSSWWRGI-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000364404782 512106890 /nfs/dbraw/zinc/10/68/90/512106890.db2.gz PCFCPYZMRVSISL-WMLDXEAASA-N 1 1 354.410 2.630 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000367334000 512449097 /nfs/dbraw/zinc/44/90/97/512449097.db2.gz WWUNBQPGJBPRSV-BYICEURKSA-N 1 1 372.469 2.545 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000411068163 512458732 /nfs/dbraw/zinc/45/87/32/512458732.db2.gz XIACDBHLPLTQQB-GFCCVEGCSA-N 1 1 367.471 2.882 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000411068163 512458735 /nfs/dbraw/zinc/45/87/35/512458735.db2.gz XIACDBHLPLTQQB-GFCCVEGCSA-N 1 1 367.471 2.882 20 5 FFBDMO COC(=O)c1ccc(F)c(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369681700 512551365 /nfs/dbraw/zinc/55/13/65/512551365.db2.gz OZPAHODTAJFEGL-UHFFFAOYSA-N 1 1 362.361 2.554 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000374015516 512623586 /nfs/dbraw/zinc/62/35/86/512623586.db2.gz VZJLRBJVHHBXER-RKVPGOIHSA-N 1 1 350.415 2.632 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000372103222 512716808 /nfs/dbraw/zinc/71/68/08/512716808.db2.gz QXVRFFKGKWMZSD-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000378427749 512754298 /nfs/dbraw/zinc/75/42/98/512754298.db2.gz JLPRGVZVFWMQOG-QGZVFWFLSA-N 1 1 366.893 2.849 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](C2CCOCC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374363247 512792268 /nfs/dbraw/zinc/79/22/68/512792268.db2.gz PQJUTSMRVKLGTK-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](C2CCOCC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374363247 512792271 /nfs/dbraw/zinc/79/22/71/512792271.db2.gz PQJUTSMRVKLGTK-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c1 ZINC000411979310 512900020 /nfs/dbraw/zinc/90/00/20/512900020.db2.gz CWQQAUXEAIFCSC-XLIONFOSSA-N 1 1 372.421 2.878 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2cn(C)nc2C)c([N+](=O)[O-])c1 ZINC000370405497 512915151 /nfs/dbraw/zinc/91/51/51/512915151.db2.gz JSZJRKRKDMCSJX-INIZCTEOSA-N 1 1 360.414 2.861 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446345 512939130 /nfs/dbraw/zinc/93/91/30/512939130.db2.gz CODWTJWTHWFVOP-KDOFPFPSSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446345 512939136 /nfs/dbraw/zinc/93/91/36/512939136.db2.gz CODWTJWTHWFVOP-KDOFPFPSSA-N 1 1 366.421 2.962 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000412079896 512949053 /nfs/dbraw/zinc/94/90/53/512949053.db2.gz VJFVADUOZQQRAL-KPZWWZAWSA-N 1 1 374.397 2.981 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000398001238 512951318 /nfs/dbraw/zinc/95/13/18/512951318.db2.gz NNIBHMPPZRTSJT-RHSMWYFYSA-N 1 1 368.437 2.817 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000397976616 512951600 /nfs/dbraw/zinc/95/16/00/512951600.db2.gz KWJZIHPNMNUTDR-CZUORRHYSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3[C@H](C)C[NH+](C)C[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000407999465 512981756 /nfs/dbraw/zinc/98/17/56/512981756.db2.gz WGMPRIVJHRMKPO-BZUAXINKSA-N 1 1 374.485 2.996 20 5 FFBDMO CC(=O)c1cc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000368542258 512992877 /nfs/dbraw/zinc/99/28/77/512992877.db2.gz CKACEVGSRKPSSH-ZWKOTPCHSA-N 1 1 369.421 2.845 20 5 FFBDMO COCC[N@@H+](C)CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1 ZINC000450314768 513138334 /nfs/dbraw/zinc/13/83/34/513138334.db2.gz NJQRYMUGZFLYHL-MRXNPFEDSA-N 1 1 359.430 2.815 20 5 FFBDMO Cc1cccc(CN(CC[NH+](C)C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])c1 ZINC000433760269 513144437 /nfs/dbraw/zinc/14/44/37/513144437.db2.gz RNVAUKNBDJSQJZ-UHFFFAOYSA-N 1 1 373.457 2.954 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CCCC[N@@H+]2C2CC2)ncc1[N+](=O)[O-] ZINC000433818922 513158711 /nfs/dbraw/zinc/15/87/11/513158711.db2.gz OCGPYNNUCYNNEW-GFCCVEGCSA-N 1 1 369.263 2.911 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CCCC[N@H+]2C2CC2)ncc1[N+](=O)[O-] ZINC000433818922 513158719 /nfs/dbraw/zinc/15/87/19/513158719.db2.gz OCGPYNNUCYNNEW-GFCCVEGCSA-N 1 1 369.263 2.911 20 5 FFBDMO CCOc1ccccc1C[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)[C@H](C)C1 ZINC000450497377 513222622 /nfs/dbraw/zinc/22/26/22/513222622.db2.gz CVVKFMYXOWPDNY-CQSZACIVSA-N 1 1 371.441 2.803 20 5 FFBDMO CCOc1ccccc1C[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)[C@H](C)C1 ZINC000450497377 513222624 /nfs/dbraw/zinc/22/26/24/513222624.db2.gz CVVKFMYXOWPDNY-CQSZACIVSA-N 1 1 371.441 2.803 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428992593 513242928 /nfs/dbraw/zinc/24/29/28/513242928.db2.gz BHJFLFUFPOWLAJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428992593 513242936 /nfs/dbraw/zinc/24/29/36/513242936.db2.gz BHJFLFUFPOWLAJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428992593 513242945 /nfs/dbraw/zinc/24/29/45/513242945.db2.gz BHJFLFUFPOWLAJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1C ZINC000440080063 513243707 /nfs/dbraw/zinc/24/37/07/513243707.db2.gz QJAMHRIVIRAFSB-TZMCWYRMSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000429012726 513253775 /nfs/dbraw/zinc/25/37/75/513253775.db2.gz VBJJGKZGCYJVBE-CKEIUWERSA-N 1 1 371.441 2.807 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCOC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042782 513266427 /nfs/dbraw/zinc/26/64/27/513266427.db2.gz RHVSAQRLAWQYIA-GDBMZVCRSA-N 1 1 361.442 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCOC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042782 513266435 /nfs/dbraw/zinc/26/64/35/513266435.db2.gz RHVSAQRLAWQYIA-GDBMZVCRSA-N 1 1 361.442 2.979 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC000450626736 513279593 /nfs/dbraw/zinc/27/95/93/513279593.db2.gz SQPACVZDIROHBK-UHFFFAOYSA-N 1 1 357.332 2.995 20 5 FFBDMO COc1cc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)c([N+](=O)[O-])cc1F ZINC000450707451 513310851 /nfs/dbraw/zinc/31/08/51/513310851.db2.gz BCFKPZVOMFXUMP-UHFFFAOYSA-N 1 1 362.361 2.725 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+](C3CCC3)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000429354813 513348912 /nfs/dbraw/zinc/34/89/12/513348912.db2.gz PAKCRGZTXGJPTQ-HNNXBMFYSA-N 1 1 363.458 2.788 20 5 FFBDMO Nc1c(C(=O)N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000425007761 513366680 /nfs/dbraw/zinc/36/66/80/513366680.db2.gz NTEJORWCSBZYGW-MAUKXSAKSA-N 1 1 366.421 2.524 20 5 FFBDMO COCCO[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000447101481 513398849 /nfs/dbraw/zinc/39/88/49/513398849.db2.gz XKEBAFFYIDRKLY-SJORKVTESA-N 1 1 366.458 2.564 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413094996 513442311 /nfs/dbraw/zinc/44/23/11/513442311.db2.gz PFPBBKNGQLDZAO-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(=NC[C@H]3CC[N@@H+](CCc4ccccc4)C3)[nH]c2c1 ZINC000447695229 513544540 /nfs/dbraw/zinc/54/45/40/513544540.db2.gz VYFFXTLTBVSKIO-MRXNPFEDSA-N 1 1 365.437 2.870 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])c2ncccc21 ZINC000413260546 513553558 /nfs/dbraw/zinc/55/35/58/513553558.db2.gz FHCZJRRAVUNXKU-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000430194032 513585584 /nfs/dbraw/zinc/58/55/84/513585584.db2.gz HUTZDHVRJABVST-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000430194032 513585589 /nfs/dbraw/zinc/58/55/89/513585589.db2.gz HUTZDHVRJABVST-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451203834 513586127 /nfs/dbraw/zinc/58/61/27/513586127.db2.gz RDFHZEKTSLLPTL-INIZCTEOSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451203835 513587314 /nfs/dbraw/zinc/58/73/14/513587314.db2.gz RDFHZEKTSLLPTL-MRXNPFEDSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1 ZINC000451311867 513669630 /nfs/dbraw/zinc/66/96/30/513669630.db2.gz ZHNTWAOGJUNOOE-SGIREYDYSA-N 1 1 374.359 2.975 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000451339693 513686697 /nfs/dbraw/zinc/68/66/97/513686697.db2.gz IWEKXYVQTYSJTD-JFIYKMOQSA-N 1 1 364.442 2.998 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@@H]3C=C[C@@H](C3)[C@]2(C)C1 ZINC000451366211 513703518 /nfs/dbraw/zinc/70/35/18/513703518.db2.gz IAWOTBSXOAUDMQ-CFLYGVGMSA-N 1 1 357.410 2.686 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451523807 513805428 /nfs/dbraw/zinc/80/54/28/513805428.db2.gz DHQYKFGJRPEQME-PBFPGSCMSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451523807 513805433 /nfs/dbraw/zinc/80/54/33/513805433.db2.gz DHQYKFGJRPEQME-PBFPGSCMSA-N 1 1 365.430 2.677 20 5 FFBDMO Cc1c([N+](=O)[O-])ccc(=O)n1Cc1cn2cc(Br)ccc2[nH+]1 ZINC000436473306 513863753 /nfs/dbraw/zinc/86/37/53/513863753.db2.gz GDOWRJAVGHYRHB-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CN(C(=O)C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000451624841 513871987 /nfs/dbraw/zinc/87/19/87/513871987.db2.gz GLLURNDOCFMDSE-MSOLQXFVSA-N 1 1 373.453 2.839 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000448803220 513905522 /nfs/dbraw/zinc/90/55/22/513905522.db2.gz CWSYPLBRBFHKHY-UHFFFAOYSA-N 1 1 353.394 2.737 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)n2)cc1 ZINC000451693428 513916198 /nfs/dbraw/zinc/91/61/98/513916198.db2.gz IDGSTGGVZILEOE-IIAWOOMASA-N 1 1 358.398 2.628 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000451700290 513921478 /nfs/dbraw/zinc/92/14/78/513921478.db2.gz XFOMSUUMSISDSV-BFYDXBDKSA-N 1 1 361.442 2.715 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccnn3C3CCCC3)C2)nc1 ZINC000449031332 514037263 /nfs/dbraw/zinc/03/72/63/514037263.db2.gz VGBBKISZIIULEK-CQSZACIVSA-N 1 1 356.430 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccnn3C3CCCC3)C2)nc1 ZINC000449031332 514037274 /nfs/dbraw/zinc/03/72/74/514037274.db2.gz VGBBKISZIIULEK-CQSZACIVSA-N 1 1 356.430 2.988 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423426006 514139969 /nfs/dbraw/zinc/13/99/69/514139969.db2.gz OSBFRNIOAKUNNA-IIDMSEBBSA-N 1 1 357.458 2.772 20 5 FFBDMO CN(C)C(=O)[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414495860 514149256 /nfs/dbraw/zinc/14/92/56/514149256.db2.gz HSIWFSUAXRPPQB-ZDUSSCGKSA-N 1 1 360.439 2.628 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432346660 514167820 /nfs/dbraw/zinc/16/78/20/514167820.db2.gz LSEVFTFPFGUJGY-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC12COC2 ZINC000449364321 514181553 /nfs/dbraw/zinc/18/15/53/514181553.db2.gz NSSKLQVIDNQGMD-ROOCWEIGSA-N 1 1 360.410 2.510 20 5 FFBDMO CCOC(=O)[C@H]1C[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC12COC2 ZINC000449364322 514181690 /nfs/dbraw/zinc/18/16/90/514181690.db2.gz NSSKLQVIDNQGMD-UBWHZCOUSA-N 1 1 360.410 2.510 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420581455 514189990 /nfs/dbraw/zinc/18/99/90/514189990.db2.gz GZLHVIRLYSEKAS-DZGCQCFKSA-N 1 1 354.410 2.941 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000420589148 514193228 /nfs/dbraw/zinc/19/32/28/514193228.db2.gz RNLVVQDZUSXYAT-VMPITWQZSA-N 1 1 366.421 2.529 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)n1 ZINC000427370638 514195152 /nfs/dbraw/zinc/19/51/52/514195152.db2.gz ULWCHJHKSJQWJK-UHFFFAOYSA-N 1 1 357.414 2.700 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000420605483 514198251 /nfs/dbraw/zinc/19/82/51/514198251.db2.gz AKUCBINWJYKSMC-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000449427518 514206402 /nfs/dbraw/zinc/20/64/02/514206402.db2.gz SLWGINYTKIQFPD-WCQYABFASA-N 1 1 374.384 2.840 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](CCCO)C1 ZINC000452130255 514211019 /nfs/dbraw/zinc/21/10/19/514211019.db2.gz NQDUMQMZATVCNM-VXGBXAGGSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](CCCO)C1 ZINC000452130255 514211026 /nfs/dbraw/zinc/21/10/26/514211026.db2.gz NQDUMQMZATVCNM-VXGBXAGGSA-N 1 1 355.822 2.670 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000449550064 514250652 /nfs/dbraw/zinc/25/06/52/514250652.db2.gz BXERSONCJLPBDB-NFAWXSAZSA-N 1 1 350.415 2.595 20 5 FFBDMO C[N@H+](CCCNC(=O)C1CCC1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432787297 514287946 /nfs/dbraw/zinc/28/79/46/514287946.db2.gz GAPRNPDQVSITGI-UHFFFAOYSA-N 1 1 371.384 2.934 20 5 FFBDMO C[N@@H+](CCCNC(=O)C1CCC1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432787297 514287949 /nfs/dbraw/zinc/28/79/49/514287949.db2.gz GAPRNPDQVSITGI-UHFFFAOYSA-N 1 1 371.384 2.934 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000423959592 514308899 /nfs/dbraw/zinc/30/88/99/514308899.db2.gz CLSKKZRLGXDLDJ-DYVFJYSZSA-N 1 1 372.450 2.644 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000444935904 514371801 /nfs/dbraw/zinc/37/18/01/514371801.db2.gz IFZIOEYASDEHSX-UHFFFAOYSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@@H](Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000433095517 514378804 /nfs/dbraw/zinc/37/88/04/514378804.db2.gz YLUBMWDXBNJHAP-CYBMUJFWSA-N 1 1 354.410 2.611 20 5 FFBDMO C[C@@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1ccc([N+](=O)[O-])cc1 ZINC000433095517 514378813 /nfs/dbraw/zinc/37/88/13/514378813.db2.gz YLUBMWDXBNJHAP-CYBMUJFWSA-N 1 1 354.410 2.611 20 5 FFBDMO COCC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433192934 514416684 /nfs/dbraw/zinc/41/66/84/514416684.db2.gz IFTXCTFRBXEGLO-AWEZNQCLSA-N 1 1 370.471 2.826 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000438955534 514471455 /nfs/dbraw/zinc/47/14/55/514471455.db2.gz UMJRAEZEMMMXMO-ZDUSSCGKSA-N 1 1 373.450 2.523 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000438955534 514471463 /nfs/dbraw/zinc/47/14/63/514471463.db2.gz UMJRAEZEMMMXMO-ZDUSSCGKSA-N 1 1 373.450 2.523 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000428542446 514494293 /nfs/dbraw/zinc/49/42/93/514494293.db2.gz RERUVNOKXGTDJB-HNNXBMFYSA-N 1 1 359.357 2.553 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000439255291 514516266 /nfs/dbraw/zinc/51/62/66/514516266.db2.gz GLMOHBAZBLSHQF-MRXNPFEDSA-N 1 1 363.458 2.805 20 5 FFBDMO Cc1nc(NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000450257610 514568527 /nfs/dbraw/zinc/56/85/27/514568527.db2.gz WQJHHSOREOKOPS-CQSZACIVSA-N 1 1 355.442 2.959 20 5 FFBDMO C[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[N@@H+](C)Cc1ccccc1 ZINC000461391856 514589234 /nfs/dbraw/zinc/58/92/34/514589234.db2.gz CMTACOUEORDWFT-OAHLLOKOSA-N 1 1 369.421 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1nc(-c3ccccn3)n[nH]1)CCC2 ZINC000453364211 514610180 /nfs/dbraw/zinc/61/01/80/514610180.db2.gz QZRSOEYINYFFGP-HNNXBMFYSA-N 1 1 350.382 2.942 20 5 FFBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489179378 514741555 /nfs/dbraw/zinc/74/15/55/514741555.db2.gz ZAEKPCMZZXICNV-WBVHZDCISA-N 1 1 353.426 2.821 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]1(CO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000475668399 514753383 /nfs/dbraw/zinc/75/33/83/514753383.db2.gz QODPDERMCGNAPQ-HXUWFJFHSA-N 1 1 369.421 2.603 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]1(CO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000475668399 514753390 /nfs/dbraw/zinc/75/33/90/514753390.db2.gz QODPDERMCGNAPQ-HXUWFJFHSA-N 1 1 369.421 2.603 20 5 FFBDMO COc1cc(N(C)CC(C)(C)C[NH+]2CCOCC2)c(F)cc1[N+](=O)[O-] ZINC000508356604 514754123 /nfs/dbraw/zinc/75/41/23/514754123.db2.gz XMZARGGMBPVYQJ-UHFFFAOYSA-N 1 1 355.410 2.537 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCS[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000475705750 514769458 /nfs/dbraw/zinc/76/94/58/514769458.db2.gz LQNPGUITBCANRO-INIZCTEOSA-N 1 1 368.455 2.720 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCS[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000475705751 514770042 /nfs/dbraw/zinc/77/00/42/514770042.db2.gz LQNPGUITBCANRO-MRXNPFEDSA-N 1 1 368.455 2.720 20 5 FFBDMO Cc1cc(N2CCC([N@@H+](C)CCO)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461943925 514798592 /nfs/dbraw/zinc/79/85/92/514798592.db2.gz YWXBMKWENGHPIT-UHFFFAOYSA-N 1 1 361.364 2.815 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000508594181 514833981 /nfs/dbraw/zinc/83/39/81/514833981.db2.gz IIIYBNQETKTCCU-GFCCVEGCSA-N 1 1 360.366 2.858 20 5 FFBDMO O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000471381067 514860286 /nfs/dbraw/zinc/86/02/86/514860286.db2.gz KMNDGEAZXRACBN-CALCHBBNSA-N 1 1 369.396 2.938 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccsc2Cl)cc1 ZINC000480279503 514904592 /nfs/dbraw/zinc/90/45/92/514904592.db2.gz AHRCKFLFDWEALH-UHFFFAOYSA-N 1 1 360.844 2.873 20 5 FFBDMO Cc1nc2ccc(Cn3c(=O)onc3-c3ccc([N+](=O)[O-])cc3)cc2[nH]1 ZINC000467211708 514941634 /nfs/dbraw/zinc/94/16/34/514941634.db2.gz NPUNRZQMCWFVDE-UHFFFAOYSA-N 1 1 351.322 2.645 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2c(N)cccc2[N+](=O)[O-])CCC1 ZINC000456122948 514966550 /nfs/dbraw/zinc/96/65/50/514966550.db2.gz PIWSASUAVIRVNY-UHFFFAOYSA-N 1 1 368.437 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)nc1OCc1ccccc1 ZINC000489929105 515035181 /nfs/dbraw/zinc/03/51/81/515035181.db2.gz VPCIEBPJFKYDMW-OAHLLOKOSA-N 1 1 365.393 2.614 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)C1CCCCC1 ZINC000480685786 515044100 /nfs/dbraw/zinc/04/41/00/515044100.db2.gz NHYBOYLCAIGWSJ-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000467550446 515044750 /nfs/dbraw/zinc/04/47/50/515044750.db2.gz KKANYAXBAPSRSZ-WMHRWZGDSA-N 1 1 362.426 2.900 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462441382 515053500 /nfs/dbraw/zinc/05/35/00/515053500.db2.gz NOOORFQYKFPPEL-INIZCTEOSA-N 1 1 356.426 2.887 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC[N@H+]1C ZINC000462480373 515074758 /nfs/dbraw/zinc/07/47/58/515074758.db2.gz LUIANQHGYDWVFD-GOEBONIOSA-N 1 1 356.426 2.885 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C3CC3)C2)nc1OCc1ccccc1 ZINC000462484573 515077002 /nfs/dbraw/zinc/07/70/02/515077002.db2.gz AJOIDSJOYFVGMQ-OAHLLOKOSA-N 1 1 354.410 2.639 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000456351330 515119972 /nfs/dbraw/zinc/11/99/72/515119972.db2.gz MKZZBBCOUYNYSX-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000472227222 515177167 /nfs/dbraw/zinc/17/71/67/515177167.db2.gz XYIPXVFEMTUJEH-GFCCVEGCSA-N 1 1 357.838 2.864 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467395 515191627 /nfs/dbraw/zinc/19/16/27/515191627.db2.gz XAHDSFGYPUHULR-KYNGSXCRSA-N 1 1 369.421 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467395 515191631 /nfs/dbraw/zinc/19/16/31/515191631.db2.gz XAHDSFGYPUHULR-KYNGSXCRSA-N 1 1 369.421 2.896 20 5 FFBDMO C[C@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCC[N@H+]1C ZINC000462701954 515198988 /nfs/dbraw/zinc/19/89/88/515198988.db2.gz PEYSKMCVWKYGFH-HOCLYGCPSA-N 1 1 356.426 2.885 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)n(C)c1C ZINC000462895480 515287819 /nfs/dbraw/zinc/28/78/19/515287819.db2.gz MFKBBSWVPKFCFI-UHFFFAOYSA-N 1 1 351.790 2.972 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000468483330 515380010 /nfs/dbraw/zinc/38/00/10/515380010.db2.gz JWKGTNNGYXWMLT-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000481757049 515453397 /nfs/dbraw/zinc/45/33/97/515453397.db2.gz WQJCCCYRSJYVQQ-IRXDYDNUSA-N 1 1 369.421 2.578 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2CCCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510160091 515455143 /nfs/dbraw/zinc/45/51/43/515455143.db2.gz OGEDUZRKHFCYDW-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CCCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510160091 515455153 /nfs/dbraw/zinc/45/51/53/515455153.db2.gz OGEDUZRKHFCYDW-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2Cc3ccc(O)cc3C3(CC3)C2)c1 ZINC000463427816 515492731 /nfs/dbraw/zinc/49/27/31/515492731.db2.gz WVJQQEFCRKIFET-QGZVFWFLSA-N 1 1 370.405 2.588 20 5 FFBDMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473155605 515519225 /nfs/dbraw/zinc/51/92/25/515519225.db2.gz AZMPEDLFUVRISX-YMTOWFKASA-N 1 1 369.830 2.960 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456990277 515569452 /nfs/dbraw/zinc/56/94/52/515569452.db2.gz LTSAAARFLOLXLH-QGZVFWFLSA-N 1 1 359.813 2.964 20 5 FFBDMO O=C(CC[N@H+](CCO)[C@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000500069638 515580385 /nfs/dbraw/zinc/58/03/85/515580385.db2.gz JGYZKTYOJXZGTD-SFHVURJKSA-N 1 1 369.421 2.905 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505592545 515601108 /nfs/dbraw/zinc/60/11/08/515601108.db2.gz TUGKJRPHZSOTBQ-RYUDHWBXSA-N 1 1 373.400 2.772 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000486901297 515679093 /nfs/dbraw/zinc/67/90/93/515679093.db2.gz LHTRSTLAMGSHMG-UHFFFAOYSA-N 1 1 366.418 2.543 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000457135110 515679529 /nfs/dbraw/zinc/67/95/29/515679529.db2.gz VZOIJTNUSJTHPC-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO CS(=O)(=O)c1ccc(F)c(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000500384863 515682744 /nfs/dbraw/zinc/68/27/44/515682744.db2.gz QHBGSXJCKNGAJB-XQRVVYSFSA-N 1 1 364.398 2.940 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1cnn(C)c1)CC(C)C ZINC000459601356 515683537 /nfs/dbraw/zinc/68/35/37/515683537.db2.gz XJMJZHALINTKLA-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1cnn(C)c1)CC(C)C ZINC000459601356 515683548 /nfs/dbraw/zinc/68/35/48/515683548.db2.gz XJMJZHALINTKLA-UHFFFAOYSA-N 1 1 359.430 2.733 20 5 FFBDMO C[C@H]1[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000494061264 515724418 /nfs/dbraw/zinc/72/44/18/515724418.db2.gz VKMFQDBXLXJQJW-DOTOQJQBSA-N 1 1 368.437 2.786 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000459681517 515739967 /nfs/dbraw/zinc/73/99/67/515739967.db2.gz XRWSFDRYWCKIDL-OAHLLOKOSA-N 1 1 366.414 2.538 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CC2(N3CCCCC3)CCOCC2)c(F)c1 ZINC000478221780 515742158 /nfs/dbraw/zinc/74/21/58/515742158.db2.gz BDJMPDSJLKRZDL-UHFFFAOYSA-N 1 1 351.422 2.859 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676370 515765468 /nfs/dbraw/zinc/76/54/68/515765468.db2.gz JJCXKYOHQNLQCR-ZIAGYGMSSA-N 1 1 373.457 2.988 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676370 515765473 /nfs/dbraw/zinc/76/54/73/515765473.db2.gz JJCXKYOHQNLQCR-ZIAGYGMSSA-N 1 1 373.457 2.988 20 5 FFBDMO Cc1ccc2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000511095486 515777155 /nfs/dbraw/zinc/77/71/55/515777155.db2.gz KGLYAGFFONXBCT-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000511122591 515791287 /nfs/dbraw/zinc/79/12/87/515791287.db2.gz ONJASKQTYCXRDU-JTQLQIEISA-N 1 1 365.377 2.937 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000511122591 515791295 /nfs/dbraw/zinc/79/12/95/515791295.db2.gz ONJASKQTYCXRDU-JTQLQIEISA-N 1 1 365.377 2.937 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](CN(C)S(C)(=O)=O)C1 ZINC000511124726 515794762 /nfs/dbraw/zinc/79/47/62/515794762.db2.gz LTDUJBQQKDPEOL-HUUCEWRRSA-N 1 1 369.487 2.568 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000511126470 515796290 /nfs/dbraw/zinc/79/62/90/515796290.db2.gz QHDBZFUDZGPMRS-CQSZACIVSA-N 1 1 359.348 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)c(F)c1 ZINC000478387037 515802212 /nfs/dbraw/zinc/80/22/12/515802212.db2.gz QXFLKTQZQMAGTI-FXAWDEMLSA-N 1 1 373.428 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2CO)c(F)c1 ZINC000478387037 515802217 /nfs/dbraw/zinc/80/22/17/515802217.db2.gz QXFLKTQZQMAGTI-FXAWDEMLSA-N 1 1 373.428 2.707 20 5 FFBDMO COc1cccc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)c1[N+](=O)[O-] ZINC000487275059 515815718 /nfs/dbraw/zinc/81/57/18/515815718.db2.gz YVEITADDJHHUJA-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487294880 515820092 /nfs/dbraw/zinc/82/00/92/515820092.db2.gz DIVWMEMFYSOYHX-HOCLYGCPSA-N 1 1 356.426 2.574 20 5 FFBDMO CCN(CCn1ccc([N+](=O)[O-])n1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000478437696 515822529 /nfs/dbraw/zinc/82/25/29/515822529.db2.gz QCGNYTPNZABYCL-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000478437696 515822538 /nfs/dbraw/zinc/82/25/38/515822538.db2.gz QCGNYTPNZABYCL-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000478437696 515822548 /nfs/dbraw/zinc/82/25/48/515822548.db2.gz QCGNYTPNZABYCL-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000459810809 515824361 /nfs/dbraw/zinc/82/43/61/515824361.db2.gz QIRBHUZKOFZWDV-CYBMUJFWSA-N 1 1 365.430 2.833 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000494386539 515826906 /nfs/dbraw/zinc/82/69/06/515826906.db2.gz NRJHDLZJNSYKCA-MKBNYLNASA-N 1 1 350.394 2.928 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000500882306 515894090 /nfs/dbraw/zinc/89/40/90/515894090.db2.gz CQCAYMBTUSXVFY-INIZCTEOSA-N 1 1 351.472 2.769 20 5 FFBDMO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000474148870 515905296 /nfs/dbraw/zinc/90/52/96/515905296.db2.gz YCOSAJJHSDUPBV-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000464687955 515925167 /nfs/dbraw/zinc/92/51/67/515925167.db2.gz GPCKAPQOFUREBB-AWEZNQCLSA-N 1 1 351.422 2.906 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000470156392 516151824 /nfs/dbraw/zinc/15/18/24/516151824.db2.gz OCHBPYOYMJQIIJ-OWQGQXMQSA-N 1 1 355.394 2.941 20 5 FFBDMO CCN1CCN([C@@H]2CC[N@H+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169872 516158304 /nfs/dbraw/zinc/15/83/04/516158304.db2.gz LFPLDUYDOIDYMO-XMJIKXADSA-N 1 1 358.486 2.710 20 5 FFBDMO CCN1CCN([C@@H]2CC[N@@H+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169872 516158310 /nfs/dbraw/zinc/15/83/10/516158310.db2.gz LFPLDUYDOIDYMO-XMJIKXADSA-N 1 1 358.486 2.710 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000460493325 516169596 /nfs/dbraw/zinc/16/95/96/516169596.db2.gz RQOCMJGTNVNQMY-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO COc1c(C(=O)NCCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000474776497 516190806 /nfs/dbraw/zinc/19/08/06/516190806.db2.gz RXSBWQDAQATTPW-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@H](c2ccccc2)C1 ZINC000497402524 516319725 /nfs/dbraw/zinc/31/97/25/516319725.db2.gz UOBZKZQLIIBBQW-RDJZCZTQSA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](c2ccccc2)C1 ZINC000497401299 516319809 /nfs/dbraw/zinc/31/98/09/516319809.db2.gz ZBLNGMAUZWOIOI-MJGOQNOKSA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@H](c2ccccc2)C1 ZINC000497412343 516320856 /nfs/dbraw/zinc/32/08/56/516320856.db2.gz ZFBQZIMHDYGYCF-RDJZCZTQSA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@@H](c2ccccc2)C1 ZINC000497412344 516320878 /nfs/dbraw/zinc/32/08/78/516320878.db2.gz ZFBQZIMHDYGYCF-WBVHZDCISA-N 1 1 364.405 2.904 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497514058 516324844 /nfs/dbraw/zinc/32/48/44/516324844.db2.gz ABYLRJRBWHWRGG-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497535599 516325633 /nfs/dbraw/zinc/32/56/33/516325633.db2.gz WDFJCNZPKSNIPR-AWEZNQCLSA-N 1 1 369.487 2.921 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1C ZINC000497558468 516326343 /nfs/dbraw/zinc/32/63/43/516326343.db2.gz QKUJXNSXZFCGQP-CABCVRRESA-N 1 1 369.487 2.753 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000535659936 516439781 /nfs/dbraw/zinc/43/97/81/516439781.db2.gz QRGJTCBJISGUTH-GOEBONIOSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000535659936 516439791 /nfs/dbraw/zinc/43/97/91/516439791.db2.gz QRGJTCBJISGUTH-GOEBONIOSA-N 1 1 362.817 2.762 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000517783557 516451998 /nfs/dbraw/zinc/45/19/98/516451998.db2.gz ZDCGSMPLSQRFES-UHFFFAOYSA-N 1 1 359.430 2.856 20 5 FFBDMO C[N@H+](CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000517783557 516452003 /nfs/dbraw/zinc/45/20/03/516452003.db2.gz ZDCGSMPLSQRFES-UHFFFAOYSA-N 1 1 359.430 2.856 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000517783557 516452010 /nfs/dbraw/zinc/45/20/10/516452010.db2.gz ZDCGSMPLSQRFES-UHFFFAOYSA-N 1 1 359.430 2.856 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000513051020 516453289 /nfs/dbraw/zinc/45/32/89/516453289.db2.gz IZYXQSYZWNQEHV-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000513051020 516453278 /nfs/dbraw/zinc/45/32/78/516453278.db2.gz IZYXQSYZWNQEHV-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO CN1CC[N@H+](C)C[C@H]1c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000550998685 516516806 /nfs/dbraw/zinc/51/68/06/516516806.db2.gz MQANLTVQCCLNHQ-LBPRGKRZSA-N 1 1 371.319 2.582 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000550998685 516516812 /nfs/dbraw/zinc/51/68/12/516516812.db2.gz MQANLTVQCCLNHQ-LBPRGKRZSA-N 1 1 371.319 2.582 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCO[C@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000540427530 516551607 /nfs/dbraw/zinc/55/16/07/516551607.db2.gz VJDJLAIFTWCTRS-MPGHIAIKSA-N 1 1 363.458 2.957 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCO[C@@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000540427532 516552049 /nfs/dbraw/zinc/55/20/49/516552049.db2.gz VJDJLAIFTWCTRS-RVKKMQEKSA-N 1 1 363.458 2.957 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000518128523 516558197 /nfs/dbraw/zinc/55/81/97/516558197.db2.gz WLHUBGWPCLVBSO-UHFFFAOYSA-N 1 1 368.437 2.596 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637305 516559345 /nfs/dbraw/zinc/55/93/45/516559345.db2.gz RUTNNNZVMUTTGM-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637305 516559357 /nfs/dbraw/zinc/55/93/57/516559357.db2.gz RUTNNNZVMUTTGM-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000547789421 516565946 /nfs/dbraw/zinc/56/59/46/516565946.db2.gz FTSAZZOHLSZSFA-CQSZACIVSA-N 1 1 357.414 2.583 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000540479725 516575608 /nfs/dbraw/zinc/57/56/08/516575608.db2.gz WIGXQUITRVIYAQ-KGLIPLIRSA-N 1 1 370.409 2.660 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CC[C@@H]4CCCCO4)CC3)nc2c1 ZINC000547832571 516589197 /nfs/dbraw/zinc/58/91/97/516589197.db2.gz JUIJDZRTICCPDO-INIZCTEOSA-N 1 1 373.457 2.942 20 5 FFBDMO CC(C)(C)OCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000547832499 516589263 /nfs/dbraw/zinc/58/92/63/516589263.db2.gz XBKPELLOGQRDQI-UHFFFAOYSA-N 1 1 361.446 2.798 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000536097138 516627604 /nfs/dbraw/zinc/62/76/04/516627604.db2.gz ZNBLBEGJMHOFJM-OAHLLOKOSA-N 1 1 362.474 2.947 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518599716 516717421 /nfs/dbraw/zinc/71/74/21/516717421.db2.gz PIEVKOPISPVXIB-ZDUSSCGKSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518599716 516717429 /nfs/dbraw/zinc/71/74/29/516717429.db2.gz PIEVKOPISPVXIB-ZDUSSCGKSA-N 1 1 360.439 2.885 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000513702522 516724739 /nfs/dbraw/zinc/72/47/39/516724739.db2.gz JUSPSWKHEJRVNB-SFHVURJKSA-N 1 1 352.394 2.956 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000524617635 516770396 /nfs/dbraw/zinc/77/03/96/516770396.db2.gz BPSSAQRVMOCSSG-HUUCEWRRSA-N 1 1 371.441 2.725 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000561982611 516862864 /nfs/dbraw/zinc/86/28/64/516862864.db2.gz PGNLEWYPDKFKHS-ZDUSSCGKSA-N 1 1 371.384 2.934 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000561982611 516862869 /nfs/dbraw/zinc/86/28/69/516862869.db2.gz PGNLEWYPDKFKHS-ZDUSSCGKSA-N 1 1 371.384 2.934 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)c1ccco1 ZINC000514139755 516877758 /nfs/dbraw/zinc/87/77/58/516877758.db2.gz FYXQOVWSLONIEH-LBPRGKRZSA-N 1 1 369.324 2.822 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212107 516906591 /nfs/dbraw/zinc/90/65/91/516906591.db2.gz BFVYBZUIPCHYJY-CMPLNLGQSA-N 1 1 357.357 2.608 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000558780508 516940932 /nfs/dbraw/zinc/94/09/32/516940932.db2.gz XYSPHWCYAWUCTH-LBPRGKRZSA-N 1 1 361.489 2.589 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000558780508 516940941 /nfs/dbraw/zinc/94/09/41/516940941.db2.gz XYSPHWCYAWUCTH-LBPRGKRZSA-N 1 1 361.489 2.589 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000532392458 516948636 /nfs/dbraw/zinc/94/86/36/516948636.db2.gz QZOJKLQDWYAKKA-UHFFFAOYSA-N 1 1 366.421 2.653 20 5 FFBDMO Cc1cc(CNc2ncnc3cccc([N+](=O)[O-])c32)cc(N2CCCC2)[nH+]1 ZINC000562238688 516976116 /nfs/dbraw/zinc/97/61/16/516976116.db2.gz ZMWRNJBVWOOYCF-UHFFFAOYSA-N 1 1 364.409 2.876 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N(C)[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000525521510 517067044 /nfs/dbraw/zinc/06/70/44/517067044.db2.gz FNRGESWEXNJCAR-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)C[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000562394711 517076079 /nfs/dbraw/zinc/07/60/79/517076079.db2.gz DTELQAWOAURUPR-CRAIPNDOSA-N 1 1 363.458 2.561 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552252768 517162486 /nfs/dbraw/zinc/16/24/86/517162486.db2.gz WQSOGEXHGRHCKE-IEBWSBKVSA-N 1 1 366.421 2.783 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552254471 517164808 /nfs/dbraw/zinc/16/48/08/517164808.db2.gz GHSOOFHKVVSOIX-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000525804401 517171903 /nfs/dbraw/zinc/17/19/03/517171903.db2.gz VMKHHAGHWVMBTC-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000541721611 517186314 /nfs/dbraw/zinc/18/63/14/517186314.db2.gz VGFMWKPXAYPFTO-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2CCN(Cc3ccco3)CC2)cccc1[N+](=O)[O-] ZINC000532905592 517195690 /nfs/dbraw/zinc/19/56/90/517195690.db2.gz YJBJQUKGEBXIIE-UHFFFAOYSA-N 1 1 372.425 2.643 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970507 517229434 /nfs/dbraw/zinc/22/94/34/517229434.db2.gz OBGQSELNUJHOEK-IRXDYDNUSA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970507 517229441 /nfs/dbraw/zinc/22/94/41/517229441.db2.gz OBGQSELNUJHOEK-IRXDYDNUSA-N 1 1 361.442 2.619 20 5 FFBDMO C[C@H](CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000520264884 517324248 /nfs/dbraw/zinc/32/42/48/517324248.db2.gz BPVXPQAVXJYHPG-LSDHHAIUSA-N 1 1 364.446 2.536 20 5 FFBDMO COc1cccc(CNC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549171978 517437900 /nfs/dbraw/zinc/43/79/00/517437900.db2.gz PZSUUECKNMKOLD-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000527090001 517497294 /nfs/dbraw/zinc/49/72/94/517497294.db2.gz JLPDEUBJCPMLGG-SJORKVTESA-N 1 1 362.430 2.668 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000516193262 517612577 /nfs/dbraw/zinc/61/25/77/517612577.db2.gz IUOMBCUYMYXKAU-ZDUSSCGKSA-N 1 1 354.426 2.711 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000560169097 517616601 /nfs/dbraw/zinc/61/66/01/517616601.db2.gz YKMFBWYPFPABGK-LJQANCHMSA-N 1 1 355.438 2.962 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000553317216 517639846 /nfs/dbraw/zinc/63/98/46/517639846.db2.gz PZSZXHVAFVJYES-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000553317216 517639852 /nfs/dbraw/zinc/63/98/52/517639852.db2.gz PZSZXHVAFVJYES-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1n[nH]cc1CCC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556863193 517714494 /nfs/dbraw/zinc/71/44/94/517714494.db2.gz WGZNLKHNKAUDPT-QGZVFWFLSA-N 1 1 354.414 2.672 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000546550976 517721916 /nfs/dbraw/zinc/72/19/16/517721916.db2.gz NRSRNSILMMHLKG-CYBMUJFWSA-N 1 1 351.422 2.860 20 5 FFBDMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000560410704 517780826 /nfs/dbraw/zinc/78/08/26/517780826.db2.gz BTNUCOIVDVHDSI-AWEZNQCLSA-N 1 1 363.805 2.538 20 5 FFBDMO O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000534261765 517811546 /nfs/dbraw/zinc/81/15/46/517811546.db2.gz OQDMLZSOCOPNAH-CYBMUJFWSA-N 1 1 363.805 2.538 20 5 FFBDMO C[C@@H](CO)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000553907374 517963799 /nfs/dbraw/zinc/96/37/99/517963799.db2.gz ZWZSXVWQIZVQHJ-NSHDSACASA-N 1 1 355.822 2.812 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000539780686 518160059 /nfs/dbraw/zinc/16/00/59/518160059.db2.gz UHHPGFGNDJVYNT-GOSISDBHSA-N 1 1 354.410 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccc3ccccc3n2)cc1 ZINC000569650664 518219826 /nfs/dbraw/zinc/21/98/26/518219826.db2.gz RYJVGKWCENELBE-UHFFFAOYSA-N 1 1 371.418 2.707 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000578566798 518267575 /nfs/dbraw/zinc/26/75/75/518267575.db2.gz LOVJSHGKTRZTII-CQSZACIVSA-N 1 1 373.457 2.846 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000566967039 518288374 /nfs/dbraw/zinc/28/83/74/518288374.db2.gz MJBPIJRDXNYIAF-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000566967039 518288378 /nfs/dbraw/zinc/28/83/78/518288378.db2.gz MJBPIJRDXNYIAF-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO CC(C)Cc1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000578634601 518303193 /nfs/dbraw/zinc/30/31/93/518303193.db2.gz BOXKIDKIGRXFTE-HNNXBMFYSA-N 1 1 359.430 2.549 20 5 FFBDMO C[NH+](C)C1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CCCCCC1 ZINC000564118404 518313815 /nfs/dbraw/zinc/31/38/15/518313815.db2.gz GYDJXHHHPSIACZ-INIZCTEOSA-N 1 1 365.474 2.579 20 5 FFBDMO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202509 518348972 /nfs/dbraw/zinc/34/89/72/518348972.db2.gz MLBMUEXAGLNOCP-OWCLPIDISA-N 1 1 362.474 2.879 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202509 518348976 /nfs/dbraw/zinc/34/89/76/518348976.db2.gz MLBMUEXAGLNOCP-OWCLPIDISA-N 1 1 362.474 2.879 20 5 FFBDMO O=[N+]([O-])c1ccc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1CO ZINC000575958604 518360255 /nfs/dbraw/zinc/36/02/55/518360255.db2.gz ZQYQGJAVZAFFOT-LJQANCHMSA-N 1 1 372.421 2.757 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)c1 ZINC000585718388 518573448 /nfs/dbraw/zinc/57/34/48/518573448.db2.gz FXCCDUGGLXPYGS-HXUWFJFHSA-N 1 1 372.421 2.627 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000564918396 518694511 /nfs/dbraw/zinc/69/45/11/518694511.db2.gz LNVKAVVTFCOLQU-MFKMUULPSA-N 1 1 358.341 2.816 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+]2CC(C)C)n1 ZINC000567771603 518702280 /nfs/dbraw/zinc/70/22/80/518702280.db2.gz HKUVSFZTXLRTPI-CYBMUJFWSA-N 1 1 350.419 2.699 20 5 FFBDMO C[C@]1(CNc2nccc(C(N)=O)c2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000579656677 518783947 /nfs/dbraw/zinc/78/39/47/518783947.db2.gz ACDFLUGAWRKTRU-LJQANCHMSA-N 1 1 369.425 2.555 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000573830307 518855639 /nfs/dbraw/zinc/85/56/39/518855639.db2.gz USEWGVGNXJDOPG-QGZVFWFLSA-N 1 1 358.442 2.882 20 5 FFBDMO Cc1c(Cc2nc([C@@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303317 519013546 /nfs/dbraw/zinc/01/35/46/519013546.db2.gz MYKGBQAVLHSVNX-YJBOKZPZSA-N 1 1 358.398 2.803 20 5 FFBDMO Cc1c(Cc2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303317 519013552 /nfs/dbraw/zinc/01/35/52/519013552.db2.gz MYKGBQAVLHSVNX-YJBOKZPZSA-N 1 1 358.398 2.803 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(C)(c3nc(C)no3)CC2)c1 ZINC000589510938 519021570 /nfs/dbraw/zinc/02/15/70/519021570.db2.gz XLQDELVWHRDXIO-UHFFFAOYSA-N 1 1 374.397 2.627 20 5 FFBDMO C[N@@H+]1CCc2[nH]c3ccc(C(=O)NCc4ccccc4[N+](=O)[O-])cc3c2C1 ZINC000590424203 519226613 /nfs/dbraw/zinc/22/66/13/519226613.db2.gz ROXSNHKUUPVBFF-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO C[N@H+]1CCc2[nH]c3ccc(C(=O)NCc4ccccc4[N+](=O)[O-])cc3c2C1 ZINC000590424203 519226628 /nfs/dbraw/zinc/22/66/28/519226628.db2.gz ROXSNHKUUPVBFF-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000574650897 519263001 /nfs/dbraw/zinc/26/30/01/519263001.db2.gz KZRWQEXYTPKLNH-ZDUSSCGKSA-N 1 1 354.426 2.713 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](C[C@@H]4CCCC[C@H]4O)CC3)nc2c1 ZINC000577956279 519340584 /nfs/dbraw/zinc/34/05/84/519340584.db2.gz XOJBFEKOJQWGHE-KBXCAEBGSA-N 1 1 373.457 2.534 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213711 519372086 /nfs/dbraw/zinc/37/20/86/519372086.db2.gz BZBIQCMSNKNVSG-BXUZGUMPSA-N 1 1 364.427 2.770 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213711 519372095 /nfs/dbraw/zinc/37/20/95/519372095.db2.gz BZBIQCMSNKNVSG-BXUZGUMPSA-N 1 1 364.427 2.770 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2c([N+](=O)[O-])nc(C)n2CC)[C@H](C)C1 ZINC000578159843 519450360 /nfs/dbraw/zinc/45/03/60/519450360.db2.gz ZHYLNGBDGGEDOG-UKRRQHHQSA-N 1 1 353.467 2.669 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000572229093 519506113 /nfs/dbraw/zinc/50/61/13/519506113.db2.gz BBFCYMRXLMHBBL-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000572229093 519506117 /nfs/dbraw/zinc/50/61/17/519506117.db2.gz BBFCYMRXLMHBBL-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000566478226 519513296 /nfs/dbraw/zinc/51/32/96/519513296.db2.gz MAQHDNJXQRKFNW-UHFFFAOYSA-N 1 1 371.441 2.623 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cc([N+](=O)[O-])c1C ZINC000578435069 519590444 /nfs/dbraw/zinc/59/04/44/519590444.db2.gz KZDNBXVXJGEOIW-KRWDZBQOSA-N 1 1 373.384 2.838 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681530 519609200 /nfs/dbraw/zinc/60/92/00/519609200.db2.gz IISCPLDTHITDOV-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@@H](C[N@H+](C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681530 519609223 /nfs/dbraw/zinc/60/92/23/519609223.db2.gz IISCPLDTHITDOV-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@@H](C[N@@H+](C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681530 519609227 /nfs/dbraw/zinc/60/92/27/519609227.db2.gz IISCPLDTHITDOV-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594418460 519954369 /nfs/dbraw/zinc/95/43/69/519954369.db2.gz JFHOKYFIEFUCNC-MSOLQXFVSA-N 1 1 360.458 2.920 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH+]1CCC(SC)CC1 ZINC000602920184 519973272 /nfs/dbraw/zinc/97/32/72/519973272.db2.gz MKWKSXDFPRZTRL-NSHDSACASA-N 1 1 353.444 2.758 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1C ZINC000616405555 520003076 /nfs/dbraw/zinc/00/30/76/520003076.db2.gz ZGZQAEQIQAQAGX-MRXNPFEDSA-N 1 1 355.394 2.828 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1C ZINC000616405555 520003083 /nfs/dbraw/zinc/00/30/83/520003083.db2.gz ZGZQAEQIQAQAGX-MRXNPFEDSA-N 1 1 355.394 2.828 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000600225123 520136201 /nfs/dbraw/zinc/13/62/01/520136201.db2.gz XIYTXUXRVFUKGD-GOSISDBHSA-N 1 1 356.426 2.906 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000600297368 520186962 /nfs/dbraw/zinc/18/69/62/520186962.db2.gz BLFJUJIGVBDBSF-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000600297368 520186970 /nfs/dbraw/zinc/18/69/70/520186970.db2.gz BLFJUJIGVBDBSF-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000600300103 520189096 /nfs/dbraw/zinc/18/90/96/520189096.db2.gz XOCHXUGMBWECJU-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000600300103 520189100 /nfs/dbraw/zinc/18/91/00/520189100.db2.gz XOCHXUGMBWECJU-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000597715603 520193055 /nfs/dbraw/zinc/19/30/55/520193055.db2.gz NMWXEUPJBSFSAS-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(=O)NCc2ccccc2)C1 ZINC000592156307 520232723 /nfs/dbraw/zinc/23/27/23/520232723.db2.gz XSAUBBWPYPKFRI-QGZVFWFLSA-N 1 1 369.421 2.742 20 5 FFBDMO CN(CCCC[NH+]1CCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000603412950 520254404 /nfs/dbraw/zinc/25/44/04/520254404.db2.gz ICEBULGMYLLUAR-UHFFFAOYSA-N 1 1 359.430 2.809 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC000592188897 520254622 /nfs/dbraw/zinc/25/46/22/520254622.db2.gz UWPQXAWUOYXXKM-ROUUACIJSA-N 1 1 354.410 2.546 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000609309850 520270214 /nfs/dbraw/zinc/27/02/14/520270214.db2.gz OYLISEOZJDYWBB-HNNXBMFYSA-N 1 1 356.426 2.683 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000600472762 520281843 /nfs/dbraw/zinc/28/18/43/520281843.db2.gz PXJXZBJMKUQIAD-ZDUSSCGKSA-N 1 1 369.368 2.943 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1SC ZINC000597857675 520287378 /nfs/dbraw/zinc/28/73/78/520287378.db2.gz ITDKEPVDIJKNTR-NSHDSACASA-N 1 1 367.471 2.928 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000609353154 520293738 /nfs/dbraw/zinc/29/37/38/520293738.db2.gz OPJCTUBCVKQXSM-OKILXGFUSA-N 1 1 369.487 2.698 20 5 FFBDMO [NH3+]CC(F)(F)CNC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 ZINC000592326286 520336005 /nfs/dbraw/zinc/33/60/05/520336005.db2.gz MUNGHRAPRBVAGG-UHFFFAOYSA-N 1 1 359.398 2.953 20 5 FFBDMO Cc1cc(N2CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)ccc1[N+](=O)[O-] ZINC000603842775 520374302 /nfs/dbraw/zinc/37/43/02/520374302.db2.gz CPCGFDZGBNWVGJ-UHFFFAOYSA-N 1 1 369.421 2.997 20 5 FFBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287699 520387855 /nfs/dbraw/zinc/38/78/55/520387855.db2.gz VIXHHURGLCPYJH-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287699 520387858 /nfs/dbraw/zinc/38/78/58/520387858.db2.gz VIXHHURGLCPYJH-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000603934223 520409467 /nfs/dbraw/zinc/40/94/67/520409467.db2.gz URCKNHBCMNZJNN-UHFFFAOYSA-N 1 1 351.350 2.547 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609758169 520421870 /nfs/dbraw/zinc/42/18/70/520421870.db2.gz NOUKHRXLUCVXKX-RHSMWYFYSA-N 1 1 356.426 2.635 20 5 FFBDMO CN(CCOCC[NH3+])Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000600776265 520463259 /nfs/dbraw/zinc/46/32/59/520463259.db2.gz QQITYNKVTKQQSM-UHFFFAOYSA-N 1 1 363.389 2.933 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595471304 520492268 /nfs/dbraw/zinc/49/22/68/520492268.db2.gz ZBYGLEQHAINILF-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000595471304 520492281 /nfs/dbraw/zinc/49/22/81/520492281.db2.gz ZBYGLEQHAINILF-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO CCOc1cc(C[NH2+][C@](C)(CC(=O)OC)c2ccncc2)ccc1[N+](=O)[O-] ZINC000595486111 520502486 /nfs/dbraw/zinc/50/24/86/520502486.db2.gz INAGVXPGGTUPEZ-LJQANCHMSA-N 1 1 373.409 2.957 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](c1cccnc1)C(C)(C)CO ZINC000595502272 520512109 /nfs/dbraw/zinc/51/21/09/520512109.db2.gz XXTXPCIGXSLFDH-GOSISDBHSA-N 1 1 372.425 2.586 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C[C@H]1C ZINC000610135240 520554214 /nfs/dbraw/zinc/55/42/14/520554214.db2.gz NLQKOJUTGKOLOF-CABCVRRESA-N 1 1 369.487 2.705 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000598343922 520566875 /nfs/dbraw/zinc/56/68/75/520566875.db2.gz YNCBBYBQNKSDSL-GFCCVEGCSA-N 1 1 370.247 2.880 20 5 FFBDMO Cn1c(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000604472360 520569644 /nfs/dbraw/zinc/56/96/44/520569644.db2.gz SRTKLUGZJMRHNO-MRXNPFEDSA-N 1 1 356.426 2.575 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000595591547 520577628 /nfs/dbraw/zinc/57/76/28/520577628.db2.gz VSWDAYJOYQQSLB-CYBMUJFWSA-N 1 1 374.363 2.897 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N[C@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000604506135 520582648 /nfs/dbraw/zinc/58/26/48/520582648.db2.gz GVPSXJRMWYOTOL-ZBFHGGJFSA-N 1 1 372.469 2.798 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1 ZINC000601106417 520637584 /nfs/dbraw/zinc/63/75/84/520637584.db2.gz WGIMGSKAFFFJOV-UHFFFAOYSA-N 1 1 363.384 2.904 20 5 FFBDMO Cn1cc([C@H]2OCCC[C@@H]2Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000601149496 520661506 /nfs/dbraw/zinc/66/15/06/520661506.db2.gz MPXPADWAMAGIRC-ZWKOTPCHSA-N 1 1 353.382 2.631 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000610422112 520676305 /nfs/dbraw/zinc/67/63/05/520676305.db2.gz CIWPEDSEPXXBOT-GOSISDBHSA-N 1 1 354.410 2.613 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[N@H+]1Cc1ccccn1 ZINC000610422112 520676313 /nfs/dbraw/zinc/67/63/13/520676313.db2.gz CIWPEDSEPXXBOT-GOSISDBHSA-N 1 1 354.410 2.613 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH+]2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000610447524 520691515 /nfs/dbraw/zinc/69/15/15/520691515.db2.gz GRPOQGRBPOUWHV-IUCAKERBSA-N 1 1 360.258 2.854 20 5 FFBDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000593058088 520716003 /nfs/dbraw/zinc/71/60/03/520716003.db2.gz JAMFXVQJTJECKV-HIFRSBDPSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c1 ZINC000595786559 520723777 /nfs/dbraw/zinc/72/37/77/520723777.db2.gz BIVMLKJVFLPJEQ-SUMDDJOVSA-N 1 1 364.442 2.616 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000610519983 520725837 /nfs/dbraw/zinc/72/58/37/520725837.db2.gz FHPRGDUPQONIAS-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598598726 520733808 /nfs/dbraw/zinc/73/38/08/520733808.db2.gz UADDUSUUDNASHE-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO COC(=O)c1ccnc(NCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598602771 520737959 /nfs/dbraw/zinc/73/79/59/520737959.db2.gz QHTUTCVMBXGWHA-AWEZNQCLSA-N 1 1 372.425 2.521 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000598610159 520740883 /nfs/dbraw/zinc/74/08/83/520740883.db2.gz DZPRIRXFFFXPDS-QWHCGFSZSA-N 1 1 362.430 2.841 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+](CCC2CC2)CC2CC2)cc1 ZINC000595872411 520780729 /nfs/dbraw/zinc/78/07/29/520780729.db2.gz YAGNJBZOYOPOCG-UHFFFAOYSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000593188305 520810841 /nfs/dbraw/zinc/81/08/41/520810841.db2.gz BXNMYMAESILWCW-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO CCS(=O)(=O)N(CC[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1C ZINC000598729288 520814078 /nfs/dbraw/zinc/81/40/78/520814078.db2.gz FESRPESNDOPPPI-UHFFFAOYSA-N 1 1 355.460 2.545 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000593204526 520825384 /nfs/dbraw/zinc/82/53/84/520825384.db2.gz YIJMGABSHPPZHL-UHFFFAOYSA-N 1 1 359.373 2.904 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC2)C1 ZINC000596128765 520928465 /nfs/dbraw/zinc/92/84/65/520928465.db2.gz MOEVECSSPCCBAW-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000596135631 520933584 /nfs/dbraw/zinc/93/35/84/520933584.db2.gz YAJARSLEBVMBOV-ZDUSSCGKSA-N 1 1 355.822 2.811 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000596135631 520933586 /nfs/dbraw/zinc/93/35/86/520933586.db2.gz YAJARSLEBVMBOV-ZDUSSCGKSA-N 1 1 355.822 2.811 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000618222350 520950088 /nfs/dbraw/zinc/95/00/88/520950088.db2.gz XJERMVIMRZWJAX-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cn1cc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993520 520965780 /nfs/dbraw/zinc/96/57/80/520965780.db2.gz DDIRSUUJOSFIDL-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO Cn1cc(CNC[C@@H]2CCCC[N@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993520 520965787 /nfs/dbraw/zinc/96/57/87/520965787.db2.gz DDIRSUUJOSFIDL-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO Cn1cc(CNC[C@@H]2CCCC[N@@H+](C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598993520 520965794 /nfs/dbraw/zinc/96/57/94/520965794.db2.gz DDIRSUUJOSFIDL-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593406136 520970269 /nfs/dbraw/zinc/97/02/69/520970269.db2.gz BHQOZWMEAYGQHZ-AWEZNQCLSA-N 1 1 351.422 2.905 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596204324 520970381 /nfs/dbraw/zinc/97/03/81/520970381.db2.gz CHXXSKDCBOVWKM-ZDUSSCGKSA-N 1 1 355.822 2.811 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596204324 520970383 /nfs/dbraw/zinc/97/03/83/520970383.db2.gz CHXXSKDCBOVWKM-ZDUSSCGKSA-N 1 1 355.822 2.811 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088121 520978638 /nfs/dbraw/zinc/97/86/38/520978638.db2.gz DHTZKLOWXVMMDT-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088121 520978643 /nfs/dbraw/zinc/97/86/43/520978643.db2.gz DHTZKLOWXVMMDT-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000596246112 520991895 /nfs/dbraw/zinc/99/18/95/520991895.db2.gz BQQZARCRBHEFTN-QGZVFWFLSA-N 1 1 368.437 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@]1([NH+]2CCOCC2)CCSC1 ZINC000593456358 521003969 /nfs/dbraw/zinc/00/39/69/521003969.db2.gz DNZQBDWPIGZLJP-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cn1 ZINC000611140084 521005905 /nfs/dbraw/zinc/00/59/05/521005905.db2.gz XJNPIIFZRIOFFC-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070063 521014045 /nfs/dbraw/zinc/01/40/45/521014045.db2.gz JWYAVICKUCSCLR-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@@H]2COCCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599078091 521019929 /nfs/dbraw/zinc/01/99/29/521019929.db2.gz JGTDHAOLHAZZDD-APWZRJJASA-N 1 1 359.426 2.760 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H]2COCCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599078107 521020068 /nfs/dbraw/zinc/02/00/68/521020068.db2.gz JGTDHAOLHAZZDD-QFBILLFUSA-N 1 1 359.426 2.760 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000611185037 521029761 /nfs/dbraw/zinc/02/97/61/521029761.db2.gz OOVYGDWAERFRHL-XLIONFOSSA-N 1 1 371.437 2.856 20 5 FFBDMO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCOCC3)C2)c(Br)c1 ZINC000599095920 521029969 /nfs/dbraw/zinc/02/99/69/521029969.db2.gz YJWOQEQLJWFBMN-UHFFFAOYSA-N 1 1 356.220 2.632 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000601969708 521049222 /nfs/dbraw/zinc/04/92/22/521049222.db2.gz DWMAOAGNFYAJKZ-WBVHZDCISA-N 1 1 352.337 2.774 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596424608 521065061 /nfs/dbraw/zinc/06/50/61/521065061.db2.gz UCUZJDHYNCLPOS-HNNXBMFYSA-N 1 1 362.817 2.822 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000593545674 521066465 /nfs/dbraw/zinc/06/64/65/521066465.db2.gz XTIAQGGUOUQGOT-PBHICJAKSA-N 1 1 361.417 2.752 20 5 FFBDMO Cc1cc(N2CCO[C@@H](CCC[NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000596565979 521133252 /nfs/dbraw/zinc/13/32/52/521133252.db2.gz JQVGTXDJTMGMLG-INIZCTEOSA-N 1 1 358.442 2.998 20 5 FFBDMO CC(C)[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N1CCCC1 ZINC000611395786 521133732 /nfs/dbraw/zinc/13/37/32/521133732.db2.gz UAOZHFLKZUTHRG-KRWDZBQOSA-N 1 1 372.425 2.986 20 5 FFBDMO CCO[C@H](C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)C1CC1 ZINC000599371671 521179463 /nfs/dbraw/zinc/17/94/63/521179463.db2.gz PEPOTCLLMOYNOP-GOSISDBHSA-N 1 1 373.457 2.798 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000611568005 521222607 /nfs/dbraw/zinc/22/26/07/521222607.db2.gz JTEWIKLDGFIEIE-CQSZACIVSA-N 1 1 350.444 2.842 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599464798 521239686 /nfs/dbraw/zinc/23/96/86/521239686.db2.gz TVUTWHRHMWLUJI-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H](N4CCOCC4)C3)co2)cc1 ZINC000593996034 521336408 /nfs/dbraw/zinc/33/64/08/521336408.db2.gz HOUQCZUHAAQMQR-SFHVURJKSA-N 1 1 372.425 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](N4CCOCC4)C3)co2)cc1 ZINC000593996034 521336416 /nfs/dbraw/zinc/33/64/16/521336416.db2.gz HOUQCZUHAAQMQR-SFHVURJKSA-N 1 1 372.425 2.546 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000593998384 521338390 /nfs/dbraw/zinc/33/83/90/521338390.db2.gz YWMKSKIGIVBBMO-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000593998384 521338394 /nfs/dbraw/zinc/33/83/94/521338394.db2.gz YWMKSKIGIVBBMO-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000593998384 521338401 /nfs/dbraw/zinc/33/84/01/521338401.db2.gz YWMKSKIGIVBBMO-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC000611828821 521354181 /nfs/dbraw/zinc/35/41/81/521354181.db2.gz WXGKIQPGFMOLEZ-AWEZNQCLSA-N 1 1 350.419 2.989 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098839 521403202 /nfs/dbraw/zinc/40/32/02/521403202.db2.gz WYPPQVOMXJFRFT-SOUVJXGZSA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098839 521403210 /nfs/dbraw/zinc/40/32/10/521403210.db2.gz WYPPQVOMXJFRFT-SOUVJXGZSA-N 1 1 364.446 2.831 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2[C@@H](C)CC(C(=O)OC)C[C@@H]2C)c1 ZINC000599692461 521405543 /nfs/dbraw/zinc/40/55/43/521405543.db2.gz SXLSXOPIZBRSGF-RYUDHWBXSA-N 1 1 364.398 2.543 20 5 FFBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1cc([N+](=O)[O-])c[nH]1 ZINC000612037581 521449955 /nfs/dbraw/zinc/44/99/55/521449955.db2.gz HMOZFFKUWDQFSD-BPQIPLTHSA-N 1 1 368.437 2.953 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000602722110 521496494 /nfs/dbraw/zinc/49/64/94/521496494.db2.gz MQFVZFKJHHXXQZ-OAHLLOKOSA-N 1 1 373.375 2.645 20 5 FFBDMO C[C@@H](NC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1 ZINC000597101832 521507610 /nfs/dbraw/zinc/50/76/10/521507610.db2.gz UXCAWBJXQJAYIZ-SECBINFHSA-N 1 1 353.810 2.602 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC000602787091 521531259 /nfs/dbraw/zinc/53/12/59/521531259.db2.gz OHASKZBFISWKLC-AWEZNQCLSA-N 1 1 352.435 2.544 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]2N1 ZINC000597204733 521573550 /nfs/dbraw/zinc/57/35/50/521573550.db2.gz FTIYXYURHZAXIG-BBRMVZONSA-N 1 1 355.394 2.955 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727974 720334971 /nfs/dbraw/zinc/33/49/71/720334971.db2.gz VBYBQTGYGFJGHJ-LSDHHAIUSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723937 720368076 /nfs/dbraw/zinc/36/80/76/720368076.db2.gz IDIJMOKSVQGAQY-LSDHHAIUSA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1cc(Cl)nc(N2CC[NH+](CCc3ccccn3)CC2)c1[N+](=O)[O-] ZINC001165053273 722011185 /nfs/dbraw/zinc/01/11/85/722011185.db2.gz DSRMSZRXSCDPRW-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164952514 722016570 /nfs/dbraw/zinc/01/65/70/722016570.db2.gz MQIGHJVTOPBUTK-UHFFFAOYSA-N 1 1 368.441 2.581 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)ccc1Cl ZINC000153902474 728790761 /nfs/dbraw/zinc/79/07/61/728790761.db2.gz HRHNCQKFAYWKKA-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)ccc1Cl ZINC000153902474 728790763 /nfs/dbraw/zinc/79/07/63/728790763.db2.gz HRHNCQKFAYWKKA-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCCC[C@H]2C[NH+]2CCOCC2)ccc1Cl ZINC000153902474 728790765 /nfs/dbraw/zinc/79/07/65/728790765.db2.gz HRHNCQKFAYWKKA-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO CSC[C@H]1CCC[N@@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154794414 728812314 /nfs/dbraw/zinc/81/23/14/728812314.db2.gz SJDXMLQRGQCFGE-CYBMUJFWSA-N 1 1 350.444 2.622 20 5 FFBDMO CSC[C@H]1CCC[N@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154794414 728812316 /nfs/dbraw/zinc/81/23/16/728812316.db2.gz SJDXMLQRGQCFGE-CYBMUJFWSA-N 1 1 350.444 2.622 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000155109303 728820898 /nfs/dbraw/zinc/82/08/98/728820898.db2.gz KSYNAECZDQERRV-JTQLQIEISA-N 1 1 371.235 2.821 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000072858615 728214372 /nfs/dbraw/zinc/21/43/72/728214372.db2.gz ASEBSZALYGYAPA-STQMWFEESA-N 1 1 368.865 2.849 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000120651167 728614007 /nfs/dbraw/zinc/61/40/07/728614007.db2.gz HIOAHHJYDDYBCD-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO CC[N@H+](CCc1nccs1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134176100 728728879 /nfs/dbraw/zinc/72/88/79/728728879.db2.gz GLNIXRSFKYIFFF-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO CC[N@@H+](CCc1nccs1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000134176100 728728880 /nfs/dbraw/zinc/72/88/80/728728880.db2.gz GLNIXRSFKYIFFF-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000139877285 728741337 /nfs/dbraw/zinc/74/13/37/728741337.db2.gz FOAXGAVVTZMTKH-DOMZBBRYSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000150937190 728743845 /nfs/dbraw/zinc/74/38/45/728743845.db2.gz ISMHWOPUDHKDEB-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000150937190 728743846 /nfs/dbraw/zinc/74/38/46/728743846.db2.gz ISMHWOPUDHKDEB-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000171955680 729016915 /nfs/dbraw/zinc/01/69/15/729016915.db2.gz DRUZQUCBLGXFSF-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000856800067 730358540 /nfs/dbraw/zinc/35/85/40/730358540.db2.gz NVMKSNKNQVBFKK-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000857303015 730390154 /nfs/dbraw/zinc/39/01/54/730390154.db2.gz JVOLORSKIXXZRI-SNVBAGLBSA-N 1 1 370.247 2.960 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860098867 730476354 /nfs/dbraw/zinc/47/63/54/730476354.db2.gz TZKHPGNVKRRTAD-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000865012648 730902655 /nfs/dbraw/zinc/90/26/55/730902655.db2.gz IBFXVDXERJPWJZ-UHFFFAOYSA-N 1 1 351.422 2.855 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000866209448 731040870 /nfs/dbraw/zinc/04/08/70/731040870.db2.gz SAILVMWUBUIYIN-WDEREUQCSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000866209447 731040977 /nfs/dbraw/zinc/04/09/77/731040977.db2.gz SAILVMWUBUIYIN-QWRGUYRKSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1ccc(COC(=O)[C@H]([NH2+]C2CCOCC2)C(C)C)cc1[N+](=O)[O-] ZINC000869421570 731397776 /nfs/dbraw/zinc/39/77/76/731397776.db2.gz USTFGJODVIYKPJ-QGZVFWFLSA-N 1 1 350.415 2.740 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000874831655 732104858 /nfs/dbraw/zinc/10/48/58/732104858.db2.gz ADNZDQMANBLELV-RYUDHWBXSA-N 1 1 355.341 2.505 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cc1SC ZINC000874835767 732105477 /nfs/dbraw/zinc/10/54/77/732105477.db2.gz ADXAQSOGIOANTC-OLZOCXBDSA-N 1 1 365.455 2.634 20 5 FFBDMO O=C1NC2(CO1)CC[NH+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000877312002 732342955 /nfs/dbraw/zinc/34/29/55/732342955.db2.gz BMYWZMGLSWTZRE-UHFFFAOYSA-N 1 1 359.304 2.688 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)c1cc(Br)no1 ZINC000878598233 732562413 /nfs/dbraw/zinc/56/24/13/732562413.db2.gz AKAMYLXXSGSFRB-LBPRGKRZSA-N 1 1 370.203 2.553 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)o1 ZINC000878991191 732627916 /nfs/dbraw/zinc/62/79/16/732627916.db2.gz VSVOYSCVMUBRIB-QWRGUYRKSA-N 1 1 364.789 2.767 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879560972 732723017 /nfs/dbraw/zinc/72/30/17/732723017.db2.gz JSVSCEVMOKQDBT-CHWSQXEVSA-N 1 1 365.455 2.617 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879574815 732727442 /nfs/dbraw/zinc/72/74/42/732727442.db2.gz GUKFXXPCEYUUOS-BFQNTYOBSA-N 1 1 366.849 2.601 20 5 FFBDMO CC(C)(C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000928079377 738816948 /nfs/dbraw/zinc/81/69/48/738816948.db2.gz IOMJWIRWDDRDDB-GOEBONIOSA-N 1 1 363.483 2.568 20 5 FFBDMO CSc1cccc(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928089011 738819698 /nfs/dbraw/zinc/81/96/98/738819698.db2.gz IPOJDDUCFQSPTL-CHWSQXEVSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1cccc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928089011 738819700 /nfs/dbraw/zinc/81/97/00/738819700.db2.gz IPOJDDUCFQSPTL-CHWSQXEVSA-N 1 1 367.496 2.626 20 5 FFBDMO C[C@]1(NC(=O)c2sc(Br)cc2[N+](=O)[O-])C[NH+]2CCC1CC2 ZINC000892775010 734602257 /nfs/dbraw/zinc/60/22/57/734602257.db2.gz WPHZWVUWGNKREV-ZDUSSCGKSA-N 1 1 374.260 2.633 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000894484071 734866810 /nfs/dbraw/zinc/86/68/10/734866810.db2.gz BJDGXHNMVWFLDO-ZIAGYGMSSA-N 1 1 350.415 2.948 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000901105967 735745059 /nfs/dbraw/zinc/74/50/59/735745059.db2.gz WZITTXZVFBIVMU-MFKMUULPSA-N 1 1 355.797 2.944 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767123180 737294130 /nfs/dbraw/zinc/29/41/30/737294130.db2.gz MAWPLDFPRFAPBU-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767123180 737294131 /nfs/dbraw/zinc/29/41/31/737294131.db2.gz MAWPLDFPRFAPBU-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000912810575 737342955 /nfs/dbraw/zinc/34/29/55/737342955.db2.gz WIUBJKPXKKSNNK-CHWSQXEVSA-N 1 1 351.451 2.634 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767948140 737385272 /nfs/dbraw/zinc/38/52/72/737385272.db2.gz LJCDZAXENUWBAR-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000785468821 738966451 /nfs/dbraw/zinc/96/64/51/738966451.db2.gz NNOYIIAAWXAHNF-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000771395082 737722083 /nfs/dbraw/zinc/72/20/83/737722083.db2.gz KITDAZRAZFCVMZ-BDAKNGLRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@@H+]1C ZINC000771395082 737722084 /nfs/dbraw/zinc/72/20/84/737722084.db2.gz KITDAZRAZFCVMZ-BDAKNGLRSA-N 1 1 374.210 2.661 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000771762313 737753460 /nfs/dbraw/zinc/75/34/60/737753460.db2.gz OCSOSCYBOWEZPE-STQMWFEESA-N 1 1 373.450 2.536 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000772374290 737807108 /nfs/dbraw/zinc/80/71/08/737807108.db2.gz MNQKSTUPOHHRAD-GDBMZVCRSA-N 1 1 350.415 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3cccs3)CC2)c([N+](=O)[O-])c1 ZINC000774821486 738029825 /nfs/dbraw/zinc/02/98/25/738029825.db2.gz RHOVOAZEGBQVSU-UHFFFAOYSA-N 1 1 362.411 2.882 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cc1SC ZINC000923292141 738266825 /nfs/dbraw/zinc/26/68/25/738266825.db2.gz URHUBYBPWCFOST-NEPJUHHUSA-N 1 1 365.455 2.634 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000778219470 738364930 /nfs/dbraw/zinc/36/49/30/738364930.db2.gz FPSCXILVSONUEP-NSHDSACASA-N 1 1 363.443 2.594 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000785547488 738976124 /nfs/dbraw/zinc/97/61/24/738976124.db2.gz YVVDULVJDZARHN-WQGACYEGSA-N 1 1 353.394 2.544 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000785726325 738991353 /nfs/dbraw/zinc/99/13/53/738991353.db2.gz CKUBAVHBKMVGNZ-GHMZBOCLSA-N 1 1 369.805 2.603 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000787420334 739135362 /nfs/dbraw/zinc/13/53/62/739135362.db2.gz HAQTWJJHEZZQRM-VHSXEESVSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000787420334 739135367 /nfs/dbraw/zinc/13/53/67/739135367.db2.gz HAQTWJJHEZZQRM-VHSXEESVSA-N 1 1 357.204 2.741 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000788566320 739259624 /nfs/dbraw/zinc/25/96/24/739259624.db2.gz VFHAAIKWHCNHDK-UHFFFAOYSA-N 1 1 350.444 2.752 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000788566320 739259630 /nfs/dbraw/zinc/25/96/30/739259630.db2.gz VFHAAIKWHCNHDK-UHFFFAOYSA-N 1 1 350.444 2.752 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000934892544 739862398 /nfs/dbraw/zinc/86/23/98/739862398.db2.gz XVMLUSMOGMKLCE-SKDRFNHKSA-N 1 1 370.812 2.526 20 5 FFBDMO C[C@H](NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000935311927 739930538 /nfs/dbraw/zinc/93/05/38/739930538.db2.gz GPVMFGRERUELMC-LBPRGKRZSA-N 1 1 351.834 2.947 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000935685964 739994440 /nfs/dbraw/zinc/99/44/40/739994440.db2.gz JAVLKFWGYMUVKP-GOEBONIOSA-N 1 1 369.824 2.826 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935775865 740009042 /nfs/dbraw/zinc/00/90/42/740009042.db2.gz NQFFTMUAPWOXQA-VIFPVBQESA-N 1 1 358.801 2.526 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796329960 740132605 /nfs/dbraw/zinc/13/26/05/740132605.db2.gz LZWSRCLTKOGOGW-OORQEUNZSA-N 1 1 365.817 2.542 20 5 FFBDMO Cc1ccc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c([N+](=O)[O-])c1Br ZINC000804397632 740868947 /nfs/dbraw/zinc/86/89/47/740868947.db2.gz ZXWNVOBOFGMAEE-NEPJUHHUSA-N 1 1 370.247 2.941 20 5 FFBDMO Cc1ccc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c([N+](=O)[O-])c1Br ZINC000804397637 740869089 /nfs/dbraw/zinc/86/90/89/740869089.db2.gz ZXWNVOBOFGMAEE-RYUDHWBXSA-N 1 1 370.247 2.941 20 5 FFBDMO C[N@@H+](Cc1cccc(F)c1Cl)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985426233 741395042 /nfs/dbraw/zinc/39/50/42/741395042.db2.gz NVGGGGQEMHKZGS-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1cccc(F)c1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426233 741395044 /nfs/dbraw/zinc/39/50/44/741395044.db2.gz NVGGGGQEMHKZGS-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1cccc(F)c1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426233 741395046 /nfs/dbraw/zinc/39/50/46/741395046.db2.gz NVGGGGQEMHKZGS-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO CC[C@H](C)[C@@H](OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173253 741684595 /nfs/dbraw/zinc/68/45/95/741684595.db2.gz ZKTPIUCQTKNSTO-RRQGHBQHSA-N 1 1 350.415 2.773 20 5 FFBDMO CC[C@H](C)[C@@H](OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173253 741684598 /nfs/dbraw/zinc/68/45/98/741684598.db2.gz ZKTPIUCQTKNSTO-RRQGHBQHSA-N 1 1 350.415 2.773 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F ZINC000822811239 742786477 /nfs/dbraw/zinc/78/64/77/742786477.db2.gz CGJOWYHFWFZXNM-VIFPVBQESA-N 1 1 352.341 2.752 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000823503511 742928601 /nfs/dbraw/zinc/92/86/01/742928601.db2.gz UGGZPJWUNDKVDP-SJLPKXTDSA-N 1 1 350.415 2.682 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1C ZINC000826629281 743410068 /nfs/dbraw/zinc/41/00/68/743410068.db2.gz OJWDKDJOAADSBZ-TXEJJXNPSA-N 1 1 350.444 2.750 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831159706 745492462 /nfs/dbraw/zinc/49/24/62/745492462.db2.gz XZCFWIUIDYJQNJ-JGGQBBKZSA-N 1 1 367.833 2.812 20 5 FFBDMO CC(C)(C[NH+]1CCCC1)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000832761069 745750914 /nfs/dbraw/zinc/75/09/14/745750914.db2.gz HMMNJOPLCCTKIU-UHFFFAOYSA-N 1 1 352.410 2.527 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000838148716 746584384 /nfs/dbraw/zinc/58/43/84/746584384.db2.gz KGRFDDSWTYJSGN-NSHDSACASA-N 1 1 357.813 2.778 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590012 746864909 /nfs/dbraw/zinc/86/49/09/746864909.db2.gz MFZFDXOEZHDWQV-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590012 746864913 /nfs/dbraw/zinc/86/49/13/746864913.db2.gz MFZFDXOEZHDWQV-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1CN1CCC2(CC[NH2+]C2)CC1 ZINC000843125998 747777352 /nfs/dbraw/zinc/77/73/52/747777352.db2.gz DKQYOZLENFFNDU-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO C[N@@H+](CCCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000848591478 748968464 /nfs/dbraw/zinc/96/84/64/748968464.db2.gz MWTRTJHZMAUQFD-UHFFFAOYSA-N 1 1 357.357 2.557 20 5 FFBDMO Cc1noc(C[NH2+][C@@](C)(CNC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000851853963 749704502 /nfs/dbraw/zinc/70/45/02/749704502.db2.gz NFISGKFVDSLYRG-INIZCTEOSA-N 1 1 354.407 2.674 20 5 FFBDMO Cn1cc([C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000852074055 749767413 /nfs/dbraw/zinc/76/74/13/749767413.db2.gz PQBWKRWBJMVBOY-MRXNPFEDSA-N 1 1 364.833 2.975 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000852198872 749800169 /nfs/dbraw/zinc/80/01/69/749800169.db2.gz BXKSXUFOOYQEOG-GFCCVEGCSA-N 1 1 354.838 2.920 20 5 FFBDMO C[C@@H]1COC2(CCC2)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852445169 749860935 /nfs/dbraw/zinc/86/09/35/749860935.db2.gz WDXWYZOAWCBDGV-GFCCVEGCSA-N 1 1 351.378 2.706 20 5 FFBDMO CC[N@H+](CCc1nccs1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000133993683 845658237 /nfs/dbraw/zinc/65/82/37/845658237.db2.gz HZFMPLAIFGDPSI-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO CC[N@@H+](CCc1nccs1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000133993683 845658244 /nfs/dbraw/zinc/65/82/44/845658244.db2.gz HZFMPLAIFGDPSI-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO C[N@@H+]1CCO[C@H](CSCc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000400774059 845874934 /nfs/dbraw/zinc/87/49/34/845874934.db2.gz DLENVIJBJPJVQW-NSHDSACASA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@H](CSCc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000400774059 845874938 /nfs/dbraw/zinc/87/49/38/845874938.db2.gz DLENVIJBJPJVQW-NSHDSACASA-N 1 1 361.261 2.921 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3ccn(C)n3)C2)c([N+](=O)[O-])cc1OC ZINC000896492282 971510067 /nfs/dbraw/zinc/51/00/67/971510067.db2.gz OEVHISQNWTVWIL-ZDUSSCGKSA-N 1 1 360.414 2.725 20 5 FFBDMO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@@H]1C[N@@H+](C)CCN1C ZINC000896569855 971594829 /nfs/dbraw/zinc/59/48/29/971594829.db2.gz JESHXHYSVYJZLD-QRWLVFNGSA-N 1 1 362.477 2.752 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000110506926 971796455 /nfs/dbraw/zinc/79/64/55/971796455.db2.gz XXGIURMSBABVNU-CQSZACIVSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000110506926 971796460 /nfs/dbraw/zinc/79/64/60/971796460.db2.gz XXGIURMSBABVNU-CQSZACIVSA-N 1 1 354.410 2.645 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759892813 971911794 /nfs/dbraw/zinc/91/17/94/971911794.db2.gz BWJJSJYFNGBAQS-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759892813 971911798 /nfs/dbraw/zinc/91/17/98/971911798.db2.gz BWJJSJYFNGBAQS-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO C[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001174716779 1013286818 /nfs/dbraw/zinc/28/68/18/1013286818.db2.gz TVDKTCKFFUTPPQ-QFYYESIMSA-N 1 1 366.805 2.749 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001174716779 1013286826 /nfs/dbraw/zinc/28/68/26/1013286826.db2.gz TVDKTCKFFUTPPQ-QFYYESIMSA-N 1 1 366.805 2.749 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)C[C@@H]1CC(C)C ZINC000933250132 963753993 /nfs/dbraw/zinc/75/39/93/963753993.db2.gz VIVMYIGZPMKKGE-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)C[C@@H]1CC(C)C ZINC000933250132 963753996 /nfs/dbraw/zinc/75/39/96/963753996.db2.gz VIVMYIGZPMKKGE-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)C[C@@H]1CC(C)C ZINC000933250132 963754000 /nfs/dbraw/zinc/75/40/00/963754000.db2.gz VIVMYIGZPMKKGE-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(C)c(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1C ZINC001022063731 964188297 /nfs/dbraw/zinc/18/82/97/964188297.db2.gz JOABAQYSNBXYJR-SFNKJDCFSA-N 1 1 359.470 2.631 20 5 FFBDMO Cc1cc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c(C)s1 ZINC001270742957 965859067 /nfs/dbraw/zinc/85/90/67/965859067.db2.gz DIYDUHMMDRYALJ-HUUCEWRRSA-N 1 1 351.472 2.549 20 5 FFBDMO CN1CC[N@H+](C)C[C@@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001211587347 967575908 /nfs/dbraw/zinc/57/59/08/967575908.db2.gz FLXUWVQYUAXPQJ-MRXNPFEDSA-N 1 1 360.421 2.751 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001211587347 967575911 /nfs/dbraw/zinc/57/59/11/967575911.db2.gz FLXUWVQYUAXPQJ-MRXNPFEDSA-N 1 1 360.421 2.751 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(NC(=O)C3CC3)cc2)c([N+](=O)[O-])cc1O ZINC001177162692 1013862459 /nfs/dbraw/zinc/86/24/59/1013862459.db2.gz OPOWAHSXKDWRDE-UHFFFAOYSA-N 1 1 371.393 2.947 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000892962934 970444676 /nfs/dbraw/zinc/44/46/76/970444676.db2.gz QIMUVSPQHSBKEJ-CHWSQXEVSA-N 1 1 362.382 2.540 20 5 FFBDMO C[C@@]1([C@@H]2CCCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)COC(=O)N1 ZINC000895531850 970707674 /nfs/dbraw/zinc/70/76/74/970707674.db2.gz MNFNGXJDMZTYAU-XIKOKIGWSA-N 1 1 356.382 2.858 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825827645 1014092430 /nfs/dbraw/zinc/09/24/30/1014092430.db2.gz WZOYLLWBUYIQMR-WMLDXEAASA-N 1 1 363.458 2.645 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000843816120 977307383 /nfs/dbraw/zinc/30/73/83/977307383.db2.gz BFIZYPQXHQXJNF-BETUJISGSA-N 1 1 367.421 2.662 20 5 FFBDMO CC(C)Oc1cc(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000842334232 977351884 /nfs/dbraw/zinc/35/18/84/977351884.db2.gz QRAVUBLDWOPNLN-OAHLLOKOSA-N 1 1 366.414 2.648 20 5 FFBDMO CC(C)Oc1cc(C(=O)OC[C@H]2C[N@H+](C(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000842334232 977351889 /nfs/dbraw/zinc/35/18/89/977351889.db2.gz QRAVUBLDWOPNLN-OAHLLOKOSA-N 1 1 366.414 2.648 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCC[NH+]1CCN(C(C)C)CC1 ZINC000899937594 977401180 /nfs/dbraw/zinc/40/11/80/977401180.db2.gz PZAMIIXDVRAEAK-UHFFFAOYSA-N 1 1 362.474 2.956 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687738 1014680149 /nfs/dbraw/zinc/68/01/49/1014680149.db2.gz LLVDIZIDJPNMAV-QZTJIDSGSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687738 1014680153 /nfs/dbraw/zinc/68/01/53/1014680153.db2.gz LLVDIZIDJPNMAV-QZTJIDSGSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691825 1014686154 /nfs/dbraw/zinc/68/61/54/1014686154.db2.gz PHGYJBMSLOFYRU-ZWKOTPCHSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691825 1014686160 /nfs/dbraw/zinc/68/61/60/1014686160.db2.gz PHGYJBMSLOFYRU-ZWKOTPCHSA-N 1 1 368.437 2.908 20 5 FFBDMO CN(CCC[NH2+]Cc1cc(Cl)sc1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001483465206 982272161 /nfs/dbraw/zinc/27/21/61/982272161.db2.gz ZRBGQRJLPQSXDC-NXEZZACHSA-N 1 1 366.270 2.658 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cnc3n2CCOC3)o1 ZINC000898270831 982663047 /nfs/dbraw/zinc/66/30/47/982663047.db2.gz NYZNUZHTZRHWGC-UHFFFAOYSA-N 1 1 354.366 2.871 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000912652211 984086124 /nfs/dbraw/zinc/08/61/24/984086124.db2.gz CHROLKFXMYWYNQ-UHFFFAOYSA-N 1 1 361.442 2.767 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000164789975 984402109 /nfs/dbraw/zinc/40/21/09/984402109.db2.gz LDOUXNSCMXYNRX-MJGOQNOKSA-N 1 1 355.442 2.735 20 5 FFBDMO CCCC(=O)NC1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000764885380 984783906 /nfs/dbraw/zinc/78/39/06/984783906.db2.gz ONNOGSMHLIKNIT-UHFFFAOYSA-N 1 1 359.430 2.591 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000764945509 984873298 /nfs/dbraw/zinc/87/32/98/984873298.db2.gz HYHNAUZFGNMXLI-HNNXBMFYSA-N 1 1 373.457 2.839 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](C)c1cccc(N2CCOC2=O)c1 ZINC000878530095 1015087489 /nfs/dbraw/zinc/08/74/89/1015087489.db2.gz PHZQBKOMOPAOFW-CYBMUJFWSA-N 1 1 373.413 2.749 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)NCC(C)C)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000761280310 985075929 /nfs/dbraw/zinc/07/59/29/985075929.db2.gz PCUZJMXZLMKOCA-UHFFFAOYSA-N 1 1 373.457 2.695 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000170903478 985171517 /nfs/dbraw/zinc/17/15/17/985171517.db2.gz XBRHFOXLZKIQON-AWEZNQCLSA-N 1 1 367.450 2.554 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000170903478 985171523 /nfs/dbraw/zinc/17/15/23/985171523.db2.gz XBRHFOXLZKIQON-AWEZNQCLSA-N 1 1 367.450 2.554 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)nc1 ZINC000172358447 985518275 /nfs/dbraw/zinc/51/82/75/985518275.db2.gz UKFYBHPESQTGTG-ZDUSSCGKSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)nc1 ZINC000172358447 985518276 /nfs/dbraw/zinc/51/82/76/985518276.db2.gz UKFYBHPESQTGTG-ZDUSSCGKSA-N 1 1 361.333 2.724 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000063537631 985940209 /nfs/dbraw/zinc/94/02/09/985940209.db2.gz PQYRXDRKDJZNKF-QGZVFWFLSA-N 1 1 367.421 2.601 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000174281052 986175612 /nfs/dbraw/zinc/17/56/12/986175612.db2.gz YGYMKAHTQQLIGX-QUCCMNQESA-N 1 1 374.437 2.698 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000762474829 988394474 /nfs/dbraw/zinc/39/44/74/988394474.db2.gz YVWWQQGWMFQJPW-INIZCTEOSA-N 1 1 371.397 2.798 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000762474829 988394485 /nfs/dbraw/zinc/39/44/85/988394485.db2.gz YVWWQQGWMFQJPW-INIZCTEOSA-N 1 1 371.397 2.798 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1[C@H](O)c1ccccc1 ZINC000879244538 1015434941 /nfs/dbraw/zinc/43/49/41/1015434941.db2.gz QZKMEIVRRIXDRB-IMFGXOCKSA-N 1 1 372.421 2.533 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000126509088 989106271 /nfs/dbraw/zinc/10/62/71/989106271.db2.gz NGTIWDHIHAYULL-UONOGXRCSA-N 1 1 356.426 2.993 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000917462999 990220738 /nfs/dbraw/zinc/22/07/38/990220738.db2.gz UTKBLGPASFNWKR-GOSISDBHSA-N 1 1 360.414 2.584 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC001035186588 990400028 /nfs/dbraw/zinc/40/00/28/990400028.db2.gz GMHBVLBUDQAIBG-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCCC3CCCC3)C2)CC1 ZINC001035186588 990400031 /nfs/dbraw/zinc/40/00/31/990400031.db2.gz GMHBVLBUDQAIBG-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCC3CCCC3)C2)CC1 ZINC001035186588 990400035 /nfs/dbraw/zinc/40/00/35/990400035.db2.gz GMHBVLBUDQAIBG-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO CC1(C)[C@H](c2ccccc2F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000879638864 1015621253 /nfs/dbraw/zinc/62/12/53/1015621253.db2.gz GHEKIKRNSSAKRJ-HOCLYGCPSA-N 1 1 362.405 2.559 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000180187477 991449257 /nfs/dbraw/zinc/44/92/57/991449257.db2.gz ALUAMKVJKPPKEB-HKUYNNGSSA-N 1 1 368.437 2.836 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1CCCCC1)Cc1ccccc1 ZINC001484399537 991562349 /nfs/dbraw/zinc/56/23/49/991562349.db2.gz MWKDZSPIHVSJJB-RTBURBONSA-N 1 1 359.470 2.850 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267451 991728894 /nfs/dbraw/zinc/72/88/94/991728894.db2.gz PKBXXNBFBQHASF-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267451 991728903 /nfs/dbraw/zinc/72/89/03/991728903.db2.gz PKBXXNBFBQHASF-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000072500994 993123763 /nfs/dbraw/zinc/12/37/63/993123763.db2.gz JTRLBKAOFYWLPU-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO O=C(C[NH+]1CCC2(CCCCO2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000880455530 1015839229 /nfs/dbraw/zinc/83/92/29/1015839229.db2.gz AGUTXRGPKJHCJL-UHFFFAOYSA-N 1 1 359.426 2.519 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](N2CCCCC2=O)C1 ZINC000747530211 994257256 /nfs/dbraw/zinc/25/72/56/994257256.db2.gz QWNXWKGDXHKQMD-KRWDZBQOSA-N 1 1 361.442 2.970 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](N2CCCCC2=O)C1 ZINC000747530211 994257268 /nfs/dbraw/zinc/25/72/68/994257268.db2.gz QWNXWKGDXHKQMD-KRWDZBQOSA-N 1 1 361.442 2.970 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)CC2(CCOCC2)C1 ZINC000880585543 1015879770 /nfs/dbraw/zinc/87/97/70/1015879770.db2.gz IKGBDHDHJJMVMT-KRWDZBQOSA-N 1 1 364.442 2.745 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810845657 994952572 /nfs/dbraw/zinc/95/25/72/994952572.db2.gz FQLOMWSYEHRTMH-KGLIPLIRSA-N 1 1 356.382 2.564 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271088 995915979 /nfs/dbraw/zinc/91/59/79/995915979.db2.gz SXOMQJCKKUTJES-UONOGXRCSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271088 995915985 /nfs/dbraw/zinc/91/59/85/995915985.db2.gz SXOMQJCKKUTJES-UONOGXRCSA-N 1 1 359.220 2.593 20 5 FFBDMO COc1ccc(CC(=O)Nc2cccnc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000727674347 995921370 /nfs/dbraw/zinc/92/13/70/995921370.db2.gz RPNGLJFUVUROKO-UHFFFAOYSA-N 1 1 367.365 2.674 20 5 FFBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000844423459 997879084 /nfs/dbraw/zinc/87/90/84/997879084.db2.gz SNZCNUKTDHEYFU-SFHVURJKSA-N 1 1 370.409 2.862 20 5 FFBDMO C[C@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])[C@H]1CCNC(=O)OC(C)(C)C ZINC000844727824 998099996 /nfs/dbraw/zinc/09/99/96/998099996.db2.gz IKYPWSOVVXFXPY-KBPBESRZSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])[C@H]1CCNC(=O)OC(C)(C)C ZINC000844727824 998100018 /nfs/dbraw/zinc/10/00/18/998100018.db2.gz IKYPWSOVVXFXPY-KBPBESRZSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)[C@H]1CCNC(=O)OC(C)(C)C ZINC000844731427 998129035 /nfs/dbraw/zinc/12/90/35/998129035.db2.gz SMQQXUYJECAUBL-ZFWWWQNUSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)[C@H]1CCNC(=O)OC(C)(C)C ZINC000844731427 998129045 /nfs/dbraw/zinc/12/90/45/998129045.db2.gz SMQQXUYJECAUBL-ZFWWWQNUSA-N 1 1 367.450 2.764 20 5 FFBDMO COc1ccc(OCCOC(=O)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000803855702 1016244196 /nfs/dbraw/zinc/24/41/96/1016244196.db2.gz JNAJPVNJHGBIGR-AWEZNQCLSA-N 1 1 366.414 2.790 20 5 FFBDMO C[C@@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000803859747 1016248468 /nfs/dbraw/zinc/24/84/68/1016248468.db2.gz VQSNJIRZDMNBQP-KGLIPLIRSA-N 1 1 363.414 2.730 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000803856043 1016247039 /nfs/dbraw/zinc/24/70/39/1016247039.db2.gz LYYAEWLWLSWVCZ-AWEZNQCLSA-N 1 1 374.397 2.953 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000734401463 999284279 /nfs/dbraw/zinc/28/42/79/999284279.db2.gz HKJJHSHNKWYUTF-CXAGYDPISA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000742155140 999762203 /nfs/dbraw/zinc/76/22/03/999762203.db2.gz PNTNHTMIXHSZSG-PJIJBLCYSA-N 1 1 374.441 2.830 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001086363166 999870188 /nfs/dbraw/zinc/87/01/88/999870188.db2.gz FSGMNHPEGVAKHR-QSFMABPGSA-N 1 1 367.449 2.798 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000746390667 999985292 /nfs/dbraw/zinc/98/52/92/999985292.db2.gz BIYNZVKPKYPYQO-AWEZNQCLSA-N 1 1 358.442 2.648 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CCN2Cc1cccc(C[NH+]2CCOCC2)c1 ZINC001168894943 1000004210 /nfs/dbraw/zinc/00/42/10/1000004210.db2.gz ZZZBCNMOWUQCGO-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169011642 1000015611 /nfs/dbraw/zinc/01/56/11/1000015611.db2.gz LWVMMTXMISOGCL-IIDMSEBBSA-N 1 1 353.463 2.907 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000767458889 1000116243 /nfs/dbraw/zinc/11/62/43/1000116243.db2.gz JSQJUKSKKPEBRH-ZDUSSCGKSA-N 1 1 369.425 2.605 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000769662105 1000571566 /nfs/dbraw/zinc/57/15/66/1000571566.db2.gz KGHZCFKENFNKSL-HNNXBMFYSA-N 1 1 360.458 2.798 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)c2ncc([N+](=O)[O-])cc12 ZINC000769776808 1000593798 /nfs/dbraw/zinc/59/37/98/1000593798.db2.gz KPIAVPJNVGSEPQ-LJQANCHMSA-N 1 1 365.393 2.737 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c2ncc([N+](=O)[O-])cc12 ZINC000769776808 1000593800 /nfs/dbraw/zinc/59/38/00/1000593800.db2.gz KPIAVPJNVGSEPQ-LJQANCHMSA-N 1 1 365.393 2.737 20 5 FFBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000770044657 1000663795 /nfs/dbraw/zinc/66/37/95/1000663795.db2.gz RHXJSRSMLDLSKA-QUCCMNQESA-N 1 1 374.437 2.779 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000785739551 1001474023 /nfs/dbraw/zinc/47/40/23/1001474023.db2.gz BHYPREPRHOCZRW-RYUDHWBXSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000785740021 1001474208 /nfs/dbraw/zinc/47/42/08/1001474208.db2.gz BHYPREPRHOCZRW-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000785740021 1001474210 /nfs/dbraw/zinc/47/42/10/1001474210.db2.gz BHYPREPRHOCZRW-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO COC(=O)COc1ccc(CNc2ccc(C)[nH+]c2N(C)C)cc1[N+](=O)[O-] ZINC000788965303 1001923285 /nfs/dbraw/zinc/92/32/85/1001923285.db2.gz JBGYQNKJXAQFIM-UHFFFAOYSA-N 1 1 374.397 2.528 20 5 FFBDMO Cn1c(=O)ccc2c1CCC[C@H]2[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001182666393 1001989419 /nfs/dbraw/zinc/98/94/19/1001989419.db2.gz OBLVLOXYAPYVPY-CYBMUJFWSA-N 1 1 354.366 2.602 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1F ZINC001185413705 1002948682 /nfs/dbraw/zinc/94/86/82/1002948682.db2.gz WXTVBQKSQXCUBX-OLZOCXBDSA-N 1 1 373.450 2.584 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(Cc3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC001170326942 1003112969 /nfs/dbraw/zinc/11/29/69/1003112969.db2.gz CRWKNZWCYAAHCP-MRXNPFEDSA-N 1 1 370.453 2.747 20 5 FFBDMO COC(=O)CC[C@@H]1CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352803 1003121086 /nfs/dbraw/zinc/12/10/86/1003121086.db2.gz QQPBAYFSRSSACT-UONOGXRCSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+]2CCc3ccc(=O)[nH]c3CC2)c([N+](=O)[O-])c1 ZINC001170353419 1003121594 /nfs/dbraw/zinc/12/15/94/1003121594.db2.gz XZJBKCFPHLDEKP-CYBMUJFWSA-N 1 1 357.410 2.736 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170356037 1003122811 /nfs/dbraw/zinc/12/28/11/1003122811.db2.gz UTDANAVADDMQJE-UONOGXRCSA-N 1 1 350.415 2.810 20 5 FFBDMO COC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341361 1003130028 /nfs/dbraw/zinc/13/00/28/1003130028.db2.gz PLLFRUROHUVWSU-ZFWWWQNUSA-N 1 1 374.441 2.514 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341361 1003130033 /nfs/dbraw/zinc/13/00/33/1003130033.db2.gz PLLFRUROHUVWSU-ZFWWWQNUSA-N 1 1 374.441 2.514 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCN(C)c3ncccc3C2)c([N+](=O)[O-])c1 ZINC001170340106 1003130156 /nfs/dbraw/zinc/13/01/56/1003130156.db2.gz DMNZJLRLKSUDAF-AWEZNQCLSA-N 1 1 356.426 2.881 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000804812378 1003857997 /nfs/dbraw/zinc/85/79/97/1003857997.db2.gz NJCISVDUKXLWBM-UHFFFAOYSA-N 1 1 366.421 2.800 20 5 FFBDMO Cn1c[nH+]c2c1ccc1c2CCCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198676144 1004707128 /nfs/dbraw/zinc/70/71/28/1004707128.db2.gz IOBQIGQEXUFUJU-GOSISDBHSA-N 1 1 352.394 2.968 20 5 FFBDMO Cc1cc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000104827927 1004817694 /nfs/dbraw/zinc/81/76/94/1004817694.db2.gz VOOZIZNJFHCEHS-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO CCC(C)(C)CC[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001195487991 1004976085 /nfs/dbraw/zinc/97/60/85/1004976085.db2.gz MUFHCBSEWGWDNS-UHFFFAOYSA-N 1 1 357.476 2.631 20 5 FFBDMO C[C@@H]1CC[C@@H](C(N)=O)[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001195595666 1004995224 /nfs/dbraw/zinc/99/52/24/1004995224.db2.gz GFIJWSIQWBJRIE-GBIKHYSHSA-N 1 1 370.247 2.832 20 5 FFBDMO CC(C)n1cc(C2=CCC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)nn1 ZINC000852133684 1005944145 /nfs/dbraw/zinc/94/41/45/1005944145.db2.gz AMMOVHHRPGPSRV-IBGZPJMESA-N 1 1 371.441 2.980 20 5 FFBDMO CC(C)n1cc(C2=CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000852135482 1005944456 /nfs/dbraw/zinc/94/44/56/1005944456.db2.gz RSLGTLDNXZOAQR-LJQANCHMSA-N 1 1 371.441 2.980 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582379 1005961703 /nfs/dbraw/zinc/96/17/03/1005961703.db2.gz PLQQFCRZDLZGSJ-OXQOHEQNSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000776582192 1005961890 /nfs/dbraw/zinc/96/18/90/1005961890.db2.gz LRBNXZHVDJXGOY-QZTJIDSGSA-N 1 1 373.384 2.505 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000776582192 1005961895 /nfs/dbraw/zinc/96/18/95/1005961895.db2.gz LRBNXZHVDJXGOY-QZTJIDSGSA-N 1 1 373.384 2.505 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498943 1006415071 /nfs/dbraw/zinc/41/50/71/1006415071.db2.gz SKLCGHZBNOFWCB-HOTGVXAUSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498943 1006415077 /nfs/dbraw/zinc/41/50/77/1006415077.db2.gz SKLCGHZBNOFWCB-HOTGVXAUSA-N 1 1 359.430 2.946 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1 ZINC000853812005 1006543446 /nfs/dbraw/zinc/54/34/46/1006543446.db2.gz GUMZUQCZCYKBTB-GFCCVEGCSA-N 1 1 371.384 2.803 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC001135059704 1006659661 /nfs/dbraw/zinc/65/96/61/1006659661.db2.gz OGWVPHGZKNTZTA-FZZIBODNSA-N 1 1 357.332 2.684 20 5 FFBDMO COCCn1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815616727 1006713782 /nfs/dbraw/zinc/71/37/82/1006713782.db2.gz WWOQNWUVIRHRML-LRDDRELGSA-N 1 1 359.430 2.748 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000816452133 1007061338 /nfs/dbraw/zinc/06/13/38/1007061338.db2.gz WQYQFXVNXJIXTJ-CRAIPNDOSA-N 1 1 372.425 2.635 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000113197511 1007220488 /nfs/dbraw/zinc/22/04/88/1007220488.db2.gz VKLBHTUFMXMMOI-ZDUSSCGKSA-N 1 1 364.402 2.806 20 5 FFBDMO C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000817288911 1007510439 /nfs/dbraw/zinc/51/04/39/1007510439.db2.gz OWMMJTVIQKUWMJ-FRFSOERESA-N 1 1 364.442 2.928 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000855809691 1007575864 /nfs/dbraw/zinc/57/58/64/1007575864.db2.gz JODKZHHZZUZBQB-ZDUSSCGKSA-N 1 1 365.405 2.636 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000855811394 1007577283 /nfs/dbraw/zinc/57/72/83/1007577283.db2.gz MWCSPHOMIWEOFI-AWEZNQCLSA-N 1 1 360.458 2.798 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1nc(C)c[nH]1 ZINC001191103153 1007889283 /nfs/dbraw/zinc/88/92/83/1007889283.db2.gz KUMYFNNEXWHTBR-UHFFFAOYSA-N 1 1 361.405 2.975 20 5 FFBDMO CC(=O)N(C)c1ccc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000858250223 1008333034 /nfs/dbraw/zinc/33/30/34/1008333034.db2.gz KLLVZEGPJPATSF-UHFFFAOYSA-N 1 1 371.393 2.639 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)Cc1cncnc1 ZINC001177220002 1008525786 /nfs/dbraw/zinc/52/57/86/1008525786.db2.gz SBHLCHIJAREGQH-UHFFFAOYSA-N 1 1 373.416 2.928 20 5 FFBDMO CC(C)(CCC(=O)N1CC[NH+](Cc2cccc3cccnc32)CC1)[N+](=O)[O-] ZINC000822318163 1008572479 /nfs/dbraw/zinc/57/24/79/1008572479.db2.gz ZUDNOEKAAYNHSK-UHFFFAOYSA-N 1 1 370.453 2.715 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000886432145 1008678629 /nfs/dbraw/zinc/67/86/29/1008678629.db2.gz PLJHMLCFJWXQDN-GOSISDBHSA-N 1 1 358.394 2.935 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000886432145 1008678635 /nfs/dbraw/zinc/67/86/35/1008678635.db2.gz PLJHMLCFJWXQDN-GOSISDBHSA-N 1 1 358.394 2.935 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860253687 1008916845 /nfs/dbraw/zinc/91/68/45/1008916845.db2.gz GBKZZCWYTDYJLM-MRXNPFEDSA-N 1 1 371.437 2.715 20 5 FFBDMO C[C@@H]1CN(c2cc[nH+]cc2)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000887132837 1009044820 /nfs/dbraw/zinc/04/48/20/1009044820.db2.gz OJEVFCLYYIPRDR-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482770 1009087750 /nfs/dbraw/zinc/08/77/50/1009087750.db2.gz XLAZLBZTUFOKAA-TYPHKJRUSA-N 1 1 367.449 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482770 1009087764 /nfs/dbraw/zinc/08/77/64/1009087764.db2.gz XLAZLBZTUFOKAA-TYPHKJRUSA-N 1 1 367.449 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482770 1009087778 /nfs/dbraw/zinc/08/77/78/1009087778.db2.gz XLAZLBZTUFOKAA-TYPHKJRUSA-N 1 1 367.449 2.835 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126476000 1009231248 /nfs/dbraw/zinc/23/12/48/1009231248.db2.gz ZVKWAYUNOHOWNL-YVEFUNNKSA-N 1 1 374.397 2.592 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000129701626 1009297710 /nfs/dbraw/zinc/29/77/10/1009297710.db2.gz IIIICHQYQJUGKP-INIZCTEOSA-N 1 1 363.458 2.536 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000129701626 1009297719 /nfs/dbraw/zinc/29/77/19/1009297719.db2.gz IIIICHQYQJUGKP-INIZCTEOSA-N 1 1 363.458 2.536 20 5 FFBDMO O=C1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCN1Cc1ccccn1 ZINC001180322728 1009650691 /nfs/dbraw/zinc/65/06/91/1009650691.db2.gz NQODDKKSMKSUMB-QGZVFWFLSA-N 1 1 374.828 2.924 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000715594849 1010351970 /nfs/dbraw/zinc/35/19/70/1010351970.db2.gz JMLRLVXIMWXNNT-ZDUSSCGKSA-N 1 1 361.348 2.877 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000715594849 1010351981 /nfs/dbraw/zinc/35/19/81/1010351981.db2.gz JMLRLVXIMWXNNT-ZDUSSCGKSA-N 1 1 361.348 2.877 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000794633976 1010448455 /nfs/dbraw/zinc/44/84/55/1010448455.db2.gz QBJQOWSTWBRBOP-AWEZNQCLSA-N 1 1 361.398 2.884 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000794633976 1010448463 /nfs/dbraw/zinc/44/84/63/1010448463.db2.gz QBJQOWSTWBRBOP-AWEZNQCLSA-N 1 1 361.398 2.884 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000864676265 1010552968 /nfs/dbraw/zinc/55/29/68/1010552968.db2.gz IZJJDQZMIQVVDQ-KRWDZBQOSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000864676265 1010552974 /nfs/dbraw/zinc/55/29/74/1010552974.db2.gz IZJJDQZMIQVVDQ-KRWDZBQOSA-N 1 1 357.385 2.792 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H](C[C@H]4CCOC4)C3)n2)c1 ZINC000773255397 1010898403 /nfs/dbraw/zinc/89/84/03/1010898403.db2.gz AINXNQCOBYUTHX-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1ccnc1 ZINC000121676929 1011068720 /nfs/dbraw/zinc/06/87/20/1011068720.db2.gz OOZXQPLWAAWOJO-YOEHRIQHSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1ccnc1 ZINC000121676929 1011068725 /nfs/dbraw/zinc/06/87/25/1011068725.db2.gz OOZXQPLWAAWOJO-YOEHRIQHSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867955887 1011130573 /nfs/dbraw/zinc/13/05/73/1011130573.db2.gz IQRIMIQCPVHSRT-WNYOCNMUSA-N 1 1 369.421 2.757 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905495 1012078031 /nfs/dbraw/zinc/07/80/31/1012078031.db2.gz CQFSINVMJNCVOT-MAUKXSAKSA-N 1 1 370.453 2.817 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905495 1012078046 /nfs/dbraw/zinc/07/80/46/1012078046.db2.gz CQFSINVMJNCVOT-MAUKXSAKSA-N 1 1 370.453 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CCN(C3COC3)CC1)CC2 ZINC001172908789 1012081656 /nfs/dbraw/zinc/08/16/56/1012081656.db2.gz YZQBDIUYBRVUFD-SFHVURJKSA-N 1 1 359.470 2.543 20 5 FFBDMO CCOC(=O)[C@H]1CSCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921346 1012102170 /nfs/dbraw/zinc/10/21/70/1012102170.db2.gz PAIFPNQHMCQBHI-DOTOQJQBSA-N 1 1 364.467 2.823 20 5 FFBDMO CCOC(=O)[C@H]1CSCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921346 1012102178 /nfs/dbraw/zinc/10/21/78/1012102178.db2.gz PAIFPNQHMCQBHI-DOTOQJQBSA-N 1 1 364.467 2.823 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870078840 1012108730 /nfs/dbraw/zinc/10/87/30/1012108730.db2.gz LOYRVBUPCAYEND-QGZVFWFLSA-N 1 1 373.434 2.566 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)c1 ZINC000870079822 1012109255 /nfs/dbraw/zinc/10/92/55/1012109255.db2.gz ACBPSZLDFFSSKN-MRXNPFEDSA-N 1 1 373.434 2.809 20 5 FFBDMO C[C@@H](C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000870087703 1012116802 /nfs/dbraw/zinc/11/68/02/1012116802.db2.gz UALLBCNGCRRYKR-XIKOKIGWSA-N 1 1 373.384 2.716 20 5 FFBDMO C/C(=C\C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870087822 1012120052 /nfs/dbraw/zinc/12/00/52/1012120052.db2.gz ULRAFMXSIWGZQH-XUDAUXSOSA-N 1 1 367.405 2.877 20 5 FFBDMO CCO[C@@H]1C[C@H]2C[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CCN2C1 ZINC001172910205 1012122289 /nfs/dbraw/zinc/12/22/89/1012122289.db2.gz KXGNFKLXTPHRFX-YZGWKJHDSA-N 1 1 359.470 2.637 20 5 FFBDMO CCO[C@@H]1C[C@H]2CN([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[N@@H+]2C1 ZINC001172910205 1012122299 /nfs/dbraw/zinc/12/22/99/1012122299.db2.gz KXGNFKLXTPHRFX-YZGWKJHDSA-N 1 1 359.470 2.637 20 5 FFBDMO CCO[C@@H]1C[C@H]2CN([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[N@H+]2C1 ZINC001172910205 1012122306 /nfs/dbraw/zinc/12/23/06/1012122306.db2.gz KXGNFKLXTPHRFX-YZGWKJHDSA-N 1 1 359.470 2.637 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1C[C@@H]3C[N@H+](CC4CC4)C[C@H](C1)O3)CC2 ZINC001172910821 1012122384 /nfs/dbraw/zinc/12/23/84/1012122384.db2.gz OJDHGOKGHNZUAR-NRSPTQNISA-N 1 1 371.481 2.637 20 5 FFBDMO O=C1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1F ZINC001173010819 1012181609 /nfs/dbraw/zinc/18/16/09/1012181609.db2.gz ZVRKKZUTXLJSCD-CYBMUJFWSA-N 1 1 371.359 2.845 20 5 FFBDMO O=C1CC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1F ZINC001173010819 1012181622 /nfs/dbraw/zinc/18/16/22/1012181622.db2.gz ZVRKKZUTXLJSCD-CYBMUJFWSA-N 1 1 371.359 2.845 20 5 FFBDMO CN(C)CCC[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014626 1012187241 /nfs/dbraw/zinc/18/72/41/1012187241.db2.gz VFGSGESPVVMKFH-UHFFFAOYSA-N 1 1 356.417 2.725 20 5 FFBDMO CN(C)CCC[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014626 1012187254 /nfs/dbraw/zinc/18/72/54/1012187254.db2.gz VFGSGESPVVMKFH-UHFFFAOYSA-N 1 1 356.417 2.725 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2ncc(F)cn2)c1F ZINC001173183798 1012326356 /nfs/dbraw/zinc/32/63/56/1012326356.db2.gz NQAMQGGIGODBPF-NXEZZACHSA-N 1 1 352.341 2.953 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccncc2)CC1 ZINC001173225021 1012359215 /nfs/dbraw/zinc/35/92/15/1012359215.db2.gz AWEUAUXEIMYWGY-QGZVFWFLSA-N 1 1 354.454 2.781 20 5 FFBDMO COc1cc(C)nc(O[C@@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237129 1012382813 /nfs/dbraw/zinc/38/28/13/1012382813.db2.gz IAZCJIVNXHLWAZ-RHSMWYFYSA-N 1 1 372.425 2.786 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000097667642 1012930933 /nfs/dbraw/zinc/93/09/33/1012930933.db2.gz RMCCUNUMVXLOET-RYUDHWBXSA-N 1 1 364.402 2.662 20 5 FFBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106426 1018368450 /nfs/dbraw/zinc/36/84/50/1018368450.db2.gz ZYQXAIWJOWYFMI-YOEHRIQHSA-N 1 1 363.458 2.897 20 5 FFBDMO CCOc1ccc([C@H](C)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106426 1018368461 /nfs/dbraw/zinc/36/84/61/1018368461.db2.gz ZYQXAIWJOWYFMI-YOEHRIQHSA-N 1 1 363.458 2.897 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801860665 1019458491 /nfs/dbraw/zinc/45/84/91/1019458491.db2.gz NCSFWGYKWWLIRB-XQQFMLRXSA-N 1 1 364.421 2.794 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000801950972 1019537109 /nfs/dbraw/zinc/53/71/09/1019537109.db2.gz OFDHLCJKWRBHIS-VXGBXAGGSA-N 1 1 364.421 2.699 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])NCC[NH+]1Cc2ccccc2C1 ZINC000930653342 1020120809 /nfs/dbraw/zinc/12/08/09/1020120809.db2.gz SYNVSYUQSYMGRW-UHFFFAOYSA-N 1 1 357.385 2.799 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCO[C@H]1CCOC1)[C@H]1CC[C@H](O)CC1 ZINC000930809885 1020197623 /nfs/dbraw/zinc/19/76/23/1020197623.db2.gz OVRKFGNHZFNJQD-BZSNNMDCSA-N 1 1 364.442 2.506 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(C4OCCO4)CC3)c2)c1 ZINC000777954665 1020323899 /nfs/dbraw/zinc/32/38/99/1020323899.db2.gz ALPSPNHMNCNBKC-UHFFFAOYSA-N 1 1 358.398 2.501 20 5 FFBDMO CCOc1cc(CN2CCC([N@H+]3CCCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000931288204 1020404669 /nfs/dbraw/zinc/40/46/69/1020404669.db2.gz YAEPRNLMEWWTAM-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932138797 1020717400 /nfs/dbraw/zinc/71/74/00/1020717400.db2.gz YUFULMLGUDTRJT-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932138797 1020717410 /nfs/dbraw/zinc/71/74/10/1020717410.db2.gz YUFULMLGUDTRJT-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCn2nc(C3CC3)cc2C1 ZINC000932604816 1020845845 /nfs/dbraw/zinc/84/58/45/1020845845.db2.gz IBOGTKNQGXROSE-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCn2nc(C3CC3)cc2C1 ZINC000932604816 1020845851 /nfs/dbraw/zinc/84/58/51/1020845851.db2.gz IBOGTKNQGXROSE-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]([C@@H]2CCCO2)C1 ZINC000933183226 1020974347 /nfs/dbraw/zinc/97/43/47/1020974347.db2.gz OCGPNSNNMJPLQT-COXVUDFISA-N 1 1 366.389 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]([C@@H]2CCCO2)C1 ZINC000933183226 1020974353 /nfs/dbraw/zinc/97/43/53/1020974353.db2.gz OCGPNSNNMJPLQT-COXVUDFISA-N 1 1 366.389 2.667 20 5 FFBDMO CCN1C[C@@H](C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000749663474 1021018006 /nfs/dbraw/zinc/01/80/06/1021018006.db2.gz FUEGTQJNDFHKSF-MJGOQNOKSA-N 1 1 371.437 2.848 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](Cc3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000933571839 1021033679 /nfs/dbraw/zinc/03/36/79/1021033679.db2.gz FDLSOJGIEGDYDA-LBPRGKRZSA-N 1 1 364.377 2.889 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](Cc3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000933571839 1021033683 /nfs/dbraw/zinc/03/36/83/1021033683.db2.gz FDLSOJGIEGDYDA-LBPRGKRZSA-N 1 1 364.377 2.889 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336377 1021200356 /nfs/dbraw/zinc/20/03/56/1021200356.db2.gz PJTQDZZEOQDPLF-CJNGLKHVSA-N 1 1 372.450 2.721 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336377 1021200367 /nfs/dbraw/zinc/20/03/67/1021200367.db2.gz PJTQDZZEOQDPLF-CJNGLKHVSA-N 1 1 372.450 2.721 20 5 FFBDMO CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000750116626 1021379319 /nfs/dbraw/zinc/37/93/19/1021379319.db2.gz SLYPZRRFECAFDV-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000750116626 1021379334 /nfs/dbraw/zinc/37/93/34/1021379334.db2.gz SLYPZRRFECAFDV-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000750116626 1021379351 /nfs/dbraw/zinc/37/93/51/1021379351.db2.gz SLYPZRRFECAFDV-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1c(C)c(C)c(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1C ZINC001020138955 1022564288 /nfs/dbraw/zinc/56/42/88/1022564288.db2.gz JOABAQYSNBXYJR-YWTNHNAXSA-N 1 1 359.470 2.631 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3nccs3)C2)nc1-c1ccncc1 ZINC001119391600 1022734991 /nfs/dbraw/zinc/73/49/91/1022734991.db2.gz FBJHGHUVTONOPG-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3nccs3)C2)nc1-c1ccncc1 ZINC001119391600 1022735001 /nfs/dbraw/zinc/73/50/01/1022735001.db2.gz FBJHGHUVTONOPG-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO C/C(=C\C(=O)N1CCC[N@@H+](C[C@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000751690050 1022911866 /nfs/dbraw/zinc/91/18/66/1022911866.db2.gz YEDWAWLCUWRYNG-JRJUITNWSA-N 1 1 373.453 2.711 20 5 FFBDMO CCc1ccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1 ZINC001040700745 1022954559 /nfs/dbraw/zinc/95/45/59/1022954559.db2.gz QVFUBIVZZYMYGX-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO COCC[C@]1([NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CCOC1 ZINC001119855834 1023133076 /nfs/dbraw/zinc/13/30/76/1023133076.db2.gz VBLCGQMROBPXOT-AWEZNQCLSA-N 1 1 359.220 2.643 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@]3(CCCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752790720 1023205334 /nfs/dbraw/zinc/20/53/34/1023205334.db2.gz BUJNAXSYFSRDJU-IBGZPJMESA-N 1 1 374.441 2.687 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@]3(CCCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752790720 1023205343 /nfs/dbraw/zinc/20/53/43/1023205343.db2.gz BUJNAXSYFSRDJU-IBGZPJMESA-N 1 1 374.441 2.687 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803955 1023208719 /nfs/dbraw/zinc/20/87/19/1023208719.db2.gz PFBZYUVUBIGGKA-SMDDNHRTSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803955 1023208729 /nfs/dbraw/zinc/20/87/29/1023208729.db2.gz PFBZYUVUBIGGKA-SMDDNHRTSA-N 1 1 367.450 2.601 20 5 FFBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790737 1023636206 /nfs/dbraw/zinc/63/62/06/1023636206.db2.gz QJFPWWIXWGQSPI-OAHLLOKOSA-N 1 1 352.398 2.639 20 5 FFBDMO COc1cc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)ccc1[N+](=O)[O-] ZINC001121275983 1023684168 /nfs/dbraw/zinc/68/41/68/1023684168.db2.gz BUNDRDQHCJVTNB-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000756980457 1023776114 /nfs/dbraw/zinc/77/61/14/1023776114.db2.gz SHIVJWOQYRWUMF-AWEZNQCLSA-N 1 1 360.458 2.877 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[NH+](Cc4ccccc4)CC3)cc2N1 ZINC000193509694 1024548012 /nfs/dbraw/zinc/54/80/12/1024548012.db2.gz SRMYRXPFYOIIES-UHFFFAOYSA-N 1 1 366.421 2.802 20 5 FFBDMO O=C1CC2(CN1C[N@H+]1CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C1)CCOCC2 ZINC000840124643 1026967905 /nfs/dbraw/zinc/96/79/05/1026967905.db2.gz JIYUEVRYCJIKLV-QGZVFWFLSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1CC2(CN1C[N@@H+]1CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C1)CCOCC2 ZINC000840124643 1026967909 /nfs/dbraw/zinc/96/79/09/1026967909.db2.gz JIYUEVRYCJIKLV-QGZVFWFLSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC12CCOCC2 ZINC000840125973 1026969714 /nfs/dbraw/zinc/96/97/14/1026969714.db2.gz NOZPESQSKNGJSE-QGZVFWFLSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC12CCOCC2 ZINC000840125973 1026969719 /nfs/dbraw/zinc/96/97/19/1026969719.db2.gz NOZPESQSKNGJSE-QGZVFWFLSA-N 1 1 373.453 2.761 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCCc2ccccc2CC1 ZINC000840132745 1026974185 /nfs/dbraw/zinc/97/41/85/1026974185.db2.gz FDQHQCZFGSFNDS-UHFFFAOYSA-N 1 1 353.378 2.951 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCCc2ccccc2CC1 ZINC000840132745 1026974193 /nfs/dbraw/zinc/97/41/93/1026974193.db2.gz FDQHQCZFGSFNDS-UHFFFAOYSA-N 1 1 353.378 2.951 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001141947482 1027202532 /nfs/dbraw/zinc/20/25/32/1027202532.db2.gz YYRBNFUPNLWOIF-GFCCVEGCSA-N 1 1 367.409 2.901 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](Cn1cnc(-c3cccc([N+](=O)[O-])c3)n1)C2 ZINC000795722003 1028009625 /nfs/dbraw/zinc/00/96/25/1028009625.db2.gz ZOZFXSBFSOFQAH-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001154615587 1028378523 /nfs/dbraw/zinc/37/85/23/1028378523.db2.gz IYAPSVHKLWVMLR-LLVKDONJSA-N 1 1 366.805 2.591 20 5 FFBDMO Cc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000249948061 1028410539 /nfs/dbraw/zinc/41/05/39/1028410539.db2.gz ZUIGOERPKCBCHM-NEPJUHHUSA-N 1 1 364.402 2.662 20 5 FFBDMO CSc1nc(Cl)c([N+](=O)[O-])c(NCC[C@@H]2CC[NH2+]CC2(F)F)n1 ZINC001162810851 1028664854 /nfs/dbraw/zinc/66/48/54/1028664854.db2.gz ODTRBDWUVKJLNN-ZETCQYMHSA-N 1 1 367.809 2.807 20 5 FFBDMO CSc1nc(Cl)nc(NCC[C@@H]2CC[NH2+]CC2(F)F)c1[N+](=O)[O-] ZINC001162813214 1028666498 /nfs/dbraw/zinc/66/64/98/1028666498.db2.gz SONIJPHPXAUJFB-ZETCQYMHSA-N 1 1 367.809 2.807 20 5 FFBDMO CN(C)C1(CNc2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC[NH+](C)CC1 ZINC001156181962 1029078764 /nfs/dbraw/zinc/07/87/64/1029078764.db2.gz LMHSCIRLBZURGT-UHFFFAOYSA-N 1 1 362.261 2.735 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164494776 1029298667 /nfs/dbraw/zinc/29/86/67/1029298667.db2.gz RPPBDRIRBBMGMA-CZUORRHYSA-N 1 1 365.861 2.690 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC001165089415 1029379696 /nfs/dbraw/zinc/37/96/96/1029379696.db2.gz UNOIPYHBRCXXLH-GOEBONIOSA-N 1 1 374.828 2.592 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c1 ZINC001165089303 1029381183 /nfs/dbraw/zinc/38/11/83/1029381183.db2.gz TUBMRDFKGLAKAP-GOEBONIOSA-N 1 1 374.828 2.592 20 5 FFBDMO Cc1ccc(-c2ccc(N3C[C@H]4[C@H](C3)CCC[N@@H+]4C)nn2)cc1[N+](=O)[O-] ZINC001157269212 1029530912 /nfs/dbraw/zinc/53/09/12/1029530912.db2.gz ASLXSVVQUDUPGZ-YJBOKZPZSA-N 1 1 353.426 2.891 20 5 FFBDMO CCOc1nc(-n2ccc(C[NH2+]Cc3ccccc3)n2)ccc1[N+](=O)[O-] ZINC001157612360 1029630777 /nfs/dbraw/zinc/63/07/77/1029630777.db2.gz TVNHXXUQAOQICI-UHFFFAOYSA-N 1 1 353.382 2.864 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCCC(=O)Nc2ccccc2)ncc1[N+](=O)[O-] ZINC001158124522 1029738354 /nfs/dbraw/zinc/73/83/54/1029738354.db2.gz YWJMHDDCNAZRMD-PKNBQFBNSA-N 1 1 355.398 2.963 20 5 FFBDMO O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001142263270 1030235303 /nfs/dbraw/zinc/23/53/03/1030235303.db2.gz ACWXKFKIPCUYON-INIZCTEOSA-N 1 1 350.378 2.863 20 5 FFBDMO CC(C)(O)C[N@@H+]1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001203352027 1030677958 /nfs/dbraw/zinc/67/79/58/1030677958.db2.gz NATMQKDPAIYUHB-HNNXBMFYSA-N 1 1 359.426 2.790 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001203352027 1030677966 /nfs/dbraw/zinc/67/79/66/1030677966.db2.gz NATMQKDPAIYUHB-HNNXBMFYSA-N 1 1 359.426 2.790 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@@]2(O)CCc3ccccc32)c2ccc([N+](=O)[O-])cc12 ZINC000842623223 1030840600 /nfs/dbraw/zinc/84/06/00/1030840600.db2.gz LBCMRDZLTVIRHQ-FQEVSTJZSA-N 1 1 366.421 2.976 20 5 FFBDMO C[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C[C@]1(O)CCc2ccccc21 ZINC000842623979 1030844745 /nfs/dbraw/zinc/84/47/45/1030844745.db2.gz MCONMUJSPGEDSD-LJQANCHMSA-N 1 1 352.394 2.668 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1CN1CCN(c3ccccc3[N+](=O)[O-])C1=O)CCOCC2 ZINC000842638383 1030866865 /nfs/dbraw/zinc/86/68/65/1030866865.db2.gz KLOYJDHCHBVKNP-OAHLLOKOSA-N 1 1 374.441 2.685 20 5 FFBDMO C[NH+]1CCC(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)(c2ccccc2)CC1 ZINC001149686120 1031570497 /nfs/dbraw/zinc/57/04/97/1031570497.db2.gz DMOWFYWCZIAQRQ-UHFFFAOYSA-N 1 1 369.421 2.694 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312696212 1033680603 /nfs/dbraw/zinc/68/06/03/1033680603.db2.gz QZAGCVIEWWLYLF-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000831538927 1034117414 /nfs/dbraw/zinc/11/74/14/1034117414.db2.gz JOPZITHWHBKKKJ-HNNXBMFYSA-N 1 1 372.381 2.544 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000831698867 1034220522 /nfs/dbraw/zinc/22/05/22/1034220522.db2.gz BTGIAKXNIANHSB-ROUUACIJSA-N 1 1 361.442 2.542 20 5 FFBDMO O=c1cc[nH]c(O[C@H]2[C@@H]3CC[C@H]2C[N@H+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC001225667381 1034360217 /nfs/dbraw/zinc/36/02/17/1034360217.db2.gz RRHMZPJELQZTQM-HWWDLCQESA-N 1 1 355.394 2.985 20 5 FFBDMO COC(=O)c1cc(O[C@@H]2CCC[N@H+](C(C)C)C2)c(OC)cc1[N+](=O)[O-] ZINC001226438539 1034683991 /nfs/dbraw/zinc/68/39/91/1034683991.db2.gz HNIKBVHWDYVJBN-GFCCVEGCSA-N 1 1 352.387 2.642 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(C[NH+]3CCN(c4cnccn4)CC3)nc12 ZINC001232218048 1035504168 /nfs/dbraw/zinc/50/41/68/1035504168.db2.gz CTQXFFFBEHQTNO-UHFFFAOYSA-N 1 1 356.433 2.895 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000835396344 1035744965 /nfs/dbraw/zinc/74/49/65/1035744965.db2.gz MFGJSKNLEAEVKH-HUUCEWRRSA-N 1 1 356.382 2.564 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC001229058666 1036477477 /nfs/dbraw/zinc/47/74/77/1036477477.db2.gz BYMNFRAQLCFWQX-DZGCQCFKSA-N 1 1 371.393 2.991 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3nccc4c3cccc4[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001234677284 1037137528 /nfs/dbraw/zinc/13/75/28/1037137528.db2.gz TYTHWVLGTKQLOL-RPLLJCPNSA-N 1 1 371.393 2.689 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3cccc(Br)c3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001230326079 1037223235 /nfs/dbraw/zinc/22/32/35/1037223235.db2.gz HGXUIMCBURVAOF-RLCGTCKNSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cccc(Br)c3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001230326079 1037223245 /nfs/dbraw/zinc/22/32/45/1037223245.db2.gz HGXUIMCBURVAOF-RLCGTCKNSA-N 1 1 355.188 2.540 20 5 FFBDMO COc1cc(N2CCC([NH2+]C(C)(C)C(C)(C)N)CC2)ccc1[N+](=O)[O-] ZINC001256103667 1038387341 /nfs/dbraw/zinc/38/73/41/1038387341.db2.gz XJRILUIGZCSVAS-UHFFFAOYSA-N 1 1 350.463 2.678 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(F)cc(F)c3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258145253 1039224046 /nfs/dbraw/zinc/22/40/46/1039224046.db2.gz HGHGTJFEXORCHB-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO Cc1ccc(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c([N+](=O)[O-])c1C ZINC001258161601 1039239245 /nfs/dbraw/zinc/23/92/45/1039239245.db2.gz KDQDVNRGVRDQTG-BETUJISGSA-N 1 1 360.414 2.913 20 5 FFBDMO CC[C@@]1(CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC[NH2+]1 ZINC001246455812 1039362235 /nfs/dbraw/zinc/36/22/35/1039362235.db2.gz KERMTGOSXIDNEN-SFHVURJKSA-N 1 1 368.428 2.964 20 5 FFBDMO O=C(NCCCN[C@@H]1CCC[NH2+]C1)c1c2ccccc2nc2ccccc21 ZINC001246482676 1039365312 /nfs/dbraw/zinc/36/53/12/1039365312.db2.gz HXXJZRFJXXTHDD-MRXNPFEDSA-N 1 1 362.477 2.850 20 5 FFBDMO COc1cccc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1OC ZINC001247666459 1039874618 /nfs/dbraw/zinc/87/46/18/1039874618.db2.gz ONFBHPXQHUVFBG-ZDUSSCGKSA-N 1 1 370.365 2.905 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 ZINC001254558496 1040796653 /nfs/dbraw/zinc/79/66/53/1040796653.db2.gz BWSVRNGVIQWKPU-ZVZYQTTQSA-N 1 1 366.421 2.516 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CCN2c2ncccn2)C1 ZINC001254562720 1040798397 /nfs/dbraw/zinc/79/83/97/1040798397.db2.gz SYPSZJTYARKWOI-KXBFYZLASA-N 1 1 353.426 2.671 20 5 FFBDMO O=C(Cc1ccsc1)N1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254606276 1040834544 /nfs/dbraw/zinc/83/45/44/1040834544.db2.gz GCIHFUXDDKGOLV-SFHVURJKSA-N 1 1 371.462 2.510 20 5 FFBDMO COc1cc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ccn1 ZINC001254605390 1040835376 /nfs/dbraw/zinc/83/53/76/1040835376.db2.gz BNQXGHOGWQDNMU-AEFFLSMTSA-N 1 1 355.394 2.619 20 5 FFBDMO Cc1nc(Nc2cc([N+](=O)[O-])cnc2C)cc(N2C[C@H](C)O[C@@H](C)C2)[nH+]1 ZINC001249546959 1040859483 /nfs/dbraw/zinc/85/94/83/1040859483.db2.gz SVTGJNWEBUHBAO-QWRGUYRKSA-N 1 1 358.402 2.754 20 5 FFBDMO Cc1[nH]c(C2CCN(S(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC001213746765 1040869139 /nfs/dbraw/zinc/86/91/39/1040869139.db2.gz ZQUPNLKONZBQFS-UHFFFAOYSA-N 1 1 370.456 2.565 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC2)c1 ZINC001538712605 1070479857 /nfs/dbraw/zinc/47/98/57/1070479857.db2.gz KPQHGLGEZMRTJP-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCc2ccccc2)CC1 ZINC001317004100 1045047352 /nfs/dbraw/zinc/04/73/52/1045047352.db2.gz LWPPUVUESBFNEQ-RTBURBONSA-N 1 1 359.470 2.597 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001539397626 1070631230 /nfs/dbraw/zinc/63/12/30/1070631230.db2.gz VEANEKQBKZMJLL-CYBMUJFWSA-N 1 1 355.822 2.618 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@@H]3CCCC[C@@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001318012020 1045191565 /nfs/dbraw/zinc/19/15/65/1045191565.db2.gz AEBIYFKNEGHRDO-VBQJREDUSA-N 1 1 357.410 2.739 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001319572159 1045199205 /nfs/dbraw/zinc/19/92/05/1045199205.db2.gz LQPYDBACRGDYRR-AEFFLSMTSA-N 1 1 372.400 2.979 20 5 FFBDMO CC(C)(C)CCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001323825838 1045741119 /nfs/dbraw/zinc/74/11/19/1045741119.db2.gz OGEPBLYNUQJAMX-HZPDHXFCSA-N 1 1 351.491 2.792 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001540070143 1070755311 /nfs/dbraw/zinc/75/53/11/1070755311.db2.gz YKWBOUUWGCZACG-UHFFFAOYSA-N 1 1 373.457 2.690 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001324939346 1046297807 /nfs/dbraw/zinc/29/78/07/1046297807.db2.gz GFJZCRIBKAAVAB-GFCCVEGCSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C1Nc2ccccc2[C@@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC001332363984 1048363753 /nfs/dbraw/zinc/36/37/53/1048363753.db2.gz BMJXCIANXOKFQR-KRWDZBQOSA-N 1 1 352.394 2.938 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CCC[N@@H+](CC)C2)ccc1[N+](=O)[O-] ZINC001333506556 1048948312 /nfs/dbraw/zinc/94/83/12/1048948312.db2.gz HHNBXZVUJHKYOK-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@@H+](CC)C1CC1 ZINC001295098675 1049878193 /nfs/dbraw/zinc/87/81/93/1049878193.db2.gz VYIOVABMNAGFRN-UHFFFAOYSA-N 1 1 358.446 2.794 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001307211643 1050064423 /nfs/dbraw/zinc/06/44/23/1050064423.db2.gz CCZPXCHFAJZGDY-UHFFFAOYSA-N 1 1 370.369 2.905 20 5 FFBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001301803838 1050989261 /nfs/dbraw/zinc/98/92/61/1050989261.db2.gz QYWQGKGRGXCQIW-AWEZNQCLSA-N 1 1 361.785 2.741 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001306977739 1052230371 /nfs/dbraw/zinc/23/03/71/1052230371.db2.gz CKTWPMJMEJVYKF-AWEZNQCLSA-N 1 1 358.442 2.757 20 5 FFBDMO C[C@@H]1CCC[C@@H](C[N@@H+](C)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001307851205 1052356656 /nfs/dbraw/zinc/35/66/56/1052356656.db2.gz MKCMRTSWOQVGEZ-HUUCEWRRSA-N 1 1 369.487 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@]3(CO)c3ccccc3)nc2c1 ZINC001308164226 1052422556 /nfs/dbraw/zinc/42/25/56/1052422556.db2.gz RPMBHFOUSJCQDV-LJQANCHMSA-N 1 1 352.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@]3(CO)c3ccccc3)nc2c1 ZINC001308164226 1052422560 /nfs/dbraw/zinc/42/25/60/1052422560.db2.gz RPMBHFOUSJCQDV-LJQANCHMSA-N 1 1 352.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO ZINC001346068360 1052731462 /nfs/dbraw/zinc/73/14/62/1052731462.db2.gz MPDVNYXPZIHNJX-QWHCGFSZSA-N 1 1 359.348 2.649 20 5 FFBDMO Nc1c(NC(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC001347391924 1053928354 /nfs/dbraw/zinc/92/83/54/1053928354.db2.gz PHIPKYDRLJRHLV-NSHDSACASA-N 1 1 353.810 2.532 20 5 FFBDMO O=C1N(C[NH+]2CCC3(CCCCO3)CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC001337191046 1054546150 /nfs/dbraw/zinc/54/61/50/1054546150.db2.gz NCFIRRUECZVUMF-UHFFFAOYSA-N 1 1 374.441 2.829 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348236243 1054564450 /nfs/dbraw/zinc/56/44/50/1054564450.db2.gz XVODROPMVNWIQR-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348236243 1054564468 /nfs/dbraw/zinc/56/44/68/1054564468.db2.gz XVODROPMVNWIQR-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001338554834 1055619914 /nfs/dbraw/zinc/61/99/14/1055619914.db2.gz MHUWYYJQAHWOSW-INIZCTEOSA-N 1 1 361.445 2.992 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001339235572 1056234594 /nfs/dbraw/zinc/23/45/94/1056234594.db2.gz WAKQCNJRQSGVKM-WMLDXEAASA-N 1 1 370.457 2.712 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001339414463 1056429409 /nfs/dbraw/zinc/42/94/09/1056429409.db2.gz NKOMRNIPRSXVCS-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001339414463 1056429419 /nfs/dbraw/zinc/42/94/19/1056429419.db2.gz NKOMRNIPRSXVCS-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2C)CC1 ZINC001339542569 1056565360 /nfs/dbraw/zinc/56/53/60/1056565360.db2.gz VNTGUDSBLUGHHM-UHFFFAOYSA-N 1 1 362.434 2.540 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000538096317 1056795894 /nfs/dbraw/zinc/79/58/94/1056795894.db2.gz BLEGVECDXVMQOJ-UKRRQHHQSA-N 1 1 352.398 2.885 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC[N@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000849597328 1056937978 /nfs/dbraw/zinc/93/79/78/1056937978.db2.gz SFOVPIGLQNCLQH-HZPDHXFCSA-N 1 1 371.441 2.619 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2sccc2Cl)CC1 ZINC001500424813 1058486124 /nfs/dbraw/zinc/48/61/24/1058486124.db2.gz SPINSMPIVXYHQM-DGCLKSJQSA-N 1 1 371.890 2.785 20 5 FFBDMO COC1CCC([N@@H+](C)CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848479090 1060107578 /nfs/dbraw/zinc/10/75/78/1060107578.db2.gz QMNWNJUTCUVSSQ-VMWRSERWSA-N 1 1 361.442 2.758 20 5 FFBDMO CC(C)OC1CC[NH+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848478772 1060109500 /nfs/dbraw/zinc/10/95/00/1060109500.db2.gz RNFWDCHNMONXGF-GOSISDBHSA-N 1 1 361.442 2.758 20 5 FFBDMO COCCOC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848478498 1060110530 /nfs/dbraw/zinc/11/05/30/1060110530.db2.gz IOBXXCUWXNKPBN-UHFFFAOYSA-N 1 1 360.414 2.543 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000848479724 1060112660 /nfs/dbraw/zinc/11/26/60/1060112660.db2.gz JOYGMIBVFSAWGR-GOSISDBHSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000848485386 1060127164 /nfs/dbraw/zinc/12/71/64/1060127164.db2.gz ZEPPZTISUKZNTK-IEBWSBKVSA-N 1 1 373.453 2.617 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)CC1 ZINC001475442418 1061093352 /nfs/dbraw/zinc/09/33/52/1061093352.db2.gz JYDOKZUQSVXPFB-UHFFFAOYSA-N 1 1 369.487 2.707 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](c3ncccn3)C2)cccc1[N+](=O)[O-] ZINC001460847048 1061128447 /nfs/dbraw/zinc/12/84/47/1061128447.db2.gz HMZLELURAPUFKQ-CQSZACIVSA-N 1 1 355.398 2.511 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C ZINC001546421695 1061132924 /nfs/dbraw/zinc/13/29/24/1061132924.db2.gz OWXLWSNIFPEMBC-OAHLLOKOSA-N 1 1 372.473 2.869 20 5 FFBDMO O=C1[C@H]([N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460925358 1061152255 /nfs/dbraw/zinc/15/22/55/1061152255.db2.gz SUKCCOSTYJWICJ-FRQCXROJSA-N 1 1 373.453 2.839 20 5 FFBDMO COc1c(O)ccc(C[NH2+][C@@H](CC(=O)N(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC001462266349 1061562774 /nfs/dbraw/zinc/56/27/74/1061562774.db2.gz IEFHVZVFFGVBCU-HNNXBMFYSA-N 1 1 373.409 2.618 20 5 FFBDMO CCc1ccc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001463526942 1062145199 /nfs/dbraw/zinc/14/51/99/1062145199.db2.gz KGCQKRZQBMKAIF-ZIAGYGMSSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1ccc(CNC(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC001479122644 1062238082 /nfs/dbraw/zinc/23/80/82/1062238082.db2.gz SCFOLCOLTNJIEI-AWEZNQCLSA-N 1 1 360.458 2.919 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+]1Cc1ccccc1 ZINC001466752561 1063545081 /nfs/dbraw/zinc/54/50/81/1063545081.db2.gz GTPDVZNWHWIQTD-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001466752561 1063545096 /nfs/dbraw/zinc/54/50/96/1063545096.db2.gz GTPDVZNWHWIQTD-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CCC1(C)C ZINC001469560645 1064167858 /nfs/dbraw/zinc/16/78/58/1064167858.db2.gz XYEZJIXSVWBOFV-UHFFFAOYSA-N 1 1 368.865 2.916 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC001470710394 1064421674 /nfs/dbraw/zinc/42/16/74/1064421674.db2.gz CTWJHLUFDXKYSW-KRWDZBQOSA-N 1 1 369.421 2.673 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])c1 ZINC001472844318 1065155901 /nfs/dbraw/zinc/15/59/01/1065155901.db2.gz MOFVKUGGPPQJBB-INIZCTEOSA-N 1 1 370.409 2.771 20 5 FFBDMO CN(C)c1cc[nH+]c(CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])c1 ZINC001472877672 1065165731 /nfs/dbraw/zinc/16/57/31/1065165731.db2.gz AQFDBKCXSBGRJH-UHFFFAOYSA-N 1 1 368.353 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(CSCC[NH+]2CCOCC2)c1 ZINC001559354904 1076151943 /nfs/dbraw/zinc/15/19/43/1076151943.db2.gz IHEHYBYDGDWOCG-UHFFFAOYSA-N 1 1 361.261 2.923 20 5 FFBDMO Cc1cccc(C[C@]2(C)CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC001560040535 1076216094 /nfs/dbraw/zinc/21/60/94/1076216094.db2.gz SXXRILBUSUTIAY-MOPGFXCFSA-N 1 1 358.442 2.558 20 5 FFBDMO Cc1cccc(C[C@]2(C)CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC001560040536 1076216698 /nfs/dbraw/zinc/21/66/98/1076216698.db2.gz SXXRILBUSUTIAY-OALUTQOASA-N 1 1 358.442 2.558 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3Br)CC[C@@H]21 ZINC001560077420 1076222852 /nfs/dbraw/zinc/22/28/52/1076222852.db2.gz KRUCUCPVRVOOQV-ABAIWWIYSA-N 1 1 354.248 2.883 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)n1 ZINC001566426211 1076959153 /nfs/dbraw/zinc/95/91/53/1076959153.db2.gz JMOALRNHUMZGAU-NVXWUHKLSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)n1 ZINC001566426211 1076959156 /nfs/dbraw/zinc/95/91/56/1076959156.db2.gz JMOALRNHUMZGAU-NVXWUHKLSA-N 1 1 358.373 2.613 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001568640293 1077104407 /nfs/dbraw/zinc/10/44/07/1077104407.db2.gz CEOJGGFRUHLPLY-NSHDSACASA-N 1 1 372.828 2.820 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC001586218492 1079576825 /nfs/dbraw/zinc/57/68/25/1079576825.db2.gz FNFFTRVICSESOE-CALCHBBNSA-N 1 1 351.834 2.591 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC001590260601 1081129242 /nfs/dbraw/zinc/12/92/42/1081129242.db2.gz QBTRVLAWZPFVOQ-ZJUUUORDSA-N 1 1 351.436 2.511 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC001590260601 1081129244 /nfs/dbraw/zinc/12/92/44/1081129244.db2.gz QBTRVLAWZPFVOQ-ZJUUUORDSA-N 1 1 351.436 2.511 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000007668244 249310539 /nfs/dbraw/zinc/31/05/39/249310539.db2.gz DPWGOHQGIZLGGJ-UHFFFAOYSA-N 1 1 359.382 2.683 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000007668244 249310541 /nfs/dbraw/zinc/31/05/41/249310541.db2.gz DPWGOHQGIZLGGJ-UHFFFAOYSA-N 1 1 359.382 2.683 20 5 FFBDMO COCC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H](C)C(N)=O ZINC000093137495 250017635 /nfs/dbraw/zinc/01/76/35/250017635.db2.gz UXLNMRKMPKTKNU-GFCCVEGCSA-N 1 1 363.439 2.646 20 5 FFBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H](C)C(N)=O ZINC000093137495 250017639 /nfs/dbraw/zinc/01/76/39/250017639.db2.gz UXLNMRKMPKTKNU-GFCCVEGCSA-N 1 1 363.439 2.646 20 5 FFBDMO COc1cc(C[N@H+](C)CC[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093481464 250035862 /nfs/dbraw/zinc/03/58/62/250035862.db2.gz RFTRAOFYHYGLFO-SNVBAGLBSA-N 1 1 366.336 2.747 20 5 FFBDMO COc1cc(C[N@@H+](C)CC[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093481464 250035865 /nfs/dbraw/zinc/03/58/65/250035865.db2.gz RFTRAOFYHYGLFO-SNVBAGLBSA-N 1 1 366.336 2.747 20 5 FFBDMO Cn1cc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093479631 250036365 /nfs/dbraw/zinc/03/63/65/250036365.db2.gz HUGQXDHQGMHRFF-RTHVDDQRSA-N 1 1 356.426 2.588 20 5 FFBDMO CCN1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000106478892 250271787 /nfs/dbraw/zinc/27/17/87/250271787.db2.gz GHHGJPCMESVXMY-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1C ZINC000106891193 250295784 /nfs/dbraw/zinc/29/57/84/250295784.db2.gz JXMMKJSWBRFXBN-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864236 250296567 /nfs/dbraw/zinc/29/65/67/250296567.db2.gz JOIYYSNVQCIDBB-ZYHUDNBSSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864236 250296569 /nfs/dbraw/zinc/29/65/69/250296569.db2.gz JOIYYSNVQCIDBB-ZYHUDNBSSA-N 1 1 360.357 2.940 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000153270333 251120777 /nfs/dbraw/zinc/12/07/77/251120777.db2.gz VEYIHSIALQBVGZ-AWEZNQCLSA-N 1 1 369.425 2.527 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000186804727 251267766 /nfs/dbraw/zinc/26/77/66/251267766.db2.gz RTJJXAZENAADGB-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)cc1SC ZINC000272625321 252084442 /nfs/dbraw/zinc/08/44/42/252084442.db2.gz APXATACKJWAVFU-LLVKDONJSA-N 1 1 365.455 2.706 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccccc2C[N@@H+]2CC[C@@H](O)C2)c(Cl)c1 ZINC000273049832 252200537 /nfs/dbraw/zinc/20/05/37/252200537.db2.gz BIDBOGLHHPOSDQ-OAHLLOKOSA-N 1 1 362.817 2.822 20 5 FFBDMO Cc1ccc(NC(=O)c2ccc(C[NH+]3CCN(C)CC3)cc2)cc1[N+](=O)[O-] ZINC000022063460 207794864 /nfs/dbraw/zinc/79/48/64/207794864.db2.gz GHWOXPOJAZVXAK-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 in-vitro FFBDMO CCOCCOCC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000276273777 256085649 /nfs/dbraw/zinc/08/56/49/256085649.db2.gz QLASNDCXKSQRJS-UHFFFAOYSA-N 1 1 363.414 2.777 20 5 FFBDMO CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C)C1 ZINC000277891995 256252060 /nfs/dbraw/zinc/25/20/60/256252060.db2.gz DLZVOGBXXXCXCE-QMMMGPOBSA-N 1 1 362.249 2.585 20 5 FFBDMO CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000277891995 256252061 /nfs/dbraw/zinc/25/20/61/256252061.db2.gz DLZVOGBXXXCXCE-QMMMGPOBSA-N 1 1 362.249 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(NCc3ccccc3C[N@@H+]3CC[C@@H](O)C3)nc2c1 ZINC000278431711 256312035 /nfs/dbraw/zinc/31/20/35/256312035.db2.gz JNRGVABUPYHPEM-MRXNPFEDSA-N 1 1 367.409 2.650 20 5 FFBDMO Cc1cc(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000278338313 256301347 /nfs/dbraw/zinc/30/13/47/256301347.db2.gz BXECYHDCBKDUAV-CQSZACIVSA-N 1 1 362.430 2.620 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279139857 256386217 /nfs/dbraw/zinc/38/62/17/256386217.db2.gz RUWGNTQPUYSACH-HNAYVOBHSA-N 1 1 360.502 2.933 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000279155638 256388058 /nfs/dbraw/zinc/38/80/58/256388058.db2.gz HRETVXSZDRPOSU-CYBMUJFWSA-N 1 1 366.437 2.650 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000278919915 256362137 /nfs/dbraw/zinc/36/21/37/256362137.db2.gz UQQGSPWFMDPBSA-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000281021871 256595409 /nfs/dbraw/zinc/59/54/09/256595409.db2.gz OLUZARIJFNLIGP-QGPMSJSTSA-N 1 1 361.442 2.939 20 5 FFBDMO C[N@@H+](CCc1nc(-c2ccccc2)no1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285880747 257009482 /nfs/dbraw/zinc/00/94/82/257009482.db2.gz JKCKREACFLNXFI-KRWDZBQOSA-N 1 1 368.393 2.853 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000286347943 257032365 /nfs/dbraw/zinc/03/23/65/257032365.db2.gz BKQTUFGDJOHLPA-UHFFFAOYSA-N 1 1 360.414 2.851 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000295144575 257618300 /nfs/dbraw/zinc/61/83/00/257618300.db2.gz BJABBNPPIFCWMI-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@H+]1CCc2sccc2C1 ZINC000301126131 258027506 /nfs/dbraw/zinc/02/75/06/258027506.db2.gz VUPUYEAVIXEKEU-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO Cc1nn(C)c(N2CCC[N@@H+](CCCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000301137719 258027818 /nfs/dbraw/zinc/02/78/18/258027818.db2.gz DBXNJJWVPRALJN-UHFFFAOYSA-N 1 1 357.458 2.782 20 5 FFBDMO CC(=O)c1ccc(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000299691002 258017509 /nfs/dbraw/zinc/01/75/09/258017509.db2.gz NKGBZJDFZMHYLP-IYBDPMFKSA-N 1 1 374.485 2.792 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000301682240 258062834 /nfs/dbraw/zinc/06/28/34/258062834.db2.gz KEGDMXKCFQAKFU-GFCCVEGCSA-N 1 1 373.251 2.521 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000301809132 258069010 /nfs/dbraw/zinc/06/90/10/258069010.db2.gz XLDOOQIXRMEPGV-OKILXGFUSA-N 1 1 368.428 2.868 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301883662 258072748 /nfs/dbraw/zinc/07/27/48/258072748.db2.gz LEINFLFTARUVAS-OKILXGFUSA-N 1 1 369.487 2.778 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(N[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)nn21 ZINC000301946210 258077324 /nfs/dbraw/zinc/07/73/24/258077324.db2.gz XKAOWWFQOFCMFT-OAHLLOKOSA-N 1 1 352.398 2.714 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1Cc1ccccc1 ZINC000301975101 258079293 /nfs/dbraw/zinc/07/92/93/258079293.db2.gz VRNZXIZBMRZTPX-DZGCQCFKSA-N 1 1 352.398 2.712 20 5 FFBDMO Cc1c(CNC(=O)[C@@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121800 258177549 /nfs/dbraw/zinc/17/75/49/258177549.db2.gz NDCWZDUMALLZAT-QWQRMKEZSA-N 1 1 363.458 2.653 20 5 FFBDMO Cc1c(CNC(=O)[C@@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121800 258177550 /nfs/dbraw/zinc/17/75/50/258177550.db2.gz NDCWZDUMALLZAT-QWQRMKEZSA-N 1 1 363.458 2.653 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000332099837 258214205 /nfs/dbraw/zinc/21/42/05/258214205.db2.gz YGUAHYJQQJGTBI-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000332238933 258220656 /nfs/dbraw/zinc/22/06/56/258220656.db2.gz OOBSNOVTJSRJRT-SUHUHFCYSA-N 1 1 355.232 2.950 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000332295273 258223643 /nfs/dbraw/zinc/22/36/43/258223643.db2.gz LYSFUHOOKXORCL-CHWSQXEVSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000332474802 258231782 /nfs/dbraw/zinc/23/17/82/258231782.db2.gz KZQJCBUARLCRDO-GXTWGEPZSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000332656359 258239414 /nfs/dbraw/zinc/23/94/14/258239414.db2.gz JQUOXJYLIIKZTB-WCQYABFASA-N 1 1 360.439 2.931 20 5 FFBDMO C[C@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000032369505 506246270 /nfs/dbraw/zinc/24/62/70/506246270.db2.gz LQMIMCKPVNLXDO-OAHLLOKOSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cnc(C)s1 ZINC000053145761 506319998 /nfs/dbraw/zinc/31/99/98/506319998.db2.gz PUUWHTOSOZTQGG-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)c(Cl)c1 ZINC000369089800 512223721 /nfs/dbraw/zinc/22/37/21/512223721.db2.gz BKZBSIKKGKOWDF-HNNXBMFYSA-N 1 1 350.806 2.917 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000377347243 512225817 /nfs/dbraw/zinc/22/58/17/512225817.db2.gz QVJKBELFWPQPOR-DYVFJYSZSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000373285941 512256351 /nfs/dbraw/zinc/25/63/51/512256351.db2.gz PWSIPULUJGREOR-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1 ZINC000039563865 506454265 /nfs/dbraw/zinc/45/42/65/506454265.db2.gz DSOBAMDIVXFLDI-UHFFFAOYSA-N 1 1 362.474 2.976 20 5 FFBDMO Cc1cc(NCC(C)(C)[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000054389534 506550370 /nfs/dbraw/zinc/55/03/70/506550370.db2.gz UWFRLLSGHBWINX-UHFFFAOYSA-N 1 1 371.441 2.883 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000375361472 512285768 /nfs/dbraw/zinc/28/57/68/512285768.db2.gz MDPDCXFMLAWLHS-SFHVURJKSA-N 1 1 369.425 2.611 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H](c1cccs1)[NH+](C)C ZINC000042157637 506604729 /nfs/dbraw/zinc/60/47/29/506604729.db2.gz ZFMFHGIJKOQODA-CYBMUJFWSA-N 1 1 369.468 2.546 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC000054686908 506604982 /nfs/dbraw/zinc/60/49/82/506604982.db2.gz ZNBBKPCIAYCFNC-UHFFFAOYSA-N 1 1 374.466 2.856 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC000054686908 506604983 /nfs/dbraw/zinc/60/49/83/506604983.db2.gz ZNBBKPCIAYCFNC-UHFFFAOYSA-N 1 1 374.466 2.856 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000043147940 506709402 /nfs/dbraw/zinc/70/94/02/506709402.db2.gz RFRCUMZHBDFSLO-INIZCTEOSA-N 1 1 364.446 2.772 20 5 FFBDMO C[N@H+](CCOc1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374711 506851259 /nfs/dbraw/zinc/85/12/59/506851259.db2.gz PLAIKAKSMWFOKV-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374711 506851262 /nfs/dbraw/zinc/85/12/62/506851262.db2.gz PLAIKAKSMWFOKV-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000067536291 506914233 /nfs/dbraw/zinc/91/42/33/506914233.db2.gz WXNBGAVNUZAVFT-KRWDZBQOSA-N 1 1 354.410 2.669 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000056460271 507020075 /nfs/dbraw/zinc/02/00/75/507020075.db2.gz NLJSOJIVJMSODI-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2cccs2)CC1 ZINC000019540243 507177323 /nfs/dbraw/zinc/17/73/23/507177323.db2.gz ZPYXPXDWEISRJB-AWEZNQCLSA-N 1 1 374.466 2.801 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000068410430 507220194 /nfs/dbraw/zinc/22/01/94/507220194.db2.gz OIRXGTDNVFQBPR-OAHLLOKOSA-N 1 1 358.442 2.930 20 5 FFBDMO CC(=O)N(C)C1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000068577019 507277818 /nfs/dbraw/zinc/27/78/18/507277818.db2.gz UYRRRDISLCPSJD-GFCCVEGCSA-N 1 1 373.413 2.649 20 5 FFBDMO C[C@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@@H+](C)C1CC1 ZINC000057705548 507311568 /nfs/dbraw/zinc/31/15/68/507311568.db2.gz UEUKNUVGWYBGAY-LLVKDONJSA-N 1 1 360.439 2.931 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000047607943 507363600 /nfs/dbraw/zinc/36/36/00/507363600.db2.gz QFFHEFZUBAQSGK-UHFFFAOYSA-N 1 1 369.421 2.708 20 5 FFBDMO CN1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000069090507 507405072 /nfs/dbraw/zinc/40/50/72/507405072.db2.gz VTPCNZQPHUWZGI-UHFFFAOYSA-N 1 1 355.394 2.913 20 5 FFBDMO CN1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2ccccc21 ZINC000069090507 507405078 /nfs/dbraw/zinc/40/50/78/507405078.db2.gz VTPCNZQPHUWZGI-UHFFFAOYSA-N 1 1 355.394 2.913 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1F)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000025252350 507478933 /nfs/dbraw/zinc/47/89/33/507478933.db2.gz GGHHCBCHVAJLJS-HNNXBMFYSA-N 1 1 352.337 2.745 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1F)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000025252350 507478936 /nfs/dbraw/zinc/47/89/36/507478936.db2.gz GGHHCBCHVAJLJS-HNNXBMFYSA-N 1 1 352.337 2.745 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)c1 ZINC000060063788 507512159 /nfs/dbraw/zinc/51/21/59/507512159.db2.gz LNEVKWVSZVLGJN-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000025699655 507524207 /nfs/dbraw/zinc/52/42/07/507524207.db2.gz WAHNRPTVLWRIOQ-KRWDZBQOSA-N 1 1 360.410 2.654 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051057497 507732557 /nfs/dbraw/zinc/73/25/57/507732557.db2.gz IJBYHRCTTGMDNE-MRXNPFEDSA-N 1 1 363.458 2.992 20 5 FFBDMO Cc1c(C[N@H+](C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000051563275 507775280 /nfs/dbraw/zinc/77/52/80/507775280.db2.gz BSAOYBYRPOSDFZ-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000064113321 507784967 /nfs/dbraw/zinc/78/49/67/507784967.db2.gz SAEJBSZWRSGASK-AWEZNQCLSA-N 1 1 371.441 2.846 20 5 FFBDMO O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1cc2ccccc2c2cccnc12 ZINC000064353925 507792328 /nfs/dbraw/zinc/79/23/28/507792328.db2.gz WRKNZRAVCLNKJA-DLBZAZTESA-N 1 1 361.445 2.981 20 5 FFBDMO Cc1ccc(NC(=O)C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000030542477 507810148 /nfs/dbraw/zinc/81/01/48/507810148.db2.gz ILXNRLWJJILVLR-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1ccc(NC(=O)C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000030542477 507810149 /nfs/dbraw/zinc/81/01/49/507810149.db2.gz ILXNRLWJJILVLR-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000031542245 507820060 /nfs/dbraw/zinc/82/00/60/507820060.db2.gz URTDOHVDQCEZLG-QGZVFWFLSA-N 1 1 369.421 2.754 20 5 FFBDMO COc1ccccc1OCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665143 507840133 /nfs/dbraw/zinc/84/01/33/507840133.db2.gz MWIJTBIKICGVKO-CQSZACIVSA-N 1 1 358.398 2.564 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072773054 507852029 /nfs/dbraw/zinc/85/20/29/507852029.db2.gz XELIKCIJYOWTNN-INIZCTEOSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072773054 507852032 /nfs/dbraw/zinc/85/20/32/507852032.db2.gz XELIKCIJYOWTNN-INIZCTEOSA-N 1 1 357.410 2.897 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1C[C@](C)(OC)C1(C)C ZINC000072897867 507870471 /nfs/dbraw/zinc/87/04/71/507870471.db2.gz QEWWTXXQSOTRQH-YJBOKZPZSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1C[C@](C)(OC)C1(C)C ZINC000072897867 507870473 /nfs/dbraw/zinc/87/04/73/507870473.db2.gz QEWWTXXQSOTRQH-YJBOKZPZSA-N 1 1 365.430 2.677 20 5 FFBDMO O=C(C[N@@H+]1CCC2(C1)CCOCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072898717 507871410 /nfs/dbraw/zinc/87/14/10/507871410.db2.gz GCJKMUUQUPVNAN-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC2(C1)CCOCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072898717 507871413 /nfs/dbraw/zinc/87/14/13/507871413.db2.gz GCJKMUUQUPVNAN-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004487 507900231 /nfs/dbraw/zinc/90/02/31/507900231.db2.gz RQFILFRXCUVBEG-CQSZACIVSA-N 1 1 372.425 2.650 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2CCc2ccccc2)c1 ZINC000090010441 507901170 /nfs/dbraw/zinc/90/11/70/507901170.db2.gz GBJGMYMBMSWLBS-MJGOQNOKSA-N 1 1 358.442 2.640 20 5 FFBDMO C[C@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000090091925 507908151 /nfs/dbraw/zinc/90/81/51/507908151.db2.gz LPBNXAGRTLMXIJ-OAHLLOKOSA-N 1 1 355.442 2.705 20 5 FFBDMO O=C(C[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O)c1cccs1 ZINC000090559311 507927448 /nfs/dbraw/zinc/92/74/48/507927448.db2.gz SYDDCQVQUXFVAH-ZDUSSCGKSA-N 1 1 361.423 2.555 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000073989080 507974471 /nfs/dbraw/zinc/97/44/71/507974471.db2.gz VKJJMSKEPQOCHM-JKSUJKDBSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000079576818 507977526 /nfs/dbraw/zinc/97/75/26/507977526.db2.gz GDOBPJMYXDZAPA-INIZCTEOSA-N 1 1 362.474 2.802 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000091458746 507987450 /nfs/dbraw/zinc/98/74/50/507987450.db2.gz OQVKRXRFVXMQGB-FRRDWIJNSA-N 1 1 362.430 2.704 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)CCn2cc([N+](=O)[O-])nc2C)C1 ZINC000109966509 507998181 /nfs/dbraw/zinc/99/81/81/507998181.db2.gz OIGAYEISWJSYLK-OAHLLOKOSA-N 1 1 365.478 2.507 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000079895839 508012459 /nfs/dbraw/zinc/01/24/59/508012459.db2.gz JOEQUXMVQAMLIU-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO CCCC[N@H+](CC(N)=O)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000091950396 508026997 /nfs/dbraw/zinc/02/69/97/508026997.db2.gz WTMMDENUYYBFPN-UHFFFAOYSA-N 1 1 361.398 2.951 20 5 FFBDMO CCCC[N@@H+](CC(N)=O)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000091950396 508026999 /nfs/dbraw/zinc/02/69/99/508026999.db2.gz WTMMDENUYYBFPN-UHFFFAOYSA-N 1 1 361.398 2.951 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(N4CCCC4)nc3)CC2)c1 ZINC000092047893 508037696 /nfs/dbraw/zinc/03/76/96/508037696.db2.gz IWGOHYOBMBDZJQ-UHFFFAOYSA-N 1 1 367.453 2.912 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C2 ZINC000080718117 508097630 /nfs/dbraw/zinc/09/76/30/508097630.db2.gz HWKGGLPOBUIUMW-ZNXRZULTSA-N 1 1 360.458 2.918 20 5 FFBDMO CCc1nn(C)c(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000092827661 508103430 /nfs/dbraw/zinc/10/34/30/508103430.db2.gz HVXCPJRJLFOXBJ-UHFFFAOYSA-N 1 1 361.421 2.742 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ccc([N+](=O)[O-])nc2)[C@H](c2ccccc2)C1 ZINC000075667779 508126520 /nfs/dbraw/zinc/12/65/20/508126520.db2.gz WKWAJUDDIXPOLG-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2ccc([N+](=O)[O-])nc2)[C@H](c2ccccc2)C1 ZINC000075667779 508126524 /nfs/dbraw/zinc/12/65/24/508126524.db2.gz WKWAJUDDIXPOLG-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ccc([N+](=O)[O-])nc2)[C@H](c2ccccc2)C1 ZINC000075667779 508126528 /nfs/dbraw/zinc/12/65/28/508126528.db2.gz WKWAJUDDIXPOLG-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)CCCO)ccc1Oc1ccc(F)cc1 ZINC000093324067 508139425 /nfs/dbraw/zinc/13/94/25/508139425.db2.gz IDASRGBPLNJZDF-UHFFFAOYSA-N 1 1 364.373 2.703 20 5 FFBDMO CCc1nn(C)c(CC)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534951 508148250 /nfs/dbraw/zinc/14/82/50/508148250.db2.gz TUAPCIQZFUUDQX-ZDUSSCGKSA-N 1 1 358.446 2.535 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1OC ZINC000093534594 508148589 /nfs/dbraw/zinc/14/85/89/508148589.db2.gz MPXBSXGTIZUYGG-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO CCC[N@H+](C)C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000081570823 508191466 /nfs/dbraw/zinc/19/14/66/508191466.db2.gz PTCDCWXPRKVSCW-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000081570823 508191470 /nfs/dbraw/zinc/19/14/70/508191470.db2.gz PTCDCWXPRKVSCW-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCO)CCc3ccccc3)o2)cc1 ZINC000112731472 508216477 /nfs/dbraw/zinc/21/64/77/508216477.db2.gz PJNXJVZYYAWVGH-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCO)CCc3ccccc3)o2)cc1 ZINC000112731472 508216481 /nfs/dbraw/zinc/21/64/81/508216481.db2.gz PJNXJVZYYAWVGH-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000097152727 508219978 /nfs/dbraw/zinc/21/99/78/508219978.db2.gz DWXOYQCDNSFYKX-GFCCVEGCSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000097152727 508219981 /nfs/dbraw/zinc/21/99/81/508219981.db2.gz DWXOYQCDNSFYKX-GFCCVEGCSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000097152727 508219983 /nfs/dbraw/zinc/21/99/83/508219983.db2.gz DWXOYQCDNSFYKX-GFCCVEGCSA-N 1 1 359.430 2.711 20 5 FFBDMO CCOC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])C1 ZINC000113939730 508287221 /nfs/dbraw/zinc/28/72/21/508287221.db2.gz NSFIJHVXFYMJFW-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])C1 ZINC000113939730 508287224 /nfs/dbraw/zinc/28/72/24/508287224.db2.gz NSFIJHVXFYMJFW-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CCc1ccc(C(=O)NCCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000085457641 508309649 /nfs/dbraw/zinc/30/96/49/508309649.db2.gz LXUVWFSXHJEKAM-GASCZTMLSA-N 1 1 363.458 2.776 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000103605666 508318923 /nfs/dbraw/zinc/31/89/23/508318923.db2.gz VAFARXHKTGBACI-INIZCTEOSA-N 1 1 360.458 2.999 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000115274691 508380487 /nfs/dbraw/zinc/38/04/87/508380487.db2.gz SIQAKKVFOIKCFY-PBHICJAKSA-N 1 1 363.458 2.770 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ncccc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000088751358 508381593 /nfs/dbraw/zinc/38/15/93/508381593.db2.gz SPAXHJKSNWQSRM-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152280872 508414837 /nfs/dbraw/zinc/41/48/37/508414837.db2.gz KBNAVHRAMPMIFJ-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152280872 508414841 /nfs/dbraw/zinc/41/48/41/508414841.db2.gz KBNAVHRAMPMIFJ-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152280872 508414845 /nfs/dbraw/zinc/41/48/45/508414845.db2.gz KBNAVHRAMPMIFJ-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@@H]1C ZINC000133563815 508417448 /nfs/dbraw/zinc/41/74/48/508417448.db2.gz CIMDWRUNRRLFTO-UONOGXRCSA-N 1 1 351.447 2.663 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)c1 ZINC000152454515 508450228 /nfs/dbraw/zinc/45/02/28/508450228.db2.gz NNPNIXXICKMANO-CQSZACIVSA-N 1 1 357.414 2.780 20 5 FFBDMO CC[C@@H](O)C[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000134489070 508539078 /nfs/dbraw/zinc/53/90/78/508539078.db2.gz TYGKUEBRRWTRRZ-LJQANCHMSA-N 1 1 371.437 2.831 20 5 FFBDMO CC[C@@H](O)C[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000134489070 508539081 /nfs/dbraw/zinc/53/90/81/508539081.db2.gz TYGKUEBRRWTRRZ-LJQANCHMSA-N 1 1 371.437 2.831 20 5 FFBDMO NC(=O)N1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000153585291 508603328 /nfs/dbraw/zinc/60/33/28/508603328.db2.gz IOYQWGVGRBYPNV-UHFFFAOYSA-N 1 1 351.406 2.533 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000123243238 508657689 /nfs/dbraw/zinc/65/76/89/508657689.db2.gz BMXDLNQRETZZKX-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO Cc1ccc(CN2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)cc1[N+](=O)[O-] ZINC000377705561 512410083 /nfs/dbraw/zinc/41/00/83/512410083.db2.gz XOJINNRIFGPUNO-DFNIBXOVSA-N 1 1 358.486 2.646 20 5 FFBDMO Cc1nc2ccccn2c1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000158499468 508713194 /nfs/dbraw/zinc/71/31/94/508713194.db2.gz ACYHTBFRRDXFCW-UHFFFAOYSA-N 1 1 351.410 2.873 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158595958 508725792 /nfs/dbraw/zinc/72/57/92/508725792.db2.gz JHXHZGVBCWSGJM-QGZVFWFLSA-N 1 1 362.474 2.949 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000158875316 508762793 /nfs/dbraw/zinc/76/27/93/508762793.db2.gz VJUYVTMPZAHNPO-UHFFFAOYSA-N 1 1 353.382 2.810 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCOC2(CCCC2)C1 ZINC000139697981 508793377 /nfs/dbraw/zinc/79/33/77/508793377.db2.gz BILQWNRELNXJPI-UHFFFAOYSA-N 1 1 361.398 2.538 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1csc(C)n1 ZINC000130168845 508801156 /nfs/dbraw/zinc/80/11/56/508801156.db2.gz UAJALEKWVBXMKX-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1csc(C)n1 ZINC000130168845 508801160 /nfs/dbraw/zinc/80/11/60/508801160.db2.gz UAJALEKWVBXMKX-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccnc(N2CCN(C)CC2)c1 ZINC000159165013 508801975 /nfs/dbraw/zinc/80/19/75/508801975.db2.gz WKSHBCDVIIPHOZ-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cnc4cnccn34)CC2)cc1 ZINC000130726642 508836825 /nfs/dbraw/zinc/83/68/25/508836825.db2.gz KKKZIYJQBXTBFE-UHFFFAOYSA-N 1 1 353.382 2.681 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000119676056 508841636 /nfs/dbraw/zinc/84/16/36/508841636.db2.gz UHDZPNVVUZGSRP-ZDUSSCGKSA-N 1 1 364.402 2.519 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000119823170 508869818 /nfs/dbraw/zinc/86/98/18/508869818.db2.gz VYTHWQZPTUEXAG-UHFFFAOYSA-N 1 1 364.446 2.522 20 5 FFBDMO Cn1cc(C[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000154969040 508894461 /nfs/dbraw/zinc/89/44/61/508894461.db2.gz HKUHHBSPNCGQIR-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000154969040 508894465 /nfs/dbraw/zinc/89/44/65/508894465.db2.gz HKUHHBSPNCGQIR-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](OCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000120075772 508923430 /nfs/dbraw/zinc/92/34/30/508923430.db2.gz PBXCENYUNPKSMB-HNNXBMFYSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1cccc(N2CCC(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)[nH+]1 ZINC000155239323 508955528 /nfs/dbraw/zinc/95/55/28/508955528.db2.gz OSPPORTWZAJJME-UHFFFAOYSA-N 1 1 372.400 2.765 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000131649298 508957043 /nfs/dbraw/zinc/95/70/43/508957043.db2.gz SQQBNEXGGBDPAG-AWEZNQCLSA-N 1 1 351.422 2.905 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000155284975 508966513 /nfs/dbraw/zinc/96/65/13/508966513.db2.gz VATHLDJGPPGPSZ-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cn1cc(C[N@H+](C)CCOc2ccccc2[N+](=O)[O-])c(C(F)(F)F)n1 ZINC000155332545 508978870 /nfs/dbraw/zinc/97/88/70/508978870.db2.gz QEDHOKKEZIEFSY-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])c(C(F)(F)F)n1 ZINC000155332545 508978873 /nfs/dbraw/zinc/97/88/73/508978873.db2.gz QEDHOKKEZIEFSY-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000155480676 509009652 /nfs/dbraw/zinc/00/96/52/509009652.db2.gz GNXDJCMMWUPCKO-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000155480676 509009654 /nfs/dbraw/zinc/00/96/54/509009654.db2.gz GNXDJCMMWUPCKO-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO Cc1cccc2[nH+]c(Cn3cc(Br)c(=O)c([N+](=O)[O-])c3)cn21 ZINC000132381461 509023318 /nfs/dbraw/zinc/02/33/18/509023318.db2.gz GBLMKTFWXREZCT-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000125778020 509028649 /nfs/dbraw/zinc/02/86/49/509028649.db2.gz ZSRHHPPTLJVTLW-HNNXBMFYSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185480250 509197121 /nfs/dbraw/zinc/19/71/21/509197121.db2.gz WWIBQHSQARPZAN-CQSZACIVSA-N 1 1 353.382 2.905 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[NH+](CCC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000217214706 509268193 /nfs/dbraw/zinc/26/81/93/509268193.db2.gz LIKXJSLJNZCHBH-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000162973141 509325996 /nfs/dbraw/zinc/32/59/96/509325996.db2.gz AYXOYYYVYTUQIH-GFCCVEGCSA-N 1 1 370.247 2.880 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000248447715 509326234 /nfs/dbraw/zinc/32/62/34/509326234.db2.gz HKDMMOJWTYNQEY-CVEARBPZSA-N 1 1 352.431 2.616 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248476036 509337887 /nfs/dbraw/zinc/33/78/87/509337887.db2.gz YBCGXCRPLKEUMI-RHSMWYFYSA-N 1 1 360.410 2.603 20 5 FFBDMO CN(C)c1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc[nH+]1 ZINC000267125834 509355440 /nfs/dbraw/zinc/35/54/40/509355440.db2.gz BHHQQRBXPWQITB-UHFFFAOYSA-N 1 1 369.425 2.911 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000248604803 509386143 /nfs/dbraw/zinc/38/61/43/509386143.db2.gz FCOBEKFUDLGRNR-IAQYHMDHSA-N 1 1 354.838 2.776 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192182543 509391826 /nfs/dbraw/zinc/39/18/26/509391826.db2.gz IURMUFVGYSUBAH-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192182543 509391831 /nfs/dbraw/zinc/39/18/31/509391831.db2.gz IURMUFVGYSUBAH-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO C[C@H]1C[C@@H]([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CCN1Cc1ccccc1 ZINC000176251037 509402669 /nfs/dbraw/zinc/40/26/69/509402669.db2.gz KBFZPODSEAHQJZ-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@@H+]1Cc1ccccc1 ZINC000176251037 509402674 /nfs/dbraw/zinc/40/26/74/509402674.db2.gz KBFZPODSEAHQJZ-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176251037 509402679 /nfs/dbraw/zinc/40/26/79/509402679.db2.gz KBFZPODSEAHQJZ-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000227347187 509408946 /nfs/dbraw/zinc/40/89/46/509408946.db2.gz JRMUEUOWXNDUTD-ZYHUDNBSSA-N 1 1 355.236 2.673 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000264281395 509432081 /nfs/dbraw/zinc/43/20/81/509432081.db2.gz IHQJSKYTKCQPNL-SFHVURJKSA-N 1 1 367.449 2.818 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186013107 509479871 /nfs/dbraw/zinc/47/98/71/509479871.db2.gz NRTMMNYWPMHBNV-CQSZACIVSA-N 1 1 354.838 2.874 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3c[nH]nc3-c3cccnc3)CC2)cc1 ZINC000179534954 509499045 /nfs/dbraw/zinc/49/90/45/509499045.db2.gz RLEIOPOLTCUPFI-UHFFFAOYSA-N 1 1 364.409 2.702 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000189288364 509502701 /nfs/dbraw/zinc/50/27/01/509502701.db2.gz XBLIGQMGIPELRZ-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000267506273 509521881 /nfs/dbraw/zinc/52/18/81/509521881.db2.gz XBGJDJBCOJXZRY-UHFFFAOYSA-N 1 1 368.231 2.525 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183018787 509550376 /nfs/dbraw/zinc/55/03/76/509550376.db2.gz OKONZCAESCBHFO-NWDGAFQWSA-N 1 1 373.500 2.588 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000165698178 509581516 /nfs/dbraw/zinc/58/15/16/509581516.db2.gz UYCFNYULFVNXQG-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+]C2(c3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC000179705104 509582078 /nfs/dbraw/zinc/58/20/78/509582078.db2.gz BUZKDBFMPRZNDW-UHFFFAOYSA-N 1 1 359.357 2.960 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2N)c1 ZINC000176598984 509604426 /nfs/dbraw/zinc/60/44/26/509604426.db2.gz QLYHCIPPLIOKTD-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000173486361 509629791 /nfs/dbraw/zinc/62/97/91/509629791.db2.gz PUGYNSUYNXMENU-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2ccccc2)c([N+](=O)[O-])c1 ZINC000173486361 509629797 /nfs/dbraw/zinc/62/97/97/509629797.db2.gz PUGYNSUYNXMENU-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO CC[N@H+](Cc1ccncc1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000267930966 509675828 /nfs/dbraw/zinc/67/58/28/509675828.db2.gz SGTFTBAIUQIWHJ-CYBMUJFWSA-N 1 1 358.398 2.848 20 5 FFBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000267930966 509675836 /nfs/dbraw/zinc/67/58/36/509675836.db2.gz SGTFTBAIUQIWHJ-CYBMUJFWSA-N 1 1 358.398 2.848 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccco1 ZINC000179947318 509684771 /nfs/dbraw/zinc/68/47/71/509684771.db2.gz ZBBZYSWMCYDTCS-LBPRGKRZSA-N 1 1 369.324 2.822 20 5 FFBDMO CC(=O)Nc1cccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000170643419 509693170 /nfs/dbraw/zinc/69/31/70/509693170.db2.gz RYXRZEDAWBSTLB-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C[C@@H](C)O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000170691376 509724057 /nfs/dbraw/zinc/72/40/57/509724057.db2.gz UJPZFAOQZTVLRV-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000249689501 509736318 /nfs/dbraw/zinc/73/63/18/509736318.db2.gz WMGFXUMCOKJTJF-ZIAGYGMSSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000249689501 509736322 /nfs/dbraw/zinc/73/63/22/509736322.db2.gz WMGFXUMCOKJTJF-ZIAGYGMSSA-N 1 1 357.414 2.833 20 5 FFBDMO O=C(NC1CC1)c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000264973414 509804285 /nfs/dbraw/zinc/80/42/85/509804285.db2.gz ZIZINFRLGPCDNB-UHFFFAOYSA-N 1 1 355.398 2.594 20 5 FFBDMO CC(C)(O)C[N@H+](Cc1ccccc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000180222881 509819948 /nfs/dbraw/zinc/81/99/48/509819948.db2.gz VFVFQJFBWNZQPN-SFHVURJKSA-N 1 1 374.437 2.608 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000268233137 509827863 /nfs/dbraw/zinc/82/78/63/509827863.db2.gz FLQSZRGTUFYLFE-UHFFFAOYSA-N 1 1 352.387 2.625 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000268233137 509827866 /nfs/dbraw/zinc/82/78/66/509827866.db2.gz FLQSZRGTUFYLFE-UHFFFAOYSA-N 1 1 352.387 2.625 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183556283 509860079 /nfs/dbraw/zinc/86/00/79/509860079.db2.gz WWVGTGUZDJZHOS-CQSZACIVSA-N 1 1 355.398 2.728 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183556283 509860088 /nfs/dbraw/zinc/86/00/88/509860088.db2.gz WWVGTGUZDJZHOS-CQSZACIVSA-N 1 1 355.398 2.728 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000268325484 509871701 /nfs/dbraw/zinc/87/17/01/509871701.db2.gz CYJRBWPMICGMLE-HNNXBMFYSA-N 1 1 358.442 2.644 20 5 FFBDMO COc1ccc(OCCN(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000173960814 509877084 /nfs/dbraw/zinc/87/70/84/509877084.db2.gz PKRCKLITJPSWBS-HNNXBMFYSA-N 1 1 351.447 2.788 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000190043645 509904560 /nfs/dbraw/zinc/90/45/60/509904560.db2.gz IQWVIMZWOJRYLA-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000245436445 509934095 /nfs/dbraw/zinc/93/40/95/509934095.db2.gz QZEDUSYWWSDMSM-YJBOKZPZSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000245436445 509934101 /nfs/dbraw/zinc/93/41/01/509934101.db2.gz QZEDUSYWWSDMSM-YJBOKZPZSA-N 1 1 362.474 2.894 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1 ZINC000193497228 509940678 /nfs/dbraw/zinc/94/06/78/509940678.db2.gz ZSSNEKFWCSQDHE-QGZVFWFLSA-N 1 1 356.426 2.746 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000193529144 509951275 /nfs/dbraw/zinc/95/12/75/509951275.db2.gz JKXKBQSKOUNXET-QGZVFWFLSA-N 1 1 356.426 2.880 20 5 FFBDMO C[N@H+](Cc1cc(F)c(F)c(F)c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000180496321 509955733 /nfs/dbraw/zinc/95/57/33/509955733.db2.gz DCOBDPGQJLXJGA-ZDUSSCGKSA-N 1 1 370.327 2.884 20 5 FFBDMO Cc1cc([C@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000183807039 509985124 /nfs/dbraw/zinc/98/51/24/509985124.db2.gz SDVKYBDDHVCVSJ-LBPRGKRZSA-N 1 1 352.412 2.929 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177310797 509991140 /nfs/dbraw/zinc/99/11/40/509991140.db2.gz LIEVTYMMPVSODD-ZBFHGGJFSA-N 1 1 357.414 2.703 20 5 FFBDMO CC(C)CCNC(=O)[C@@H](C)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174243815 510022389 /nfs/dbraw/zinc/02/23/89/510022389.db2.gz UDDLXGUJRNHEEE-OAHLLOKOSA-N 1 1 363.458 2.989 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000245687239 510085124 /nfs/dbraw/zinc/08/51/24/510085124.db2.gz AJYAHHVFNQUKTA-XJKSGUPXSA-N 1 1 360.414 2.892 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000245687239 510085132 /nfs/dbraw/zinc/08/51/32/510085132.db2.gz AJYAHHVFNQUKTA-XJKSGUPXSA-N 1 1 360.414 2.892 20 5 FFBDMO C[C@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180831078 510134270 /nfs/dbraw/zinc/13/42/70/510134270.db2.gz OVXVTKDMEQYJNR-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803147 510151311 /nfs/dbraw/zinc/15/13/11/510151311.db2.gz YBZOQNDGQFZZMT-DZGCQCFKSA-N 1 1 351.447 2.774 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000262054111 510161670 /nfs/dbraw/zinc/16/16/70/510161670.db2.gz VGYAYGMEZYFEDQ-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000171619001 510256315 /nfs/dbraw/zinc/25/63/15/510256315.db2.gz ZOJKIJLUEKZGNC-OAHLLOKOSA-N 1 1 371.441 2.781 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000171624077 510259039 /nfs/dbraw/zinc/25/90/39/510259039.db2.gz IUFXJQMITGXZMN-ZDUSSCGKSA-N 1 1 357.414 2.521 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC000246079808 510280016 /nfs/dbraw/zinc/28/00/16/510280016.db2.gz FCCWKYZBYJTYPT-HYVNUMGLSA-N 1 1 352.456 2.695 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000184361209 510285056 /nfs/dbraw/zinc/28/50/56/510285056.db2.gz WTIXWSOKBXSSFG-KRWDZBQOSA-N 1 1 371.441 2.657 20 5 FFBDMO CC[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000184385765 510296832 /nfs/dbraw/zinc/29/68/32/510296832.db2.gz QNEDNPJUTIDAGS-AWEZNQCLSA-N 1 1 369.468 2.874 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000174996786 510427441 /nfs/dbraw/zinc/42/74/41/510427441.db2.gz FVOMDHJWBZCQQZ-HZPDHXFCSA-N 1 1 358.442 2.868 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000181621222 510505354 /nfs/dbraw/zinc/50/53/54/510505354.db2.gz RTVOSMSRZOJJHM-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000181621222 510505360 /nfs/dbraw/zinc/50/53/60/510505360.db2.gz RTVOSMSRZOJJHM-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO O=C(CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475031 510510957 /nfs/dbraw/zinc/51/09/57/510510957.db2.gz GEZRZMHTPNXOPD-MAUKXSAKSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475031 510511003 /nfs/dbraw/zinc/51/10/03/510511003.db2.gz GEZRZMHTPNXOPD-MAUKXSAKSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475031 510511011 /nfs/dbraw/zinc/51/10/11/510511011.db2.gz GEZRZMHTPNXOPD-MAUKXSAKSA-N 1 1 372.469 2.872 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000175164497 510513175 /nfs/dbraw/zinc/51/31/75/510513175.db2.gz PYBDFRVHWILZBW-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)cc([N+](=O)[O-])c1C ZINC000188057204 510571388 /nfs/dbraw/zinc/57/13/88/510571388.db2.gz DWBNJTMQBVLMAT-UHFFFAOYSA-N 1 1 369.421 2.700 20 5 FFBDMO COc1cc(C(=O)NCC[N@H+]2CCc3ccccc3C2)cc([N+](=O)[O-])c1C ZINC000188057204 510571395 /nfs/dbraw/zinc/57/13/95/510571395.db2.gz DWBNJTMQBVLMAT-UHFFFAOYSA-N 1 1 369.421 2.700 20 5 FFBDMO C[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000181884141 510639966 /nfs/dbraw/zinc/63/99/66/510639966.db2.gz ADNWJXGLHOOMJL-SFHVURJKSA-N 1 1 374.462 2.858 20 5 FFBDMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000181884141 510639975 /nfs/dbraw/zinc/63/99/75/510639975.db2.gz ADNWJXGLHOOMJL-SFHVURJKSA-N 1 1 374.462 2.858 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931888 510666261 /nfs/dbraw/zinc/66/62/61/510666261.db2.gz PFQSUCAYYYMJLK-LSDHHAIUSA-N 1 1 372.512 2.975 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931888 510666264 /nfs/dbraw/zinc/66/62/64/510666264.db2.gz PFQSUCAYYYMJLK-LSDHHAIUSA-N 1 1 372.512 2.975 20 5 FFBDMO COC[C@@H](Cc1ccccc1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191486266 510683055 /nfs/dbraw/zinc/68/30/55/510683055.db2.gz WRYGWVXHEQLUFQ-MRXNPFEDSA-N 1 1 357.410 2.723 20 5 FFBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191486266 510683062 /nfs/dbraw/zinc/68/30/62/510683062.db2.gz WRYGWVXHEQLUFQ-MRXNPFEDSA-N 1 1 357.410 2.723 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])cc1O ZINC000270126561 510685831 /nfs/dbraw/zinc/68/58/31/510685831.db2.gz PAIZAILWGXYXKP-SSINHNECSA-N 1 1 364.423 2.897 20 5 FFBDMO CCC1(CC)C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[S@@]1=O ZINC000185236649 510764810 /nfs/dbraw/zinc/76/48/10/510764810.db2.gz CGVDCSOGFSVKKM-VWLOTQADSA-N 1 1 367.471 2.547 20 5 FFBDMO CCC1(CC)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[S@@]1=O ZINC000185236649 510764817 /nfs/dbraw/zinc/76/48/17/510764817.db2.gz CGVDCSOGFSVKKM-VWLOTQADSA-N 1 1 367.471 2.547 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000191657765 510775793 /nfs/dbraw/zinc/77/57/93/510775793.db2.gz GNAZTXOIZJDIJB-LBPRGKRZSA-N 1 1 368.397 2.796 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000182146717 510780878 /nfs/dbraw/zinc/78/08/78/510780878.db2.gz VMXLGUQQEITABK-WDEREUQCSA-N 1 1 357.357 2.751 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCC[N@H+](C3CCCC3)CC2)c2c(c1)COCO2 ZINC000172583258 510803802 /nfs/dbraw/zinc/80/38/02/510803802.db2.gz LBTGWXDUDQRLEQ-UHFFFAOYSA-N 1 1 361.442 2.912 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248049 510832746 /nfs/dbraw/zinc/83/27/46/510832746.db2.gz XRIQBWMFKKWUMI-CZUORRHYSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248049 510832749 /nfs/dbraw/zinc/83/27/49/510832749.db2.gz XRIQBWMFKKWUMI-CZUORRHYSA-N 1 1 364.833 2.927 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000247440229 510860949 /nfs/dbraw/zinc/86/09/49/510860949.db2.gz WRKFBIYPXKWIRK-DLBZAZTESA-N 1 1 372.469 2.751 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000364631364 510982644 /nfs/dbraw/zinc/98/26/44/510982644.db2.gz OKAIYIUKYGUQPN-LBPRGKRZSA-N 1 1 373.413 2.533 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282498670 511001503 /nfs/dbraw/zinc/00/15/03/511001503.db2.gz QQLSVYKNYGTUNH-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000282498670 511001507 /nfs/dbraw/zinc/00/15/07/511001507.db2.gz QQLSVYKNYGTUNH-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)c1 ZINC000270841047 511002731 /nfs/dbraw/zinc/00/27/31/511002731.db2.gz FDPKQXOFYAPHMT-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCC[C@H](N3CCCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000365049674 511227241 /nfs/dbraw/zinc/22/72/41/511227241.db2.gz XGKHYRFUJUDMLR-INIZCTEOSA-N 1 1 361.442 2.970 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](N3CCCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000365049674 511227248 /nfs/dbraw/zinc/22/72/48/511227248.db2.gz XGKHYRFUJUDMLR-INIZCTEOSA-N 1 1 361.442 2.970 20 5 FFBDMO CC(C)(CCC(=O)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[N+](=O)[O-] ZINC000295305933 511357532 /nfs/dbraw/zinc/35/75/32/511357532.db2.gz ONLVNRJWGXOUBH-HXUWFJFHSA-N 1 1 359.470 2.947 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280257418 511395875 /nfs/dbraw/zinc/39/58/75/511395875.db2.gz TXSFNSYXBIRWLQ-JTQLQIEISA-N 1 1 368.796 2.887 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000291975656 511413919 /nfs/dbraw/zinc/41/39/19/511413919.db2.gz YEFJODWDSSQEFR-DZGCQCFKSA-N 1 1 371.441 2.663 20 5 FFBDMO Cc1cccc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000280672601 511557546 /nfs/dbraw/zinc/55/75/46/511557546.db2.gz UIHYPRIOVIOENP-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)C2)C1 ZINC000292437247 511596782 /nfs/dbraw/zinc/59/67/82/511596782.db2.gz WPVOPACLBMFAHN-SFHVURJKSA-N 1 1 372.450 2.886 20 5 FFBDMO C[N@@H+](CCc1cnccn1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000273760163 511600094 /nfs/dbraw/zinc/60/00/94/511600094.db2.gz OVLWMKTYZMRBRT-UHFFFAOYSA-N 1 1 351.204 2.822 20 5 FFBDMO O=c1[nH]c2ccccc2cc1C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000296102061 511620261 /nfs/dbraw/zinc/62/02/61/511620261.db2.gz UFKOZNSGANVVAR-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO C[C@H](c1ccc(N)c([N+](=O)[O-])c1)[N@@H+]1C[C@H]2C[C@H](Cn3c2cccc3=O)C1 ZINC000296399729 511727809 /nfs/dbraw/zinc/72/78/09/511727809.db2.gz KKQHSWASCULCNG-VNHYZAJKSA-N 1 1 354.410 2.519 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000274326637 511795108 /nfs/dbraw/zinc/79/51/08/511795108.db2.gz YUTFYRKOGVUFPL-DZGCQCFKSA-N 1 1 371.441 2.692 20 5 FFBDMO CCOc1ccc(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350381689 511797264 /nfs/dbraw/zinc/79/72/64/511797264.db2.gz FEUGGKRVAUTMBJ-MAUKXSAKSA-N 1 1 374.397 2.969 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000363937943 511861669 /nfs/dbraw/zinc/86/16/69/511861669.db2.gz MBFDZUJDXOUODW-HOTGVXAUSA-N 1 1 372.469 2.942 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000326955686 511866228 /nfs/dbraw/zinc/86/62/28/511866228.db2.gz PCWBEQIEJAONSJ-CQSZACIVSA-N 1 1 367.833 2.575 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000284857416 511901571 /nfs/dbraw/zinc/90/15/71/511901571.db2.gz RVQVVTREFMEGQZ-DOTOQJQBSA-N 1 1 363.414 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](Cc4cscn4)CC3)nc2c1 ZINC000274835567 511958861 /nfs/dbraw/zinc/95/88/61/511958861.db2.gz NITFOPPOWCVYDS-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4cscn4)CC3)nc2c1 ZINC000274835567 511958864 /nfs/dbraw/zinc/95/88/64/511958864.db2.gz NITFOPPOWCVYDS-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO O=C1NCCN1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293564741 512010823 /nfs/dbraw/zinc/01/08/23/512010823.db2.gz SEDPRTISLCZGEU-UHFFFAOYSA-N 1 1 372.347 2.603 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000366478929 512045171 /nfs/dbraw/zinc/04/51/71/512045171.db2.gz FURRPZNGEFAKSK-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000366478929 512045173 /nfs/dbraw/zinc/04/51/73/512045173.db2.gz FURRPZNGEFAKSK-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1SC ZINC000297186401 512052373 /nfs/dbraw/zinc/05/23/73/512052373.db2.gz XKTGDVZQGANABE-YOGCLGLASA-N 1 1 365.455 2.680 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](c3nccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890443 512500523 /nfs/dbraw/zinc/50/05/23/512500523.db2.gz VHFLFAAHJNITDD-HNNXBMFYSA-N 1 1 366.425 2.718 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](c4ccncn4)C3)n2)c1 ZINC000373939080 512582762 /nfs/dbraw/zinc/58/27/62/512582762.db2.gz QIFULFJWELMLQS-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](c4ccncn4)C3)n2)c1 ZINC000373939080 512582766 /nfs/dbraw/zinc/58/27/66/512582766.db2.gz QIFULFJWELMLQS-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000411332394 512584368 /nfs/dbraw/zinc/58/43/68/512584368.db2.gz VQYFCIKVOGZBCZ-VQTJNVASSA-N 1 1 365.433 2.873 20 5 FFBDMO Cc1ccnc(C2CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)n1 ZINC000376297410 512755241 /nfs/dbraw/zinc/75/52/41/512755241.db2.gz ZSXDXZCPHHGOCQ-UHFFFAOYSA-N 1 1 370.409 2.939 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC[NH2+]2)cc1 ZINC000374320361 512764823 /nfs/dbraw/zinc/76/48/23/512764823.db2.gz IDSHNRBVUXYSFG-SFHVURJKSA-N 1 1 354.410 2.647 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H](c3[nH+]ccn3C)C2)cc1Cl ZINC000374354475 512785139 /nfs/dbraw/zinc/78/51/39/512785139.db2.gz UKWSSELWIFFHKY-JTQLQIEISA-N 1 1 364.789 2.762 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376365523 512787017 /nfs/dbraw/zinc/78/70/17/512787017.db2.gz FKMXQSDDYUWZIB-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000372296210 512802141 /nfs/dbraw/zinc/80/21/41/512802141.db2.gz CYSIPBJOWCAPHK-OAHLLOKOSA-N 1 1 354.366 2.524 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000372296210 512802147 /nfs/dbraw/zinc/80/21/47/512802147.db2.gz CYSIPBJOWCAPHK-OAHLLOKOSA-N 1 1 354.366 2.524 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000378539156 512814092 /nfs/dbraw/zinc/81/40/92/512814092.db2.gz NZXWIFBBNGNODD-OAHLLOKOSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)CC2 ZINC000368190641 512839059 /nfs/dbraw/zinc/83/90/59/512839059.db2.gz WIFLABGJVJVLON-UHFFFAOYSA-N 1 1 356.426 2.705 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)nc1 ZINC000368345339 512907929 /nfs/dbraw/zinc/90/79/29/512907929.db2.gz TTXQAASTQKCYQY-LJQANCHMSA-N 1 1 353.426 2.877 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](N3CCCC3=O)CC2)c([N+](=O)[O-])cc1F ZINC000412057501 512935587 /nfs/dbraw/zinc/93/55/87/512935587.db2.gz RDYROJHKSFWRIB-CQSZACIVSA-N 1 1 365.405 2.719 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](N3CCCC3=O)CC2)c([N+](=O)[O-])cc1F ZINC000412057501 512935589 /nfs/dbraw/zinc/93/55/89/512935589.db2.gz RDYROJHKSFWRIB-CQSZACIVSA-N 1 1 365.405 2.719 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H]3CCCC[C@@]32c2ccccc2)c1 ZINC000370706821 513063110 /nfs/dbraw/zinc/06/31/10/513063110.db2.gz FVDFXYLXHBDWBE-BHIYHBOVSA-N 1 1 356.426 2.554 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450322600 513143473 /nfs/dbraw/zinc/14/34/73/513143473.db2.gz ARPCCOFAPDKLHT-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO Cc1nn(C)c(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000428669511 513159429 /nfs/dbraw/zinc/15/94/29/513159429.db2.gz WDYGHKQJBZWORM-HNNXBMFYSA-N 1 1 361.471 2.666 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000450373736 513165253 /nfs/dbraw/zinc/16/52/53/513165253.db2.gz AVBDRCJMIOTTIK-UHFFFAOYSA-N 1 1 359.426 2.645 20 5 FFBDMO CN(C)C(=O)c1ccccc1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000417733341 513185113 /nfs/dbraw/zinc/18/51/13/513185113.db2.gz PZMAUZMAENPZDJ-UHFFFAOYSA-N 1 1 368.437 2.619 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412695147 513228529 /nfs/dbraw/zinc/22/85/29/513228529.db2.gz IOZFMMSANPIRFE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412695147 513228536 /nfs/dbraw/zinc/22/85/36/513228536.db2.gz IOZFMMSANPIRFE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000412700781 513231515 /nfs/dbraw/zinc/23/15/15/513231515.db2.gz RHOXXWLQPXTQLS-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000412700781 513231526 /nfs/dbraw/zinc/23/15/26/513231526.db2.gz RHOXXWLQPXTQLS-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[NH+]1CCC2(CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000450540269 513242338 /nfs/dbraw/zinc/24/23/38/513242338.db2.gz NGZJWAOPBZVQLB-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000429012249 513251378 /nfs/dbraw/zinc/25/13/78/513251378.db2.gz SVAROROQNREWGK-KEYYUXOJSA-N 1 1 371.441 2.807 20 5 FFBDMO C[C@H]1CN(c2ccc(Cl)c(F)c2)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000429015057 513254007 /nfs/dbraw/zinc/25/40/07/513254007.db2.gz ZGBTWLNXTUJOSB-LBPRGKRZSA-N 1 1 367.812 2.795 20 5 FFBDMO C[C@H]1CN(c2ccc(Cl)c(F)c2)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000429015057 513254014 /nfs/dbraw/zinc/25/40/14/513254014.db2.gz ZGBTWLNXTUJOSB-LBPRGKRZSA-N 1 1 367.812 2.795 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](C)C1 ZINC000429017071 513255573 /nfs/dbraw/zinc/25/55/73/513255573.db2.gz DSFCSUUIWBDWTF-HBUWYVDXSA-N 1 1 361.442 2.623 20 5 FFBDMO CC(C)c1ncc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000440489029 513331873 /nfs/dbraw/zinc/33/18/73/513331873.db2.gz RIWANISXYLLREO-UHFFFAOYSA-N 1 1 357.414 2.969 20 5 FFBDMO C[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+](C2CCC2)C1 ZINC000429370741 513355831 /nfs/dbraw/zinc/35/58/31/513355831.db2.gz FJSMAATWZVLBAN-HNAYVOBHSA-N 1 1 372.469 2.506 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000440594886 513360425 /nfs/dbraw/zinc/36/04/25/513360425.db2.gz CJICUMFDGQCPSS-GOSISDBHSA-N 1 1 363.364 2.922 20 5 FFBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425013932 513369770 /nfs/dbraw/zinc/36/97/70/513369770.db2.gz RMAZXQOUXPEFPH-HNAYVOBHSA-N 1 1 367.405 2.647 20 5 FFBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425013932 513369780 /nfs/dbraw/zinc/36/97/80/513369780.db2.gz RMAZXQOUXPEFPH-HNAYVOBHSA-N 1 1 367.405 2.647 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418121607 513380837 /nfs/dbraw/zinc/38/08/37/513380837.db2.gz XGPFNDQHPGTYPX-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)CN1CCO ZINC000418121607 513380839 /nfs/dbraw/zinc/38/08/39/513380839.db2.gz XGPFNDQHPGTYPX-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)CN1CCO ZINC000418121607 513380842 /nfs/dbraw/zinc/38/08/42/513380842.db2.gz XGPFNDQHPGTYPX-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000425056742 513394680 /nfs/dbraw/zinc/39/46/80/513394680.db2.gz KPVSTLHUPGUVNS-SLEUVZQESA-N 1 1 367.833 2.568 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSC(C)(C)CC1 ZINC000434704581 513401238 /nfs/dbraw/zinc/40/12/38/513401238.db2.gz FMXJCZWFXDCYSP-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSC(C)(C)CC1 ZINC000434704581 513401242 /nfs/dbraw/zinc/40/12/42/513401242.db2.gz FMXJCZWFXDCYSP-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429755137 513457807 /nfs/dbraw/zinc/45/78/07/513457807.db2.gz ASQWJHWVEQKNSI-NEPJUHHUSA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)n2)c1 ZINC000441197558 513510159 /nfs/dbraw/zinc/51/01/59/513510159.db2.gz AXLDZGXMWAWUJV-HUUCEWRRSA-N 1 1 358.398 2.893 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441278286 513528255 /nfs/dbraw/zinc/52/82/55/513528255.db2.gz PHUJRZARBXGRFP-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO CCc1cnc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000441323778 513540259 /nfs/dbraw/zinc/54/02/59/513540259.db2.gz OLPFHJHNCNOYHM-UHFFFAOYSA-N 1 1 362.455 2.815 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000430142598 513566603 /nfs/dbraw/zinc/56/66/03/513566603.db2.gz AORRNRMGNXXOHQ-OFQRWUPVSA-N 1 1 363.458 2.774 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000430142597 513566962 /nfs/dbraw/zinc/56/69/62/513566962.db2.gz AORRNRMGNXXOHQ-IJEWVQPXSA-N 1 1 363.458 2.774 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000430142596 513567072 /nfs/dbraw/zinc/56/70/72/513567072.db2.gz AORRNRMGNXXOHQ-IIAWOOMASA-N 1 1 363.458 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](C[C@H]2CCCO2)C2CCCC2)c1 ZINC000441438332 513568268 /nfs/dbraw/zinc/56/82/68/513568268.db2.gz JMKKKFVKAHQLBA-PKOBYXMFSA-N 1 1 364.442 2.758 20 5 FFBDMO Cc1cccc(NCCNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])[nH+]1 ZINC000447816832 513580177 /nfs/dbraw/zinc/58/01/77/513580177.db2.gz LIHBUKUEBWEBDA-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000448005173 513655810 /nfs/dbraw/zinc/65/58/10/513655810.db2.gz SXKRKRIOGVJNDU-HNNXBMFYSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000419007409 513715117 /nfs/dbraw/zinc/71/51/17/513715117.db2.gz RMTYSHRCJLIIKA-GJZGRUSLSA-N 1 1 356.426 2.548 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418062 513737362 /nfs/dbraw/zinc/73/73/62/513737362.db2.gz LYKKDFWSQUACCP-APHBMKBZSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418062 513737366 /nfs/dbraw/zinc/73/73/66/513737366.db2.gz LYKKDFWSQUACCP-APHBMKBZSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000431040872 513813042 /nfs/dbraw/zinc/81/30/42/513813042.db2.gz YWWVPFZJZBZHFB-UHFFFAOYSA-N 1 1 354.370 2.692 20 5 FFBDMO COc1cc(CN2CCC[C@@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000442928602 513817528 /nfs/dbraw/zinc/81/75/28/513817528.db2.gz QCPRWDSVMUXROZ-NSHDSACASA-N 1 1 359.373 2.766 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000451691484 513913740 /nfs/dbraw/zinc/91/37/40/513913740.db2.gz CHAPOFQEYSACFM-OAGGEKHMSA-N 1 1 361.442 2.715 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000451697800 513917239 /nfs/dbraw/zinc/91/72/39/513917239.db2.gz ROXAARLVRRTFOP-BFYDXBDKSA-N 1 1 361.442 2.715 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCOc2ccccc21 ZINC000451707718 513927980 /nfs/dbraw/zinc/92/79/80/513927980.db2.gz IHQMWIVYRKZEMI-KRWDZBQOSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCOc2ccccc21 ZINC000451707718 513927986 /nfs/dbraw/zinc/92/79/86/513927986.db2.gz IHQMWIVYRKZEMI-KRWDZBQOSA-N 1 1 373.384 2.935 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000431625640 513949374 /nfs/dbraw/zinc/94/93/74/513949374.db2.gz ZKMWXWDUYBLNOB-SFHVURJKSA-N 1 1 360.458 2.920 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414334433 514052993 /nfs/dbraw/zinc/05/29/93/514052993.db2.gz XFPDWFHBBYALRU-SNVBAGLBSA-N 1 1 361.427 2.831 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](Cc2ccccc2C)CC1 ZINC000426842528 514056344 /nfs/dbraw/zinc/05/63/44/514056344.db2.gz HKTKSEBJZGXRRX-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CCSC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451963299 514098480 /nfs/dbraw/zinc/09/84/80/514098480.db2.gz HKIZTNDVVDPSCP-SFHVURJKSA-N 1 1 361.467 2.703 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1c1ccccc1 ZINC000452007836 514131192 /nfs/dbraw/zinc/13/11/92/514131192.db2.gz RMIQNYZRBPAJDX-SJORKVTESA-N 1 1 370.405 2.992 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000452121712 514204822 /nfs/dbraw/zinc/20/48/22/514204822.db2.gz KUQPZBSSNPROOY-LALPHHSUSA-N 1 1 365.405 2.545 20 5 FFBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449456802 514218517 /nfs/dbraw/zinc/21/85/17/514218517.db2.gz SRWVVRBSSYIZFE-LJQANCHMSA-N 1 1 374.393 2.866 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000444637199 514279875 /nfs/dbraw/zinc/27/98/75/514279875.db2.gz PWJLNUFZXKNQNQ-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO CCOc1cccc(C[N@H+](CCO)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000449761700 514343362 /nfs/dbraw/zinc/34/33/62/514343362.db2.gz ADXZVYFGDHJELC-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000449761700 514343370 /nfs/dbraw/zinc/34/33/70/514343370.db2.gz ADXZVYFGDHJELC-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO C[C@H](CCCC[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000427940824 514350646 /nfs/dbraw/zinc/35/06/46/514350646.db2.gz MPQZWLJAEAZYIR-MRVPVSSYSA-N 1 1 370.258 2.697 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433056065 514365103 /nfs/dbraw/zinc/36/51/03/514365103.db2.gz CAAFEESPUBDJDP-KRWDZBQOSA-N 1 1 371.437 2.767 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NCc3ccc([N+](=O)[O-])cc3Cl)cc2C1 ZINC000433177043 514406474 /nfs/dbraw/zinc/40/64/74/514406474.db2.gz RSSPEOWBPLWEKK-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NCc3ccc([N+](=O)[O-])cc3Cl)cc2C1 ZINC000433177043 514406481 /nfs/dbraw/zinc/40/64/81/514406481.db2.gz RSSPEOWBPLWEKK-UHFFFAOYSA-N 1 1 374.828 2.704 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000433364183 514471754 /nfs/dbraw/zinc/47/17/54/514471754.db2.gz NBJNUAXYAJWGRY-KSSFIOAISA-N 1 1 372.400 2.894 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000421112823 514489037 /nfs/dbraw/zinc/48/90/37/514489037.db2.gz RGPLJNIMFJXGPG-GFCCVEGCSA-N 1 1 371.235 2.915 20 5 FFBDMO Cc1cc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc([N+](=O)[O-])c1 ZINC000428535100 514491378 /nfs/dbraw/zinc/49/13/78/514491378.db2.gz JGBDVPJEGFZKDD-GOSISDBHSA-N 1 1 355.394 2.722 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000475107455 514560550 /nfs/dbraw/zinc/56/05/50/514560550.db2.gz HYXJSNIGDKPBTK-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000475107455 514560553 /nfs/dbraw/zinc/56/05/53/514560553.db2.gz HYXJSNIGDKPBTK-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000475575697 514720007 /nfs/dbraw/zinc/72/00/07/514720007.db2.gz RXHAWKKGFHWBJC-UHFFFAOYSA-N 1 1 350.396 2.840 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000475575697 514720018 /nfs/dbraw/zinc/72/00/18/514720018.db2.gz RXHAWKKGFHWBJC-UHFFFAOYSA-N 1 1 350.396 2.840 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475620034 514736700 /nfs/dbraw/zinc/73/67/00/514736700.db2.gz RNLCKSKFQGGEMM-UHFFFAOYSA-N 1 1 370.409 2.891 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475620034 514736707 /nfs/dbraw/zinc/73/67/07/514736707.db2.gz RNLCKSKFQGGEMM-UHFFFAOYSA-N 1 1 370.409 2.891 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231150 514761664 /nfs/dbraw/zinc/76/16/64/514761664.db2.gz IPQZPDOHUQGPPA-YQQAZPJKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231150 514761676 /nfs/dbraw/zinc/76/16/76/514761676.db2.gz IPQZPDOHUQGPPA-YQQAZPJKSA-N 1 1 363.458 2.677 20 5 FFBDMO C[C@@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1 ZINC000498140444 514776664 /nfs/dbraw/zinc/77/66/64/514776664.db2.gz NYRWQJYFJPLWJC-BLLLJJGKSA-N 1 1 367.496 2.606 20 5 FFBDMO Cc1cc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cn2cc[nH+]c12 ZINC000502825985 514795394 /nfs/dbraw/zinc/79/53/94/514795394.db2.gz BFWNQTKYRWFBAI-UHFFFAOYSA-N 1 1 362.349 2.989 20 5 FFBDMO Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461948222 514801105 /nfs/dbraw/zinc/80/11/05/514801105.db2.gz MHGQEEDSDGGBPY-CABCVRRESA-N 1 1 359.348 2.831 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000489336276 514803175 /nfs/dbraw/zinc/80/31/75/514803175.db2.gz UELLFSYSKHNBER-LBPRGKRZSA-N 1 1 355.341 2.505 20 5 FFBDMO Cc1cc(N2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)c(F)cc1[N+](=O)[O-] ZINC000461955351 514803400 /nfs/dbraw/zinc/80/34/00/514803400.db2.gz LMGMIMKMQCCPNC-HNNXBMFYSA-N 1 1 350.438 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCN(CC[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000485090727 514908659 /nfs/dbraw/zinc/90/86/59/514908659.db2.gz MEKUGTYQQKHLAZ-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCOc2ccccc21 ZINC000503093205 514915970 /nfs/dbraw/zinc/91/59/70/514915970.db2.gz AQCYXOWTSOKBDD-UHFFFAOYSA-N 1 1 367.405 2.769 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498476599 514920612 /nfs/dbraw/zinc/92/06/12/514920612.db2.gz WKEMHZHODDTODW-GFCCVEGCSA-N 1 1 354.838 2.526 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[nH+]1 ZINC000489763779 514965197 /nfs/dbraw/zinc/96/51/97/514965197.db2.gz DOFZMISINJVIHV-UHFFFAOYSA-N 1 1 366.324 2.742 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000498568321 514976751 /nfs/dbraw/zinc/97/67/51/514976751.db2.gz AXRLZSSZVMWODX-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[C@@H]1CCCC[N@@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467407787 514999005 /nfs/dbraw/zinc/99/90/05/514999005.db2.gz YBWRUNTXZBEZQV-GFCCVEGCSA-N 1 1 361.489 2.508 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467407787 514999012 /nfs/dbraw/zinc/99/90/12/514999012.db2.gz YBWRUNTXZBEZQV-GFCCVEGCSA-N 1 1 361.489 2.508 20 5 FFBDMO COc1cc(NC[C@@H](CC(C)C)[NH+]2CCOCC2)c([N+](=O)[O-])cc1F ZINC000467717502 515092815 /nfs/dbraw/zinc/09/28/15/515092815.db2.gz CQOXMVHYNAHRFT-CYBMUJFWSA-N 1 1 355.410 2.901 20 5 FFBDMO Cc1ccc(NC(=O)c2cc3c(nc[nH+]c3N(C)C)n2C)cc1[N+](=O)[O-] ZINC000476622316 515130370 /nfs/dbraw/zinc/13/03/70/515130370.db2.gz DWBPTUMIWFCGSE-UHFFFAOYSA-N 1 1 354.370 2.503 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000467810748 515131161 /nfs/dbraw/zinc/13/11/61/515131161.db2.gz GPHAXUGSZKJVRF-BXUZGUMPSA-N 1 1 367.833 2.616 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000509591631 515246998 /nfs/dbraw/zinc/24/69/98/515246998.db2.gz JXVBXULEXCNTCU-ZJUUUORDSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000509591631 515247004 /nfs/dbraw/zinc/24/70/04/515247004.db2.gz JXVBXULEXCNTCU-ZJUUUORDSA-N 1 1 370.247 2.830 20 5 FFBDMO CC[N@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000463039309 515343790 /nfs/dbraw/zinc/34/37/90/515343790.db2.gz SODIHXSGGPHSCD-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000463039309 515343798 /nfs/dbraw/zinc/34/37/98/515343798.db2.gz SODIHXSGGPHSCD-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000499698807 515416922 /nfs/dbraw/zinc/41/69/22/515416922.db2.gz YCSPJMHZKBJWQG-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO COCC[N@@H+](C)CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 ZINC000505053916 515438731 /nfs/dbraw/zinc/43/87/31/515438731.db2.gz JWLCKEVMPIBSJM-OAHLLOKOSA-N 1 1 361.398 2.627 20 5 FFBDMO CC[N@@H+](CCNc1ncnc2cccc([N+](=O)[O-])c21)CCC(F)(F)F ZINC000491610076 515461157 /nfs/dbraw/zinc/46/11/57/515461157.db2.gz NNXKENIPLTZYBT-UHFFFAOYSA-N 1 1 357.336 2.646 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000510443606 515543741 /nfs/dbraw/zinc/54/37/41/515543741.db2.gz OQVWYEKAOYPNME-SKDRFNHKSA-N 1 1 370.247 2.878 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456990249 515568746 /nfs/dbraw/zinc/56/87/46/515568746.db2.gz LQSYZVFMBUQXLZ-QGZVFWFLSA-N 1 1 354.410 2.570 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000473297684 515569551 /nfs/dbraw/zinc/56/95/51/515569551.db2.gz PQFBSQDQXUPWDP-OAHLLOKOSA-N 1 1 355.394 2.552 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000473297684 515569556 /nfs/dbraw/zinc/56/95/56/515569556.db2.gz PQFBSQDQXUPWDP-OAHLLOKOSA-N 1 1 355.394 2.552 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000473309634 515573342 /nfs/dbraw/zinc/57/33/42/515573342.db2.gz KPAPRJAERDDSDV-HNNXBMFYSA-N 1 1 371.441 2.693 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCCO)Cc1ccccc1 ZINC000486808749 515644263 /nfs/dbraw/zinc/64/42/63/515644263.db2.gz CWYIYTJPNISMIU-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCCO)Cc1ccccc1 ZINC000486808749 515644271 /nfs/dbraw/zinc/64/42/71/515644271.db2.gz CWYIYTJPNISMIU-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707243 515658589 /nfs/dbraw/zinc/65/85/89/515658589.db2.gz OACIBGFAHWKVOP-DGCLKSJQSA-N 1 1 373.400 2.820 20 5 FFBDMO CON1CCC([N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000459578280 515664204 /nfs/dbraw/zinc/66/42/04/515664204.db2.gz IBEFCQWBRPOGSC-UHFFFAOYSA-N 1 1 360.414 2.750 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1SC ZINC000457127123 515671096 /nfs/dbraw/zinc/67/10/96/515671096.db2.gz REJLBPMKJKUWPQ-GFCCVEGCSA-N 1 1 367.471 2.880 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](COc3ccccc3)C2)c1 ZINC000505861690 515700474 /nfs/dbraw/zinc/70/04/74/515700474.db2.gz FIXCDQCAKZAZGB-SJLPKXTDSA-N 1 1 372.421 2.735 20 5 FFBDMO CC(C)[N@@H+]1CCCC[C@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000487086589 515752402 /nfs/dbraw/zinc/75/24/02/515752402.db2.gz HLCRJKBDDINGTP-LBPRGKRZSA-N 1 1 358.236 2.782 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000487086589 515752409 /nfs/dbraw/zinc/75/24/09/515752409.db2.gz HLCRJKBDDINGTP-LBPRGKRZSA-N 1 1 358.236 2.782 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1[C@H]1C[C@@H]1c1ccccc1 ZINC000478255368 515755144 /nfs/dbraw/zinc/75/51/44/515755144.db2.gz OICYGHRRVWAOSP-WDYCEAGBSA-N 1 1 369.396 2.981 20 5 FFBDMO C[C@H](C(=O)NCCc1cccs1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511090222 515775484 /nfs/dbraw/zinc/77/54/84/515775484.db2.gz IGOOSRCIOADSJA-CQSZACIVSA-N 1 1 361.467 2.878 20 5 FFBDMO C[C@H](C(=O)NCCc1cccs1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511090222 515775494 /nfs/dbraw/zinc/77/54/94/515775494.db2.gz IGOOSRCIOADSJA-CQSZACIVSA-N 1 1 361.467 2.878 20 5 FFBDMO Cn1ccnc1[C@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000459734833 515778953 /nfs/dbraw/zinc/77/89/53/515778953.db2.gz OPIITLSDFBKUCH-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1c1c(F)cccc1F ZINC000478328219 515783345 /nfs/dbraw/zinc/78/33/45/515783345.db2.gz OYXKZVHBWKFPGX-LLVKDONJSA-N 1 1 365.311 2.907 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Br)c(F)c1 ZINC000494267946 515789049 /nfs/dbraw/zinc/78/90/49/515789049.db2.gz KQGPYRFEVIJRSE-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO Cc1c(CNC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478456902 515829923 /nfs/dbraw/zinc/82/99/23/515829923.db2.gz IZPZFAAFQDTHJS-GOSISDBHSA-N 1 1 368.437 2.977 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@@H]1C ZINC000478555442 515868051 /nfs/dbraw/zinc/86/80/51/515868051.db2.gz GBNRWGPDGBDBFG-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000500882307 515894198 /nfs/dbraw/zinc/89/41/98/515894198.db2.gz CQCAYMBTUSXVFY-MRXNPFEDSA-N 1 1 351.472 2.769 20 5 FFBDMO Cn1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)ccc1[N+](=O)[O-] ZINC000511699886 516005865 /nfs/dbraw/zinc/00/58/65/516005865.db2.gz AWDSQTUOKDOGSL-QGZVFWFLSA-N 1 1 370.453 2.964 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000474355452 516008408 /nfs/dbraw/zinc/00/84/08/516008408.db2.gz XOCNCRYBRHAOTM-NSHDSACASA-N 1 1 365.411 2.762 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000464974584 516031841 /nfs/dbraw/zinc/03/18/41/516031841.db2.gz RXFYQLUCBSIBDR-INIZCTEOSA-N 1 1 356.426 2.527 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616488 516173743 /nfs/dbraw/zinc/17/37/43/516173743.db2.gz FVAXIFBEHRYFEA-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616488 516173749 /nfs/dbraw/zinc/17/37/49/516173749.db2.gz FVAXIFBEHRYFEA-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000488383469 516209373 /nfs/dbraw/zinc/20/93/73/516209373.db2.gz KNFUWARYXGUCJV-CHWSQXEVSA-N 1 1 368.865 2.915 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000488383470 516209413 /nfs/dbraw/zinc/20/94/13/516209413.db2.gz KNFUWARYXGUCJV-OLZOCXBDSA-N 1 1 368.865 2.915 20 5 FFBDMO CC(C)[C@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000488509594 516245322 /nfs/dbraw/zinc/24/53/22/516245322.db2.gz ASZNVEBMPLQYEM-GOSISDBHSA-N 1 1 357.458 2.767 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](N2CCOCC2)C[C@H]1C ZINC000512439114 516279920 /nfs/dbraw/zinc/27/99/20/516279920.db2.gz NTIMEZYYMDBPQC-QAPCUYQASA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](N2CCOCC2)C[C@H]1C ZINC000512439114 516279923 /nfs/dbraw/zinc/27/99/23/516279923.db2.gz NTIMEZYYMDBPQC-QAPCUYQASA-N 1 1 363.458 2.677 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488666286 516284458 /nfs/dbraw/zinc/28/44/58/516284458.db2.gz FLSXRSNTAGFSCU-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488666286 516284460 /nfs/dbraw/zinc/28/44/60/516284460.db2.gz FLSXRSNTAGFSCU-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747345 516300215 /nfs/dbraw/zinc/30/02/15/516300215.db2.gz FFZJONYWFFOEOW-LOWVWBTDSA-N 1 1 369.263 2.919 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747345 516300219 /nfs/dbraw/zinc/30/02/19/516300219.db2.gz FFZJONYWFFOEOW-LOWVWBTDSA-N 1 1 369.263 2.919 20 5 FFBDMO C[C@@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135245 516302873 /nfs/dbraw/zinc/30/28/73/516302873.db2.gz QXUMMAZSEFIAAK-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135245 516302879 /nfs/dbraw/zinc/30/28/79/516302879.db2.gz QXUMMAZSEFIAAK-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1 ZINC000543674665 516358845 /nfs/dbraw/zinc/35/88/45/516358845.db2.gz HQBZFOSZZUWLNW-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)C[C@H]1Cc1ccccc1 ZINC000557742408 516414211 /nfs/dbraw/zinc/41/42/11/516414211.db2.gz RUWAUWDZLUCYIW-MRXNPFEDSA-N 1 1 363.421 2.901 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CC(c3nc4ccccc4s3)C2)c([N+](=O)[O-])c1 ZINC000535666065 516440994 /nfs/dbraw/zinc/44/09/94/516440994.db2.gz MICMCFKIJNBRDS-UHFFFAOYSA-N 1 1 368.418 2.903 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000561347288 516534750 /nfs/dbraw/zinc/53/47/50/516534750.db2.gz IDPLMKXOSNMIJX-OGHNNQOOSA-N 1 1 365.861 2.979 20 5 FFBDMO COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000536262817 516700413 /nfs/dbraw/zinc/70/04/13/516700413.db2.gz JGHNCNIQONLFBD-JXFKEZNVSA-N 1 1 369.421 2.708 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000555099892 516780445 /nfs/dbraw/zinc/78/04/45/516780445.db2.gz QWDKXIQOUBMQBR-SFHVURJKSA-N 1 1 360.410 2.911 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000558596182 516826573 /nfs/dbraw/zinc/82/65/73/516826573.db2.gz JEGNBSLDVVCTBW-DLBZAZTESA-N 1 1 368.437 2.527 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598235 516844521 /nfs/dbraw/zinc/84/45/21/516844521.db2.gz RMNASKZUCCNPSB-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598235 516844527 /nfs/dbraw/zinc/84/45/27/516844527.db2.gz RMNASKZUCCNPSB-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541122951 516888891 /nfs/dbraw/zinc/88/88/91/516888891.db2.gz KECIDKHJFDBJIS-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541122951 516888900 /nfs/dbraw/zinc/88/89/00/516888900.db2.gz KECIDKHJFDBJIS-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000558734678 516917392 /nfs/dbraw/zinc/91/73/92/516917392.db2.gz DLRPVSNUDKPIPA-CQSZACIVSA-N 1 1 363.805 2.538 20 5 FFBDMO Cc1ccc(NC(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000532424060 516970235 /nfs/dbraw/zinc/97/02/35/516970235.db2.gz NLRMJRFAOLNMCN-JKSUJKDBSA-N 1 1 362.430 2.668 20 5 FFBDMO CCO[C@@H]1C[C@H]1[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000514707988 517014894 /nfs/dbraw/zinc/01/48/94/517014894.db2.gz HSKTULGYGPXBEU-ZYHUDNBSSA-N 1 1 364.320 2.812 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCOc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000537178001 517070636 /nfs/dbraw/zinc/07/06/36/517070636.db2.gz IEHBTZUASBZURF-ZDUSSCGKSA-N 1 1 361.373 2.580 20 5 FFBDMO O=C(NCC[N@H+]1CC=CCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000514826624 517075029 /nfs/dbraw/zinc/07/50/29/517075029.db2.gz OKPUNMUYNLONFA-UHFFFAOYSA-N 1 1 352.394 2.649 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000514826624 517075035 /nfs/dbraw/zinc/07/50/35/517075035.db2.gz OKPUNMUYNLONFA-UHFFFAOYSA-N 1 1 352.394 2.649 20 5 FFBDMO CCC[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000541741423 517195159 /nfs/dbraw/zinc/19/51/59/517195159.db2.gz SJYYBEGNDCAKNS-MRXNPFEDSA-N 1 1 363.439 2.895 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2C2CCOCC2)c([N+](=O)[O-])c1 ZINC000537525024 517219529 /nfs/dbraw/zinc/21/95/29/517219529.db2.gz OJIMUHXLXYLZTK-MRXNPFEDSA-N 1 1 350.415 2.873 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCS(=O)(=O)C1 ZINC000537616434 517263600 /nfs/dbraw/zinc/26/36/00/517263600.db2.gz PRFOSDVTSNRKQV-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCS(=O)(=O)C1 ZINC000537616434 517263611 /nfs/dbraw/zinc/26/36/11/517263611.db2.gz PRFOSDVTSNRKQV-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000520073493 517269645 /nfs/dbraw/zinc/26/96/45/517269645.db2.gz OCPMFHINRRNKLB-KGLIPLIRSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000541935057 517299831 /nfs/dbraw/zinc/29/98/31/517299831.db2.gz BPAXRBXKUCJQLU-IAGOWNOFSA-N 1 1 356.426 2.654 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000542030229 517346590 /nfs/dbraw/zinc/34/65/90/517346590.db2.gz RGKFLFWBTVVKQR-OLZOCXBDSA-N 1 1 350.419 2.988 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294726 517388823 /nfs/dbraw/zinc/38/88/23/517388823.db2.gz CUCHQRBMBQNDPW-IRXDYDNUSA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294726 517388832 /nfs/dbraw/zinc/38/88/32/517388832.db2.gz CUCHQRBMBQNDPW-IRXDYDNUSA-N 1 1 361.442 2.619 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000545878481 517409258 /nfs/dbraw/zinc/40/92/58/517409258.db2.gz QIEAIUDSPBKADK-GFCCVEGCSA-N 1 1 362.405 2.969 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000553059409 517502624 /nfs/dbraw/zinc/50/26/24/517502624.db2.gz JSMINWVOZANALW-HUUCEWRRSA-N 1 1 360.458 2.785 20 5 FFBDMO O=C(NC[C@@H]([NH2+]Cc1ccccc1)c1ccco1)c1ccc([N+](=O)[O-])[nH]1 ZINC000553212816 517578404 /nfs/dbraw/zinc/57/84/04/517578404.db2.gz XXAOAFYVVQBGAF-OAHLLOKOSA-N 1 1 354.366 2.777 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@H]2C)n1 ZINC000553275576 517620777 /nfs/dbraw/zinc/62/07/77/517620777.db2.gz LGRMFHFEKJDVJQ-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)[C@H]2C1 ZINC000549579007 517625545 /nfs/dbraw/zinc/62/55/45/517625545.db2.gz XBEBFFYNSNFRPE-LSDHHAIUSA-N 1 1 359.348 2.913 20 5 FFBDMO CNC(=O)N1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000527304213 517626776 /nfs/dbraw/zinc/62/67/76/517626776.db2.gz BUAKOUCHHMUKLV-UHFFFAOYSA-N 1 1 360.439 2.780 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000553353289 517663845 /nfs/dbraw/zinc/66/38/45/517663845.db2.gz SWXLOHVBLZUBAU-LBPRGKRZSA-N 1 1 357.357 2.800 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000521323455 517693068 /nfs/dbraw/zinc/69/30/68/517693068.db2.gz SQLWLMUCUXSLBS-GFCCVEGCSA-N 1 1 356.854 2.819 20 5 FFBDMO C[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1=CC[N@@H+](C)CC1 ZINC000542826124 517768321 /nfs/dbraw/zinc/76/83/21/517768321.db2.gz JFIBVLBNKYBZRJ-HNNXBMFYSA-N 1 1 372.469 2.578 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1F ZINC000560734420 517994183 /nfs/dbraw/zinc/99/41/83/517994183.db2.gz XAQFOSGSXFKEQR-UHFFFAOYSA-N 1 1 367.421 2.618 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000547281590 518056273 /nfs/dbraw/zinc/05/62/73/518056273.db2.gz HCQAJHBUHDBBGK-UHFFFAOYSA-N 1 1 358.442 2.577 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543437606 518090245 /nfs/dbraw/zinc/09/02/45/518090245.db2.gz YKBROTMTAFITJC-NSHDSACASA-N 1 1 357.252 2.839 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535307940 518174153 /nfs/dbraw/zinc/17/41/53/518174153.db2.gz LBVAVFWAFQUSLP-ZDUSSCGKSA-N 1 1 357.414 2.504 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)CC1 ZINC000569851274 518324672 /nfs/dbraw/zinc/32/46/72/518324672.db2.gz SEMQGGXVDSYKFV-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000582042655 518558132 /nfs/dbraw/zinc/55/81/32/518558132.db2.gz SORPMHCBRZQIQC-MRXNPFEDSA-N 1 1 371.441 2.534 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3CCc4[nH+]ccn4C3)n2)ccc1[N+](=O)[O-] ZINC000570376743 518575000 /nfs/dbraw/zinc/57/50/00/518575000.db2.gz OJNJJYUILKEEQG-GFCCVEGCSA-N 1 1 355.354 2.504 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC000586770035 518635532 /nfs/dbraw/zinc/63/55/32/518635532.db2.gz FOEZTUFCBYSUKX-SFHVURJKSA-N 1 1 359.332 2.969 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC000586770035 518635540 /nfs/dbraw/zinc/63/55/40/518635540.db2.gz FOEZTUFCBYSUKX-SFHVURJKSA-N 1 1 359.332 2.969 20 5 FFBDMO O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000586802542 518646818 /nfs/dbraw/zinc/64/68/18/518646818.db2.gz NUOKEEYHQDECJS-MRXNPFEDSA-N 1 1 357.414 2.629 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000582275672 518672033 /nfs/dbraw/zinc/67/20/33/518672033.db2.gz QXZNMCWYGVDBLD-OAHLLOKOSA-N 1 1 354.410 2.751 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000568010483 518829754 /nfs/dbraw/zinc/82/97/54/518829754.db2.gz IBDHIOYRNLBWRX-IBGZPJMESA-N 1 1 354.410 2.693 20 5 FFBDMO Cc1ncn(-c2ccc([N+](=O)[O-])c(NC(=O)Cn3c[nH+]c(C)c3C)c2)c1C ZINC000573899937 518890843 /nfs/dbraw/zinc/89/08/43/518890843.db2.gz GQXYQSUTCHOLKA-UHFFFAOYSA-N 1 1 368.397 2.849 20 5 FFBDMO O=[N+]([O-])c1cncc(Cl)c1NCc1ccccc1C[NH+]1CCOCC1 ZINC000589106643 518916324 /nfs/dbraw/zinc/91/63/24/518916324.db2.gz VJVUJSVZSHBDEG-UHFFFAOYSA-N 1 1 362.817 2.509 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)n1 ZINC000582853303 518954234 /nfs/dbraw/zinc/95/42/34/518954234.db2.gz XPYWFNXZHXMRGP-FRRDWIJNSA-N 1 1 350.419 2.555 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C(C)(C)C)C1 ZINC000568353127 518993414 /nfs/dbraw/zinc/99/34/14/518993414.db2.gz SXOHMDBNMZTYFZ-MRXNPFEDSA-N 1 1 365.430 2.679 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000589502639 519019684 /nfs/dbraw/zinc/01/96/84/519019684.db2.gz ATGGYAJOFFSSDW-HNNXBMFYSA-N 1 1 361.442 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1 ZINC000589501866 519019842 /nfs/dbraw/zinc/01/98/42/519019842.db2.gz IMWKKEMRGBSPRY-SJORKVTESA-N 1 1 361.442 2.829 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+](C(C)C)C1 ZINC000571385217 519068881 /nfs/dbraw/zinc/06/88/81/519068881.db2.gz HYHJBOHAUZGFPM-CYBMUJFWSA-N 1 1 350.419 2.845 20 5 FFBDMO CC1(C)C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000577591025 519155741 /nfs/dbraw/zinc/15/57/41/519155741.db2.gz DNMPZTIBBYRFKU-HZPDHXFCSA-N 1 1 352.456 2.879 20 5 FFBDMO CC1(C)C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000577591025 519155749 /nfs/dbraw/zinc/15/57/49/519155749.db2.gz DNMPZTIBBYRFKU-HZPDHXFCSA-N 1 1 352.456 2.879 20 5 FFBDMO CC(C)(CO)[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccnc1 ZINC000590374711 519208886 /nfs/dbraw/zinc/20/88/86/519208886.db2.gz CFLLAIJNVLEAAY-GOSISDBHSA-N 1 1 373.409 2.706 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1noc2c1CCCC2 ZINC000568801515 519221220 /nfs/dbraw/zinc/22/12/20/519221220.db2.gz XULDWUSATYNEEG-GFCCVEGCSA-N 1 1 358.398 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](C[C@H]4CCCC[C@H]4O)CC3)nc2c1 ZINC000577956282 519342718 /nfs/dbraw/zinc/34/27/18/519342718.db2.gz XOJBFEKOJQWGHE-RDTXWAMCSA-N 1 1 373.457 2.534 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[N@H+]1C1CC1 ZINC000583666820 519366355 /nfs/dbraw/zinc/36/63/55/519366355.db2.gz SQXBXSHQHPQYIB-ZFWWWQNUSA-N 1 1 358.442 2.868 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000578140331 519440350 /nfs/dbraw/zinc/44/03/50/519440350.db2.gz GMSIUVSJVQFFAU-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccnc(N)c3[N+](=O)[O-])c2C1 ZINC000566440509 519494282 /nfs/dbraw/zinc/49/42/82/519494282.db2.gz KLAZRPCCNKABNA-UHFFFAOYSA-N 1 1 355.398 2.626 20 5 FFBDMO C[C@@H]1C[N@H+](CCC2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)C[C@H](C)O1 ZINC000591149373 519530463 /nfs/dbraw/zinc/53/04/63/519530463.db2.gz UWMFMMRCFVBGTJ-OKILXGFUSA-N 1 1 366.437 2.845 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000581184675 519564778 /nfs/dbraw/zinc/56/47/78/519564778.db2.gz DZGUJEWQXHNUFQ-SNVBAGLBSA-N 1 1 353.806 2.931 20 5 FFBDMO CC(C)N(Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000602853300 519926148 /nfs/dbraw/zinc/92/61/48/519926148.db2.gz WXUSTARGOVRNRN-GOSISDBHSA-N 1 1 357.458 2.813 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000602857971 519930835 /nfs/dbraw/zinc/93/08/35/519930835.db2.gz ZPRJCOZDJLMYCF-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000602857971 519930840 /nfs/dbraw/zinc/93/08/40/519930840.db2.gz ZPRJCOZDJLMYCF-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600008541 519999398 /nfs/dbraw/zinc/99/93/98/519999398.db2.gz OFACJJAHHKRLMY-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CC2CC2)CC1 ZINC000597407168 520006894 /nfs/dbraw/zinc/00/68/94/520006894.db2.gz DUAUXFNYRKLFAD-UHFFFAOYSA-N 1 1 370.457 2.795 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC2CC2)C[C@@H]1C ZINC000597408009 520007811 /nfs/dbraw/zinc/00/78/11/520007811.db2.gz IOTCSFWQPWEVRW-AWEZNQCLSA-N 1 1 370.457 2.794 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCC([NH+]3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000600107425 520051649 /nfs/dbraw/zinc/05/16/49/520051649.db2.gz LDIMUGPABVEBMN-UHFFFAOYSA-N 1 1 361.442 2.655 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000600188330 520108385 /nfs/dbraw/zinc/10/83/85/520108385.db2.gz NVSALJHXDQVPRZ-UHFFFAOYSA-N 1 1 358.341 2.768 20 5 FFBDMO C[C@]1(CO)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC000600203503 520122530 /nfs/dbraw/zinc/12/25/30/520122530.db2.gz KETPGJWVZCCTEZ-KDURUIRLSA-N 1 1 360.410 2.668 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000608854602 520145230 /nfs/dbraw/zinc/14/52/30/520145230.db2.gz PDLDIRASNZLGGU-NSHDSACASA-N 1 1 352.410 2.556 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc(O)cc2CC1)Nc1ccccc1[N+](=O)[O-] ZINC000608866692 520149151 /nfs/dbraw/zinc/14/91/51/520149151.db2.gz RNLBEOZGYGBINK-UHFFFAOYSA-N 1 1 355.394 2.730 20 5 FFBDMO O=C([C@@H]1CCc2[nH]cnc2C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597723645 520197373 /nfs/dbraw/zinc/19/73/73/520197373.db2.gz MDJIZNAOWZUZBK-CABCVRRESA-N 1 1 354.410 2.829 20 5 FFBDMO COc1cc(C[NH2+]C/C=C\CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000594973089 520235521 /nfs/dbraw/zinc/23/55/21/520235521.db2.gz CSDIHWYVLBBONK-WAYWQWQTSA-N 1 1 358.394 2.821 20 5 FFBDMO COC(=O)c1cc(-c2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)cc([N+](=O)[O-])c1 ZINC000612955137 520237354 /nfs/dbraw/zinc/23/73/54/520237354.db2.gz WGRRVJRAPDWPHA-FTNCPSPGSA-N 1 1 372.381 2.772 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1nc2sccn2c1[N+](=O)[O-] ZINC000603402421 520249643 /nfs/dbraw/zinc/24/96/43/520249643.db2.gz ROCMZSVRWVKHMN-UHFFFAOYSA-N 1 1 360.443 2.657 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056501 520272358 /nfs/dbraw/zinc/27/23/58/520272358.db2.gz KAFKUOFDGUBJCL-NVXWUHKLSA-N 1 1 357.458 2.880 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000600472723 520278883 /nfs/dbraw/zinc/27/88/83/520278883.db2.gz OWTCZYKQBKZPCM-QGZVFWFLSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000597859793 520286892 /nfs/dbraw/zinc/28/68/92/520286892.db2.gz YEHGDCGCULPVAX-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOc2ccccc2C1 ZINC000603909364 520400034 /nfs/dbraw/zinc/40/00/34/520400034.db2.gz SYLQVGINTCGMLT-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493033 520416793 /nfs/dbraw/zinc/41/67/93/520416793.db2.gz MUNIEVNUEFMLNL-BZUAXINKSA-N 1 1 360.458 2.633 20 5 FFBDMO CC1(C)C[C@@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CO1 ZINC000595433117 520468384 /nfs/dbraw/zinc/46/83/84/520468384.db2.gz NWSAUMRAVPVKEE-CQSZACIVSA-N 1 1 359.430 2.551 20 5 FFBDMO COC(=O)c1cc(-c2cccc(C[NH+]3CCOCC3)c2)cc([N+](=O)[O-])c1 ZINC000600787594 520470160 /nfs/dbraw/zinc/47/01/60/520470160.db2.gz BJVMRQRVPRNKLX-UHFFFAOYSA-N 1 1 356.378 2.881 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604197931 520482424 /nfs/dbraw/zinc/48/24/24/520482424.db2.gz BTIWOZKUGOMFDK-ZBFHGGJFSA-N 1 1 360.458 2.655 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000604198251 520483913 /nfs/dbraw/zinc/48/39/13/520483913.db2.gz DUUHUTNHUIFPFG-INIZCTEOSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598195618 520486324 /nfs/dbraw/zinc/48/63/24/520486324.db2.gz PRQWSXNOSRQUGZ-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595465022 520488920 /nfs/dbraw/zinc/48/89/20/520488920.db2.gz LOJDFURNZRGLCW-QGZVFWFLSA-N 1 1 360.458 2.559 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000610125934 520550202 /nfs/dbraw/zinc/55/02/02/520550202.db2.gz ZCPQSERXIKGIHJ-HOCLYGCPSA-N 1 1 358.442 2.881 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595572626 520561572 /nfs/dbraw/zinc/56/15/72/520561572.db2.gz FUISRAWVLCYVME-MRXNPFEDSA-N 1 1 360.458 2.844 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000610200270 520576637 /nfs/dbraw/zinc/57/66/37/520576637.db2.gz WOBIBWXIASNXCM-XHDPSFHLSA-N 1 1 363.443 2.501 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000600995203 520581696 /nfs/dbraw/zinc/58/16/96/520581696.db2.gz NNGPRGUOFMTNBA-MRXNPFEDSA-N 1 1 367.421 2.601 20 5 FFBDMO CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H]1CC[N@@H+](C)C1 ZINC000617559005 520582622 /nfs/dbraw/zinc/58/26/22/520582622.db2.gz QAKMFWKFWNPCLE-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CCOCCO)C3CCC3)co2)cc1 ZINC000595598740 520583258 /nfs/dbraw/zinc/58/32/58/520583258.db2.gz VJBWHCYXJXJHJS-UHFFFAOYSA-N 1 1 361.398 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+](CCOCCO)C3CCC3)co2)cc1 ZINC000595598740 520583265 /nfs/dbraw/zinc/58/32/65/520583265.db2.gz VJBWHCYXJXJHJS-UHFFFAOYSA-N 1 1 361.398 2.613 20 5 FFBDMO CC1(C)C[C@@H]([N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2ccccc2)CO1 ZINC000595639372 520614359 /nfs/dbraw/zinc/61/43/59/520614359.db2.gz WVMHJUFSGUUXHT-GOSISDBHSA-N 1 1 371.437 2.826 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610296593 520626939 /nfs/dbraw/zinc/62/69/39/520626939.db2.gz HCJNPXLNNBGDAP-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO O=C(C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1)N1CCCC1 ZINC000601101917 520636207 /nfs/dbraw/zinc/63/62/07/520636207.db2.gz YEPNIAWRZPNKGV-UHFFFAOYSA-N 1 1 354.410 2.982 20 5 FFBDMO Cc1cc(CN2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)no1 ZINC000601101524 520636446 /nfs/dbraw/zinc/63/64/46/520636446.db2.gz YLDBHNYCVMUAHJ-UHFFFAOYSA-N 1 1 353.382 2.762 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670796 520637113 /nfs/dbraw/zinc/63/71/13/520637113.db2.gz DLUZKWOKUDSBLL-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670796 520637120 /nfs/dbraw/zinc/63/71/20/520637120.db2.gz DLUZKWOKUDSBLL-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[N@H+](C2CCCC2)CC1 ZINC000601122228 520646817 /nfs/dbraw/zinc/64/68/17/520646817.db2.gz VPXAZYBFNHJTIN-UHFFFAOYSA-N 1 1 361.368 2.802 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NCCCc3nnc4n3CCCC4)c2c1 ZINC000601136837 520654000 /nfs/dbraw/zinc/65/40/00/520654000.db2.gz YRHDYGTVHAVMTL-UHFFFAOYSA-N 1 1 352.398 2.537 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598509683 520668230 /nfs/dbraw/zinc/66/82/30/520668230.db2.gz KXAUQFJDSULXMG-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598509683 520668235 /nfs/dbraw/zinc/66/82/35/520668235.db2.gz KXAUQFJDSULXMG-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]2N1 ZINC000595729203 520675487 /nfs/dbraw/zinc/67/54/87/520675487.db2.gz RCSNZQODRRLEAR-QMTHXVAHSA-N 1 1 357.332 2.714 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]2N1 ZINC000595729203 520675495 /nfs/dbraw/zinc/67/54/95/520675495.db2.gz RCSNZQODRRLEAR-QMTHXVAHSA-N 1 1 357.332 2.714 20 5 FFBDMO C[C@@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422075 520676116 /nfs/dbraw/zinc/67/61/16/520676116.db2.gz UQBGJHKCKVKUQR-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422075 520676121 /nfs/dbraw/zinc/67/61/21/520676121.db2.gz UQBGJHKCKVKUQR-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO CC(C)Oc1ccnc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000593019079 520687911 /nfs/dbraw/zinc/68/79/11/520687911.db2.gz PBMIHMAXMNDZAV-CQSZACIVSA-N 1 1 357.414 2.858 20 5 FFBDMO CC(C)Oc1ccnc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000593019079 520687918 /nfs/dbraw/zinc/68/79/18/520687918.db2.gz PBMIHMAXMNDZAV-CQSZACIVSA-N 1 1 357.414 2.858 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000598561410 520707422 /nfs/dbraw/zinc/70/74/22/520707422.db2.gz QSHOKIYNWHPKGD-HNNXBMFYSA-N 1 1 368.437 2.995 20 5 FFBDMO COC(=O)c1ccnc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000598589920 520729923 /nfs/dbraw/zinc/72/99/23/520729923.db2.gz VQQZAWLRSGNCNR-FRRDWIJNSA-N 1 1 350.419 2.555 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000595801034 520735515 /nfs/dbraw/zinc/73/55/15/520735515.db2.gz VPZARTFIKBNQEY-SJORKVTESA-N 1 1 360.458 2.968 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C[C@H]1C ZINC000601355134 520751812 /nfs/dbraw/zinc/75/18/12/520751812.db2.gz KNLQFJJKOPTKFR-OLZOCXBDSA-N 1 1 373.450 2.536 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCc2ccccc21 ZINC000595882211 520790278 /nfs/dbraw/zinc/79/02/78/520790278.db2.gz ZJNUHGMBYWTYNV-AEFFLSMTSA-N 1 1 356.422 2.996 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593182349 520806335 /nfs/dbraw/zinc/80/63/35/520806335.db2.gz JPAFCTXINXXJSI-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593182349 520806337 /nfs/dbraw/zinc/80/63/37/520806337.db2.gz JPAFCTXINXXJSI-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910754 520815125 /nfs/dbraw/zinc/81/51/25/520815125.db2.gz RFAICJXZRABDOH-ZOCIIQOWSA-N 1 1 359.426 2.814 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCO[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595916970 520822815 /nfs/dbraw/zinc/82/28/15/520822815.db2.gz PTBSLFGOOIRQJY-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCO[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595916970 520822827 /nfs/dbraw/zinc/82/28/27/520822827.db2.gz PTBSLFGOOIRQJY-MRXNPFEDSA-N 1 1 357.357 2.588 20 5 FFBDMO O=[N+]([O-])c1ncccc1NCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000610808837 520852679 /nfs/dbraw/zinc/85/26/79/520852679.db2.gz YHUDJBAFJYGUJY-UHFFFAOYSA-N 1 1 361.833 2.877 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)CCCO)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596129234 520928430 /nfs/dbraw/zinc/92/84/30/520928430.db2.gz RIMRNFKYHNSUJA-UHFFFAOYSA-N 1 1 357.838 2.540 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)C[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000596129086 520929409 /nfs/dbraw/zinc/92/94/09/520929409.db2.gz MGLYRKODWIUGPM-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO O=c1[nH]ccc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596209487 520972532 /nfs/dbraw/zinc/97/25/32/520972532.db2.gz FTPPQHSNKYVEQU-AWEZNQCLSA-N 1 1 360.439 2.725 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-] ZINC000596251161 520994077 /nfs/dbraw/zinc/99/40/77/520994077.db2.gz OYCDGWJKYBQUJM-UHFFFAOYSA-N 1 1 362.430 2.621 20 5 FFBDMO O=[N+]([O-])c1cccc2c(N3CCC([N@H+]4CCCOCC4)CC3)ccnc21 ZINC000596268977 521002067 /nfs/dbraw/zinc/00/20/67/521002067.db2.gz PBCBKVAKMYHFLI-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068655 521012872 /nfs/dbraw/zinc/01/28/72/521012872.db2.gz BNBJUDSRHMLNCF-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2COCCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599078116 521020157 /nfs/dbraw/zinc/02/01/57/521020157.db2.gz JGTDHAOLHAZZDD-VQIMIIECSA-N 1 1 359.426 2.760 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1ccc2cnccc2c1[N+](=O)[O-])C(C)C ZINC000599086835 521024862 /nfs/dbraw/zinc/02/48/62/521024862.db2.gz SNZAGHVBNMSAKG-INIZCTEOSA-N 1 1 360.414 2.732 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1N1CCC([NH+]2CCOCC2)CC1 ZINC000599104765 521034411 /nfs/dbraw/zinc/03/44/11/521034411.db2.gz NPLFLENUFRCYEF-UHFFFAOYSA-N 1 1 370.247 2.658 20 5 FFBDMO C[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593503943 521035999 /nfs/dbraw/zinc/03/59/99/521035999.db2.gz NFHFQXMXXQTCEP-CQSZACIVSA-N 1 1 357.439 2.667 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000596422544 521062120 /nfs/dbraw/zinc/06/21/20/521062120.db2.gz DPYQWBODCMWVFG-LJQANCHMSA-N 1 1 371.437 2.920 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274782 521075371 /nfs/dbraw/zinc/07/53/71/521075371.db2.gz HXWFVFIULSOGOG-OAHLLOKOSA-N 1 1 361.442 2.530 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599218811 521092576 /nfs/dbraw/zinc/09/25/76/521092576.db2.gz CNPWFABNLJESCW-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cc([N+](=O)[O-])c[nH]1 ZINC000596485473 521094665 /nfs/dbraw/zinc/09/46/65/521094665.db2.gz JNIRVQNOWDLOLE-MRXNPFEDSA-N 1 1 368.437 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1N[C@@H]1C[C@@H]([NH+]3CCOCC3)C13CCC3)CCN2 ZINC000596514339 521108396 /nfs/dbraw/zinc/10/83/96/521108396.db2.gz JIIUEMCXZYWRHJ-IAGOWNOFSA-N 1 1 358.442 2.618 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N[C@@H]3C[C@@H]([NH+]4CCOCC4)C34CCC4)c21 ZINC000596514855 521108572 /nfs/dbraw/zinc/10/85/72/521108572.db2.gz NIPIOWRWKCZCJF-HZPDHXFCSA-N 1 1 369.425 2.593 20 5 FFBDMO CCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000596543134 521123342 /nfs/dbraw/zinc/12/33/42/521123342.db2.gz KOSAVRMSLLWQNT-HNNXBMFYSA-N 1 1 368.865 2.916 20 5 FFBDMO CCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000596546788 521125468 /nfs/dbraw/zinc/12/54/68/521125468.db2.gz UYNCYPLZYIGYQU-CQSZACIVSA-N 1 1 354.838 2.526 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599288898 521129323 /nfs/dbraw/zinc/12/93/23/521129323.db2.gz YPLLXYPJYDFXRV-JTQLQIEISA-N 1 1 358.236 2.817 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](OC(F)F)C2)cccc1[N+](=O)[O-] ZINC000611580114 521234718 /nfs/dbraw/zinc/23/47/18/521234718.db2.gz QXSOCSATOBFDDT-LBPRGKRZSA-N 1 1 357.357 2.935 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c(N2CCCC2)[nH+]1 ZINC000611582231 521236507 /nfs/dbraw/zinc/23/65/07/521236507.db2.gz LHTRTTKXMPBZBA-UHFFFAOYSA-N 1 1 373.388 2.550 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H](C)C1(F)F ZINC000599512150 521268372 /nfs/dbraw/zinc/26/83/72/521268372.db2.gz DFVHOVXBAYNGSR-TXEJJXNPSA-N 1 1 353.369 2.707 20 5 FFBDMO C[C@@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H](C)C1(F)F ZINC000599512150 521268380 /nfs/dbraw/zinc/26/83/80/521268380.db2.gz DFVHOVXBAYNGSR-TXEJJXNPSA-N 1 1 353.369 2.707 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599664460 521377357 /nfs/dbraw/zinc/37/73/57/521377357.db2.gz NVPYQZDHSCTMJX-CABZTGNLSA-N 1 1 368.231 2.570 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(Cc3cc(Br)c([N+](=O)[O-])s3)[C@@H]2C1 ZINC000602592397 521429159 /nfs/dbraw/zinc/42/91/59/521429159.db2.gz QWUKHRIZZNYFOB-BXKDBHETSA-N 1 1 360.277 2.945 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599768818 521457725 /nfs/dbraw/zinc/45/77/25/521457725.db2.gz NJBXFDXGBRQCGJ-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594204007 521470051 /nfs/dbraw/zinc/47/00/51/521470051.db2.gz WJHNFRMIFVCGLA-SJLPKXTDSA-N 1 1 356.426 2.683 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CCC[N@@H+]1CCCO ZINC000602672045 521471556 /nfs/dbraw/zinc/47/15/56/521471556.db2.gz CPRYILCDMXJZOS-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCCN1CCCO ZINC000602672045 521471562 /nfs/dbraw/zinc/47/15/62/521471562.db2.gz CPRYILCDMXJZOS-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1(=O)=O ZINC000602711052 521488741 /nfs/dbraw/zinc/48/87/41/521488741.db2.gz WPSHGVKBAIOTDH-SKDRFNHKSA-N 1 1 366.361 2.669 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C[C@@H]1C ZINC000597100977 521506349 /nfs/dbraw/zinc/50/63/49/521506349.db2.gz NPBKMRPNJSWBLI-UWVGGRQHSA-N 1 1 355.826 2.777 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3cn(C)nc3[N+](=O)[O-])C2)s1 ZINC000602825563 521554739 /nfs/dbraw/zinc/55/47/39/521554739.db2.gz HAOARZIRQATBRO-AWEZNQCLSA-N 1 1 363.487 2.652 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)C[C@@H]3COCCO3)o2)c([N+](=O)[O-])c1 ZINC000597204897 521573054 /nfs/dbraw/zinc/57/30/54/521573054.db2.gz GWUPICAOPWHELN-OAHLLOKOSA-N 1 1 362.382 2.711 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](CCF)C2)cc1[N+](=O)[O-] ZINC000597211171 521578007 /nfs/dbraw/zinc/57/80/07/521578007.db2.gz KXGOJCBMMCUZKN-ZDUSSCGKSA-N 1 1 354.378 2.718 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)o1 ZINC000597235522 521588336 /nfs/dbraw/zinc/58/83/36/521588336.db2.gz IWAZPIXJTQKITK-INIZCTEOSA-N 1 1 371.437 2.886 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000616117039 521624852 /nfs/dbraw/zinc/62/48/52/521624852.db2.gz ZIXBQJHSUCEAQH-HNNXBMFYSA-N 1 1 362.430 2.540 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc(F)cc1[N+](=O)[O-])[C@H]2C ZINC001164858698 720937092 /nfs/dbraw/zinc/93/70/92/720937092.db2.gz KHKBZRXXRMOQPD-LBPRGKRZSA-N 1 1 362.409 2.747 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)nc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165038052 721908158 /nfs/dbraw/zinc/90/81/58/721908158.db2.gz JFZHRSBQEDGKJP-SNVBAGLBSA-N 1 1 361.229 2.598 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1 ZINC000053698529 728082999 /nfs/dbraw/zinc/08/29/99/728082999.db2.gz SAYBZGLZUXZJFG-GFCCVEGCSA-N 1 1 373.450 2.523 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000092627250 728469785 /nfs/dbraw/zinc/46/97/85/728469785.db2.gz ICJCTHBHEIUJJC-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1ccc([C@H](CNS(=O)(=O)c2csc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000119661393 728598259 /nfs/dbraw/zinc/59/82/59/728598259.db2.gz SEXOTKIMWZGCQB-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCC[N@H+](CCO)CC1 ZINC000171681904 729010487 /nfs/dbraw/zinc/01/04/87/729010487.db2.gz LXBFQDWASZBSRU-UHFFFAOYSA-N 1 1 367.755 2.771 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)c1 ZINC000172178888 729021098 /nfs/dbraw/zinc/02/10/98/729021098.db2.gz GUBQPYCPPBKVNU-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])sc2C1 ZINC000193804505 729490598 /nfs/dbraw/zinc/49/05/98/729490598.db2.gz RREILJZZTJHIQH-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cccc(OC)c3[N+](=O)[O-])sc2C1 ZINC000193804505 729490601 /nfs/dbraw/zinc/49/06/01/729490601.db2.gz RREILJZZTJHIQH-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000779206842 738442951 /nfs/dbraw/zinc/44/29/51/738442951.db2.gz REVZJVZBTIOKHP-WFASDCNBSA-N 1 1 369.849 2.916 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000779206842 738442955 /nfs/dbraw/zinc/44/29/55/738442955.db2.gz REVZJVZBTIOKHP-WFASDCNBSA-N 1 1 369.849 2.916 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856723105 730350040 /nfs/dbraw/zinc/35/00/40/730350040.db2.gz HPRIUXLQGMYCMH-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856727265 730350687 /nfs/dbraw/zinc/35/06/87/730350687.db2.gz ZAYSOCLVVWMEMH-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@H+](CCCNc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856727265 730350689 /nfs/dbraw/zinc/35/06/89/730350689.db2.gz ZAYSOCLVVWMEMH-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856727265 730350690 /nfs/dbraw/zinc/35/06/90/730350690.db2.gz ZAYSOCLVVWMEMH-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[C@H](C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000860098176 730476204 /nfs/dbraw/zinc/47/62/04/730476204.db2.gz MCJRLEVQCQEEFE-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000860099214 730476252 /nfs/dbraw/zinc/47/62/52/730476252.db2.gz AJEWQBUKGQBCID-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000860099214 730476253 /nfs/dbraw/zinc/47/62/53/730476253.db2.gz AJEWQBUKGQBCID-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)CCN1CCN(C)CC1 ZINC000872063841 731725692 /nfs/dbraw/zinc/72/56/92/731725692.db2.gz UEEQQZBHFAFHBF-HUUCEWRRSA-N 1 1 366.531 2.993 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000874837251 732105759 /nfs/dbraw/zinc/10/57/59/732105759.db2.gz KDHRYTIVDCPRMV-CHWSQXEVSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886118835 733751690 /nfs/dbraw/zinc/75/16/90/733751690.db2.gz QMLUNAXISUUWEY-OLZOCXBDSA-N 1 1 350.419 2.725 20 5 FFBDMO C[C@@](O)(C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(F)(F)F ZINC000705012036 734359728 /nfs/dbraw/zinc/35/97/28/734359728.db2.gz CMUDRQIDCNQNIT-SNVBAGLBSA-N 1 1 357.126 2.760 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)cc1Cl ZINC000783527020 738811804 /nfs/dbraw/zinc/81/18/04/738811804.db2.gz JRSODMUOHXONOB-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102355 738824848 /nfs/dbraw/zinc/82/48/48/738824848.db2.gz HTSSBSKXVNLSKS-YPMHNXCESA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102355 738824853 /nfs/dbraw/zinc/82/48/53/738824853.db2.gz HTSSBSKXVNLSKS-YPMHNXCESA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCc2c1cnn2CCO ZINC000892672386 734588866 /nfs/dbraw/zinc/58/88/66/734588866.db2.gz LNOLSYUGZUAGIO-AWEZNQCLSA-N 1 1 350.806 2.604 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@@H]1C ZINC000783920733 738849314 /nfs/dbraw/zinc/84/93/14/738849314.db2.gz OFRDRCCWNXIIQA-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)O[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000783924947 738849702 /nfs/dbraw/zinc/84/97/02/738849702.db2.gz RZGWLGGSMKGSKN-SUMWQHHRSA-N 1 1 350.415 2.992 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)c1 ZINC000735492942 734948400 /nfs/dbraw/zinc/94/84/00/734948400.db2.gz LAQMCCXBDVMMPW-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)c1 ZINC000735492942 734948402 /nfs/dbraw/zinc/94/84/02/734948402.db2.gz LAQMCCXBDVMMPW-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CCCC[C@@H]2C[NH+]2CCOCC2)c1 ZINC000735492942 734948405 /nfs/dbraw/zinc/94/84/05/734948405.db2.gz LAQMCCXBDVMMPW-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]2C1 ZINC000895576986 735026307 /nfs/dbraw/zinc/02/63/07/735026307.db2.gz TVJIULSWAMVXFK-BETUJISGSA-N 1 1 357.332 2.524 20 5 FFBDMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000751363027 735866784 /nfs/dbraw/zinc/86/67/84/735866784.db2.gz JPFDZVGCKCWRJG-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000758905890 736530877 /nfs/dbraw/zinc/53/08/77/736530877.db2.gz XSWFEOQEBHEQQW-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000910282410 737052355 /nfs/dbraw/zinc/05/23/55/737052355.db2.gz PCAQPEOYBYQZQO-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000765734532 737150715 /nfs/dbraw/zinc/15/07/15/737150715.db2.gz JVVRDBGIUWZCIP-VXGBXAGGSA-N 1 1 354.838 2.872 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cccc4nsnc43)CC2)c1 ZINC000766013712 737183036 /nfs/dbraw/zinc/18/30/36/737183036.db2.gz MWNJCNZCJHTIFH-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000766982469 737281630 /nfs/dbraw/zinc/28/16/30/737281630.db2.gz FOAXGAVVTZMTKH-IUODEOHRSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000766982470 737281770 /nfs/dbraw/zinc/28/17/70/737281770.db2.gz FOAXGAVVTZMTKH-SWLSCSKDSA-N 1 1 366.849 2.603 20 5 FFBDMO C[C@@](O)(C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1)C(F)(F)F ZINC000767903886 737381122 /nfs/dbraw/zinc/38/11/22/737381122.db2.gz UVOBHSLAYRLFRM-HUUCEWRRSA-N 1 1 362.348 2.654 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000768245112 737409096 /nfs/dbraw/zinc/40/90/96/737409096.db2.gz UPGLZTIBKHWFQF-UHFFFAOYSA-N 1 1 372.263 2.511 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000913813842 737452439 /nfs/dbraw/zinc/45/24/39/737452439.db2.gz HUFFSBSOGDVGMF-HOTGVXAUSA-N 1 1 351.834 2.876 20 5 FFBDMO Cn1ccnc1[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774640181 738008724 /nfs/dbraw/zinc/00/87/24/738008724.db2.gz PZEWZIBMYCPURE-NSHDSACASA-N 1 1 360.805 2.778 20 5 FFBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774640181 738008725 /nfs/dbraw/zinc/00/87/25/738008725.db2.gz PZEWZIBMYCPURE-NSHDSACASA-N 1 1 360.805 2.778 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778271950 738368397 /nfs/dbraw/zinc/36/83/97/738368397.db2.gz CZFKZQYQTTYDAU-UHFFFAOYSA-N 1 1 352.341 2.823 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000787420333 739135067 /nfs/dbraw/zinc/13/50/67/739135067.db2.gz HAQTWJJHEZZQRM-UWVGGRQHSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@H]1C ZINC000787420333 739135070 /nfs/dbraw/zinc/13/50/70/739135070.db2.gz HAQTWJJHEZZQRM-UWVGGRQHSA-N 1 1 357.204 2.741 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000930882469 739177388 /nfs/dbraw/zinc/17/73/88/739177388.db2.gz LIWPNZKIHOQQQN-GJZGRUSLSA-N 1 1 350.444 2.605 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000787962822 739191932 /nfs/dbraw/zinc/19/19/32/739191932.db2.gz RHHYVHIFPRAKPH-YGRLFVJLSA-N 1 1 371.821 2.705 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC000931625859 739299532 /nfs/dbraw/zinc/29/95/32/739299532.db2.gz JPCMIKQXCOWWGC-BZNIZROVSA-N 1 1 352.822 2.972 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](C3OCCO3)C2)ccc1Br ZINC000932001893 739369929 /nfs/dbraw/zinc/36/99/29/739369929.db2.gz RDGKBCUMRCZFKV-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](C3OCCO3)C2)ccc1Br ZINC000932001893 739369933 /nfs/dbraw/zinc/36/99/33/739369933.db2.gz RDGKBCUMRCZFKV-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790721492 739488278 /nfs/dbraw/zinc/48/82/78/739488278.db2.gz VAJIAGUZSLVSCY-LLVKDONJSA-N 1 1 357.813 2.730 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792924999 739719410 /nfs/dbraw/zinc/71/94/10/739719410.db2.gz JQKAVNJOTOLRMA-HIFRSBDPSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792924999 739719413 /nfs/dbraw/zinc/71/94/13/739719413.db2.gz JQKAVNJOTOLRMA-HIFRSBDPSA-N 1 1 353.806 2.830 20 5 FFBDMO COC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000796296386 740128318 /nfs/dbraw/zinc/12/83/18/740128318.db2.gz TUKZWRWTTIAXAC-AWEZNQCLSA-N 1 1 362.304 2.531 20 5 FFBDMO COC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000796296386 740128319 /nfs/dbraw/zinc/12/83/19/740128319.db2.gz TUKZWRWTTIAXAC-AWEZNQCLSA-N 1 1 362.304 2.531 20 5 FFBDMO CN(C)C(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000796550322 740152744 /nfs/dbraw/zinc/15/27/44/740152744.db2.gz WPYPKYLDNZELRB-AWEZNQCLSA-N 1 1 351.403 2.526 20 5 FFBDMO CC[N@H+](Cc1csc(C)c1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713084 740553448 /nfs/dbraw/zinc/55/34/48/740553448.db2.gz LBIHONROMSPLSJ-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO CC[N@@H+](Cc1csc(C)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713084 740553449 /nfs/dbraw/zinc/55/34/49/740553449.db2.gz LBIHONROMSPLSJ-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO CC[N@H+](Cc1csc(C)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713084 740553451 /nfs/dbraw/zinc/55/34/51/740553451.db2.gz LBIHONROMSPLSJ-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO CC(C)(C(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000805613530 740991976 /nfs/dbraw/zinc/99/19/76/740991976.db2.gz RCGWLAJQAHFAOO-UHFFFAOYSA-N 1 1 369.805 2.604 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCCC[C@H]2COC(=O)NC)ccc1[N+](=O)[O-] ZINC000805826039 741015034 /nfs/dbraw/zinc/01/50/34/741015034.db2.gz NQUBOIKEUMRUTA-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@H]2COC(=O)NC)ccc1[N+](=O)[O-] ZINC000805826039 741015040 /nfs/dbraw/zinc/01/50/40/741015040.db2.gz NQUBOIKEUMRUTA-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc([N+](=O)[O-])cc1Br ZINC000808133666 741191387 /nfs/dbraw/zinc/19/13/87/741191387.db2.gz RPBGYZJNKBDNID-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO CN(CCCN(C)c1ccc([N+](=O)[O-])cc1Br)CC[NH+](C)C ZINC000808133666 741191388 /nfs/dbraw/zinc/19/13/88/741191388.db2.gz RPBGYZJNKBDNID-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO COc1cc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000810704895 741442955 /nfs/dbraw/zinc/44/29/55/741442955.db2.gz WWWSGPLBEVBAQY-KRWDZBQOSA-N 1 1 354.378 2.859 20 5 FFBDMO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000814655837 741854036 /nfs/dbraw/zinc/85/40/36/741854036.db2.gz YHCOCIRMSVKHDZ-ZANVPECISA-N 1 1 367.203 2.532 20 5 FFBDMO CC[N@@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000814905677 741874153 /nfs/dbraw/zinc/87/41/53/741874153.db2.gz NLRFHZVEEILBQD-LSDHHAIUSA-N 1 1 370.247 2.657 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000814905677 741874158 /nfs/dbraw/zinc/87/41/58/741874158.db2.gz NLRFHZVEEILBQD-LSDHHAIUSA-N 1 1 370.247 2.657 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C[C@@H](C)O1 ZINC000816835908 742064958 /nfs/dbraw/zinc/06/49/58/742064958.db2.gz XSTGPTPJQRMBDY-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001396807 742118214 /nfs/dbraw/zinc/11/82/14/742118214.db2.gz SFOYSEMTRIKONE-IAGOWNOFSA-N 1 1 365.861 2.642 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000824651144 743122312 /nfs/dbraw/zinc/12/23/12/743122312.db2.gz BMOYRPJPUCFHHN-CYBMUJFWSA-N 1 1 351.422 2.903 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]21 ZINC000827254392 743542273 /nfs/dbraw/zinc/54/22/73/743542273.db2.gz PCVXXYFWNPEZTG-YGRLFVJLSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827311621 743553540 /nfs/dbraw/zinc/55/35/40/743553540.db2.gz QJMKOMBBXAGOKU-MFKMUULPSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1ccc(NC[C@@H]2CCC[N@H+]2CCCO)c([N+](=O)[O-])c1Br ZINC000828422059 745065016 /nfs/dbraw/zinc/06/50/16/745065016.db2.gz NZVUJBYAXUPBBY-LBPRGKRZSA-N 1 1 372.263 2.924 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c1F ZINC000830000571 745291364 /nfs/dbraw/zinc/29/13/64/745291364.db2.gz ZXYUEHULRXLTCB-GFCCVEGCSA-N 1 1 355.385 2.889 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000834595324 745864550 /nfs/dbraw/zinc/86/45/50/745864550.db2.gz XHEOFQACJZSHOC-KGLIPLIRSA-N 1 1 355.797 2.815 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590009 746865146 /nfs/dbraw/zinc/86/51/46/746865146.db2.gz MFZFDXOEZHDWQV-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590009 746865150 /nfs/dbraw/zinc/86/51/50/746865150.db2.gz MFZFDXOEZHDWQV-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845488555 748268152 /nfs/dbraw/zinc/26/81/52/748268152.db2.gz VFTSHTOQQIVJPS-CYBMUJFWSA-N 1 1 370.856 2.994 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)CCC(C)(C)[N+](=O)[O-])ccc1Cl ZINC000847074565 748613685 /nfs/dbraw/zinc/61/36/85/748613685.db2.gz CWIMDHRADXSRHC-UHFFFAOYSA-N 1 1 357.838 2.538 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)CCC(C)(C)[N+](=O)[O-])ccc1Cl ZINC000847074565 748613690 /nfs/dbraw/zinc/61/36/90/748613690.db2.gz CWIMDHRADXSRHC-UHFFFAOYSA-N 1 1 357.838 2.538 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)CC1 ZINC000848482539 748938124 /nfs/dbraw/zinc/93/81/24/748938124.db2.gz OSWWPQDZLOIHBG-UHFFFAOYSA-N 1 1 373.450 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@@H](O)c3cccc(Cl)c3)C2)nc1 ZINC000072665080 845558444 /nfs/dbraw/zinc/55/84/44/845558444.db2.gz VNGRFLOADNRNHV-GOEBONIOSA-N 1 1 362.817 2.863 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000795186695 1013047116 /nfs/dbraw/zinc/04/71/16/1013047116.db2.gz BLRLFXSKRJDIIL-LIRRHRJNSA-N 1 1 359.401 2.978 20 5 FFBDMO CCOC(=O)c1cnc(NCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC001167750629 971697431 /nfs/dbraw/zinc/69/74/31/971697431.db2.gz ARWAPYQPUZPNPK-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000120098663 958861324 /nfs/dbraw/zinc/86/13/24/958861324.db2.gz SYRLSGNTKNCUSP-DYVFJYSZSA-N 1 1 357.385 2.984 20 5 FFBDMO Cc1cc(N2CCc3[nH+]ccn3CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001167181152 960367666 /nfs/dbraw/zinc/36/76/66/960367666.db2.gz WJBBJRYZTCJHLT-UHFFFAOYSA-N 1 1 350.382 2.619 20 5 FFBDMO O=C(CC[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942917 960550833 /nfs/dbraw/zinc/55/08/33/960550833.db2.gz GEZRZMHTPNXOPD-QAPCUYQASA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942917 960550848 /nfs/dbraw/zinc/55/08/48/960550848.db2.gz GEZRZMHTPNXOPD-QAPCUYQASA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942917 960550870 /nfs/dbraw/zinc/55/08/70/960550870.db2.gz GEZRZMHTPNXOPD-QAPCUYQASA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000134942917 960550882 /nfs/dbraw/zinc/55/08/82/960550882.db2.gz GEZRZMHTPNXOPD-QAPCUYQASA-N 1 1 372.469 2.872 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134940030 960554559 /nfs/dbraw/zinc/55/45/59/960554559.db2.gz FTDYDGGAQKIUSB-QAPCUYQASA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000872286587 1013200423 /nfs/dbraw/zinc/20/04/23/1013200423.db2.gz LULZHGRLEBQOKL-HKUYNNGSSA-N 1 1 361.442 2.719 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000872286589 1013200598 /nfs/dbraw/zinc/20/05/98/1013200598.db2.gz LULZHGRLEBQOKL-MJGOQNOKSA-N 1 1 361.442 2.719 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901677 963625012 /nfs/dbraw/zinc/62/50/12/963625012.db2.gz CODVXQRPHGCTAW-OAHLLOKOSA-N 1 1 359.430 2.530 20 5 FFBDMO C[N@@H+](CCCF)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC001176280445 1013663760 /nfs/dbraw/zinc/66/37/60/1013663760.db2.gz BUQYMTAGUQAKEE-UHFFFAOYSA-N 1 1 352.147 2.991 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c(N)c([N+](=O)[O-])c1 ZINC000729523264 967621563 /nfs/dbraw/zinc/62/15/63/967621563.db2.gz LEJBPDGEZSHGPL-ZNMIVQPWSA-N 1 1 360.458 2.963 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@@H+](C)CCN1C ZINC000895246130 968758425 /nfs/dbraw/zinc/75/84/25/968758425.db2.gz LRGZWYRJFHRBQU-GUYCJALGSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895246130 968758434 /nfs/dbraw/zinc/75/84/34/968758434.db2.gz LRGZWYRJFHRBQU-GUYCJALGSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CN(C)CC[N@H+]1C ZINC000895246130 968758437 /nfs/dbraw/zinc/75/84/37/968758437.db2.gz LRGZWYRJFHRBQU-GUYCJALGSA-N 1 1 373.432 2.842 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H](c3[nH+]ccn3C)C2)cc1C ZINC000892984403 970470434 /nfs/dbraw/zinc/47/04/34/970470434.db2.gz CMUUSFPWKRHZFA-CYBMUJFWSA-N 1 1 358.398 2.807 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)nc1-c1ccccc1 ZINC000897220652 973458567 /nfs/dbraw/zinc/45/85/67/973458567.db2.gz CWTIHFYUWAOSCH-DLBZAZTESA-N 1 1 368.437 2.692 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899643 976900755 /nfs/dbraw/zinc/90/07/55/976900755.db2.gz KBFHPULGAAOZPR-KRWDZBQOSA-N 1 1 358.398 2.833 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000877146266 1014488991 /nfs/dbraw/zinc/48/89/91/1014488991.db2.gz VLUKSQCCTFWZKN-DQPZFDDXSA-N 1 1 370.388 2.747 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691824 1014686178 /nfs/dbraw/zinc/68/61/78/1014686178.db2.gz PHGYJBMSLOFYRU-ROUUACIJSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691824 1014686184 /nfs/dbraw/zinc/68/61/84/1014686184.db2.gz PHGYJBMSLOFYRU-ROUUACIJSA-N 1 1 368.437 2.908 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000110007099 981370100 /nfs/dbraw/zinc/37/01/00/981370100.db2.gz VJUNMPBTZRKJHG-UHFFFAOYSA-N 1 1 374.485 2.999 20 5 FFBDMO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000760464033 982419574 /nfs/dbraw/zinc/41/95/74/982419574.db2.gz WULIXASJFBYJQZ-UGSOOPFHSA-N 1 1 353.382 2.560 20 5 FFBDMO C[C@@H]1CC2(CC([NH2+][C@@H](c3nccn3C)c3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000897778407 982512971 /nfs/dbraw/zinc/51/29/71/982512971.db2.gz GSJXFPMHBITBAI-LARMFPEUSA-N 1 1 356.426 2.965 20 5 FFBDMO Cc1c(Cl)nc(-c2ccc([N+](=O)[O-])cc2)nc1NC1C[NH+](C(C)C)C1 ZINC001168314421 982824030 /nfs/dbraw/zinc/82/40/30/982824030.db2.gz WMCIMTLPJFPPNM-UHFFFAOYSA-N 1 1 361.833 2.940 20 5 FFBDMO C/C(=C\C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000911839220 983904654 /nfs/dbraw/zinc/90/46/54/983904654.db2.gz AGWMWHOZBHZZAI-PLUODVSUSA-N 1 1 373.453 2.614 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000127164950 1015087376 /nfs/dbraw/zinc/08/73/76/1015087376.db2.gz LCMXCKVDVKTIIA-ZDUSSCGKSA-N 1 1 364.402 2.662 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000127165182 1015087657 /nfs/dbraw/zinc/08/76/57/1015087657.db2.gz LCMXCKVDVKTIIA-CYBMUJFWSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+](C2CC2)C1 ZINC000878658205 1015154065 /nfs/dbraw/zinc/15/40/65/1015154065.db2.gz VCTWGSDXYFYEIC-CYBMUJFWSA-N 1 1 357.414 2.561 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000915297298 988395337 /nfs/dbraw/zinc/39/53/37/988395337.db2.gz BTKLAYIHWXVVEZ-VXGBXAGGSA-N 1 1 364.402 2.804 20 5 FFBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1 ZINC000673514233 988433274 /nfs/dbraw/zinc/43/32/74/988433274.db2.gz LVZDMHZMZZYRKR-DLBZAZTESA-N 1 1 361.445 2.669 20 5 FFBDMO CN(C)c1ccnc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000922477757 988628562 /nfs/dbraw/zinc/62/85/62/988628562.db2.gz DZEZPEFSFRXBGV-UHFFFAOYSA-N 1 1 366.425 2.746 20 5 FFBDMO CCc1ccccc1C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589386 988765628 /nfs/dbraw/zinc/76/56/28/988765628.db2.gz WQCSBFMPUUECDL-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccccc1C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589386 988765635 /nfs/dbraw/zinc/76/56/35/988765635.db2.gz WQCSBFMPUUECDL-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccccc1C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589386 988765645 /nfs/dbraw/zinc/76/56/45/988765645.db2.gz WQCSBFMPUUECDL-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000879244861 1015435646 /nfs/dbraw/zinc/43/56/46/1015435646.db2.gz UBUWDCXREMWAQX-ICSRJNTNSA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000763115058 989067243 /nfs/dbraw/zinc/06/72/43/989067243.db2.gz KDSXDUXZDWTHGG-UHFFFAOYSA-N 1 1 358.398 2.947 20 5 FFBDMO Cc1cc(C(=O)NCCC[N@H+]2CCc3ccccc3C2)c(N)c([N+](=O)[O-])c1 ZINC000068513858 991457107 /nfs/dbraw/zinc/45/71/07/991457107.db2.gz KNRHTVWMTGIWLA-UHFFFAOYSA-N 1 1 368.437 2.664 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](CO)c1ccccc1 ZINC000880463028 1015842471 /nfs/dbraw/zinc/84/24/71/1015842471.db2.gz YWTNXPRTPGXGMV-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](CO)c1ccccc1 ZINC000880463028 1015842475 /nfs/dbraw/zinc/84/24/75/1015842475.db2.gz YWTNXPRTPGXGMV-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)CC2(CCOCC2)C1 ZINC000880585545 1015880958 /nfs/dbraw/zinc/88/09/58/1015880958.db2.gz IKGBDHDHJJMVMT-QGZVFWFLSA-N 1 1 364.442 2.745 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810614724 994838512 /nfs/dbraw/zinc/83/85/12/994838512.db2.gz HBGAFDQYFMHJPO-LBPRGKRZSA-N 1 1 355.354 2.531 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810842139 994949510 /nfs/dbraw/zinc/94/95/10/994949510.db2.gz SSPORWHEYPVCOI-CZUORRHYSA-N 1 1 356.382 2.564 20 5 FFBDMO CC(C)c1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n(C)n1 ZINC000813170824 995632428 /nfs/dbraw/zinc/63/24/28/995632428.db2.gz YMIPVDJNAFREFJ-INIZCTEOSA-N 1 1 372.425 2.883 20 5 FFBDMO CC(C)c1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n(C)n1 ZINC000813170824 995632432 /nfs/dbraw/zinc/63/24/32/995632432.db2.gz YMIPVDJNAFREFJ-INIZCTEOSA-N 1 1 372.425 2.883 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c(c1)CCO2 ZINC000813174177 995634818 /nfs/dbraw/zinc/63/48/18/995634818.db2.gz RDGIQYKEOIAMKN-SFHVURJKSA-N 1 1 368.389 2.961 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c(c1)CCO2 ZINC000813174177 995634821 /nfs/dbraw/zinc/63/48/21/995634821.db2.gz RDGIQYKEOIAMKN-SFHVURJKSA-N 1 1 368.389 2.961 20 5 FFBDMO Cc1noc(C)c1CCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173296 995635031 /nfs/dbraw/zinc/63/50/31/995635031.db2.gz XZCWARPZRZKAMZ-KRWDZBQOSA-N 1 1 373.409 2.950 20 5 FFBDMO Cc1noc(C)c1CCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173296 995635034 /nfs/dbraw/zinc/63/50/34/995635034.db2.gz XZCWARPZRZKAMZ-KRWDZBQOSA-N 1 1 373.409 2.950 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000823988559 996773000 /nfs/dbraw/zinc/77/30/00/996773000.db2.gz WUWQGIFWHKRKHJ-INIZCTEOSA-N 1 1 369.425 2.915 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)CC[C@@H]21 ZINC000827277681 1016123910 /nfs/dbraw/zinc/12/39/10/1016123910.db2.gz OFLVQJLQUYSQLA-QRWLVFNGSA-N 1 1 361.445 2.848 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000732568449 998704587 /nfs/dbraw/zinc/70/45/87/998704587.db2.gz ULGYMVNUXOIVEI-UHFFFAOYSA-N 1 1 355.398 2.594 20 5 FFBDMO O=[N+]([O-])c1ccccc1CN[C@@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC000733898731 999127374 /nfs/dbraw/zinc/12/73/74/999127374.db2.gz TXLCVWCILQDROA-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1ccccc1CN[C@@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000733898731 999127376 /nfs/dbraw/zinc/12/73/76/999127376.db2.gz TXLCVWCILQDROA-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738088088 999616360 /nfs/dbraw/zinc/61/63/60/999616360.db2.gz AQJQSCIZAGTOQJ-UHFFFAOYSA-N 1 1 372.473 2.863 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(CN3CCC[N@H+](C4CCCC4)CC3)n2)c1 ZINC000738270048 999623894 /nfs/dbraw/zinc/62/38/94/999623894.db2.gz OPXQHTYXSXCDTR-UHFFFAOYSA-N 1 1 370.457 2.761 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000741019622 999703375 /nfs/dbraw/zinc/70/33/75/999703375.db2.gz WMVZOZORCFJOHP-IHRRRGAJSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741023031 999704427 /nfs/dbraw/zinc/70/44/27/999704427.db2.gz YBNYSOLAQGSEPO-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741023031 999704428 /nfs/dbraw/zinc/70/44/28/999704428.db2.gz YBNYSOLAQGSEPO-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO CC[C@@]1(C)CCC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000743389350 999816354 /nfs/dbraw/zinc/81/63/54/999816354.db2.gz WQHUSOOVUAWHSC-SFHVURJKSA-N 1 1 360.414 2.833 20 5 FFBDMO CC[C@@]1(C)CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000743389350 999816356 /nfs/dbraw/zinc/81/63/56/999816356.db2.gz WQHUSOOVUAWHSC-SFHVURJKSA-N 1 1 360.414 2.833 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000744395594 999854270 /nfs/dbraw/zinc/85/42/70/999854270.db2.gz OVEDAJRVMCRPOA-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO CCOc1ccc(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000804013431 1016363996 /nfs/dbraw/zinc/36/39/96/1016363996.db2.gz KEEWKRDVXIFCSY-HNNXBMFYSA-N 1 1 366.414 2.507 20 5 FFBDMO CCOc1ccc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000804013433 1016364227 /nfs/dbraw/zinc/36/42/27/1016364227.db2.gz KEEWKRDVXIFCSY-OAHLLOKOSA-N 1 1 366.414 2.507 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169010597 1000015199 /nfs/dbraw/zinc/01/51/99/1000015199.db2.gz DYFIVXHWNHDCMB-WCVJEAGWSA-N 1 1 353.463 2.906 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ccc(N)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000804345047 1000093664 /nfs/dbraw/zinc/09/36/64/1000093664.db2.gz SVWXXVDMRSUWIS-HXUWFJFHSA-N 1 1 369.469 2.968 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2ccc(N)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000804345047 1000093666 /nfs/dbraw/zinc/09/36/66/1000093666.db2.gz SVWXXVDMRSUWIS-HXUWFJFHSA-N 1 1 369.469 2.968 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ccc(N)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000804345047 1000093668 /nfs/dbraw/zinc/09/36/68/1000093668.db2.gz SVWXXVDMRSUWIS-HXUWFJFHSA-N 1 1 369.469 2.968 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000770388041 1000784091 /nfs/dbraw/zinc/78/40/91/1000784091.db2.gz ULOBHHVIHUHGCP-IXWMDQSNSA-N 1 1 356.426 2.930 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001146934741 1000792393 /nfs/dbraw/zinc/79/23/93/1000792393.db2.gz PCTHUVBRMCBZAE-NWDGAFQWSA-N 1 1 369.853 2.698 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000785744855 1001485840 /nfs/dbraw/zinc/48/58/40/1001485840.db2.gz QPWXKNLCWOQROA-RYUDHWBXSA-N 1 1 360.370 2.561 20 5 FFBDMO Cc1c(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cccc1[N+](=O)[O-] ZINC000791000753 1002539577 /nfs/dbraw/zinc/53/95/77/1002539577.db2.gz YWAAKZHVYFXGHU-UHFFFAOYSA-N 1 1 359.338 2.872 20 5 FFBDMO COC(=O)[C@@H]1CC[C@@H](C)[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170336150 1003118219 /nfs/dbraw/zinc/11/82/19/1003118219.db2.gz UUYHXSMASAVHFH-UMVBOHGHSA-N 1 1 350.415 2.808 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@]23CC(=O)N(C)C3)c([N+](=O)[O-])c1 ZINC001170340480 1003129577 /nfs/dbraw/zinc/12/95/77/1003129577.db2.gz MBPQAXMAKZZVGF-IFXJQAMLSA-N 1 1 361.442 2.621 20 5 FFBDMO COC[C@@H]1C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341359 1003130006 /nfs/dbraw/zinc/13/00/06/1003130006.db2.gz PLLFRUROHUVWSU-HIFRSBDPSA-N 1 1 374.441 2.514 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341359 1003130010 /nfs/dbraw/zinc/13/00/10/1003130010.db2.gz PLLFRUROHUVWSU-HIFRSBDPSA-N 1 1 374.441 2.514 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@]3(CCCC(=O)N3)C2)c([N+](=O)[O-])c1 ZINC001170341082 1003130428 /nfs/dbraw/zinc/13/04/28/1003130428.db2.gz NEEDQVBKEIKCFU-AUUYWEPGSA-N 1 1 361.442 2.669 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])[C@H]1C ZINC001170345206 1003131592 /nfs/dbraw/zinc/13/15/92/1003131592.db2.gz HYRTVJQDWWWGBM-HEHGZKQESA-N 1 1 350.415 2.808 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCCN(c3ncccn3)CC2)c([N+](=O)[O-])c1 ZINC001170344677 1003131825 /nfs/dbraw/zinc/13/18/25/1003131825.db2.gz FCTKHVVTBTXLHY-HNNXBMFYSA-N 1 1 371.441 2.537 20 5 FFBDMO C[C@]12CN(CCn3ccc([N+](=O)[O-])n3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001196962959 1004025504 /nfs/dbraw/zinc/02/55/04/1004025504.db2.gz WCDNDQWHMAMDPH-BGYRXZFFSA-N 1 1 369.469 2.635 20 5 FFBDMO CC(C)(C)OC(=O)NCC[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000805764563 1004138220 /nfs/dbraw/zinc/13/82/20/1004138220.db2.gz HFWNPTJXMQMSBW-AWEZNQCLSA-N 1 1 367.450 2.561 20 5 FFBDMO CCN(C)C(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000805763465 1004138932 /nfs/dbraw/zinc/13/89/32/1004138932.db2.gz ZXZJYKFEWQVUDC-OAHLLOKOSA-N 1 1 365.430 2.916 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)[N@@H+](C)Cc1ccccc1 ZINC000110349877 1005931318 /nfs/dbraw/zinc/93/13/18/1005931318.db2.gz XMENIEYBWBIZQU-HNNXBMFYSA-N 1 1 370.453 2.911 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000813824387 1006045570 /nfs/dbraw/zinc/04/55/70/1006045570.db2.gz YCAFVTAHLDVJSP-YVEFUNNKSA-N 1 1 372.400 2.709 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c([N+](=O)[O-])c1 ZINC000853912723 1006582050 /nfs/dbraw/zinc/58/20/50/1006582050.db2.gz PCKMRVNVPIQNMN-HZPDHXFCSA-N 1 1 362.386 2.558 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000882979987 1006584660 /nfs/dbraw/zinc/58/46/60/1006584660.db2.gz VIHLOYJCFHAXDG-JXFKEZNVSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccc([N+](=O)[O-])nc3)C2)O1 ZINC000882980382 1006585064 /nfs/dbraw/zinc/58/50/64/1006585064.db2.gz IGULZHSCFKCICZ-JXFKEZNVSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@H](NCc1ccccc1OCC[NH+](C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571425 1006704273 /nfs/dbraw/zinc/70/42/73/1006704273.db2.gz DJAZVZKWJRKSQF-AWEZNQCLSA-N 1 1 358.442 2.968 20 5 FFBDMO CO[C@H]1CCCC[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093069 1006897051 /nfs/dbraw/zinc/89/70/51/1006897051.db2.gz ZSVKEDRVXUFXFL-KSZLIROESA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@H]1CCCC[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093069 1006897064 /nfs/dbraw/zinc/89/70/64/1006897064.db2.gz ZSVKEDRVXUFXFL-KSZLIROESA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000776768294 1007057339 /nfs/dbraw/zinc/05/73/39/1007057339.db2.gz LKIOXNWRWWNKFE-LJQANCHMSA-N 1 1 370.384 2.943 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000776768294 1007057356 /nfs/dbraw/zinc/05/73/56/1007057356.db2.gz LKIOXNWRWWNKFE-LJQANCHMSA-N 1 1 370.384 2.943 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000855286567 1007244490 /nfs/dbraw/zinc/24/44/90/1007244490.db2.gz TVWCPWRUHMMUEN-NSHDSACASA-N 1 1 357.813 2.919 20 5 FFBDMO CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@H]1CC[N@@H+](C)C1 ZINC000855360377 1007302349 /nfs/dbraw/zinc/30/23/49/1007302349.db2.gz KKRZKYCNOQJPRI-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC000884547142 1007476411 /nfs/dbraw/zinc/47/64/11/1007476411.db2.gz CKVUGMRJYZTEAQ-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@@H]1C[C@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000817376778 1007569881 /nfs/dbraw/zinc/56/98/81/1007569881.db2.gz CSGCWUUJURQOLU-RDBSUJKOSA-N 1 1 367.450 2.620 20 5 FFBDMO C[C@@H]1C[C@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000817376778 1007569890 /nfs/dbraw/zinc/56/98/90/1007569890.db2.gz CSGCWUUJURQOLU-RDBSUJKOSA-N 1 1 367.450 2.620 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)o1 ZINC001190436490 1007639245 /nfs/dbraw/zinc/63/92/45/1007639245.db2.gz GSGXWGIJNYYVEA-GFCCVEGCSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)o1 ZINC001190436490 1007639251 /nfs/dbraw/zinc/63/92/51/1007639251.db2.gz GSGXWGIJNYYVEA-GFCCVEGCSA-N 1 1 354.370 2.748 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000115433113 1008188955 /nfs/dbraw/zinc/18/89/55/1008188955.db2.gz CWMJJPMYJAFVOC-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137441317 1008610387 /nfs/dbraw/zinc/61/03/87/1008610387.db2.gz ACLZBQHOAQMMQK-CZUORRHYSA-N 1 1 354.410 2.570 20 5 FFBDMO Cc1nn(CCC(=O)O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000117101278 1008762647 /nfs/dbraw/zinc/76/26/47/1008762647.db2.gz YFJISXPQTJBCSE-KRWDZBQOSA-N 1 1 372.425 2.616 20 5 FFBDMO O=C(NCCCCCC[NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178463286 1008996299 /nfs/dbraw/zinc/99/62/99/1008996299.db2.gz CWPATKBXHMJLIZ-IAGOWNOFSA-N 1 1 351.491 2.888 20 5 FFBDMO Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000126435287 1009229371 /nfs/dbraw/zinc/22/93/71/1009229371.db2.gz XQYUQPDFDBSYET-BBRMVZONSA-N 1 1 358.442 2.574 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861171994 1009290680 /nfs/dbraw/zinc/29/06/80/1009290680.db2.gz OXJASHBCTOBQGF-AWEZNQCLSA-N 1 1 371.437 2.665 20 5 FFBDMO C[C@@H]1Cc2cc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc2O1 ZINC001179937396 1009497342 /nfs/dbraw/zinc/49/73/42/1009497342.db2.gz LWLWOWHNJGRQDE-CJNGLKHVSA-N 1 1 354.410 3.000 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCCC3(CC3)CC2)C1=O ZINC000863330884 1010179125 /nfs/dbraw/zinc/17/91/25/1010179125.db2.gz SSPOBIUNBITDNP-SFHVURJKSA-N 1 1 372.425 2.585 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000794641797 1010438613 /nfs/dbraw/zinc/43/86/13/1010438613.db2.gz XLVCGLUAFBEFDQ-KGLIPLIRSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000794641797 1010438618 /nfs/dbraw/zinc/43/86/18/1010438618.db2.gz XLVCGLUAFBEFDQ-KGLIPLIRSA-N 1 1 361.398 2.599 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[NH+](CCc2cnccn2)CC1 ZINC000866119155 1010931989 /nfs/dbraw/zinc/93/19/89/1010931989.db2.gz AGKYICGPBOSDMW-UHFFFAOYSA-N 1 1 363.368 2.687 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@H]2CN1CC1CC1 ZINC001172904461 1012078115 /nfs/dbraw/zinc/07/81/15/1012078115.db2.gz NPDZDNNQLWCKGG-NSHGMRRFSA-N 1 1 369.465 2.642 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](Oc3cnccn3)C1)CC2 ZINC001172914037 1012096030 /nfs/dbraw/zinc/09/60/30/1012096030.db2.gz YCBUBEMZOWCYPQ-WMZOPIPTSA-N 1 1 354.410 2.786 20 5 FFBDMO O=C1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173014013 1012184522 /nfs/dbraw/zinc/18/45/22/1012184522.db2.gz NUNMWELUUNHPTI-UHFFFAOYSA-N 1 1 353.369 2.897 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192838 1012335128 /nfs/dbraw/zinc/33/51/28/1012335128.db2.gz KXQKNWDLSMGYKP-DIFFPNOSSA-N 1 1 354.378 2.559 20 5 FFBDMO CC[N@@H+](CCn1cccn1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195113 1012338278 /nfs/dbraw/zinc/33/82/78/1012338278.db2.gz BZCBEQAVKOKLOX-ZDUSSCGKSA-N 1 1 350.394 2.892 20 5 FFBDMO Cc1noc(C[C@H]2C[C@H]3C[N@H+]([C@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3O2)n1 ZINC001173223767 1012354200 /nfs/dbraw/zinc/35/42/00/1012354200.db2.gz CJBAHZNKCWEWPF-UOAMXJAYSA-N 1 1 372.425 2.549 20 5 FFBDMO C[C@@H](NC(=O)N(C)C[C@@H]1CCc2[nH+]ccn2C1)c1ccc([N+](=O)[O-])cc1 ZINC000925244812 1017676905 /nfs/dbraw/zinc/67/69/05/1017676905.db2.gz YXDAZWXOXCHNFR-KGLIPLIRSA-N 1 1 357.414 2.756 20 5 FFBDMO CC(C)N1CC[NH+](CCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000901265874 1018884043 /nfs/dbraw/zinc/88/40/43/1018884043.db2.gz KLLBJITXVCPOLR-UHFFFAOYSA-N 1 1 374.485 2.502 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000801950968 1019536640 /nfs/dbraw/zinc/53/66/40/1019536640.db2.gz OFDHLCJKWRBHIS-NEPJUHHUSA-N 1 1 364.421 2.699 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777955713 1020316758 /nfs/dbraw/zinc/31/67/58/1020316758.db2.gz QUMIYOOLOGSYRF-SFHVURJKSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777955713 1020316767 /nfs/dbraw/zinc/31/67/67/1020316767.db2.gz QUMIYOOLOGSYRF-SFHVURJKSA-N 1 1 369.425 2.503 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001048607642 1020349701 /nfs/dbraw/zinc/34/97/01/1020349701.db2.gz FOYIVTVZWJQXQG-NCXUSEDFSA-N 1 1 359.470 2.672 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963014 1020353673 /nfs/dbraw/zinc/35/36/73/1020353673.db2.gz FORBQYITJLOWBY-VQIMIIECSA-N 1 1 355.442 2.832 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@@H]21 ZINC000777963011 1020356835 /nfs/dbraw/zinc/35/68/35/1020356835.db2.gz FORBQYITJLOWBY-LPHOPBHVSA-N 1 1 355.442 2.832 20 5 FFBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726586211 1020488879 /nfs/dbraw/zinc/48/88/79/1020488879.db2.gz IPFBARIZDAXWIR-KGLIPLIRSA-N 1 1 360.414 2.831 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H]([C@]3(C)COC(=O)N3)C2)ccc1[N+](=O)[O-] ZINC000932018128 1020668789 /nfs/dbraw/zinc/66/87/89/1020668789.db2.gz ACKAJDCFKUINGD-KSSFIOAISA-N 1 1 363.414 2.704 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@@]2(C)COC(=O)N2)C1 ZINC000932027429 1020673599 /nfs/dbraw/zinc/67/35/99/1020673599.db2.gz YJUYQKNGZWJLKY-KBXCAEBGSA-N 1 1 363.414 2.704 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1CNC(=O)OC(C)(C)C ZINC000932709608 1020880668 /nfs/dbraw/zinc/88/06/68/1020880668.db2.gz JUGQOYSZLABFNR-UONOGXRCSA-N 1 1 364.446 2.973 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933079004 1020952632 /nfs/dbraw/zinc/95/26/32/1020952632.db2.gz IKSHDOXHBPNVHH-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933079004 1020952635 /nfs/dbraw/zinc/95/26/35/1020952635.db2.gz IKSHDOXHBPNVHH-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNCCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000749674210 1021018574 /nfs/dbraw/zinc/01/85/74/1021018574.db2.gz VWJNYDLLTDXOGR-FQEVSTJZSA-N 1 1 355.438 2.666 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNCCC[N@H+]2CCc3ccccc3C2)c1 ZINC000749674210 1021018578 /nfs/dbraw/zinc/01/85/78/1021018578.db2.gz VWJNYDLLTDXOGR-FQEVSTJZSA-N 1 1 355.438 2.666 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)c1 ZINC000749686324 1021020686 /nfs/dbraw/zinc/02/06/86/1021020686.db2.gz HNVWGXFIEVZSLK-QKLQHJQFSA-N 1 1 353.422 2.696 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807073 1021428336 /nfs/dbraw/zinc/42/83/36/1021428336.db2.gz QIZRGKQCFBKYCE-WBVHZDCISA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807073 1021428339 /nfs/dbraw/zinc/42/83/39/1021428339.db2.gz QIZRGKQCFBKYCE-WBVHZDCISA-N 1 1 373.384 2.918 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@H+]2CC[C@H](O)[C@H](CO)C2)o1 ZINC001118013601 1022019813 /nfs/dbraw/zinc/01/98/13/1022019813.db2.gz ZQPLRMJHPIGTQV-ZBEGNZNMSA-N 1 1 366.801 2.683 20 5 FFBDMO O=C1NC2(CO1)CC[NH+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CC2 ZINC000753586247 1023356163 /nfs/dbraw/zinc/35/61/63/1023356163.db2.gz GKSPZMYIWBUPOA-UHFFFAOYSA-N 1 1 374.422 2.793 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](C4CCOCC4)C3)n2)c1 ZINC000754778721 1023515653 /nfs/dbraw/zinc/51/56/53/1023515653.db2.gz MBUDPDARXOFQGG-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@H](c1nnc(N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1C)[N+](=O)[O-] ZINC001121296102 1023692713 /nfs/dbraw/zinc/69/27/13/1023692713.db2.gz DZBGQDPMLZFLOY-INMHGKMJSA-N 1 1 372.473 2.642 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC001123274496 1023717640 /nfs/dbraw/zinc/71/76/40/1023717640.db2.gz HSZQFMQFAUHFHT-GFCCVEGCSA-N 1 1 350.419 2.845 20 5 FFBDMO CCC[C@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000757610426 1023836848 /nfs/dbraw/zinc/83/68/48/1023836848.db2.gz MWSUHVDWGANHBP-IFXJQAMLSA-N 1 1 374.441 2.831 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC ZINC000758155711 1023943180 /nfs/dbraw/zinc/94/31/80/1023943180.db2.gz PGMDRWXLCLGCKR-UHFFFAOYSA-N 1 1 359.430 2.630 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CCC[N@H+]2C)CC1 ZINC000194740323 1024886179 /nfs/dbraw/zinc/88/61/79/1024886179.db2.gz OYSHSVKINLJFPM-MRXNPFEDSA-N 1 1 360.458 2.655 20 5 FFBDMO CCOC(=O)c1cnn(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000840126711 1026970072 /nfs/dbraw/zinc/97/00/72/1026970072.db2.gz QLMCKBLTVTUXJJ-OAHLLOKOSA-N 1 1 358.398 2.805 20 5 FFBDMO CCOC(=O)c1cnn(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000840126711 1026970077 /nfs/dbraw/zinc/97/00/77/1026970077.db2.gz QLMCKBLTVTUXJJ-OAHLLOKOSA-N 1 1 358.398 2.805 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@@H](Nc2cccc([N+](=O)[O-])n2)C1 ZINC001158581236 1027065855 /nfs/dbraw/zinc/06/58/55/1027065855.db2.gz DGYQPUYMOIQSLT-RDJZCZTQSA-N 1 1 370.409 2.861 20 5 FFBDMO COC(=O)c1ccc2c(cnn2C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000795645216 1027383722 /nfs/dbraw/zinc/38/37/22/1027383722.db2.gz RLEFPMBXFVTYAN-UHFFFAOYSA-N 1 1 368.393 2.863 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC2CCN(c3cccnc3)CC2)ncc1[N+](=O)[O-] ZINC001160272243 1027655256 /nfs/dbraw/zinc/65/52/56/1027655256.db2.gz HHLFXMNGAVRXBY-WEVVVXLNSA-N 1 1 368.441 2.998 20 5 FFBDMO CCOC1CC2(C1)CC[N@H+](CN1CCN(c3ccccc3[N+](=O)[O-])C1=O)C2 ZINC000795725727 1028018678 /nfs/dbraw/zinc/01/86/78/1028018678.db2.gz KNYASSNWRBMLBF-UHFFFAOYSA-N 1 1 374.441 2.685 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](CN1CCN(c3ccccc3[N+](=O)[O-])C1=O)C2 ZINC000795725727 1028018694 /nfs/dbraw/zinc/01/86/94/1028018694.db2.gz KNYASSNWRBMLBF-UHFFFAOYSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001161885243 1028349008 /nfs/dbraw/zinc/34/90/08/1028349008.db2.gz KNLOJQNGIOWNGZ-AWEZNQCLSA-N 1 1 357.370 2.975 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC001162801409 1028661264 /nfs/dbraw/zinc/66/12/64/1028661264.db2.gz ZGOPRSDYUNPXBH-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC001162801409 1028661269 /nfs/dbraw/zinc/66/12/69/1028661269.db2.gz ZGOPRSDYUNPXBH-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO C[N@@H+]1CCc2c(N[C@@H]3CCc4[nH]c(=O)ccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001163563448 1028973388 /nfs/dbraw/zinc/97/33/88/1028973388.db2.gz MVSYHVJVUGJRQC-CYBMUJFWSA-N 1 1 354.410 2.653 20 5 FFBDMO C[N@H+]1CCc2c(N[C@@H]3CCc4[nH]c(=O)ccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001163563448 1028973404 /nfs/dbraw/zinc/97/34/04/1028973404.db2.gz MVSYHVJVUGJRQC-CYBMUJFWSA-N 1 1 354.410 2.653 20 5 FFBDMO CCc1cc(NCCn2cc[nH+]c2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001156010023 1029011578 /nfs/dbraw/zinc/01/15/78/1029011578.db2.gz FTLIPIMJPPWKJW-UHFFFAOYSA-N 1 1 352.398 2.653 20 5 FFBDMO O=[N+]([O-])c1cc(N2CCC[N@@H+](Cc3ccncc3)CC2)nc2[nH]ccc21 ZINC001163826457 1029076099 /nfs/dbraw/zinc/07/60/99/1029076099.db2.gz FXYNPRFZMLYLST-UHFFFAOYSA-N 1 1 352.398 2.578 20 5 FFBDMO Cc1cc(N2CCC(C[N@H+](CCO)C(C)C)CC2)c(F)cc1[N+](=O)[O-] ZINC001164190430 1029195933 /nfs/dbraw/zinc/19/59/33/1029195933.db2.gz AWLGKEHYOIACAG-UHFFFAOYSA-N 1 1 353.438 2.961 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2c(F)cccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490504 1029296175 /nfs/dbraw/zinc/29/61/75/1029296175.db2.gz KZZGRHPLGRJURB-IAQYHMDHSA-N 1 1 369.824 2.520 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3nc(C(F)(F)F)nc(Cl)c3[N+](=O)[O-])C[C@H]21 ZINC001157272460 1029532980 /nfs/dbraw/zinc/53/29/80/1029532980.db2.gz MYKQWQIGNFLMCT-JGVFFNPUSA-N 1 1 365.743 2.587 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@H]21 ZINC001157282992 1029535588 /nfs/dbraw/zinc/53/55/88/1029535588.db2.gz SCKLPJXAZVFGPE-SUMWQHHRSA-N 1 1 357.389 2.721 20 5 FFBDMO O=C(NCCC[NH2+]Cc1sc2ccccc2c1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001157775817 1029661141 /nfs/dbraw/zinc/66/11/41/1029661141.db2.gz YTYBJEYKRARVDM-VXGBXAGGSA-N 1 1 367.858 2.816 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782526168 1029733272 /nfs/dbraw/zinc/73/32/72/1029733272.db2.gz HQSNWAAABQPTGK-UONOGXRCSA-N 1 1 365.405 2.811 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2ncc([N+](=O)[O-])cc2C)c2ccccc12 ZINC001158236831 1029766790 /nfs/dbraw/zinc/76/67/90/1029766790.db2.gz QPQPHIUBUKEJPJ-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ncc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001165200067 1029886685 /nfs/dbraw/zinc/88/66/85/1029886685.db2.gz AXTLKXFJIPZBKG-KBPBESRZSA-N 1 1 371.397 2.997 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001142221306 1030181346 /nfs/dbraw/zinc/18/13/46/1030181346.db2.gz AFWKWANNAOEVMQ-KBPBESRZSA-N 1 1 351.422 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](c4cccnc4)C3)n2)cc1 ZINC000842623023 1030842545 /nfs/dbraw/zinc/84/25/45/1030842545.db2.gz SEEOBWHFOAPZTJ-INIZCTEOSA-N 1 1 350.382 2.695 20 5 FFBDMO CC(=O)NCC(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001142806120 1030906488 /nfs/dbraw/zinc/90/64/88/1030906488.db2.gz BGOBJEJYRNTURA-UHFFFAOYSA-N 1 1 350.422 2.837 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc3cc[nH]c3c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530627 1031787263 /nfs/dbraw/zinc/78/72/63/1031787263.db2.gz ICPCBROZJIMFCB-SJLPKXTDSA-N 1 1 370.453 2.742 20 5 FFBDMO NC[C@H]([NH3+])c1ccc(C(=O)Nc2cc3nc4ccccc4nc3cc2N)cc1 ZINC001218859486 1033382380 /nfs/dbraw/zinc/38/23/80/1033382380.db2.gz OKKZHBGRJNZFBS-HNNXBMFYSA-N 1 1 372.432 2.576 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@@H](C)[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000830189218 1033500630 /nfs/dbraw/zinc/50/06/30/1033500630.db2.gz BZTABLROWSTWDL-MGPQQGTHSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@@H](C)[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000830189218 1033500643 /nfs/dbraw/zinc/50/06/43/1033500643.db2.gz BZTABLROWSTWDL-MGPQQGTHSA-N 1 1 367.450 2.510 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOCc2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC001223731704 1033568469 /nfs/dbraw/zinc/56/84/69/1033568469.db2.gz WBTKMTVRMCUJDC-OAHLLOKOSA-N 1 1 363.439 2.956 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000831538928 1034118032 /nfs/dbraw/zinc/11/80/32/1034118032.db2.gz JOPZITHWHBKKKJ-OAHLLOKOSA-N 1 1 372.381 2.544 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226167329 1034555405 /nfs/dbraw/zinc/55/54/05/1034555405.db2.gz HWGLDVXIGMUPIB-KDOFPFPSSA-N 1 1 369.421 2.983 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c(Br)c3)[C@H]1CC(=O)C2 ZINC001229079802 1036488446 /nfs/dbraw/zinc/48/84/46/1036488446.db2.gz AYWDLKMKMNTPOJ-MCCGJVOXSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c(Br)c3)[C@H]1CC(=O)C2 ZINC001229079802 1036488453 /nfs/dbraw/zinc/48/84/53/1036488453.db2.gz AYWDLKMKMNTPOJ-MCCGJVOXSA-N 1 1 355.188 2.540 20 5 FFBDMO CC(=O)Nc1cc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229130691 1036512956 /nfs/dbraw/zinc/51/29/56/1036512956.db2.gz SNYFEOVLCJJXIC-WDNDVIMCSA-N 1 1 361.398 2.760 20 5 FFBDMO C[C@H](Oc1cc([N+](=O)[O-])ccc1[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC001229396693 1036649567 /nfs/dbraw/zinc/64/95/67/1036649567.db2.gz WPKKCSCERXZHIX-IFXJQAMLSA-N 1 1 358.394 2.969 20 5 FFBDMO Cc1ccnc([N+](=O)[O-])c1OC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001233556892 1036680636 /nfs/dbraw/zinc/68/06/36/1036680636.db2.gz QKXFXPUFYPNJBO-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO O=[N+]([O-])c1ncc(Cl)cc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001233717187 1036729578 /nfs/dbraw/zinc/72/95/78/1036729578.db2.gz VFWHBLICBUNBIW-OAHLLOKOSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1ncc(Cl)cc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001233717187 1036729597 /nfs/dbraw/zinc/72/95/97/1036729597.db2.gz VFWHBLICBUNBIW-OAHLLOKOSA-N 1 1 363.801 2.923 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2cccc(I)c2[N+](=O)[O-])C1 ZINC001229656278 1036807269 /nfs/dbraw/zinc/80/72/69/1036807269.db2.gz ATISNDXGSOXZGY-VIFPVBQESA-N 1 1 362.167 2.672 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](Oc2cc(O)cc3oc4c(O)ccc(O)c4c(=O)c23)C1 ZINC001234125851 1036930168 /nfs/dbraw/zinc/93/01/68/1036930168.db2.gz YWHJTYOPJYQETG-GFCCVEGCSA-N 1 1 371.389 2.925 20 5 FFBDMO O=[N+]([O-])c1c[nH]cc2nc(O[C@H]3CCN4Cc5ccccc5[NH+]=C34)nc1-2 ZINC001230231505 1037163681 /nfs/dbraw/zinc/16/36/81/1037163681.db2.gz LXLUPMQHGDVYTQ-AWEZNQCLSA-N 1 1 350.338 2.563 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@@H]2CCC[N@@H+]([C@H](C)c3ccccn3)C2)n1 ZINC001234881023 1037221987 /nfs/dbraw/zinc/22/19/87/1037221987.db2.gz KXFITKCMJBRMKS-ZIAGYGMSSA-N 1 1 358.398 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)n1 ZINC001234881023 1037221997 /nfs/dbraw/zinc/22/19/97/1037221997.db2.gz KXFITKCMJBRMKS-ZIAGYGMSSA-N 1 1 358.398 2.998 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C[C@]2(C)C1 ZINC001536776298 1070056499 /nfs/dbraw/zinc/05/64/99/1070056499.db2.gz PJYZXWJOAVQLLW-BZNIZROVSA-N 1 1 369.874 2.750 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001230639070 1037326110 /nfs/dbraw/zinc/32/61/10/1037326110.db2.gz RENICGJYOLZVKR-HNNXBMFYSA-N 1 1 350.463 2.975 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1O[C@@H]1C[NH+]2CCC1CC2 ZINC001231236692 1037508334 /nfs/dbraw/zinc/50/83/34/1037508334.db2.gz OZVWNIRDXGKGHI-GFCCVEGCSA-N 1 1 361.276 2.995 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H]3C(C)(C)O)CC2)ccc1[N+](=O)[O-] ZINC001256100773 1038383604 /nfs/dbraw/zinc/38/36/04/1038383604.db2.gz OSUWHNCMULXFKO-SFHVURJKSA-N 1 1 363.458 2.808 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H]4OCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100775 1038384202 /nfs/dbraw/zinc/38/42/02/1038384202.db2.gz OTBJXHXCQXEJRO-KDOFPFPSSA-N 1 1 361.442 2.683 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCCC34COC4)CC2)ccc1[N+](=O)[O-] ZINC001256099195 1038384933 /nfs/dbraw/zinc/38/49/33/1038384933.db2.gz NCXJQSWMYQHABU-UHFFFAOYSA-N 1 1 361.442 2.827 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC001251486449 1039154721 /nfs/dbraw/zinc/15/47/21/1039154721.db2.gz RRNSBQOSXLXGBW-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@H+](Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC001251486449 1039154730 /nfs/dbraw/zinc/15/47/30/1039154730.db2.gz RRNSBQOSXLXGBW-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@@H+](Cc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC001251486449 1039154733 /nfs/dbraw/zinc/15/47/33/1039154733.db2.gz RRNSBQOSXLXGBW-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC[C@H]1CSCC[N@H+]1Cc1ccccc1 ZINC001258133892 1039210675 /nfs/dbraw/zinc/21/06/75/1039210675.db2.gz LVBPWNBVSKJPPU-INIZCTEOSA-N 1 1 358.467 2.750 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001246898310 1039524421 /nfs/dbraw/zinc/52/44/21/1039524421.db2.gz YIVGWNOLHRKMLZ-ZACQAIPSSA-N 1 1 357.571 2.798 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001246898310 1039524438 /nfs/dbraw/zinc/52/44/38/1039524438.db2.gz YIVGWNOLHRKMLZ-ZACQAIPSSA-N 1 1 357.571 2.798 20 5 FFBDMO CN1C[C@]2(CC1=O)CCCC[N@H+]2C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254473827 1040739275 /nfs/dbraw/zinc/73/92/75/1040739275.db2.gz CCUPOUPAEGDSMR-HXUWFJFHSA-N 1 1 372.469 2.650 20 5 FFBDMO O=C1CCC[C@]2(CCC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)N1 ZINC001254476447 1040743535 /nfs/dbraw/zinc/74/35/35/1040743535.db2.gz HYHVNVBAAMJSGC-HXUWFJFHSA-N 1 1 372.469 2.698 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC[N@@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001254550985 1040792556 /nfs/dbraw/zinc/79/25/56/1040792556.db2.gz UXMUGNRTCIOWSM-FXAWDEMLSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001254550985 1040792582 /nfs/dbraw/zinc/79/25/82/1040792582.db2.gz UXMUGNRTCIOWSM-FXAWDEMLSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001254550985 1040792591 /nfs/dbraw/zinc/79/25/91/1040792591.db2.gz UXMUGNRTCIOWSM-FXAWDEMLSA-N 1 1 369.465 2.705 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001254563212 1040798851 /nfs/dbraw/zinc/79/88/51/1040798851.db2.gz XXFQMYIQXKAHJO-RHSMWYFYSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1 ZINC001254560958 1040799752 /nfs/dbraw/zinc/79/97/52/1040799752.db2.gz IOPSDROTWBMVTC-YTQUADARSA-N 1 1 366.465 2.985 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C[C@H]2COC ZINC001254563400 1040802033 /nfs/dbraw/zinc/80/20/33/1040802033.db2.gz ZTFBPUOIJFQFPR-ZBFHGGJFSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C[C@H]2COC ZINC001254563400 1040802052 /nfs/dbraw/zinc/80/20/52/1040802052.db2.gz ZTFBPUOIJFQFPR-ZBFHGGJFSA-N 1 1 358.442 2.988 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593984 1040821626 /nfs/dbraw/zinc/82/16/26/1040821626.db2.gz OTMBFGDDTXMBHI-ULQDDVLXSA-N 1 1 359.426 2.756 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593984 1040821633 /nfs/dbraw/zinc/82/16/33/1040821633.db2.gz OTMBFGDDTXMBHI-ULQDDVLXSA-N 1 1 359.426 2.756 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@H](F)[C@@](O)(C(F)(F)F)CC1)C2 ZINC001254593151 1040823137 /nfs/dbraw/zinc/82/31/37/1040823137.db2.gz JJDFGGVOJIHBJZ-QLFBSQMISA-N 1 1 362.323 2.789 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(CCOc3ccccc3)CC1)C2 ZINC001254597414 1040827166 /nfs/dbraw/zinc/82/71/66/1040827166.db2.gz DHQVMNOPJCCEAJ-FQEVSTJZSA-N 1 1 367.449 2.759 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[NH+](CCOc3ccccc3)CC1)C2 ZINC001254597414 1040827178 /nfs/dbraw/zinc/82/71/78/1040827178.db2.gz DHQVMNOPJCCEAJ-FQEVSTJZSA-N 1 1 367.449 2.759 20 5 FFBDMO O=C1N(CC2CC2)CC[C@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599397 1040830135 /nfs/dbraw/zinc/83/01/35/1040830135.db2.gz YURVOZWMEHPHSZ-CTNGQTDRSA-N 1 1 369.465 2.787 20 5 FFBDMO O=C([C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)N1CCCCC1 ZINC001254601384 1040832945 /nfs/dbraw/zinc/83/29/45/1040832945.db2.gz ZATBEAMGWYOION-QFBILLFUSA-N 1 1 357.454 2.787 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)n1 ZINC001537964484 1070305062 /nfs/dbraw/zinc/30/50/62/1070305062.db2.gz FYNVECPMSRUMQC-LJQANCHMSA-N 1 1 368.437 2.939 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC001538547511 1070451297 /nfs/dbraw/zinc/45/12/97/1070451297.db2.gz ZECRQIFHYPLJTI-QGZVFWFLSA-N 1 1 358.442 2.738 20 5 FFBDMO Cc1ccc(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC001310095965 1043634743 /nfs/dbraw/zinc/63/47/43/1043634743.db2.gz CVOXGVHXVHWZLH-DZGCQCFKSA-N 1 1 350.444 2.605 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001310520082 1043700859 /nfs/dbraw/zinc/70/08/59/1043700859.db2.gz VSZWXIMHVRJQHH-INIZCTEOSA-N 1 1 369.425 2.506 20 5 FFBDMO CC[N@@H+](CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1)C1CC1 ZINC001313805565 1044425364 /nfs/dbraw/zinc/42/53/64/1044425364.db2.gz KZIDHAPQEYUMCG-UHFFFAOYSA-N 1 1 370.457 2.938 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]CCC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280363040 1044641251 /nfs/dbraw/zinc/64/12/51/1044641251.db2.gz SLVSVSQIWXTRDY-BRSBDYLESA-N 1 1 351.491 2.887 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001318785347 1044876060 /nfs/dbraw/zinc/87/60/60/1044876060.db2.gz PIERKRZEGRFCAZ-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001318785347 1044876085 /nfs/dbraw/zinc/87/60/85/1044876085.db2.gz PIERKRZEGRFCAZ-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001539394165 1070629409 /nfs/dbraw/zinc/62/94/09/1070629409.db2.gz CHTLTFITIYKEFU-CQSZACIVSA-N 1 1 360.439 2.932 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001320810953 1045472573 /nfs/dbraw/zinc/47/25/73/1045472573.db2.gz KOVGDXARTWRMRB-OCCSQVGLSA-N 1 1 367.833 2.712 20 5 FFBDMO Cc1cnc(COC(=O)c2ccn(-c3cc[nH+]cc3)n2)c(C)c1[N+](=O)[O-] ZINC001320929143 1045496388 /nfs/dbraw/zinc/49/63/88/1045496388.db2.gz UPYBBNDVNHSUEJ-UHFFFAOYSA-N 1 1 353.338 2.544 20 5 FFBDMO CC(C)n1cnnc1[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001324939953 1046297046 /nfs/dbraw/zinc/29/70/46/1046297046.db2.gz BURRXQQOQIEMFK-NVXWUHKLSA-N 1 1 359.430 2.680 20 5 FFBDMO Cc1ccc(NC(=O)[C@]2(O)CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001540600344 1070944869 /nfs/dbraw/zinc/94/48/69/1070944869.db2.gz IWVLLBHILKNKOQ-FQEVSTJZSA-N 1 1 369.421 2.869 20 5 FFBDMO COCn1ncc(C)c1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC001333646260 1049027512 /nfs/dbraw/zinc/02/75/12/1049027512.db2.gz NMDUNQYOOKEWGX-UHFFFAOYSA-N 1 1 360.414 2.747 20 5 FFBDMO COC(=O)/C=C\c1ccc(N[C@@H]2CCC[N@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153575 1049434743 /nfs/dbraw/zinc/43/47/43/1049434743.db2.gz ZREYMPCLEBOTQN-BRLPQQTGSA-N 1 1 351.378 2.627 20 5 FFBDMO COC(=O)/C=C\c1ccc(N[C@@H]2CCC[N@@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153575 1049434748 /nfs/dbraw/zinc/43/47/48/1049434748.db2.gz ZREYMPCLEBOTQN-BRLPQQTGSA-N 1 1 351.378 2.627 20 5 FFBDMO CC(C)[NH+]1CC(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC001296601153 1050075445 /nfs/dbraw/zinc/07/54/45/1050075445.db2.gz PSGUISOGWYQOEQ-UHFFFAOYSA-N 1 1 360.458 2.654 20 5 FFBDMO NC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001341604388 1050230503 /nfs/dbraw/zinc/23/05/03/1050230503.db2.gz IWLHMWASNJERPN-NSHDSACASA-N 1 1 364.789 2.751 20 5 FFBDMO CC(C)c1[nH+]ccn1CC(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001303529619 1051376609 /nfs/dbraw/zinc/37/66/09/1051376609.db2.gz WEOXYSHGXPCTJY-UHFFFAOYSA-N 1 1 370.413 2.540 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC001303722998 1051435073 /nfs/dbraw/zinc/43/50/73/1051435073.db2.gz MCCQTKLZHRVNRI-UHFFFAOYSA-N 1 1 357.414 2.996 20 5 FFBDMO Cc1nnc(N(C)CCc2ccccc2[N+](=O)[O-])n1C[C@H](C)[N@@H+](C)C1CC1 ZINC001304796817 1051703211 /nfs/dbraw/zinc/70/32/11/1051703211.db2.gz IOPMYLQJFLOTGW-AWEZNQCLSA-N 1 1 372.473 2.656 20 5 FFBDMO C[C@H](CNC(=O)[C@@H]1[NH2+]CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC001341429230 1051785114 /nfs/dbraw/zinc/78/51/14/1051785114.db2.gz QNTOVKUUYDZQKH-FZKQIMNGSA-N 1 1 355.394 2.538 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC001339267976 1052255512 /nfs/dbraw/zinc/25/55/12/1052255512.db2.gz YQYXDNUOEKBUTE-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3COC4(CCCCC4)O3)C2)nc1 ZINC001307544206 1052319675 /nfs/dbraw/zinc/31/96/75/1052319675.db2.gz DPRQZOCNYYDXKJ-ZBFHGGJFSA-N 1 1 362.430 2.552 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@@H]2C[C@H](OC)C23CCC3)c([N+](=O)[O-])c1 ZINC001307772093 1052348385 /nfs/dbraw/zinc/34/83/85/1052348385.db2.gz QOBSCICIJDJVLT-SJORKVTESA-N 1 1 350.415 2.872 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001308167517 1052423249 /nfs/dbraw/zinc/42/32/49/1052423249.db2.gz TWKRNPLJLFATIU-UHFFFAOYSA-N 1 1 368.397 2.758 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1N1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC001343916843 1052487385 /nfs/dbraw/zinc/48/73/85/1052487385.db2.gz OXNRIVRTRXXLAR-OAHLLOKOSA-N 1 1 369.469 2.780 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCO[C@H]1C1CC1 ZINC001346134160 1052762283 /nfs/dbraw/zinc/76/22/83/1052762283.db2.gz IWVBFHRKQYXJBG-KSZLIROESA-N 1 1 360.410 2.527 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCO[C@H]1C1CC1 ZINC001346134160 1052762285 /nfs/dbraw/zinc/76/22/85/1052762285.db2.gz IWVBFHRKQYXJBG-KSZLIROESA-N 1 1 360.410 2.527 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001344750398 1052914888 /nfs/dbraw/zinc/91/48/88/1052914888.db2.gz XFLVVYRPMGBBBM-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001348361232 1054653039 /nfs/dbraw/zinc/65/30/39/1054653039.db2.gz CDDMLAZHDRTAMF-AEFFLSMTSA-N 1 1 370.409 2.623 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)[C@H]2C1 ZINC001338298998 1055400005 /nfs/dbraw/zinc/40/00/05/1055400005.db2.gz XVCCKHMVKCFHQA-JQFCIGGWSA-N 1 1 358.442 2.583 20 5 FFBDMO CCOC(=O)C[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC001338448676 1055524296 /nfs/dbraw/zinc/52/42/96/1055524296.db2.gz OWTDIOJOVHOSDC-ZDUSSCGKSA-N 1 1 352.387 2.530 20 5 FFBDMO CCOC(=O)C[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC001338448676 1055524310 /nfs/dbraw/zinc/52/43/10/1055524310.db2.gz OWTDIOJOVHOSDC-ZDUSSCGKSA-N 1 1 352.387 2.530 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1 ZINC001300097455 1055748480 /nfs/dbraw/zinc/74/84/80/1055748480.db2.gz OGSCYWQRYQKYTB-QGZVFWFLSA-N 1 1 363.458 2.861 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Oc2cccc([N+](=O)[O-])c2)[C@H](c2cnn(C)c2)C1 ZINC000849487692 1056872943 /nfs/dbraw/zinc/87/29/43/1056872943.db2.gz FBLCPNPGHVWRPG-MSOLQXFVSA-N 1 1 372.425 2.748 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCCc2ccccc2Cl)CC1 ZINC001200471826 1058300667 /nfs/dbraw/zinc/30/06/67/1058300667.db2.gz JNVRLBKBTLYNGF-NVXWUHKLSA-N 1 1 365.861 2.518 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])C2)c1 ZINC001454307533 1059494774 /nfs/dbraw/zinc/49/47/74/1059494774.db2.gz CJVDAZOVADWSRN-KRWDZBQOSA-N 1 1 371.412 2.976 20 5 FFBDMO CC(C)[N@@H+](CCO)CC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC001515988909 1059922704 /nfs/dbraw/zinc/92/27/04/1059922704.db2.gz MYPXWYVMRSQTLJ-UHFFFAOYSA-N 1 1 356.854 2.562 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC[C@H](OC4CCC4)C3)n2)c1 ZINC000848497218 1060165653 /nfs/dbraw/zinc/16/56/53/1060165653.db2.gz JNTGEPSZCDJPDA-KRWDZBQOSA-N 1 1 357.414 2.844 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H](OC4CCC4)C3)n2)c1 ZINC000848497218 1060165659 /nfs/dbraw/zinc/16/56/59/1060165659.db2.gz JNTGEPSZCDJPDA-KRWDZBQOSA-N 1 1 357.414 2.844 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3c(F)cccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC001457061840 1060267039 /nfs/dbraw/zinc/26/70/39/1060267039.db2.gz NSUYOSRCERVCCK-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO CC(C)[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC001457091754 1060274440 /nfs/dbraw/zinc/27/44/40/1060274440.db2.gz ZOVWMKGFIARFCA-RHSMWYFYSA-N 1 1 371.441 2.806 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000848585179 1060314438 /nfs/dbraw/zinc/31/44/38/1060314438.db2.gz MVHKJARKJBATEW-IUODEOHRSA-N 1 1 369.368 2.509 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC001517276322 1060432855 /nfs/dbraw/zinc/43/28/55/1060432855.db2.gz OVHPTTVVOUUTLA-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC001517276322 1060432859 /nfs/dbraw/zinc/43/28/59/1060432859.db2.gz OVHPTTVVOUUTLA-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+](CCCO)C2CC2)o1 ZINC001459611721 1060779797 /nfs/dbraw/zinc/77/97/97/1060779797.db2.gz DOAKLOGBCXRIBC-UHFFFAOYSA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+](CCCO)C2CC2)o1 ZINC001459611721 1060779810 /nfs/dbraw/zinc/77/98/10/1060779810.db2.gz DOAKLOGBCXRIBC-UHFFFAOYSA-N 1 1 352.778 2.645 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)[C@H](C)c1ccccc1 ZINC001459783064 1060818648 /nfs/dbraw/zinc/81/86/48/1060818648.db2.gz AFSZLZALFZRITN-OAHLLOKOSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@H](C)c1ccccc1 ZINC001459783064 1060818657 /nfs/dbraw/zinc/81/86/57/1060818657.db2.gz AFSZLZALFZRITN-OAHLLOKOSA-N 1 1 357.410 2.897 20 5 FFBDMO CCC(=O)NC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001460776810 1061097266 /nfs/dbraw/zinc/09/72/66/1061097266.db2.gz FFGUVMOBHXMZLH-GFCCVEGCSA-N 1 1 373.413 2.696 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](C3CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460834767 1061121716 /nfs/dbraw/zinc/12/17/16/1061121716.db2.gz NNBYRLLFUFTTAV-QFBILLFUSA-N 1 1 373.453 2.839 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001460898221 1061143432 /nfs/dbraw/zinc/14/34/32/1061143432.db2.gz FBZMWMHGHIRBOJ-BWACUDIHSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001460898221 1061143439 /nfs/dbraw/zinc/14/34/39/1061143439.db2.gz FBZMWMHGHIRBOJ-BWACUDIHSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001460898226 1061143525 /nfs/dbraw/zinc/14/35/25/1061143525.db2.gz FBZMWMHGHIRBOJ-NVGCLXPQSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001460898226 1061143533 /nfs/dbraw/zinc/14/35/33/1061143533.db2.gz FBZMWMHGHIRBOJ-NVGCLXPQSA-N 1 1 365.455 2.615 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001460950447 1061163278 /nfs/dbraw/zinc/16/32/78/1061163278.db2.gz QJOYLRZOCFTFAW-PKOBYXMFSA-N 1 1 372.421 2.798 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@]12CCCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001460982699 1061177091 /nfs/dbraw/zinc/17/70/91/1061177091.db2.gz XOFKFUWRVINFOD-LJQANCHMSA-N 1 1 359.426 2.519 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@]12CCCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001460982699 1061177097 /nfs/dbraw/zinc/17/70/97/1061177097.db2.gz XOFKFUWRVINFOD-LJQANCHMSA-N 1 1 359.426 2.519 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c(C)c1[N+](=O)[O-] ZINC001463659366 1062200540 /nfs/dbraw/zinc/20/05/40/1062200540.db2.gz QCNZSKMZYJFTEP-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c(C)c1[N+](=O)[O-] ZINC001463659366 1062200556 /nfs/dbraw/zinc/20/05/56/1062200556.db2.gz QCNZSKMZYJFTEP-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H](C)C2)n1 ZINC001525879414 1063447583 /nfs/dbraw/zinc/44/75/83/1063447583.db2.gz UYPVRWWBGLXIEW-OAHLLOKOSA-N 1 1 368.437 2.892 20 5 FFBDMO O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001467548686 1063777993 /nfs/dbraw/zinc/77/79/93/1063777993.db2.gz UNSJGDYHXKYREI-KBPBESRZSA-N 1 1 370.409 2.733 20 5 FFBDMO CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC[N@@H+]1CCO ZINC001467549419 1063778070 /nfs/dbraw/zinc/77/80/70/1063778070.db2.gz QSXCVANAIHFHBB-UHFFFAOYSA-N 1 1 372.425 2.668 20 5 FFBDMO CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC[N@H+]1CCO ZINC001467549419 1063778079 /nfs/dbraw/zinc/77/80/79/1063778079.db2.gz QSXCVANAIHFHBB-UHFFFAOYSA-N 1 1 372.425 2.668 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC001470710395 1064420911 /nfs/dbraw/zinc/42/09/11/1064420911.db2.gz CTWJHLUFDXKYSW-QGZVFWFLSA-N 1 1 369.421 2.673 20 5 FFBDMO COc1cccc(C(=O)N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC001471093485 1064554750 /nfs/dbraw/zinc/55/47/50/1064554750.db2.gz QVNDUEGSKOJUGK-UHFFFAOYSA-N 1 1 367.405 2.561 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 ZINC001472591213 1065106186 /nfs/dbraw/zinc/10/61/86/1065106186.db2.gz VJVIIXUCJDMVLT-UHFFFAOYSA-N 1 1 354.370 2.909 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c([N+](=O)[O-])c1 ZINC001472859586 1065160464 /nfs/dbraw/zinc/16/04/64/1065160464.db2.gz LJLHYNJIEWHFDU-INIZCTEOSA-N 1 1 370.409 2.771 20 5 FFBDMO CCC[C@H]1CCC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001473260486 1065230940 /nfs/dbraw/zinc/23/09/40/1065230940.db2.gz XLVWUWCNCLAVFC-KRWDZBQOSA-N 1 1 374.485 2.756 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001473767810 1065353071 /nfs/dbraw/zinc/35/30/71/1065353071.db2.gz NDQYNFRSGCODTP-KGLIPLIRSA-N 1 1 363.414 2.587 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCO[C@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC001473769555 1065353207 /nfs/dbraw/zinc/35/32/07/1065353207.db2.gz VJDJLAIFTWCTRS-RKVPGOIHSA-N 1 1 363.458 2.957 20 5 FFBDMO C[N@@H+]1C[C@@]23CN(CCC(=O)Nc4ccccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001473902287 1065412998 /nfs/dbraw/zinc/41/29/98/1065412998.db2.gz SDOCXJRBWCMDSU-BGYRXZFFSA-N 1 1 372.469 2.731 20 5 FFBDMO C[N@H+]1C[C@@]23CN(CCC(=O)Nc4ccccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001473902287 1065413001 /nfs/dbraw/zinc/41/30/01/1065413001.db2.gz SDOCXJRBWCMDSU-BGYRXZFFSA-N 1 1 372.469 2.731 20 5 FFBDMO CN1C[C@]23C[N@H+](CCC(=O)Nc4ccccc4[N+](=O)[O-])C[C@@]2(C1)CCCC3 ZINC001473902287 1065413008 /nfs/dbraw/zinc/41/30/08/1065413008.db2.gz SDOCXJRBWCMDSU-BGYRXZFFSA-N 1 1 372.469 2.731 20 5 FFBDMO CN1C[C@]23C[N@@H+](CCC(=O)Nc4ccccc4[N+](=O)[O-])C[C@@]2(C1)CCCC3 ZINC001473902287 1065413013 /nfs/dbraw/zinc/41/30/13/1065413013.db2.gz SDOCXJRBWCMDSU-BGYRXZFFSA-N 1 1 372.469 2.731 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)Nc1nc(-c3ccc([N+](=O)[O-])cc3)c[nH]1)C2 ZINC001559006323 1076114558 /nfs/dbraw/zinc/11/45/58/1076114558.db2.gz DUEZEBMUXODMKN-CYBMUJFWSA-N 1 1 366.381 2.691 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC001559255626 1076140198 /nfs/dbraw/zinc/14/01/98/1076140198.db2.gz YBYQXLDZMSUXFL-HOCLYGCPSA-N 1 1 368.437 2.874 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)c1C ZINC001561945631 1076451245 /nfs/dbraw/zinc/45/12/45/1076451245.db2.gz GGWAZKMJKQNCJI-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(-c2ccsc2)cc1 ZINC001567281884 1077011329 /nfs/dbraw/zinc/01/13/29/1077011329.db2.gz XBWLXRIGXHHXAI-IAGOWNOFSA-N 1 1 359.451 2.628 20 5 FFBDMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(-c2ccsc2)cc1 ZINC001567281884 1077011334 /nfs/dbraw/zinc/01/13/34/1077011334.db2.gz XBWLXRIGXHHXAI-IAGOWNOFSA-N 1 1 359.451 2.628 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(-c2ccsc2)cc1 ZINC001567281884 1077011339 /nfs/dbraw/zinc/01/13/39/1077011339.db2.gz XBWLXRIGXHHXAI-IAGOWNOFSA-N 1 1 359.451 2.628 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C ZINC001586370756 1079613730 /nfs/dbraw/zinc/61/37/30/1079613730.db2.gz LHTHYIIXTJIVCQ-LPWJVIDDSA-N 1 1 369.849 2.955 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1N)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001587795166 1079866053 /nfs/dbraw/zinc/86/60/53/1079866053.db2.gz VVCFUCXBCDCULQ-QGZVFWFLSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001590049407 1080978223 /nfs/dbraw/zinc/97/82/23/1080978223.db2.gz OYRGXAUOICIKCX-GFCCVEGCSA-N 1 1 350.382 2.894 20 5 FFBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001590049407 1080978226 /nfs/dbraw/zinc/97/82/26/1080978226.db2.gz OYRGXAUOICIKCX-GFCCVEGCSA-N 1 1 350.382 2.894 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093755762 250046296 /nfs/dbraw/zinc/04/62/96/250046296.db2.gz OMDXQILNNPLGPT-GFCCVEGCSA-N 1 1 360.357 2.681 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093755762 250046301 /nfs/dbraw/zinc/04/63/01/250046301.db2.gz OMDXQILNNPLGPT-GFCCVEGCSA-N 1 1 360.357 2.681 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCc1ccccn1 ZINC000152931249 251083256 /nfs/dbraw/zinc/08/32/56/251083256.db2.gz KOARCKKDJSIKQG-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CCC[N@H+]1CC[C@H](CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272493735 252051183 /nfs/dbraw/zinc/05/11/83/252051183.db2.gz FINBPQBHNFXJQE-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272551357 252066689 /nfs/dbraw/zinc/06/66/89/252066689.db2.gz RIVYAZDWBLASMF-ZWKOTPCHSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@@H]1C[C@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000272568323 252068804 /nfs/dbraw/zinc/06/88/04/252068804.db2.gz VJARECJRWDPNJW-QIIPPGSGSA-N 1 1 355.442 2.633 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272572400 252071010 /nfs/dbraw/zinc/07/10/10/252071010.db2.gz QXPBVECKZHRTHY-NSHDSACASA-N 1 1 352.341 2.644 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000272604401 252079627 /nfs/dbraw/zinc/07/96/27/252079627.db2.gz YYBYDVUWTAOWQY-QMTHXVAHSA-N 1 1 368.231 2.524 20 5 FFBDMO CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272785069 252131151 /nfs/dbraw/zinc/13/11/51/252131151.db2.gz ZZVTXSVLBIUKLI-HNNXBMFYSA-N 1 1 355.398 2.728 20 5 FFBDMO CCOc1ccccc1C[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000273371445 252292767 /nfs/dbraw/zinc/29/27/67/252292767.db2.gz FFDAXDOSSOBTKK-UHFFFAOYSA-N 1 1 364.423 2.557 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000273390014 252294923 /nfs/dbraw/zinc/29/49/23/252294923.db2.gz UQUBJSMPWOSZDF-CYBMUJFWSA-N 1 1 362.348 2.999 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000276037069 256067310 /nfs/dbraw/zinc/06/73/10/256067310.db2.gz SDDNPIRBQAGSCM-PKOBYXMFSA-N 1 1 366.421 2.611 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000277074538 256158519 /nfs/dbraw/zinc/15/85/19/256158519.db2.gz TTYVTEFDPBGFLY-MAUKXSAKSA-N 1 1 372.469 2.751 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000277199421 256171503 /nfs/dbraw/zinc/17/15/03/256171503.db2.gz FKYUVUSDSZOFAY-SUMWQHHRSA-N 1 1 359.426 2.692 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277753678 256235460 /nfs/dbraw/zinc/23/54/60/256235460.db2.gz CIBUAJBVCWQMSV-MRXNPFEDSA-N 1 1 356.426 2.752 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000277834421 256245699 /nfs/dbraw/zinc/24/56/99/256245699.db2.gz RRZLRGWBHQGEHR-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO COCCOc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000278748164 256344269 /nfs/dbraw/zinc/34/42/69/256344269.db2.gz RWZRCRDLZJPWGD-UHFFFAOYSA-N 1 1 356.382 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])c1 ZINC000278900837 256360199 /nfs/dbraw/zinc/36/01/99/256360199.db2.gz QYVDCTQBACVIFR-ZDUSSCGKSA-N 1 1 372.385 2.878 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])c1 ZINC000278900837 256360202 /nfs/dbraw/zinc/36/02/02/256360202.db2.gz QYVDCTQBACVIFR-ZDUSSCGKSA-N 1 1 372.385 2.878 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@]2(CO)CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000284905443 256958076 /nfs/dbraw/zinc/95/80/76/256958076.db2.gz VAJIGTGLRAHVMB-GOSISDBHSA-N 1 1 357.366 2.817 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000286720111 257051466 /nfs/dbraw/zinc/05/14/66/257051466.db2.gz DZDRDQIESMUGSV-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO C[C@@H](CO)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1 ZINC000287598151 257097999 /nfs/dbraw/zinc/09/79/99/257097999.db2.gz DCFOYVUCMVWXAS-LBPRGKRZSA-N 1 1 353.394 2.688 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1 ZINC000289403845 257279327 /nfs/dbraw/zinc/27/93/27/257279327.db2.gz GDZWVQIKPIXANS-ICSRJNTNSA-N 1 1 353.422 2.765 20 5 FFBDMO Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000290612113 257346611 /nfs/dbraw/zinc/34/66/11/257346611.db2.gz ZFTKNDUMKQPQDY-UHFFFAOYSA-N 1 1 370.457 2.845 20 5 FFBDMO O=c1[nH]cnc2cc(NCC[N@@H+]3CCc4sccc4C3)c([N+](=O)[O-])cc12 ZINC000301061757 258022377 /nfs/dbraw/zinc/02/23/77/258022377.db2.gz CEFDPMHDRIOURH-UHFFFAOYSA-N 1 1 371.422 2.775 20 5 FFBDMO O=c1[nH]cnc2cc(NCC[N@H+]3CCc4sccc4C3)c([N+](=O)[O-])cc12 ZINC000301061757 258022378 /nfs/dbraw/zinc/02/23/78/258022378.db2.gz CEFDPMHDRIOURH-UHFFFAOYSA-N 1 1 371.422 2.775 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(CNc3ccccc3[N+](=O)[O-])c2)C1 ZINC000301204950 258034189 /nfs/dbraw/zinc/03/41/89/258034189.db2.gz OSTBLXSQVJXBPI-QGZVFWFLSA-N 1 1 368.437 2.904 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000301235598 258035447 /nfs/dbraw/zinc/03/54/47/258035447.db2.gz LSWDNICGGZTJEY-HNNXBMFYSA-N 1 1 371.441 2.846 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)n1 ZINC000302071618 258086035 /nfs/dbraw/zinc/08/60/35/258086035.db2.gz YQSNDXUQMVIWTK-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1N1CC[NH+](CCOc3ccccc3)CC1)CCN2 ZINC000302487505 258103263 /nfs/dbraw/zinc/10/32/63/258103263.db2.gz XYONVGQNOUSLIO-UHFFFAOYSA-N 1 1 368.437 2.764 20 5 FFBDMO COC(=O)c1cnc(NC[C@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000302659415 258107392 /nfs/dbraw/zinc/10/73/92/258107392.db2.gz ATGHDCLFDYCTBY-ZDUSSCGKSA-N 1 1 370.409 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1)CCN2 ZINC000302882849 258113650 /nfs/dbraw/zinc/11/36/50/258113650.db2.gz KGOXRUGFHDRWFC-JKSUJKDBSA-N 1 1 368.437 2.610 20 5 FFBDMO Cc1nc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000301736144 258065590 /nfs/dbraw/zinc/06/55/90/258065590.db2.gz VCAKYMNXXNUSGO-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO CC[NH+]1CCN([C@@H]2CCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000301984811 258080391 /nfs/dbraw/zinc/08/03/91/258080391.db2.gz CHKUCLQDBDSVCQ-MRXNPFEDSA-N 1 1 369.469 2.668 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NCC3=CC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000332055484 258211836 /nfs/dbraw/zinc/21/18/36/258211836.db2.gz NDZDUYLTQFCAIO-OAHLLOKOSA-N 1 1 372.469 2.823 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000332331075 258225585 /nfs/dbraw/zinc/22/55/85/258225585.db2.gz QIGNCCSOIYPIGV-FZKQIMNGSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000332369274 258227539 /nfs/dbraw/zinc/22/75/39/258227539.db2.gz AAZSXRXAXMOFGW-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332659276 258239325 /nfs/dbraw/zinc/23/93/25/258239325.db2.gz WOYUNVWDZNIXGX-CMPLNLGQSA-N 1 1 355.341 2.505 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000064960244 506245670 /nfs/dbraw/zinc/24/56/70/506245670.db2.gz FCMBZPIDEOGBBO-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO C[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCC[C@@H](C)C1 ZINC000065867395 506382075 /nfs/dbraw/zinc/38/20/75/506382075.db2.gz SHXOTTZEGUEUEF-CABCVRRESA-N 1 1 358.442 2.786 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cn1 ZINC000366779871 512183603 /nfs/dbraw/zinc/18/36/03/512183603.db2.gz QVTXZEXRXLMKAA-UHFFFAOYSA-N 1 1 367.365 2.810 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)Nc1ccc(Cl)cc1 ZINC000373237610 512235467 /nfs/dbraw/zinc/23/54/67/512235467.db2.gz SSJRIVFPEQDOCH-UHFFFAOYSA-N 1 1 363.805 2.720 20 5 FFBDMO Cc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373247345 512239271 /nfs/dbraw/zinc/23/92/71/512239271.db2.gz YRFNYQDORJPXST-CQSZACIVSA-N 1 1 357.414 2.764 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000066474329 506529776 /nfs/dbraw/zinc/52/97/76/506529776.db2.gz SKXQGIPMWDDVTL-JKSUJKDBSA-N 1 1 363.458 2.990 20 5 FFBDMO C[N@H+](Cc1ccc(F)c(F)c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000044380874 506840149 /nfs/dbraw/zinc/84/01/49/506840149.db2.gz LAIAKCOEGLTNON-AWEZNQCLSA-N 1 1 352.337 2.745 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000045079928 506916372 /nfs/dbraw/zinc/91/63/72/506916372.db2.gz XLVNSGUCKCQKJM-CQSZACIVSA-N 1 1 355.460 2.523 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000014920843 507005360 /nfs/dbraw/zinc/00/53/60/507005360.db2.gz FUIFIZZCLVRNKF-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000014920843 507005363 /nfs/dbraw/zinc/00/53/63/507005363.db2.gz FUIFIZZCLVRNKF-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000367050036 512314241 /nfs/dbraw/zinc/31/42/41/512314241.db2.gz LMJQVZIUMHCSJR-INIZCTEOSA-N 1 1 357.414 2.802 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC000068195857 507143841 /nfs/dbraw/zinc/14/38/41/507143841.db2.gz VDDVPDOWMFPUOC-WDEREUQCSA-N 1 1 355.822 2.614 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000022498597 507296681 /nfs/dbraw/zinc/29/66/81/507296681.db2.gz MAJJXZDRAWAISZ-UHFFFAOYSA-N 1 1 369.421 2.708 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000057778263 507327352 /nfs/dbraw/zinc/32/73/52/507327352.db2.gz PXNXCSOCPJEONE-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO COC(=O)c1cccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000023815964 507376495 /nfs/dbraw/zinc/37/64/95/507376495.db2.gz PXZQTIOWCNMQGS-UHFFFAOYSA-N 1 1 355.394 2.704 20 5 FFBDMO CCCc1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000069156123 507424441 /nfs/dbraw/zinc/42/44/41/507424441.db2.gz TVNRBZKIGWHFGJ-UHFFFAOYSA-N 1 1 371.441 2.619 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[N@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000069156123 507424447 /nfs/dbraw/zinc/42/44/47/507424447.db2.gz TVNRBZKIGWHFGJ-UHFFFAOYSA-N 1 1 371.441 2.619 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000069156123 507424454 /nfs/dbraw/zinc/42/44/54/507424454.db2.gz TVNRBZKIGWHFGJ-UHFFFAOYSA-N 1 1 371.441 2.619 20 5 FFBDMO CCc1ccc(C[N@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000024795570 507438741 /nfs/dbraw/zinc/43/87/41/507438741.db2.gz GODWCESHPMJFNO-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO CCc1ccc(C[N@@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000024795570 507438747 /nfs/dbraw/zinc/43/87/47/507438747.db2.gz GODWCESHPMJFNO-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000025167021 507472912 /nfs/dbraw/zinc/47/29/12/507472912.db2.gz PWHLPGXGTBOWFL-UHFFFAOYSA-N 1 1 354.410 2.987 20 5 FFBDMO Cc1ccccc1OCC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027374167 507653811 /nfs/dbraw/zinc/65/38/11/507653811.db2.gz PPLYISCFZXTNLX-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027374167 507653818 /nfs/dbraw/zinc/65/38/18/507653818.db2.gz PPLYISCFZXTNLX-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO COc1cccc(N2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000051291711 507758259 /nfs/dbraw/zinc/75/82/59/507758259.db2.gz BCBMINPDMONSJP-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000072772421 507851620 /nfs/dbraw/zinc/85/16/20/507851620.db2.gz HRQQPIQVNTYACV-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000072772421 507851623 /nfs/dbraw/zinc/85/16/23/507851623.db2.gz HRQQPIQVNTYACV-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000072773056 507852480 /nfs/dbraw/zinc/85/24/80/507852480.db2.gz XELIKCIJYOWTNN-MRXNPFEDSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000072773056 507852483 /nfs/dbraw/zinc/85/24/83/507852483.db2.gz XELIKCIJYOWTNN-MRXNPFEDSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[NH+](CC)C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000072823446 507858109 /nfs/dbraw/zinc/85/81/09/507858109.db2.gz NEHAWUGAJCMTQL-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CN(CC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000107683745 507863602 /nfs/dbraw/zinc/86/36/02/507863602.db2.gz CMEGRFIWIQCTIP-UHFFFAOYSA-N 1 1 368.437 2.552 20 5 FFBDMO CN(CC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccccc1 ZINC000107683745 507863604 /nfs/dbraw/zinc/86/36/04/507863604.db2.gz CMEGRFIWIQCTIP-UHFFFAOYSA-N 1 1 368.437 2.552 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCS1 ZINC000072862682 507866043 /nfs/dbraw/zinc/86/60/43/507866043.db2.gz OCABZYKSEHATSX-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO COCCOC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089902379 507881474 /nfs/dbraw/zinc/88/14/74/507881474.db2.gz RACCPGVOOCOSHS-UHFFFAOYSA-N 1 1 361.398 2.877 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003581 507900208 /nfs/dbraw/zinc/90/02/08/507900208.db2.gz RWKLRSAWXQGHJF-OAHLLOKOSA-N 1 1 371.441 2.612 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000090590327 507929146 /nfs/dbraw/zinc/92/91/46/507929146.db2.gz KPTQQLBHZCGUDB-MRXNPFEDSA-N 1 1 363.801 2.563 20 5 FFBDMO Cn1cccc1[C@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000073641893 507941931 /nfs/dbraw/zinc/94/19/31/507941931.db2.gz WWRCTXKNLFVVMV-QGZVFWFLSA-N 1 1 354.410 2.660 20 5 FFBDMO Cn1cccc1[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000073641893 507941932 /nfs/dbraw/zinc/94/19/32/507941932.db2.gz WWRCTXKNLFVVMV-QGZVFWFLSA-N 1 1 354.410 2.660 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000074319848 508011968 /nfs/dbraw/zinc/01/19/68/508011968.db2.gz BAPZVSAHPRHSIU-UHFFFAOYSA-N 1 1 362.474 2.977 20 5 FFBDMO C[C@@H]1C[NH+](CC2CC[NH+](Cc3cc([O-])ccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000092586998 508084365 /nfs/dbraw/zinc/08/43/65/508084365.db2.gz KNKSHHSNXHKHEO-HUUCEWRRSA-N 1 1 363.458 2.622 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000092612740 508086684 /nfs/dbraw/zinc/08/66/84/508086684.db2.gz RVAMIQSYIPBRTN-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000111308101 508088910 /nfs/dbraw/zinc/08/89/10/508088910.db2.gz HLURCGZLGJDZSG-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000075588839 508120310 /nfs/dbraw/zinc/12/03/10/508120310.db2.gz FSMPWCOSJHILKC-ISTRZQFTSA-N 1 1 360.414 2.533 20 5 FFBDMO CCCc1n[nH]c(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122297 508140627 /nfs/dbraw/zinc/14/06/27/508140627.db2.gz JTBQCPLUQDAFIT-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122297 508140630 /nfs/dbraw/zinc/14/06/30/508140630.db2.gz JTBQCPLUQDAFIT-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122297 508140633 /nfs/dbraw/zinc/14/06/33/508140633.db2.gz JTBQCPLUQDAFIT-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)cc1 ZINC000093483727 508146441 /nfs/dbraw/zinc/14/64/41/508146441.db2.gz XBIKDVTXDWBWQP-IYBDPMFKSA-N 1 1 364.785 2.578 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000112310548 508173186 /nfs/dbraw/zinc/17/31/86/508173186.db2.gz RHBXJWNEXICZCD-GFCCVEGCSA-N 1 1 357.838 2.864 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000081569395 508191886 /nfs/dbraw/zinc/19/18/86/508191886.db2.gz LPKVKOWWGCWCQG-CQSZACIVSA-N 1 1 359.430 2.809 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)CC12CCCCC2 ZINC000081598758 508195093 /nfs/dbraw/zinc/19/50/93/508195093.db2.gz RYDRJVYGPOOQMS-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076483627 508212052 /nfs/dbraw/zinc/21/20/52/508212052.db2.gz LMQMEQIDLOSVLI-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000083415912 508245164 /nfs/dbraw/zinc/24/51/64/508245164.db2.gz LYWOBRHDYBLLOK-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@@H]1CC(C)C ZINC000113942113 508287301 /nfs/dbraw/zinc/28/73/01/508287301.db2.gz UBIVRPNEOHARLA-HNNXBMFYSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000113939598 508287424 /nfs/dbraw/zinc/28/74/24/508287424.db2.gz FZADILRLDLVJNZ-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000113939598 508287425 /nfs/dbraw/zinc/28/74/25/508287425.db2.gz FZADILRLDLVJNZ-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000114459510 508316229 /nfs/dbraw/zinc/31/62/29/508316229.db2.gz RCNQARJNFKIDOW-HOTGVXAUSA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@@H+](CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)Cc1ccccc1 ZINC000087061813 508334661 /nfs/dbraw/zinc/33/46/61/508334661.db2.gz UCXPVLRJAZBBTP-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000077839475 508383413 /nfs/dbraw/zinc/38/34/13/508383413.db2.gz UBUTYLMVLWRSAM-GOSISDBHSA-N 1 1 360.458 2.797 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNc2nc3sccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000115415173 508392959 /nfs/dbraw/zinc/39/29/59/508392959.db2.gz KHNNQCPDGFBAON-PHIMTYICSA-N 1 1 353.448 2.604 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2nc3sccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000115415173 508392961 /nfs/dbraw/zinc/39/29/61/508392961.db2.gz KHNNQCPDGFBAON-PHIMTYICSA-N 1 1 353.448 2.604 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000115436223 508394280 /nfs/dbraw/zinc/39/42/80/508394280.db2.gz ANFQMBWCORARBO-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000121779161 508417059 /nfs/dbraw/zinc/41/70/59/508417059.db2.gz KNXKELPOKAIJDE-INIZCTEOSA-N 1 1 358.442 2.753 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000156448103 508421638 /nfs/dbraw/zinc/42/16/38/508421638.db2.gz KGVRWCACPJFHLN-CQSZACIVSA-N 1 1 356.426 2.947 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC[C@@H]21 ZINC000133672309 508433106 /nfs/dbraw/zinc/43/31/06/508433106.db2.gz SPABZKQFWDOCBF-QAPCUYQASA-N 1 1 372.469 2.751 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153055859 508543074 /nfs/dbraw/zinc/54/30/74/508543074.db2.gz UBVGYQVOUXFAQR-MRXNPFEDSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153055859 508543078 /nfs/dbraw/zinc/54/30/78/508543078.db2.gz UBVGYQVOUXFAQR-MRXNPFEDSA-N 1 1 372.421 2.792 20 5 FFBDMO CC(C)(C)C[N@@H+](CCCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117340450 508593014 /nfs/dbraw/zinc/59/30/14/508593014.db2.gz GDKZVZPPMOXHJW-UHFFFAOYSA-N 1 1 365.430 2.623 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000128727444 508635619 /nfs/dbraw/zinc/63/56/19/508635619.db2.gz FWZXESUWEIKOQK-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000128727444 508635622 /nfs/dbraw/zinc/63/56/22/508635622.db2.gz FWZXESUWEIKOQK-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153774635 508645658 /nfs/dbraw/zinc/64/56/58/508645658.db2.gz TWUUVTZSDWJKBG-LESCRADOSA-N 1 1 363.458 2.645 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000153893843 508671988 /nfs/dbraw/zinc/67/19/88/508671988.db2.gz MNGYZXQYSGAADZ-SUMWQHHRSA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123493256 508695042 /nfs/dbraw/zinc/69/50/42/508695042.db2.gz UWPVULNMSRNPJZ-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000154011682 508698796 /nfs/dbraw/zinc/69/87/96/508698796.db2.gz PWRBFZODPJTKKC-GOSISDBHSA-N 1 1 360.458 2.607 20 5 FFBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136893952 508722992 /nfs/dbraw/zinc/72/29/92/508722992.db2.gz UBUDSOHOMVXJDQ-KUHUBIRLSA-N 1 1 367.409 2.902 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136939556 508726429 /nfs/dbraw/zinc/72/64/29/508726429.db2.gz DXKWFRWNTVWYGX-GDBMZVCRSA-N 1 1 356.426 2.704 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C[C@@H](O)c1cnn(C)c1 ZINC000371458237 512413447 /nfs/dbraw/zinc/41/34/47/512413447.db2.gz JXSAAUQJQXIBIB-SJLPKXTDSA-N 1 1 374.441 2.815 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124068258 508778673 /nfs/dbraw/zinc/77/86/73/508778673.db2.gz ABLFHMQMMMCBHJ-CZUORRHYSA-N 1 1 371.441 2.550 20 5 FFBDMO COc1cc(C[N@@H+]2CCOC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000369450746 512416958 /nfs/dbraw/zinc/41/69/58/512416958.db2.gz GAPUVNAAJGKELN-NSHDSACASA-N 1 1 360.357 2.716 20 5 FFBDMO COc1cc(C[N@H+]2CCOC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000369450746 512416963 /nfs/dbraw/zinc/41/69/63/512416963.db2.gz GAPUVNAAJGKELN-NSHDSACASA-N 1 1 360.357 2.716 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000124282338 508809577 /nfs/dbraw/zinc/80/95/77/508809577.db2.gz JDYMSZYKMKJCPQ-MRXNPFEDSA-N 1 1 362.474 2.881 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000130305397 508811015 /nfs/dbraw/zinc/81/10/15/508811015.db2.gz RUMVDZCWEDDAAB-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC000130305397 508811016 /nfs/dbraw/zinc/81/10/16/508811016.db2.gz RUMVDZCWEDDAAB-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[nH+]c1 ZINC000119610613 508828794 /nfs/dbraw/zinc/82/87/94/508828794.db2.gz AHNRMEHJYHMWLJ-UHFFFAOYSA-N 1 1 367.409 2.940 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000154857297 508870595 /nfs/dbraw/zinc/87/05/95/508870595.db2.gz HMMONBSMBJIFBS-MRXNPFEDSA-N 1 1 350.419 2.559 20 5 FFBDMO CS(=O)(=O)C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000154959658 508892515 /nfs/dbraw/zinc/89/25/15/508892515.db2.gz PYNMDZQWPWBYRV-ZBZNSMLMSA-N 1 1 360.435 2.984 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)Cc1cccc(N(C)C)c1 ZINC000159838848 508899475 /nfs/dbraw/zinc/89/94/75/508899475.db2.gz WJRPZNHALAFCIW-UHFFFAOYSA-N 1 1 372.425 2.740 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159838848 508899478 /nfs/dbraw/zinc/89/94/78/508899478.db2.gz WJRPZNHALAFCIW-UHFFFAOYSA-N 1 1 372.425 2.740 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCCO)CC1 ZINC000155065874 508916114 /nfs/dbraw/zinc/91/61/14/508916114.db2.gz RASAUYDSUPKAJY-UHFFFAOYSA-N 1 1 352.431 2.745 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000120161144 508940287 /nfs/dbraw/zinc/94/02/87/508940287.db2.gz RXCDGLMIJILKEE-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](Cc2c[nH]nc2-c2cccnc2)CC1 ZINC000160433355 508987040 /nfs/dbraw/zinc/98/70/40/508987040.db2.gz ZUQHSYDUWQWZBU-UHFFFAOYSA-N 1 1 364.409 2.702 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000120554527 509019776 /nfs/dbraw/zinc/01/97/76/509019776.db2.gz YWYQERJZIIKJAN-MRXNPFEDSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@H](c1cccnc1)N1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000120554527 509019778 /nfs/dbraw/zinc/01/97/78/509019778.db2.gz YWYQERJZIIKJAN-MRXNPFEDSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000120554372 509019960 /nfs/dbraw/zinc/01/99/60/509019960.db2.gz YWYQERJZIIKJAN-INIZCTEOSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@@H](c1cccnc1)N1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000120554372 509019965 /nfs/dbraw/zinc/01/99/65/509019965.db2.gz YWYQERJZIIKJAN-INIZCTEOSA-N 1 1 356.426 2.747 20 5 FFBDMO O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1ccc([N+](=O)[O-])cc1 ZINC000151697618 509068505 /nfs/dbraw/zinc/06/85/05/509068505.db2.gz DWTQCBLRXLGOQG-LJQANCHMSA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1ccc([N+](=O)[O-])cc1 ZINC000151697618 509068506 /nfs/dbraw/zinc/06/85/06/509068506.db2.gz DWTQCBLRXLGOQG-LJQANCHMSA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126554540 509094695 /nfs/dbraw/zinc/09/46/95/509094695.db2.gz VGGAHBQSHMIICP-YVEFUNNKSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000126554540 509094699 /nfs/dbraw/zinc/09/46/99/509094699.db2.gz VGGAHBQSHMIICP-YVEFUNNKSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126554540 509094702 /nfs/dbraw/zinc/09/47/02/509094702.db2.gz VGGAHBQSHMIICP-YVEFUNNKSA-N 1 1 369.425 2.560 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000126858238 509139447 /nfs/dbraw/zinc/13/94/47/509139447.db2.gz OPBQAZSFCJBMQM-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000126858238 509139452 /nfs/dbraw/zinc/13/94/52/509139452.db2.gz OPBQAZSFCJBMQM-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185491941 509203957 /nfs/dbraw/zinc/20/39/57/509203957.db2.gz DZMNDKSUUPEUIR-UONOGXRCSA-N 1 1 351.422 2.932 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000195666895 509216656 /nfs/dbraw/zinc/21/66/56/509216656.db2.gz ARUVNSCZGBXEHI-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000195666895 509216665 /nfs/dbraw/zinc/21/66/65/509216665.db2.gz ARUVNSCZGBXEHI-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000248164930 509253337 /nfs/dbraw/zinc/25/33/37/509253337.db2.gz SUNBLNHTUSFDNZ-CRAIPNDOSA-N 1 1 360.458 2.730 20 5 FFBDMO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000182525241 509284168 /nfs/dbraw/zinc/28/41/68/509284168.db2.gz SYQOHXWNFYJNOA-NSHDSACASA-N 1 1 356.382 2.503 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000191998057 509285030 /nfs/dbraw/zinc/28/50/30/509285030.db2.gz IPYKLTPENGBYQC-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000248401229 509296362 /nfs/dbraw/zinc/29/63/62/509296362.db2.gz ZDBBRSPCMYJARD-CXAGYDPISA-N 1 1 354.410 2.626 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000172894301 509296934 /nfs/dbraw/zinc/29/69/34/509296934.db2.gz MTGFKKBRIOKZIR-GFCCVEGCSA-N 1 1 364.423 2.858 20 5 FFBDMO C[C@H](C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1nccs1 ZINC000248439528 509320502 /nfs/dbraw/zinc/32/05/02/509320502.db2.gz CMNRERSHIQYUIH-CHWSQXEVSA-N 1 1 351.428 2.527 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000267286717 509429134 /nfs/dbraw/zinc/42/91/34/509429134.db2.gz WNYUUNAVFLUBGL-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000248875744 509523987 /nfs/dbraw/zinc/52/39/87/509523987.db2.gz RABNTDQUBHHAAN-NVXWUHKLSA-N 1 1 369.421 2.610 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccco1 ZINC000164704396 509527315 /nfs/dbraw/zinc/52/73/15/509527315.db2.gz LNWOTUPTVJCUBM-UHFFFAOYSA-N 1 1 361.398 2.973 20 5 FFBDMO CCCN1CCC([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000173366989 509555873 /nfs/dbraw/zinc/55/58/73/509555873.db2.gz MJVAHAVQZNCOHE-UHFFFAOYSA-N 1 1 351.447 2.788 20 5 FFBDMO CCCN1CCC([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000173366989 509555876 /nfs/dbraw/zinc/55/58/76/509555876.db2.gz MJVAHAVQZNCOHE-UHFFFAOYSA-N 1 1 351.447 2.788 20 5 FFBDMO COc1ccc(OCC[N@@H+](CCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000173386661 509567797 /nfs/dbraw/zinc/56/77/97/509567797.db2.gz ZPLRIMGHVVYNNN-SFHVURJKSA-N 1 1 372.421 2.964 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000179817000 509635116 /nfs/dbraw/zinc/63/51/16/509635116.db2.gz FLHGJWGADIXMLP-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000192807987 509651947 /nfs/dbraw/zinc/65/19/47/509651947.db2.gz SIRDNWQOYDLZJU-CJNGLKHVSA-N 1 1 359.426 2.692 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000249462409 509687649 /nfs/dbraw/zinc/68/76/49/509687649.db2.gz PFUBTZSBDBGCLL-RHSMWYFYSA-N 1 1 363.439 2.937 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000249462409 509687652 /nfs/dbraw/zinc/68/76/52/509687652.db2.gz PFUBTZSBDBGCLL-RHSMWYFYSA-N 1 1 363.439 2.937 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000249903470 509778497 /nfs/dbraw/zinc/77/84/97/509778497.db2.gz UFZISRMOIQPULF-FUHWJXTLSA-N 1 1 372.421 2.833 20 5 FFBDMO Cn1c2ccccc2nc1C(C)(C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000186574975 509780122 /nfs/dbraw/zinc/78/01/22/509780122.db2.gz JGAIJXGRDADTDI-UHFFFAOYSA-N 1 1 367.409 2.945 20 5 FFBDMO O=C1C[C@H]([N@@H+]2CC[C@@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000250217489 509792814 /nfs/dbraw/zinc/79/28/14/509792814.db2.gz WEZVYEOCVWHMDJ-QAPCUYQASA-N 1 1 365.389 2.716 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000250217489 509792826 /nfs/dbraw/zinc/79/28/26/509792826.db2.gz WEZVYEOCVWHMDJ-QAPCUYQASA-N 1 1 365.389 2.716 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176987394 509801724 /nfs/dbraw/zinc/80/17/24/509801724.db2.gz YICOBIHVYMFHOO-LLVKDONJSA-N 1 1 370.247 2.962 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)ccc1[N+](=O)[O-] ZINC000173849651 509815582 /nfs/dbraw/zinc/81/55/82/509815582.db2.gz CVLUCIOFHGEPDV-CABCVRRESA-N 1 1 367.471 2.539 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000173850045 509815751 /nfs/dbraw/zinc/81/57/51/509815751.db2.gz LUMUTDVNSRFSSY-CABCVRRESA-N 1 1 367.471 2.539 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000173889107 509836447 /nfs/dbraw/zinc/83/64/47/509836447.db2.gz HYILHIGSWBSHNE-LBPRGKRZSA-N 1 1 373.400 2.978 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000183588425 509874666 /nfs/dbraw/zinc/87/46/66/509874666.db2.gz CJSAPVJNUHVXQQ-LLVKDONJSA-N 1 1 361.427 2.620 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000183588425 509874670 /nfs/dbraw/zinc/87/46/70/509874670.db2.gz CJSAPVJNUHVXQQ-LLVKDONJSA-N 1 1 361.427 2.620 20 5 FFBDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000177124372 509887353 /nfs/dbraw/zinc/88/73/53/509887353.db2.gz BIFRSCVKKVLFTI-INIZCTEOSA-N 1 1 354.414 2.998 20 5 FFBDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000177124372 509887360 /nfs/dbraw/zinc/88/73/60/509887360.db2.gz BIFRSCVKKVLFTI-INIZCTEOSA-N 1 1 354.414 2.998 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000186773824 509895772 /nfs/dbraw/zinc/89/57/72/509895772.db2.gz LQOMNXOLTGCBJA-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO COC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000190072859 509922019 /nfs/dbraw/zinc/92/20/19/509922019.db2.gz PSTNBDVPERTDAA-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439945 509935214 /nfs/dbraw/zinc/93/52/14/509935214.db2.gz UAPKAZZVTKUAJJ-WFASDCNBSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@H]1CCCCN1C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174241229 510020779 /nfs/dbraw/zinc/02/07/79/510020779.db2.gz QUOCJHTXLQLHBM-HNNXBMFYSA-N 1 1 361.442 2.839 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1CCO ZINC000190241703 510022373 /nfs/dbraw/zinc/02/23/73/510022373.db2.gz IHGBHKHWGSLHNF-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1CCO ZINC000190241703 510022388 /nfs/dbraw/zinc/02/23/88/510022388.db2.gz IHGBHKHWGSLHNF-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1CCO ZINC000190241703 510022393 /nfs/dbraw/zinc/02/23/93/510022393.db2.gz IHGBHKHWGSLHNF-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000261727542 510043378 /nfs/dbraw/zinc/04/33/78/510043378.db2.gz FNAXXUDTKYIINK-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193827194 510088003 /nfs/dbraw/zinc/08/80/03/510088003.db2.gz OVYKLHDFPNNLBR-AWEZNQCLSA-N 1 1 364.402 2.631 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193827194 510088011 /nfs/dbraw/zinc/08/80/11/510088011.db2.gz OVYKLHDFPNNLBR-AWEZNQCLSA-N 1 1 364.402 2.631 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261945803 510125079 /nfs/dbraw/zinc/12/50/79/510125079.db2.gz LBUCXXYBYRUTFJ-SFHVURJKSA-N 1 1 357.385 2.840 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C2(CCCCC2)C1 ZINC000174569931 510186202 /nfs/dbraw/zinc/18/62/02/510186202.db2.gz RYZYOLBZYNQHRV-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N1CC(=O)Nc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000194058780 510196282 /nfs/dbraw/zinc/19/62/82/510196282.db2.gz LPQZJRQZYQAHPG-OLZOCXBDSA-N 1 1 368.393 2.619 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000184305116 510250920 /nfs/dbraw/zinc/25/09/20/510250920.db2.gz UDPCABYJVYWQGB-UHFFFAOYSA-N 1 1 360.458 2.905 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000174782403 510307680 /nfs/dbraw/zinc/30/76/80/510307680.db2.gz RYRGAODWMDIWLJ-CZUORRHYSA-N 1 1 359.430 2.807 20 5 FFBDMO O=c1c2ccccc2ncn1CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178075803 510417304 /nfs/dbraw/zinc/41/73/04/510417304.db2.gz ZSSXFQABOBRGOC-UHFFFAOYSA-N 1 1 364.405 2.969 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)N1CC(=O)Nc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000181559327 510472982 /nfs/dbraw/zinc/47/29/82/510472982.db2.gz BFBRVYSDCSOASM-HNNXBMFYSA-N 1 1 368.393 2.621 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000266261515 510486077 /nfs/dbraw/zinc/48/60/77/510486077.db2.gz PFJCVEIXLQXVMH-UHFFFAOYSA-N 1 1 374.369 2.598 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000175138538 510500086 /nfs/dbraw/zinc/50/00/86/510500086.db2.gz IXIFYVGHZIQIKA-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246483931 510513727 /nfs/dbraw/zinc/51/37/27/510513727.db2.gz LQLQVJSWUHLARN-ZFWWWQNUSA-N 1 1 371.441 2.663 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000266343325 510529546 /nfs/dbraw/zinc/52/95/46/510529546.db2.gz AWCDBYRBYPMDGS-CYBMUJFWSA-N 1 1 369.849 2.817 20 5 FFBDMO C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181680585 510537277 /nfs/dbraw/zinc/53/72/77/510537277.db2.gz MPPLLRGRYPPENR-CABCVRRESA-N 1 1 361.442 2.743 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000191185397 510537952 /nfs/dbraw/zinc/53/79/52/510537952.db2.gz NCPWLNQCRVUXJP-QYJAPNMZSA-N 1 1 374.384 2.981 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000191185397 510537956 /nfs/dbraw/zinc/53/79/56/510537956.db2.gz NCPWLNQCRVUXJP-QYJAPNMZSA-N 1 1 374.384 2.981 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000269793575 510548019 /nfs/dbraw/zinc/54/80/19/510548019.db2.gz AKXYSBJOLPSWHU-UHFFFAOYSA-N 1 1 374.441 2.507 20 5 FFBDMO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266549322 510652145 /nfs/dbraw/zinc/65/21/45/510652145.db2.gz SVIGGZLYSGGMNA-XHDPSFHLSA-N 1 1 372.347 2.864 20 5 FFBDMO O=C1C[C@@H](c2ccccc2)[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000195199080 510713614 /nfs/dbraw/zinc/71/36/14/510713614.db2.gz GYIZLNSPBHHITC-SFHVURJKSA-N 1 1 355.394 2.537 20 5 FFBDMO O=C(CC[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000185182012 510733409 /nfs/dbraw/zinc/73/34/09/510733409.db2.gz KUXOXIMEEYPWEQ-LBPRGKRZSA-N 1 1 351.378 2.563 20 5 FFBDMO CC(C)(C)OC(=O)CCCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182179566 510798981 /nfs/dbraw/zinc/79/89/81/510798981.db2.gz ZVAMXULFXFCIIC-AWEZNQCLSA-N 1 1 364.446 2.988 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000182218945 510818890 /nfs/dbraw/zinc/81/88/90/510818890.db2.gz ZGBYUTOSMVQMKF-QGZVFWFLSA-N 1 1 359.426 2.533 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OC(F)F ZINC000247246078 510853926 /nfs/dbraw/zinc/85/39/26/510853926.db2.gz ZSFNGCBDQBEYJN-GXFFZTMASA-N 1 1 360.357 2.798 20 5 FFBDMO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247645661 510867583 /nfs/dbraw/zinc/86/75/83/510867583.db2.gz UIGBNJQJUQRWTH-GUDVDZBRSA-N 1 1 358.442 2.810 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000364527095 510916425 /nfs/dbraw/zinc/91/64/25/510916425.db2.gz JTKUQFOLHOCPEZ-LSBZLQRGSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C(N)=O)c1ccccn1 ZINC000297428735 510942144 /nfs/dbraw/zinc/94/21/44/510942144.db2.gz VDPXSLBLIFRBOX-WBMJQRKESA-N 1 1 360.439 2.677 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000294084659 510950452 /nfs/dbraw/zinc/95/04/52/510950452.db2.gz JVSQXERGWUWWEU-KRWDZBQOSA-N 1 1 351.834 2.735 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000285599114 510972089 /nfs/dbraw/zinc/97/20/89/510972089.db2.gz PLYPOAPZQIIPDX-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000285599114 510972093 /nfs/dbraw/zinc/97/20/93/510972093.db2.gz PLYPOAPZQIIPDX-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC1(C)C ZINC000330553693 510998731 /nfs/dbraw/zinc/99/87/31/510998731.db2.gz GHDJTXUXBLAVBG-LLVKDONJSA-N 1 1 355.822 2.568 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1 ZINC000282535298 511017493 /nfs/dbraw/zinc/01/74/93/511017493.db2.gz VJWQYJLUPSMZAE-ZMMAXQRCSA-N 1 1 356.426 2.563 20 5 FFBDMO Cc1c(-c2cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)on2)cnn1C ZINC000282552509 511022807 /nfs/dbraw/zinc/02/28/07/511022807.db2.gz XJJMTPWLVUFBRO-UHFFFAOYSA-N 1 1 355.398 2.966 20 5 FFBDMO Cc1c(CN2CCC([NH+]3CCN(C(C)C)CC3)CC2)cccc1[N+](=O)[O-] ZINC000270961431 511037895 /nfs/dbraw/zinc/03/78/95/511037895.db2.gz VDMIMFXWWIGXSR-UHFFFAOYSA-N 1 1 360.502 2.894 20 5 FFBDMO Cc1nc(N2CCC3(C[C@@H]3[N@H+](C)Cc3nccs3)CC2)ncc1[N+](=O)[O-] ZINC000294903391 511214325 /nfs/dbraw/zinc/21/43/25/511214325.db2.gz HGQZZRRESJEUEB-AWEZNQCLSA-N 1 1 374.470 2.641 20 5 FFBDMO Cc1nc(N2CCC3(C[C@@H]3[N@@H+](C)Cc3nccs3)CC2)ncc1[N+](=O)[O-] ZINC000294903391 511214328 /nfs/dbraw/zinc/21/43/28/511214328.db2.gz HGQZZRRESJEUEB-AWEZNQCLSA-N 1 1 374.470 2.641 20 5 FFBDMO C[NH+](C)[C@H]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000295071888 511271189 /nfs/dbraw/zinc/27/11/89/511271189.db2.gz DAMFXRHUEIADLW-AWEZNQCLSA-N 1 1 357.414 2.541 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2C[C@H]1C ZINC000295107259 511283756 /nfs/dbraw/zinc/28/37/56/511283756.db2.gz HDKWOHNPEXESJW-CHWSQXEVSA-N 1 1 363.439 2.636 20 5 FFBDMO COc1cccc(S(=O)(=O)CC[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271718758 511299491 /nfs/dbraw/zinc/29/94/91/511299491.db2.gz KLLSOIICYLMXML-CYBMUJFWSA-N 1 1 364.423 2.728 20 5 FFBDMO O=C(c1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363021318 511300865 /nfs/dbraw/zinc/30/08/65/511300865.db2.gz KZZOMSODTICKCX-HZPDHXFCSA-N 1 1 358.442 2.870 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C2)C1 ZINC000295223220 511327530 /nfs/dbraw/zinc/32/75/30/511327530.db2.gz BHEUAZHFCBKNHB-OAHLLOKOSA-N 1 1 357.332 2.781 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000298698210 511379453 /nfs/dbraw/zinc/37/94/53/511379453.db2.gz ZSKUUYKHUGMLKW-CVEARBPZSA-N 1 1 363.414 2.575 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291938245 511398303 /nfs/dbraw/zinc/39/83/03/511398303.db2.gz TYEAEBXHLBFENQ-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291938245 511398306 /nfs/dbraw/zinc/39/83/06/511398306.db2.gz TYEAEBXHLBFENQ-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000280320141 511419759 /nfs/dbraw/zinc/41/97/59/511419759.db2.gz GYAKVABMSJNYKZ-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000280320141 511419766 /nfs/dbraw/zinc/41/97/66/511419766.db2.gz GYAKVABMSJNYKZ-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000365480205 511475537 /nfs/dbraw/zinc/47/55/37/511475537.db2.gz HAURZZXRCARDLP-HNNXBMFYSA-N 1 1 360.458 2.872 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000283724813 511475772 /nfs/dbraw/zinc/47/57/72/511475772.db2.gz WEMCCMQKKXYZLQ-KRWDZBQOSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000272258752 511482905 /nfs/dbraw/zinc/48/29/05/511482905.db2.gz MMANXTPZYACIRC-LSDHHAIUSA-N 1 1 360.458 2.785 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292177837 511494290 /nfs/dbraw/zinc/49/42/90/511494290.db2.gz FCFRFFZZVNAQOS-QGZVFWFLSA-N 1 1 366.849 2.528 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000299243283 511563440 /nfs/dbraw/zinc/56/34/40/511563440.db2.gz XNDDAVMLIJJMPV-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000299307722 511586786 /nfs/dbraw/zinc/58/67/86/511586786.db2.gz BPWTZLGOAVACSG-UHFFFAOYSA-N 1 1 355.394 2.851 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000296147698 511633952 /nfs/dbraw/zinc/63/39/52/511633952.db2.gz XHGKVHCIVYDMTD-UHFFFAOYSA-N 1 1 364.409 2.702 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000299436775 511635187 /nfs/dbraw/zinc/63/51/87/511635187.db2.gz HYUOBDHKCJIWQA-CYBMUJFWSA-N 1 1 371.441 2.788 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000299447818 511639495 /nfs/dbraw/zinc/63/94/95/511639495.db2.gz OPEMYYUPCOTEEC-CYBMUJFWSA-N 1 1 371.441 2.931 20 5 FFBDMO CC(C)(C)CNC(=O)C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000284270877 511662760 /nfs/dbraw/zinc/66/27/60/511662760.db2.gz XKDAKLYNCVBFTO-UHFFFAOYSA-N 1 1 352.391 2.534 20 5 FFBDMO O=C(c1cc(N2CCC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363636490 511672196 /nfs/dbraw/zinc/67/21/96/511672196.db2.gz BXCCSGVQVFTAAW-INIZCTEOSA-N 1 1 358.442 2.505 20 5 FFBDMO C[C@@H](CNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000280987836 511679236 /nfs/dbraw/zinc/67/92/36/511679236.db2.gz QCJBWLBTPUCELU-ZDUSSCGKSA-N 1 1 354.410 2.869 20 5 FFBDMO COCC[C@@H]1COCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365849934 511686009 /nfs/dbraw/zinc/68/60/09/511686009.db2.gz SYGTVVINYGTRIJ-MRXNPFEDSA-N 1 1 361.398 2.530 20 5 FFBDMO COCC[C@@H]1COCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365849934 511686013 /nfs/dbraw/zinc/68/60/13/511686013.db2.gz SYGTVVINYGTRIJ-MRXNPFEDSA-N 1 1 361.398 2.530 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000365856524 511690251 /nfs/dbraw/zinc/69/02/51/511690251.db2.gz JHKNLMKOJCIUIJ-QGZVFWFLSA-N 1 1 372.368 2.594 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000303514421 511739780 /nfs/dbraw/zinc/73/97/80/511739780.db2.gz PBADEEMBKRYBAR-LBPRGKRZSA-N 1 1 366.437 2.947 20 5 FFBDMO Cn1cc(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000292897553 511763854 /nfs/dbraw/zinc/76/38/54/511763854.db2.gz ZOIJUBQXPRFAMC-LJQANCHMSA-N 1 1 355.442 2.523 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000312178384 511782522 /nfs/dbraw/zinc/78/25/22/511782522.db2.gz PWQIHRGIWJOSGY-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCCC[C@@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC000281298405 511795249 /nfs/dbraw/zinc/79/52/49/511795249.db2.gz HIGLCEKBFZHPNP-MRXNPFEDSA-N 1 1 360.414 2.943 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC000281298405 511795253 /nfs/dbraw/zinc/79/52/53/511795253.db2.gz HIGLCEKBFZHPNP-MRXNPFEDSA-N 1 1 360.414 2.943 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000293015932 511807260 /nfs/dbraw/zinc/80/72/60/511807260.db2.gz KEZDEBRHUPHINE-LJQANCHMSA-N 1 1 363.458 2.962 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000363871243 511820798 /nfs/dbraw/zinc/82/07/98/511820798.db2.gz AQIFNVZBWZQERG-CYBMUJFWSA-N 1 1 360.439 2.693 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000284772676 511863329 /nfs/dbraw/zinc/86/33/29/511863329.db2.gz MVCYTIAMIUGJID-CQSZACIVSA-N 1 1 373.413 2.526 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c1 ZINC000281482492 511863909 /nfs/dbraw/zinc/86/39/09/511863909.db2.gz GZTWYSXRNXJBQD-INIZCTEOSA-N 1 1 363.458 2.766 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000284857425 511901612 /nfs/dbraw/zinc/90/16/12/511901612.db2.gz RVQVVTREFMEGQZ-RDJZCZTQSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1cc(F)c(NC(=O)N2CC[NH+](CCOC(C)C)CC2)cc1[N+](=O)[O-] ZINC000296799091 511902887 /nfs/dbraw/zinc/90/28/87/511902887.db2.gz QRNPGFRWORXBRE-UHFFFAOYSA-N 1 1 368.409 2.617 20 5 FFBDMO Cc1cc(F)c(NC(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1[N+](=O)[O-] ZINC000296889509 511938292 /nfs/dbraw/zinc/93/82/92/511938292.db2.gz XAEBJXOJILTJCY-KRWDZBQOSA-N 1 1 350.394 2.992 20 5 FFBDMO Cc1ncc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)s1 ZINC000274873351 511971600 /nfs/dbraw/zinc/97/16/00/511971600.db2.gz XUKQMZYRNSWZCP-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000293503314 511989005 /nfs/dbraw/zinc/98/90/05/511989005.db2.gz UQGQUGFFLCNFKB-GRYCIOLGSA-N 1 1 354.838 2.600 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000366382902 511991081 /nfs/dbraw/zinc/99/10/81/511991081.db2.gz BUXNARYJOAHEJI-NVXWUHKLSA-N 1 1 358.442 2.896 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000373760737 512492695 /nfs/dbraw/zinc/49/26/95/512492695.db2.gz MAZABDGXZMHTLW-CQSZACIVSA-N 1 1 357.414 2.979 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000375787602 512505909 /nfs/dbraw/zinc/50/59/09/512505909.db2.gz HHHZSISWFJBKNM-RFLUGMABSA-N 1 1 356.382 2.500 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000371702595 512535391 /nfs/dbraw/zinc/53/53/91/512535391.db2.gz FQGACNRXFBCRIS-KRWDZBQOSA-N 1 1 366.893 2.849 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cnc([C@H]4CCCO4)s3)CC2)n1 ZINC000369692789 512557617 /nfs/dbraw/zinc/55/76/17/512557617.db2.gz KRFCWCIZMJFBPF-CQSZACIVSA-N 1 1 363.443 2.936 20 5 FFBDMO Cc1cnc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000378050150 512563434 /nfs/dbraw/zinc/56/34/34/512563434.db2.gz SCJLXNFTQFFUSX-KRWDZBQOSA-N 1 1 353.394 2.862 20 5 FFBDMO O=C(CC[N@@H+]1CCOC[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411306228 512573257 /nfs/dbraw/zinc/57/32/57/512573257.db2.gz YQJTYZKLVSTKFZ-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411306228 512573262 /nfs/dbraw/zinc/57/32/62/512573262.db2.gz YQJTYZKLVSTKFZ-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000374258055 512731714 /nfs/dbraw/zinc/73/17/14/512731714.db2.gz ULOBHHVIHUHGCP-ABTXCIMASA-N 1 1 356.426 2.930 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000374356448 512786967 /nfs/dbraw/zinc/78/69/67/512786967.db2.gz IDRBWOYXGJNHJX-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)n2)c1 ZINC000374357820 512787900 /nfs/dbraw/zinc/78/79/00/512787900.db2.gz KBMITQPQPASLHZ-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000370162097 512796734 /nfs/dbraw/zinc/79/67/34/512796734.db2.gz NLUHUNMLIITXJN-OAHLLOKOSA-N 1 1 354.410 2.524 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)n1 ZINC000378561998 512824824 /nfs/dbraw/zinc/82/48/24/512824824.db2.gz DJFKPWFHLFJSEH-UHFFFAOYSA-N 1 1 357.370 2.981 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@H](O)C[C@H]3c3ccccc3)n2)cc1 ZINC000411933590 512878973 /nfs/dbraw/zinc/87/89/73/512878973.db2.gz GVEGQKPGNXTNNG-SJORKVTESA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@H](O)C[C@H]3c3ccccc3)n2)cc1 ZINC000411933590 512878980 /nfs/dbraw/zinc/87/89/80/512878980.db2.gz GVEGQKPGNXTNNG-SJORKVTESA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC([C@H]4CCOC4)CC3)o2)cc1 ZINC000374595703 512909143 /nfs/dbraw/zinc/90/91/43/512909143.db2.gz PQRUHZXEKVQICO-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000412079912 512948731 /nfs/dbraw/zinc/94/87/31/512948731.db2.gz VJFVADUOZQQRAL-XIKOKIGWSA-N 1 1 374.397 2.981 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071506 512993125 /nfs/dbraw/zinc/99/31/25/512993125.db2.gz QCDKOZICPCBOHH-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071506 512993123 /nfs/dbraw/zinc/99/31/23/512993123.db2.gz QCDKOZICPCBOHH-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cn1 ZINC000372699727 513004225 /nfs/dbraw/zinc/00/42/25/513004225.db2.gz HBOVEMNXOXWRBU-UHFFFAOYSA-N 1 1 352.354 2.627 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](Cc2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368621176 513029262 /nfs/dbraw/zinc/02/92/62/513029262.db2.gz HWMKKVICYKNIOC-INIZCTEOSA-N 1 1 354.410 2.883 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1C ZINC000440080059 513242777 /nfs/dbraw/zinc/24/27/77/513242777.db2.gz QJAMHRIVIRAFSB-JSGCOSHPSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]([C@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428997140 513246833 /nfs/dbraw/zinc/24/68/33/513246833.db2.gz RYVYKWQUXBKSLB-ADAWSYLGSA-N 1 1 360.458 2.584 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000429012248 513251541 /nfs/dbraw/zinc/25/15/41/513251541.db2.gz SVAROROQNREWGK-JKIFEVAISA-N 1 1 371.441 2.807 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000434439945 513323453 /nfs/dbraw/zinc/32/34/53/513323453.db2.gz WIBOXUGNHXFZIO-OAHLLOKOSA-N 1 1 369.425 2.527 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000450828960 513358439 /nfs/dbraw/zinc/35/84/39/513358439.db2.gz OHWXIOLWHPYOEX-YOGCLGLASA-N 1 1 351.378 2.948 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)CN1CCOCC1 ZINC000434701855 513398374 /nfs/dbraw/zinc/39/83/74/513398374.db2.gz IEXUVLLYCJVEMC-OAHLLOKOSA-N 1 1 351.447 2.535 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)CN1CCOCC1 ZINC000434701855 513398375 /nfs/dbraw/zinc/39/83/75/513398375.db2.gz IEXUVLLYCJVEMC-OAHLLOKOSA-N 1 1 351.447 2.535 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000440928373 513439863 /nfs/dbraw/zinc/43/98/63/513439863.db2.gz YIYQKTJDPIITIT-MDZLAQPJSA-N 1 1 367.833 2.757 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441017015 513460307 /nfs/dbraw/zinc/46/03/07/513460307.db2.gz WKDOCOGDMNNWAB-ZTQAJYAQSA-N 1 1 372.421 2.659 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCC(c2ccccc2)=N1)c1ccc([N+](=O)[O-])cc1 ZINC000451102585 513524617 /nfs/dbraw/zinc/52/46/17/513524617.db2.gz DOBGNTJRJJHRBO-AWEZNQCLSA-N 1 1 352.394 2.882 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441278841 513528792 /nfs/dbraw/zinc/52/87/92/513528792.db2.gz QNMHCIQVVVQVII-JYJNAYRXSA-N 1 1 361.442 2.979 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000430306801 513616943 /nfs/dbraw/zinc/61/69/43/513616943.db2.gz XMYRTXPQBCCRGB-INIZCTEOSA-N 1 1 369.421 2.959 20 5 FFBDMO COC(=O)c1cnc(NC[C@H]2CCC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000435601868 513633088 /nfs/dbraw/zinc/63/30/88/513633088.db2.gz RHNIDEQFOPYYAZ-OAHLLOKOSA-N 1 1 362.430 2.985 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000451262354 513635169 /nfs/dbraw/zinc/63/51/69/513635169.db2.gz KPUZLDQXQCMKHP-LPHOPBHVSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000451262354 513635171 /nfs/dbraw/zinc/63/51/71/513635171.db2.gz KPUZLDQXQCMKHP-LPHOPBHVSA-N 1 1 360.385 2.774 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1 ZINC000451295497 513659627 /nfs/dbraw/zinc/65/96/27/513659627.db2.gz DNSUSYFKQVRWJG-QGTPRVQTSA-N 1 1 364.442 2.744 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451339621 513686847 /nfs/dbraw/zinc/68/68/47/513686847.db2.gz ILTBNIWGSFOVTH-PILAGYSTSA-N 1 1 361.442 2.937 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c(C)cc1[N+](=O)[O-] ZINC000416395141 513750889 /nfs/dbraw/zinc/75/08/89/513750889.db2.gz YGENDATXTPHBQP-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC000419319163 513774795 /nfs/dbraw/zinc/77/47/95/513774795.db2.gz VPJPSPBYSVWPAL-SJLPKXTDSA-N 1 1 372.421 2.878 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451523806 513806015 /nfs/dbraw/zinc/80/60/15/513806015.db2.gz DHQYKFGJRPEQME-OGHNNQOOSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451523806 513806022 /nfs/dbraw/zinc/80/60/22/513806022.db2.gz DHQYKFGJRPEQME-OGHNNQOOSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000448695986 513849426 /nfs/dbraw/zinc/84/94/26/513849426.db2.gz CKYZXQHPJIUYHN-VXGBXAGGSA-N 1 1 353.394 2.735 20 5 FFBDMO COc1cc(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000448712035 513860229 /nfs/dbraw/zinc/86/02/29/513860229.db2.gz HQAQGUYJPPGVSG-BETUJISGSA-N 1 1 367.421 2.840 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691973 513913213 /nfs/dbraw/zinc/91/32/13/513913213.db2.gz DCUVABYYXGIRAU-BZPMIXESSA-N 1 1 367.833 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691973 513913220 /nfs/dbraw/zinc/91/32/20/513913220.db2.gz DCUVABYYXGIRAU-BZPMIXESSA-N 1 1 367.833 2.670 20 5 FFBDMO NC(=O)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCOc2ccccc21 ZINC000451711624 513932136 /nfs/dbraw/zinc/93/21/36/513932136.db2.gz MTIYNLYLKISBKW-SFHVURJKSA-N 1 1 369.421 2.839 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000451729170 513942568 /nfs/dbraw/zinc/94/25/68/513942568.db2.gz URGWSJUNVHEIAD-QGZVFWFLSA-N 1 1 355.394 2.796 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000451729170 513942573 /nfs/dbraw/zinc/94/25/73/513942573.db2.gz URGWSJUNVHEIAD-QGZVFWFLSA-N 1 1 355.394 2.796 20 5 FFBDMO COc1cc(C[N@@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000451877034 514039542 /nfs/dbraw/zinc/03/95/42/514039542.db2.gz CALPNTYNODNXCQ-LBPRGKRZSA-N 1 1 361.364 2.919 20 5 FFBDMO COc1cc(C[N@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000451877034 514039551 /nfs/dbraw/zinc/03/95/51/514039551.db2.gz CALPNTYNODNXCQ-LBPRGKRZSA-N 1 1 361.364 2.919 20 5 FFBDMO CCc1ccc([C@H](NCCCN2CC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423179120 514070821 /nfs/dbraw/zinc/07/08/21/514070821.db2.gz HBFNJOLNFBFDPF-HXUWFJFHSA-N 1 1 372.469 2.725 20 5 FFBDMO COC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000414496079 514149072 /nfs/dbraw/zinc/14/90/72/514149072.db2.gz YLAPGLRXXDBHAC-ROUUACIJSA-N 1 1 371.437 2.944 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCN(CC(F)(F)F)CC1 ZINC000452044003 514157851 /nfs/dbraw/zinc/15/78/51/514157851.db2.gz VOBOJZJDLOWMME-UHFFFAOYSA-N 1 1 361.364 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](O)[C@H](CO)C3)o2)c(Cl)c1 ZINC000414561211 514179975 /nfs/dbraw/zinc/17/99/75/514179975.db2.gz SBNZLUUSILYRBG-ZBEGNZNMSA-N 1 1 366.801 2.683 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000452103738 514192578 /nfs/dbraw/zinc/19/25/78/514192578.db2.gz MLZOEDQXRLPNAD-CQSZACIVSA-N 1 1 363.414 2.641 20 5 FFBDMO C[C@]1(F)C[NH2+]CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000423692350 514202671 /nfs/dbraw/zinc/20/26/71/514202671.db2.gz QHNJPJQKHQTKKH-AWEZNQCLSA-N 1 1 361.826 2.500 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000427608522 514262936 /nfs/dbraw/zinc/26/29/36/514262936.db2.gz YTVNOUQEMHZDBY-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000427608522 514262943 /nfs/dbraw/zinc/26/29/43/514262943.db2.gz YTVNOUQEMHZDBY-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@H+](CCCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300242 514282484 /nfs/dbraw/zinc/28/24/84/514282484.db2.gz ACJRQTGEETXVIU-APWZRJJASA-N 1 1 374.485 2.539 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300242 514282490 /nfs/dbraw/zinc/28/24/90/514282490.db2.gz ACJRQTGEETXVIU-APWZRJJASA-N 1 1 374.485 2.539 20 5 FFBDMO COc1ccc([C@@H](CCO)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444671082 514288521 /nfs/dbraw/zinc/28/85/21/514288521.db2.gz HYYASQAVHKZINL-OAHLLOKOSA-N 1 1 356.382 2.693 20 5 FFBDMO CC(C)c1ccc(C(=O)NC2CCC([NH+]3CCNCC3)CC2)cc1[N+](=O)[O-] ZINC000423956463 514307492 /nfs/dbraw/zinc/30/74/92/514307492.db2.gz UJPMWIHGJYPTKO-UHFFFAOYSA-N 1 1 374.485 2.664 20 5 FFBDMO CC(C)c1[nH+]ccn1CCC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000427977687 514364927 /nfs/dbraw/zinc/36/49/27/514364927.db2.gz ZQFSNHBXUFQSEV-UHFFFAOYSA-N 1 1 358.398 2.726 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433195933 514416011 /nfs/dbraw/zinc/41/60/11/514416011.db2.gz ZRGRLHFPFYSANA-CQSZACIVSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433195933 514416018 /nfs/dbraw/zinc/41/60/18/514416018.db2.gz ZRGRLHFPFYSANA-CQSZACIVSA-N 1 1 367.471 2.686 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](CCO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421023463 514444635 /nfs/dbraw/zinc/44/46/35/514444635.db2.gz WBYZSVVGOLVSEN-GFCCVEGCSA-N 1 1 355.822 2.671 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](CCO)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421023463 514444636 /nfs/dbraw/zinc/44/46/36/514444636.db2.gz WBYZSVVGOLVSEN-GFCCVEGCSA-N 1 1 355.822 2.671 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000445245441 514451305 /nfs/dbraw/zinc/45/13/05/514451305.db2.gz BBRJAQRZTSLYOT-CQSZACIVSA-N 1 1 369.849 2.643 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)Nc1ccc([N+](=O)[O-])cc1F ZINC000461112907 514519510 /nfs/dbraw/zinc/51/95/10/514519510.db2.gz NVROVDARCXEFCS-HNNXBMFYSA-N 1 1 374.372 2.945 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000461255697 514552802 /nfs/dbraw/zinc/55/28/02/514552802.db2.gz DQHDKHNHFCDGME-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000461255697 514552808 /nfs/dbraw/zinc/55/28/08/514552808.db2.gz DQHDKHNHFCDGME-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCn4cc[nH+]c4C3)n2)c2c1NCCC2 ZINC000453231663 514575350 /nfs/dbraw/zinc/57/53/50/514575350.db2.gz GLJLTMSFQBJLAG-NSHDSACASA-N 1 1 366.381 2.929 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@](C)(C(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000475664900 514752292 /nfs/dbraw/zinc/75/22/92/514752292.db2.gz AOVAOQGDYLUFCX-GOSISDBHSA-N 1 1 359.382 2.561 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)C2CCC(OC)CC2)cc1[N+](=O)[O-] ZINC000475694526 514764313 /nfs/dbraw/zinc/76/43/13/514764313.db2.gz GZPOHGJIAUELMC-UHFFFAOYSA-N 1 1 366.414 2.536 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000489315714 514793616 /nfs/dbraw/zinc/79/36/16/514793616.db2.gz REZQVKYPECBJOV-DOMZBBRYSA-N 1 1 369.849 2.814 20 5 FFBDMO Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461948225 514800009 /nfs/dbraw/zinc/80/00/09/514800009.db2.gz MHGQEEDSDGGBPY-LSDHHAIUSA-N 1 1 359.348 2.831 20 5 FFBDMO COc1c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000475900152 514848157 /nfs/dbraw/zinc/84/81/57/514848157.db2.gz OYVCYQJTCYXUMI-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCOCC1 ZINC000462085155 514873116 /nfs/dbraw/zinc/87/31/16/514873116.db2.gz QRQGACREBZBHGB-CQSZACIVSA-N 1 1 359.373 2.965 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1CC=CCC1 ZINC000485112478 514918116 /nfs/dbraw/zinc/91/81/16/514918116.db2.gz HVKVLDGMQLDGEC-INIZCTEOSA-N 1 1 373.453 2.789 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000498568314 514975404 /nfs/dbraw/zinc/97/54/04/514975404.db2.gz AXRLZSSZVMWODX-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])nn3C)c2C1 ZINC000476382270 515027653 /nfs/dbraw/zinc/02/76/53/515027653.db2.gz VXXXPRNRQDURSO-UHFFFAOYSA-N 1 1 357.414 2.942 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000467550443 515044723 /nfs/dbraw/zinc/04/47/23/515044723.db2.gz KKANYAXBAPSRSZ-AIADIJKESA-N 1 1 362.426 2.900 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000467810750 515131395 /nfs/dbraw/zinc/13/13/95/515131395.db2.gz GPHAXUGSZKJVRF-RISCZKNCSA-N 1 1 367.833 2.616 20 5 FFBDMO COc1cc(CN2CC[NH+](CCOc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000485824334 515205577 /nfs/dbraw/zinc/20/55/77/515205577.db2.gz LCHMJJZYYUNXKE-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO Cn1c(C(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000490512225 515234842 /nfs/dbraw/zinc/23/48/42/515234842.db2.gz CBJGNCRPOXSVNJ-IBGZPJMESA-N 1 1 356.426 2.718 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000468457142 515366106 /nfs/dbraw/zinc/36/61/06/515366106.db2.gz BEAGTLGPMIEZGY-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000468695377 515474948 /nfs/dbraw/zinc/47/49/48/515474948.db2.gz SFIGHURGNOPWPS-UKRRQHHQSA-N 1 1 354.410 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(N3CC[NH+](Cc4ccccc4)CC3)n2)cc1 ZINC000486452762 515488988 /nfs/dbraw/zinc/48/89/88/515488988.db2.gz SBMUHXFFPWOECL-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC000468740934 515498372 /nfs/dbraw/zinc/49/83/72/515498372.db2.gz VERKGYDSJZPMPG-DPEYORQISA-N 1 1 359.470 2.966 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000468740934 515498383 /nfs/dbraw/zinc/49/83/83/515498383.db2.gz VERKGYDSJZPMPG-DPEYORQISA-N 1 1 359.470 2.966 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492178020 515510410 /nfs/dbraw/zinc/51/04/10/515510410.db2.gz JFGXHTIJMDDQAM-UXHICEINSA-N 1 1 354.454 2.520 20 5 FFBDMO CN1CCN(C)[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492178020 515510416 /nfs/dbraw/zinc/51/04/16/515510416.db2.gz JFGXHTIJMDDQAM-UXHICEINSA-N 1 1 354.454 2.520 20 5 FFBDMO CCOc1cc(C[N@H+](CCO)Cc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492604866 515548198 /nfs/dbraw/zinc/54/81/98/515548198.db2.gz GDYDFQNFRFOUHK-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CCOc1cc(C[N@@H+](CCO)Cc2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492604866 515548211 /nfs/dbraw/zinc/54/82/11/515548211.db2.gz GDYDFQNFRFOUHK-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COC(=O)c1cnc(NC[C@H]2CCCC[N@H+]2CC(C)C)c([N+](=O)[O-])c1 ZINC000477719871 515566837 /nfs/dbraw/zinc/56/68/37/515566837.db2.gz PCOSPXWEMAQTDB-CQSZACIVSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707247 515659069 /nfs/dbraw/zinc/65/90/69/515659069.db2.gz OACIBGFAHWKVOP-YPMHNXCESA-N 1 1 373.400 2.820 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457116060 515661756 /nfs/dbraw/zinc/66/17/56/515661756.db2.gz LERVPYZZXYSYLH-TZMCWYRMSA-N 1 1 369.849 2.957 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC1CC[NH+](Cc2cccnc2)CC1 ZINC000482513514 515703739 /nfs/dbraw/zinc/70/37/39/515703739.db2.gz SYXAZOROBHAVKQ-UHFFFAOYSA-N 1 1 356.426 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1csc(C)n1 ZINC000500451267 515715881 /nfs/dbraw/zinc/71/58/81/515715881.db2.gz YRRCUCRNTRGRKL-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1csc(C)n1 ZINC000500451267 515715888 /nfs/dbraw/zinc/71/58/88/515715888.db2.gz YRRCUCRNTRGRKL-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000478169056 515723026 /nfs/dbraw/zinc/72/30/26/515723026.db2.gz KZVMPHQGAJWGMJ-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC[N@H+]1C ZINC000454785928 515743032 /nfs/dbraw/zinc/74/30/32/515743032.db2.gz NDKQJPWBFVVXRU-QGPMSJSTSA-N 1 1 360.458 2.967 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000511128537 515795988 /nfs/dbraw/zinc/79/59/88/515795988.db2.gz XGXIRKAQZSDZQM-CQSZACIVSA-N 1 1 373.375 2.870 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000511128537 515795996 /nfs/dbraw/zinc/79/59/96/515795996.db2.gz XGXIRKAQZSDZQM-CQSZACIVSA-N 1 1 373.375 2.870 20 5 FFBDMO Cc1cccc2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc(=O)n12 ZINC000511136434 515800650 /nfs/dbraw/zinc/80/06/50/515800650.db2.gz AEHKRSKBXALCOQ-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO CCS(=O)(=O)C[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494471224 515855224 /nfs/dbraw/zinc/85/52/24/515855224.db2.gz MBQKFCWDUGCIPC-VIFPVBQESA-N 1 1 354.350 2.526 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000469686122 515917659 /nfs/dbraw/zinc/91/76/59/515917659.db2.gz SPTJCYWBMXFCOG-QGZVFWFLSA-N 1 1 371.441 2.690 20 5 FFBDMO COc1c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000474201802 515930203 /nfs/dbraw/zinc/93/02/03/515930203.db2.gz YLQUYCOGDGHCSO-HNNXBMFYSA-N 1 1 359.382 2.763 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000478718133 515940610 /nfs/dbraw/zinc/94/06/10/515940610.db2.gz AWFLGCMRDCYZSJ-CHWSQXEVSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)COCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000501028355 515943340 /nfs/dbraw/zinc/94/33/40/515943340.db2.gz IUFJJTZILRHUPT-UHFFFAOYSA-N 1 1 361.446 2.656 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1)c1nccs1 ZINC000474357581 516008675 /nfs/dbraw/zinc/00/86/75/516008675.db2.gz UQCNRCNXGMENOZ-GFCCVEGCSA-N 1 1 365.411 2.844 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C ZINC000460215057 516070192 /nfs/dbraw/zinc/07/01/92/516070192.db2.gz PXTNQDGXPKFQNH-KGLIPLIRSA-N 1 1 358.446 2.792 20 5 FFBDMO CC[C@H]1C(=O)N(CC)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000495226550 516109916 /nfs/dbraw/zinc/10/99/16/516109916.db2.gz DBXSCZYJRBQXDO-INIZCTEOSA-N 1 1 372.425 2.735 20 5 FFBDMO CC[C@H]1C(=O)N(CC)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000495226550 516109922 /nfs/dbraw/zinc/10/99/22/516109922.db2.gz DBXSCZYJRBQXDO-INIZCTEOSA-N 1 1 372.425 2.735 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000501490217 516121427 /nfs/dbraw/zinc/12/14/27/516121427.db2.gz JODBIPFOZHJHBQ-QWHCGFSZSA-N 1 1 350.419 2.845 20 5 FFBDMO CCN1CCN([C@H]2CC[N@H+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169870 516159415 /nfs/dbraw/zinc/15/94/15/516159415.db2.gz LFPLDUYDOIDYMO-NXNYUAIASA-N 1 1 358.486 2.710 20 5 FFBDMO CCN1CCN([C@H]2CC[N@@H+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169870 516159424 /nfs/dbraw/zinc/15/94/24/516159424.db2.gz LFPLDUYDOIDYMO-NXNYUAIASA-N 1 1 358.486 2.710 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000470203752 516171898 /nfs/dbraw/zinc/17/18/98/516171898.db2.gz FBKSNTAYBSCNBY-GMMCIKNFSA-N 1 1 371.359 2.999 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000501616486 516174739 /nfs/dbraw/zinc/17/47/39/516174739.db2.gz FVAXIFBEHRYFEA-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000501616486 516174745 /nfs/dbraw/zinc/17/47/45/516174745.db2.gz FVAXIFBEHRYFEA-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000483701149 516177835 /nfs/dbraw/zinc/17/78/35/516177835.db2.gz LVYKUQAMVXBMSM-UKRRQHHQSA-N 1 1 364.446 2.618 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000488711719 516291423 /nfs/dbraw/zinc/29/14/23/516291423.db2.gz IEJBHFVBWTXSPM-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO COC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000488748784 516300352 /nfs/dbraw/zinc/30/03/52/516300352.db2.gz HORQCXVJBQHLFO-IIYDPXPESA-N 1 1 361.442 2.856 20 5 FFBDMO C[C@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CCC2)C1 ZINC000488760717 516302856 /nfs/dbraw/zinc/30/28/56/516302856.db2.gz FGXOLRRXJCPCPH-CYBMUJFWSA-N 1 1 357.414 2.955 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)C[C@H]1Cc1ccccc1 ZINC000557741359 516414194 /nfs/dbraw/zinc/41/41/94/516414194.db2.gz DLRZQEBZCBRDFN-CQSZACIVSA-N 1 1 369.450 2.963 20 5 FFBDMO C[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000517718995 516424172 /nfs/dbraw/zinc/42/41/72/516424172.db2.gz GIKBXKPRPWTQHC-HNNXBMFYSA-N 1 1 369.421 2.537 20 5 FFBDMO C[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000517718995 516424177 /nfs/dbraw/zinc/42/41/77/516424177.db2.gz GIKBXKPRPWTQHC-HNNXBMFYSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccccc1CN1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000523701352 516550630 /nfs/dbraw/zinc/55/06/30/516550630.db2.gz DDPJCBXEDZBCLG-UHFFFAOYSA-N 1 1 355.438 2.964 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000558025809 516556754 /nfs/dbraw/zinc/55/67/54/516556754.db2.gz PJABPCLXYPXXEH-ZMSDIMECSA-N 1 1 361.442 2.552 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544144005 516611671 /nfs/dbraw/zinc/61/16/71/516611671.db2.gz MEFUQULTKIVYCV-PXNSSMCTSA-N 1 1 356.422 2.998 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CCN(CCO)CC1 ZINC000513524689 516659411 /nfs/dbraw/zinc/65/94/11/516659411.db2.gz JZTAVWPUQLHKOS-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC[NH+](CCO)CC1 ZINC000513524689 516659422 /nfs/dbraw/zinc/65/94/22/516659422.db2.gz JZTAVWPUQLHKOS-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@H](C)CO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000554883903 516679918 /nfs/dbraw/zinc/67/99/18/516679918.db2.gz PTPPGJKAKMLMCL-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCCC[C@H]3[NH+]3CCOCC3)cc2N1 ZINC000531911011 516708072 /nfs/dbraw/zinc/70/80/72/516708072.db2.gz GBIGDYKKLVKKBA-RHSMWYFYSA-N 1 1 374.441 2.535 20 5 FFBDMO Cc1c(Br)c(N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)ncc1[N+](=O)[O-] ZINC000544395002 516740254 /nfs/dbraw/zinc/74/02/54/516740254.db2.gz SXENLPYTDSYSAG-RYUDHWBXSA-N 1 1 369.263 2.981 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000531981319 516740850 /nfs/dbraw/zinc/74/08/50/516740850.db2.gz UGPRNSTYIVPCFP-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@@H](C)C1 ZINC000561762680 516755978 /nfs/dbraw/zinc/75/59/78/516755978.db2.gz PTYKIIXRYKWZSH-AHIWAGSCSA-N 1 1 356.426 2.878 20 5 FFBDMO Cc1ccc(-c2noc([C@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)cc1F ZINC000544514812 516791885 /nfs/dbraw/zinc/79/18/85/516791885.db2.gz AOMVPUMPJPKPBB-NSHDSACASA-N 1 1 360.349 2.640 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000518865522 516800388 /nfs/dbraw/zinc/80/03/88/516800388.db2.gz LLCQIKFWIQYTEA-CYBMUJFWSA-N 1 1 351.451 2.512 20 5 FFBDMO COc1cc(C)c(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)n1 ZINC000540997984 516819977 /nfs/dbraw/zinc/81/99/77/516819977.db2.gz LDSRXIFOYRJBQP-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CN(C)c1cc(NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc[nH+]1 ZINC000540998015 516821449 /nfs/dbraw/zinc/82/14/49/516821449.db2.gz RUTRQEFPQYWSMQ-UHFFFAOYSA-N 1 1 352.297 2.910 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000514098399 516862068 /nfs/dbraw/zinc/86/20/68/516862068.db2.gz GOWHRWNYJABYSY-XYJFISCASA-N 1 1 355.442 2.634 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000548294590 516878953 /nfs/dbraw/zinc/87/89/53/516878953.db2.gz OANDUJOLUDOXCH-IBGZPJMESA-N 1 1 356.426 2.718 20 5 FFBDMO C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000548294179 516879875 /nfs/dbraw/zinc/87/98/75/516879875.db2.gz HXUAHERVSQVGCJ-IBGZPJMESA-N 1 1 354.410 2.774 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000525105567 516917954 /nfs/dbraw/zinc/91/79/54/516917954.db2.gz IYQRQKQRTFHKTD-GVXVVHGQSA-N 1 1 355.822 2.614 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000514630344 516972164 /nfs/dbraw/zinc/97/21/64/516972164.db2.gz LXCJUMUMGGDWIA-UHFFFAOYSA-N 1 1 360.458 2.609 20 5 FFBDMO CC(C)(C)C1=CC[N@H+](CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000562307826 517022032 /nfs/dbraw/zinc/02/20/32/517022032.db2.gz FBURYKHHZQMLIR-UHFFFAOYSA-N 1 1 367.471 2.551 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000562307826 517022043 /nfs/dbraw/zinc/02/20/43/517022043.db2.gz FBURYKHHZQMLIR-UHFFFAOYSA-N 1 1 367.471 2.551 20 5 FFBDMO COC(=O)COc1ccc(CNc2ccc(C3CCC3)c[nH+]2)cc1[N+](=O)[O-] ZINC000555637139 517034975 /nfs/dbraw/zinc/03/49/75/517034975.db2.gz YJPWTISIBFOFHV-UHFFFAOYSA-N 1 1 371.393 2.843 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000537174302 517068482 /nfs/dbraw/zinc/06/84/82/517068482.db2.gz FCFAIJMOMYMXKE-HNNXBMFYSA-N 1 1 361.373 2.958 20 5 FFBDMO CC[N@@H+](CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])CCC(F)(F)F ZINC000559077602 517073134 /nfs/dbraw/zinc/07/31/34/517073134.db2.gz XGAJJKZCDBKVNO-UHFFFAOYSA-N 1 1 373.335 2.930 20 5 FFBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000514880016 517106967 /nfs/dbraw/zinc/10/69/67/517106967.db2.gz DQFTXVOWVMBEIC-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2C2CCOCC2)c([N+](=O)[O-])c1 ZINC000537525023 517219601 /nfs/dbraw/zinc/21/96/01/517219601.db2.gz OJIMUHXLXYLZTK-INIZCTEOSA-N 1 1 350.415 2.873 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970506 517229774 /nfs/dbraw/zinc/22/97/74/517229774.db2.gz OBGQSELNUJHOEK-IAGOWNOFSA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970506 517229780 /nfs/dbraw/zinc/22/97/80/517229780.db2.gz OBGQSELNUJHOEK-IAGOWNOFSA-N 1 1 361.442 2.619 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000542032540 517348480 /nfs/dbraw/zinc/34/84/80/517348480.db2.gz OTVIMJUFKHGSQE-UHFFFAOYSA-N 1 1 358.398 2.857 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000520421742 517386942 /nfs/dbraw/zinc/38/69/42/517386942.db2.gz AXRUUGOBIWWYFS-UXLLHSPISA-N 1 1 361.442 2.837 20 5 FFBDMO COC(=O)CCC1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000533344535 517415275 /nfs/dbraw/zinc/41/52/75/517415275.db2.gz KUZHUWLEAIUMJY-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO Cn1c(C(=O)NC[C@H]([NH2+]Cc2ccccc2)c2ccco2)ccc1[N+](=O)[O-] ZINC000552873067 517423407 /nfs/dbraw/zinc/42/34/07/517423407.db2.gz OKZHZELXNLKTBB-HNNXBMFYSA-N 1 1 368.393 2.787 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000562854492 517458823 /nfs/dbraw/zinc/45/88/23/517458823.db2.gz XMJQGQQZBUFSPJ-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO CCC[N@H+]1CC[C@H](CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000562854489 517459321 /nfs/dbraw/zinc/45/93/21/517459321.db2.gz XMJQGQQZBUFSPJ-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO CC(C)(C)c1cn2c([nH+]1)CC[C@H](Nc1cccc(C(N)=O)c1[N+](=O)[O-])C2 ZINC000552998285 517471247 /nfs/dbraw/zinc/47/12/47/517471247.db2.gz ZPKAYXDBNYKSOB-NSHDSACASA-N 1 1 357.414 2.615 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000559988718 517519239 /nfs/dbraw/zinc/51/92/39/517519239.db2.gz FQUKQWFYYDZDDJ-GOSISDBHSA-N 1 1 350.415 2.885 20 5 FFBDMO Cn1cc(CNCC2([NH+](C)C)CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538316861 517561332 /nfs/dbraw/zinc/56/13/32/517561332.db2.gz ALYHSLPXVZGSQX-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000553210997 517579115 /nfs/dbraw/zinc/57/91/15/517579115.db2.gz ZXPBVQOUZNYKQY-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO C[NH+](C)C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000549621818 517639778 /nfs/dbraw/zinc/63/97/78/517639778.db2.gz GQXRESFSDOIALU-MRXNPFEDSA-N 1 1 363.801 2.987 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000560252767 517658096 /nfs/dbraw/zinc/65/80/96/517658096.db2.gz XBOVFPLDEHUTKK-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000560252767 517658108 /nfs/dbraw/zinc/65/81/08/517658108.db2.gz XBOVFPLDEHUTKK-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000553390399 517686718 /nfs/dbraw/zinc/68/67/18/517686718.db2.gz YSMFAGNJTAJWDD-CYBMUJFWSA-N 1 1 367.409 2.598 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cc(F)c(F)cc2F)cc1 ZINC000542691347 517687578 /nfs/dbraw/zinc/68/75/78/517687578.db2.gz SQOKAXXLGIUESV-UHFFFAOYSA-N 1 1 374.340 2.576 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC000553562095 517784506 /nfs/dbraw/zinc/78/45/06/517784506.db2.gz SBZMEBPUVWCDHA-CQSZACIVSA-N 1 1 362.430 2.985 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516826133 517859053 /nfs/dbraw/zinc/85/90/53/517859053.db2.gz OROYAWHIIAEYGA-ACJLOTCBSA-N 1 1 373.457 2.600 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000521907692 517895620 /nfs/dbraw/zinc/89/56/20/517895620.db2.gz LJDGYDGQGLYNHH-HIFRSBDPSA-N 1 1 371.441 2.836 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])Nc1c[nH+]ccc1-n1cccn1 ZINC000517343944 518122712 /nfs/dbraw/zinc/12/27/12/518122712.db2.gz SCGLOBSWZBFLQU-UHFFFAOYSA-N 1 1 352.354 2.616 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000543580855 518143336 /nfs/dbraw/zinc/14/33/36/518143336.db2.gz GPAPMKHRGNQXJE-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000581455829 518292474 /nfs/dbraw/zinc/29/24/74/518292474.db2.gz BJNYQAMCCALFRC-HZSPNIEDSA-N 1 1 364.446 2.945 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCC1 ZINC000584372639 518308107 /nfs/dbraw/zinc/30/81/07/518308107.db2.gz FGJVOFGSQZGHIU-UHFFFAOYSA-N 1 1 373.457 2.792 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC000578784647 518372197 /nfs/dbraw/zinc/37/21/97/518372197.db2.gz QTRNDRJKSYNSCC-OAHLLOKOSA-N 1 1 360.458 2.872 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000576079157 518417766 /nfs/dbraw/zinc/41/77/66/518417766.db2.gz CIMFXBVEXDLLAI-KRWDZBQOSA-N 1 1 370.453 2.965 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000578931954 518441051 /nfs/dbraw/zinc/44/10/51/518441051.db2.gz BMJFCEJAENPIPI-ZDUSSCGKSA-N 1 1 357.476 2.610 20 5 FFBDMO CCC(CC)(C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(=O)OC ZINC000567283695 518444568 /nfs/dbraw/zinc/44/45/68/518444568.db2.gz VHKANEZCWNYLCQ-INIZCTEOSA-N 1 1 374.441 2.987 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000564610410 518525181 /nfs/dbraw/zinc/52/51/81/518525181.db2.gz KZBXUBQZJHRZOA-CQSZACIVSA-N 1 1 364.446 2.619 20 5 FFBDMO Cc1c(Br)c(=O)n(CC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000576332364 518540291 /nfs/dbraw/zinc/54/02/91/518540291.db2.gz LBWJNCZXRXCHGB-NSHDSACASA-N 1 1 358.236 2.702 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)c1 ZINC000585718387 518573346 /nfs/dbraw/zinc/57/33/46/518573346.db2.gz FXCCDUGGLXPYGS-FQEVSTJZSA-N 1 1 372.421 2.627 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000585767843 518591406 /nfs/dbraw/zinc/59/14/06/518591406.db2.gz KIQUPDCVHUGQGO-UHFFFAOYSA-N 1 1 358.398 2.777 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000576558065 518649630 /nfs/dbraw/zinc/64/96/30/518649630.db2.gz VVLCYMOWIPUJFL-GOSISDBHSA-N 1 1 358.442 2.998 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)NC(=O)NC1CCCC1 ZINC000576791008 518763815 /nfs/dbraw/zinc/76/38/15/518763815.db2.gz NTJFFBOXUILOCS-HNNXBMFYSA-N 1 1 374.441 2.543 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)NC(=O)NC1CCCC1 ZINC000576791008 518763818 /nfs/dbraw/zinc/76/38/18/518763818.db2.gz NTJFFBOXUILOCS-HNNXBMFYSA-N 1 1 374.441 2.543 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc1SC ZINC000582514725 518790500 /nfs/dbraw/zinc/79/05/00/518790500.db2.gz URHUBYBPWCFOST-NWDGAFQWSA-N 1 1 365.455 2.634 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000570992827 518875293 /nfs/dbraw/zinc/87/52/93/518875293.db2.gz CGYNTCTYAZEIGM-UHFFFAOYSA-N 1 1 361.273 2.975 20 5 FFBDMO C[C@@H]1CC[C@H]([N@@H+](CCO)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000589261246 518966202 /nfs/dbraw/zinc/96/62/02/518966202.db2.gz IXUGASHZOAICMV-YPMHNXCESA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1c(F)cccc1Cl ZINC000565476881 518974641 /nfs/dbraw/zinc/97/46/41/518974641.db2.gz YVSDNYGREXAYHC-NSHDSACASA-N 1 1 354.765 2.917 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000589537789 519026102 /nfs/dbraw/zinc/02/61/02/519026102.db2.gz ISFDCCMODRYMAC-CQSZACIVSA-N 1 1 374.441 2.758 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000574473716 519172316 /nfs/dbraw/zinc/17/23/16/519172316.db2.gz FZTPMPAMXGDTQG-LXIYXOSZSA-N 1 1 356.426 2.878 20 5 FFBDMO COc1cncc(/C=C/CC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 ZINC000583319474 519186735 /nfs/dbraw/zinc/18/67/35/519186735.db2.gz RFCKSSCKRZNCKO-GORDUTHDSA-N 1 1 369.425 2.619 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[C@@H]4C[N@@H+](C)C[C@@H]43)cc2[N+](=O)[O-])CC1 ZINC000590446584 519235055 /nfs/dbraw/zinc/23/50/55/519235055.db2.gz UWQQAOQUKZOFNY-APWZRJJASA-N 1 1 372.469 2.607 20 5 FFBDMO CCS(=O)(=O)NC1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000571720981 519237697 /nfs/dbraw/zinc/23/76/97/519237697.db2.gz AEONQXFIHCNCLC-UHFFFAOYSA-N 1 1 369.487 2.622 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc(N)c([N+](=O)[O-])n1 ZINC000590571336 519270536 /nfs/dbraw/zinc/27/05/36/519270536.db2.gz AFKIZMFJHSLYMH-CQSZACIVSA-N 1 1 355.442 2.980 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2cc(OC)c(C)cc2[N+](=O)[O-])CC1 ZINC000590574666 519271579 /nfs/dbraw/zinc/27/15/79/519271579.db2.gz PVXBGQKSCONEPW-CQSZACIVSA-N 1 1 350.463 2.597 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc([NH2+]CC3CCCC3)cc2)c1 ZINC000571910466 519341377 /nfs/dbraw/zinc/34/13/77/519341377.db2.gz ZBEWGGGTTYHXNW-SFHVURJKSA-N 1 1 359.430 2.866 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1 ZINC000583722170 519398005 /nfs/dbraw/zinc/39/80/05/519398005.db2.gz KUVKKBOEOORSRA-SJLPKXTDSA-N 1 1 359.426 2.957 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C1CCCC1 ZINC000591011859 519474087 /nfs/dbraw/zinc/47/40/87/519474087.db2.gz RSWMMTNZBNWOAA-UHFFFAOYSA-N 1 1 365.430 2.823 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)c1 ZINC000566429318 519487940 /nfs/dbraw/zinc/48/79/40/519487940.db2.gz SNYLECDLDHUMCB-HOTGVXAUSA-N 1 1 357.410 2.527 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000594417590 519953779 /nfs/dbraw/zinc/95/37/79/519953779.db2.gz CCRYPJQOOHITKG-MAUKXSAKSA-N 1 1 369.425 2.732 20 5 FFBDMO Cn1cc(C[NH2+][C@@H](CCO)c2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])n1 ZINC000602917523 519969925 /nfs/dbraw/zinc/96/99/25/519969925.db2.gz LVEZKKXSAYKKCN-ZDUSSCGKSA-N 1 1 359.213 2.848 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594604057 520049845 /nfs/dbraw/zinc/04/98/45/520049845.db2.gz XRPKZDRUBPUBKI-IEBWSBKVSA-N 1 1 374.485 2.856 20 5 FFBDMO O=C(NC1CC1)c1ccc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594604472 520049966 /nfs/dbraw/zinc/04/99/66/520049966.db2.gz ZORZQZBNOXUCOE-DOTOQJQBSA-N 1 1 358.442 2.916 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600110238 520053442 /nfs/dbraw/zinc/05/34/42/520053442.db2.gz ZERCQOQVXBSRKG-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO CCOC(=O)c1[nH]c(C)c(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1C ZINC000600156084 520088991 /nfs/dbraw/zinc/08/89/91/520088991.db2.gz MWRBNEXWJCZOCQ-UHFFFAOYSA-N 1 1 371.397 2.883 20 5 FFBDMO CNC(=O)c1ccc(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000591987099 520122072 /nfs/dbraw/zinc/12/20/72/520122072.db2.gz VGGIQLKKCJXAHE-SJORKVTESA-N 1 1 368.437 2.712 20 5 FFBDMO CN(CC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000600229082 520140866 /nfs/dbraw/zinc/14/08/66/520140866.db2.gz OPKRSBYJJYMMPS-INIZCTEOSA-N 1 1 360.458 2.554 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866650 520149786 /nfs/dbraw/zinc/14/97/86/520149786.db2.gz LAKMHVRYNNAKCS-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866650 520149790 /nfs/dbraw/zinc/14/97/90/520149790.db2.gz LAKMHVRYNNAKCS-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000600298101 520189257 /nfs/dbraw/zinc/18/92/57/520189257.db2.gz FZVUDXFMCPCFJZ-MRXNPFEDSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000600298101 520189261 /nfs/dbraw/zinc/18/92/61/520189261.db2.gz FZVUDXFMCPCFJZ-MRXNPFEDSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000600299490 520189371 /nfs/dbraw/zinc/18/93/71/520189371.db2.gz UHYOJUREPCUWQD-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000600299490 520189379 /nfs/dbraw/zinc/18/93/79/520189379.db2.gz UHYOJUREPCUWQD-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO CCN(CC)C(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131226 520207965 /nfs/dbraw/zinc/20/79/65/520207965.db2.gz UKBLDOIHWBSWQI-QAQDUYKDSA-N 1 1 363.458 2.569 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131226 520207969 /nfs/dbraw/zinc/20/79/69/520207969.db2.gz UKBLDOIHWBSWQI-QAQDUYKDSA-N 1 1 363.458 2.569 20 5 FFBDMO Cc1ncc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000592132215 520208272 /nfs/dbraw/zinc/20/82/72/520208272.db2.gz CETHWXXPMFUEGR-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1ncc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000592132215 520208280 /nfs/dbraw/zinc/20/82/80/520208280.db2.gz CETHWXXPMFUEGR-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCn1ccnc1)[C@H]1CC[C@H](O)CC1 ZINC000592133628 520210657 /nfs/dbraw/zinc/21/06/57/520210657.db2.gz ZJUBVIUQMSRVMK-IYARVYRRSA-N 1 1 358.442 2.987 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](CCO)c1ccccc1F ZINC000592162033 520237397 /nfs/dbraw/zinc/23/73/97/520237397.db2.gz UKMAPRKGXVDRNJ-MRXNPFEDSA-N 1 1 361.373 2.694 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)CN2CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000594979855 520240693 /nfs/dbraw/zinc/24/06/93/520240693.db2.gz MNCJJTGEZUIXLI-AWEZNQCLSA-N 1 1 351.447 2.822 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@H](CNCc2ccccc2[N+](=O)[O-])C1 ZINC000594993692 520247989 /nfs/dbraw/zinc/24/79/89/520247989.db2.gz HAIXINXQIKPORF-LJQANCHMSA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNCc2ccccc2[N+](=O)[O-])C1 ZINC000594993692 520247994 /nfs/dbraw/zinc/24/79/94/520247994.db2.gz HAIXINXQIKPORF-LJQANCHMSA-N 1 1 354.454 2.501 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCc2c1cnn2CCO ZINC000595019004 520258751 /nfs/dbraw/zinc/25/87/51/520258751.db2.gz VLSDPHLJNQUJQV-BLLLJJGKSA-N 1 1 360.414 2.520 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595056351 520271678 /nfs/dbraw/zinc/27/16/78/520271678.db2.gz FOPMTLYOKMYXIM-NVXWUHKLSA-N 1 1 357.458 2.880 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600473180 520280874 /nfs/dbraw/zinc/28/08/74/520280874.db2.gz SQBXKZJYFYGHMD-MRXNPFEDSA-N 1 1 356.426 2.752 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000597855057 520283951 /nfs/dbraw/zinc/28/39/51/520283951.db2.gz QBWUGUIKJIRZIY-ZDUSSCGKSA-N 1 1 351.472 2.924 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000597859373 520287500 /nfs/dbraw/zinc/28/75/00/520287500.db2.gz CZLFZJHZQNEWAS-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO Cn1cc(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597925371 520325954 /nfs/dbraw/zinc/32/59/54/520325954.db2.gz NWKDXRSSBIXABB-CQSZACIVSA-N 1 1 371.441 2.598 20 5 FFBDMO C[N@@H+](CCn1c(=O)c([N+](=O)[O-])cc2c1CCCC2)Cc1ccc(F)cc1 ZINC000592360386 520349115 /nfs/dbraw/zinc/34/91/15/520349115.db2.gz IIGOMVZCYACAFT-UHFFFAOYSA-N 1 1 359.401 2.906 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])CC1 ZINC000603854256 520379635 /nfs/dbraw/zinc/37/96/35/520379635.db2.gz YKVGTKMCZUREGZ-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000592479448 520407372 /nfs/dbraw/zinc/40/73/72/520407372.db2.gz ZQFOKSJASCDSOH-DOTOQJQBSA-N 1 1 360.458 2.696 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705266 520411136 /nfs/dbraw/zinc/41/11/36/520411136.db2.gz NEGHAMSYECYZPG-OCCSQVGLSA-N 1 1 369.849 2.611 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[NH+](CCC(C)(C)C)CC1 ZINC000603959819 520415356 /nfs/dbraw/zinc/41/53/56/520415356.db2.gz WZUUMOWCYVPWGG-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592493962 520416061 /nfs/dbraw/zinc/41/60/61/520416061.db2.gz XYYBOBQYTZPRSZ-BBWFWOEESA-N 1 1 374.485 2.942 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609731665 520416091 /nfs/dbraw/zinc/41/60/91/520416091.db2.gz HOWOVHWYTCSVTD-ZDUSSCGKSA-N 1 1 369.849 2.817 20 5 FFBDMO Cc1noc(C[NH+]2CCC(C(=O)NC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000595361147 520428847 /nfs/dbraw/zinc/42/88/47/520428847.db2.gz QETQGPGHPHKNRT-UHFFFAOYSA-N 1 1 350.419 2.552 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604197928 520481222 /nfs/dbraw/zinc/48/12/22/520481222.db2.gz BTIWOZKUGOMFDK-GDBMZVCRSA-N 1 1 360.458 2.655 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000609963934 520491250 /nfs/dbraw/zinc/49/12/50/520491250.db2.gz JQVKYJWUSCZYCS-STQMWFEESA-N 1 1 350.419 2.841 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000610100365 520540676 /nfs/dbraw/zinc/54/06/76/520540676.db2.gz WYQVHIKUZLVESH-MSOLQXFVSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000610121994 520549568 /nfs/dbraw/zinc/54/95/68/520549568.db2.gz KYKRZNULXIGRAT-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595557147 520551637 /nfs/dbraw/zinc/55/16/37/520551637.db2.gz HOHWIFXVFLALPG-INIZCTEOSA-N 1 1 357.385 2.872 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595572302 520559907 /nfs/dbraw/zinc/55/99/07/520559907.db2.gz DTTDQRUPWALJKU-LJQANCHMSA-N 1 1 368.437 2.711 20 5 FFBDMO Cc1cc(N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601183667 520677281 /nfs/dbraw/zinc/67/72/81/520677281.db2.gz BMBWLWBHEQDKNH-CVEARBPZSA-N 1 1 353.426 2.748 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](OCc3ccncc3)C2)c1 ZINC000593029420 520693154 /nfs/dbraw/zinc/69/31/54/520693154.db2.gz UETOIWLNVSZRDG-KRWDZBQOSA-N 1 1 371.393 2.568 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](OCc3ccncc3)C2)c1 ZINC000593029420 520693158 /nfs/dbraw/zinc/69/31/58/520693158.db2.gz UETOIWLNVSZRDG-KRWDZBQOSA-N 1 1 371.393 2.568 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749751 520697807 /nfs/dbraw/zinc/69/78/07/520697807.db2.gz HHMNZYNYWNEOBZ-KRWDZBQOSA-N 1 1 372.368 2.942 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595789780 520727737 /nfs/dbraw/zinc/72/77/37/520727737.db2.gz OHLNPJXXKVBKFV-LPHOPBHVSA-N 1 1 373.453 2.765 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2CC(C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000598676209 520782342 /nfs/dbraw/zinc/78/23/42/520782342.db2.gz DRTWLBJQGVVWLE-UHFFFAOYSA-N 1 1 370.405 2.920 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000610662828 520785409 /nfs/dbraw/zinc/78/54/09/520785409.db2.gz ZCJFWMNDBJQPIF-UHFFFAOYSA-N 1 1 356.382 2.540 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNc1cc(N)c([N+](=O)[O-])c(CO)c1)C1CC1 ZINC000614153756 520827955 /nfs/dbraw/zinc/82/79/55/520827955.db2.gz VDTNJQOYHXFBQS-IBGZPJMESA-N 1 1 370.453 2.992 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000596038402 520870737 /nfs/dbraw/zinc/87/07/37/520870737.db2.gz MLGDROVDTOHFDR-LPHOPBHVSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000596038402 520870741 /nfs/dbraw/zinc/87/07/41/520870741.db2.gz MLGDROVDTOHFDR-LPHOPBHVSA-N 1 1 369.421 2.957 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000598887773 520901171 /nfs/dbraw/zinc/90/11/71/520901171.db2.gz BYZSARYBRZARBQ-UHFFFAOYSA-N 1 1 367.446 2.852 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] ZINC000598887808 520901974 /nfs/dbraw/zinc/90/19/74/520901974.db2.gz CPYODGSMTXBRNK-UHFFFAOYSA-N 1 1 367.446 2.852 20 5 FFBDMO CC1CCC(O)(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000596094008 520908209 /nfs/dbraw/zinc/90/82/09/520908209.db2.gz GGPWSWMQUHVBFS-LTCLLZNKSA-N 1 1 358.442 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1N1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000596140854 520936559 /nfs/dbraw/zinc/93/65/59/520936559.db2.gz JQHPWUGBEQQMIF-GFCCVEGCSA-N 1 1 370.247 2.516 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596160220 520945330 /nfs/dbraw/zinc/94/53/30/520945330.db2.gz BEXFBBZZSRQGTP-JOYOIKCWSA-N 1 1 353.806 2.929 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000598978005 520955542 /nfs/dbraw/zinc/95/55/42/520955542.db2.gz GHFIVRBBSDTCIW-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000601884406 521006507 /nfs/dbraw/zinc/00/65/07/521006507.db2.gz YBFZGUBEALGMIV-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cccc(Cn2nc([N+](=O)[O-])cc2C)c1 ZINC000593464192 521012055 /nfs/dbraw/zinc/01/20/55/521012055.db2.gz FLTLSLVSZWARSP-UHFFFAOYSA-N 1 1 373.457 2.610 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000596307338 521020026 /nfs/dbraw/zinc/02/00/26/521020026.db2.gz KSMYNZJPLSYSEM-GFCCVEGCSA-N 1 1 355.460 2.531 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2COCCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599078100 521020218 /nfs/dbraw/zinc/02/02/18/521020218.db2.gz JGTDHAOLHAZZDD-LPHOPBHVSA-N 1 1 359.426 2.760 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599083378 521021364 /nfs/dbraw/zinc/02/13/64/521021364.db2.gz KPQNIPAFZOFGPK-MNOVXSKESA-N 1 1 368.231 2.714 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000596461638 521084868 /nfs/dbraw/zinc/08/48/68/521084868.db2.gz IUEHIXXHXSDZSB-QGZVFWFLSA-N 1 1 357.458 2.873 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(F)c1 ZINC000596514749 521109160 /nfs/dbraw/zinc/10/91/60/521109160.db2.gz DPGAOOMHCYVWMC-HUUCEWRRSA-N 1 1 353.369 2.928 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000596540041 521123887 /nfs/dbraw/zinc/12/38/87/521123887.db2.gz SCFBQUOIOPISSF-ZDUSSCGKSA-N 1 1 359.348 2.649 20 5 FFBDMO O=c1[nH]cnc2cc(NC[C@H]3CC[N@H+]3Cc3ccccc3)c([N+](=O)[O-])cc21 ZINC000596553339 521128687 /nfs/dbraw/zinc/12/86/87/521128687.db2.gz QFRNDZUMPWHLOJ-CQSZACIVSA-N 1 1 365.393 2.930 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000593658969 521136578 /nfs/dbraw/zinc/13/65/78/521136578.db2.gz JTJWZDWDXRRODB-HNNXBMFYSA-N 1 1 366.414 2.536 20 5 FFBDMO CC1(C)CN(C(=O)C2CC2)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611463162 521170297 /nfs/dbraw/zinc/17/02/97/521170297.db2.gz DZYGXWXOQDMLLW-UHFFFAOYSA-N 1 1 361.442 2.697 20 5 FFBDMO CC1(C)CN(C(=O)C2CC2)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611463162 521170303 /nfs/dbraw/zinc/17/03/03/521170303.db2.gz DZYGXWXOQDMLLW-UHFFFAOYSA-N 1 1 361.442 2.697 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735958 521181989 /nfs/dbraw/zinc/18/19/89/521181989.db2.gz AYJYDPNHUMBGQB-FRFSOERESA-N 1 1 353.850 2.967 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735958 521182001 /nfs/dbraw/zinc/18/20/01/521182001.db2.gz AYJYDPNHUMBGQB-FRFSOERESA-N 1 1 353.850 2.967 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599391705 521194573 /nfs/dbraw/zinc/19/45/73/521194573.db2.gz QLYKBTLAIQAZMQ-HNNXBMFYSA-N 1 1 367.471 2.589 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1C ZINC000599464732 521239973 /nfs/dbraw/zinc/23/99/73/521239973.db2.gz RNWRREOZKGGMCV-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H]1C[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H](C)C1(F)F ZINC000599512149 521267570 /nfs/dbraw/zinc/26/75/70/521267570.db2.gz DFVHOVXBAYNGSR-RYUDHWBXSA-N 1 1 353.369 2.707 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596827632 521313182 /nfs/dbraw/zinc/31/31/82/521313182.db2.gz FPCPOTDAFKHVDN-CQSZACIVSA-N 1 1 362.430 2.847 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](c3cnn(C)c3)C(C)(C)C2)c1 ZINC000593998005 521338366 /nfs/dbraw/zinc/33/83/66/521338366.db2.gz MJISEABPUVJTMR-MRXNPFEDSA-N 1 1 372.425 2.741 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027141 521359577 /nfs/dbraw/zinc/35/95/77/521359577.db2.gz RGWSCGGGNJNGMA-MSOLQXFVSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027141 521359588 /nfs/dbraw/zinc/35/95/88/521359588.db2.gz RGWSCGGGNJNGMA-MSOLQXFVSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027142 521360728 /nfs/dbraw/zinc/36/07/28/521360728.db2.gz RGWSCGGGNJNGMA-QZTJIDSGSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027142 521360737 /nfs/dbraw/zinc/36/07/37/521360737.db2.gz RGWSCGGGNJNGMA-QZTJIDSGSA-N 1 1 359.426 2.734 20 5 FFBDMO COC(=O)[C@](C)(NCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599651154 521361651 /nfs/dbraw/zinc/36/16/51/521361651.db2.gz HLBHHIAMIPDAES-ZRGWGRIASA-N 1 1 363.458 2.551 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2cc(F)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000599687229 521403318 /nfs/dbraw/zinc/40/33/18/521403318.db2.gz OIUFSBITDNEFIM-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2cc(F)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000599687229 521403324 /nfs/dbraw/zinc/40/33/24/521403324.db2.gz OIUFSBITDNEFIM-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2[C@H](C)CC(C(=O)OC)C[C@H]2C)c1 ZINC000599692462 521405754 /nfs/dbraw/zinc/40/57/54/521405754.db2.gz SXLSXOPIZBRSGF-VXGBXAGGSA-N 1 1 364.398 2.543 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000612030455 521446520 /nfs/dbraw/zinc/44/65/20/521446520.db2.gz KFUHOQDBKQJVJU-YLJYHZDGSA-N 1 1 372.421 2.798 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCC[N@@H+](CCCO)C1 ZINC000602675886 521474319 /nfs/dbraw/zinc/47/43/19/521474319.db2.gz WPBRABFSADBYKG-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@@H]1CCC[N@H+](CCCO)C1 ZINC000602675886 521474325 /nfs/dbraw/zinc/47/43/25/521474325.db2.gz WPBRABFSADBYKG-CQSZACIVSA-N 1 1 361.364 2.550 20 5 FFBDMO COC(=O)[C@H](CC(C)(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602700642 521486061 /nfs/dbraw/zinc/48/60/61/521486061.db2.gz MZPKGQVORGXKQW-HNNXBMFYSA-N 1 1 364.446 2.526 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597095686 521500835 /nfs/dbraw/zinc/50/08/35/521500835.db2.gz FDRQDXGJYJHOKF-CYBMUJFWSA-N 1 1 355.826 2.634 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(CCc2cnccn2)CC1 ZINC000602743678 521510397 /nfs/dbraw/zinc/51/03/97/521510397.db2.gz YBIXOIISBCYDHY-LGMDPLHJSA-N 1 1 367.453 2.648 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[NH+](CCc2cnccn2)CC1 ZINC000602743678 521510399 /nfs/dbraw/zinc/51/03/99/521510399.db2.gz YBIXOIISBCYDHY-LGMDPLHJSA-N 1 1 367.453 2.648 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000602786545 521530658 /nfs/dbraw/zinc/53/06/58/521530658.db2.gz QZRRSDCZKGNRDX-GOSISDBHSA-N 1 1 357.458 2.554 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594284314 521537180 /nfs/dbraw/zinc/53/71/80/521537180.db2.gz VQXCHRPTSIPMBW-WMZOPIPTSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1Cn1c(C)nc2ccccc21 ZINC000602795360 521537757 /nfs/dbraw/zinc/53/77/57/521537757.db2.gz MOSONJVRTASLOL-INIZCTEOSA-N 1 1 368.441 2.922 20 5 FFBDMO Cc1c([C@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000602804409 521542841 /nfs/dbraw/zinc/54/28/41/521542841.db2.gz FXZXKYNDJJCTLG-NSHDSACASA-N 1 1 358.377 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccns4)CC3)nc2c1 ZINC000602809253 521545686 /nfs/dbraw/zinc/54/56/86/521545686.db2.gz PAZIOXVNQQGIIN-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO Cn1cc(C[N@@H+]2C[C@]3(C)COC[C@]3(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597195237 521568400 /nfs/dbraw/zinc/56/84/00/521568400.db2.gz FFZQPFAKMSYPGJ-KDURUIRLSA-N 1 1 356.426 2.854 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062101 521613644 /nfs/dbraw/zinc/61/36/44/521613644.db2.gz CIILWMXJJHPWRE-HZMBPMFUSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062101 521613648 /nfs/dbraw/zinc/61/36/48/521613648.db2.gz CIILWMXJJHPWRE-HZMBPMFUSA-N 1 1 358.236 2.797 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000619864428 521909556 /nfs/dbraw/zinc/90/95/56/521909556.db2.gz OZJKWYBURAEOJN-QFBILLFUSA-N 1 1 374.441 2.625 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000619863438 521909582 /nfs/dbraw/zinc/90/95/82/521909582.db2.gz FUDKKTIACPVLER-VQIMIIECSA-N 1 1 374.441 2.625 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCC[NH+]2CCOCC2)nc1-c1ccc(F)cc1 ZINC000485406051 561318416 /nfs/dbraw/zinc/31/84/16/561318416.db2.gz NDFYWMITSJZZRM-UHFFFAOYSA-N 1 1 360.389 2.930 20 5 FFBDMO CC(C)C[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[NH+]1CCOCC1 ZINC000509039142 561782328 /nfs/dbraw/zinc/78/23/28/561782328.db2.gz JLHZMPVOGFCJLI-CQSZACIVSA-N 1 1 359.430 2.697 20 5 FFBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1-c1nn[nH]n1 ZINC000821818512 606772317 /nfs/dbraw/zinc/77/23/17/606772317.db2.gz USUYNZWZXYCQII-UHFFFAOYSA-N 1 1 374.788 2.727 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000824656555 609314410 /nfs/dbraw/zinc/31/44/10/609314410.db2.gz LPPUMYCNBDWLQN-STQMWFEESA-N 1 1 371.445 2.840 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637568 719238904 /nfs/dbraw/zinc/23/89/04/719238904.db2.gz WKEHKSUGUMAWMA-NKWVEPMBSA-N 1 1 353.732 2.586 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637568 719238909 /nfs/dbraw/zinc/23/89/09/719238909.db2.gz WKEHKSUGUMAWMA-NKWVEPMBSA-N 1 1 353.732 2.586 20 5 FFBDMO C[N@H+]1CCO[C@H]2CN(c3ccc4ccc5ccc(Cl)nc5c4n3)C[C@H]21 ZINC001164671915 719396186 /nfs/dbraw/zinc/39/61/86/719396186.db2.gz ZWAGWDILYQGQTP-CABCVRRESA-N 1 1 354.841 2.956 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(N3CC[C@@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc21 ZINC001164724694 720402479 /nfs/dbraw/zinc/40/24/79/720402479.db2.gz KOCZLXGWUSWNIN-CVEARBPZSA-N 1 1 364.409 2.719 20 5 FFBDMO Cc1ccnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)c1[N+](=O)[O-] ZINC001164899726 721521312 /nfs/dbraw/zinc/52/13/12/721521312.db2.gz LYRBLYQERJPRDH-DOTOQJQBSA-N 1 1 372.400 2.779 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000155109197 728820387 /nfs/dbraw/zinc/82/03/87/728820387.db2.gz KSYNAECZDQERRV-SNVBAGLBSA-N 1 1 371.235 2.821 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000155122116 728820818 /nfs/dbraw/zinc/82/08/18/728820818.db2.gz AWSMGZJBJDGAMC-UHFFFAOYSA-N 1 1 359.224 2.819 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000159110211 728900922 /nfs/dbraw/zinc/90/09/22/728900922.db2.gz AKIRZQJITPKRDN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000159110211 728900924 /nfs/dbraw/zinc/90/09/24/728900924.db2.gz AKIRZQJITPKRDN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCC[N@H+](CCF)C1 ZINC000899219895 735461319 /nfs/dbraw/zinc/46/13/19/735461319.db2.gz FVWLJQQAJXUYKG-ZDUSSCGKSA-N 1 1 357.813 2.731 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCC[N@@H+](CCF)C1 ZINC000899219895 735461321 /nfs/dbraw/zinc/46/13/21/735461321.db2.gz FVWLJQQAJXUYKG-ZDUSSCGKSA-N 1 1 357.813 2.731 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000081096042 728393922 /nfs/dbraw/zinc/39/39/22/728393922.db2.gz JRAVLPFOIBHNAA-IUODEOHRSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000120308065 728609531 /nfs/dbraw/zinc/60/95/31/728609531.db2.gz IFHZWWMZUHARGS-NWDGAFQWSA-N 1 1 373.500 2.588 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000122341277 728646433 /nfs/dbraw/zinc/64/64/33/728646433.db2.gz UBSTZROGEKUZLD-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000122341277 728646435 /nfs/dbraw/zinc/64/64/35/728646435.db2.gz UBSTZROGEKUZLD-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO CCC[N@H+](CC(=O)N(C)C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123003254 728653972 /nfs/dbraw/zinc/65/39/72/728653972.db2.gz JYYMVXUHJRFPNQ-UHFFFAOYSA-N 1 1 358.236 2.658 20 5 FFBDMO CCC[N@@H+](CC(=O)N(C)C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123003254 728653973 /nfs/dbraw/zinc/65/39/73/728653973.db2.gz JYYMVXUHJRFPNQ-UHFFFAOYSA-N 1 1 358.236 2.658 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000906201144 736469336 /nfs/dbraw/zinc/46/93/36/736469336.db2.gz WDHAYHSLORBKRU-CVEARBPZSA-N 1 1 351.834 2.924 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000857634725 730403283 /nfs/dbraw/zinc/40/32/83/730403283.db2.gz MISRELFAPSDUQA-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC000769517796 737538388 /nfs/dbraw/zinc/53/83/88/737538388.db2.gz XNXCZDCATBBDMV-NXEZZACHSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC000769517796 737538390 /nfs/dbraw/zinc/53/83/90/737538390.db2.gz XNXCZDCATBBDMV-NXEZZACHSA-N 1 1 357.204 2.598 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000868480610 731296661 /nfs/dbraw/zinc/29/66/61/731296661.db2.gz BKYOBZYYSPJTDA-ZFWWWQNUSA-N 1 1 366.849 2.526 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557759 732721781 /nfs/dbraw/zinc/72/17/81/732721781.db2.gz FKAFDIBRKVLDAX-QWRGUYRKSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557759 732721785 /nfs/dbraw/zinc/72/17/85/732721785.db2.gz FKAFDIBRKVLDAX-QWRGUYRKSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2CSC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000879566781 732724891 /nfs/dbraw/zinc/72/48/91/732724891.db2.gz YGUVBIMCLFDJEP-NWDGAFQWSA-N 1 1 353.419 2.747 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cccc([N+](=O)[O-])c3Br)CC[C@H]21 ZINC000879579077 732728504 /nfs/dbraw/zinc/72/85/04/732728504.db2.gz JOGUXXVIHKTPHR-DGCLKSJQSA-N 1 1 354.248 2.883 20 5 FFBDMO CN(C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000885989207 733739002 /nfs/dbraw/zinc/73/90/02/733739002.db2.gz YKXGBWZKBRIMEU-ZDUSSCGKSA-N 1 1 350.419 2.679 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000885989207 733739005 /nfs/dbraw/zinc/73/90/05/733739005.db2.gz YKXGBWZKBRIMEU-ZDUSSCGKSA-N 1 1 350.419 2.679 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098214 738823424 /nfs/dbraw/zinc/82/34/24/738823424.db2.gz HFYZFNMFWFTMRM-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098214 738823427 /nfs/dbraw/zinc/82/34/27/738823427.db2.gz HFYZFNMFWFTMRM-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100785 738823878 /nfs/dbraw/zinc/82/38/78/738823878.db2.gz ZNOCHFUPYWPBMH-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100785 738823885 /nfs/dbraw/zinc/82/38/85/738823885.db2.gz ZNOCHFUPYWPBMH-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCCC[C@H]3C[NH+]3CCOCC3)sc2c1 ZINC000732049379 734714501 /nfs/dbraw/zinc/71/45/01/734714501.db2.gz SJKGZDGPDOYCII-AWEZNQCLSA-N 1 1 362.455 2.896 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894048514 734793027 /nfs/dbraw/zinc/79/30/27/734793027.db2.gz ZGGTVGPRGYJEQO-GJZGRUSLSA-N 1 1 366.849 2.669 20 5 FFBDMO CNC(=O)COc1cccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000740004489 735064850 /nfs/dbraw/zinc/06/48/50/735064850.db2.gz OCZSTQCQEFVKBB-UHFFFAOYSA-N 1 1 363.801 2.663 20 5 FFBDMO CO[C@@]1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCSC1 ZINC000903314409 736074510 /nfs/dbraw/zinc/07/45/10/736074510.db2.gz NHFOOVVNVHAQCR-NVXWUHKLSA-N 1 1 362.455 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCS[C@H]4COCC[C@H]43)c2)cc1 ZINC000767782347 737367788 /nfs/dbraw/zinc/36/77/88/737367788.db2.gz ITQKTLFWFMFDHM-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCS[C@H]4COCC[C@H]43)c2)cc1 ZINC000767782347 737367791 /nfs/dbraw/zinc/36/77/91/737367791.db2.gz ITQKTLFWFMFDHM-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768542223 737431150 /nfs/dbraw/zinc/43/11/50/737431150.db2.gz QNLSJWGYQISEGJ-TZMCWYRMSA-N 1 1 369.849 2.611 20 5 FFBDMO CN(CC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000768747753 737454662 /nfs/dbraw/zinc/45/46/62/737454662.db2.gz PYKXTMMAWCLTIW-UHFFFAOYSA-N 1 1 353.419 2.772 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)OCC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000919226245 737845570 /nfs/dbraw/zinc/84/55/70/737845570.db2.gz DIDQQZYTRKIEIF-ZDUSSCGKSA-N 1 1 351.359 2.843 20 5 FFBDMO CC[C@H](CSC)[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000773260624 737886281 /nfs/dbraw/zinc/88/62/81/737886281.db2.gz YNJKHTPLOSQVLX-CYBMUJFWSA-N 1 1 352.460 2.868 20 5 FFBDMO Cn1ccnc1[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774640180 738008800 /nfs/dbraw/zinc/00/88/00/738008800.db2.gz PZEWZIBMYCPURE-LLVKDONJSA-N 1 1 360.805 2.778 20 5 FFBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774640180 738008804 /nfs/dbraw/zinc/00/88/04/738008804.db2.gz PZEWZIBMYCPURE-LLVKDONJSA-N 1 1 360.805 2.778 20 5 FFBDMO CSc1cccc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-] ZINC000777316321 738278224 /nfs/dbraw/zinc/27/82/24/738278224.db2.gz XRVDIFPTHJRICG-CYBMUJFWSA-N 1 1 368.455 2.830 20 5 FFBDMO CN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCC[N@@H+](C)C1 ZINC000929832134 739026403 /nfs/dbraw/zinc/02/64/03/739026403.db2.gz AUKFFWSUWKODAI-NSHDSACASA-N 1 1 358.345 2.754 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700839 739314044 /nfs/dbraw/zinc/31/40/44/739314044.db2.gz ZPBRZOUTUMTEJK-KBPBESRZSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700839 739314049 /nfs/dbraw/zinc/31/40/49/739314049.db2.gz ZPBRZOUTUMTEJK-KBPBESRZSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@]1(C2CC[NH+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)COC(=O)N1 ZINC000932094059 739385597 /nfs/dbraw/zinc/38/55/97/739385597.db2.gz SJCZYKUCSXVCBN-INIZCTEOSA-N 1 1 353.806 2.959 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790765576 739492683 /nfs/dbraw/zinc/49/26/83/739492683.db2.gz QBRVLMHFSCRVIJ-OAHLLOKOSA-N 1 1 357.813 2.728 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000933976758 739713521 /nfs/dbraw/zinc/71/35/21/739713521.db2.gz UTIIHEBBAAVLTO-IAGOWNOFSA-N 1 1 362.455 2.542 20 5 FFBDMO CO[C@H]1CC[C@@H]1[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107645 739731822 /nfs/dbraw/zinc/73/18/22/739731822.db2.gz XNXTVPSKQHRMDC-AAEUAGOBSA-N 1 1 352.778 2.907 20 5 FFBDMO CO[C@H]1CC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107645 739731826 /nfs/dbraw/zinc/73/18/26/739731826.db2.gz XNXTVPSKQHRMDC-AAEUAGOBSA-N 1 1 352.778 2.907 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119233 739732725 /nfs/dbraw/zinc/73/27/25/739732725.db2.gz WZXROGVBHCSWHZ-DGCLKSJQSA-N 1 1 360.357 2.857 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H]2CC[C@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119233 739732730 /nfs/dbraw/zinc/73/27/30/739732730.db2.gz WZXROGVBHCSWHZ-DGCLKSJQSA-N 1 1 360.357 2.857 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333006 739766952 /nfs/dbraw/zinc/76/69/52/739766952.db2.gz NJYQLGWHKORVNQ-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333006 739766958 /nfs/dbraw/zinc/76/69/58/739766958.db2.gz NJYQLGWHKORVNQ-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H]1CCC[N@@H+]1CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795431403 740021100 /nfs/dbraw/zinc/02/11/00/740021100.db2.gz GIMCHOXTZFIWOG-SECBINFHSA-N 1 1 354.204 2.755 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795431403 740021104 /nfs/dbraw/zinc/02/11/04/740021104.db2.gz GIMCHOXTZFIWOG-SECBINFHSA-N 1 1 354.204 2.755 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000805823184 741014424 /nfs/dbraw/zinc/01/44/24/741014424.db2.gz ARPSZTIQEKIBFO-ZDUSSCGKSA-N 1 1 368.455 2.830 20 5 FFBDMO C[C@H](C[N+](=O)[O-])OC(=O)c1ccccc1OCC[N@H+]1CCCC[C@@H]1C ZINC000814045110 741787881 /nfs/dbraw/zinc/78/78/81/741787881.db2.gz MTIWIMDSXLCWFA-LSDHHAIUSA-N 1 1 350.415 2.762 20 5 FFBDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1n1cccn1 ZINC000815166951 741908204 /nfs/dbraw/zinc/90/82/04/741908204.db2.gz MXJVTHFXULKJHC-OAGGEKHMSA-N 1 1 350.806 2.953 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](O)CC12CCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000817291528 742118967 /nfs/dbraw/zinc/11/89/67/742118967.db2.gz OEIARGFURRHQMN-GFCCVEGCSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](O)CC12CCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000817291528 742118969 /nfs/dbraw/zinc/11/89/69/742118969.db2.gz OEIARGFURRHQMN-GFCCVEGCSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000834595335 745864512 /nfs/dbraw/zinc/86/45/12/745864512.db2.gz XICGOTWODWZJOB-UONOGXRCSA-N 1 1 373.787 2.575 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000839502882 746841976 /nfs/dbraw/zinc/84/19/76/746841976.db2.gz IEDPIEAYSRRDAM-OCCSQVGLSA-N 1 1 368.865 2.991 20 5 FFBDMO CC(C)[N@H+](C[C@@H]1CCC(=O)N1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000840188002 747033485 /nfs/dbraw/zinc/03/34/85/747033485.db2.gz JQQJOULQOQTDFC-NSHDSACASA-N 1 1 364.427 2.818 20 5 FFBDMO CC(C)[N@@H+](C[C@@H]1CCC(=O)N1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000840188002 747033491 /nfs/dbraw/zinc/03/34/91/747033491.db2.gz JQQJOULQOQTDFC-NSHDSACASA-N 1 1 364.427 2.818 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000846929294 748577301 /nfs/dbraw/zinc/57/73/01/748577301.db2.gz KCNZOJYRSCVNCF-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000847256369 748663329 /nfs/dbraw/zinc/66/33/29/748663329.db2.gz PQAUIAJXFKYYSM-LSDHHAIUSA-N 1 1 353.369 2.820 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)OCC[C@H]2CC[N@@H+](C)C2)cc1OC ZINC000847827112 748790920 /nfs/dbraw/zinc/79/09/20/748790920.db2.gz HNMSTUYKPMHFNM-GFCCVEGCSA-N 1 1 352.387 2.501 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910501 749725266 /nfs/dbraw/zinc/72/52/66/749725266.db2.gz COGATNUTLLNXFQ-CMPLNLGQSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910501 749725271 /nfs/dbraw/zinc/72/52/71/749725271.db2.gz COGATNUTLLNXFQ-CMPLNLGQSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[NH2+][C@@H](CNC(=O)OC(C)(C)C)C(C)(C)C)c1[N+](=O)[O-] ZINC000852011038 749750743 /nfs/dbraw/zinc/75/07/43/749750743.db2.gz ZDCZMBUQKBORFS-LBPRGKRZSA-N 1 1 356.423 2.920 20 5 FFBDMO O=C(C[N@H+](C1CC1)C1(CO)CCC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852159125 749789897 /nfs/dbraw/zinc/78/98/97/749789897.db2.gz OXMSAKQKYFTMMH-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+](C1CC1)C1(CO)CCC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852159125 749789903 /nfs/dbraw/zinc/78/99/03/749789903.db2.gz OXMSAKQKYFTMMH-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO C[C@@]1(C2CC2)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000852322570 749834137 /nfs/dbraw/zinc/83/41/37/749834137.db2.gz MUIOXQAWTXMFKA-KRWDZBQOSA-N 1 1 351.378 2.563 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)c2ccccc2N1 ZINC000759897602 971914838 /nfs/dbraw/zinc/91/48/38/971914838.db2.gz ZMZPTVVNOCQRJT-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)c2ccccc2N1 ZINC000759897602 971914843 /nfs/dbraw/zinc/91/48/43/971914843.db2.gz ZMZPTVVNOCQRJT-OAHLLOKOSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001116021083 1032068001 /nfs/dbraw/zinc/06/80/01/1032068001.db2.gz DVHQUJRJOCXELA-HUUCEWRRSA-N 1 1 372.425 2.833 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1 ZINC000255030641 960031200 /nfs/dbraw/zinc/03/12/00/960031200.db2.gz PUFKKRPIKXCYES-XGICHPGQSA-N 1 1 368.393 2.747 20 5 FFBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022064418 964195620 /nfs/dbraw/zinc/19/56/20/964195620.db2.gz GMUFTRYMLQOYAF-IYWMVGAKSA-N 1 1 365.433 2.756 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC001175725187 1013544410 /nfs/dbraw/zinc/54/44/10/1013544410.db2.gz VHWJXCXVNNKJJZ-OALUTQOASA-N 1 1 366.421 2.887 20 5 FFBDMO Cn1c2ccccc2c(N2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])c1=O ZINC000892123666 966019018 /nfs/dbraw/zinc/01/90/18/966019018.db2.gz YJBVSDRRRINUCU-UHFFFAOYSA-N 1 1 358.442 2.757 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-] ZINC000176709410 966709303 /nfs/dbraw/zinc/70/93/03/966709303.db2.gz RCFLIZALDDYDMN-CHWSQXEVSA-N 1 1 367.421 2.660 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@H]2C[C@@H]2CCCO2)cc1 ZINC001176611803 1013736116 /nfs/dbraw/zinc/73/61/16/1013736116.db2.gz XIMLDYYTBOLCEU-AEFFLSMTSA-N 1 1 350.415 2.634 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901220 968103921 /nfs/dbraw/zinc/10/39/21/968103921.db2.gz AHXFCSGMUBLMCX-GDBMZVCRSA-N 1 1 373.457 2.919 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901220 968103926 /nfs/dbraw/zinc/10/39/26/968103926.db2.gz AHXFCSGMUBLMCX-GDBMZVCRSA-N 1 1 373.457 2.919 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@H]1C ZINC000892642114 969676835 /nfs/dbraw/zinc/67/68/35/969676835.db2.gz MCCIZUKRRRHABF-KGLIPLIRSA-N 1 1 358.442 2.756 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000874845395 1013916170 /nfs/dbraw/zinc/91/61/70/1013916170.db2.gz GGJZLLIUHJJPMO-AEFFLSMTSA-N 1 1 372.469 2.506 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000874850090 1013917658 /nfs/dbraw/zinc/91/76/58/1013917658.db2.gz NVRIIWQFORTVQY-DOTOQJQBSA-N 1 1 358.442 2.504 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000897016383 973155053 /nfs/dbraw/zinc/15/50/53/973155053.db2.gz GRHSAGVYWSAMQL-PBHICJAKSA-N 1 1 368.437 2.887 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@@]2(C1)CCC[N@@H+](C)C2)c1ccccc1[N+](=O)[O-] ZINC000897059246 973205389 /nfs/dbraw/zinc/20/53/89/973205389.db2.gz BGQIRQMUGXXNFE-BEFAXECRSA-N 1 1 360.458 2.826 20 5 FFBDMO C[N@@H+](Cc1cccc(C(F)F)c1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985426234 974054706 /nfs/dbraw/zinc/05/47/06/974054706.db2.gz NVKRNDIWKYOQHH-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO C[N@H+](Cc1cccc(C(F)F)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426234 974054715 /nfs/dbraw/zinc/05/47/15/974054715.db2.gz NVKRNDIWKYOQHH-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO C[N@@H+](Cc1cccc(C(F)F)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426234 974054724 /nfs/dbraw/zinc/05/47/24/974054724.db2.gz NVKRNDIWKYOQHH-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO C[C@@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876468017 1014278951 /nfs/dbraw/zinc/27/89/51/1014278951.db2.gz BCITYVLUSRUNCJ-XOKHGSTOSA-N 1 1 372.425 2.668 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000981136907 976263769 /nfs/dbraw/zinc/26/37/69/976263769.db2.gz LIOPHPZQHBTKRX-QZTJIDSGSA-N 1 1 359.470 2.684 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981136907 976263777 /nfs/dbraw/zinc/26/37/77/976263777.db2.gz LIOPHPZQHBTKRX-QZTJIDSGSA-N 1 1 359.470 2.684 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981136907 976263786 /nfs/dbraw/zinc/26/37/86/976263786.db2.gz LIOPHPZQHBTKRX-QZTJIDSGSA-N 1 1 359.470 2.684 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000843802941 976843545 /nfs/dbraw/zinc/84/35/45/976843545.db2.gz FQTVCTTYZMLAIH-FZMZJTMJSA-N 1 1 364.402 2.756 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn(C[C@H]4CCCO4)nn3)C2)cc1 ZINC000877565361 1014628683 /nfs/dbraw/zinc/62/86/83/1014628683.db2.gz GCIZIAGUSHMIAE-VQIMIIECSA-N 1 1 371.441 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn(C[C@H]4CCCO4)nn3)C2)cc1 ZINC000877565361 1014628690 /nfs/dbraw/zinc/62/86/90/1014628690.db2.gz GCIZIAGUSHMIAE-VQIMIIECSA-N 1 1 371.441 2.745 20 5 FFBDMO COc1cc(CN[C@H]2C[C@H]([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000906517753 980674904 /nfs/dbraw/zinc/67/49/04/980674904.db2.gz OVWWYPKKBOIACK-WKILWMFISA-N 1 1 357.410 2.762 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877742598 1014704533 /nfs/dbraw/zinc/70/45/33/1014704533.db2.gz FMBCPXUUWJFOHF-YJBOKZPZSA-N 1 1 355.442 2.521 20 5 FFBDMO CCC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000878058237 1014840207 /nfs/dbraw/zinc/84/02/07/1014840207.db2.gz YSUSWBXIIOADIQ-CQSZACIVSA-N 1 1 367.450 2.550 20 5 FFBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000878058237 1014840220 /nfs/dbraw/zinc/84/02/20/1014840220.db2.gz YSUSWBXIIOADIQ-CQSZACIVSA-N 1 1 367.450 2.550 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000878163348 1014894146 /nfs/dbraw/zinc/89/41/46/1014894146.db2.gz QJLAMHGXSSYYLS-ZIAGYGMSSA-N 1 1 359.430 2.949 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@@H]1CCC[N@@H+](C)C1 ZINC000151095547 984177435 /nfs/dbraw/zinc/17/74/35/984177435.db2.gz ULHKWPXEUHJUEW-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)C[C@@]2(C)C1 ZINC000913293804 984234708 /nfs/dbraw/zinc/23/47/08/984234708.db2.gz URGFOEYDECCHAJ-BGYRXZFFSA-N 1 1 372.469 2.609 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000158032883 984745121 /nfs/dbraw/zinc/74/51/21/984745121.db2.gz RHQVSPLPRGBJER-QAPCUYQASA-N 1 1 355.442 2.851 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000170647469 985104381 /nfs/dbraw/zinc/10/43/81/985104381.db2.gz UNNQNMXZGLZCKG-AWEZNQCLSA-N 1 1 365.430 2.820 20 5 FFBDMO COc1c(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000913686414 986830523 /nfs/dbraw/zinc/83/05/23/986830523.db2.gz KONLYNQSEFGMPK-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1c(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000913686414 986830533 /nfs/dbraw/zinc/83/05/33/986830533.db2.gz KONLYNQSEFGMPK-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000130504821 987370211 /nfs/dbraw/zinc/37/02/11/987370211.db2.gz OOERUPSOCYESIJ-IBGZPJMESA-N 1 1 369.469 2.983 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](C/C=C\c3ccccc3)C[C@H]2CC1 ZINC000946589067 988771556 /nfs/dbraw/zinc/77/15/56/988771556.db2.gz DPHYXTGSBAAMKS-DNJKDJJLSA-N 1 1 369.465 2.535 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](C/C=C\c3ccccc3)C[C@H]2CC1 ZINC000946589067 988771561 /nfs/dbraw/zinc/77/15/61/988771561.db2.gz DPHYXTGSBAAMKS-DNJKDJJLSA-N 1 1 369.465 2.535 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](C/C=C\c3ccccc3)C[C@H]2CC1 ZINC000946589067 988771570 /nfs/dbraw/zinc/77/15/70/988771570.db2.gz DPHYXTGSBAAMKS-DNJKDJJLSA-N 1 1 369.465 2.535 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000153934768 989772388 /nfs/dbraw/zinc/77/23/88/989772388.db2.gz YMULQTBONWRDKO-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO Cc1cc(C)cc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c1 ZINC001034815725 990274665 /nfs/dbraw/zinc/27/46/65/990274665.db2.gz CLENDMQWCFZNNN-WOJBJXKFSA-N 1 1 367.449 2.875 20 5 FFBDMO CCc1cccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)c1 ZINC001035187548 990410171 /nfs/dbraw/zinc/41/01/71/990410171.db2.gz WFUDOMBSDFVYOX-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1cccc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035187548 990410173 /nfs/dbraw/zinc/41/01/73/990410173.db2.gz WFUDOMBSDFVYOX-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1cccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035187548 990410176 /nfs/dbraw/zinc/41/01/76/990410176.db2.gz WFUDOMBSDFVYOX-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000130277532 990508246 /nfs/dbraw/zinc/50/82/46/990508246.db2.gz MVSHGEURNXLLOJ-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000919769062 990726736 /nfs/dbraw/zinc/72/67/36/990726736.db2.gz MQDHOUJOXVEDFS-AWEZNQCLSA-N 1 1 373.457 2.571 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+]4CCC[C@H]4C3)cc2[N+](=O)[O-])CC1 ZINC000195316893 990842548 /nfs/dbraw/zinc/84/25/48/990842548.db2.gz HHJPUWICFAGXNF-KRWDZBQOSA-N 1 1 372.469 2.751 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000923315642 991058010 /nfs/dbraw/zinc/05/80/10/991058010.db2.gz LUAIYSDCCMDGKQ-JKSUJKDBSA-N 1 1 358.442 2.504 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])c(F)c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000711789538 991168947 /nfs/dbraw/zinc/16/89/47/991168947.db2.gz QFLBRBLAGILZAT-FQEVSTJZSA-N 1 1 373.428 2.803 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000069008910 991570372 /nfs/dbraw/zinc/57/03/72/991570372.db2.gz OUJDAMXIXPKRFB-AWEZNQCLSA-N 1 1 371.441 2.766 20 5 FFBDMO C[C@]([NH3+])(Cc1ccccc1F)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001212325109 991683665 /nfs/dbraw/zinc/68/36/65/991683665.db2.gz IITVLVXEFYBMLC-INIZCTEOSA-N 1 1 361.308 2.735 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](c2nccs2)C1 ZINC000880319455 1015806397 /nfs/dbraw/zinc/80/63/97/1015806397.db2.gz GWKGZGTZWXZIOD-LBPRGKRZSA-N 1 1 374.422 2.839 20 5 FFBDMO CCOc1cc(C(=O)O[C@H](C)Cn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000810618463 994838743 /nfs/dbraw/zinc/83/87/43/994838743.db2.gz FUVFSSAPTQSHQY-LLVKDONJSA-N 1 1 363.370 2.753 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001132801139 995143433 /nfs/dbraw/zinc/14/34/33/995143433.db2.gz JVPGUTLUPTXHAX-BFYDXBDKSA-N 1 1 374.485 2.901 20 5 FFBDMO COc1cc(COC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000811444996 995148140 /nfs/dbraw/zinc/14/81/40/995148140.db2.gz NRKWSNUQAZRWOT-QGZVFWFLSA-N 1 1 372.368 2.998 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCCC3(CC[NH+](C)CC3)C2)c1 ZINC000811500656 995169429 /nfs/dbraw/zinc/16/94/29/995169429.db2.gz JWHMPEHEIHGGEL-UHFFFAOYSA-N 1 1 361.442 2.689 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000888830804 1015951086 /nfs/dbraw/zinc/95/10/86/1015951086.db2.gz CYQSPNOFADBMTO-SFHVURJKSA-N 1 1 362.430 2.943 20 5 FFBDMO COCC[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C(C)(C)C)CC1 ZINC000880706922 1015951337 /nfs/dbraw/zinc/95/13/37/1015951337.db2.gz XKNRZHLBIVZCHP-UHFFFAOYSA-N 1 1 364.446 2.688 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@H](n3cccn3)C2)o1 ZINC001170704661 995667361 /nfs/dbraw/zinc/66/73/61/995667361.db2.gz URODNEUOSPBORS-LBPRGKRZSA-N 1 1 374.788 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@H](n3cccn3)C2)o1 ZINC001170704661 995667363 /nfs/dbraw/zinc/66/73/63/995667363.db2.gz URODNEUOSPBORS-LBPRGKRZSA-N 1 1 374.788 2.942 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000826725018 1016032577 /nfs/dbraw/zinc/03/25/77/1016032577.db2.gz UEQRJKVFYUDTQV-KRWDZBQOSA-N 1 1 355.394 2.667 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000826725018 1016032589 /nfs/dbraw/zinc/03/25/89/1016032589.db2.gz UEQRJKVFYUDTQV-KRWDZBQOSA-N 1 1 355.394 2.667 20 5 FFBDMO Cc1ccc(CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000823968507 996769924 /nfs/dbraw/zinc/76/99/24/996769924.db2.gz VDIOFUVIWJNBSF-UHFFFAOYSA-N 1 1 370.413 2.802 20 5 FFBDMO Nc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000823987331 996773214 /nfs/dbraw/zinc/77/32/14/996773214.db2.gz PWZKBVFOEMQMQE-MRXNPFEDSA-N 1 1 369.425 2.963 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000823993522 996773559 /nfs/dbraw/zinc/77/35/59/996773559.db2.gz GZVSGYWELHXKBG-MRXNPFEDSA-N 1 1 369.425 2.963 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000803731867 1016113429 /nfs/dbraw/zinc/11/34/29/1016113429.db2.gz SGTBEDXHWYBWKT-JTPHSUOKSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000803731867 1016113434 /nfs/dbraw/zinc/11/34/34/1016113434.db2.gz SGTBEDXHWYBWKT-JTPHSUOKSA-N 1 1 365.433 2.993 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1 ZINC000843889496 997482207 /nfs/dbraw/zinc/48/22/07/997482207.db2.gz CIKRYJCSBRCLAY-HNNXBMFYSA-N 1 1 373.384 2.861 20 5 FFBDMO C[C@@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])[C@H]1CCNC(=O)OC(C)(C)C ZINC000844727826 998099100 /nfs/dbraw/zinc/09/91/00/998099100.db2.gz IKYPWSOVVXFXPY-KGLIPLIRSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])[C@H]1CCNC(=O)OC(C)(C)C ZINC000844727826 998099114 /nfs/dbraw/zinc/09/91/14/998099114.db2.gz IKYPWSOVVXFXPY-KGLIPLIRSA-N 1 1 367.450 2.764 20 5 FFBDMO O=C1CCCN1C[C@@H]1CCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000732213518 998536332 /nfs/dbraw/zinc/53/63/32/998536332.db2.gz WSESPOCJRBWXLS-KRWDZBQOSA-N 1 1 361.442 2.841 20 5 FFBDMO CCc1cccc(NC(=O)C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000732230561 998562569 /nfs/dbraw/zinc/56/25/69/998562569.db2.gz LTFDSVSXJVAYRF-UHFFFAOYSA-N 1 1 371.393 2.657 20 5 FFBDMO CC(C)[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCC1 ZINC000741013232 999700802 /nfs/dbraw/zinc/70/08/02/999700802.db2.gz FDGQKKMGXKZWGX-MRXNPFEDSA-N 1 1 374.397 2.808 20 5 FFBDMO C[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000742200447 999764278 /nfs/dbraw/zinc/76/42/78/999764278.db2.gz XYJBWAQPSDBWPF-LLVKDONJSA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000742200447 999764279 /nfs/dbraw/zinc/76/42/79/999764279.db2.gz XYJBWAQPSDBWPF-LLVKDONJSA-N 1 1 374.363 2.578 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)[nH+]1 ZINC000743462850 999820133 /nfs/dbraw/zinc/82/01/33/999820133.db2.gz BTKANCCRAMQCBH-UHFFFAOYSA-N 1 1 373.369 2.665 20 5 FFBDMO C[N@@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@@H](c2ccccc2)C1 ZINC000745753163 999928873 /nfs/dbraw/zinc/92/88/73/999928873.db2.gz HZWOPYJFXZGQJI-GOSISDBHSA-N 1 1 373.384 2.628 20 5 FFBDMO C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@@H](c2ccccc2)C1 ZINC000745753163 999928874 /nfs/dbraw/zinc/92/88/74/999928874.db2.gz HZWOPYJFXZGQJI-GOSISDBHSA-N 1 1 373.384 2.628 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011033 1000015397 /nfs/dbraw/zinc/01/53/97/1000015397.db2.gz HLXXRBZEVGUMBL-LUXYFRNMSA-N 1 1 353.463 2.811 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC[C@@H]2C1 ZINC001169010588 1000015354 /nfs/dbraw/zinc/01/53/54/1000015354.db2.gz DVBRXITVXODCRJ-XUWVNRHRSA-N 1 1 353.463 2.621 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2cc([N+](=O)[O-])c(C)cn2)c2ccccc12 ZINC001169115837 1000026259 /nfs/dbraw/zinc/02/62/59/1000026259.db2.gz USUOLPIHMZWMMB-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804331337 1000061738 /nfs/dbraw/zinc/06/17/38/1000061738.db2.gz OFRZYUFBDMCLFV-UHFFFAOYSA-N 1 1 356.426 2.816 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000804358159 1000127520 /nfs/dbraw/zinc/12/75/20/1000127520.db2.gz SXSZPCSZTYEUJJ-UHFFFAOYSA-N 1 1 372.381 2.947 20 5 FFBDMO CN(CC(F)F)C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000769514085 1000539287 /nfs/dbraw/zinc/53/92/87/1000539287.db2.gz FRNZGCGEJNKKOG-UHFFFAOYSA-N 1 1 371.384 2.527 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)Cc2ccc(C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000771559261 1001148380 /nfs/dbraw/zinc/14/83/80/1001148380.db2.gz CZDIRXMQRRTXNS-UHFFFAOYSA-N 1 1 359.430 2.775 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000771857302 1001231405 /nfs/dbraw/zinc/23/14/05/1001231405.db2.gz GGCKCGASKWLBHR-UHFFFAOYSA-N 1 1 358.398 2.560 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC001149018221 1001250403 /nfs/dbraw/zinc/25/04/03/1001250403.db2.gz JBNHZWJSBOGURR-OAHLLOKOSA-N 1 1 361.442 2.797 20 5 FFBDMO CC[C@@H]1CC[C@H](C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000772357869 1001361643 /nfs/dbraw/zinc/36/16/43/1001361643.db2.gz SPXNZDZWEBEADB-JKSUJKDBSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000785676379 1001466586 /nfs/dbraw/zinc/46/65/86/1001466586.db2.gz SOEUATUBMCPETD-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000746665834 1001680753 /nfs/dbraw/zinc/68/07/53/1001680753.db2.gz GTXKJMCWYHXOAB-HIFRSBDPSA-N 1 1 367.450 2.559 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CC[C@@H](C)C1 ZINC000790476741 1002387157 /nfs/dbraw/zinc/38/71/57/1002387157.db2.gz CWGYHTKALOGZIR-RHSMWYFYSA-N 1 1 359.430 2.948 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791208340 1002618406 /nfs/dbraw/zinc/61/84/06/1002618406.db2.gz HIPICOKYZPVVDL-CHWSQXEVSA-N 1 1 366.437 2.650 20 5 FFBDMO COC[C@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001170341346 1003129333 /nfs/dbraw/zinc/12/93/33/1003129333.db2.gz PIXPYBFEHIAACG-CZUORRHYSA-N 1 1 374.441 2.514 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001399902 1016782744 /nfs/dbraw/zinc/78/27/44/1016782744.db2.gz OGBMBMOYQVWGRL-WOJBJXKFSA-N 1 1 367.449 2.833 20 5 FFBDMO O=C(Nc1nccc2ccc([N+](=O)[O-])cc21)c1cnn(-c2cc[nH+]cc2)c1 ZINC001130957111 1004592787 /nfs/dbraw/zinc/59/27/87/1004592787.db2.gz MCKIAXHZVQKQSO-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO Cc1ccc(CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000867305745 1004881364 /nfs/dbraw/zinc/88/13/64/1004881364.db2.gz TXZBAHFICVLTOS-UHFFFAOYSA-N 1 1 372.400 2.896 20 5 FFBDMO Cc1[nH+]c2cc3c(cc2n1C[C@H](O)c1ccc([N+](=O)[O-])cc1)OCCO3 ZINC000776274041 1005339527 /nfs/dbraw/zinc/33/95/27/1005339527.db2.gz GEIHUTIRKHPQTE-INIZCTEOSA-N 1 1 355.350 2.758 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)O[C@H]1CC[N@@H+](Cc2ccc3c(c2)CCC3)C1 ZINC000776557936 1005928778 /nfs/dbraw/zinc/92/87/78/1005928778.db2.gz KWWKOAAFDSKELD-SFHVURJKSA-N 1 1 369.421 2.853 20 5 FFBDMO COc1ccc([C@H](O)C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)cc1 ZINC000852071320 1005938990 /nfs/dbraw/zinc/93/89/90/1005938990.db2.gz MOCSEJYANUQWIX-SFHVURJKSA-N 1 1 361.398 2.845 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153210 1005946210 /nfs/dbraw/zinc/94/62/10/1005946210.db2.gz CRQXKYNCNJWBSX-WCQYABFASA-N 1 1 368.434 2.874 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153210 1005946211 /nfs/dbraw/zinc/94/62/11/1005946211.db2.gz CRQXKYNCNJWBSX-WCQYABFASA-N 1 1 368.434 2.874 20 5 FFBDMO O=C(CC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)OCc1ccccc1 ZINC000776579244 1005960003 /nfs/dbraw/zinc/96/00/03/1005960003.db2.gz KGHFPCXHTRBPAC-UHFFFAOYSA-N 1 1 369.421 2.850 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000776590287 1006003308 /nfs/dbraw/zinc/00/33/08/1006003308.db2.gz FUFDGSFEUKPJCR-MRXNPFEDSA-N 1 1 365.430 2.569 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000776590287 1006003320 /nfs/dbraw/zinc/00/33/20/1006003320.db2.gz FUFDGSFEUKPJCR-MRXNPFEDSA-N 1 1 365.430 2.569 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)nc1-c1ccccn1 ZINC000853517492 1006422571 /nfs/dbraw/zinc/42/25/71/1006422571.db2.gz VEVMZJRHZJRNFH-QGPMSJSTSA-N 1 1 371.441 2.826 20 5 FFBDMO C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C[C@](C)(O)c1ccccc1 ZINC000853519052 1006425365 /nfs/dbraw/zinc/42/53/65/1006425365.db2.gz XSCWZRXHEXLNJU-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C[C@](C)(O)c1ccccc1 ZINC000853519052 1006425371 /nfs/dbraw/zinc/42/53/71/1006425371.db2.gz XSCWZRXHEXLNJU-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H](C)c3ccccc3)CC2)n1 ZINC000882810280 1006513120 /nfs/dbraw/zinc/51/31/20/1006513120.db2.gz CFNRBSBIKTYAQU-AWEZNQCLSA-N 1 1 370.409 2.660 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980905 1006588309 /nfs/dbraw/zinc/58/83/09/1006588309.db2.gz WTWNHDXAGZFGAR-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980905 1006588315 /nfs/dbraw/zinc/58/83/15/1006588315.db2.gz WTWNHDXAGZFGAR-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO COc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000854225156 1006731385 /nfs/dbraw/zinc/73/13/85/1006731385.db2.gz XAASCLLCYOMGTK-IXDGSTSKSA-N 1 1 370.453 2.982 20 5 FFBDMO CC[NH+]1CCC(N2CCCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000817285762 1007507771 /nfs/dbraw/zinc/50/77/71/1007507771.db2.gz NQKWTQZAOLRYMR-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856673832 1007942598 /nfs/dbraw/zinc/94/25/98/1007942598.db2.gz FDBZTELEWFVFQI-FZKQIMNGSA-N 1 1 360.414 2.671 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000819902537 1008248007 /nfs/dbraw/zinc/24/80/07/1008248007.db2.gz FOHGPCYJMJWSHJ-QGZVFWFLSA-N 1 1 373.409 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000819902537 1008248013 /nfs/dbraw/zinc/24/80/13/1008248013.db2.gz FOHGPCYJMJWSHJ-QGZVFWFLSA-N 1 1 373.409 2.741 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000820078991 1008281778 /nfs/dbraw/zinc/28/17/78/1008281778.db2.gz BOKSWSWEFUJZOF-DZFIZOCASA-N 1 1 351.406 2.763 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001136379081 1008378508 /nfs/dbraw/zinc/37/85/08/1008378508.db2.gz UHAYSLSXGLAFTE-TUAOUCFPSA-N 1 1 368.865 2.927 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000805776595 1008515189 /nfs/dbraw/zinc/51/51/89/1008515189.db2.gz RQTHKJPJWGSHCI-MRXNPFEDSA-N 1 1 365.430 2.964 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1)c1ccccc1 ZINC000886032268 1008520816 /nfs/dbraw/zinc/52/08/16/1008520816.db2.gz CHOHGMPVCYKNMI-HNNXBMFYSA-N 1 1 354.410 2.632 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)c1ccccc1 ZINC000886032268 1008520819 /nfs/dbraw/zinc/52/08/19/1008520819.db2.gz CHOHGMPVCYKNMI-HNNXBMFYSA-N 1 1 354.410 2.632 20 5 FFBDMO COc1cc2c(c(OC)c1OC)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886046761 1008523779 /nfs/dbraw/zinc/52/37/79/1008523779.db2.gz PBFMCTQCPSPRRW-UHFFFAOYSA-N 1 1 373.409 2.616 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000886122826 1008574193 /nfs/dbraw/zinc/57/41/93/1008574193.db2.gz LEAIHYYFZOUCQK-CABCVRRESA-N 1 1 362.430 2.964 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000886122826 1008574201 /nfs/dbraw/zinc/57/42/01/1008574201.db2.gz LEAIHYYFZOUCQK-CABCVRRESA-N 1 1 362.430 2.964 20 5 FFBDMO C[C@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001177708399 1008724703 /nfs/dbraw/zinc/72/47/03/1008724703.db2.gz PAZLSWXBKVZDHT-HNNXBMFYSA-N 1 1 361.442 2.839 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(C2CC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464487 1008999331 /nfs/dbraw/zinc/99/93/31/1008999331.db2.gz TZKHGVIMABCBMZ-RTBURBONSA-N 1 1 359.470 2.995 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000823913831 1009267558 /nfs/dbraw/zinc/26/75/58/1009267558.db2.gz FFLHCWQBRJHDEZ-OAHLLOKOSA-N 1 1 355.398 2.573 20 5 FFBDMO O=c1[nH]ccc2oc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc21 ZINC001179938765 1009498458 /nfs/dbraw/zinc/49/84/58/1009498458.db2.gz XYYBCIKGUFPCIX-NSHDSACASA-N 1 1 355.354 2.523 20 5 FFBDMO O=c1[nH]ccc2oc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc21 ZINC001179938765 1009498466 /nfs/dbraw/zinc/49/84/66/1009498466.db2.gz XYYBCIKGUFPCIX-NSHDSACASA-N 1 1 355.354 2.523 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863504689 1010231517 /nfs/dbraw/zinc/23/15/17/1010231517.db2.gz XKSFXMWPEZTFFY-DNVCBOLYSA-N 1 1 374.441 2.626 20 5 FFBDMO CCOC(=O)CC(=O)n1c2ccc(OCC)cc2c(=[NH2+])c2ccc(N)cc21 ZINC001181787653 1010245187 /nfs/dbraw/zinc/24/51/87/1010245187.db2.gz KSUWOZCGBBILNK-UHFFFAOYSA-N 1 1 367.405 2.848 20 5 FFBDMO C[N@@H+](CCCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])Cc1ccccc1 ZINC000864615361 1010528678 /nfs/dbraw/zinc/52/86/78/1010528678.db2.gz AIEUPGZSYZZXQR-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1C[C@H]1C(N)=O ZINC001182379596 1010541096 /nfs/dbraw/zinc/54/10/96/1010541096.db2.gz HHWKJPKHOVTDDF-CVEARBPZSA-N 1 1 362.433 2.822 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H](O)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000866638045 1011028567 /nfs/dbraw/zinc/02/85/67/1011028567.db2.gz CTWOKGNYJVICBP-QZTJIDSGSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867958009 1011131513 /nfs/dbraw/zinc/13/15/13/1011131513.db2.gz FRYNQVJPZYXCEZ-HXUWFJFHSA-N 1 1 368.437 2.508 20 5 FFBDMO O=C(N1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1)C(F)(F)F ZINC001172902945 1012077848 /nfs/dbraw/zinc/07/78/48/1012077848.db2.gz DIFJDKHTTXGRPP-AWEZNQCLSA-N 1 1 371.359 2.549 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@@H](OCC3CC3)[C@H]3COC[C@H]31)CC2 ZINC001172908127 1012081337 /nfs/dbraw/zinc/08/13/37/1012081337.db2.gz AYXOIYWZMCWSCE-MJUUVYJYSA-N 1 1 372.465 2.968 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](Oc3ncccn3)C1)CC2 ZINC001172914095 1012097976 /nfs/dbraw/zinc/09/79/76/1012097976.db2.gz ZBJPWDCENSRFSD-WMZOPIPTSA-N 1 1 354.410 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](Oc3ncc(F)cn3)C1)CC2 ZINC001172913079 1012126370 /nfs/dbraw/zinc/12/63/70/1012126370.db2.gz OTLFKBLWCWFPRJ-AEFFLSMTSA-N 1 1 372.400 2.925 20 5 FFBDMO C[N@@H+](CC1(C)COC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173016064 1012186207 /nfs/dbraw/zinc/18/62/07/1012186207.db2.gz AQBDUNYIVRGTDI-UHFFFAOYSA-N 1 1 355.385 2.810 20 5 FFBDMO COC(=O)C1CC[NH+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173180751 1012324040 /nfs/dbraw/zinc/32/40/40/1012324040.db2.gz MQIZFAJFLVOWKR-NSHDSACASA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC12CC2 ZINC001173191622 1012331849 /nfs/dbraw/zinc/33/18/49/1012331849.db2.gz DVVJDUONKJPEBD-DGCLKSJQSA-N 1 1 366.389 2.559 20 5 FFBDMO COC(=O)CC[C@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195486 1012337516 /nfs/dbraw/zinc/33/75/16/1012337516.db2.gz GTSNHUMKQJZTJC-OLZOCXBDSA-N 1 1 368.405 2.949 20 5 FFBDMO C[NH+]1CCN(CC2CN(C(=O)c3cc4ccccc4c4cccnc34)C2)CC1 ZINC000647825538 1012600918 /nfs/dbraw/zinc/60/09/18/1012600918.db2.gz ZVBNRFAKABCCBW-UHFFFAOYSA-N 1 1 374.488 2.707 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)[C@@](C)(N)c2cccc([N+](=O)[O-])c2)C1 ZINC000870920330 1012636369 /nfs/dbraw/zinc/63/63/69/1012636369.db2.gz CTFQDUONBQXZMU-ZDUSMZPESA-N 1 1 374.485 2.633 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NCc2cc3c(cc2[N+](=O)[O-])OCCO3)cn1 ZINC000777513606 1017240687 /nfs/dbraw/zinc/24/06/87/1017240687.db2.gz FEOJRJHTNCZJFL-UHFFFAOYSA-N 1 1 367.365 2.867 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928436244 1018978931 /nfs/dbraw/zinc/97/89/31/1018978931.db2.gz BDTMIPRRJYZQNH-KBXCAEBGSA-N 1 1 369.421 2.996 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000827925620 1019006234 /nfs/dbraw/zinc/00/62/34/1019006234.db2.gz BDTXLWBCPKEBBZ-KRWDZBQOSA-N 1 1 373.384 2.545 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@H+](Cn2cc([N+](=O)[O-])cn2)C2CC2)CC1 ZINC000725773265 1020255434 /nfs/dbraw/zinc/25/54/34/1020255434.db2.gz CUBSOPWLLYWOAU-UHFFFAOYSA-N 1 1 365.434 2.613 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@@H+](Cn2cc([N+](=O)[O-])cn2)C2CC2)CC1 ZINC000725773265 1020255437 /nfs/dbraw/zinc/25/54/37/1020255437.db2.gz CUBSOPWLLYWOAU-UHFFFAOYSA-N 1 1 365.434 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN2CC[NH+](CCc3ccncc3)CC2)cc1 ZINC000931338249 1020429830 /nfs/dbraw/zinc/42/98/30/1020429830.db2.gz HGELCYGXOZXWMD-UHFFFAOYSA-N 1 1 370.453 2.619 20 5 FFBDMO CC[N@@H+](Cc1ccccc1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726582535 1020489039 /nfs/dbraw/zinc/48/90/39/1020489039.db2.gz DXRWAALLXOVUMX-UHFFFAOYSA-N 1 1 368.393 2.843 20 5 FFBDMO CC[N@H+](Cc1ccccc1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726582535 1020489042 /nfs/dbraw/zinc/48/90/42/1020489042.db2.gz DXRWAALLXOVUMX-UHFFFAOYSA-N 1 1 368.393 2.843 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@@H]2C2CCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000726587526 1020490250 /nfs/dbraw/zinc/49/02/50/1020490250.db2.gz SGEOECGKAWNWOF-QGZVFWFLSA-N 1 1 372.425 2.976 20 5 FFBDMO COCCO[C@@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000800850224 1020593893 /nfs/dbraw/zinc/59/38/93/1020593893.db2.gz NYKDFEHZKZZREE-GOSISDBHSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000800850224 1020593899 /nfs/dbraw/zinc/59/38/99/1020593899.db2.gz NYKDFEHZKZZREE-GOSISDBHSA-N 1 1 360.414 2.543 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H]([C@@]3(C)COC(=O)N3)C2)ccc1[N+](=O)[O-] ZINC000932018129 1020669009 /nfs/dbraw/zinc/66/90/09/1020669009.db2.gz ACKAJDCFKUINGD-RDTXWAMCSA-N 1 1 363.414 2.704 20 5 FFBDMO C[N@H+](Cc1ccc(C(=O)NC2CC2)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749670799 1021018913 /nfs/dbraw/zinc/01/89/13/1021018913.db2.gz LNXPNXCULRMHFW-LJQANCHMSA-N 1 1 369.421 2.652 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCCOC2=O)CC1 ZINC000933619180 1021047367 /nfs/dbraw/zinc/04/73/67/1021047367.db2.gz NALAIHJPQZYTRU-UHFFFAOYSA-N 1 1 363.414 2.800 20 5 FFBDMO CN(CC(F)F)C1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000749843492 1021053912 /nfs/dbraw/zinc/05/39/12/1021053912.db2.gz CVEGVPWOROHVJU-UHFFFAOYSA-N 1 1 371.384 2.623 20 5 FFBDMO COCCC[N@@H+](Cc1ccncc1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749951312 1021160579 /nfs/dbraw/zinc/16/05/79/1021160579.db2.gz QDEBPACBMLWCSH-UHFFFAOYSA-N 1 1 370.413 2.539 20 5 FFBDMO COCCC[N@H+](Cc1ccncc1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749951312 1021160585 /nfs/dbraw/zinc/16/05/85/1021160585.db2.gz QDEBPACBMLWCSH-UHFFFAOYSA-N 1 1 370.413 2.539 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001116380604 1021187970 /nfs/dbraw/zinc/18/79/70/1021187970.db2.gz ONZBGCFZZDQQRZ-MJGOQNOKSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001116380604 1021187973 /nfs/dbraw/zinc/18/79/73/1021187973.db2.gz ONZBGCFZZDQQRZ-MJGOQNOKSA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000934899333 1021453903 /nfs/dbraw/zinc/45/39/03/1021453903.db2.gz QXSQOXDANMKCDC-UHFFFAOYSA-N 1 1 372.400 2.719 20 5 FFBDMO C[C@H](C1CC1)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000042123208 1022140344 /nfs/dbraw/zinc/14/03/44/1022140344.db2.gz VETMQCRTIJCLAJ-OAHLLOKOSA-N 1 1 372.469 2.506 20 5 FFBDMO CC(C)CC[N@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000045722193 1022424657 /nfs/dbraw/zinc/42/46/57/1022424657.db2.gz AERIYXRDJJAIQO-LJQANCHMSA-N 1 1 374.441 2.830 20 5 FFBDMO CC(C)CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000045722193 1022424664 /nfs/dbraw/zinc/42/46/64/1022424664.db2.gz AERIYXRDJJAIQO-LJQANCHMSA-N 1 1 374.441 2.830 20 5 FFBDMO C/C(=C/C(=O)N1CC[NH+](CCOC(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000752500256 1023152640 /nfs/dbraw/zinc/15/26/40/1023152640.db2.gz CHKNTRHCCLCGIM-PEZBUJJGSA-N 1 1 361.442 2.567 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@]1(O)CCc2ccccc21 ZINC000829358824 1033118738 /nfs/dbraw/zinc/11/87/38/1033118738.db2.gz NMASCTLBFSCVSS-HXUWFJFHSA-N 1 1 369.421 2.689 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000191663498 1023889747 /nfs/dbraw/zinc/88/97/47/1023889747.db2.gz NUKGEZFAKAHBBW-INIZCTEOSA-N 1 1 354.410 2.571 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001121700866 1023934729 /nfs/dbraw/zinc/93/47/29/1023934729.db2.gz ZVSKEEFDUHQURK-HZPDHXFCSA-N 1 1 372.473 2.737 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC001125161741 1024421231 /nfs/dbraw/zinc/42/12/31/1024421231.db2.gz GCHLMNHGSFYHAY-QGZVFWFLSA-N 1 1 367.405 2.985 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)COc1ccc(C=O)cc1[N+](=O)[O-] ZINC000837514900 1025865173 /nfs/dbraw/zinc/86/51/73/1025865173.db2.gz NONSHXQWRDYNFG-OAHLLOKOSA-N 1 1 364.398 2.592 20 5 FFBDMO CC(C)(C)c1ccc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000838912953 1026535449 /nfs/dbraw/zinc/53/54/49/1026535449.db2.gz RTDNXLAVWVZBDG-GASCZTMLSA-N 1 1 362.426 2.912 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC4(CC3)OCCCO4)c2)cc1 ZINC000840088350 1026951477 /nfs/dbraw/zinc/95/14/77/1026951477.db2.gz QCVVTZRWPZFWJJ-UHFFFAOYSA-N 1 1 358.398 2.645 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@H]3O)n2)c1 ZINC000840114436 1026961658 /nfs/dbraw/zinc/96/16/58/1026961658.db2.gz IDYXXGVHKPOWCI-KZNAEPCWSA-N 1 1 371.441 2.826 20 5 FFBDMO O=C1CC2(CN1C[N@H+]1CCC[C@H](c3ccc([N+](=O)[O-])cc3)C1)CCOCC2 ZINC000840124642 1026968082 /nfs/dbraw/zinc/96/80/82/1026968082.db2.gz JIYUEVRYCJIKLV-KRWDZBQOSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1CC2(CN1C[N@@H+]1CCC[C@H](c3ccc([N+](=O)[O-])cc3)C1)CCOCC2 ZINC000840124642 1026968088 /nfs/dbraw/zinc/96/80/88/1026968088.db2.gz JIYUEVRYCJIKLV-KRWDZBQOSA-N 1 1 373.453 2.761 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000840159311 1026991702 /nfs/dbraw/zinc/99/17/02/1026991702.db2.gz HLZZIKGKLUNYPH-GOSISDBHSA-N 1 1 360.414 2.956 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000840159311 1026991706 /nfs/dbraw/zinc/99/17/06/1026991706.db2.gz HLZZIKGKLUNYPH-GOSISDBHSA-N 1 1 360.414 2.956 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@@H](Nc2cccc([N+](=O)[O-])n2)C1 ZINC001158581238 1027066262 /nfs/dbraw/zinc/06/62/62/1027066262.db2.gz DGYQPUYMOIQSLT-WBVHZDCISA-N 1 1 370.409 2.861 20 5 FFBDMO COc1ccc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)c(OC)n1 ZINC001160805655 1027884339 /nfs/dbraw/zinc/88/43/39/1027884339.db2.gz QWTFAAMZFPXUDT-BQYQJAHWSA-N 1 1 359.386 2.546 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001155894203 1028963219 /nfs/dbraw/zinc/96/32/19/1028963219.db2.gz SHDSLIHJCBPEPE-DLTWYDFYSA-N 1 1 374.485 2.900 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000781386554 1029181506 /nfs/dbraw/zinc/18/15/06/1029181506.db2.gz RCAPAOCJZOYJHU-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])cc1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164492479 1029297963 /nfs/dbraw/zinc/29/79/63/1029297963.db2.gz LOXPPCYMPOCDBD-YESZJQIVSA-N 1 1 354.410 2.551 20 5 FFBDMO O=C(NCCC[NH2+]CCCc1cccc2ccccc21)[C@@H]1CC1[N+](=O)[O-] ZINC001157774876 1029661275 /nfs/dbraw/zinc/66/12/75/1029661275.db2.gz FDEZPHRHTVQHLQ-RTBURBONSA-N 1 1 355.438 2.534 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc(O)cc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782512220 1029727538 /nfs/dbraw/zinc/72/75/38/1029727538.db2.gz CVDQJFROZYXIJH-UHFFFAOYSA-N 1 1 359.357 2.826 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2ccc([N+](=O)[O-])c(C)n2)c2ccccc12 ZINC001158235867 1029766522 /nfs/dbraw/zinc/76/65/22/1029766522.db2.gz DXGKEAURHLGXTC-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@@H]2[NH2+]C[C@@H]21 ZINC001158421754 1029825798 /nfs/dbraw/zinc/82/57/98/1029825798.db2.gz FSUOAGVAJXLZKI-FKBYEOEOSA-N 1 1 359.473 2.826 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001534856213 1069693096 /nfs/dbraw/zinc/69/30/96/1069693096.db2.gz AJBRGQFJWFFFCJ-WMLDXEAASA-N 1 1 368.437 2.796 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](c4cccnc4)C3)n2)c1 ZINC000842622478 1030837110 /nfs/dbraw/zinc/83/71/10/1030837110.db2.gz PKYNOOKBRCXUEE-INIZCTEOSA-N 1 1 350.382 2.695 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796706220 1030887616 /nfs/dbraw/zinc/88/76/16/1030887616.db2.gz IZUDGJOBPMQLCJ-SJORKVTESA-N 1 1 365.430 2.617 20 5 FFBDMO O=c1[nH]c2cccc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2o1 ZINC001204305417 1031218417 /nfs/dbraw/zinc/21/84/17/1031218417.db2.gz BSXUYJDIVAXPBI-GFCCVEGCSA-N 1 1 355.354 2.523 20 5 FFBDMO C[C@]12CN(C(=O)c3cc([N+](=O)[O-])c[nH]3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001150129260 1031664006 /nfs/dbraw/zinc/66/40/06/1031664006.db2.gz XIAIAYUQLPPADW-BGYRXZFFSA-N 1 1 368.437 2.907 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC001151375428 1031939115 /nfs/dbraw/zinc/93/91/15/1031939115.db2.gz FLDLBGWQILJRLY-ZDUSSCGKSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC001151375428 1031939126 /nfs/dbraw/zinc/93/91/26/1031939126.db2.gz FLDLBGWQILJRLY-ZDUSSCGKSA-N 1 1 369.849 2.821 20 5 FFBDMO COC(=O)c1cccc2nc([C@@](F)(Cl)O[C@@H](C)C[N+](C)(C)C)[nH]c21 ZINC001223402746 1033428576 /nfs/dbraw/zinc/42/85/76/1033428576.db2.gz HDPKBOWWQBHCAB-QFYYESIMSA-O 1 1 358.821 2.779 20 5 FFBDMO C[C@@H]([NH3+])c1ncc(C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)s1 ZINC001219255691 1033575630 /nfs/dbraw/zinc/57/56/30/1033575630.db2.gz JTSFMGPFNNPFGM-SNVBAGLBSA-N 1 1 364.430 2.853 20 5 FFBDMO C[C@@H](OCc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001224108828 1033719978 /nfs/dbraw/zinc/71/99/78/1033719978.db2.gz LCLQVOJREHMSQE-CRAIPNDOSA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@@H](OCc1ccc([N+](=O)[O-])nc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001224108828 1033719994 /nfs/dbraw/zinc/71/99/94/1033719994.db2.gz LCLQVOJREHMSQE-CRAIPNDOSA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000831563142 1034125525 /nfs/dbraw/zinc/12/55/25/1034125525.db2.gz KTBWLYMTUQILBV-KWCYVHTRSA-N 1 1 371.359 2.998 20 5 FFBDMO NC(=O)CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000831894766 1034390190 /nfs/dbraw/zinc/39/01/90/1034390190.db2.gz HQAZVYWSGNJKGP-QGZVFWFLSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000831894766 1034390206 /nfs/dbraw/zinc/39/02/06/1034390206.db2.gz HQAZVYWSGNJKGP-QGZVFWFLSA-N 1 1 373.384 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)cc1 ZINC000832041417 1034511564 /nfs/dbraw/zinc/51/15/64/1034511564.db2.gz VDLUOOXNFMJVRB-QAPCUYQASA-N 1 1 362.426 2.981 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226167334 1034555995 /nfs/dbraw/zinc/55/59/95/1034555995.db2.gz HWGLDVXIGMUPIB-RDTXWAMCSA-N 1 1 369.421 2.983 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1 ZINC001226171613 1034559036 /nfs/dbraw/zinc/55/90/36/1034559036.db2.gz DPLJFUHAKADGJU-DZGCQCFKSA-N 1 1 370.409 2.693 20 5 FFBDMO COc1cc(O[C@@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC001226579773 1034745483 /nfs/dbraw/zinc/74/54/83/1034745483.db2.gz USSPUCPGHXOVEC-UONOGXRCSA-N 1 1 358.398 2.998 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC001140097021 1035340886 /nfs/dbraw/zinc/34/08/86/1035340886.db2.gz HVLSXAPBNOSLQG-CQSZACIVSA-N 1 1 351.834 2.924 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000835082042 1035518146 /nfs/dbraw/zinc/51/81/46/1035518146.db2.gz FMJDNZAJHCBPDJ-MRXNPFEDSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000835082042 1035518155 /nfs/dbraw/zinc/51/81/55/1035518155.db2.gz FMJDNZAJHCBPDJ-MRXNPFEDSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(=O)Nc1cc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C(C)=O)cc1[N+](=O)[O-] ZINC001229130687 1036512737 /nfs/dbraw/zinc/51/27/37/1036512737.db2.gz SNYFEOVLCJJXIC-BTTYYORXSA-N 1 1 361.398 2.760 20 5 FFBDMO Cc1c(C(=O)OCc2ccc([N+](=O)[O-])c(F)c2)cnn1-c1cc[nH+]cc1 ZINC001256065878 1038354985 /nfs/dbraw/zinc/35/49/85/1038354985.db2.gz IQITYPYEWXGHNS-UHFFFAOYSA-N 1 1 356.313 2.980 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@](C)(O)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093514 1038378540 /nfs/dbraw/zinc/37/85/40/1038378540.db2.gz MWWYEWBFBSKCOM-LIRRHRJNSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cccc(-c2nc3ccc(N4CC[NH+](C)CC4)cc3[nH]2)c1[N+](=O)[O-] ZINC001250880759 1038775826 /nfs/dbraw/zinc/77/58/26/1038775826.db2.gz COSPGWUBAQQUGT-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)O1 ZINC001258012637 1039109555 /nfs/dbraw/zinc/10/95/55/1039109555.db2.gz QVHVKBAJTVNXAZ-QLNSKBQOSA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1cc(Cc2nnc(CC[NH+]3C[C@H](C)O[C@@H](C)C3)o2)ccc1[N+](=O)[O-] ZINC001258071878 1039153052 /nfs/dbraw/zinc/15/30/52/1039153052.db2.gz NQLVJIOVHSHRPD-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1c([N+](=O)[O-])ccc(F)c1-c1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258154463 1039234769 /nfs/dbraw/zinc/23/47/69/1039234769.db2.gz VUJNBTBGAFJKBN-PHIMTYICSA-N 1 1 364.377 2.744 20 5 FFBDMO CC1(C)CC[NH2+]C[C@H]1NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246323295 1039313805 /nfs/dbraw/zinc/31/38/05/1039313805.db2.gz AFJVVZSKEVJZQD-MRXNPFEDSA-N 1 1 368.428 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCOC[C@@]3(CCC[NH2+]C3)C1)CC2 ZINC001246633198 1039422727 /nfs/dbraw/zinc/42/27/27/1039422727.db2.gz FBRQXYUKSPNGEI-AZUAARDMSA-N 1 1 359.470 2.544 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3cccc([N+](=O)[O-])c3F)c2C(N)=O)C1 ZINC001210379164 1039512029 /nfs/dbraw/zinc/51/20/29/1039512029.db2.gz SSRUPJGYHYJEIF-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3cccc([N+](=O)[O-])c3F)c2C(N)=O)C1 ZINC001210379164 1039512035 /nfs/dbraw/zinc/51/20/35/1039512035.db2.gz SSRUPJGYHYJEIF-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO COc1cnc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c(C)c1 ZINC001247672488 1039877912 /nfs/dbraw/zinc/87/79/12/1039877912.db2.gz JKEZYIZNTFFAKO-ZDUSSCGKSA-N 1 1 355.354 2.599 20 5 FFBDMO O=C1CCC[C@@]2(CCC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)N1 ZINC001254476446 1040743005 /nfs/dbraw/zinc/74/30/05/1040743005.db2.gz HYHVNVBAAMJSGC-FQEVSTJZSA-N 1 1 372.469 2.698 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@@H]4C[C@H]3[C@@H](C(F)(F)F)O4)CC2)cc1 ZINC001254479663 1040745644 /nfs/dbraw/zinc/74/56/44/1040745644.db2.gz GVHAJEOIYCCKBR-JYJNAYRXSA-N 1 1 371.359 2.968 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])[C@H]1Cc1cnn(C)c1 ZINC001254558796 1040795803 /nfs/dbraw/zinc/79/58/03/1040795803.db2.gz VTYPNAYEHZABER-XPGWFJOJSA-N 1 1 372.469 2.981 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2C[C@H](C(=O)NC3CC3)C[C@@H]2C1 ZINC001254556952 1040796075 /nfs/dbraw/zinc/79/60/75/1040796075.db2.gz NYBHOCJQKXSLSL-QSPRXWTASA-N 1 1 357.454 2.762 20 5 FFBDMO CCOCc1nnn2c1C[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC001254557414 1040796293 /nfs/dbraw/zinc/79/62/93/1040796293.db2.gz PXRCXNBIFPIKEG-AWEZNQCLSA-N 1 1 359.430 2.560 20 5 FFBDMO CCOCc1nnn2c1C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC001254557414 1040796305 /nfs/dbraw/zinc/79/63/05/1040796305.db2.gz PXRCXNBIFPIKEG-AWEZNQCLSA-N 1 1 359.430 2.560 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(Cc2cccc(N)c2)CC1 ZINC001254571314 1040808833 /nfs/dbraw/zinc/80/88/33/1040808833.db2.gz SFHUEGMJILYJMA-MRXNPFEDSA-N 1 1 354.454 2.926 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1 ZINC001254594402 1040821539 /nfs/dbraw/zinc/82/15/39/1040821539.db2.gz QQTDNXRBEQTQIM-JZXOWHBKSA-N 1 1 373.453 2.861 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1c1ccccc1 ZINC001254605367 1040834388 /nfs/dbraw/zinc/83/43/88/1040834388.db2.gz BMOMYFNJIKNFGO-XUVXKRRUSA-N 1 1 366.417 2.951 20 5 FFBDMO O=C(Cc1ccsc1)N1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254606271 1040835274 /nfs/dbraw/zinc/83/52/74/1040835274.db2.gz GCIHFUXDDKGOLV-GOSISDBHSA-N 1 1 371.462 2.510 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313376430 1044338164 /nfs/dbraw/zinc/33/81/64/1044338164.db2.gz PORJMMRTUKBVMV-SJLPKXTDSA-N 1 1 360.458 2.968 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1cccc2ccccc21)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001280813919 1044741682 /nfs/dbraw/zinc/74/16/82/1044741682.db2.gz JALHXARMXGKHNX-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO CN(CCC[N@H+](C)Cc1cccc2ccccc21)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001280813919 1044741699 /nfs/dbraw/zinc/74/16/99/1044741699.db2.gz JALHXARMXGKHNX-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1cccc2ccccc21)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001280813919 1044741714 /nfs/dbraw/zinc/74/17/14/1044741714.db2.gz JALHXARMXGKHNX-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC001318694619 1044813370 /nfs/dbraw/zinc/81/33/70/1044813370.db2.gz MLKBDPAJOYEWOV-QGZVFWFLSA-N 1 1 354.410 2.944 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001318786112 1044875051 /nfs/dbraw/zinc/87/50/51/1044875051.db2.gz XXZTYDHRZKVEHO-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001318786112 1044875074 /nfs/dbraw/zinc/87/50/74/1044875074.db2.gz XXZTYDHRZKVEHO-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC001319315928 1045108011 /nfs/dbraw/zinc/10/80/11/1045108011.db2.gz SIISTEIJNOOBJV-ZDUSSCGKSA-N 1 1 357.410 2.765 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001319691115 1045240663 /nfs/dbraw/zinc/24/06/63/1045240663.db2.gz NAAVHYQBGHARSX-ROUUACIJSA-N 1 1 372.400 2.979 20 5 FFBDMO Cc1cc(C(=O)NC2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)no1 ZINC001319947823 1045310330 /nfs/dbraw/zinc/31/03/30/1045310330.db2.gz NGWNRGBMCLXFQP-XQRVVYSFSA-N 1 1 370.409 2.799 20 5 FFBDMO COc1cc2[nH+]c(N3Cc4ccc([N+](=O)[O-])cc4C3)nc(N)c2cc1OC ZINC001323207829 1045508894 /nfs/dbraw/zinc/50/88/94/1045508894.db2.gz ZXRUBDWPXRDSCD-UHFFFAOYSA-N 1 1 367.365 2.658 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC001328553062 1048350599 /nfs/dbraw/zinc/35/05/99/1048350599.db2.gz LHKCUNXDXAEKEC-BBRMVZONSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC001328553062 1048350611 /nfs/dbraw/zinc/35/06/11/1048350611.db2.gz LHKCUNXDXAEKEC-BBRMVZONSA-N 1 1 361.398 2.741 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001329254206 1048637458 /nfs/dbraw/zinc/63/74/58/1048637458.db2.gz UIHJZJMOJCOVFB-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001329254206 1048637465 /nfs/dbraw/zinc/63/74/65/1048637465.db2.gz UIHJZJMOJCOVFB-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(C)ccc([N+](=O)[O-])c2C)CC[N@@H+]1CCOC ZINC001295226972 1049906065 /nfs/dbraw/zinc/90/60/65/1049906065.db2.gz FVNZWUVWXFSCBO-INIZCTEOSA-N 1 1 363.458 2.785 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC001295226972 1049906069 /nfs/dbraw/zinc/90/60/69/1049906069.db2.gz FVNZWUVWXFSCBO-INIZCTEOSA-N 1 1 363.458 2.785 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)CC[C@H](O)c1ccccc1)CC2 ZINC001340616640 1050997741 /nfs/dbraw/zinc/99/77/41/1050997741.db2.gz SEXMGEFSDAYFEO-PMACEKPBSA-N 1 1 356.422 2.828 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC)CC1 ZINC001340879810 1051212938 /nfs/dbraw/zinc/21/29/38/1051212938.db2.gz YVTIXUXVBGZUDJ-CQSZACIVSA-N 1 1 352.483 2.584 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001342656722 1051265512 /nfs/dbraw/zinc/26/55/12/1051265512.db2.gz BIJVJZGWJIXKTK-OAHLLOKOSA-N 1 1 372.473 2.737 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC001343485379 1052259026 /nfs/dbraw/zinc/25/90/26/1052259026.db2.gz DGMHLIUZCUBVBF-QGZVFWFLSA-N 1 1 374.828 2.749 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(NCc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC001308505800 1052462247 /nfs/dbraw/zinc/46/22/47/1052462247.db2.gz NJHJUPMNKCRHND-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccnc(-c3ccccn3)n2)cc1[N+](=O)[O-] ZINC001308503260 1052462429 /nfs/dbraw/zinc/46/24/29/1052462429.db2.gz QGLRVUGMAYSOGY-UHFFFAOYSA-N 1 1 351.366 2.745 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3c(C)c(F)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336026480 1053715530 /nfs/dbraw/zinc/71/55/30/1053715530.db2.gz YITIPJGGLGQMTE-MRXNPFEDSA-N 1 1 373.384 2.838 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@H+](C)CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348469943 1054717136 /nfs/dbraw/zinc/71/71/36/1054717136.db2.gz JIDMMAXCIMVRBC-FRFSOERESA-N 1 1 365.455 2.705 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@@H+](C)CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348469943 1054717152 /nfs/dbraw/zinc/71/71/52/1054717152.db2.gz JIDMMAXCIMVRBC-FRFSOERESA-N 1 1 365.455 2.705 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1 ZINC001338188903 1055303784 /nfs/dbraw/zinc/30/37/84/1055303784.db2.gz MEAGQKVAUVGUEU-UHFFFAOYSA-N 1 1 366.219 2.870 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+]2C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001352495446 1055525956 /nfs/dbraw/zinc/52/59/56/1055525956.db2.gz SBSPRFLVYWPMKQ-INIZCTEOSA-N 1 1 358.446 2.652 20 5 FFBDMO CCn1c([C@@H]2CCC[N@H+]2C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001352495446 1055525965 /nfs/dbraw/zinc/52/59/65/1055525965.db2.gz SBSPRFLVYWPMKQ-INIZCTEOSA-N 1 1 358.446 2.652 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3C[N@H+]4CCC[C@H]4CO3)o2)cc1 ZINC001200267438 1056189084 /nfs/dbraw/zinc/18/90/84/1056189084.db2.gz FYBIJGJDIHRLNH-FUHWJXTLSA-N 1 1 357.410 2.808 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC001339235577 1056234432 /nfs/dbraw/zinc/23/44/32/1056234432.db2.gz WAKQCNJRQSGVKM-YOEHRIQHSA-N 1 1 370.457 2.712 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCCc2ccc(Cl)cc2)CC1 ZINC001200470973 1058298681 /nfs/dbraw/zinc/29/86/81/1058298681.db2.gz BLFGJPINYVQQPM-IAGOWNOFSA-N 1 1 365.861 2.518 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001472057528 1058325645 /nfs/dbraw/zinc/32/56/45/1058325645.db2.gz RCIDWQDWOHUUAX-HNNXBMFYSA-N 1 1 369.849 2.864 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001454633561 1059590224 /nfs/dbraw/zinc/59/02/24/1059590224.db2.gz KFDDQRVMLJCEMH-HOCLYGCPSA-N 1 1 368.437 2.675 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](Cc3ccccc3)CCOCC2)s1 ZINC001472889315 1059675213 /nfs/dbraw/zinc/67/52/13/1059675213.db2.gz VLXHVYLBQNFNGI-UHFFFAOYSA-N 1 1 362.455 2.780 20 5 FFBDMO Cc1nccn1CCC[N@H+](C)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848482750 1060122097 /nfs/dbraw/zinc/12/20/97/1060122097.db2.gz RTQUYPZVUMLFCU-UHFFFAOYSA-N 1 1 354.414 2.943 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848496902 1060168086 /nfs/dbraw/zinc/16/80/86/1060168086.db2.gz HPNTWFDOIYGTAS-RBUKOAKNSA-N 1 1 373.453 2.902 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848496902 1060168096 /nfs/dbraw/zinc/16/80/96/1060168096.db2.gz HPNTWFDOIYGTAS-RBUKOAKNSA-N 1 1 373.453 2.902 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1 ZINC000848584307 1060310295 /nfs/dbraw/zinc/31/02/95/1060310295.db2.gz TWFAZHACTGCMAB-UHFFFAOYSA-N 1 1 368.340 2.668 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000848585177 1060314348 /nfs/dbraw/zinc/31/43/48/1060314348.db2.gz MVHKJARKJBATEW-DOMZBBRYSA-N 1 1 369.368 2.509 20 5 FFBDMO O=C(COC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000848774850 1060661795 /nfs/dbraw/zinc/66/17/95/1060661795.db2.gz NYFDKYZYOLVAQR-QGZVFWFLSA-N 1 1 368.389 2.843 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000848783913 1060689854 /nfs/dbraw/zinc/68/98/54/1060689854.db2.gz GKAJAKWLSTVLHX-KGLIPLIRSA-N 1 1 364.402 2.733 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1nc(-c2ccc(F)c(C)c2)no1 ZINC001459910335 1060844919 /nfs/dbraw/zinc/84/49/19/1060844919.db2.gz HZYNMYATMFWTJT-LLVKDONJSA-N 1 1 374.376 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+](CCOCCO)C2CCC2)c1 ZINC001460418121 1060988960 /nfs/dbraw/zinc/98/89/60/1060988960.db2.gz MIXJKMSMJODDRF-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+](CCOCCO)C2CCC2)c1 ZINC001460418121 1060988982 /nfs/dbraw/zinc/98/89/82/1060988982.db2.gz MIXJKMSMJODDRF-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001460602339 1061028434 /nfs/dbraw/zinc/02/84/34/1061028434.db2.gz AFOQLRRWBKNWFY-XPKDYRNWSA-N 1 1 365.430 2.616 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001460780015 1061098499 /nfs/dbraw/zinc/09/84/99/1061098499.db2.gz VVXJUPQYTJKAPM-SFHVURJKSA-N 1 1 373.409 2.516 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001460780015 1061098508 /nfs/dbraw/zinc/09/85/08/1061098508.db2.gz VVXJUPQYTJKAPM-SFHVURJKSA-N 1 1 373.409 2.516 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)c(C)cc1[N+](=O)[O-] ZINC001475703549 1061218801 /nfs/dbraw/zinc/21/88/01/1061218801.db2.gz PNQXVYNRHXIHFJ-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC001461688005 1061376931 /nfs/dbraw/zinc/37/69/31/1061376931.db2.gz QDRJZWAJUJQULL-LJQANCHMSA-N 1 1 352.394 2.778 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[N@@H+](CCCO)C1 ZINC001476666327 1061455255 /nfs/dbraw/zinc/45/52/55/1061455255.db2.gz XTRCBDFNPSBJMH-GFCCVEGCSA-N 1 1 370.837 2.525 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC1 ZINC001464088707 1062417976 /nfs/dbraw/zinc/41/79/76/1062417976.db2.gz SZDDAXZQCTXXJU-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC001466026519 1063300183 /nfs/dbraw/zinc/30/01/83/1063300183.db2.gz FGBVIELVLLGLNR-ZFWWWQNUSA-N 1 1 350.444 2.605 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001533530525 1063329977 /nfs/dbraw/zinc/32/99/77/1063329977.db2.gz FJVDKWSMTDXKLN-INIZCTEOSA-N 1 1 354.410 2.645 20 5 FFBDMO C[C@@H]1CN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+](C2CC2)C1 ZINC001468522754 1063999866 /nfs/dbraw/zinc/99/98/66/1063999866.db2.gz OJIUODUOSRKDCY-HNNXBMFYSA-N 1 1 357.454 2.959 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NCc1c(Br)cccc1[N+](=O)[O-] ZINC001474060810 1065449086 /nfs/dbraw/zinc/44/90/86/1065449086.db2.gz BJPMDCKOBHMODW-YGRLFVJLSA-N 1 1 354.248 2.930 20 5 FFBDMO CC(C)(C)OC(=O)NC/C=C/C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001474492853 1065534898 /nfs/dbraw/zinc/53/48/98/1065534898.db2.gz DTDORXNOPFQSQV-SNAWJCMRSA-N 1 1 362.386 2.907 20 5 FFBDMO COc1cc(C)c(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1OC ZINC001579144752 1078575291 /nfs/dbraw/zinc/57/52/91/1078575291.db2.gz ORWKKJWHMLXDLW-SFHVURJKSA-N 1 1 359.382 2.733 20 5 FFBDMO COc1cc(C)c(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1OC ZINC001579144750 1078575312 /nfs/dbraw/zinc/57/53/12/1078575312.db2.gz ORWKKJWHMLXDLW-GOSISDBHSA-N 1 1 359.382 2.733 20 5 FFBDMO Nc1cccc2c1CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC001580458998 1078809310 /nfs/dbraw/zinc/80/93/10/1078809310.db2.gz NDIMFHQFMIDGIM-UHFFFAOYSA-N 1 1 358.373 2.703 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC001580494249 1078815406 /nfs/dbraw/zinc/81/54/06/1078815406.db2.gz RJCCYGUCKANUHB-OTIVFRFGSA-N 1 1 355.369 2.920 20 5 FFBDMO C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCCC1 ZINC001558321148 1075981039 /nfs/dbraw/zinc/98/10/39/1075981039.db2.gz JYOJFWGZICEZFL-GFCCVEGCSA-N 1 1 357.414 2.560 20 5 FFBDMO C[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CCCC1 ZINC001558321148 1075981041 /nfs/dbraw/zinc/98/10/41/1075981041.db2.gz JYOJFWGZICEZFL-GFCCVEGCSA-N 1 1 357.414 2.560 20 5 FFBDMO C[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCCC1 ZINC001558321148 1075981044 /nfs/dbraw/zinc/98/10/44/1075981044.db2.gz JYOJFWGZICEZFL-GFCCVEGCSA-N 1 1 357.414 2.560 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1CO ZINC001559753926 1076187885 /nfs/dbraw/zinc/18/78/85/1076187885.db2.gz XUPROBMXIIYKKT-ZANVPECISA-N 1 1 352.778 2.501 20 5 FFBDMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001560102301 1076227082 /nfs/dbraw/zinc/22/70/82/1076227082.db2.gz KKNHMLWYWQKLOU-SFHVURJKSA-N 1 1 366.364 2.965 20 5 FFBDMO COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1nnc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC001560125838 1076230937 /nfs/dbraw/zinc/23/09/37/1076230937.db2.gz OSDVWHHZXGDOIR-KDOFPFPSSA-N 1 1 372.381 2.562 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187209 1076243686 /nfs/dbraw/zinc/24/36/86/1076243686.db2.gz BMBMDZUOYUVRQD-AAEUAGOBSA-N 1 1 360.370 2.591 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187209 1076243692 /nfs/dbraw/zinc/24/36/92/1076243692.db2.gz BMBMDZUOYUVRQD-AAEUAGOBSA-N 1 1 360.370 2.591 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC001560212790 1076248130 /nfs/dbraw/zinc/24/81/30/1076248130.db2.gz QNIYHODARWFJOU-ZDUSSCGKSA-N 1 1 357.414 2.881 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(C)(c3nc(C)no3)CC2)c1[N+](=O)[O-] ZINC001560745542 1076296306 /nfs/dbraw/zinc/29/63/06/1076296306.db2.gz RTHLMUCOEZPXKZ-UHFFFAOYSA-N 1 1 362.386 2.554 20 5 FFBDMO C[S@@](=O)Cc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC001560823994 1076303026 /nfs/dbraw/zinc/30/30/26/1076303026.db2.gz WYHZRVDIWBGURA-RUZDIDTESA-N 1 1 359.407 2.904 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CC[N@H+]2CC)c([N+](=O)[O-])cc1OCC ZINC001562067174 1076474169 /nfs/dbraw/zinc/47/41/69/1076474169.db2.gz FDDMGGJTWQVFAM-GFCCVEGCSA-N 1 1 366.418 2.608 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001567742637 1077050036 /nfs/dbraw/zinc/05/00/36/1077050036.db2.gz YHJRYFXEJUGPFT-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590052744 1080980648 /nfs/dbraw/zinc/98/06/48/1080980648.db2.gz TXBFOOOEOPNKBE-SJKOYZFVSA-N 1 1 368.397 2.501 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093505007 250036144 /nfs/dbraw/zinc/03/61/44/250036144.db2.gz NEXZDZKYNBWMQE-CRAIPNDOSA-N 1 1 356.426 2.996 20 5 FFBDMO Cc1ccc(NC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000119151270 250439052 /nfs/dbraw/zinc/43/90/52/250439052.db2.gz HJUVTAHSMODBAN-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO Cn1cc(C[N@@H+](C[C@H]2CCOC2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129901499 250867254 /nfs/dbraw/zinc/86/72/54/250867254.db2.gz SWECGYWJTCMRBB-CQSZACIVSA-N 1 1 356.426 2.996 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000272425325 252034820 /nfs/dbraw/zinc/03/48/20/252034820.db2.gz CARKBRLVZRYJET-BLLLJJGKSA-N 1 1 366.849 2.874 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CSCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000272588187 252074826 /nfs/dbraw/zinc/07/48/26/252074826.db2.gz ZQNRMZWYZCHNGT-LSDHHAIUSA-N 1 1 364.496 2.856 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651172 512124133 /nfs/dbraw/zinc/12/41/33/512124133.db2.gz HOXWLYBQXKNVKV-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO COC1CCC([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000275468193 256011615 /nfs/dbraw/zinc/01/16/15/256011615.db2.gz LFHTVEDDYHNOEG-UHFFFAOYSA-N 1 1 353.394 2.952 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651172 512124143 /nfs/dbraw/zinc/12/41/43/512124143.db2.gz HOXWLYBQXKNVKV-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276232593 256082836 /nfs/dbraw/zinc/08/28/36/256082836.db2.gz KTUATPMLHQFDGM-CYBMUJFWSA-N 1 1 364.402 2.691 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276232593 256082838 /nfs/dbraw/zinc/08/28/38/256082838.db2.gz KTUATPMLHQFDGM-CYBMUJFWSA-N 1 1 364.402 2.691 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000276426668 256098711 /nfs/dbraw/zinc/09/87/11/256098711.db2.gz OVDJFWJGEGHXLN-UHFFFAOYSA-N 1 1 364.446 2.522 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000277834424 256245451 /nfs/dbraw/zinc/24/54/51/256245451.db2.gz RRZLRGWBHQGEHR-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000278903135 256360222 /nfs/dbraw/zinc/36/02/22/256360222.db2.gz RVDRCUYQLFNNNO-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO O=c1[nH]c(NCC[N@@H+]2CCc3ccccc3C2)nc2ccc([N+](=O)[O-])cc21 ZINC000281050453 256598407 /nfs/dbraw/zinc/59/84/07/256598407.db2.gz XAQDXSVFGCBCRW-UHFFFAOYSA-N 1 1 365.393 2.714 20 5 FFBDMO O=c1[nH]c(NCC[N@H+]2CCc3ccccc3C2)nc2ccc([N+](=O)[O-])cc21 ZINC000281050453 256598408 /nfs/dbraw/zinc/59/84/08/256598408.db2.gz XAQDXSVFGCBCRW-UHFFFAOYSA-N 1 1 365.393 2.714 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000285942695 257012554 /nfs/dbraw/zinc/01/25/54/257012554.db2.gz MFEDGTZHQDNFEK-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1nc2ccccn2c(=O)c1CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000289387622 257277989 /nfs/dbraw/zinc/27/79/89/257277989.db2.gz MBPQYZNVLKAKGD-UHFFFAOYSA-N 1 1 366.421 2.628 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000295865568 257650094 /nfs/dbraw/zinc/65/00/94/257650094.db2.gz FHOOAVOYQZCSIZ-MRXNPFEDSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301120797 258026587 /nfs/dbraw/zinc/02/65/87/258026587.db2.gz SMDAVRFULWOKMB-VXGBXAGGSA-N 1 1 366.418 2.836 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC000301158180 258029784 /nfs/dbraw/zinc/02/97/84/258029784.db2.gz CQUYVNDRDFFOHY-CQSZACIVSA-N 1 1 361.446 2.545 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000301158179 258030190 /nfs/dbraw/zinc/03/01/90/258030190.db2.gz CQUYVNDRDFFOHY-AWEZNQCLSA-N 1 1 361.446 2.545 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccccn1)C1CC1 ZINC000299509530 258000936 /nfs/dbraw/zinc/00/09/36/258000936.db2.gz CCNVPFDLTRNXDN-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000302027092 258083101 /nfs/dbraw/zinc/08/31/01/258083101.db2.gz HDXAWDXUYXMICH-HUUCEWRRSA-N 1 1 358.446 2.728 20 5 FFBDMO CC[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1Cc1ccccc1 ZINC000302175634 258093074 /nfs/dbraw/zinc/09/30/74/258093074.db2.gz WWODALCBFRPHMQ-INIZCTEOSA-N 1 1 366.425 2.738 20 5 FFBDMO Cc1cc(N[C@@H](C)CCN2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302299918 258098592 /nfs/dbraw/zinc/09/85/92/258098592.db2.gz YGQWKKKCNDKVAA-AWEZNQCLSA-N 1 1 357.458 2.889 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[C@@H](C)C1 ZINC000302438395 258102032 /nfs/dbraw/zinc/10/20/32/258102032.db2.gz MRQSALZXLUXKPU-LSDHHAIUSA-N 1 1 356.426 2.548 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1CC(C)(C)O ZINC000302465498 258102552 /nfs/dbraw/zinc/10/25/52/258102552.db2.gz BFNGXQMKZFVKFR-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000302754116 258109788 /nfs/dbraw/zinc/10/97/88/258109788.db2.gz IANAVANBXGVGQX-XJKSGUPXSA-N 1 1 370.409 2.709 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1Br ZINC000317144151 258115753 /nfs/dbraw/zinc/11/57/53/258115753.db2.gz FOMPHKXUCMFDCN-QWRGUYRKSA-N 1 1 368.231 2.714 20 5 FFBDMO CCOc1cc(N2CCN(c3cc(C)[nH+]c(C)n3)CC2)ccc1[N+](=O)[O-] ZINC000301514949 258053560 /nfs/dbraw/zinc/05/35/60/258053560.db2.gz JMZGGVGEHJYOHH-UHFFFAOYSA-N 1 1 357.414 2.727 20 5 FFBDMO Cc1nc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000301736146 258065598 /nfs/dbraw/zinc/06/55/98/258065598.db2.gz VCAKYMNXXNUSGO-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000301873855 258072074 /nfs/dbraw/zinc/07/20/74/258072074.db2.gz HZAVMJPFMIGKIX-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000301873855 258072076 /nfs/dbraw/zinc/07/20/76/258072076.db2.gz HZAVMJPFMIGKIX-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000332007013 258209644 /nfs/dbraw/zinc/20/96/44/258209644.db2.gz JJQONTLPJIUVJF-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000375157674 512187782 /nfs/dbraw/zinc/18/77/82/512187782.db2.gz GMNNRWBARAKSMD-FUHWJXTLSA-N 1 1 361.398 2.524 20 5 FFBDMO C[N@@H+](CCNC(=O)CSc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000054265665 506525930 /nfs/dbraw/zinc/52/59/30/506525930.db2.gz QIUOZLBNTCMXTC-UHFFFAOYSA-N 1 1 359.451 2.935 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000054644302 506594845 /nfs/dbraw/zinc/59/48/45/506594845.db2.gz OKMATNSRGMMOSF-UHFFFAOYSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2sccc2C1 ZINC000054763715 506616515 /nfs/dbraw/zinc/61/65/15/506616515.db2.gz BUPGFUUQROKGOS-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2sccc2C1 ZINC000054763715 506616522 /nfs/dbraw/zinc/61/65/22/506616522.db2.gz BUPGFUUQROKGOS-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000008157693 506627491 /nfs/dbraw/zinc/62/74/91/506627491.db2.gz HXNRSOQFHZLYIU-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)[NH+]1CCOCC1 ZINC000067162307 506779290 /nfs/dbraw/zinc/77/92/90/506779290.db2.gz CVQWPFNQQSZQHO-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)NCc1cccc([N+](=O)[O-])c1 ZINC000067536468 506916432 /nfs/dbraw/zinc/91/64/32/506916432.db2.gz GALLWURSRVUAQJ-UHFFFAOYSA-N 1 1 368.437 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2OC)[NH+](C)C)c1 ZINC000067778536 507006842 /nfs/dbraw/zinc/00/68/42/507006842.db2.gz XOINLYAGDQNNIJ-KRWDZBQOSA-N 1 1 373.409 2.645 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1C)[N@H+]1CCc2ccccc2C1 ZINC000046246584 507103986 /nfs/dbraw/zinc/10/39/86/507103986.db2.gz GTHDUUDKQDSMJQ-QGZVFWFLSA-N 1 1 368.437 2.865 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000046281400 507111266 /nfs/dbraw/zinc/11/12/66/507111266.db2.gz GCJUPWYGIFSEND-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO Cc1cc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)ccc1[N+](=O)[O-] ZINC000018010090 507133829 /nfs/dbraw/zinc/13/38/29/507133829.db2.gz MODYCPUCTVNJDW-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000068353296 507199574 /nfs/dbraw/zinc/19/95/74/507199574.db2.gz LUXNZRHNOVOPBV-CHWSQXEVSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000068359552 507201476 /nfs/dbraw/zinc/20/14/76/507201476.db2.gz KKNJGXGMXRDMIK-CQSZACIVSA-N 1 1 371.441 2.766 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000046859955 507210317 /nfs/dbraw/zinc/21/03/17/507210317.db2.gz YNJZWEGFSPDWPO-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047142614 507272445 /nfs/dbraw/zinc/27/24/45/507272445.db2.gz NJUAWBQCDYHFFV-MRXNPFEDSA-N 1 1 374.485 2.802 20 5 FFBDMO C[C@H](CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[N@@H+](C)C1CC1 ZINC000057705540 507311785 /nfs/dbraw/zinc/31/17/85/507311785.db2.gz SOBMHICBXORJHT-LLVKDONJSA-N 1 1 360.439 2.931 20 5 FFBDMO CCN1C(=O)N=NC1C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000377567267 512331428 /nfs/dbraw/zinc/33/14/28/512331428.db2.gz WUGJZDHCZIWATD-UHFFFAOYSA-N 1 1 365.821 2.945 20 5 FFBDMO O=C(CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)Nc1ccccc1F ZINC000024897078 507447107 /nfs/dbraw/zinc/44/71/07/507447107.db2.gz NNCJCUJVRRWMKP-UHFFFAOYSA-N 1 1 372.400 2.885 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000069476494 507497275 /nfs/dbraw/zinc/49/72/75/507497275.db2.gz GILLHGASBHBMLV-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000060064772 507512361 /nfs/dbraw/zinc/51/23/61/507512361.db2.gz GEWOYVQTNOQMGB-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)c3cccc([N+](=O)[O-])c3)c2)CCO1 ZINC000060064772 507512365 /nfs/dbraw/zinc/51/23/65/507512365.db2.gz GEWOYVQTNOQMGB-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000025634427 507517452 /nfs/dbraw/zinc/51/74/52/507517452.db2.gz RWLDIZSBRMDWOF-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000061164856 507601130 /nfs/dbraw/zinc/60/11/30/507601130.db2.gz XDHMNPIFHCVHEJ-MRXNPFEDSA-N 1 1 369.425 2.501 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000050025578 507652858 /nfs/dbraw/zinc/65/28/58/507652858.db2.gz XRLFZMZFYRHJDP-IBGZPJMESA-N 1 1 368.437 2.788 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000062264942 507662757 /nfs/dbraw/zinc/66/27/57/507662757.db2.gz DVQCILFRUFVIKT-UHFFFAOYSA-N 1 1 367.365 2.892 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCCN1CC[NH+](CCOc2ccccc2)CC1 ZINC000051562495 507775476 /nfs/dbraw/zinc/77/54/76/507775476.db2.gz HIHJXQSPOLWYJF-UHFFFAOYSA-N 1 1 371.437 2.670 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@@H](c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000029536837 507782539 /nfs/dbraw/zinc/78/25/39/507782539.db2.gz TYHXCCZQMROOIN-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000029536837 507782542 /nfs/dbraw/zinc/78/25/42/507782542.db2.gz TYHXCCZQMROOIN-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NCCC[N@H+]1CCc2ccccc2C1 ZINC000029838519 507792631 /nfs/dbraw/zinc/79/26/31/507792631.db2.gz FZRIIZUZDOGHCE-UHFFFAOYSA-N 1 1 369.421 2.538 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000072759323 507850142 /nfs/dbraw/zinc/85/01/42/507850142.db2.gz SRIYIEXNBAZHON-HNNXBMFYSA-N 1 1 359.430 2.951 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558826 507883280 /nfs/dbraw/zinc/88/32/80/507883280.db2.gz WFXJCCQBXOLVAX-MRXNPFEDSA-N 1 1 365.393 2.823 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[NH+]1CCN(C)CC1 ZINC000090089314 507907881 /nfs/dbraw/zinc/90/78/81/507907881.db2.gz LSUBOSLTBCFONF-HNNXBMFYSA-N 1 1 355.442 2.705 20 5 FFBDMO O=C(c1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000091480029 507988658 /nfs/dbraw/zinc/98/86/58/507988658.db2.gz SQGNSFZYJYDAGM-CQSZACIVSA-N 1 1 369.425 2.938 20 5 FFBDMO CCc1nn(C)c(N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091730777 508005743 /nfs/dbraw/zinc/00/57/43/508005743.db2.gz ROIMUJUWPAIFOS-MRXNPFEDSA-N 1 1 357.458 2.992 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079912181 508014587 /nfs/dbraw/zinc/01/45/87/508014587.db2.gz MRQTXYPYENXUFZ-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC ZINC000091832699 508017111 /nfs/dbraw/zinc/01/71/11/508017111.db2.gz AOXJJCSINCNKCD-GFCCVEGCSA-N 1 1 362.386 2.683 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1OC ZINC000091832699 508017113 /nfs/dbraw/zinc/01/71/13/508017113.db2.gz AOXJJCSINCNKCD-GFCCVEGCSA-N 1 1 362.386 2.683 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092098489 508042879 /nfs/dbraw/zinc/04/28/79/508042879.db2.gz RGORDFJXCUVFNQ-HNNXBMFYSA-N 1 1 359.382 2.574 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092098489 508042882 /nfs/dbraw/zinc/04/28/82/508042882.db2.gz RGORDFJXCUVFNQ-HNNXBMFYSA-N 1 1 359.382 2.574 20 5 FFBDMO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000080230703 508054387 /nfs/dbraw/zinc/05/43/87/508054387.db2.gz ZEJJLJIALRSMQQ-DZGCQCFKSA-N 1 1 369.425 2.554 20 5 FFBDMO CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[N@@H+](C)C1 ZINC000092253380 508054721 /nfs/dbraw/zinc/05/47/21/508054721.db2.gz YIYDRPRMEWKNCA-HNNXBMFYSA-N 1 1 357.458 2.769 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@H]2CCCN(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092253380 508054731 /nfs/dbraw/zinc/05/47/31/508054731.db2.gz YIYDRPRMEWKNCA-HNNXBMFYSA-N 1 1 357.458 2.769 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@H]2CCCN(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092253380 508054733 /nfs/dbraw/zinc/05/47/33/508054733.db2.gz YIYDRPRMEWKNCA-HNNXBMFYSA-N 1 1 357.458 2.769 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000092609186 508086471 /nfs/dbraw/zinc/08/64/71/508086471.db2.gz YLSKSEQNNOLABX-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000080645034 508091129 /nfs/dbraw/zinc/09/11/29/508091129.db2.gz CMVKMGRACWQLNR-UHFFFAOYSA-N 1 1 355.320 2.674 20 5 FFBDMO CCC[N@@H+](CC)CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000080677941 508094537 /nfs/dbraw/zinc/09/45/37/508094537.db2.gz HAYYPOVKSULSFE-UHFFFAOYSA-N 1 1 359.430 2.703 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cccc(-n4cccn4)c3)C2)nc1 ZINC000093534243 508147874 /nfs/dbraw/zinc/14/78/74/508147874.db2.gz IAYYGOAXTWWLPC-INIZCTEOSA-N 1 1 364.409 2.862 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000112075078 508148725 /nfs/dbraw/zinc/14/87/25/508148725.db2.gz DFJWOUWXVSPFKB-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000076495176 508213983 /nfs/dbraw/zinc/21/39/83/508213983.db2.gz SUQNMQDAWACUSJ-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000076495176 508213986 /nfs/dbraw/zinc/21/39/86/508213986.db2.gz SUQNMQDAWACUSJ-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC(C)(C)C1 ZINC000083415813 508245341 /nfs/dbraw/zinc/24/53/41/508245341.db2.gz GHUZKZKTDYFLMP-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO Cc1ccc2nc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn2c1 ZINC000084083733 508265123 /nfs/dbraw/zinc/26/51/23/508265123.db2.gz QPYXGUQGJVALAK-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1ccc2nc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn2c1 ZINC000084083733 508265124 /nfs/dbraw/zinc/26/51/24/508265124.db2.gz QPYXGUQGJVALAK-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO CCOC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000113936121 508286381 /nfs/dbraw/zinc/28/63/81/508286381.db2.gz XBGDPQAIBUUOPF-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000113936121 508286385 /nfs/dbraw/zinc/28/63/85/508286385.db2.gz XBGDPQAIBUUOPF-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000113936120 508286697 /nfs/dbraw/zinc/28/66/97/508286697.db2.gz XBGDPQAIBUUOPF-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000113936120 508286698 /nfs/dbraw/zinc/28/66/98/508286698.db2.gz XBGDPQAIBUUOPF-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000085293268 508302674 /nfs/dbraw/zinc/30/26/74/508302674.db2.gz ORYWKUXTMPUZAK-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cc([N+](=O)[O-])c1 ZINC000121916743 508448197 /nfs/dbraw/zinc/44/81/97/508448197.db2.gz GIMQHXLXYHJCTJ-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000156627332 508453582 /nfs/dbraw/zinc/45/35/82/508453582.db2.gz GATJPDKBLLVORQ-UHFFFAOYSA-N 1 1 371.328 2.641 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3nccc(C)c3[N+](=O)[O-])CC2)c1 ZINC000152628236 508481619 /nfs/dbraw/zinc/48/16/19/508481619.db2.gz HPAVCNIJBXDHIS-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO Cc1c(CC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134078953 508490058 /nfs/dbraw/zinc/49/00/58/508490058.db2.gz XWBPAHZHUKUXKQ-LPHOPBHVSA-N 1 1 357.454 2.921 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116279128 508493927 /nfs/dbraw/zinc/49/39/27/508493927.db2.gz DNSIEBCKOIAIML-KRWDZBQOSA-N 1 1 366.893 2.850 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000117341909 508593641 /nfs/dbraw/zinc/59/36/41/508593641.db2.gz DKNYGRIUVMRTDD-AWEZNQCLSA-N 1 1 363.414 2.641 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128687582 508629066 /nfs/dbraw/zinc/62/90/66/508629066.db2.gz PANLCJGDJSBBKI-JKSUJKDBSA-N 1 1 353.394 2.688 20 5 FFBDMO O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000153787297 508649142 /nfs/dbraw/zinc/64/91/42/508649142.db2.gz SZJSSBZJCBQODA-UHFFFAOYSA-N 1 1 370.409 2.749 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000153893733 508671833 /nfs/dbraw/zinc/67/18/33/508671833.db2.gz MNGYZXQYSGAADZ-DYVFJYSZSA-N 1 1 359.426 2.692 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1cccc(F)c1 ZINC000118866461 508688468 /nfs/dbraw/zinc/68/84/68/508688468.db2.gz HZFLEDVYHICCGH-HNNXBMFYSA-N 1 1 373.388 2.644 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000119024031 508708579 /nfs/dbraw/zinc/70/85/79/508708579.db2.gz YNHMLBMVTKCZFR-HNNXBMFYSA-N 1 1 366.893 2.850 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000154100338 508717068 /nfs/dbraw/zinc/71/70/68/508717068.db2.gz PMKRVMUJCUCJMA-GUYCJALGSA-N 1 1 359.426 2.692 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000123661658 508722083 /nfs/dbraw/zinc/72/20/83/508722083.db2.gz HEQYXSXCAHYJRW-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO Cc1ccn(Cc2cn3cc(Br)ccc3[nH+]2)c(=O)c1[N+](=O)[O-] ZINC000129599102 508744815 /nfs/dbraw/zinc/74/48/15/508744815.db2.gz LVMPSOWAWNYJNO-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCC[C@H](C)C1 ZINC000124119392 508786000 /nfs/dbraw/zinc/78/60/00/508786000.db2.gz CKCFWNCEUNXKAI-GJZGRUSLSA-N 1 1 360.458 2.783 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000124500764 508842672 /nfs/dbraw/zinc/84/26/72/508842672.db2.gz RIBLJOYSEATWEQ-CQSZACIVSA-N 1 1 367.421 2.597 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c(OC)c1 ZINC000159702671 508877244 /nfs/dbraw/zinc/87/72/44/508877244.db2.gz IIUQSTKZMMISAS-KRWDZBQOSA-N 1 1 373.409 2.611 20 5 FFBDMO C[C@@H]1SCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1c1ccccc1 ZINC000159834034 508898687 /nfs/dbraw/zinc/89/86/87/508898687.db2.gz ZPMWIUJVEGKWOU-KBXCAEBGSA-N 1 1 359.451 2.935 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000159855679 508900752 /nfs/dbraw/zinc/90/07/52/508900752.db2.gz BDDREKZQTNJVLV-OAHLLOKOSA-N 1 1 359.451 2.871 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000155006074 508902664 /nfs/dbraw/zinc/90/26/64/508902664.db2.gz ZSBPXGVGMFSBMK-GFCCVEGCSA-N 1 1 359.382 2.561 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[C@@H]1[NH+]1CCOCC1 ZINC000120009177 508909820 /nfs/dbraw/zinc/90/98/20/508909820.db2.gz YNMILGVVSDEXPU-QAPCUYQASA-N 1 1 368.437 2.814 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150881845 508914204 /nfs/dbraw/zinc/91/42/04/508914204.db2.gz MTBJXIAWVFNEMS-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150881845 508914208 /nfs/dbraw/zinc/91/42/08/508914208.db2.gz MTBJXIAWVFNEMS-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000155311679 508974046 /nfs/dbraw/zinc/97/40/46/508974046.db2.gz PMBDRUPDLYWVCY-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO COCCOc1cccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000160428785 508985911 /nfs/dbraw/zinc/98/59/11/508985911.db2.gz GGTJPEOFYAVNOE-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125573972 509001430 /nfs/dbraw/zinc/00/14/30/509001430.db2.gz IASBJYOYKRJEOA-CRAIPNDOSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@H](c1cccnc1)N1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120577016 509024782 /nfs/dbraw/zinc/02/47/82/509024782.db2.gz JZEZRJOCQMUETE-MRXNPFEDSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120577016 509024784 /nfs/dbraw/zinc/02/47/84/509024784.db2.gz JZEZRJOCQMUETE-MRXNPFEDSA-N 1 1 356.426 2.747 20 5 FFBDMO CCN1CCN([C@H](C)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000155573443 509030057 /nfs/dbraw/zinc/03/00/57/509030057.db2.gz PADGXTXDQNEGQA-VQIMIIECSA-N 1 1 360.502 2.532 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)Cc1ccccn1 ZINC000161188812 509082894 /nfs/dbraw/zinc/08/28/94/509082894.db2.gz XENXBQSGXKJRTO-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126741560 509120834 /nfs/dbraw/zinc/12/08/34/509120834.db2.gz WKSZFBPPBYIQKQ-KSSFIOAISA-N 1 1 372.469 2.750 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000162013282 509169602 /nfs/dbraw/zinc/16/96/02/509169602.db2.gz RIKDRRONHCMEGT-UHFFFAOYSA-N 1 1 351.366 2.974 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000172715072 509193224 /nfs/dbraw/zinc/19/32/24/509193224.db2.gz CGOYLHQIALKXMM-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3c([N+](=O)[O-])cnn3C)cc2)C1 ZINC000162487867 509235360 /nfs/dbraw/zinc/23/53/60/509235360.db2.gz PDBOFASBCAIZFZ-CYBMUJFWSA-N 1 1 357.414 2.813 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000248374145 509279053 /nfs/dbraw/zinc/27/90/53/509279053.db2.gz OBLXXASTNBMIGX-GOSISDBHSA-N 1 1 371.437 2.547 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]2CCCC[C@@H]21 ZINC000248411195 509304947 /nfs/dbraw/zinc/30/49/47/509304947.db2.gz DNILVSZDFQBVSC-YRGRVCCFSA-N 1 1 361.398 2.773 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000248459699 509331006 /nfs/dbraw/zinc/33/10/06/509331006.db2.gz NUYVKSTYOAGTOZ-IAGOWNOFSA-N 1 1 357.410 2.521 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248461065 509332693 /nfs/dbraw/zinc/33/26/93/509332693.db2.gz OUSDZZUUMCWSGQ-RRFJBIMHSA-N 1 1 354.472 2.941 20 5 FFBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000182663118 509356980 /nfs/dbraw/zinc/35/69/80/509356980.db2.gz MMMVEAXQFIAACK-CYBMUJFWSA-N 1 1 351.403 2.505 20 5 FFBDMO C[C@@H]1C[C@@H]([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CCN1Cc1ccccc1 ZINC000176251022 509403359 /nfs/dbraw/zinc/40/33/59/509403359.db2.gz KBFZPODSEAHQJZ-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@@H+]1Cc1ccccc1 ZINC000176251022 509403364 /nfs/dbraw/zinc/40/33/64/509403364.db2.gz KBFZPODSEAHQJZ-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176251022 509403372 /nfs/dbraw/zinc/40/33/72/509403372.db2.gz KBFZPODSEAHQJZ-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179366134 509403633 /nfs/dbraw/zinc/40/36/33/509403633.db2.gz OIZSKBOMNKEJEB-OAHLLOKOSA-N 1 1 372.425 2.580 20 5 FFBDMO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000192211011 509403941 /nfs/dbraw/zinc/40/39/41/509403941.db2.gz PUYDJSMYRJAXEF-IBGZPJMESA-N 1 1 369.421 2.616 20 5 FFBDMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1[N+](=O)[O-] ZINC000192210633 509404091 /nfs/dbraw/zinc/40/40/91/509404091.db2.gz JORRAPXWWDNUIR-QGZVFWFLSA-N 1 1 369.421 2.616 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271588 509413475 /nfs/dbraw/zinc/41/34/75/509413475.db2.gz SNWBGQRPRWEWBO-HNNXBMFYSA-N 1 1 351.447 2.646 20 5 FFBDMO C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182821043 509442414 /nfs/dbraw/zinc/44/24/14/509442414.db2.gz OIFKCTLTOJQDGH-LSDHHAIUSA-N 1 1 360.458 2.776 20 5 FFBDMO C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182841608 509455199 /nfs/dbraw/zinc/45/51/99/509455199.db2.gz VNFJQGBDRFUPQC-RYUDHWBXSA-N 1 1 364.421 2.699 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000248835204 509504787 /nfs/dbraw/zinc/50/47/87/509504787.db2.gz NCPWLNQCRVUXJP-PTEHBNRSSA-N 1 1 374.384 2.981 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000248835204 509504795 /nfs/dbraw/zinc/50/47/95/509504795.db2.gz NCPWLNQCRVUXJP-PTEHBNRSSA-N 1 1 374.384 2.981 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000248894078 509533988 /nfs/dbraw/zinc/53/39/88/509533988.db2.gz SXODRSZEHVVRLM-WMLDXEAASA-N 1 1 369.421 2.854 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCN(C)CC1 ZINC000192648098 509581896 /nfs/dbraw/zinc/58/18/96/509581896.db2.gz HNBCFBYCLBTZPZ-UXHICEINSA-N 1 1 360.502 2.834 20 5 FFBDMO CC(=O)c1ccccc1OCC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173468452 509618874 /nfs/dbraw/zinc/61/88/74/509618874.db2.gz NGSCFLFLDBNQHX-OAHLLOKOSA-N 1 1 370.409 2.758 20 5 FFBDMO CC(=O)c1ccccc1OCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173468452 509618884 /nfs/dbraw/zinc/61/88/84/509618884.db2.gz NGSCFLFLDBNQHX-OAHLLOKOSA-N 1 1 370.409 2.758 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCc2cccc(C[N@@H+](C)CC)c2)c1[N+](=O)[O-] ZINC000264667440 509634435 /nfs/dbraw/zinc/63/44/35/509634435.db2.gz KOXRTVKGCJPHML-UHFFFAOYSA-N 1 1 359.430 2.652 20 5 FFBDMO CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@@H]1CCC[N@@H+](C)C1 ZINC000267920514 509670410 /nfs/dbraw/zinc/67/04/10/509670410.db2.gz JMMOXVYRTMKJSL-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C[C@H](C)O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000170691373 509724893 /nfs/dbraw/zinc/72/48/93/509724893.db2.gz UJPZFAOQZTVLRV-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268040723 509730233 /nfs/dbraw/zinc/73/02/33/509730233.db2.gz XYWBBGDLFRDMIF-ONGXEEELSA-N 1 1 357.332 2.969 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000189773893 509743958 /nfs/dbraw/zinc/74/39/58/509743958.db2.gz PFUBTZSBDBGCLL-WMLDXEAASA-N 1 1 363.439 2.937 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000189773893 509743961 /nfs/dbraw/zinc/74/39/61/509743961.db2.gz PFUBTZSBDBGCLL-WMLDXEAASA-N 1 1 363.439 2.937 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)NCc1ccco1 ZINC000237948737 509783966 /nfs/dbraw/zinc/78/39/66/509783966.db2.gz MUVRTHVKWQHWDR-UHFFFAOYSA-N 1 1 355.350 2.854 20 5 FFBDMO COC[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000251522185 509811186 /nfs/dbraw/zinc/81/11/86/509811186.db2.gz CUEPSRLOYXNLML-CJNGLKHVSA-N 1 1 361.398 2.528 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000177019222 509822915 /nfs/dbraw/zinc/82/29/15/509822915.db2.gz HTAZGAYCUPDEHV-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180240019 509828986 /nfs/dbraw/zinc/82/89/86/509828986.db2.gz JVNFRMAMWBOIIE-QGZVFWFLSA-N 1 1 372.368 2.860 20 5 FFBDMO CC(C)(CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000183564348 509862915 /nfs/dbraw/zinc/86/29/15/509862915.db2.gz CNFSOAZRVJUTSI-UHFFFAOYSA-N 1 1 369.425 2.948 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000183585824 509872981 /nfs/dbraw/zinc/87/29/81/509872981.db2.gz GBURDIOQKXCHKJ-ZFWWWQNUSA-N 1 1 355.398 2.774 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265284417 509967381 /nfs/dbraw/zinc/96/73/81/509967381.db2.gz JFMLLZICXQPKNK-UONOGXRCSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCCOC1 ZINC000174142358 509967659 /nfs/dbraw/zinc/96/76/59/509967659.db2.gz YZLQZYWBUYMXHB-RYUDHWBXSA-N 1 1 355.822 2.934 20 5 FFBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988444 /nfs/dbraw/zinc/98/84/44/509988444.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988451 /nfs/dbraw/zinc/98/84/51/509988451.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177304264 509988462 /nfs/dbraw/zinc/98/84/62/509988462.db2.gz QJRRNRUZDYMVGV-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000245535744 509989296 /nfs/dbraw/zinc/98/92/96/509989296.db2.gz FQLCXQZGVLRJNF-IAQYHMDHSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000245535744 509989298 /nfs/dbraw/zinc/98/92/98/509989298.db2.gz FQLCXQZGVLRJNF-IAQYHMDHSA-N 1 1 355.822 2.670 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193760812 510054448 /nfs/dbraw/zinc/05/44/48/510054448.db2.gz ICBFZTJXGKTFNZ-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000180693463 510059412 /nfs/dbraw/zinc/05/94/12/510059412.db2.gz GSMNQWLHADBRTM-UHFFFAOYSA-N 1 1 360.458 2.905 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000193813026 510083120 /nfs/dbraw/zinc/08/31/20/510083120.db2.gz XKJVGNGSELAXNC-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1cccnc1)C1CC1 ZINC000180742594 510085342 /nfs/dbraw/zinc/08/53/42/510085342.db2.gz NYXAUTUFBFOPPA-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000193851290 510099517 /nfs/dbraw/zinc/09/95/17/510099517.db2.gz OBIFWKLUQIKSIY-UHFFFAOYSA-N 1 1 357.414 2.942 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000194058794 510195898 /nfs/dbraw/zinc/19/58/98/510195898.db2.gz LPQZJRQZYQAHPG-QWHCGFSZSA-N 1 1 368.393 2.619 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000265733619 510201587 /nfs/dbraw/zinc/20/15/87/510201587.db2.gz RTQJSUWABNODIN-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO O=C(C[N@@H+]1CCCc2ccccc2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000171592955 510242852 /nfs/dbraw/zinc/24/28/52/510242852.db2.gz DURLNOQOQBNILH-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO O=C(C[N@H+]1CCCc2ccccc2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000171592955 510242858 /nfs/dbraw/zinc/24/28/58/510242858.db2.gz DURLNOQOQBNILH-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000246025814 510254196 /nfs/dbraw/zinc/25/41/96/510254196.db2.gz VNGNHSFYCKZVFJ-SMDDNHRTSA-N 1 1 369.368 2.753 20 5 FFBDMO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174745015 510286821 /nfs/dbraw/zinc/28/68/21/510286821.db2.gz UGPZOFZXHLOSRU-CYBMUJFWSA-N 1 1 373.240 2.981 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N)cc1)[NH+]1CCOCC1 ZINC000184380661 510295385 /nfs/dbraw/zinc/29/53/85/510295385.db2.gz HXFXJRHEEGMEED-ZDUSSCGKSA-N 1 1 370.409 2.823 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCN4CCCC[C@H]4C3)o2)c1 ZINC000246287145 510407556 /nfs/dbraw/zinc/40/75/56/510407556.db2.gz AFMIMZFAGGRQBC-KRWDZBQOSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCN4CCCC[C@H]4C3)o2)c1 ZINC000246287145 510407561 /nfs/dbraw/zinc/40/75/61/510407561.db2.gz AFMIMZFAGGRQBC-KRWDZBQOSA-N 1 1 356.426 2.962 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(C(=O)NC)cc1 ZINC000175053919 510460997 /nfs/dbraw/zinc/46/09/97/510460997.db2.gz RXCMASRUWSZXOI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(C(=O)NC)cc1 ZINC000175053919 510461002 /nfs/dbraw/zinc/46/10/02/510461002.db2.gz RXCMASRUWSZXOI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000181555032 510471832 /nfs/dbraw/zinc/47/18/32/510471832.db2.gz GNIRKFPEMINFSO-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000181555032 510471835 /nfs/dbraw/zinc/47/18/35/510471835.db2.gz GNIRKFPEMINFSO-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000266235121 510474582 /nfs/dbraw/zinc/47/45/82/510474582.db2.gz DBEVLXTXBRYYDD-LBPRGKRZSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@H]2C1 ZINC000266235121 510474590 /nfs/dbraw/zinc/47/45/90/510474590.db2.gz DBEVLXTXBRYYDD-LBPRGKRZSA-N 1 1 357.332 2.924 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](c2cccs2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000172015166 510499347 /nfs/dbraw/zinc/49/93/47/510499347.db2.gz YLAQUEQZYVRUNW-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181679715 510536241 /nfs/dbraw/zinc/53/62/41/510536241.db2.gz REVOTNQRWSFJCU-UONOGXRCSA-N 1 1 361.442 2.986 20 5 FFBDMO O=C1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@H]2N1 ZINC000246568785 510561474 /nfs/dbraw/zinc/56/14/74/510561474.db2.gz KZAXKEFAPCTGGK-HZPDHXFCSA-N 1 1 370.409 2.535 20 5 FFBDMO O=C1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@H]2N1 ZINC000246568785 510561479 /nfs/dbraw/zinc/56/14/79/510561479.db2.gz KZAXKEFAPCTGGK-HZPDHXFCSA-N 1 1 370.409 2.535 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000194919839 510591974 /nfs/dbraw/zinc/59/19/74/510591974.db2.gz XBIOPFQUXWMNOW-LJQANCHMSA-N 1 1 361.442 2.765 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2CC[NH+](C/C=C/c3ccccc3)CC2)c1 ZINC000178563389 510664924 /nfs/dbraw/zinc/66/49/24/510664924.db2.gz AFSCNGQZSLGPME-FERLCFGISA-N 1 1 367.449 2.959 20 5 FFBDMO CN(Cc1c(F)cccc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188277615 510685197 /nfs/dbraw/zinc/68/51/97/510685197.db2.gz BMGVGYLKQCISIC-FQEVSTJZSA-N 1 1 373.428 2.803 20 5 FFBDMO C[C@@H]1CN(C)c2ccccc2C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181976719 510688682 /nfs/dbraw/zinc/68/86/82/510688682.db2.gz XJHJMEHATADSRF-WBVHZDCISA-N 1 1 371.437 2.675 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000182085017 510747855 /nfs/dbraw/zinc/74/78/55/510747855.db2.gz NMPNYAPVQBXVNN-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO CN(C)C(=O)CC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000182185204 510802742 /nfs/dbraw/zinc/80/27/42/510802742.db2.gz ZEJSSYRQQVDXBT-UHFFFAOYSA-N 1 1 372.425 2.940 20 5 FFBDMO C[N@H+](Cc1ccc(F)c(F)c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182204583 510812735 /nfs/dbraw/zinc/81/27/35/510812735.db2.gz MEVPNXRWFPEEQX-CYBMUJFWSA-N 1 1 352.337 2.745 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247302979 510856206 /nfs/dbraw/zinc/85/62/06/510856206.db2.gz VDCCLMSEVGPAFL-WMLDXEAASA-N 1 1 364.446 2.853 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604032 510965145 /nfs/dbraw/zinc/96/51/45/510965145.db2.gz HIVMQIHWFVPVCV-LBPRGKRZSA-N 1 1 361.377 2.665 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000294231686 510998744 /nfs/dbraw/zinc/99/87/44/510998744.db2.gz RNVRZAKNASVTJR-KRWDZBQOSA-N 1 1 369.824 2.874 20 5 FFBDMO CN(c1ncc([N+](=O)[O-])cc1Br)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286460030 511025400 /nfs/dbraw/zinc/02/54/00/511025400.db2.gz SPPFUKOHYZQZSO-ZACCUICWSA-N 1 1 355.236 2.814 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cn1 ZINC000361635174 511072801 /nfs/dbraw/zinc/07/28/01/511072801.db2.gz KVMHBZAJTIIFRS-WEVVVXLNSA-N 1 1 363.377 2.814 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N1CCN(C)CC1 ZINC000271135021 511093508 /nfs/dbraw/zinc/09/35/08/511093508.db2.gz MSXQGCZLWXDQID-HOTGVXAUSA-N 1 1 366.531 2.691 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCc1cnccn1 ZINC000271283428 511149811 /nfs/dbraw/zinc/14/98/11/511149811.db2.gz APJJNFZLQCKWAK-GFCCVEGCSA-N 1 1 354.370 2.670 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1cnccn1 ZINC000271283428 511149813 /nfs/dbraw/zinc/14/98/13/511149813.db2.gz APJJNFZLQCKWAK-GFCCVEGCSA-N 1 1 354.370 2.670 20 5 FFBDMO CC(C)N1CC[NH+](CCCn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000298113422 511179709 /nfs/dbraw/zinc/17/97/09/511179709.db2.gz BDKDNYVZMKGROL-UHFFFAOYSA-N 1 1 357.458 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)cs2)c1 ZINC000362719297 511225182 /nfs/dbraw/zinc/22/51/82/511225182.db2.gz IGTGPQPUVQPKDS-IAGOWNOFSA-N 1 1 374.466 2.671 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000271512711 511229610 /nfs/dbraw/zinc/22/96/10/511229610.db2.gz AMPJYMGYMGQWLE-UHFFFAOYSA-N 1 1 371.235 2.917 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000365099733 511256878 /nfs/dbraw/zinc/25/68/78/511256878.db2.gz MROLQGGKUUVPTR-RYUDHWBXSA-N 1 1 355.797 2.673 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000295078324 511273852 /nfs/dbraw/zinc/27/38/52/511273852.db2.gz WOUBJMBMGKXXRT-RDJZCZTQSA-N 1 1 359.426 2.500 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H](n4cccn4)C3)o2)c1 ZINC000291741898 511318018 /nfs/dbraw/zinc/31/80/18/511318018.db2.gz KBNQVWDBCCKHDQ-MRXNPFEDSA-N 1 1 353.382 2.936 20 5 FFBDMO COCc1ccccc1CNC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271786133 511324726 /nfs/dbraw/zinc/32/47/26/511324726.db2.gz TWBIDRORUGWFNH-AWEZNQCLSA-N 1 1 357.410 2.708 20 5 FFBDMO Cc1nc(NCc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)ncc1[N+](=O)[O-] ZINC000295446855 511408374 /nfs/dbraw/zinc/40/83/74/511408374.db2.gz GXJUNHODPDPQDP-CYBMUJFWSA-N 1 1 357.414 2.526 20 5 FFBDMO Cc1nc(NCc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)ncc1[N+](=O)[O-] ZINC000295446855 511408377 /nfs/dbraw/zinc/40/83/77/511408377.db2.gz GXJUNHODPDPQDP-CYBMUJFWSA-N 1 1 357.414 2.526 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280292551 511409393 /nfs/dbraw/zinc/40/93/93/511409393.db2.gz WMZHVTCKNSFAJO-UHFFFAOYSA-N 1 1 354.769 2.641 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000291975659 511414094 /nfs/dbraw/zinc/41/40/94/511414094.db2.gz YEFJODWDSSQEFR-UKRRQHHQSA-N 1 1 371.441 2.663 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cc(C[NH+]2CCCC2)on1 ZINC000292108456 511468273 /nfs/dbraw/zinc/46/82/73/511468273.db2.gz LXKSZGAHXLAAHS-UHFFFAOYSA-N 1 1 372.425 2.931 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000280510799 511493894 /nfs/dbraw/zinc/49/38/94/511493894.db2.gz NNDWQAODCNDJLB-INIZCTEOSA-N 1 1 373.409 2.531 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292181449 511497149 /nfs/dbraw/zinc/49/71/49/511497149.db2.gz KQRPESGLXXOXHT-QGZVFWFLSA-N 1 1 367.833 2.571 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)c([N+](=O)[O-])cc1F ZINC000295759374 511506062 /nfs/dbraw/zinc/50/60/62/511506062.db2.gz XVPVUCNAZRZBFM-QWHCGFSZSA-N 1 1 373.384 2.524 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)c([N+](=O)[O-])cc1F ZINC000295759374 511506067 /nfs/dbraw/zinc/50/60/67/511506067.db2.gz XVPVUCNAZRZBFM-QWHCGFSZSA-N 1 1 373.384 2.524 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](OCc3ccncc3)C2)c2c(c1)COCO2 ZINC000280719493 511575538 /nfs/dbraw/zinc/57/55/38/511575538.db2.gz BZKXPDPGRMFQNZ-SFHVURJKSA-N 1 1 371.393 2.647 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](OCc3ccncc3)C2)c2c(c1)COCO2 ZINC000280719493 511575543 /nfs/dbraw/zinc/57/55/43/511575543.db2.gz BZKXPDPGRMFQNZ-SFHVURJKSA-N 1 1 371.393 2.647 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1c[nH+]c2c1C[C@@H](C)[C@H](C)C2 ZINC000296049962 511602466 /nfs/dbraw/zinc/60/24/66/511602466.db2.gz UBMOCWSCONHSMU-VXGBXAGGSA-N 1 1 358.398 2.809 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCO)C1CCCCC1 ZINC000299496378 511658475 /nfs/dbraw/zinc/65/84/75/511658475.db2.gz BELMILZUROXFTK-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](c1ccc(Cl)cc1)c1cnccn1 ZINC000365886022 511710021 /nfs/dbraw/zinc/71/00/21/511710021.db2.gz PJMIZNXKRLQFNW-QGZVFWFLSA-N 1 1 372.816 2.956 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](c1ccc(Cl)cc1)c1cnccn1 ZINC000365886022 511710027 /nfs/dbraw/zinc/71/00/27/511710027.db2.gz PJMIZNXKRLQFNW-QGZVFWFLSA-N 1 1 372.816 2.956 20 5 FFBDMO CNC(=O)[C@]1(C)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000281072526 511710913 /nfs/dbraw/zinc/71/09/13/511710913.db2.gz INIQSPQSFCCCRA-QGZVFWFLSA-N 1 1 360.439 2.676 20 5 FFBDMO Cc1nc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)oc1C ZINC000274118416 511724809 /nfs/dbraw/zinc/72/48/09/511724809.db2.gz UVJWSSOXLGUUAI-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO Cc1nc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)oc1C ZINC000274118416 511724815 /nfs/dbraw/zinc/72/48/15/511724815.db2.gz UVJWSSOXLGUUAI-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CCn4cc[nH+]c4C3)n2)c1 ZINC000350243582 511755776 /nfs/dbraw/zinc/75/57/76/511755776.db2.gz HRCSTPISIKXNAK-NSHDSACASA-N 1 1 355.354 2.504 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCn4cc[nH+]c4C3)n2)c1 ZINC000350243580 511755868 /nfs/dbraw/zinc/75/58/68/511755868.db2.gz HRCSTPISIKXNAK-LLVKDONJSA-N 1 1 355.354 2.504 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000292973370 511791468 /nfs/dbraw/zinc/79/14/68/511791468.db2.gz ATKYWZFMINSWFR-LLVKDONJSA-N 1 1 360.357 2.799 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCCC[C@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC000281298402 511795563 /nfs/dbraw/zinc/79/55/63/511795563.db2.gz HIGLCEKBFZHPNP-INIZCTEOSA-N 1 1 360.414 2.943 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC000281298402 511795568 /nfs/dbraw/zinc/79/55/68/511795568.db2.gz HIGLCEKBFZHPNP-INIZCTEOSA-N 1 1 360.414 2.943 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000293014207 511807284 /nfs/dbraw/zinc/80/72/84/511807284.db2.gz QBHNRJKWQYQSGH-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000293050377 511821433 /nfs/dbraw/zinc/82/14/33/511821433.db2.gz MVHYZPUFRIPHEM-IBGZPJMESA-N 1 1 363.458 2.962 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)CCCO)c([N+](=O)[O-])c1 ZINC000281589287 511901434 /nfs/dbraw/zinc/90/14/34/511901434.db2.gz FJPHIESEKSDFLJ-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)CCCO)c([N+](=O)[O-])c1 ZINC000281589287 511901437 /nfs/dbraw/zinc/90/14/37/511901437.db2.gz FJPHIESEKSDFLJ-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000293503316 511989362 /nfs/dbraw/zinc/98/93/62/511989362.db2.gz UQGQUGFFLCNFKB-TUAOUCFPSA-N 1 1 354.838 2.600 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000375695078 512459227 /nfs/dbraw/zinc/45/92/27/512459227.db2.gz ZDPNXCSEBQIXPO-QGZVFWFLSA-N 1 1 360.414 2.662 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000375766285 512495777 /nfs/dbraw/zinc/49/57/77/512495777.db2.gz ULOQGYJFJFKHSK-ZDUSSCGKSA-N 1 1 358.398 2.574 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1F ZINC000411414184 512624422 /nfs/dbraw/zinc/62/44/22/512624422.db2.gz HSHJKCAJGNISAY-OLZOCXBDSA-N 1 1 367.421 2.664 20 5 FFBDMO O=C1[C@H]([NH+]2CCC(OCC3CC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000374091953 512655735 /nfs/dbraw/zinc/65/57/35/512655735.db2.gz HDXSSCQFWPCLLL-GOSISDBHSA-N 1 1 359.426 2.591 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000376138445 512678797 /nfs/dbraw/zinc/67/87/97/512678797.db2.gz BNVJWFQWEZFPSW-UHFFFAOYSA-N 1 1 357.366 2.687 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(C)(CN2CC[NH+](C)CC2)CC1 ZINC000367935709 512731250 /nfs/dbraw/zinc/73/12/50/512731250.db2.gz QSIYINMBAWUSLQ-UHFFFAOYSA-N 1 1 374.485 2.651 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[NH2+]2)cc1 ZINC000374358201 512788208 /nfs/dbraw/zinc/78/82/08/512788208.db2.gz BLBMHBNMLRETHB-SFHVURJKSA-N 1 1 354.410 2.526 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376395928 512799646 /nfs/dbraw/zinc/79/96/46/512799646.db2.gz NJEKTGNNJVTVPD-LLVKDONJSA-N 1 1 358.427 2.792 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4ccncn4)CC3)n2)c1 ZINC000411827803 512834082 /nfs/dbraw/zinc/83/40/82/512834082.db2.gz JPIZGMHALUZTEQ-UHFFFAOYSA-N 1 1 366.381 2.814 20 5 FFBDMO CCc1nn(C)c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000381013579 512874053 /nfs/dbraw/zinc/87/40/53/512874053.db2.gz PYPMNWCQMZQPGN-DLBZAZTESA-N 1 1 369.469 2.849 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949955 512885720 /nfs/dbraw/zinc/88/57/20/512885720.db2.gz QSXAMSSDQKCRDS-ZWKOTPCHSA-N 1 1 356.378 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949955 512885725 /nfs/dbraw/zinc/88/57/25/512885725.db2.gz QSXAMSSDQKCRDS-ZWKOTPCHSA-N 1 1 356.378 2.769 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c1 ZINC000411979306 512899153 /nfs/dbraw/zinc/89/91/53/512899153.db2.gz CWQQAUXEAIFCSC-PXNSSMCTSA-N 1 1 372.421 2.878 20 5 FFBDMO C[C@@]1(CNC(=O)c2cccc([N+](=O)[O-])c2N)CCC[N@H+]1Cc1ccccc1 ZINC000397919617 512950859 /nfs/dbraw/zinc/95/08/59/512950859.db2.gz PCRURJYWWQGKBI-FQEVSTJZSA-N 1 1 368.437 2.962 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])c2cnccc21)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372605514 512966265 /nfs/dbraw/zinc/96/62/65/512966265.db2.gz ICKJFMIJTMAJIZ-MRXNPFEDSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000408012166 512983756 /nfs/dbraw/zinc/98/37/56/512983756.db2.gz BEYJMFWZEWDSFD-MBNYWOFBSA-N 1 1 364.421 2.794 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086825 512995236 /nfs/dbraw/zinc/99/52/36/512995236.db2.gz LVYSHOUMLWQLML-BZUAXINKSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086825 512995239 /nfs/dbraw/zinc/99/52/39/512995239.db2.gz LVYSHOUMLWQLML-BZUAXINKSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000372769184 513036030 /nfs/dbraw/zinc/03/60/30/513036030.db2.gz WJDQRRBRQQPOCD-QWHCGFSZSA-N 1 1 357.332 2.970 20 5 FFBDMO Cc1c(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000368700368 513067013 /nfs/dbraw/zinc/06/70/13/513067013.db2.gz RPJKYYSPERJDOR-UHFFFAOYSA-N 1 1 362.386 2.512 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000368845887 513120157 /nfs/dbraw/zinc/12/01/57/513120157.db2.gz PWWIVVKFUFCBAC-MRXNPFEDSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](OCc2c(C)noc2C)C1 ZINC000368845887 513120159 /nfs/dbraw/zinc/12/01/59/513120159.db2.gz PWWIVVKFUFCBAC-MRXNPFEDSA-N 1 1 361.398 2.999 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1nccc2c1cccc2[N+](=O)[O-] ZINC000450409312 513181830 /nfs/dbraw/zinc/18/18/30/513181830.db2.gz UJCMRZQMDMXWLL-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000428802416 513195559 /nfs/dbraw/zinc/19/55/59/513195559.db2.gz JJVSLDQKQIBDKN-FQEVSTJZSA-N 1 1 370.405 2.790 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007860 513250397 /nfs/dbraw/zinc/25/03/97/513250397.db2.gz WLHRVSOBMCJBBC-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@H]1N1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007860 513250402 /nfs/dbraw/zinc/25/04/02/513250402.db2.gz WLHRVSOBMCJBBC-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@H]1N1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007860 513250407 /nfs/dbraw/zinc/25/04/07/513250407.db2.gz WLHRVSOBMCJBBC-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429023177 513260253 /nfs/dbraw/zinc/26/02/53/513260253.db2.gz DOXPTPZECWZEIZ-BASYENTBSA-N 1 1 360.458 2.584 20 5 FFBDMO COc1ccccc1CCNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429239243 513312798 /nfs/dbraw/zinc/31/27/98/513312798.db2.gz PWSKGHGCXCTZOG-UHFFFAOYSA-N 1 1 371.437 2.787 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425060388 513396778 /nfs/dbraw/zinc/39/67/78/513396778.db2.gz VHRGNEWVMWILRQ-SWLSCSKDSA-N 1 1 367.833 2.570 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])c4ncccc43)CC2)CCO1 ZINC000413074378 513425897 /nfs/dbraw/zinc/42/58/97/513425897.db2.gz JABCPBQOYSMABG-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c(C(F)(F)F)c1 ZINC000413146625 513481684 /nfs/dbraw/zinc/48/16/84/513481684.db2.gz XNHFPADPFCQFBP-LBPRGKRZSA-N 1 1 374.363 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441191479 513507899 /nfs/dbraw/zinc/50/78/99/513507899.db2.gz BXIZPRVYZKVHGP-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000441241246 513519188 /nfs/dbraw/zinc/51/91/88/513519188.db2.gz SEVWBJZAGDCATF-UONOGXRCSA-N 1 1 366.849 2.759 20 5 FFBDMO C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CCN(C)CC1 ZINC000413219383 513527171 /nfs/dbraw/zinc/52/71/71/513527171.db2.gz MJEKWXZPVSRUAK-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCN(C)CC1 ZINC000413219383 513527176 /nfs/dbraw/zinc/52/71/76/513527176.db2.gz MJEKWXZPVSRUAK-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425390976 513540132 /nfs/dbraw/zinc/54/01/32/513540132.db2.gz CRYBDJPVUPOBIV-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425390976 513540140 /nfs/dbraw/zinc/54/01/40/513540140.db2.gz CRYBDJPVUPOBIV-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c(F)c1 ZINC000413256552 513550536 /nfs/dbraw/zinc/55/05/36/513550536.db2.gz CPANEVJDUYUOSJ-MRXNPFEDSA-N 1 1 360.389 2.832 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425420514 513555034 /nfs/dbraw/zinc/55/50/34/513555034.db2.gz MQDSDBQEBRGTQA-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+](CCOc2ccccc2)CC1 ZINC000430212674 513589314 /nfs/dbraw/zinc/58/93/14/513589314.db2.gz PFKJDSGMVYTWMJ-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)s1)c1ccc([N+](=O)[O-])cc1 ZINC000425484086 513591937 /nfs/dbraw/zinc/59/19/37/513591937.db2.gz RXLMRBYDJFNPOS-NSHDSACASA-N 1 1 369.468 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](n4ccnn4)C3)co2)cc1 ZINC000425506466 513607867 /nfs/dbraw/zinc/60/78/67/513607867.db2.gz LKQWLJJWCZNRJK-MRXNPFEDSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](n4ccnn4)C3)co2)cc1 ZINC000425506466 513607875 /nfs/dbraw/zinc/60/78/75/513607875.db2.gz LKQWLJJWCZNRJK-MRXNPFEDSA-N 1 1 354.370 2.678 20 5 FFBDMO C[N@@H+](CCCCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-])C1CC1 ZINC000413351168 513608681 /nfs/dbraw/zinc/60/86/81/513608681.db2.gz YZPSFMXVKSHWBG-UHFFFAOYSA-N 1 1 362.474 2.713 20 5 FFBDMO O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000435628577 513643798 /nfs/dbraw/zinc/64/37/98/513643798.db2.gz VEYSNTCPJZMRMN-HNNXBMFYSA-N 1 1 367.471 2.670 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@H]1[C@@H]1CCCOC1 ZINC000451295496 513658847 /nfs/dbraw/zinc/65/88/47/513658847.db2.gz DNSUSYFKQVRWJG-OLMNPRSZSA-N 1 1 364.442 2.744 20 5 FFBDMO CCCN(CCC[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000451298434 513661171 /nfs/dbraw/zinc/66/11/71/513661171.db2.gz ISNZNUVSYKMLFD-UHFFFAOYSA-N 1 1 359.430 2.789 20 5 FFBDMO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000430765502 513742419 /nfs/dbraw/zinc/74/24/19/513742419.db2.gz RPTQJMMEOGLGBE-IBGZPJMESA-N 1 1 373.409 2.821 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431039546 513811205 /nfs/dbraw/zinc/81/12/05/513811205.db2.gz XNHJQOGRRYNPAG-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@@H](O)COCc3ccco3)C2)cc1 ZINC000451543137 513821963 /nfs/dbraw/zinc/82/19/63/513821963.db2.gz AZHMUNSRNNWGQS-FUHWJXTLSA-N 1 1 360.410 2.945 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@H](O)COCC(F)(F)F)C2)cc1 ZINC000451554156 513830172 /nfs/dbraw/zinc/83/01/72/513830172.db2.gz ZKCUFNCSFVKVHZ-ZFWWWQNUSA-N 1 1 362.348 2.714 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000413843428 513843944 /nfs/dbraw/zinc/84/39/44/513843944.db2.gz JJFZMABOMKXLLS-OTWHNJEPSA-N 1 1 351.406 2.871 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCCC[C@@H]1C ZINC000448699169 513852326 /nfs/dbraw/zinc/85/23/26/513852326.db2.gz SMHIYWVZXWZRMW-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448703568 513854317 /nfs/dbraw/zinc/85/43/17/513854317.db2.gz BYEXIWITJSVDGP-HUUCEWRRSA-N 1 1 361.442 2.794 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000448823615 513916585 /nfs/dbraw/zinc/91/65/85/513916585.db2.gz OYCLVNWPCCKFBL-GFCCVEGCSA-N 1 1 353.394 2.593 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](CO)CC(C)(C)C ZINC000451777223 513974697 /nfs/dbraw/zinc/97/46/97/513974697.db2.gz HZSFWSGFOLRYJG-HNNXBMFYSA-N 1 1 351.447 2.961 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000426890014 514067670 /nfs/dbraw/zinc/06/76/70/514067670.db2.gz PSDAEPJUCXOCGR-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO O=C(NCC[NH+]1CCC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426977157 514084201 /nfs/dbraw/zinc/08/42/01/514084201.db2.gz IPFLOWQCNRGEIW-UHFFFAOYSA-N 1 1 355.394 2.609 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000444025921 514101817 /nfs/dbraw/zinc/10/18/17/514101817.db2.gz RVNOJVDCUXYVGB-OLZOCXBDSA-N 1 1 350.419 2.940 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444031721 514103901 /nfs/dbraw/zinc/10/39/01/514103901.db2.gz NOICJQVOWOAKOM-UHFFFAOYSA-N 1 1 359.376 2.641 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444035231 514106048 /nfs/dbraw/zinc/10/60/48/514106048.db2.gz JBSDIZJFLNUTFU-LBPRGKRZSA-N 1 1 371.387 2.784 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000432197218 514123165 /nfs/dbraw/zinc/12/31/65/514123165.db2.gz WUGCKPYXLHYLQJ-YLJYHZDGSA-N 1 1 369.421 2.844 20 5 FFBDMO CCS(=O)(=O)CCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000414548989 514174257 /nfs/dbraw/zinc/17/42/57/514174257.db2.gz ZFLWQVBFJZHKBP-UHFFFAOYSA-N 1 1 369.468 2.633 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414554337 514177291 /nfs/dbraw/zinc/17/72/91/514177291.db2.gz GWHSLUBYCJOHEN-MRXNPFEDSA-N 1 1 358.341 2.971 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414554337 514177296 /nfs/dbraw/zinc/17/72/96/514177296.db2.gz GWHSLUBYCJOHEN-MRXNPFEDSA-N 1 1 358.341 2.971 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420581457 514190249 /nfs/dbraw/zinc/19/02/49/514190249.db2.gz GZLHVIRLYSEKAS-HIFRSBDPSA-N 1 1 354.410 2.941 20 5 FFBDMO C[C@@]1(F)C[NH2+]CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000423692357 514202073 /nfs/dbraw/zinc/20/20/73/514202073.db2.gz QHNJPJQKHQTKKH-CQSZACIVSA-N 1 1 361.826 2.500 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000452121719 514205930 /nfs/dbraw/zinc/20/59/30/514205930.db2.gz KUQPZBSSNPROOY-TYNCELHUSA-N 1 1 365.405 2.545 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000420628464 514207030 /nfs/dbraw/zinc/20/70/30/514207030.db2.gz PGUJRUMPGZJCQZ-UHFFFAOYSA-N 1 1 367.881 2.640 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000420628464 514207035 /nfs/dbraw/zinc/20/70/35/514207035.db2.gz PGUJRUMPGZJCQZ-UHFFFAOYSA-N 1 1 367.881 2.640 20 5 FFBDMO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449460448 514218392 /nfs/dbraw/zinc/21/83/92/514218392.db2.gz ZBDJNDZMFDMVBG-IBGZPJMESA-N 1 1 374.393 2.866 20 5 FFBDMO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ncc(Br)cn1 ZINC000432981368 514341237 /nfs/dbraw/zinc/34/12/37/514341237.db2.gz CDLBKKRBRSQBCN-SNVBAGLBSA-N 1 1 367.203 2.877 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)c1 ZINC000438828969 514449781 /nfs/dbraw/zinc/44/97/81/514449781.db2.gz IYRUCDATLQAQLF-FQEVSTJZSA-N 1 1 366.421 2.970 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000428489110 514484023 /nfs/dbraw/zinc/48/40/23/514484023.db2.gz WJEVSIWTMMXQBD-DXTPNHAXSA-N 1 1 357.332 2.608 20 5 FFBDMO NC(=O)c1cccc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000439099539 514493075 /nfs/dbraw/zinc/49/30/75/514493075.db2.gz KEGMIAXKFIRPSH-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@]1([NH+]2CCOCC2)CCSC1 ZINC000450270039 514574049 /nfs/dbraw/zinc/57/40/49/514574049.db2.gz PWJRHEJKYSYACU-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000470693025 514577655 /nfs/dbraw/zinc/57/76/55/514577655.db2.gz JOPHYEAOMPPZPI-MRXNPFEDSA-N 1 1 360.458 2.798 20 5 FFBDMO Cn1c(C(=O)N2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000461434743 514617013 /nfs/dbraw/zinc/61/70/13/514617013.db2.gz ZCIHLPUNTABPJA-IAGOWNOFSA-N 1 1 368.437 2.527 20 5 FFBDMO CNc1nc(C(=O)NCc2cccc(C[N@@H+](C)C(C)C)c2)ccc1[N+](=O)[O-] ZINC000455601935 514623955 /nfs/dbraw/zinc/62/39/55/514623955.db2.gz YRKGUWBMZVOQOT-UHFFFAOYSA-N 1 1 371.441 2.802 20 5 FFBDMO CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475423152 514656414 /nfs/dbraw/zinc/65/64/14/514656414.db2.gz QIZCPRUNFDAFJS-QGZVFWFLSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000508325130 514742783 /nfs/dbraw/zinc/74/27/83/514742783.db2.gz LRWSJRJSWLXWFO-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000502713328 514749950 /nfs/dbraw/zinc/74/99/50/514749950.db2.gz WFPMSVSATRXKMV-HNNXBMFYSA-N 1 1 369.487 2.836 20 5 FFBDMO Cc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cn2cc[nH+]c12 ZINC000502747353 514760464 /nfs/dbraw/zinc/76/04/64/514760464.db2.gz DZXJFOHVLVAVGF-UHFFFAOYSA-N 1 1 362.349 2.989 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@]2(CO)CC(C)C)c([N+](=O)[O-])c1 ZINC000475714857 514774035 /nfs/dbraw/zinc/77/40/35/514774035.db2.gz LBPDDTLRJVFTKJ-SFHVURJKSA-N 1 1 352.431 2.855 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502893769 514831873 /nfs/dbraw/zinc/83/18/73/514831873.db2.gz IVECDHZGRCFBPK-HNNXBMFYSA-N 1 1 359.430 2.921 20 5 FFBDMO COCC[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000489414757 514836946 /nfs/dbraw/zinc/83/69/46/514836946.db2.gz OWDXNFBBLBSYDX-UHFFFAOYSA-N 1 1 351.428 2.887 20 5 FFBDMO COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1scnc1C ZINC000489414757 514836955 /nfs/dbraw/zinc/83/69/55/514836955.db2.gz OWDXNFBBLBSYDX-UHFFFAOYSA-N 1 1 351.428 2.887 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502917952 514842073 /nfs/dbraw/zinc/84/20/73/514842073.db2.gz GFOXASMKLNUHIZ-HNNXBMFYSA-N 1 1 359.430 2.921 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000498316825 514857649 /nfs/dbraw/zinc/85/76/49/514857649.db2.gz JQPNYZQNDKZWFO-OAHLLOKOSA-N 1 1 368.437 2.947 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc([N+](=O)[O-])nn3C)cc2)C1 ZINC000476076466 514908749 /nfs/dbraw/zinc/90/87/49/514908749.db2.gz VTXBQERAQOMATM-CYBMUJFWSA-N 1 1 357.414 2.813 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498498784 514932574 /nfs/dbraw/zinc/93/25/74/514932574.db2.gz ZPWZEOFTAVKBGD-MRXNPFEDSA-N 1 1 368.865 2.772 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000467214557 514942832 /nfs/dbraw/zinc/94/28/32/514942832.db2.gz CXSLRMOWDWETAC-ZUZCIYMTSA-N 1 1 352.822 2.530 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@@H](C[N@@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000503194243 514952403 /nfs/dbraw/zinc/95/24/03/514952403.db2.gz WBNADXRVWHURFX-SFHVURJKSA-N 1 1 371.485 2.891 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@@H](C[N@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000503194243 514952410 /nfs/dbraw/zinc/95/24/10/514952410.db2.gz WBNADXRVWHURFX-SFHVURJKSA-N 1 1 371.485 2.891 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000498566547 514972174 /nfs/dbraw/zinc/97/21/74/514972174.db2.gz LIQZVJFBCGBESP-AGIUHOORSA-N 1 1 369.849 2.957 20 5 FFBDMO C[N@@H+](CCOc1ccc(Br)cc1)CCn1cc([N+](=O)[O-])cn1 ZINC000471701786 514985712 /nfs/dbraw/zinc/98/57/12/514985712.db2.gz QUWYWCKIRLZNMU-UHFFFAOYSA-N 1 1 369.219 2.565 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000476352246 515014093 /nfs/dbraw/zinc/01/40/93/515014093.db2.gz GJLBYZCYMQWTQE-UHFFFAOYSA-N 1 1 368.397 2.949 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000498723814 515040703 /nfs/dbraw/zinc/04/07/03/515040703.db2.gz YXRXFWWKVGBSNX-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000480699815 515048501 /nfs/dbraw/zinc/04/85/01/515048501.db2.gz PJLIRYHJBRACAJ-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO CCOC(=O)c1cc(NC[C@@H]2C[N@@H+](CC(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000467735029 515097510 /nfs/dbraw/zinc/09/75/10/515097510.db2.gz VZDFOWYXONWYTO-OAHLLOKOSA-N 1 1 365.430 2.540 20 5 FFBDMO CCOC(=O)c1cc(NC[C@H]2C[N@@H+](CC(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000467735028 515098230 /nfs/dbraw/zinc/09/82/30/515098230.db2.gz VZDFOWYXONWYTO-HNNXBMFYSA-N 1 1 365.430 2.540 20 5 FFBDMO COc1cc(C[N@@H+](CCO)CC2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000485727963 515161234 /nfs/dbraw/zinc/16/12/34/515161234.db2.gz YHOLAHONODLCGN-UHFFFAOYSA-N 1 1 352.431 2.987 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000509431006 515174774 /nfs/dbraw/zinc/17/47/74/515174774.db2.gz RXETYAKWURYSMW-UHFFFAOYSA-N 1 1 367.409 2.998 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000462912268 515295856 /nfs/dbraw/zinc/29/58/56/515295856.db2.gz MYCVOLGXJVDOIR-HNNXBMFYSA-N 1 1 358.398 2.796 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463135233 515379413 /nfs/dbraw/zinc/37/94/13/515379413.db2.gz WBYQMCCWWMJFQQ-NEPJUHHUSA-N 1 1 357.332 2.970 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491152180 515386341 /nfs/dbraw/zinc/38/63/41/515386341.db2.gz YWFNRJFEOIURCU-GFCCVEGCSA-N 1 1 373.400 2.773 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486235948 515392632 /nfs/dbraw/zinc/39/26/32/515392632.db2.gz SEFJQGQUCHJCNW-TXEJJXNPSA-N 1 1 355.385 2.795 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000491322047 515413361 /nfs/dbraw/zinc/41/33/61/515413361.db2.gz KHODGBBNKRQASE-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])n2C)C[N@H+]1Cc1ccccc1 ZINC000510150548 515451416 /nfs/dbraw/zinc/45/14/16/515451416.db2.gz WMKVEKYAKKDKMB-RDJZCZTQSA-N 1 1 370.453 2.964 20 5 FFBDMO CC[N@@H+](CCNc1ccc(C(=O)NC)cc1[N+](=O)[O-])CCC(F)(F)F ZINC000491581336 515454810 /nfs/dbraw/zinc/45/48/10/515454810.db2.gz LKXFXDOTKAHIBM-UHFFFAOYSA-N 1 1 362.352 2.641 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](CCOc3ccccc3)CC2)c(F)c1 ZINC000491954609 515485496 /nfs/dbraw/zinc/48/54/96/515485496.db2.gz FKMFAPWDSWNNBK-UHFFFAOYSA-N 1 1 359.401 2.931 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000499894514 515496387 /nfs/dbraw/zinc/49/63/87/515496387.db2.gz LXMYRYLMEZCUBE-UHFFFAOYSA-N 1 1 357.332 2.995 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456990275 515568336 /nfs/dbraw/zinc/56/83/36/515568336.db2.gz LTSAAARFLOLXLH-KRWDZBQOSA-N 1 1 359.813 2.964 20 5 FFBDMO O=C(CCC(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000457021557 515589652 /nfs/dbraw/zinc/58/96/52/515589652.db2.gz MQXJDYZUNQOLLM-GOSISDBHSA-N 1 1 367.405 2.731 20 5 FFBDMO CCc1ccc(C[N@H+](C)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000500304554 515662089 /nfs/dbraw/zinc/66/20/89/515662089.db2.gz QJLJIJCASZOCAY-SFHVURJKSA-N 1 1 367.405 2.921 20 5 FFBDMO CCc1ccc(C[N@@H+](C)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000500304554 515662097 /nfs/dbraw/zinc/66/20/97/515662097.db2.gz QJLJIJCASZOCAY-SFHVURJKSA-N 1 1 367.405 2.921 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](COc3ccccc3)C2)c1 ZINC000505861691 515699710 /nfs/dbraw/zinc/69/97/10/515699710.db2.gz FIXCDQCAKZAZGB-WMZOPIPTSA-N 1 1 372.421 2.735 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000486962633 515700843 /nfs/dbraw/zinc/70/08/43/515700843.db2.gz GTHQIDKWQARGOS-HUUCEWRRSA-N 1 1 366.849 2.717 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486969532 515702611 /nfs/dbraw/zinc/70/26/11/515702611.db2.gz HSCOPJGGULXKIM-LBPRGKRZSA-N 1 1 356.854 2.820 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000493998982 515709718 /nfs/dbraw/zinc/70/97/18/515709718.db2.gz GWLRKXLMLPSGNS-UGSOOPFHSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000493998982 515709723 /nfs/dbraw/zinc/70/97/23/515709723.db2.gz GWLRKXLMLPSGNS-UGSOOPFHSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494040591 515718709 /nfs/dbraw/zinc/71/87/09/515718709.db2.gz YDJCFHMSDKABAH-KXBFYZLASA-N 1 1 369.421 2.753 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@](O)(CO)C2)cc1[N+](=O)[O-] ZINC000459704673 515756672 /nfs/dbraw/zinc/75/66/72/515756672.db2.gz HSQOYIGWTODPBL-HXUWFJFHSA-N 1 1 371.437 2.682 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511105682 515782524 /nfs/dbraw/zinc/78/25/24/515782524.db2.gz JTYRRNPJSYOLGX-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511105682 515782532 /nfs/dbraw/zinc/78/25/32/515782532.db2.gz JTYRRNPJSYOLGX-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459802940 515816795 /nfs/dbraw/zinc/81/67/95/515816795.db2.gz NFGCFRJBYHZJIS-DOPJRALCSA-N 1 1 361.442 2.795 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cnccc1C ZINC000483010448 515881147 /nfs/dbraw/zinc/88/11/47/515881147.db2.gz BMGFMBAQSJXOHO-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000487838945 516000096 /nfs/dbraw/zinc/00/00/96/516000096.db2.gz OGNRVOFGNIAEHK-FZMZJTMJSA-N 1 1 354.838 2.573 20 5 FFBDMO CNc1nc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000455215793 516045936 /nfs/dbraw/zinc/04/59/36/516045936.db2.gz WGIWGPBHEUJMQR-MJBXVCDLSA-N 1 1 361.446 2.509 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000460223620 516075238 /nfs/dbraw/zinc/07/52/38/516075238.db2.gz YRGVNUUEDOYSNC-UHFFFAOYSA-N 1 1 358.442 2.921 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2c3ccccc3ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000488112778 516120855 /nfs/dbraw/zinc/12/08/55/516120855.db2.gz IJXLEUAWJUFKJQ-GASCZTMLSA-N 1 1 358.442 2.866 20 5 FFBDMO O=C(NCC[NH+]1CCC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000495446830 516165492 /nfs/dbraw/zinc/16/54/92/516165492.db2.gz CDNTVOQERYQLLN-UHFFFAOYSA-N 1 1 354.410 2.642 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000460493324 516169748 /nfs/dbraw/zinc/16/97/48/516169748.db2.gz RQOCMJGTNVNQMY-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@H]1C ZINC000495473971 516175367 /nfs/dbraw/zinc/17/53/67/516175367.db2.gz KSTISRNWMBNZTH-CABCVRRESA-N 1 1 371.441 2.725 20 5 FFBDMO COc1c(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000474777980 516192619 /nfs/dbraw/zinc/19/26/19/516192619.db2.gz YJOXUTMQZHEPFS-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000488383471 516210026 /nfs/dbraw/zinc/21/00/26/516210026.db2.gz KNFUWARYXGUCJV-QWHCGFSZSA-N 1 1 368.865 2.915 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CCc3[nH+]c[nH]c3C2)ncc1[N+](=O)[O-] ZINC000517449687 516330635 /nfs/dbraw/zinc/33/06/35/516330635.db2.gz XHAXJCDAXXWHBG-MRVPVSSYSA-N 1 1 352.192 2.753 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CCc3[nH]c[nH+]c3C2)ncc1[N+](=O)[O-] ZINC000517449687 516330640 /nfs/dbraw/zinc/33/06/40/516330640.db2.gz XHAXJCDAXXWHBG-MRVPVSSYSA-N 1 1 352.192 2.753 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000531255473 516377034 /nfs/dbraw/zinc/37/70/34/516377034.db2.gz GUVJCXBVWPEVMK-LBPRGKRZSA-N 1 1 353.382 2.918 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)s1 ZINC000523088374 516385276 /nfs/dbraw/zinc/38/52/76/516385276.db2.gz DPWAECXQOFEIRC-UHFFFAOYSA-N 1 1 374.466 2.640 20 5 FFBDMO Cn1c(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572613 516404872 /nfs/dbraw/zinc/40/48/72/516404872.db2.gz IEGPBFWAANQUCS-CJNGLKHVSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572613 516404877 /nfs/dbraw/zinc/40/48/77/516404877.db2.gz IEGPBFWAANQUCS-CJNGLKHVSA-N 1 1 362.817 2.762 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000561259719 516482933 /nfs/dbraw/zinc/48/29/33/516482933.db2.gz TXRIGUJDQLEFSF-UHFFFAOYSA-N 1 1 370.409 2.720 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000540428859 516552220 /nfs/dbraw/zinc/55/22/20/516552220.db2.gz ANNDVZPMCLZIEO-UHFFFAOYSA-N 1 1 369.377 2.849 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccc(NCc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000558064411 516577171 /nfs/dbraw/zinc/57/71/71/516577171.db2.gz PYXLBSKLTJDWLL-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000531726402 516612518 /nfs/dbraw/zinc/61/25/18/516612518.db2.gz QXBLBLBBSCTOIQ-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO C[C@H]1CC[N@@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140109 516647389 /nfs/dbraw/zinc/64/73/89/516647389.db2.gz LAXFBSLUEBHELQ-BBRMVZONSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140109 516647397 /nfs/dbraw/zinc/64/73/97/516647397.db2.gz LAXFBSLUEBHELQ-BBRMVZONSA-N 1 1 357.410 2.739 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554848177 516663025 /nfs/dbraw/zinc/66/30/25/516663025.db2.gz IWMPJQIUBRPEFR-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554848177 516663038 /nfs/dbraw/zinc/66/30/38/516663038.db2.gz IWMPJQIUBRPEFR-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551402252 516694432 /nfs/dbraw/zinc/69/44/32/516694432.db2.gz ZZGNKEGQHUJOKN-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551402252 516694437 /nfs/dbraw/zinc/69/44/37/516694437.db2.gz ZZGNKEGQHUJOKN-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551402252 516694446 /nfs/dbraw/zinc/69/44/46/516694446.db2.gz ZZGNKEGQHUJOKN-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000551424830 516703361 /nfs/dbraw/zinc/70/33/61/516703361.db2.gz PGNMJRXIAKMSCK-HNNXBMFYSA-N 1 1 373.413 2.526 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCCc3occc3C2)cc1[N+](=O)[O-] ZINC000558427769 516736156 /nfs/dbraw/zinc/73/61/56/516736156.db2.gz VYPMQESSARBRDA-UHFFFAOYSA-N 1 1 360.366 2.688 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCCc3occc3C2)cc1[N+](=O)[O-] ZINC000558427769 516736166 /nfs/dbraw/zinc/73/61/66/516736166.db2.gz VYPMQESSARBRDA-UHFFFAOYSA-N 1 1 360.366 2.688 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000544393285 516739588 /nfs/dbraw/zinc/73/95/88/516739588.db2.gz FNFIUCLANFGYRZ-MWLCHTKSSA-N 1 1 357.252 2.837 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000518788643 516775918 /nfs/dbraw/zinc/77/59/18/516775918.db2.gz YHHHSZYSCATGAZ-ZDUSSCGKSA-N 1 1 363.414 2.565 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N[C@@H](C)C[NH+]2CCN(c3ccccn3)CC2)c1 ZINC000524688789 516789705 /nfs/dbraw/zinc/78/97/05/516789705.db2.gz SSKPAHGXYMFOTK-HNNXBMFYSA-N 1 1 371.441 2.621 20 5 FFBDMO COc1ccc(NC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000541100986 516876171 /nfs/dbraw/zinc/87/61/71/516876171.db2.gz LXFVLMXPECMTQV-QWHCGFSZSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000562049486 516895770 /nfs/dbraw/zinc/89/57/70/516895770.db2.gz JRXFCAWMVDKWLW-BZNIZROVSA-N 1 1 363.801 2.898 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514208513 516903222 /nfs/dbraw/zinc/90/32/22/516903222.db2.gz MSWZHLFAPCCUSS-GFCCVEGCSA-N 1 1 369.368 2.943 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212110 516904976 /nfs/dbraw/zinc/90/49/76/516904976.db2.gz BFVYBZUIPCHYJY-ZYHUDNBSSA-N 1 1 357.357 2.608 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000532398385 516953356 /nfs/dbraw/zinc/95/33/56/516953356.db2.gz OMJSCJYGEXYFKH-QWHZDKJVSA-N 1 1 368.437 2.876 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000562214790 516960975 /nfs/dbraw/zinc/96/09/75/516960975.db2.gz VEPWXUKCGRWVNA-HNNXBMFYSA-N 1 1 358.442 2.999 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)O1 ZINC000548508508 517024297 /nfs/dbraw/zinc/02/42/97/517024297.db2.gz JHNDNOVRXYFPCX-LZWOXQAQSA-N 1 1 373.457 2.545 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000525385268 517024987 /nfs/dbraw/zinc/02/49/87/517024987.db2.gz SLPUPTWZJHSQSH-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO C[N@H+](CCc1ccccc1O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000541391635 517027312 /nfs/dbraw/zinc/02/73/12/517027312.db2.gz VOQPVSOGBJKWLO-QGZVFWFLSA-N 1 1 355.394 2.580 20 5 FFBDMO C[N@@H+](CCc1ccccc1O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000541391635 517027319 /nfs/dbraw/zinc/02/73/19/517027319.db2.gz VOQPVSOGBJKWLO-QGZVFWFLSA-N 1 1 355.394 2.580 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000541525053 517094862 /nfs/dbraw/zinc/09/48/62/517094862.db2.gz WEWAJIPSKXKSAW-DZGCQCFKSA-N 1 1 364.446 2.618 20 5 FFBDMO COc1cc(C)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1 ZINC000541927963 517296980 /nfs/dbraw/zinc/29/69/80/517296980.db2.gz RKOLKZRJJPPAQB-CQSZACIVSA-N 1 1 357.414 2.697 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COc1cccc2[nH]ccc21 ZINC000548934231 517312589 /nfs/dbraw/zinc/31/25/89/517312589.db2.gz XFPXIEAISVUTKJ-KRWDZBQOSA-N 1 1 369.421 2.990 20 5 FFBDMO CCc1ccc([C@H](CO)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000541983497 517321198 /nfs/dbraw/zinc/32/11/98/517321198.db2.gz GSGKTIJIKNVVMK-INIZCTEOSA-N 1 1 357.410 2.727 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H]1C ZINC000520274586 517327260 /nfs/dbraw/zinc/32/72/60/517327260.db2.gz MRKPMEXVRJFTEY-RDTXWAMCSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CC[C@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1 ZINC000545762748 517358880 /nfs/dbraw/zinc/35/88/80/517358880.db2.gz PYIWRHFHAQMJOL-JTQLQIEISA-N 1 1 367.203 2.750 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+](Cc1cccnc1)C1CC1 ZINC000537861044 517383953 /nfs/dbraw/zinc/38/39/53/517383953.db2.gz ZMJSMDRRNWODMJ-UHFFFAOYSA-N 1 1 368.393 2.952 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C[C@@H](C)OC)C(C)C)c([N+](=O)[O-])c1 ZINC000533429479 517457906 /nfs/dbraw/zinc/45/79/06/517457906.db2.gz CAQIRLYOFSYEBJ-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO CCOc1cccc(N2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000520744367 517498833 /nfs/dbraw/zinc/49/88/33/517498833.db2.gz AXSDKYOUKFNLRM-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[NH+](CC2CC2)CC1 ZINC000549511642 517595662 /nfs/dbraw/zinc/59/56/62/517595662.db2.gz XOTUHNFUBPFXLN-UHFFFAOYSA-N 1 1 357.332 2.781 20 5 FFBDMO CCc1cc(N[C@H]2CCc3[nH+]c[nH]c3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549519925 517598726 /nfs/dbraw/zinc/59/87/26/517598726.db2.gz DWUNMYIUABCNNO-AWEZNQCLSA-N 1 1 364.409 2.729 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1 ZINC000538421470 517613257 /nfs/dbraw/zinc/61/32/57/517613257.db2.gz IQEQRLQTJIZTMW-QGZVFWFLSA-N 1 1 369.421 2.975 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c1 ZINC000538421470 517613270 /nfs/dbraw/zinc/61/32/70/517613270.db2.gz IQEQRLQTJIZTMW-QGZVFWFLSA-N 1 1 369.421 2.975 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000560169096 517617248 /nfs/dbraw/zinc/61/72/48/517617248.db2.gz YKMFBWYPFPABGK-IBGZPJMESA-N 1 1 355.438 2.962 20 5 FFBDMO Cc1c(Br)c(N2CC[C@]3(C2)CCC[N@H+](C)C3)ncc1[N+](=O)[O-] ZINC000549576843 517624943 /nfs/dbraw/zinc/62/49/43/517624943.db2.gz DCFHCFRBFQCFQP-OAHLLOKOSA-N 1 1 369.263 2.983 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+][C@@H]2CSc3ccccc32)cc1 ZINC000516268487 517644345 /nfs/dbraw/zinc/64/43/45/517644345.db2.gz FEUYGQPSIDALPP-OAHLLOKOSA-N 1 1 364.448 2.805 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000560275426 517672636 /nfs/dbraw/zinc/67/26/36/517672636.db2.gz VBBOPQKRCZQAKQ-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000546540142 517715991 /nfs/dbraw/zinc/71/59/91/517715991.db2.gz SRKHJYDXAPSIHT-STQMWFEESA-N 1 1 351.422 2.953 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)c1 ZINC000553506086 517753609 /nfs/dbraw/zinc/75/36/09/517753609.db2.gz ACINJJUTQOEVLC-UHFFFAOYSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556934967 517759699 /nfs/dbraw/zinc/75/96/99/517759699.db2.gz ZIHKRKPWKGKXAF-IBGZPJMESA-N 1 1 353.422 2.836 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556934967 517759711 /nfs/dbraw/zinc/75/97/11/517759711.db2.gz ZIHKRKPWKGKXAF-IBGZPJMESA-N 1 1 353.422 2.836 20 5 FFBDMO COc1cc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000538749777 517762063 /nfs/dbraw/zinc/76/20/63/517762063.db2.gz GBGFXWLJHBIFHZ-OAHLLOKOSA-N 1 1 363.458 2.776 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000538918885 517843643 /nfs/dbraw/zinc/84/36/43/517843643.db2.gz PGYLAPLFCQZXKP-UTUOFQBUSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C ZINC000538918885 517843655 /nfs/dbraw/zinc/84/36/55/517843655.db2.gz PGYLAPLFCQZXKP-UTUOFQBUSA-N 1 1 355.822 2.567 20 5 FFBDMO CCOc1cc(N2CC[C@H]([NH+]3CCN(C(C)C)CC3)C2)ccc1[N+](=O)[O-] ZINC000538937459 517852706 /nfs/dbraw/zinc/85/27/06/517852706.db2.gz IQFLLROWCMTRFT-KRWDZBQOSA-N 1 1 362.474 2.598 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000517087426 518018269 /nfs/dbraw/zinc/01/82/69/518018269.db2.gz QETXPKMIUFXJHA-ZBFHGGJFSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284771 518058443 /nfs/dbraw/zinc/05/84/43/518058443.db2.gz JZQLXKJXMJJXNB-QGZVFWFLSA-N 1 1 365.817 2.664 20 5 FFBDMO CN1CC[C@@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284771 518058453 /nfs/dbraw/zinc/05/84/53/518058453.db2.gz JZQLXKJXMJJXNB-QGZVFWFLSA-N 1 1 365.817 2.664 20 5 FFBDMO CCC[C@H]1CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000563849085 518148572 /nfs/dbraw/zinc/14/85/72/518148572.db2.gz HPARUKZBKHDBRX-YJBOKZPZSA-N 1 1 363.458 2.658 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000564068062 518292655 /nfs/dbraw/zinc/29/26/55/518292655.db2.gz UEHOMKOGRGYVQJ-AWEZNQCLSA-N 1 1 373.457 2.792 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000584409116 518327093 /nfs/dbraw/zinc/32/70/93/518327093.db2.gz LYJSKNOPMKYMCL-GOEBONIOSA-N 1 1 350.415 2.873 20 5 FFBDMO C[NH+]1CCC(N2CCC(Nc3nc4c(cc3[N+](=O)[O-])CCCC4)CC2)CC1 ZINC000564206435 518350555 /nfs/dbraw/zinc/35/05/55/518350555.db2.gz WUHAPVGHLGFXHK-UHFFFAOYSA-N 1 1 373.501 2.839 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000567142060 518372981 /nfs/dbraw/zinc/37/29/81/518372981.db2.gz CPOXZWZYNLAHPE-PHIMTYICSA-N 1 1 357.357 2.751 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000581698622 518411663 /nfs/dbraw/zinc/41/16/63/518411663.db2.gz OHOFXFJYPVHVMB-ZDUSSCGKSA-N 1 1 367.409 2.502 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000564607401 518523147 /nfs/dbraw/zinc/52/31/47/518523147.db2.gz LLXDGBDWBDVREU-DOTOQJQBSA-N 1 1 360.385 2.963 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000564607402 518523360 /nfs/dbraw/zinc/52/33/60/518523360.db2.gz LLXDGBDWBDVREU-NVXWUHKLSA-N 1 1 360.385 2.963 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)s1 ZINC000582610871 518838592 /nfs/dbraw/zinc/83/85/92/518838592.db2.gz CRWISVFFFMYGGI-CYBMUJFWSA-N 1 1 362.455 2.887 20 5 FFBDMO Cc1ccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000577211050 518968043 /nfs/dbraw/zinc/96/80/43/518968043.db2.gz MNDRMOPLFHIJSI-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccc(O)cc3CC2)c1 ZINC000589497546 519018583 /nfs/dbraw/zinc/01/85/83/519018583.db2.gz JYZCJQQIHTUQMY-UHFFFAOYSA-N 1 1 356.378 2.688 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1 ZINC000589503486 519020082 /nfs/dbraw/zinc/02/00/82/519020082.db2.gz SGSKTFKGCKHWGV-CYBMUJFWSA-N 1 1 364.398 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c1 ZINC000589503486 519020088 /nfs/dbraw/zinc/02/00/88/519020088.db2.gz SGSKTFKGCKHWGV-CYBMUJFWSA-N 1 1 364.398 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3c[nH]nc3C)CC2)c1 ZINC000589518071 519023153 /nfs/dbraw/zinc/02/31/53/519023153.db2.gz UXTFOMIMQXNVJE-UHFFFAOYSA-N 1 1 358.398 2.793 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000577393788 519059557 /nfs/dbraw/zinc/05/95/57/519059557.db2.gz YXRDAJFAJPKORF-PKOBYXMFSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000577393788 519059569 /nfs/dbraw/zinc/05/95/69/519059569.db2.gz YXRDAJFAJPKORF-PKOBYXMFSA-N 1 1 360.385 2.905 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000590022597 519131418 /nfs/dbraw/zinc/13/14/18/519131418.db2.gz JQGAVMNDUCXALR-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)Nc2ccc([N+](=O)[O-])c(OC(C)C)n2)CC1 ZINC000583214476 519133075 /nfs/dbraw/zinc/13/30/75/519133075.db2.gz PYBAIWDQYAZAEF-UHFFFAOYSA-N 1 1 365.478 2.605 20 5 FFBDMO CNc1c(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000574471571 519170123 /nfs/dbraw/zinc/17/01/23/519170123.db2.gz KANIVYDSJVEGSF-MRXNPFEDSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1c(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000574471571 519170129 /nfs/dbraw/zinc/17/01/29/519170129.db2.gz KANIVYDSJVEGSF-MRXNPFEDSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1c(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000574471570 519170705 /nfs/dbraw/zinc/17/07/05/519170705.db2.gz KANIVYDSJVEGSF-INIZCTEOSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1c(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000574471570 519170712 /nfs/dbraw/zinc/17/07/12/519170712.db2.gz KANIVYDSJVEGSF-INIZCTEOSA-N 1 1 368.437 2.635 20 5 FFBDMO COc1cncc(/C=C/CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000571758728 519261603 /nfs/dbraw/zinc/26/16/03/519261603.db2.gz UJHZLZVTXFAKMK-WPTTZPOMSA-N 1 1 369.425 2.983 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000590582898 519273551 /nfs/dbraw/zinc/27/35/51/519273551.db2.gz WDWXPXBNLYVCQQ-GXFFZTMASA-N 1 1 353.806 2.565 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000568935199 519290857 /nfs/dbraw/zinc/29/08/57/519290857.db2.gz LSKXWICERRDFHY-LLVKDONJSA-N 1 1 357.357 2.909 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000580771127 519350902 /nfs/dbraw/zinc/35/09/02/519350902.db2.gz XDQOTUGJFYPYIL-HNNXBMFYSA-N 1 1 361.490 2.554 20 5 FFBDMO CO[C@H](CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000569249026 519454162 /nfs/dbraw/zinc/45/41/62/519454162.db2.gz FXGIAPOCGGPFBA-ZIAGYGMSSA-N 1 1 372.347 2.975 20 5 FFBDMO Cc1cc(CNC(=O)COc2cccc([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000575033875 519463640 /nfs/dbraw/zinc/46/36/40/519463640.db2.gz KKNIGJSPTJUIRZ-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000583943462 519510158 /nfs/dbraw/zinc/51/01/58/519510158.db2.gz KUSCCUBATFVPDL-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[NH2+]C3(CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591282628 519573333 /nfs/dbraw/zinc/57/33/33/519573333.db2.gz IASHVDHQGBVYSH-MRXNPFEDSA-N 1 1 355.442 2.760 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602856888 519929390 /nfs/dbraw/zinc/92/93/90/519929390.db2.gz STXWIYJJNHQBLB-IAGOWNOFSA-N 1 1 357.410 2.609 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+](C)Cc2ccns2)c([N+](=O)[O-])c1 ZINC000602881958 519946096 /nfs/dbraw/zinc/94/60/96/519946096.db2.gz IDGRKZAMQYMIEV-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccns2)c([N+](=O)[O-])c1 ZINC000602881958 519946107 /nfs/dbraw/zinc/94/61/07/519946107.db2.gz IDGRKZAMQYMIEV-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000594417292 519951931 /nfs/dbraw/zinc/95/19/31/519951931.db2.gz BKYCBSTXESAQEC-IAGOWNOFSA-N 1 1 370.409 2.595 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(c2ccc(F)cn2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000602902480 519961417 /nfs/dbraw/zinc/96/14/17/519961417.db2.gz CBBZHEMNQPLWSF-UHFFFAOYSA-N 1 1 372.400 2.971 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])CC1 ZINC000602953743 519991004 /nfs/dbraw/zinc/99/10/04/519991004.db2.gz CZAOTKHOSBZWQX-UHFFFAOYSA-N 1 1 363.462 2.696 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC000594483199 519991891 /nfs/dbraw/zinc/99/18/91/519991891.db2.gz CVLWAUGWVTYTPD-KGLIPLIRSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1C ZINC000594484041 519993288 /nfs/dbraw/zinc/99/32/88/519993288.db2.gz QERPHDQMDQERJK-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594484874 519994093 /nfs/dbraw/zinc/99/40/93/519994093.db2.gz WLDZUALZSZYCNI-QWHCGFSZSA-N 1 1 373.862 2.543 20 5 FFBDMO COC(=O)c1cc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000594592791 520042320 /nfs/dbraw/zinc/04/23/20/520042320.db2.gz XGNNIKSKPQBIJS-MCIONIFRSA-N 1 1 365.430 2.599 20 5 FFBDMO COC(=O)c1cc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000594592791 520042327 /nfs/dbraw/zinc/04/23/27/520042327.db2.gz XGNNIKSKPQBIJS-MCIONIFRSA-N 1 1 365.430 2.599 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C(C)(C)C ZINC000603140902 520102899 /nfs/dbraw/zinc/10/28/99/520102899.db2.gz CIYAQJHQBMUHBG-MRXNPFEDSA-N 1 1 372.425 2.651 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600182405 520106678 /nfs/dbraw/zinc/10/66/78/520106678.db2.gz BICPVEZLZLWWJH-TXEJJXNPSA-N 1 1 372.368 2.870 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600182405 520106684 /nfs/dbraw/zinc/10/66/84/520106684.db2.gz BICPVEZLZLWWJH-TXEJJXNPSA-N 1 1 372.368 2.870 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000608854649 520144992 /nfs/dbraw/zinc/14/49/92/520144992.db2.gz WDENLVFYQLHPSD-GFCCVEGCSA-N 1 1 363.414 2.564 20 5 FFBDMO O=[N+]([O-])c1cnccc1N1CC[NH+](CCOc2ccc(Cl)cc2)CC1 ZINC000608971997 520169719 /nfs/dbraw/zinc/16/97/19/520169719.db2.gz WYYPGIXAXQTLQO-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000600311846 520198438 /nfs/dbraw/zinc/19/84/38/520198438.db2.gz CLNSSABWPGQLCR-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCc3ccc(O)cc3CC2)c2c(c1)COCO2 ZINC000609133372 520200830 /nfs/dbraw/zinc/20/08/30/520200830.db2.gz SNUULQIIENOVHD-UHFFFAOYSA-N 1 1 356.378 2.768 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000592155285 520231791 /nfs/dbraw/zinc/23/17/91/520231791.db2.gz NLCYFXADZRJBTO-HNNXBMFYSA-N 1 1 357.385 2.872 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000592155285 520231797 /nfs/dbraw/zinc/23/17/97/520231797.db2.gz NLCYFXADZRJBTO-HNNXBMFYSA-N 1 1 357.385 2.872 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(=O)NCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000592155555 520232512 /nfs/dbraw/zinc/23/25/12/520232512.db2.gz OXJHBPKCCBQKQX-KRWDZBQOSA-N 1 1 369.421 2.742 20 5 FFBDMO COCC[N@@H+]1CCC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000609268921 520248966 /nfs/dbraw/zinc/24/89/66/520248966.db2.gz IPNBFCBCKZCTQT-ZDUSSCGKSA-N 1 1 363.439 2.650 20 5 FFBDMO COCC[N@H+]1CCC[C@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000609268921 520248973 /nfs/dbraw/zinc/24/89/73/520248973.db2.gz IPNBFCBCKZCTQT-ZDUSSCGKSA-N 1 1 363.439 2.650 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccnc1N1CCOCC1 ZINC000595005955 520253470 /nfs/dbraw/zinc/25/34/70/520253470.db2.gz CDBDJIIAOPVSBM-AWEZNQCLSA-N 1 1 372.425 2.686 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000600472238 520278576 /nfs/dbraw/zinc/27/85/76/520278576.db2.gz NJTCQVRCHYNDJU-SFHVURJKSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000597856802 520284235 /nfs/dbraw/zinc/28/42/35/520284235.db2.gz AJQKETSZHIJBRW-CYBMUJFWSA-N 1 1 372.425 2.511 20 5 FFBDMO COc1ccc(CC(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000609506092 520336546 /nfs/dbraw/zinc/33/65/46/520336546.db2.gz CHDQDYDJJSWXSD-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO O=C(C[N@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000603906197 520400433 /nfs/dbraw/zinc/40/04/33/520400433.db2.gz WPPXKJQHTKZOOF-IYBDPMFKSA-N 1 1 366.421 2.602 20 5 FFBDMO O=C(C[N@@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000603906197 520400442 /nfs/dbraw/zinc/40/04/42/520400442.db2.gz WPPXKJQHTKZOOF-IYBDPMFKSA-N 1 1 366.421 2.602 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609758134 520423124 /nfs/dbraw/zinc/42/31/24/520423124.db2.gz LBPIPTADTRSQFF-XJKSGUPXSA-N 1 1 358.442 2.868 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000598195956 520486183 /nfs/dbraw/zinc/48/61/83/520486183.db2.gz XSIRHTZOMYREQK-INIZCTEOSA-N 1 1 368.437 2.566 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000598195840 520486760 /nfs/dbraw/zinc/48/67/60/520486760.db2.gz UJQLNCTVXARQPG-IBGZPJMESA-N 1 1 353.422 2.984 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000609963822 520492390 /nfs/dbraw/zinc/49/23/90/520492390.db2.gz PXQXXWYVIQECFR-BETUJISGSA-N 1 1 350.419 2.841 20 5 FFBDMO Cc1noc(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000595480865 520499151 /nfs/dbraw/zinc/49/91/51/520499151.db2.gz AFEACQHCJLAICO-IBGZPJMESA-N 1 1 356.426 2.989 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595522865 520527764 /nfs/dbraw/zinc/52/77/64/520527764.db2.gz PARLTDQONGQDIG-INIZCTEOSA-N 1 1 360.458 2.559 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000595536195 520534575 /nfs/dbraw/zinc/53/45/75/520534575.db2.gz OPILITPXVQUEKE-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595557148 520551351 /nfs/dbraw/zinc/55/13/51/520551351.db2.gz HOHWIFXVFLALPG-MRXNPFEDSA-N 1 1 357.385 2.872 20 5 FFBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(S(C)(=O)=O)cc1 ZINC000610197234 520575002 /nfs/dbraw/zinc/57/50/02/520575002.db2.gz HXTIMTYSDMWABR-NSHDSACASA-N 1 1 374.422 2.725 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000604535025 520592585 /nfs/dbraw/zinc/59/25/85/520592585.db2.gz PBQLIZKSJCUWGX-QGZVFWFLSA-N 1 1 354.410 2.518 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000592883334 520632896 /nfs/dbraw/zinc/63/28/96/520632896.db2.gz ZFBWEGIEWZBCKM-SJORKVTESA-N 1 1 369.421 2.679 20 5 FFBDMO CCN(CC)c1ncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)s1 ZINC000601149847 520662456 /nfs/dbraw/zinc/66/24/56/520662456.db2.gz QPLFIUXUZXHZRG-QGZVFWFLSA-N 1 1 364.471 2.895 20 5 FFBDMO Cc1c(CC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511934 520672131 /nfs/dbraw/zinc/67/21/31/520672131.db2.gz UZDYOAMJWDJUCQ-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@]2(CO)CCCc3ccccc32)c1 ZINC000593028531 520693425 /nfs/dbraw/zinc/69/34/25/520693425.db2.gz JQDIDEJDDZPHSO-FQEVSTJZSA-N 1 1 370.405 2.695 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@H+](C3CCC3)C[C@H](C)C2)c1 ZINC000593029623 520693761 /nfs/dbraw/zinc/69/37/61/520693761.db2.gz JCWWMDIQQXQSMZ-CQSZACIVSA-N 1 1 361.442 2.688 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595761035 520706269 /nfs/dbraw/zinc/70/62/69/520706269.db2.gz WDTMZBLQVKFLSJ-BDJLRTHQSA-N 1 1 358.341 2.673 20 5 FFBDMO CN(C(=O)C[NH+]1CCC([C@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000595790824 520727907 /nfs/dbraw/zinc/72/79/07/520727907.db2.gz YKNUXRJZVCCGIG-GOSISDBHSA-N 1 1 361.442 2.839 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)OCC12CCC2 ZINC000593091107 520739222 /nfs/dbraw/zinc/73/92/22/520739222.db2.gz FMULLHOPJWJQKD-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598613954 520744662 /nfs/dbraw/zinc/74/46/62/520744662.db2.gz ZYUOWPVQFKBJDM-HIFRSBDPSA-N 1 1 370.409 2.851 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C[C@H]1C ZINC000601355133 520752111 /nfs/dbraw/zinc/75/21/11/520752111.db2.gz KNLQFJJKOPTKFR-CHWSQXEVSA-N 1 1 373.450 2.536 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c([N+](=O)[O-])s1 ZINC000601361021 520755225 /nfs/dbraw/zinc/75/52/25/520755225.db2.gz AZHNZUSEHUZFHP-OLZOCXBDSA-N 1 1 373.500 2.601 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595836687 520758396 /nfs/dbraw/zinc/75/83/96/520758396.db2.gz YEEMWFUUHDQLHZ-WCQYABFASA-N 1 1 372.368 2.716 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOc2ccc(O)cc2C1 ZINC000595845516 520760775 /nfs/dbraw/zinc/76/07/75/520760775.db2.gz OJDARMRDQOWDOX-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOc2ccc(O)cc2C1 ZINC000595845516 520760784 /nfs/dbraw/zinc/76/07/84/520760784.db2.gz OJDARMRDQOWDOX-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601537540 520831348 /nfs/dbraw/zinc/83/13/48/520831348.db2.gz FOCMONVYCUGQFX-IAGOWNOFSA-N 1 1 361.417 2.661 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c(Cl)c1 ZINC000618068363 520864179 /nfs/dbraw/zinc/86/41/79/520864179.db2.gz WMIVEQNUCOBRIS-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c(Cl)c1 ZINC000618068363 520864189 /nfs/dbraw/zinc/86/41/89/520864189.db2.gz WMIVEQNUCOBRIS-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO CCN1CC[NH+](CCCNc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596073675 520896258 /nfs/dbraw/zinc/89/62/58/520896258.db2.gz LFUWWMKRRLEJAQ-UHFFFAOYSA-N 1 1 356.854 2.696 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593319013 520906568 /nfs/dbraw/zinc/90/65/68/520906568.db2.gz ILFJZBNARKJXON-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593319013 520906572 /nfs/dbraw/zinc/90/65/72/520906572.db2.gz ILFJZBNARKJXON-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923692 520907172 /nfs/dbraw/zinc/90/71/72/520907172.db2.gz WOYVWPQHZNKFCR-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923692 520907174 /nfs/dbraw/zinc/90/71/74/520907174.db2.gz WOYVWPQHZNKFCR-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923692 520907177 /nfs/dbraw/zinc/90/71/77/520907177.db2.gz WOYVWPQHZNKFCR-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593322021 520908704 /nfs/dbraw/zinc/90/87/04/520908704.db2.gz KUXRCXVRDMTOPD-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593322021 520908708 /nfs/dbraw/zinc/90/87/08/520908708.db2.gz KUXRCXVRDMTOPD-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000593336210 520918738 /nfs/dbraw/zinc/91/87/38/520918738.db2.gz DUXQJPILEBUXTR-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO CCN1CC[NH+]([C@@H]2CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)CC1 ZINC000596124923 520927871 /nfs/dbraw/zinc/92/78/71/520927871.db2.gz ZXNIABFNSLGWOP-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000610986869 520930976 /nfs/dbraw/zinc/93/09/76/520930976.db2.gz AYTHWFBSENGGAI-IBGZPJMESA-N 1 1 372.469 2.650 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000618222351 520950316 /nfs/dbraw/zinc/95/03/16/520950316.db2.gz XJERMVIMRZWJAX-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000611072245 520971268 /nfs/dbraw/zinc/97/12/68/520971268.db2.gz BGZNFYROGILDKC-HOCLYGCPSA-N 1 1 359.426 2.579 20 5 FFBDMO COc1cc(NCCN2CC[N@@H+](C)C(C)(C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596223588 520979844 /nfs/dbraw/zinc/97/98/44/520979844.db2.gz SDEZDXCPGONFAK-UHFFFAOYSA-N 1 1 356.854 2.695 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419669 520981997 /nfs/dbraw/zinc/98/19/97/520981997.db2.gz HYOAHERHGMZXEV-MJBXVCDLSA-N 1 1 351.422 2.759 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599036862 520992388 /nfs/dbraw/zinc/99/23/88/520992388.db2.gz XBFVYYVEHNTBSS-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000599044484 520996746 /nfs/dbraw/zinc/99/67/46/520996746.db2.gz YCTIYLOUBFTZMJ-ZWKOTPCHSA-N 1 1 353.422 2.899 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000596256892 520997681 /nfs/dbraw/zinc/99/76/81/520997681.db2.gz IDIGMUUTCXQDBQ-OAHLLOKOSA-N 1 1 368.437 2.652 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)[C@@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599066019 521011062 /nfs/dbraw/zinc/01/10/62/521011062.db2.gz NCRPIAIXEJOOEM-ZIFCJYIRSA-N 1 1 360.410 2.969 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC1CC([NH+]2CCOCC2)C1 ZINC000599093316 521030499 /nfs/dbraw/zinc/03/04/99/521030499.db2.gz OQIJANRVDBTGDL-UHFFFAOYSA-N 1 1 356.220 2.632 20 5 FFBDMO Cc1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c1 ZINC000593495821 521031819 /nfs/dbraw/zinc/03/18/19/521031819.db2.gz JWBDBRXAJQZSQV-RTBURBONSA-N 1 1 368.437 2.778 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C(F)F)CC1 ZINC000601971652 521048953 /nfs/dbraw/zinc/04/89/53/521048953.db2.gz DHMWTDXJNWNXMZ-CQSZACIVSA-N 1 1 357.357 2.588 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(c2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000611258859 521061896 /nfs/dbraw/zinc/06/18/96/521061896.db2.gz VGOQQWMLFFPXSG-UHFFFAOYSA-N 1 1 354.410 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599164088 521065695 /nfs/dbraw/zinc/06/56/95/521065695.db2.gz JJINESOOVLGVFW-SFHVURJKSA-N 1 1 374.485 2.856 20 5 FFBDMO CN1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)Cc2ccccc21 ZINC000611268517 521068679 /nfs/dbraw/zinc/06/86/79/521068679.db2.gz YJVAZOZFTSHXOM-UHFFFAOYSA-N 1 1 355.394 2.818 20 5 FFBDMO CN1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)Cc2ccccc21 ZINC000611268517 521068687 /nfs/dbraw/zinc/06/86/87/521068687.db2.gz YJVAZOZFTSHXOM-UHFFFAOYSA-N 1 1 355.394 2.818 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287367 521081847 /nfs/dbraw/zinc/08/18/47/521081847.db2.gz ZUDJVJXEWWGKGD-YOEHRIQHSA-N 1 1 373.453 2.815 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](CC3CC3)C2)s1 ZINC000596570023 521136917 /nfs/dbraw/zinc/13/69/17/521136917.db2.gz GZPXJADVBREMRI-LBPRGKRZSA-N 1 1 373.500 2.594 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000596570023 521136918 /nfs/dbraw/zinc/13/69/18/521136918.db2.gz GZPXJADVBREMRI-LBPRGKRZSA-N 1 1 373.500 2.594 20 5 FFBDMO COC(=O)Cc1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571724 521137511 /nfs/dbraw/zinc/13/75/11/521137511.db2.gz YVKUMXZMZBNDTB-INIZCTEOSA-N 1 1 361.442 2.844 20 5 FFBDMO O=c1[nH]cnc2cc(NC[C@H]3CCC[N@@H+](CC4CC4)C3)c([N+](=O)[O-])cc21 ZINC000596571759 521137971 /nfs/dbraw/zinc/13/79/71/521137971.db2.gz ZSYBEEDGZMWJSQ-CYBMUJFWSA-N 1 1 357.414 2.778 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599393407 521193564 /nfs/dbraw/zinc/19/35/64/521193564.db2.gz HZHLHBVKKOHGNX-LLVKDONJSA-N 1 1 368.231 2.571 20 5 FFBDMO CCCN(CC(F)(F)F)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000599405422 521203099 /nfs/dbraw/zinc/20/30/99/521203099.db2.gz SRLDVMRBMJSFTN-UHFFFAOYSA-N 1 1 361.364 2.870 20 5 FFBDMO CCCN(CC(F)(F)F)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000599405422 521203103 /nfs/dbraw/zinc/20/31/03/521203103.db2.gz SRLDVMRBMJSFTN-UHFFFAOYSA-N 1 1 361.364 2.870 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[NH+](Cc4cccc(O)c4)CC3)c2c1 ZINC000611710706 521292536 /nfs/dbraw/zinc/29/25/36/521292536.db2.gz MXQAGBIXOCPIMR-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000599599785 521323515 /nfs/dbraw/zinc/32/35/15/521323515.db2.gz UIIRIEJVYQBVQA-UHFFFAOYSA-N 1 1 361.373 2.866 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc4nccnc4c3)C2)nc1 ZINC000602471612 521362686 /nfs/dbraw/zinc/36/26/86/521362686.db2.gz FHMJLAOVUOHJEA-AWEZNQCLSA-N 1 1 350.382 2.619 20 5 FFBDMO Cn1cc(CN2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c([N+](=O)[O-])n1 ZINC000602482943 521371470 /nfs/dbraw/zinc/37/14/70/521371470.db2.gz HMZCSBWIWMDWTO-UHFFFAOYSA-N 1 1 369.469 2.816 20 5 FFBDMO Cn1cc(CN2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c([N+](=O)[O-])n1 ZINC000602482943 521371473 /nfs/dbraw/zinc/37/14/73/521371473.db2.gz HMZCSBWIWMDWTO-UHFFFAOYSA-N 1 1 369.469 2.816 20 5 FFBDMO CCOC(=O)CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000594052296 521374612 /nfs/dbraw/zinc/37/46/12/521374612.db2.gz VUCGURUIWCDAEL-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000594052296 521374620 /nfs/dbraw/zinc/37/46/20/521374620.db2.gz VUCGURUIWCDAEL-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[NH+](CCCF)CC1 ZINC000599666677 521379052 /nfs/dbraw/zinc/37/90/52/521379052.db2.gz AXHJUIBGVQRGMT-ZDUSSCGKSA-N 1 1 363.393 2.683 20 5 FFBDMO CCN1CCN([C@H](C)C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602513226 521388526 /nfs/dbraw/zinc/38/85/26/521388526.db2.gz AUBRRIIWPDPMGK-CYBMUJFWSA-N 1 1 374.407 2.729 20 5 FFBDMO C[C@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CN1CCN(C)CC1 ZINC000602538952 521400002 /nfs/dbraw/zinc/40/00/02/521400002.db2.gz GBYCVGSYUPFOHL-CYBMUJFWSA-N 1 1 374.407 2.587 20 5 FFBDMO O=[N+]([O-])c1sc(CN[C@H]2CC[N@H+](CC3CC3)C2)cc1Br ZINC000602564005 521413080 /nfs/dbraw/zinc/41/30/80/521413080.db2.gz KHOUFYXPLHOFMK-JTQLQIEISA-N 1 1 360.277 2.993 20 5 FFBDMO O=[N+]([O-])c1sc(CN[C@H]2CC[N@@H+](CC3CC3)C2)cc1Br ZINC000602564005 521413086 /nfs/dbraw/zinc/41/30/86/521413086.db2.gz KHOUFYXPLHOFMK-JTQLQIEISA-N 1 1 360.277 2.993 20 5 FFBDMO CC[N@H+](CCC1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1)CC(C)C ZINC000602664412 521469042 /nfs/dbraw/zinc/46/90/42/521469042.db2.gz WWLKSLHAUKKXEK-UHFFFAOYSA-N 1 1 351.495 2.908 20 5 FFBDMO CC[N@@H+](CCC1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1)CC(C)C ZINC000602664412 521469048 /nfs/dbraw/zinc/46/90/48/521469048.db2.gz WWLKSLHAUKKXEK-UHFFFAOYSA-N 1 1 351.495 2.908 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599827796 521495862 /nfs/dbraw/zinc/49/58/62/521495862.db2.gz DGPLMYCMABJNTQ-CYBMUJFWSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597102834 521507625 /nfs/dbraw/zinc/50/76/25/521507625.db2.gz YYSSGWSQDXIJHC-CYBMUJFWSA-N 1 1 355.826 2.634 20 5 FFBDMO CC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(=O)Nc1c(C)cccc1C ZINC000602794763 521535694 /nfs/dbraw/zinc/53/56/94/521535694.db2.gz OYXZOZOBDJOZRX-UHFFFAOYSA-N 1 1 359.430 2.677 20 5 FFBDMO CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(=O)Nc1c(C)cccc1C ZINC000602794763 521535699 /nfs/dbraw/zinc/53/56/99/521535699.db2.gz OYXZOZOBDJOZRX-UHFFFAOYSA-N 1 1 359.430 2.677 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](Cn2cnc3ccccc32)C1 ZINC000602810250 521545270 /nfs/dbraw/zinc/54/52/70/521545270.db2.gz GFXIQVOHQNUFNJ-INIZCTEOSA-N 1 1 368.441 2.862 20 5 FFBDMO Cn1cc(C[N@@H+]2CCCC[C@@H]2CCC(=O)OC(C)(C)C)c([N+](=O)[O-])n1 ZINC000602844570 521565498 /nfs/dbraw/zinc/56/54/98/521565498.db2.gz BWSRFZFLHOMZDZ-CQSZACIVSA-N 1 1 352.435 2.805 20 5 FFBDMO Cn1cc(C[N@H+]2CCCC[C@@H]2CCC(=O)OC(C)(C)C)c([N+](=O)[O-])n1 ZINC000602844570 521565504 /nfs/dbraw/zinc/56/55/04/521565504.db2.gz BWSRFZFLHOMZDZ-CQSZACIVSA-N 1 1 352.435 2.805 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000619566971 521773771 /nfs/dbraw/zinc/77/37/71/521773771.db2.gz DRCOALBQGRNWFD-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000540886388 562595771 /nfs/dbraw/zinc/59/57/71/562595771.db2.gz NJDMJFCNXANEJK-UHFFFAOYSA-N 1 1 366.381 2.699 20 5 FFBDMO C[N@@H+](CCCOc1cccc(-c2nn[nH]n2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000821600171 606883726 /nfs/dbraw/zinc/88/37/26/606883726.db2.gz AOJUQVVWPFVYHM-UHFFFAOYSA-N 1 1 368.397 2.676 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000826169869 608469016 /nfs/dbraw/zinc/46/90/16/608469016.db2.gz IGQHNPVMDXPCNT-NSHDSACASA-N 1 1 354.370 2.634 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCC3(CC2)C[N@@H+](Cc2cccs2)CCO3)n1 ZINC001164695671 719888031 /nfs/dbraw/zinc/88/80/31/719888031.db2.gz PZYWZKJTAIVRIS-UHFFFAOYSA-N 1 1 374.466 2.923 20 5 FFBDMO COc1cc(C)nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164722587 720374668 /nfs/dbraw/zinc/37/46/68/720374668.db2.gz DOOAIGWTLNLREM-JKSUJKDBSA-N 1 1 369.425 2.555 20 5 FFBDMO Cc1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001164901707 721512823 /nfs/dbraw/zinc/51/28/23/721512823.db2.gz YDLPQNDFWUKPEQ-WBVHZDCISA-N 1 1 372.400 2.779 20 5 FFBDMO Cc1cc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)nc2ccc([N+](=O)[O-])cc12 ZINC001164965958 722069746 /nfs/dbraw/zinc/06/97/46/722069746.db2.gz SZXNIDOVLLHGKB-CALCHBBNSA-N 1 1 368.437 2.751 20 5 FFBDMO CCOC(=O)C1([N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000154646060 728808925 /nfs/dbraw/zinc/80/89/25/728808925.db2.gz RQSMDJPIKRIVQV-INIZCTEOSA-N 1 1 350.415 2.826 20 5 FFBDMO CCOC(=O)C1([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000154646060 728808931 /nfs/dbraw/zinc/80/89/31/728808931.db2.gz RQSMDJPIKRIVQV-INIZCTEOSA-N 1 1 350.415 2.826 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000744411602 735352878 /nfs/dbraw/zinc/35/28/78/735352878.db2.gz PZIFWICWHPMFOV-AWEZNQCLSA-N 1 1 368.865 2.993 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000092627072 728469731 /nfs/dbraw/zinc/46/97/31/728469731.db2.gz OUHWDJZKYJNHDY-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000130583173 728719781 /nfs/dbraw/zinc/71/97/81/728719781.db2.gz OTIJUJANFIETTB-ZDUSSCGKSA-N 1 1 350.419 2.556 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C ZINC000171956562 729016954 /nfs/dbraw/zinc/01/69/54/729016954.db2.gz MHDBLAVDIVRVPL-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C ZINC000171956562 729016955 /nfs/dbraw/zinc/01/69/55/729016955.db2.gz MHDBLAVDIVRVPL-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000857263339 730388125 /nfs/dbraw/zinc/38/81/25/730388125.db2.gz XCGBXUMIYMKJTF-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO C[NH+]1CCN(CC2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000858610915 730429888 /nfs/dbraw/zinc/42/98/88/730429888.db2.gz JGFSGZPZDQAYGU-UHFFFAOYSA-N 1 1 359.257 2.585 20 5 FFBDMO CC1([NH+]2CCOCC2)CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000858765714 730433122 /nfs/dbraw/zinc/43/31/22/730433122.db2.gz XKKTYLPVUBTQFX-UHFFFAOYSA-N 1 1 362.455 2.896 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@]1(C)C[C@@H](OC)C[N@H+]1C ZINC000861350677 730602868 /nfs/dbraw/zinc/60/28/68/730602868.db2.gz QNRDTFWQIFAFLU-CXAGYDPISA-N 1 1 368.455 2.973 20 5 FFBDMO C[C@@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000925167370 738484921 /nfs/dbraw/zinc/48/49/21/738484921.db2.gz BVYCFPQPSSROPY-UHOFOFEASA-N 1 1 364.471 2.535 20 5 FFBDMO COc1ccc(OCCO[NH+]=C(N)CCC(F)(F)F)c([N+](=O)[O-])c1 ZINC000863490169 730786092 /nfs/dbraw/zinc/78/60/92/730786092.db2.gz IDWDPZLNUNNBIZ-UHFFFAOYSA-N 1 1 351.281 2.823 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000864883411 730888303 /nfs/dbraw/zinc/88/83/03/730888303.db2.gz AWEIZSPXSMVIFD-CQSZACIVSA-N 1 1 351.422 2.905 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000866841431 731107134 /nfs/dbraw/zinc/10/71/34/731107134.db2.gz BWZCCPCXVCWPOV-CQSZACIVSA-N 1 1 351.422 2.761 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000872020347 731721386 /nfs/dbraw/zinc/72/13/86/731721386.db2.gz GJNAAKDXYZWAGP-WMLDXEAASA-N 1 1 352.454 2.657 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)CCN1CCN(C)CC1 ZINC000872063842 731725637 /nfs/dbraw/zinc/72/56/37/731725637.db2.gz UEEQQZBHFAFHBF-LSDHHAIUSA-N 1 1 366.531 2.993 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@@H+]1CCCO ZINC000872074962 731726962 /nfs/dbraw/zinc/72/69/62/731726962.db2.gz KZMFBUCGGWYIEK-UKRRQHHQSA-N 1 1 353.488 2.814 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@H+]1CCCO ZINC000872074962 731726964 /nfs/dbraw/zinc/72/69/64/731726964.db2.gz KZMFBUCGGWYIEK-UKRRQHHQSA-N 1 1 353.488 2.814 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000874825154 732104151 /nfs/dbraw/zinc/10/41/51/732104151.db2.gz WZQRPJNHULKEAN-NEPJUHHUSA-N 1 1 368.231 2.666 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000878944464 732619455 /nfs/dbraw/zinc/61/94/55/732619455.db2.gz XBLZAICEDYNOKD-GJZGRUSLSA-N 1 1 361.364 2.587 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879561945 732723985 /nfs/dbraw/zinc/72/39/85/732723985.db2.gz XKXWIOBZDGXTBC-AVGNSLFASA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879561945 732723988 /nfs/dbraw/zinc/72/39/88/732723988.db2.gz XKXWIOBZDGXTBC-AVGNSLFASA-N 1 1 365.455 2.615 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827878 733845084 /nfs/dbraw/zinc/84/50/84/733845084.db2.gz SXXJBGPEVSLQMP-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827878 733845086 /nfs/dbraw/zinc/84/50/86/733845086.db2.gz SXXJBGPEVSLQMP-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000927646680 738765438 /nfs/dbraw/zinc/76/54/38/738765438.db2.gz WFZMMGDMONQNTA-ZDUSSCGKSA-N 1 1 368.821 2.623 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]C[C@H](O)C(F)(F)F)o2)c([N+](=O)[O-])c1 ZINC000726606650 734436582 /nfs/dbraw/zinc/43/65/82/734436582.db2.gz JQQDRGQBMYCDKW-AWEZNQCLSA-N 1 1 360.288 2.876 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783680058 738826283 /nfs/dbraw/zinc/82/62/83/738826283.db2.gz PBLUWYAHWAAPMN-SNVBAGLBSA-N 1 1 365.739 2.749 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC000928431779 738868247 /nfs/dbraw/zinc/86/82/47/738868247.db2.gz OJTVZHCEBCXKIQ-MUWHJKNJSA-N 1 1 350.177 2.863 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000897269746 735213662 /nfs/dbraw/zinc/21/36/62/735213662.db2.gz OLFZLWKGGAVDRC-AWEZNQCLSA-N 1 1 350.415 2.948 20 5 FFBDMO CCC[N@@H+](CC)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1Cl ZINC000752255161 735971146 /nfs/dbraw/zinc/97/11/46/735971146.db2.gz UDGJHMZNVHCSIE-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]C[C@@H](n2cncn2)C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000903210499 736055623 /nfs/dbraw/zinc/05/56/23/736055623.db2.gz YOQVSZAZUWWPMN-NOZJJQNGSA-N 1 1 359.308 2.649 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[N@H+]1C1CC1 ZINC000756952436 736376240 /nfs/dbraw/zinc/37/62/40/736376240.db2.gz SUAXAALEMUZGQS-JQWIXIFHSA-N 1 1 352.822 2.673 20 5 FFBDMO CN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000757262651 736399312 /nfs/dbraw/zinc/39/93/12/736399312.db2.gz PHPMWWGUEZUGEF-CQSZACIVSA-N 1 1 352.822 2.626 20 5 FFBDMO CC[N@@H+](CCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)CCC(F)(F)F ZINC000757619442 736414075 /nfs/dbraw/zinc/41/40/75/736414075.db2.gz WMWLIDZHZFTCJQ-VMPITWQZSA-N 1 1 359.348 2.999 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000757705885 736421282 /nfs/dbraw/zinc/42/12/82/736421282.db2.gz ZYLHCJVXHJNOAK-MNOVXSKESA-N 1 1 353.806 2.708 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000906240754 736475399 /nfs/dbraw/zinc/47/53/99/736475399.db2.gz OZROIAPYEXCWGC-ZIAGYGMSSA-N 1 1 351.834 2.924 20 5 FFBDMO CSc1ccc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000759964403 736607121 /nfs/dbraw/zinc/60/71/21/736607121.db2.gz XZSDRZPTMQKBKD-CQSZACIVSA-N 1 1 368.455 2.830 20 5 FFBDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766910788 737274633 /nfs/dbraw/zinc/27/46/33/737274633.db2.gz RQFTZLKLWFMXRN-WMLDXEAASA-N 1 1 350.415 2.682 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000770381695 737620522 /nfs/dbraw/zinc/62/05/22/737620522.db2.gz PGCJSBRWPKNLNN-CYBMUJFWSA-N 1 1 370.247 2.658 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776597754 738212538 /nfs/dbraw/zinc/21/25/38/738212538.db2.gz MECYMXMUXMJSMG-HOCLYGCPSA-N 1 1 350.415 2.539 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000923269257 738264111 /nfs/dbraw/zinc/26/41/11/738264111.db2.gz YGVYDNLLHOBHTA-NWDGAFQWSA-N 1 1 355.797 2.625 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778247730 738366589 /nfs/dbraw/zinc/36/65/89/738366589.db2.gz OCHOVOWCBJAOKI-OLZOCXBDSA-N 1 1 355.385 2.923 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000785741172 738994317 /nfs/dbraw/zinc/99/43/17/738994317.db2.gz FOWHIDKLNPVCCQ-GHMZBOCLSA-N 1 1 369.805 2.603 20 5 FFBDMO COCC[N@H+](Cc1scnc1C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000785989774 739017172 /nfs/dbraw/zinc/01/71/72/739017172.db2.gz BMOZCTULWGEUSH-HNNXBMFYSA-N 1 1 351.428 2.542 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000931335577 739247351 /nfs/dbraw/zinc/24/73/51/739247351.db2.gz XYGKAMFIFBCQKM-NOZJJQNGSA-N 1 1 369.219 2.525 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931725545 739319032 /nfs/dbraw/zinc/31/90/32/739319032.db2.gz ZUNHPEZXHJRWBZ-SCRDCRAPSA-N 1 1 366.849 2.744 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932017559 739373501 /nfs/dbraw/zinc/37/35/01/739373501.db2.gz WGBWHVIHDHJGND-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)s1 ZINC000932665833 739487905 /nfs/dbraw/zinc/48/79/05/739487905.db2.gz SEKUHMDVPJMNMH-JTQLQIEISA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)s1 ZINC000932665833 739487908 /nfs/dbraw/zinc/48/79/08/739487908.db2.gz SEKUHMDVPJMNMH-JTQLQIEISA-N 1 1 365.386 2.967 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000791142758 739532287 /nfs/dbraw/zinc/53/22/87/739532287.db2.gz RBNKLUIPCRXWEH-LBPRGKRZSA-N 1 1 357.813 2.919 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933436617 739624562 /nfs/dbraw/zinc/62/45/62/739624562.db2.gz USEFGVWPLFOPOW-WFASDCNBSA-N 1 1 353.850 2.979 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000933778811 739689315 /nfs/dbraw/zinc/68/93/15/739689315.db2.gz JEIMEQURIAKCRV-JTQLQIEISA-N 1 1 372.828 2.773 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CCCO2)[C@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871482 739714397 /nfs/dbraw/zinc/71/43/97/739714397.db2.gz LPUOZHMMCUXXAW-LSDHHAIUSA-N 1 1 367.427 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCO2)[C@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871482 739714398 /nfs/dbraw/zinc/71/43/98/739714398.db2.gz LPUOZHMMCUXXAW-LSDHHAIUSA-N 1 1 367.427 2.990 20 5 FFBDMO O=C(CC[N@@H+]1CCCCC[C@H]1CCO)Nc1cc([N+](=O)[O-])ccc1F ZINC000792922894 739719117 /nfs/dbraw/zinc/71/91/17/739719117.db2.gz BUTDRRMYGHZVHW-ZDUSSCGKSA-N 1 1 353.394 2.690 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCC[C@@H]1C ZINC000793459918 739783771 /nfs/dbraw/zinc/78/37/71/739783771.db2.gz FUOBPNFPWPJELZ-JTQLQIEISA-N 1 1 370.247 2.880 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000801841040 740656960 /nfs/dbraw/zinc/65/69/60/740656960.db2.gz DLMXQMCZMIJZFJ-UHFFFAOYSA-N 1 1 352.410 2.509 20 5 FFBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000802140872 740677864 /nfs/dbraw/zinc/67/78/64/740677864.db2.gz MOCWKRXMIYATQV-ZFWWWQNUSA-N 1 1 368.455 2.728 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C ZINC000803496160 740804655 /nfs/dbraw/zinc/80/46/55/740804655.db2.gz XOWFEBUHLMWUTH-HZMBPMFUSA-N 1 1 371.821 2.705 20 5 FFBDMO COCC[N@H+]1CC[C@H](Nc2ccc(C)c(Br)c2[N+](=O)[O-])C1 ZINC000804442286 740874486 /nfs/dbraw/zinc/87/44/86/740874486.db2.gz ULRSYVKVJLWCER-NSHDSACASA-N 1 1 358.236 2.798 20 5 FFBDMO COc1ccc(COC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000811446650 741522780 /nfs/dbraw/zinc/52/27/80/741522780.db2.gz WAPDZDXIWVQMFR-QGZVFWFLSA-N 1 1 354.378 2.859 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000817178897 742101995 /nfs/dbraw/zinc/10/19/95/742101995.db2.gz OTJNQSVQOPKRSQ-UHFFFAOYSA-N 1 1 362.407 2.846 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC2(CCC2)O1 ZINC000830734186 745421593 /nfs/dbraw/zinc/42/15/93/745421593.db2.gz HIMNNAVIFAGLMC-LBPRGKRZSA-N 1 1 351.378 2.706 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831159710 745492673 /nfs/dbraw/zinc/49/26/73/745492673.db2.gz XZCFWIUIDYJQNJ-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000837436460 746445556 /nfs/dbraw/zinc/44/55/56/746445556.db2.gz BEFKYOSOKPPSMY-ZDUSSCGKSA-N 1 1 351.359 2.923 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839416113 746824848 /nfs/dbraw/zinc/82/48/48/746824848.db2.gz ZTBAHFOQBHYSRT-LBPRGKRZSA-N 1 1 370.247 2.914 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Br)C1 ZINC000839440592 746828456 /nfs/dbraw/zinc/82/84/56/746828456.db2.gz WCOUTZRIAVOQKZ-LBPRGKRZSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000846912883 748572884 /nfs/dbraw/zinc/57/28/84/748572884.db2.gz PJFJSWVJZKKKPZ-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO COc1ccc(CSCC(=O)OCC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000847826311 748790742 /nfs/dbraw/zinc/79/07/42/748790742.db2.gz VVJNZBMAMMPUOT-CYBMUJFWSA-N 1 1 368.455 2.722 20 5 FFBDMO COC(=O)c1nc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)ccc1Cl ZINC000850516791 749379332 /nfs/dbraw/zinc/37/93/32/749379332.db2.gz YMAQCZOHDITMEX-VIFPVBQESA-N 1 1 364.789 2.863 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1 ZINC000895929015 971089669 /nfs/dbraw/zinc/08/96/69/971089669.db2.gz TVSCFMYNEPQVFU-UHFFFAOYSA-N 1 1 372.450 2.963 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCN1 ZINC000895929015 971089675 /nfs/dbraw/zinc/08/96/75/971089675.db2.gz TVSCFMYNEPQVFU-UHFFFAOYSA-N 1 1 372.450 2.963 20 5 FFBDMO Cc1nn(C)c(NCC2([N@@H+](C)Cc3ccccc3)CCOCC2)c1[N+](=O)[O-] ZINC000896108240 971248212 /nfs/dbraw/zinc/24/82/12/971248212.db2.gz WIRNOGDDVZTEET-UHFFFAOYSA-N 1 1 373.457 2.730 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000047174465 971941421 /nfs/dbraw/zinc/94/14/21/971941421.db2.gz JFETUWNQYXDZHV-UHFFFAOYSA-N 1 1 366.381 2.925 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000866846360 958884664 /nfs/dbraw/zinc/88/46/64/958884664.db2.gz CSLFNZWWYZZHSD-RHSMWYFYSA-N 1 1 361.417 2.752 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)cc1 ZINC001174843392 1013323940 /nfs/dbraw/zinc/32/39/40/1013323940.db2.gz NBDBRCGMDLSDGD-HNNXBMFYSA-N 1 1 371.441 2.754 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1C1CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000728288911 962468612 /nfs/dbraw/zinc/46/86/12/962468612.db2.gz KBBGKUYTLPBOCE-IBGZPJMESA-N 1 1 372.469 2.508 20 5 FFBDMO O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022063730 964188277 /nfs/dbraw/zinc/18/82/77/964188277.db2.gz JJVZETGBRGGQCQ-FCGDIQPGSA-N 1 1 357.454 2.746 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](CO)c1ccc(Br)cc1 ZINC001175758706 1013553678 /nfs/dbraw/zinc/55/36/78/1013553678.db2.gz SJIPBNHWEFJNIF-CYBMUJFWSA-N 1 1 352.188 2.576 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCOCC2)c2nonc21 ZINC000018061441 965245812 /nfs/dbraw/zinc/24/58/12/965245812.db2.gz KBNVVCYZVNKVOO-UHFFFAOYSA-N 1 1 369.381 2.575 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000843760794 965828243 /nfs/dbraw/zinc/82/82/43/965828243.db2.gz ALFQAIQEPMSYRN-UHFFFAOYSA-N 1 1 357.385 2.830 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000843760794 965828251 /nfs/dbraw/zinc/82/82/51/965828251.db2.gz ALFQAIQEPMSYRN-UHFFFAOYSA-N 1 1 357.385 2.830 20 5 FFBDMO COc1c(O)ccc(CNC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000895113592 967657923 /nfs/dbraw/zinc/65/79/23/967657923.db2.gz BAXZMYZPEMEKEE-SJORKVTESA-N 1 1 371.437 2.744 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000892553365 969475179 /nfs/dbraw/zinc/47/51/79/969475179.db2.gz MFHWXLSWKORLLD-UHFFFAOYSA-N 1 1 362.405 2.565 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000874847386 1013917680 /nfs/dbraw/zinc/91/76/80/1013917680.db2.gz PBMBBLHGKQLCHA-MOPGFXCFSA-N 1 1 372.469 2.894 20 5 FFBDMO Cc1cc(C)c(OC(=O)[C@H]2CC[N@H+](C)C[C@@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000875062457 1013960203 /nfs/dbraw/zinc/96/02/03/1013960203.db2.gz UPODVVIIRNWLCB-JKSUJKDBSA-N 1 1 372.425 2.586 20 5 FFBDMO Cn1c2ccccc2c(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1=O ZINC000892764414 970279187 /nfs/dbraw/zinc/27/91/87/970279187.db2.gz XINGRCYZMUMQJD-OAHLLOKOSA-N 1 1 370.453 2.615 20 5 FFBDMO C[C@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000875160963 1013982151 /nfs/dbraw/zinc/98/21/51/1013982151.db2.gz DLDBPCYQHSMXPE-MORSLUCNSA-N 1 1 372.425 2.668 20 5 FFBDMO C[C@H](CNC(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897064527 973215286 /nfs/dbraw/zinc/21/52/86/973215286.db2.gz YZWKKIVIQPHWLT-HUUCEWRRSA-N 1 1 360.458 2.824 20 5 FFBDMO COC(=O)c1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1C ZINC001167778992 974334863 /nfs/dbraw/zinc/33/48/63/974334863.db2.gz NRDYZFKLOQPBLX-HNNXBMFYSA-N 1 1 370.409 2.771 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000125624152 975088784 /nfs/dbraw/zinc/08/87/84/975088784.db2.gz XITYWDKTYAKGAL-OAHLLOKOSA-N 1 1 360.458 2.640 20 5 FFBDMO Cc1ncccc1OC[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000842173529 976710367 /nfs/dbraw/zinc/71/03/67/976710367.db2.gz RHNAKTPPVQLFDX-MSOLQXFVSA-N 1 1 357.410 2.875 20 5 FFBDMO Cc1cccc(CCC[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)c1 ZINC000981764900 976764478 /nfs/dbraw/zinc/76/44/78/976764478.db2.gz JIMXIIDBCOGKEF-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1cccc(CCC[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c1 ZINC000981764900 976764487 /nfs/dbraw/zinc/76/44/87/976764487.db2.gz JIMXIIDBCOGKEF-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1cccc(CCC[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c1 ZINC000981764900 976764499 /nfs/dbraw/zinc/76/44/99/976764499.db2.gz JIMXIIDBCOGKEF-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1[nH+]c2cc3c(cc2n1C[C@H](O)c1cccc([N+](=O)[O-])c1)OCCO3 ZINC000136900384 977132304 /nfs/dbraw/zinc/13/23/04/977132304.db2.gz RDHFHDLKRJADBP-INIZCTEOSA-N 1 1 355.350 2.758 20 5 FFBDMO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000877168437 1014496529 /nfs/dbraw/zinc/49/65/29/1014496529.db2.gz UJBNMZSALXHTEE-BJMVHTGZSA-N 1 1 369.469 2.995 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC000910790429 982053939 /nfs/dbraw/zinc/05/39/39/982053939.db2.gz NGOGURFBNOHLHB-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC000910790429 982053948 /nfs/dbraw/zinc/05/39/48/982053948.db2.gz NGOGURFBNOHLHB-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO Cc1ncccc1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000898256351 982670758 /nfs/dbraw/zinc/67/07/58/982670758.db2.gz WLERILSSUNTIFV-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)CCc1ccccn1 ZINC000764322422 984431613 /nfs/dbraw/zinc/43/16/13/984431613.db2.gz COLLPOHOOOYNJJ-UHFFFAOYSA-N 1 1 372.425 2.892 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000046403943 984675821 /nfs/dbraw/zinc/67/58/21/984675821.db2.gz OAGMRYYOBPNWBV-UHFFFAOYSA-N 1 1 354.410 2.989 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000158032736 984744911 /nfs/dbraw/zinc/74/49/11/984744911.db2.gz RHQVSPLPRGBJER-CRAIPNDOSA-N 1 1 355.442 2.851 20 5 FFBDMO C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(N2CCCCC2=O)cc1 ZINC000878631938 1015142052 /nfs/dbraw/zinc/14/20/52/1015142052.db2.gz BLQYXERNUJHQCW-CYBMUJFWSA-N 1 1 357.414 2.696 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)o1 ZINC000878643980 1015149150 /nfs/dbraw/zinc/14/91/50/1015149150.db2.gz QVFFVQRFWDLLPD-CQSZACIVSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCOC[C@H](C3CCC3)C2)o1 ZINC000878643980 1015149154 /nfs/dbraw/zinc/14/91/54/1015149154.db2.gz QVFFVQRFWDLLPD-CQSZACIVSA-N 1 1 358.398 2.893 20 5 FFBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1 ZINC000673514236 988433684 /nfs/dbraw/zinc/43/36/84/988433684.db2.gz LVZDMHZMZZYRKR-IAGOWNOFSA-N 1 1 361.445 2.669 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)OCCCn2cc[nH+]c2C)cc1OC ZINC000763111069 989044937 /nfs/dbraw/zinc/04/49/37/989044937.db2.gz DMPBMDRPHFYNIM-UHFFFAOYSA-N 1 1 363.370 2.754 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000879419994 1015523021 /nfs/dbraw/zinc/52/30/21/1015523021.db2.gz RGIZYICYQZNXON-COXVUDFISA-N 1 1 365.405 2.688 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)[nH+]c1 ZINC000127729159 1015524918 /nfs/dbraw/zinc/52/49/18/1015524918.db2.gz CVZFKKMFQNRUGO-UHFFFAOYSA-N 1 1 373.369 2.747 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC000917125088 990145740 /nfs/dbraw/zinc/14/57/40/990145740.db2.gz MUHOGKBNXCWXRT-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000154599839 990317938 /nfs/dbraw/zinc/31/79/38/990317938.db2.gz RPJBIGZABSCFTK-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3=CCCCC3)C2)CC1 ZINC001035186661 990409946 /nfs/dbraw/zinc/40/99/46/990409946.db2.gz IRRKNRAXUPLDPX-QZTJIDSGSA-N 1 1 361.486 2.857 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCC3=CCCCC3)C2)CC1 ZINC001035186661 990409949 /nfs/dbraw/zinc/40/99/49/990409949.db2.gz IRRKNRAXUPLDPX-QZTJIDSGSA-N 1 1 361.486 2.857 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3=CCCCC3)C2)CC1 ZINC001035186661 990409952 /nfs/dbraw/zinc/40/99/52/990409952.db2.gz IRRKNRAXUPLDPX-QZTJIDSGSA-N 1 1 361.486 2.857 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CCC3CCCCCC3)C2)CC1 ZINC001035704596 990528312 /nfs/dbraw/zinc/52/83/12/990528312.db2.gz SMOAGSPGCKNOJC-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000195143304 990739173 /nfs/dbraw/zinc/73/91/73/990739173.db2.gz IGWPEDNNFOSSDE-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000195143304 990739178 /nfs/dbraw/zinc/73/91/78/990739178.db2.gz IGWPEDNNFOSSDE-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO COCCOc1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179534879 991289191 /nfs/dbraw/zinc/28/91/91/991289191.db2.gz MLOLGAJWESMKHU-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cc1c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000068084591 991331654 /nfs/dbraw/zinc/33/16/54/991331654.db2.gz ZUIGOERPKCBCHM-RYUDHWBXSA-N 1 1 364.402 2.662 20 5 FFBDMO C[N@H+](Cc1ccc2cc[nH]c2c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000879725282 1015654109 /nfs/dbraw/zinc/65/41/09/1015654109.db2.gz XUEGNDGXMJUWFQ-INIZCTEOSA-N 1 1 355.394 2.948 20 5 FFBDMO Cc1ccc(CC[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1 ZINC001485451724 991944565 /nfs/dbraw/zinc/94/45/65/991944565.db2.gz ZAOROJFKILSXMK-QZTJIDSGSA-N 1 1 359.470 2.611 20 5 FFBDMO Cn1nnnc1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000879915977 1015706729 /nfs/dbraw/zinc/70/67/29/1015706729.db2.gz FEFVSVFMEJXQOT-UHFFFAOYSA-N 1 1 370.335 2.517 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000071950002 992704892 /nfs/dbraw/zinc/70/48/92/992704892.db2.gz FFUIWSWQFYXHPV-UHFFFAOYSA-N 1 1 372.381 2.704 20 5 FFBDMO COc1cc(CN2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c([N+](=O)[O-])cc1OC(F)F ZINC000880133370 1015764171 /nfs/dbraw/zinc/76/41/71/1015764171.db2.gz SXMQCEWTGSBQJW-OLZOCXBDSA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000072706090 993273350 /nfs/dbraw/zinc/27/33/50/993273350.db2.gz IPSIBJNFBZZVCQ-GFCCVEGCSA-N 1 1 364.402 2.806 20 5 FFBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](CO)c1ccccc1 ZINC000880462623 1015840614 /nfs/dbraw/zinc/84/06/14/1015840614.db2.gz UISKECGZBRIKOH-SFHVURJKSA-N 1 1 357.410 2.613 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](CO)c1ccccc1 ZINC000880462623 1015840622 /nfs/dbraw/zinc/84/06/22/1015840622.db2.gz UISKECGZBRIKOH-SFHVURJKSA-N 1 1 357.410 2.613 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000880460712 1015841092 /nfs/dbraw/zinc/84/10/92/1015841092.db2.gz BTBDACUXNLGQKU-GOSISDBHSA-N 1 1 357.410 2.979 20 5 FFBDMO O=C(NC1CC1)OC[C@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000810040482 994687759 /nfs/dbraw/zinc/68/77/59/994687759.db2.gz RTFNZHYNVNDJAP-MRXNPFEDSA-N 1 1 363.414 2.717 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1CCC1)Cc1cccc(Cl)c1 ZINC001133395861 995497314 /nfs/dbraw/zinc/49/73/14/995497314.db2.gz FQRPFCLQBINTFU-IAGOWNOFSA-N 1 1 365.861 2.724 20 5 FFBDMO CC(C)=CC[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001133396252 995498374 /nfs/dbraw/zinc/49/83/74/995498374.db2.gz YWROKSMZELGLKT-IAGOWNOFSA-N 1 1 365.861 2.890 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000747832280 995595360 /nfs/dbraw/zinc/59/53/60/995595360.db2.gz PAFWYKOXLZZKJV-HOTGVXAUSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1COc2ccccc21 ZINC000813170580 995632583 /nfs/dbraw/zinc/63/25/83/995632583.db2.gz IBCORCOEAWJONM-FUHWJXTLSA-N 1 1 368.389 2.889 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1COc2ccccc21 ZINC000813170580 995632588 /nfs/dbraw/zinc/63/25/88/995632588.db2.gz IBCORCOEAWJONM-FUHWJXTLSA-N 1 1 368.389 2.889 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCc1cccs1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054265000 1015996124 /nfs/dbraw/zinc/99/61/24/1015996124.db2.gz ZEMWQZQSSUQMTN-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CCc1cccs1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054265000 1015996129 /nfs/dbraw/zinc/99/61/29/1015996129.db2.gz ZEMWQZQSSUQMTN-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCc1cccs1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054265000 1015996136 /nfs/dbraw/zinc/99/61/36/1015996136.db2.gz ZEMWQZQSSUQMTN-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000826725021 1016033810 /nfs/dbraw/zinc/03/38/10/1016033810.db2.gz UEQRJKVFYUDTQV-QGZVFWFLSA-N 1 1 355.394 2.667 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000826725021 1016033816 /nfs/dbraw/zinc/03/38/16/1016033816.db2.gz UEQRJKVFYUDTQV-QGZVFWFLSA-N 1 1 355.394 2.667 20 5 FFBDMO C[C@@H](CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000826747869 1016058565 /nfs/dbraw/zinc/05/85/65/1016058565.db2.gz YRUXAFBNFUSDOK-KXBFYZLASA-N 1 1 371.437 2.655 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823986050 996772767 /nfs/dbraw/zinc/77/27/67/996772767.db2.gz GSFYGJUZUGSWNA-CQSZACIVSA-N 1 1 369.425 2.915 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823986050 996772773 /nfs/dbraw/zinc/77/27/73/996772773.db2.gz GSFYGJUZUGSWNA-CQSZACIVSA-N 1 1 369.425 2.915 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2ccc(C[NH+](C)C)o2)c([N+](=O)[O-])c1 ZINC001136872133 996951413 /nfs/dbraw/zinc/95/14/13/996951413.db2.gz FVMNQDRDXLSMPW-UHFFFAOYSA-N 1 1 360.414 2.790 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)[C@@H](c2ccccc2)C1 ZINC001137280139 1016081322 /nfs/dbraw/zinc/08/13/22/1016081322.db2.gz KQVKJEXRFFIUTB-UXHICEINSA-N 1 1 365.433 2.825 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH2+][C@H](c2ccccc2C)C1 ZINC000825170289 997235777 /nfs/dbraw/zinc/23/57/77/997235777.db2.gz WHZGYCSVHFRMBH-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000730841965 997514406 /nfs/dbraw/zinc/51/44/06/997514406.db2.gz UMGURQGRIHBDEO-TXEJJXNPSA-N 1 1 364.402 2.804 20 5 FFBDMO CN(C[C@@](C)(O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000844269023 997754054 /nfs/dbraw/zinc/75/40/54/997754054.db2.gz QYXBWTLJVCPQIE-SFHVURJKSA-N 1 1 367.446 2.645 20 5 FFBDMO O=C(NC1(C2CC[NH+](CCCC3CCCC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000152220 1016246582 /nfs/dbraw/zinc/24/65/82/1016246582.db2.gz ALIGUSUWIGRNAO-QZTJIDSGSA-N 1 1 363.502 2.983 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)[nH+]c1 ZINC000736684258 999565823 /nfs/dbraw/zinc/56/58/23/999565823.db2.gz VDESISNYRKRSLT-UHFFFAOYSA-N 1 1 373.369 2.747 20 5 FFBDMO C[C@@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741032428 999701690 /nfs/dbraw/zinc/70/16/90/999701690.db2.gz FNRSMSXTAOPDOC-UONOGXRCSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@@H](OC(=O)[C@@H](C)[NH+]1CCCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741032429 999701784 /nfs/dbraw/zinc/70/17/84/999701784.db2.gz FNRSMSXTAOPDOC-ZIAGYGMSSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086084073 999754931 /nfs/dbraw/zinc/75/49/31/999754931.db2.gz BJBKHANOGQLGHV-FCGDIQPGSA-N 1 1 359.470 2.535 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000742242107 999765973 /nfs/dbraw/zinc/76/59/73/999765973.db2.gz SDRSDQZGHJHEDT-HNNXBMFYSA-N 1 1 360.458 2.799 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169010307 1000015267 /nfs/dbraw/zinc/01/52/67/1000015267.db2.gz COSOLORFHOAUDC-LVQVYYBASA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036863 1000016698 /nfs/dbraw/zinc/01/66/98/1000016698.db2.gz QIJDEHQFRWOMBH-QUHHJHJSSA-N 1 1 353.463 2.952 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018475 1000017248 /nfs/dbraw/zinc/01/72/48/1000017248.db2.gz CNYAPEJHBNSURC-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018475 1000017249 /nfs/dbraw/zinc/01/72/49/1000017249.db2.gz CNYAPEJHBNSURC-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCn1cc(C[N@@H+](Cc2c(C)nn(C)c2C)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cn1 ZINC001169026336 1000018286 /nfs/dbraw/zinc/01/82/86/1000018286.db2.gz KYJPNWYJRCLXOU-FUHWJXTLSA-N 1 1 374.489 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCOC4(CCOCC4)CC3)c2)cc1 ZINC000768909567 1000383347 /nfs/dbraw/zinc/38/33/47/1000383347.db2.gz XHLBDNSTAOJBCV-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCOC4(CCOCC4)CC3)c2)cc1 ZINC000768909567 1000383352 /nfs/dbraw/zinc/38/33/52/1000383352.db2.gz XHLBDNSTAOJBCV-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc(C(F)F)cc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000674045 1016422657 /nfs/dbraw/zinc/42/26/57/1016422657.db2.gz LJJCQRKDYRSZCK-HZPDHXFCSA-N 1 1 365.380 2.538 20 5 FFBDMO O=C(NCC1=CC[N@H+](Cc2ccc(C(F)F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674045 1016422672 /nfs/dbraw/zinc/42/26/72/1016422672.db2.gz LJJCQRKDYRSZCK-HZPDHXFCSA-N 1 1 365.380 2.538 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc(C(F)F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674045 1016422686 /nfs/dbraw/zinc/42/26/86/1016422686.db2.gz LJJCQRKDYRSZCK-HZPDHXFCSA-N 1 1 365.380 2.538 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C[C@H]1C ZINC001147743444 1000969040 /nfs/dbraw/zinc/96/90/40/1000969040.db2.gz WHNFEBQMYNFJOJ-OLZOCXBDSA-N 1 1 366.437 2.745 20 5 FFBDMO CC[C@H]1CC[C@@H](C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000772357145 1001361659 /nfs/dbraw/zinc/36/16/59/1001361659.db2.gz SPXNZDZWEBEADB-CVEARBPZSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000791058118 1002564469 /nfs/dbraw/zinc/56/44/69/1002564469.db2.gz ARQYOVLDJWLOLX-HNNXBMFYSA-N 1 1 364.402 2.662 20 5 FFBDMO O=C(OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000792235301 1002950304 /nfs/dbraw/zinc/95/03/04/1002950304.db2.gz QEBPUZAXFHLAFG-HNNXBMFYSA-N 1 1 363.370 2.953 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2C[C@H](CO)[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170329359 1003115027 /nfs/dbraw/zinc/11/50/27/1003115027.db2.gz PJSZDRLXKYWKEN-SUHUHFCYSA-N 1 1 362.348 2.637 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](Oc3nccnc3C)C2)c([N+](=O)[O-])c1 ZINC001170354836 1003123306 /nfs/dbraw/zinc/12/33/06/1003123306.db2.gz QBKAVSZTJNUSBE-GUYCJALGSA-N 1 1 372.425 2.786 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170356038 1003123437 /nfs/dbraw/zinc/12/34/37/1003123437.db2.gz UTDANAVADDMQJE-ZIAGYGMSSA-N 1 1 350.415 2.810 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339908 1003130483 /nfs/dbraw/zinc/13/04/83/1003130483.db2.gz KRUIZILUKCRKDN-LSDHHAIUSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339908 1003130493 /nfs/dbraw/zinc/13/04/93/1003130493.db2.gz KRUIZILUKCRKDN-LSDHHAIUSA-N 1 1 374.441 2.509 20 5 FFBDMO Cc1nn(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000772829091 1003311276 /nfs/dbraw/zinc/31/12/76/1003311276.db2.gz RESIOOOLWSYLKI-KSSFIOAISA-N 1 1 370.457 2.554 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc([N+](=O)[O-])c3cnccc13)C2 ZINC001186895523 1003462057 /nfs/dbraw/zinc/46/20/57/1003462057.db2.gz GEXJGDOWZVSXKB-ZDUSSCGKSA-N 1 1 367.409 2.610 20 5 FFBDMO CCN(C)C(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805762634 1004136866 /nfs/dbraw/zinc/13/68/66/1004136866.db2.gz LSFOMMDFRVXPJJ-IRXDYDNUSA-N 1 1 365.430 2.571 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC[C@@H]2C2CCC2)C1=O ZINC000102886117 1004209790 /nfs/dbraw/zinc/20/97/90/1004209790.db2.gz LHSOAHUWIQPKPZ-APWZRJJASA-N 1 1 372.425 2.584 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC001192672284 1004233900 /nfs/dbraw/zinc/23/39/00/1004233900.db2.gz FXZCNTJHJSIICZ-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO COC(=O)c1c(C)[nH]c(C(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC001197647077 1004300558 /nfs/dbraw/zinc/30/05/58/1004300558.db2.gz NCLXIVDRQACBDQ-LLVKDONJSA-N 1 1 359.382 2.860 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000808014203 1004738549 /nfs/dbraw/zinc/73/85/49/1004738549.db2.gz GIOHPHQYWUMUPY-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC001195621919 1005001244 /nfs/dbraw/zinc/00/12/44/1005001244.db2.gz FMGVXENHLDDTSF-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO Cc1ccc(F)cc1C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001050326297 1016971375 /nfs/dbraw/zinc/97/13/75/1016971375.db2.gz WMIQQMGOUGTDGU-BNEJOLLZSA-N 1 1 363.433 2.564 20 5 FFBDMO CC(C)(C)OC(=O)[C@]12COC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C2 ZINC000852487256 1006050560 /nfs/dbraw/zinc/05/05/60/1006050560.db2.gz CPTORKKVHPYSCQ-FZKQIMNGSA-N 1 1 366.389 2.524 20 5 FFBDMO Cc1cc(N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001187765777 1006240859 /nfs/dbraw/zinc/24/08/59/1006240859.db2.gz RHFMHXITGBEHCX-BEFAXECRSA-N 1 1 353.426 2.748 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](Cc1ccccc1C1CC1)CC2 ZINC001050517365 1017034885 /nfs/dbraw/zinc/03/48/85/1017034885.db2.gz QETMRPJJHXFWMD-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498944 1006415717 /nfs/dbraw/zinc/41/57/17/1006415717.db2.gz SKLCGHZBNOFWCB-HZPDHXFCSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498944 1006415721 /nfs/dbraw/zinc/41/57/21/1006415721.db2.gz SKLCGHZBNOFWCB-HZPDHXFCSA-N 1 1 359.430 2.946 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853503304 1006417169 /nfs/dbraw/zinc/41/71/69/1006417169.db2.gz GJNSHIGOBAJSBA-GJZGRUSLSA-N 1 1 357.414 2.559 20 5 FFBDMO CO[C@@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517477 1006422919 /nfs/dbraw/zinc/42/29/19/1006422919.db2.gz URWQOPLPQDPTNB-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517477 1006422921 /nfs/dbraw/zinc/42/29/21/1006422921.db2.gz URWQOPLPQDPTNB-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000853796094 1006538959 /nfs/dbraw/zinc/53/89/59/1006538959.db2.gz RFJKCVQRMUTFTN-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccc([N+](=O)[O-])nc3)C2)O1 ZINC000882980385 1006584834 /nfs/dbraw/zinc/58/48/34/1006584834.db2.gz IGULZHSCFKCICZ-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H](NCc1ccccc1OCC[NH+](C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571426 1006704649 /nfs/dbraw/zinc/70/46/49/1006704649.db2.gz DJAZVZKWJRKSQF-CQSZACIVSA-N 1 1 358.442 2.968 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000816452136 1007061723 /nfs/dbraw/zinc/06/17/23/1007061723.db2.gz WQYQFXVNXJIXTJ-YJBOKZPZSA-N 1 1 372.425 2.635 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000855166197 1007148532 /nfs/dbraw/zinc/14/85/32/1007148532.db2.gz FHACLQSDWVSFDC-HNNXBMFYSA-N 1 1 360.458 2.798 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001190867672 1007820491 /nfs/dbraw/zinc/82/04/91/1007820491.db2.gz LZTJRNFJTZNSIT-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[NH+]1CCOCC1 ZINC000858241842 1008331988 /nfs/dbraw/zinc/33/19/88/1008331988.db2.gz HEFPGKIANUDWLW-LJQANCHMSA-N 1 1 371.437 2.835 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1N[C@H]1C[C@H]2CC[N@@H+](C1)[C@H]2C ZINC001170979469 1008536759 /nfs/dbraw/zinc/53/67/59/1008536759.db2.gz JSVRUIZREVKXCN-AXFHLTTASA-N 1 1 353.806 2.929 20 5 FFBDMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 ZINC000886109398 1008566679 /nfs/dbraw/zinc/56/66/79/1008566679.db2.gz JIEZDPVWEBWKAZ-ZDUSSCGKSA-N 1 1 374.416 2.941 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859611385 1008587265 /nfs/dbraw/zinc/58/72/65/1008587265.db2.gz CVIQYZPVHPUPLL-KBRIMQKVSA-N 1 1 364.442 2.928 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@H]2C)c1C ZINC000890277741 1009107819 /nfs/dbraw/zinc/10/78/19/1009107819.db2.gz QPJICLBLQXOKPZ-CQSZACIVSA-N 1 1 361.442 2.537 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@](C)(O)c1ccccc1 ZINC000823584206 1009121010 /nfs/dbraw/zinc/12/10/10/1009121010.db2.gz CDXQQXSAXNOWIR-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@](C)(O)c1ccccc1 ZINC000823584206 1009121015 /nfs/dbraw/zinc/12/10/15/1009121015.db2.gz CDXQQXSAXNOWIR-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823599450 1009135547 /nfs/dbraw/zinc/13/55/47/1009135547.db2.gz UKHQXQZBOFVSLE-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823599450 1009135551 /nfs/dbraw/zinc/13/55/51/1009135551.db2.gz UKHQXQZBOFVSLE-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](CNC(=O)C[N@@H+](C)CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC001179398486 1009323175 /nfs/dbraw/zinc/32/31/75/1009323175.db2.gz IJIQRRVJCPXMGP-INIZCTEOSA-N 1 1 355.438 2.989 20 5 FFBDMO C[C@H](CNC(=O)C[N@@H+](C)CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC001179398487 1009323596 /nfs/dbraw/zinc/32/35/96/1009323596.db2.gz IJIQRRVJCPXMGP-MRXNPFEDSA-N 1 1 355.438 2.989 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134873217 1009497207 /nfs/dbraw/zinc/49/72/07/1009497207.db2.gz AEJMGEZJPBMYLI-BEFAXECRSA-N 1 1 372.469 2.790 20 5 FFBDMO C[C@@H]1Cc2cc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc2O1 ZINC001179937397 1009498153 /nfs/dbraw/zinc/49/81/53/1009498153.db2.gz LWLWOWHNJGRQDE-CZUORRHYSA-N 1 1 354.410 3.000 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000864630502 1010535025 /nfs/dbraw/zinc/53/50/25/1010535025.db2.gz MZXZTQVXNYGATF-INIZCTEOSA-N 1 1 357.385 2.667 20 5 FFBDMO COc1ccc(CN(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1C ZINC000867945962 1011127677 /nfs/dbraw/zinc/12/76/77/1011127677.db2.gz AWXYKRIGHBCLSS-LJQANCHMSA-N 1 1 357.410 2.744 20 5 FFBDMO CC(C)(C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870081410 1012111317 /nfs/dbraw/zinc/11/13/17/1012111317.db2.gz GFOCTZDBGYPQKM-GOSISDBHSA-N 1 1 369.421 2.751 20 5 FFBDMO CCOC(=O)[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCS1 ZINC001172911620 1012122692 /nfs/dbraw/zinc/12/26/92/1012122692.db2.gz DBFRKMKXRPOFFE-NVXWUHKLSA-N 1 1 364.467 2.823 20 5 FFBDMO CC(C)(O)CC[NH+]1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172913557 1012125266 /nfs/dbraw/zinc/12/52/66/1012125266.db2.gz RTUFENCQUQZJEV-SFHVURJKSA-N 1 1 361.486 2.621 20 5 FFBDMO COC[C@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010691 1012182313 /nfs/dbraw/zinc/18/23/13/1012182313.db2.gz XUGBYRPAIWGVDV-CYBMUJFWSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[NH2+]2)cc1 ZINC000870144415 1012194661 /nfs/dbraw/zinc/19/46/61/1012194661.db2.gz CSCMGMJIKBYOGA-QGZVFWFLSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@H]2CCCN(C(C)=O)C2)c1F ZINC001173191460 1012333182 /nfs/dbraw/zinc/33/31/82/1012333182.db2.gz FKBXUVGSJHVORN-JSGCOSHPSA-N 1 1 367.421 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1F ZINC001173191724 1012333340 /nfs/dbraw/zinc/33/33/40/1012333340.db2.gz GTIDEWLUHUJCAL-MCIONIFRSA-N 1 1 351.422 2.842 20 5 FFBDMO CCOC1CC2(C[C@@H]2C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000870376618 1012340561 /nfs/dbraw/zinc/34/05/61/1012340561.db2.gz CBCJWZGQEKYAEU-SARBKMAYSA-N 1 1 374.437 2.918 20 5 FFBDMO CCOC1CC2(C[C@@H]2C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000870376618 1012340578 /nfs/dbraw/zinc/34/05/78/1012340578.db2.gz CBCJWZGQEKYAEU-SARBKMAYSA-N 1 1 374.437 2.918 20 5 FFBDMO CCOC(=O)c1cc2n(n1)CCC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173220802 1012352053 /nfs/dbraw/zinc/35/20/53/1012352053.db2.gz CPRWAWXBWCFAOY-CQSZACIVSA-N 1 1 372.425 2.805 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cnn(C)c21 ZINC001173224346 1012358370 /nfs/dbraw/zinc/35/83/70/1012358370.db2.gz JOYUKZMMMCRNJK-RHSMWYFYSA-N 1 1 358.442 2.895 20 5 FFBDMO CC[NH+](CC)CCCN1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173232898 1012364532 /nfs/dbraw/zinc/36/45/32/1012364532.db2.gz JCAOECYSCUZLOQ-GOSISDBHSA-N 1 1 362.518 2.875 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CCC1(C)C ZINC000871150397 1012752335 /nfs/dbraw/zinc/75/23/35/1012752335.db2.gz NKLMKLCTXAXAHL-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]21 ZINC000827331027 1017640666 /nfs/dbraw/zinc/64/06/66/1017640666.db2.gz VDEQQFDTMWLZEJ-CZUORRHYSA-N 1 1 372.450 2.885 20 5 FFBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106424 1018368900 /nfs/dbraw/zinc/36/89/00/1018368900.db2.gz ZYQXAIWJOWYFMI-RHSMWYFYSA-N 1 1 363.458 2.897 20 5 FFBDMO CCOc1ccc([C@@H](C)NC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106424 1018368910 /nfs/dbraw/zinc/36/89/10/1018368910.db2.gz ZYQXAIWJOWYFMI-RHSMWYFYSA-N 1 1 363.458 2.897 20 5 FFBDMO O=[N+]([O-])c1cc(-c2cc(C[N@@H+]3CCC[C@@H]3CO)on2)ccc1N1CCCC1 ZINC000901398617 1019043102 /nfs/dbraw/zinc/04/31/02/1019043102.db2.gz WSKUKYGJMIFTLM-OAHLLOKOSA-N 1 1 372.425 2.807 20 5 FFBDMO C[C@]1(NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000406045875 1032844108 /nfs/dbraw/zinc/84/41/08/1032844108.db2.gz UZTCIQBUAQRDBL-IBGZPJMESA-N 1 1 354.410 2.571 20 5 FFBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@H]1C[N@H+](C(C)C)CCO1 ZINC000802138834 1019788691 /nfs/dbraw/zinc/78/86/91/1019788691.db2.gz PVFWYZVRTZHDOO-FUHWJXTLSA-N 1 1 364.442 2.816 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@H+](Cn2nccc2[N+](=O)[O-])C2CC2)CC1 ZINC000725773646 1020256344 /nfs/dbraw/zinc/25/63/44/1020256344.db2.gz KZSIJZKGKPPTHI-UHFFFAOYSA-N 1 1 365.434 2.613 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@@H+](Cn2nccc2[N+](=O)[O-])C2CC2)CC1 ZINC000725773646 1020256350 /nfs/dbraw/zinc/25/63/50/1020256350.db2.gz KZSIJZKGKPPTHI-UHFFFAOYSA-N 1 1 365.434 2.613 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@@]2(C)CN(C)C[C@]2(C)C1 ZINC000931307643 1020414157 /nfs/dbraw/zinc/41/41/57/1020414157.db2.gz NOKLCXGXDPBTRT-RTBURBONSA-N 1 1 360.458 2.505 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C(=O)OC(C)(C)C ZINC000828917136 1032904363 /nfs/dbraw/zinc/90/43/63/1032904363.db2.gz DOOLIINGPWUFHC-COXVUDFISA-N 1 1 364.442 2.928 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932138798 1020718164 /nfs/dbraw/zinc/71/81/64/1020718164.db2.gz YUFULMLGUDTRJT-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932138798 1020718171 /nfs/dbraw/zinc/71/81/71/1020718171.db2.gz YUFULMLGUDTRJT-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932142288 1020721741 /nfs/dbraw/zinc/72/17/41/1020721741.db2.gz BJBZYPQBAKRDEV-ZDUSSCGKSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932142287 1020721758 /nfs/dbraw/zinc/72/17/58/1020721758.db2.gz BJBZYPQBAKRDEV-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000749601187 1021012324 /nfs/dbraw/zinc/01/23/24/1021012324.db2.gz DZYVWWXFDHZJPP-AWEZNQCLSA-N 1 1 364.402 2.887 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000749667118 1021018893 /nfs/dbraw/zinc/01/88/93/1021018893.db2.gz VIOHJILCKSGOCM-QZTJIDSGSA-N 1 1 352.394 2.741 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](Cc3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000933571835 1021033628 /nfs/dbraw/zinc/03/36/28/1021033628.db2.gz FDLSOJGIEGDYDA-GFCCVEGCSA-N 1 1 364.377 2.889 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](Cc3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000933571835 1021033632 /nfs/dbraw/zinc/03/36/32/1021033632.db2.gz FDLSOJGIEGDYDA-GFCCVEGCSA-N 1 1 364.377 2.889 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000749813463 1021043423 /nfs/dbraw/zinc/04/34/23/1021043423.db2.gz ZSFSKAMKKDDKDD-HNNXBMFYSA-N 1 1 365.430 2.915 20 5 FFBDMO Cc1nn(C[N@H+](C)CCN(C)c2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000749954555 1021162453 /nfs/dbraw/zinc/16/24/53/1021162453.db2.gz XSMJPSOBSJVMOG-UHFFFAOYSA-N 1 1 354.414 2.674 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2Cc3ncccc3N3CCC[C@H]3C2)c1 ZINC000934491439 1021258580 /nfs/dbraw/zinc/25/85/80/1021258580.db2.gz SPHGXZQDLHFUNK-LPHOPBHVSA-N 1 1 354.410 2.508 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934840508 1021423558 /nfs/dbraw/zinc/42/35/58/1021423558.db2.gz FXJOBENBFZHDIU-DLBZAZTESA-N 1 1 373.453 2.623 20 5 FFBDMO COC(=O)C[C@@H]([NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754515855 1023481443 /nfs/dbraw/zinc/48/14/43/1023481443.db2.gz BSBPCXAGMGBBSU-QMTHXVAHSA-N 1 1 360.370 2.637 20 5 FFBDMO CCOc1cc(C[N@@H+](CCC(=O)OC)C2CCOCC2)ccc1[N+](=O)[O-] ZINC000755038802 1023557996 /nfs/dbraw/zinc/55/79/96/1023557996.db2.gz CLBYCGURIQBMAL-UHFFFAOYSA-N 1 1 366.414 2.538 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000755676489 1023622600 /nfs/dbraw/zinc/62/26/00/1023622600.db2.gz AIBWXOLTQIDJCN-QWSHFYNQSA-N 1 1 362.426 2.898 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3nccc(C)n3)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000758245553 1023991485 /nfs/dbraw/zinc/99/14/85/1023991485.db2.gz HVHPHZGAJIIMJL-UHFFFAOYSA-N 1 1 367.413 2.583 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC001124639917 1024354626 /nfs/dbraw/zinc/35/46/26/1024354626.db2.gz NJZYGBXAEWODKL-STQMWFEESA-N 1 1 367.421 2.660 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)C1 ZINC000840085189 1026950370 /nfs/dbraw/zinc/95/03/70/1026950370.db2.gz BIGNFPRHJVSKAI-IBGZPJMESA-N 1 1 355.442 2.834 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000840184054 1027000970 /nfs/dbraw/zinc/00/09/70/1027000970.db2.gz JFLNDUIOKGATPT-SFHVURJKSA-N 1 1 358.398 2.691 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000840370562 1027063627 /nfs/dbraw/zinc/06/36/27/1027063627.db2.gz YLKJTUHQBJRDLF-HNNXBMFYSA-N 1 1 368.437 2.665 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](C/C=C/c2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160096963 1027588255 /nfs/dbraw/zinc/58/82/55/1027588255.db2.gz CQHZEFXPEPAUSU-LVLPYEQSSA-N 1 1 355.438 2.503 20 5 FFBDMO O=C(NCCC1=CC[N@H+](C/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160096963 1027588267 /nfs/dbraw/zinc/58/82/67/1027588267.db2.gz CQHZEFXPEPAUSU-LVLPYEQSSA-N 1 1 355.438 2.503 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](C/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160096963 1027588273 /nfs/dbraw/zinc/58/82/73/1027588273.db2.gz CQHZEFXPEPAUSU-LVLPYEQSSA-N 1 1 355.438 2.503 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000093534360 1027752344 /nfs/dbraw/zinc/75/23/44/1027752344.db2.gz OGVARNWHSPWFTA-CQSZACIVSA-N 1 1 357.370 2.893 20 5 FFBDMO CC[N@H+](Cc1ccccc1C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957712988 1028582771 /nfs/dbraw/zinc/58/27/71/1028582771.db2.gz FIYXXHMAEFCCGZ-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@@H+](Cc1ccccc1C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712988 1028582781 /nfs/dbraw/zinc/58/27/81/1028582781.db2.gz FIYXXHMAEFCCGZ-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@H+](Cc1ccccc1C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712988 1028582786 /nfs/dbraw/zinc/58/27/86/1028582786.db2.gz FIYXXHMAEFCCGZ-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO C[NH+](C)C=Cc1cc(NCCCC(=O)c2cccnc2)ncc1[N+](=O)[O-] ZINC001163179256 1028832396 /nfs/dbraw/zinc/83/23/96/1028832396.db2.gz PSDUILOFHLSSDC-JXMROGBWSA-N 1 1 355.398 2.992 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2CCCC[C@H]21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000245612876 1029044366 /nfs/dbraw/zinc/04/43/66/1029044366.db2.gz WPEMUKSYYJMMQQ-GXTWGEPZSA-N 1 1 361.398 2.917 20 5 FFBDMO Cc1[nH+]ccn1CCNc1ncccc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC001163917179 1029115188 /nfs/dbraw/zinc/11/51/88/1029115188.db2.gz XFEOBEOQFNOVTC-UHFFFAOYSA-N 1 1 366.381 2.859 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC001164124145 1029179624 /nfs/dbraw/zinc/17/96/24/1029179624.db2.gz BNEGHRNHAWOFPK-PWSUYJOCSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001164124145 1029179632 /nfs/dbraw/zinc/17/96/32/1029179632.db2.gz BNEGHRNHAWOFPK-PWSUYJOCSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)c1 ZINC001165089304 1029380369 /nfs/dbraw/zinc/38/03/69/1029380369.db2.gz TUBMRDFKGLAKAP-HOCLYGCPSA-N 1 1 374.828 2.592 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CCC2(CCC[N@H+]2C)CC1 ZINC000782355233 1029669961 /nfs/dbraw/zinc/66/99/61/1029669961.db2.gz CSSJXUYOCQSZRN-UHFFFAOYSA-N 1 1 365.405 2.975 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782509787 1029725282 /nfs/dbraw/zinc/72/52/82/1029725282.db2.gz QVRDQORDRXMNDS-ZIAGYGMSSA-N 1 1 366.437 2.867 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782509787 1029725288 /nfs/dbraw/zinc/72/52/88/1029725288.db2.gz QVRDQORDRXMNDS-ZIAGYGMSSA-N 1 1 366.437 2.867 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CC2CC1(C[NH3+])C2 ZINC001158186325 1029752096 /nfs/dbraw/zinc/75/20/96/1029752096.db2.gz FOTCJAHGDBNLOO-UDOFLQGHSA-N 1 1 359.473 2.813 20 5 FFBDMO C[N@@H+](C1CN(c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)C1)[C@@H]1CCOC1 ZINC001165205019 1029891437 /nfs/dbraw/zinc/89/14/37/1029891437.db2.gz FZSPYPLHDHECGQ-GFCCVEGCSA-N 1 1 362.817 2.706 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)Cn1cncn1 ZINC001142130192 1030071298 /nfs/dbraw/zinc/07/12/98/1030071298.db2.gz VDIPUAVYMGQTEL-UHFFFAOYSA-N 1 1 360.421 2.993 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001142221484 1030181226 /nfs/dbraw/zinc/18/12/26/1030181226.db2.gz FGGBLTJMDFYMNU-UONOGXRCSA-N 1 1 371.441 2.835 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@H]3CCOC3)CC2)nc1-c1ccncc1 ZINC000784006541 1030409289 /nfs/dbraw/zinc/40/92/89/1030409289.db2.gz YVPFBIXAVDYDFX-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)CC1 ZINC000798957449 1031595428 /nfs/dbraw/zinc/59/54/28/1031595428.db2.gz XLYRNCMXEKJZEO-UHFFFAOYSA-N 1 1 361.442 2.674 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000798965081 1031597329 /nfs/dbraw/zinc/59/73/29/1031597329.db2.gz XXGXYEQYVCEJET-OAHLLOKOSA-N 1 1 371.393 2.531 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1[N+](=O)[O-] ZINC001205503804 1031795196 /nfs/dbraw/zinc/79/51/96/1031795196.db2.gz JVDAFEXWKGUFBL-UHFFFAOYSA-N 1 1 361.354 2.892 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ncc(Br)cc1[N+](=O)[O-] ZINC001225750602 1034394692 /nfs/dbraw/zinc/39/46/92/1034394692.db2.gz ONBIBQHOMOPXBJ-DDFAGTSDSA-N 1 1 356.220 2.861 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O ZINC000832954766 1035040400 /nfs/dbraw/zinc/04/04/00/1035040400.db2.gz VKAXCPQPVFNUPL-LLVKDONJSA-N 1 1 368.409 2.543 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC001139721309 1035207518 /nfs/dbraw/zinc/20/75/18/1035207518.db2.gz DQEQTQVOSVUBET-UHFFFAOYSA-N 1 1 351.834 2.949 20 5 FFBDMO OC[C@@H]1CCn2nccc2C[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232229314 1035507771 /nfs/dbraw/zinc/50/77/71/1035507771.db2.gz ZWWZTQGYZYEFNZ-IBGZPJMESA-N 1 1 359.433 2.746 20 5 FFBDMO OC[C@@H]1CCn2nccc2C[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232229314 1035507776 /nfs/dbraw/zinc/50/77/76/1035507776.db2.gz ZWWZTQGYZYEFNZ-IBGZPJMESA-N 1 1 359.433 2.746 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227452894 1035562258 /nfs/dbraw/zinc/56/22/58/1035562258.db2.gz SDGWGWRQYPBOFC-MRXNPFEDSA-N 1 1 354.406 2.783 20 5 FFBDMO CC(C)(CCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[N+](=O)[O-] ZINC000835458121 1035777315 /nfs/dbraw/zinc/77/73/15/1035777315.db2.gz OXCKVBPNFQOXSZ-HNNXBMFYSA-N 1 1 365.386 2.548 20 5 FFBDMO CC(C)(CCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[N+](=O)[O-] ZINC000835458121 1035777330 /nfs/dbraw/zinc/77/73/30/1035777330.db2.gz OXCKVBPNFQOXSZ-HNNXBMFYSA-N 1 1 365.386 2.548 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnc2n1CCCC2 ZINC000835458924 1035777895 /nfs/dbraw/zinc/77/78/95/1035777895.db2.gz WDDHXWGMACHIOX-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnc2n1CCCC2 ZINC000835458924 1035777915 /nfs/dbraw/zinc/77/79/15/1035777915.db2.gz WDDHXWGMACHIOX-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO Cc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c([N+](=O)[O-])cc1Br ZINC001228001123 1035863458 /nfs/dbraw/zinc/86/34/58/1035863458.db2.gz MVDGZMVCMGUZKU-TURKWSHLSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])cc1Br ZINC001228001123 1035863474 /nfs/dbraw/zinc/86/34/74/1035863474.db2.gz MVDGZMVCMGUZKU-TURKWSHLSA-N 1 1 369.215 2.849 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]1[N@H+]2C ZINC001228759045 1036307572 /nfs/dbraw/zinc/30/75/72/1036307572.db2.gz RQRDYGMUCDVLFD-GDJRKYJOSA-N 1 1 354.790 2.794 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC001140895722 1036404463 /nfs/dbraw/zinc/40/44/63/1036404463.db2.gz GAWKMCWKICXDBQ-OAHLLOKOSA-N 1 1 368.437 2.771 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC001229455651 1036686332 /nfs/dbraw/zinc/68/63/32/1036686332.db2.gz KXPCFAAUCYWHRA-SOLBZPMBSA-N 1 1 355.394 2.518 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1cc(N2CCOCC2)ccc1[N+](=O)[O-] ZINC001234363481 1037005351 /nfs/dbraw/zinc/00/53/51/1037005351.db2.gz JHODDGXRRHZSRC-QWHZDKJVSA-N 1 1 361.442 2.541 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2c([O-])ccc3c([O-])c4c(=O)cc(O)cc-4oc32)CC1 ZINC001234751652 1037169438 /nfs/dbraw/zinc/16/94/38/1037169438.db2.gz BVAWYWWRQNHWQG-GFCCVEGCSA-N 1 1 371.389 2.926 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@@H]2CCC[N@@H+]([C@@H](C)c3ccccn3)C2)n1 ZINC001234881021 1037222492 /nfs/dbraw/zinc/22/24/92/1037222492.db2.gz KXFITKCMJBRMKS-UONOGXRCSA-N 1 1 358.398 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)n1 ZINC001234881021 1037222504 /nfs/dbraw/zinc/22/25/04/1037222504.db2.gz KXFITKCMJBRMKS-UONOGXRCSA-N 1 1 358.398 2.998 20 5 FFBDMO COc1cc(N2CCC(N3CCC[N@H+]4CCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099560 1038383641 /nfs/dbraw/zinc/38/36/41/1038383641.db2.gz RMNKVYHRRDPSJT-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCCN4CCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099560 1038383655 /nfs/dbraw/zinc/38/36/55/1038383655.db2.gz RMNKVYHRRDPSJT-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCN4CCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099560 1038383670 /nfs/dbraw/zinc/38/36/70/1038383670.db2.gz RMNKVYHRRDPSJT-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3c[nH]c4cc([N+](=O)[O-])ccc43)o2)C[C@H](C)O1 ZINC001258037720 1039137963 /nfs/dbraw/zinc/13/79/63/1039137963.db2.gz ZXAPKYYQQMYGGK-TXEJJXNPSA-N 1 1 371.397 2.778 20 5 FFBDMO N[C@@H](Cc1[nH]cc[nH+]1)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247344645 1039721985 /nfs/dbraw/zinc/72/19/85/1039721985.db2.gz HVTOIVRWJLTRKU-ZDUSSCGKSA-N 1 1 357.377 2.799 20 5 FFBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2ccc3c(c2)OCCO3)no1 ZINC001247665224 1039874673 /nfs/dbraw/zinc/87/46/73/1039874673.db2.gz BMSYPDGCPDZJOA-ZDUSSCGKSA-N 1 1 368.349 2.659 20 5 FFBDMO COc1nccc(C)c1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248208847 1040172390 /nfs/dbraw/zinc/17/23/90/1040172390.db2.gz LZPKTWYARHUCAW-CYBMUJFWSA-N 1 1 355.354 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@H](CO)[C@@H](C(F)(F)F)C3)CC2)cc1 ZINC001254473914 1040739350 /nfs/dbraw/zinc/73/93/50/1040739350.db2.gz JLJOCBHQSMWTNO-WBMJQRKESA-N 1 1 373.375 2.666 20 5 FFBDMO CC(=O)N1CCC[C@@H]([N@@H+](C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480308 1040746706 /nfs/dbraw/zinc/74/67/06/1040746706.db2.gz DQLQHRKZPCGNBQ-LJQANCHMSA-N 1 1 360.458 2.506 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cnn(C)c21 ZINC001254560673 1040796032 /nfs/dbraw/zinc/79/60/32/1040796032.db2.gz HAQHAFPOKAPWLS-RHSMWYFYSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001254555886 1040796151 /nfs/dbraw/zinc/79/61/51/1040796151.db2.gz IVKYXKVBQMCOKU-ZUIJCZDSSA-N 1 1 369.421 2.900 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001254555886 1040796166 /nfs/dbraw/zinc/79/61/66/1040796166.db2.gz IVKYXKVBQMCOKU-ZUIJCZDSSA-N 1 1 369.421 2.900 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598340 1040827750 /nfs/dbraw/zinc/82/77/50/1040827750.db2.gz WLDKFGGMFXDYAH-AEFFLSMTSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598340 1040827762 /nfs/dbraw/zinc/82/77/62/1040827762.db2.gz WLDKFGGMFXDYAH-AEFFLSMTSA-N 1 1 370.453 2.914 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254601376 1040831599 /nfs/dbraw/zinc/83/15/99/1040831599.db2.gz YZEYEOSWEWKRCV-GUYCJALGSA-N 1 1 361.442 2.909 20 5 FFBDMO C[NH+]1CCN(c2ccc3nc(Cc4ccccc4[N+](=O)[O-])[nH]c3c2)CC1 ZINC001250617318 1041267193 /nfs/dbraw/zinc/26/71/93/1041267193.db2.gz SWGBTCKHWOZHJI-UHFFFAOYSA-N 1 1 351.410 2.814 20 5 FFBDMO Cc1ccc(F)cc1C[NH+]1CCC(C)(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001278608156 1041405756 /nfs/dbraw/zinc/40/57/56/1041405756.db2.gz XGKJQHTZCDAMRF-IAGOWNOFSA-N 1 1 363.433 2.518 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3cc(F)cc([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001216480388 1042038200 /nfs/dbraw/zinc/03/82/00/1042038200.db2.gz ACMRIFWDHQIQDN-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3cc(F)cc([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001216480388 1042038205 /nfs/dbraw/zinc/03/82/05/1042038205.db2.gz ACMRIFWDHQIQDN-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC001265595997 1042868963 /nfs/dbraw/zinc/86/89/63/1042868963.db2.gz QGULEOBMQADMCM-UHFFFAOYSA-N 1 1 374.372 2.795 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000702164210 1042884196 /nfs/dbraw/zinc/88/41/96/1042884196.db2.gz TWSRJNFLWYDWFG-KRWDZBQOSA-N 1 1 358.417 2.962 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001310506384 1043699041 /nfs/dbraw/zinc/69/90/41/1043699041.db2.gz CGRJJUPEKNIAFP-SNVBAGLBSA-N 1 1 357.208 2.573 20 5 FFBDMO CC[N@H+]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@H](C)C1 ZINC001312638188 1044148156 /nfs/dbraw/zinc/14/81/56/1044148156.db2.gz PUNPQYZDONMPCJ-LLVKDONJSA-N 1 1 374.363 2.849 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@H]3CCCC[C@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001318012019 1045191449 /nfs/dbraw/zinc/19/14/49/1045191449.db2.gz AEBIYFKNEGHRDO-KEYYUXOJSA-N 1 1 357.410 2.739 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC001319847559 1045284307 /nfs/dbraw/zinc/28/43/07/1045284307.db2.gz OHJFKUABIOMIJF-UHFFFAOYSA-N 1 1 374.622 2.612 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)N2CCS[C@@H]2c2ccc([N+](=O)[O-])cc2)no1 ZINC001320255221 1045376642 /nfs/dbraw/zinc/37/66/42/1045376642.db2.gz SOYOGCSPQGKDIT-MRXNPFEDSA-N 1 1 362.411 2.532 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC001320383531 1045400577 /nfs/dbraw/zinc/40/05/77/1045400577.db2.gz XYVMQCXBJKRYQK-CYBMUJFWSA-N 1 1 352.398 2.731 20 5 FFBDMO Cc1c(C(=O)OCCc2ccc([N+](=O)[O-])cc2)cnn1-c1cc[nH+]cc1 ZINC001320636580 1045440747 /nfs/dbraw/zinc/44/07/47/1045440747.db2.gz JGHPKVZVRKECPJ-UHFFFAOYSA-N 1 1 352.350 2.883 20 5 FFBDMO O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccn(-c2cc[nH+]cc2)n1 ZINC001321172960 1045572941 /nfs/dbraw/zinc/57/29/41/1045572941.db2.gz ADQLRCXXAPINEE-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001324939347 1046297733 /nfs/dbraw/zinc/29/77/33/1046297733.db2.gz GFJZCRIBKAAVAB-LBPRGKRZSA-N 1 1 357.332 2.924 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001326417179 1046924077 /nfs/dbraw/zinc/92/40/77/1046924077.db2.gz ICLPLOATENURSQ-INIZCTEOSA-N 1 1 364.398 2.689 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001326417179 1046924090 /nfs/dbraw/zinc/92/40/90/1046924090.db2.gz ICLPLOATENURSQ-INIZCTEOSA-N 1 1 364.398 2.689 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC001326665579 1047026765 /nfs/dbraw/zinc/02/67/65/1047026765.db2.gz AWQCENFRKYAMQF-UHFFFAOYSA-N 1 1 367.405 2.775 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC001331329578 1047868318 /nfs/dbraw/zinc/86/83/18/1047868318.db2.gz JMHKTJCOOVIVFX-WFASDCNBSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001328886336 1048502667 /nfs/dbraw/zinc/50/26/67/1048502667.db2.gz VYOHFJFDMGQWQW-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001328886336 1048502672 /nfs/dbraw/zinc/50/26/72/1048502672.db2.gz VYOHFJFDMGQWQW-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001329818280 1048924457 /nfs/dbraw/zinc/92/44/57/1048924457.db2.gz HXVCURFEASWCTA-NVXWUHKLSA-N 1 1 363.433 2.708 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)CC[C@@H](O)c1ccccc1)CC2 ZINC001340616653 1050997707 /nfs/dbraw/zinc/99/77/07/1050997707.db2.gz SEXMGEFSDAYFEO-WOJBJXKFSA-N 1 1 356.422 2.828 20 5 FFBDMO C[C@H]1[C@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001303802578 1051451771 /nfs/dbraw/zinc/45/17/71/1051451771.db2.gz ZLAZBNOHIFUZHB-CMPLNLGQSA-N 1 1 374.363 2.624 20 5 FFBDMO CCN(c1nnc([C@H](C)[N+](=O)[O-])n1C)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001341358505 1051718213 /nfs/dbraw/zinc/71/82/13/1051718213.db2.gz HAPLULUUIGCPAP-VYDXJSESSA-N 1 1 372.473 2.815 20 5 FFBDMO C[N@H+]1CC[C@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC001306167685 1052050097 /nfs/dbraw/zinc/05/00/97/1052050097.db2.gz CUWAUGWMWKLLCK-LPHOPBHVSA-N 1 1 368.437 2.816 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)ncc1[N+](=O)[O-] ZINC001307233919 1052273791 /nfs/dbraw/zinc/27/37/91/1052273791.db2.gz JYEJXKOQCVHRQU-GMTAPVOTSA-N 1 1 355.236 2.813 20 5 FFBDMO CC(C)(C)[C@@H](CO)[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307679921 1052335007 /nfs/dbraw/zinc/33/50/07/1052335007.db2.gz OUNLEIXGQAZEPU-GFCCVEGCSA-N 1 1 354.794 2.795 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001307710062 1052339591 /nfs/dbraw/zinc/33/95/91/1052339591.db2.gz PNWJFUFGUWMLHP-NOZJJQNGSA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001307710062 1052339600 /nfs/dbraw/zinc/33/96/00/1052339600.db2.gz PNWJFUFGUWMLHP-NOZJJQNGSA-N 1 1 352.778 2.501 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001308162436 1052421616 /nfs/dbraw/zinc/42/16/16/1052421616.db2.gz XRMOIUISSAPLRW-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001308162436 1052421619 /nfs/dbraw/zinc/42/16/19/1052421619.db2.gz XRMOIUISSAPLRW-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO COC(=O)[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001344042439 1052562543 /nfs/dbraw/zinc/56/25/43/1052562543.db2.gz ICBQFDHITBZUIQ-ZLKJLUDKSA-N 1 1 360.370 2.637 20 5 FFBDMO COc1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC001345728340 1052590983 /nfs/dbraw/zinc/59/09/83/1052590983.db2.gz USIUVIRSDUGWPT-CYBMUJFWSA-N 1 1 350.419 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1-c1noc(C(C)(C)C[NH+]2CCOCC2)n1 ZINC001335180554 1053247523 /nfs/dbraw/zinc/24/75/23/1053247523.db2.gz IOYLVDJXTIERIK-UHFFFAOYSA-N 1 1 360.414 2.871 20 5 FFBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(=O)N1CCCC1 ZINC001349804015 1055476641 /nfs/dbraw/zinc/47/66/41/1055476641.db2.gz UMKGAAUPCXKGCZ-UHFFFAOYSA-N 1 1 370.247 2.848 20 5 FFBDMO C[NH+](C)C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001338447961 1055523230 /nfs/dbraw/zinc/52/32/30/1055523230.db2.gz GDFQTPRJGMYKBX-KRWDZBQOSA-N 1 1 374.416 2.955 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC001544296743 1071624030 /nfs/dbraw/zinc/62/40/30/1071624030.db2.gz FWSPIJRISFMBLC-KRWDZBQOSA-N 1 1 368.437 2.940 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(C(C)(C)c3ccc([N+](=O)[O-])cc3)n2C)CC1 ZINC001339377092 1056389630 /nfs/dbraw/zinc/38/96/30/1056389630.db2.gz UVYOPVVQKCSAJO-UHFFFAOYSA-N 1 1 372.473 2.581 20 5 FFBDMO C[N@@H+](CCc1cccc(NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC001446972926 1058578914 /nfs/dbraw/zinc/57/89/14/1058578914.db2.gz LBHGJCDBEIEJFX-IBGZPJMESA-N 1 1 369.421 2.904 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001472448595 1058650146 /nfs/dbraw/zinc/65/01/46/1058650146.db2.gz OGKIZJRUDVHILA-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001451478844 1059118304 /nfs/dbraw/zinc/11/83/04/1059118304.db2.gz ZONOHWKXQCEVIP-QGZVFWFLSA-N 1 1 362.389 2.930 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC001520129937 1059417043 /nfs/dbraw/zinc/41/70/43/1059417043.db2.gz XEIZKAUHCJOMQZ-CHWSQXEVSA-N 1 1 350.419 2.940 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001455007862 1059669251 /nfs/dbraw/zinc/66/92/51/1059669251.db2.gz DQKRHNYIDWQFAP-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001515868545 1059854706 /nfs/dbraw/zinc/85/47/06/1059854706.db2.gz MZSXFERPPYVVHY-INIZCTEOSA-N 1 1 374.445 2.725 20 5 FFBDMO O=C1CCCN1C1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848478606 1060109546 /nfs/dbraw/zinc/10/95/46/1060109546.db2.gz PKAWUBNSEYDDND-UHFFFAOYSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000848488424 1060135761 /nfs/dbraw/zinc/13/57/61/1060135761.db2.gz BLDUNDQHVCSNLH-PKOBYXMFSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000848488424 1060135766 /nfs/dbraw/zinc/13/57/66/1060135766.db2.gz BLDUNDQHVCSNLH-PKOBYXMFSA-N 1 1 366.421 2.753 20 5 FFBDMO CC(C)[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC001457091762 1060274607 /nfs/dbraw/zinc/27/46/07/1060274607.db2.gz ZOVWMKGFIARFCA-WMLDXEAASA-N 1 1 371.441 2.806 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1 ZINC000848584454 1060310757 /nfs/dbraw/zinc/31/07/57/1060310757.db2.gz YMTCSBZAULEFBQ-UHFFFAOYSA-N 1 1 368.340 2.668 20 5 FFBDMO C[N@@H+](CCn1nnc(-c2ccccc2[N+](=O)[O-])n1)Cc1ccc(F)cc1 ZINC001459288074 1060737909 /nfs/dbraw/zinc/73/79/09/1060737909.db2.gz GVVOUOPYPFCVEC-UHFFFAOYSA-N 1 1 356.361 2.519 20 5 FFBDMO CC(C)(C)OC[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001460746147 1061087838 /nfs/dbraw/zinc/08/78/38/1061087838.db2.gz GDFODFATLSIQEH-INIZCTEOSA-N 1 1 361.442 2.763 20 5 FFBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001460746147 1061087854 /nfs/dbraw/zinc/08/78/54/1061087854.db2.gz GDFODFATLSIQEH-INIZCTEOSA-N 1 1 361.442 2.763 20 5 FFBDMO Cc1cc([C@@H]2CCCC[N@@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837715 1061124445 /nfs/dbraw/zinc/12/44/45/1061124445.db2.gz YIRKRWGEUSLJEE-ZBFHGGJFSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1cc([C@@H]2CCCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837715 1061124451 /nfs/dbraw/zinc/12/44/51/1061124451.db2.gz YIRKRWGEUSLJEE-ZBFHGGJFSA-N 1 1 360.414 2.593 20 5 FFBDMO COc1ccc(CNc2cccc(C[NH+]3CCN(C)CC3)c2)cc1[N+](=O)[O-] ZINC001461095299 1061210873 /nfs/dbraw/zinc/21/08/73/1061210873.db2.gz BBMSTWRPAULGOA-UHFFFAOYSA-N 1 1 370.453 2.963 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001546208133 1061310706 /nfs/dbraw/zinc/31/07/06/1061310706.db2.gz GMCQQGRNPUGWEX-HOCLYGCPSA-N 1 1 368.437 2.817 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001462244072 1061552102 /nfs/dbraw/zinc/55/21/02/1061552102.db2.gz NPSQZQWZGIKGDU-INIZCTEOSA-N 1 1 361.442 2.887 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(c3nccc(C)n3)CC2)c1[N+](=O)[O-] ZINC001462633782 1061699069 /nfs/dbraw/zinc/69/90/69/1061699069.db2.gz IEQXANRGNJFSGD-UHFFFAOYSA-N 1 1 358.398 2.787 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC001463220333 1061999419 /nfs/dbraw/zinc/99/94/19/1061999419.db2.gz CJJYELZTXFTOEU-CYBMUJFWSA-N 1 1 370.247 2.500 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC001532914489 1063207030 /nfs/dbraw/zinc/20/70/30/1063207030.db2.gz LBAGHLYGRPWFCK-KRWDZBQOSA-N 1 1 356.426 2.842 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001495516280 1063503517 /nfs/dbraw/zinc/50/35/17/1063503517.db2.gz BMWXQZFEDLKZPI-IAGOWNOFSA-N 1 1 365.861 2.724 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Nc2cc[nH+]c(N(C)C)c2)c([N+](=O)[O-])c1 ZINC001467122270 1063645325 /nfs/dbraw/zinc/64/53/25/1063645325.db2.gz OJJGQFSGUZZGML-UHFFFAOYSA-N 1 1 372.429 2.988 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001469560700 1064168163 /nfs/dbraw/zinc/16/81/63/1064168163.db2.gz YPKNGPPOFCHVGR-UHFFFAOYSA-N 1 1 368.865 2.822 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCO[C@@H](CNc3ccc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001472855719 1065159375 /nfs/dbraw/zinc/15/93/75/1065159375.db2.gz MXPPVULOLAABQR-KRWDZBQOSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1cccc(C[N@H+]2CCO[C@@H](CNc3ccc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001472855719 1065159380 /nfs/dbraw/zinc/15/93/80/1065159380.db2.gz MXPPVULOLAABQR-KRWDZBQOSA-N 1 1 356.426 2.920 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NCc3c(Br)cccc3[N+](=O)[O-])[C@H]2C1 ZINC001474303324 1065489609 /nfs/dbraw/zinc/48/96/09/1065489609.db2.gz XNAXUKMPBYDCHP-JKOKRWQUSA-N 1 1 354.248 2.787 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001556325288 1075730411 /nfs/dbraw/zinc/73/04/11/1075730411.db2.gz ZZFTUROVNJTNSV-UXHICEINSA-N 1 1 367.449 2.941 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC001558018205 1075928847 /nfs/dbraw/zinc/92/88/47/1075928847.db2.gz ATPFKTLZMOSSJH-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO Cc1ccc(NCCNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC001558488430 1076015829 /nfs/dbraw/zinc/01/58/29/1076015829.db2.gz IIFCYLXAWKHCID-UHFFFAOYSA-N 1 1 350.325 2.618 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001559102559 1076126234 /nfs/dbraw/zinc/12/62/34/1076126234.db2.gz VQBKFXMZTGQVIX-LLVKDONJSA-N 1 1 353.806 2.931 20 5 FFBDMO C[C@@H]1CN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC001559166979 1076131670 /nfs/dbraw/zinc/13/16/70/1076131670.db2.gz LUQQZTQCEYJPDL-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO O=[N+]([O-])c1ncccc1N1CCC[N@@H+](Cc2ccccc2)CCOCC1 ZINC001559290651 1076146579 /nfs/dbraw/zinc/14/65/79/1076146579.db2.gz XCNLFUKGRZQPBU-UHFFFAOYSA-N 1 1 356.426 2.719 20 5 FFBDMO C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CC1CCCCCC1 ZINC001559918201 1076201995 /nfs/dbraw/zinc/20/19/95/1076201995.db2.gz DICIQRVRFBXVDN-UHFFFAOYSA-N 1 1 369.487 2.775 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC001560034810 1076215241 /nfs/dbraw/zinc/21/52/41/1076215241.db2.gz DUDWVKYZRYCSQJ-AWEZNQCLSA-N 1 1 358.398 2.793 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cc([N+](=O)[O-])ccc3Br)CC[C@H]21 ZINC001560077421 1076222699 /nfs/dbraw/zinc/22/26/99/1076222699.db2.gz KRUCUCPVRVOOQV-IAQYHMDHSA-N 1 1 354.248 2.883 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC001560226200 1076251100 /nfs/dbraw/zinc/25/11/00/1076251100.db2.gz MVJXLCFXRBLBOI-UHFFFAOYSA-N 1 1 367.450 2.513 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCC[N@H+]1C ZINC001585855721 1079505898 /nfs/dbraw/zinc/50/58/98/1079505898.db2.gz MKUDNGPTQJKGIS-YPMHNXCESA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589902500 1080852026 /nfs/dbraw/zinc/85/20/26/1080852026.db2.gz GLOABVVTFJAUTK-NSHDSACASA-N 1 1 358.427 2.899 20 5 FFBDMO C[C@@H](Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978295 1080917485 /nfs/dbraw/zinc/91/74/85/1080917485.db2.gz MCVLCTFSSBJPEB-OCCSQVGLSA-N 1 1 371.445 2.840 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742183 250045379 /nfs/dbraw/zinc/04/53/79/250045379.db2.gz LSRJPHJNDSSDIB-AWEZNQCLSA-N 1 1 351.447 2.776 20 5 FFBDMO CC(C)[N@@H+](C)CCNc1ccc(I)cc1[N+](=O)[O-] ZINC000097347881 250064137 /nfs/dbraw/zinc/06/41/37/250064137.db2.gz DQBGQEPVWNXTHT-UHFFFAOYSA-N 1 1 363.199 2.952 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000093907164 250049667 /nfs/dbraw/zinc/04/96/67/250049667.db2.gz DVEZCVFXPLQWDZ-MRXNPFEDSA-N 1 1 363.458 2.607 20 5 FFBDMO COc1cc(C[N@@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])cc1F ZINC000186847417 251274968 /nfs/dbraw/zinc/27/49/68/251274968.db2.gz QLYAWFMWBJMNIV-UHFFFAOYSA-N 1 1 356.419 2.841 20 5 FFBDMO COc1cc(C[N@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])cc1F ZINC000186847417 251274971 /nfs/dbraw/zinc/27/49/71/251274971.db2.gz QLYAWFMWBJMNIV-UHFFFAOYSA-N 1 1 356.419 2.841 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268762097 251375942 /nfs/dbraw/zinc/37/59/42/251375942.db2.gz VXVQZUPDSLNRKU-HNNXBMFYSA-N 1 1 354.410 2.524 20 5 FFBDMO CNC(=O)c1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271639825 251842000 /nfs/dbraw/zinc/84/20/00/251842000.db2.gz RDUPMKHPCCFSGD-QWHCGFSZSA-N 1 1 370.409 2.632 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC000272496051 252053533 /nfs/dbraw/zinc/05/35/33/252053533.db2.gz VCVCVOZYXSYEMY-GXFFZTMASA-N 1 1 370.356 2.754 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272671395 252098287 /nfs/dbraw/zinc/09/82/87/252098287.db2.gz TXMRMUWAYZAQBB-DOMZBBRYSA-N 1 1 367.833 2.570 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000272697276 252106177 /nfs/dbraw/zinc/10/61/77/252106177.db2.gz YATUKULQLRCZTN-QMTHXVAHSA-N 1 1 368.231 2.524 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000273397643 252298221 /nfs/dbraw/zinc/29/82/21/252298221.db2.gz VVFOXDGKIUVCOQ-CVEARBPZSA-N 1 1 372.421 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccc(F)cn4)CC3)nc2c1 ZINC000276166631 256078099 /nfs/dbraw/zinc/07/80/99/256078099.db2.gz DUGADWIAIIAXTC-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)ccc1[N+](=O)[O-] ZINC000276900769 256141345 /nfs/dbraw/zinc/14/13/45/256141345.db2.gz LTOLOEDAHQMWRL-HNNXBMFYSA-N 1 1 371.441 2.911 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277571358 256212331 /nfs/dbraw/zinc/21/23/31/256212331.db2.gz OACRNYQVYVVPIY-OAHLLOKOSA-N 1 1 363.458 2.751 20 5 FFBDMO Cc1cc(N2CCC(Nc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)nc(C)[nH+]1 ZINC000278430184 256312043 /nfs/dbraw/zinc/31/20/43/256312043.db2.gz JJRKHCYIKOVOBL-UHFFFAOYSA-N 1 1 367.413 2.959 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](CC(F)(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000278805470 256349980 /nfs/dbraw/zinc/34/99/80/256349980.db2.gz OWQSYDXFTYCLLC-NSHDSACASA-N 1 1 357.332 2.758 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](CC(F)(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000278805470 256349982 /nfs/dbraw/zinc/34/99/82/256349982.db2.gz OWQSYDXFTYCLLC-NSHDSACASA-N 1 1 357.332 2.758 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000286157858 257022882 /nfs/dbraw/zinc/02/28/82/257022882.db2.gz PSFOZIJIRKPYMP-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000286157858 257022883 /nfs/dbraw/zinc/02/28/83/257022883.db2.gz PSFOZIJIRKPYMP-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CCC(=O)Nc4cccc([N+](=O)[O-])c4C)[C@H]1[C@H]3C2 ZINC000286597362 257044812 /nfs/dbraw/zinc/04/48/12/257044812.db2.gz QWENXVPZSBEMTG-PRRIXCOJSA-N 1 1 359.426 2.587 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)c1 ZINC000289950472 257308047 /nfs/dbraw/zinc/30/80/47/257308047.db2.gz QDJXXHQQOVTENL-HNNXBMFYSA-N 1 1 354.370 2.597 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)c1 ZINC000289950472 257308048 /nfs/dbraw/zinc/30/80/48/257308048.db2.gz QDJXXHQQOVTENL-HNNXBMFYSA-N 1 1 354.370 2.597 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)[C@@H](C)C1 ZINC000290044465 257312834 /nfs/dbraw/zinc/31/28/34/257312834.db2.gz ZYIJXYFLNIGFKA-BBRMVZONSA-N 1 1 358.446 2.557 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000290926144 257365329 /nfs/dbraw/zinc/36/53/29/257365329.db2.gz OMCGSBAWGAUJME-SFHVURJKSA-N 1 1 366.425 2.947 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)cc2)c1C ZINC000291139330 257386924 /nfs/dbraw/zinc/38/69/24/257386924.db2.gz FTADWGFWBRBDRT-UHFFFAOYSA-N 1 1 368.397 2.931 20 5 FFBDMO Cn1cc(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609981 257554089 /nfs/dbraw/zinc/55/40/89/257554089.db2.gz JXNZFVRREYGQNB-HXUWFJFHSA-N 1 1 369.469 2.913 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@]3(C2)CCCN(C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609981 257554094 /nfs/dbraw/zinc/55/40/94/257554094.db2.gz JXNZFVRREYGQNB-HXUWFJFHSA-N 1 1 369.469 2.913 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@]3(C2)CCCN(C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609981 257554095 /nfs/dbraw/zinc/55/40/95/257554095.db2.gz JXNZFVRREYGQNB-HXUWFJFHSA-N 1 1 369.469 2.913 20 5 FFBDMO COC(=O)c1c(C)[nH]c(C(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000299734861 258021635 /nfs/dbraw/zinc/02/16/35/258021635.db2.gz ZZXJXHAICAZYJO-NSHDSACASA-N 1 1 359.382 2.860 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000302659414 258107491 /nfs/dbraw/zinc/10/74/91/258107491.db2.gz ATGHDCLFDYCTBY-CYBMUJFWSA-N 1 1 370.409 2.635 20 5 FFBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000302807280 258111319 /nfs/dbraw/zinc/11/13/19/258111319.db2.gz XPHATIFDRDJEAU-CYBMUJFWSA-N 1 1 370.388 2.660 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1Br ZINC000317301724 258116020 /nfs/dbraw/zinc/11/60/20/258116020.db2.gz MONWWBKHWFMQLP-QWRGUYRKSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1[NH+]1CCOCC1 ZINC000301566534 258056434 /nfs/dbraw/zinc/05/64/34/258056434.db2.gz KRDCMEHMLNQANL-ABAIWWIYSA-N 1 1 370.247 2.514 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2ncc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000301578371 258056835 /nfs/dbraw/zinc/05/68/35/258056835.db2.gz ZLROTUNCPGZIMM-GWCFXTLKSA-N 1 1 357.252 2.919 20 5 FFBDMO Cc1nc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000301623298 258059518 /nfs/dbraw/zinc/05/95/18/258059518.db2.gz GCZCDFMTDLXNBH-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N(C)C[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000301690877 258063147 /nfs/dbraw/zinc/06/31/47/258063147.db2.gz WJBZPRDTTRRBCN-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO COC(=O)c1cc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)cc(C)c1[N+](=O)[O-] ZINC000301712255 258064221 /nfs/dbraw/zinc/06/42/21/258064221.db2.gz LABBGBODCJVITE-AWEZNQCLSA-N 1 1 372.425 2.882 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[NH+]1CCN(C)CC1 ZINC000301899788 258073846 /nfs/dbraw/zinc/07/38/46/258073846.db2.gz YKYHXZBWNJEQIJ-CQSZACIVSA-N 1 1 350.463 2.820 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301964441 258078902 /nfs/dbraw/zinc/07/89/02/258078902.db2.gz NTATVLHSSDZEMN-GDBMZVCRSA-N 1 1 366.425 2.960 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O ZINC000330700640 258168815 /nfs/dbraw/zinc/16/88/15/258168815.db2.gz GXULSFWCTQVKQU-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O ZINC000330700640 258168816 /nfs/dbraw/zinc/16/88/16/258168816.db2.gz GXULSFWCTQVKQU-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000032723308 506284818 /nfs/dbraw/zinc/28/48/18/506284818.db2.gz BWVSDRUOPBXPNT-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC000366850904 512217395 /nfs/dbraw/zinc/21/73/95/512217395.db2.gz LJCIYOQQPVLYKB-SJORKVTESA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC000366850904 512217403 /nfs/dbraw/zinc/21/74/03/512217403.db2.gz LJCIYOQQPVLYKB-SJORKVTESA-N 1 1 358.373 2.613 20 5 FFBDMO CNC(=O)c1ccc(NC[C@@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000053558773 506405615 /nfs/dbraw/zinc/40/56/15/506405615.db2.gz SOSLEYUXFVLZGI-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000054646707 506594414 /nfs/dbraw/zinc/59/44/14/506594414.db2.gz KIIXDXMOUIMXRI-MRXNPFEDSA-N 1 1 362.474 2.949 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)NCc1ccccc1[N+](=O)[O-] ZINC000054687301 506604881 /nfs/dbraw/zinc/60/48/81/506604881.db2.gz FFLDTDHZTJKJMD-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)NCc1ccccc1[N+](=O)[O-] ZINC000054687301 506604882 /nfs/dbraw/zinc/60/48/82/506604882.db2.gz FFLDTDHZTJKJMD-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000043084470 506697237 /nfs/dbraw/zinc/69/72/37/506697237.db2.gz AWFLGCMRDCYZSJ-OLZOCXBDSA-N 1 1 365.430 2.605 20 5 FFBDMO CNc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000009919863 506717896 /nfs/dbraw/zinc/71/78/96/506717896.db2.gz QSCOLPLMORSKBP-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000055407447 506745671 /nfs/dbraw/zinc/74/56/71/506745671.db2.gz LRWSJRJSWLXWFO-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000067703047 506981027 /nfs/dbraw/zinc/98/10/27/506981027.db2.gz ANVNSFJYFZFYFA-OAHLLOKOSA-N 1 1 361.445 2.508 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000045557181 506982638 /nfs/dbraw/zinc/98/26/38/506982638.db2.gz SOYRSESGCBYMRD-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2sccc2C1 ZINC000057004181 507142520 /nfs/dbraw/zinc/14/25/20/507142520.db2.gz NQLHXNDWLAZFEF-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC000057004181 507142530 /nfs/dbraw/zinc/14/25/30/507142530.db2.gz NQLHXNDWLAZFEF-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO Cc1ccccc1C[N@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000024789550 507438537 /nfs/dbraw/zinc/43/85/37/507438537.db2.gz AYVZCHKGPPVPDJ-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000024789550 507438541 /nfs/dbraw/zinc/43/85/41/507438541.db2.gz AYVZCHKGPPVPDJ-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000058883738 507476954 /nfs/dbraw/zinc/47/69/54/507476954.db2.gz AIGQOMPQCCWSHK-OWCLPIDISA-N 1 1 360.458 2.871 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000025698299 507524304 /nfs/dbraw/zinc/52/43/04/507524304.db2.gz NKBRZMSPQYIRNM-QGZVFWFLSA-N 1 1 360.410 2.654 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000026156162 507561567 /nfs/dbraw/zinc/56/15/67/507561567.db2.gz DDZMRFZZXYQQEY-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000028049761 507706244 /nfs/dbraw/zinc/70/62/44/507706244.db2.gz HDRZZLGJAUDFGF-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051051074 507727858 /nfs/dbraw/zinc/72/78/58/507727858.db2.gz YRLXKXFDNLTPGN-HOTGVXAUSA-N 1 1 363.458 2.990 20 5 FFBDMO CC[N@H+](CCC(=O)OC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000064570270 507802751 /nfs/dbraw/zinc/80/27/51/507802751.db2.gz SFDOWDRDBSXRGI-UHFFFAOYSA-N 1 1 362.329 2.590 20 5 FFBDMO CC[N@@H+](CCC(=O)OC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000064570270 507802754 /nfs/dbraw/zinc/80/27/54/507802754.db2.gz SFDOWDRDBSXRGI-UHFFFAOYSA-N 1 1 362.329 2.590 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000078146620 507839443 /nfs/dbraw/zinc/83/94/43/507839443.db2.gz FKXCPKKHNPNBKS-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000078146620 507839444 /nfs/dbraw/zinc/83/94/44/507839444.db2.gz FKXCPKKHNPNBKS-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO COc1c(C)cnc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000072665141 507840455 /nfs/dbraw/zinc/84/04/55/507840455.db2.gz VHNAQAXHBKRSFY-CQSZACIVSA-N 1 1 357.414 2.697 20 5 FFBDMO COc1c(C)c[nH+]c(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000072665141 507840460 /nfs/dbraw/zinc/84/04/60/507840460.db2.gz VHNAQAXHBKRSFY-CQSZACIVSA-N 1 1 357.414 2.697 20 5 FFBDMO O=[N+]([O-])c1ccc(CCN2CC[NH+](CCOc3ccccc3)CC2)cc1 ZINC000108102998 507877573 /nfs/dbraw/zinc/87/75/73/507877573.db2.gz DOMWZVUQZNFYOR-UHFFFAOYSA-N 1 1 355.438 2.834 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(CCOc3ccccc3)CC2)cc1 ZINC000108102998 507877575 /nfs/dbraw/zinc/87/75/75/507877575.db2.gz DOMWZVUQZNFYOR-UHFFFAOYSA-N 1 1 355.438 2.834 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000108302697 507885527 /nfs/dbraw/zinc/88/55/27/507885527.db2.gz NKIVKLKHZGWEFA-AWEZNQCLSA-N 1 1 372.450 2.932 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC2 ZINC000078619308 507890236 /nfs/dbraw/zinc/89/02/36/507890236.db2.gz LWIIJXULQWYVDY-UHFFFAOYSA-N 1 1 372.425 2.517 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC2 ZINC000078619308 507890238 /nfs/dbraw/zinc/89/02/38/507890238.db2.gz LWIIJXULQWYVDY-UHFFFAOYSA-N 1 1 372.425 2.517 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000090002034 507898905 /nfs/dbraw/zinc/89/89/05/507898905.db2.gz ISGMLUYABZYGNS-HOCLYGCPSA-N 1 1 360.801 2.818 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000090002034 507898907 /nfs/dbraw/zinc/89/89/07/507898907.db2.gz ISGMLUYABZYGNS-HOCLYGCPSA-N 1 1 360.801 2.818 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000108783058 507918060 /nfs/dbraw/zinc/91/80/60/507918060.db2.gz YNWKCFFYWLSCOE-OAHLLOKOSA-N 1 1 372.469 2.799 20 5 FFBDMO Cc1cc(NCc2ccc(C[NH+]3CCN(C)CC3)cc2)ncc1[N+](=O)[O-] ZINC000074740825 508051092 /nfs/dbraw/zinc/05/10/92/508051092.db2.gz XKEPTXQTRNCZBH-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000092585493 508084578 /nfs/dbraw/zinc/08/45/78/508084578.db2.gz NBRXVWJVGGVZKB-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000092585493 508084581 /nfs/dbraw/zinc/08/45/81/508084581.db2.gz NBRXVWJVGGVZKB-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000080715923 508096921 /nfs/dbraw/zinc/09/69/21/508096921.db2.gz SYFPVWJYCQIAGT-ALOPSCKCSA-N 1 1 372.469 2.940 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)cn1 ZINC000075667829 508126655 /nfs/dbraw/zinc/12/66/55/508126655.db2.gz HRLDTTSHNODUEO-UHFFFAOYSA-N 1 1 355.442 2.610 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000093298380 508136351 /nfs/dbraw/zinc/13/63/51/508136351.db2.gz DGCWZMXSFSRZDW-CQSZACIVSA-N 1 1 350.415 2.885 20 5 FFBDMO CNC(=O)[C@@H](C)C[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000093899211 508159191 /nfs/dbraw/zinc/15/91/91/508159191.db2.gz NWIDVXINWODQBI-LBPRGKRZSA-N 1 1 361.398 2.677 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C1 ZINC000081363250 508167789 /nfs/dbraw/zinc/16/77/89/508167789.db2.gz CNWSKBVYIMHNOD-CYBMUJFWSA-N 1 1 364.402 2.615 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000076486211 508212967 /nfs/dbraw/zinc/21/29/67/508212967.db2.gz ZGTMBFDYOXXZMA-RDTXWAMCSA-N 1 1 371.441 2.583 20 5 FFBDMO CNC(=O)c1ccc(N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000076691256 508241726 /nfs/dbraw/zinc/24/17/26/508241726.db2.gz FPJXFOWQYVHZOK-HNNXBMFYSA-N 1 1 368.437 2.665 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000115444065 508394877 /nfs/dbraw/zinc/39/48/77/508394877.db2.gz GXQUQTCIROWGJU-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000152437409 508446038 /nfs/dbraw/zinc/44/60/38/508446038.db2.gz XEPGFEZFDZQXCB-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO COC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCCC1 ZINC000134247602 508513456 /nfs/dbraw/zinc/51/34/56/508513456.db2.gz JBMLWYJUFMBZTO-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000157202845 508536611 /nfs/dbraw/zinc/53/66/11/508536611.db2.gz HAJOZZWQRQTNLP-RHSMWYFYSA-N 1 1 358.442 2.725 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000128042463 508539676 /nfs/dbraw/zinc/53/96/76/508539676.db2.gz XDHMNPIFHCVHEJ-INIZCTEOSA-N 1 1 369.425 2.501 20 5 FFBDMO Cc1nc(N2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)sc1C ZINC000157596070 508585290 /nfs/dbraw/zinc/58/52/90/508585290.db2.gz GWGAMYHKWDIIPD-UHFFFAOYSA-N 1 1 362.455 2.869 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+](CCO)C1CCCCC1 ZINC000117341223 508593102 /nfs/dbraw/zinc/59/31/02/508593102.db2.gz WMOQEVZQRHUOOC-UHFFFAOYSA-N 1 1 363.414 2.520 20 5 FFBDMO CC(C)C[C@@H]1COCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341922 508593455 /nfs/dbraw/zinc/59/34/55/508593455.db2.gz LXYFNCNGZHTBRU-OAHLLOKOSA-N 1 1 363.414 2.640 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866853 508689071 /nfs/dbraw/zinc/68/90/71/508689071.db2.gz ZNLPOHWEPJHQSX-ZFWWWQNUSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866853 508689075 /nfs/dbraw/zinc/68/90/75/508689075.db2.gz ZNLPOHWEPJHQSX-ZFWWWQNUSA-N 1 1 355.398 2.503 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]CCc2nc[nH]n2)ccc1Oc1ccc(F)cc1 ZINC000119178356 508741400 /nfs/dbraw/zinc/74/14/00/508741400.db2.gz YGGXQLQRZWOBJP-UHFFFAOYSA-N 1 1 357.345 2.977 20 5 FFBDMO CC1CC[NH+]([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])c2cccs2)CC1 ZINC000158940903 508771481 /nfs/dbraw/zinc/77/14/81/508771481.db2.gz GEMKLOXBQUFXPY-GFCCVEGCSA-N 1 1 363.443 2.582 20 5 FFBDMO Cn1cc(Br)cc1C[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154449422 508787065 /nfs/dbraw/zinc/78/70/65/508787065.db2.gz SSZSRSYRAZQEBK-OAHLLOKOSA-N 1 1 368.231 2.861 20 5 FFBDMO O=C(c1ccc(O)cc1)C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000154480763 508793464 /nfs/dbraw/zinc/79/34/64/508793464.db2.gz PPXIGGLCJNTXCU-IBGZPJMESA-N 1 1 370.405 2.929 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)sc2C1 ZINC000159251638 508814503 /nfs/dbraw/zinc/81/45/03/508814503.db2.gz BPBBTCQIHJVGAE-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)sc2C1 ZINC000159251638 508814505 /nfs/dbraw/zinc/81/45/05/508814505.db2.gz BPBBTCQIHJVGAE-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000159258051 508815092 /nfs/dbraw/zinc/81/50/92/508815092.db2.gz CAOACTXUPVYMMQ-DYVFJYSZSA-N 1 1 359.426 2.579 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000119593923 508824817 /nfs/dbraw/zinc/82/48/17/508824817.db2.gz WNDFNMFVYCTQEZ-KXBFYZLASA-N 1 1 368.437 2.915 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCc2ccccn2)c([N+](=O)[O-])c1 ZINC000124404640 508826498 /nfs/dbraw/zinc/82/64/98/508826498.db2.gz MNZGFLSLERSYAT-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000130744637 508839648 /nfs/dbraw/zinc/83/96/48/508839648.db2.gz OTGNSMPATHQHKY-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000130744637 508839650 /nfs/dbraw/zinc/83/96/50/508839650.db2.gz OTGNSMPATHQHKY-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000124500990 508842583 /nfs/dbraw/zinc/84/25/83/508842583.db2.gz RIBLJOYSEATWEQ-AWEZNQCLSA-N 1 1 367.421 2.597 20 5 FFBDMO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000131002468 508875492 /nfs/dbraw/zinc/87/54/92/508875492.db2.gz UAOLCSKTGNPCAS-SNVBAGLBSA-N 1 1 362.777 2.846 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC[N@@H+]1CCOC ZINC000131011845 508877214 /nfs/dbraw/zinc/87/72/14/508877214.db2.gz VZSSBVAXXMDKPG-ZDUSSCGKSA-N 1 1 355.460 2.538 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC[N@H+]1CCOC ZINC000131011845 508877217 /nfs/dbraw/zinc/87/72/17/508877217.db2.gz VZSSBVAXXMDKPG-ZDUSSCGKSA-N 1 1 355.460 2.538 20 5 FFBDMO CC(C)[N@H+](CCc1nccs1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000159740414 508883304 /nfs/dbraw/zinc/88/33/04/508883304.db2.gz LPBFNZPHEOYTCZ-UHFFFAOYSA-N 1 1 374.466 2.894 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000159740414 508883306 /nfs/dbraw/zinc/88/33/06/508883306.db2.gz LPBFNZPHEOYTCZ-UHFFFAOYSA-N 1 1 374.466 2.894 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)N1CC[NH+](C2CC2)CC1 ZINC000160075550 508934791 /nfs/dbraw/zinc/93/47/91/508934791.db2.gz NALWHNARANRVNK-UHFFFAOYSA-N 1 1 358.320 2.926 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ncc([N+](=O)[O-])cc1Br ZINC000120182577 508945581 /nfs/dbraw/zinc/94/55/81/508945581.db2.gz OWBXAKWEMYNBTQ-UHFFFAOYSA-N 1 1 354.208 2.784 20 5 FFBDMO CC(=O)Nc1ccccc1C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000160434498 508986697 /nfs/dbraw/zinc/98/66/97/508986697.db2.gz GRVGIMJOTNDPGU-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000125777797 509028566 /nfs/dbraw/zinc/02/85/66/509028566.db2.gz ZSRHHPPTLJVTLW-OAHLLOKOSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000132966568 509098387 /nfs/dbraw/zinc/09/83/87/509098387.db2.gz PEEPLKAZILSAQF-ZWNOBZJWSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000132966568 509098390 /nfs/dbraw/zinc/09/83/90/509098390.db2.gz PEEPLKAZILSAQF-ZWNOBZJWSA-N 1 1 360.357 2.798 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000121077548 509122926 /nfs/dbraw/zinc/12/29/26/509122926.db2.gz KEDBWUQDOLQKTC-AWEZNQCLSA-N 1 1 358.442 2.855 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000156108659 509128308 /nfs/dbraw/zinc/12/83/08/509128308.db2.gz BEEDVTMZOPOBMS-IUODEOHRSA-N 1 1 350.419 2.797 20 5 FFBDMO CC[N@H+](CCc1nccs1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000121145444 509138840 /nfs/dbraw/zinc/13/88/40/509138840.db2.gz JTPKERFDPJIJBB-OAHLLOKOSA-N 1 1 360.439 2.721 20 5 FFBDMO CC[N@@H+](CCc1nccs1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000121145444 509138843 /nfs/dbraw/zinc/13/88/43/509138843.db2.gz JTPKERFDPJIJBB-OAHLLOKOSA-N 1 1 360.439 2.721 20 5 FFBDMO O=C1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@@H]2N1 ZINC000133289442 509142764 /nfs/dbraw/zinc/14/27/64/509142764.db2.gz KZAXKEFAPCTGGK-HOTGVXAUSA-N 1 1 370.409 2.535 20 5 FFBDMO O=C1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@@H]2N1 ZINC000133289442 509142765 /nfs/dbraw/zinc/14/27/65/509142765.db2.gz KZAXKEFAPCTGGK-HOTGVXAUSA-N 1 1 370.409 2.535 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121427275 509173206 /nfs/dbraw/zinc/17/32/06/509173206.db2.gz TYBIKAAUUXHLBD-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO O=C1NCCCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182357133 509192781 /nfs/dbraw/zinc/19/27/81/509192781.db2.gz SPYSAYDMHFNOIQ-UHFFFAOYSA-N 1 1 352.822 2.628 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)n1 ZINC000191815167 509195465 /nfs/dbraw/zinc/19/54/65/509195465.db2.gz DWSGROIMUOAKEV-GJZGRUSLSA-N 1 1 363.462 2.538 20 5 FFBDMO O=C(CN1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901290 509248220 /nfs/dbraw/zinc/24/82/20/509248220.db2.gz GOUYMIGUCKAIIK-NSHDSACASA-N 1 1 363.805 2.789 20 5 FFBDMO COc1cccc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000185644304 509282205 /nfs/dbraw/zinc/28/22/05/509282205.db2.gz LQSIKEJQBMTIQD-JKSUJKDBSA-N 1 1 357.410 2.651 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000162733116 509288645 /nfs/dbraw/zinc/28/86/45/509288645.db2.gz UTALYLCUKGSOAO-ZIAGYGMSSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000162765016 509295811 /nfs/dbraw/zinc/29/58/11/509295811.db2.gz UMEPSFKAVNMIBH-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000182622205 509337841 /nfs/dbraw/zinc/33/78/41/509337841.db2.gz AVIAVTMAOGAVIG-CVEARBPZSA-N 1 1 361.442 2.535 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182670310 509361039 /nfs/dbraw/zinc/36/10/39/509361039.db2.gz FGMUGXDMKMFWSV-WCQYABFASA-N 1 1 369.368 2.895 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1OC(F)F ZINC000176206344 509378739 /nfs/dbraw/zinc/37/87/39/509378739.db2.gz GVAVJKBFUBDQQH-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO COCCO[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000179335653 509382060 /nfs/dbraw/zinc/38/20/60/509382060.db2.gz MEQLBIDWGWJUOA-KRWDZBQOSA-N 1 1 361.398 2.877 20 5 FFBDMO COCCO[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000179335653 509382068 /nfs/dbraw/zinc/38/20/68/509382068.db2.gz MEQLBIDWGWJUOA-KRWDZBQOSA-N 1 1 361.398 2.877 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000248683252 509434209 /nfs/dbraw/zinc/43/42/09/509434209.db2.gz XPNPTLODYMICHQ-GOEBONIOSA-N 1 1 371.441 2.594 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000182853700 509461091 /nfs/dbraw/zinc/46/10/91/509461091.db2.gz QVWKZBNAOFQLKP-CHWSQXEVSA-N 1 1 363.462 2.653 20 5 FFBDMO C[C@@H]1C[N@H+](CCC2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C[C@H](C)O1 ZINC000267449243 509489894 /nfs/dbraw/zinc/48/98/94/509489894.db2.gz ZTDNCNGODSTVRS-OKILXGFUSA-N 1 1 365.430 2.539 20 5 FFBDMO C[N@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000179574311 509520660 /nfs/dbraw/zinc/52/06/60/509520660.db2.gz YENSZNUQQFOTHI-UHFFFAOYSA-N 1 1 369.468 2.604 20 5 FFBDMO C[N@@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000179574311 509520664 /nfs/dbraw/zinc/52/06/64/509520664.db2.gz YENSZNUQQFOTHI-UHFFFAOYSA-N 1 1 369.468 2.604 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183007766 509545054 /nfs/dbraw/zinc/54/50/54/509545054.db2.gz PKKMYGOERXEZNF-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183007766 509545058 /nfs/dbraw/zinc/54/50/58/509545058.db2.gz PKKMYGOERXEZNF-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000248961556 509555468 /nfs/dbraw/zinc/55/54/68/509555468.db2.gz BGDALIZQZUKPOM-MLGOLLRUSA-N 1 1 359.382 2.881 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000248961556 509555472 /nfs/dbraw/zinc/55/54/72/509555472.db2.gz BGDALIZQZUKPOM-MLGOLLRUSA-N 1 1 359.382 2.881 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000179713237 509585945 /nfs/dbraw/zinc/58/59/45/509585945.db2.gz UBUPVJLMZDADKA-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000179713237 509585951 /nfs/dbraw/zinc/58/59/51/509585951.db2.gz UBUPVJLMZDADKA-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000179713237 509585956 /nfs/dbraw/zinc/58/59/56/509585956.db2.gz UBUPVJLMZDADKA-CYBMUJFWSA-N 1 1 367.409 2.721 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNC(=O)c3ccccc3[N+](=O)[O-])CC2)oc1C ZINC000264694056 509651683 /nfs/dbraw/zinc/65/16/83/509651683.db2.gz HZQGJSLEZWHFDH-UHFFFAOYSA-N 1 1 372.425 2.842 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180147580 509777919 /nfs/dbraw/zinc/77/79/19/509777919.db2.gz DATCJQJKDKYAPW-JXFKEZNVSA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000176980044 509796196 /nfs/dbraw/zinc/79/61/96/509796196.db2.gz DTHBXCQCVUDCRT-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(=O)C2CC2)CC1 ZINC000170912710 509843506 /nfs/dbraw/zinc/84/35/06/509843506.db2.gz KNGMOERGHZRSJS-UHFFFAOYSA-N 1 1 361.442 2.873 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)C1 ZINC000173949480 509870509 /nfs/dbraw/zinc/87/05/09/509870509.db2.gz CSXQFCQLLGMFTM-CQSZACIVSA-N 1 1 369.487 2.510 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000186780875 509896770 /nfs/dbraw/zinc/89/67/70/509896770.db2.gz YYMNUEAFXWOSEA-CQSZACIVSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[N@H+]1C1CC1 ZINC000177172953 509916789 /nfs/dbraw/zinc/91/67/89/509916789.db2.gz YAQPJSDDWLWLIS-NXEZZACHSA-N 1 1 368.231 2.712 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245440541 509936346 /nfs/dbraw/zinc/93/63/46/509936346.db2.gz UPSVCKKXTQQYLP-YOEHRIQHSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245440541 509936350 /nfs/dbraw/zinc/93/63/50/509936350.db2.gz UPSVCKKXTQQYLP-YOEHRIQHSA-N 1 1 362.474 2.894 20 5 FFBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000245468178 509954608 /nfs/dbraw/zinc/95/46/08/509954608.db2.gz ZVNTVRCBTXKXAG-YRGRVCCFSA-N 1 1 361.398 2.915 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](c4cc[nH]n4)C3)n2)cc1 ZINC000193590759 509979326 /nfs/dbraw/zinc/97/93/26/509979326.db2.gz GFBQRXOWKMQYBU-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)n2)cc1 ZINC000193590759 509979334 /nfs/dbraw/zinc/97/93/34/509979334.db2.gz GFBQRXOWKMQYBU-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015549 510005974 /nfs/dbraw/zinc/00/59/74/510005974.db2.gz UWWDTJVYHQMCFH-PBHICJAKSA-N 1 1 353.438 2.961 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000261709584 510035425 /nfs/dbraw/zinc/03/54/25/510035425.db2.gz DLKXJNUOIPWLAU-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCC([N@@H+](C)CCCO)CC2)cc1[N+](=O)[O-] ZINC000190326511 510065878 /nfs/dbraw/zinc/06/58/78/510065878.db2.gz UUYAWBDTUSYLCE-UHFFFAOYSA-N 1 1 363.458 2.637 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193813719 510083906 /nfs/dbraw/zinc/08/39/06/510083906.db2.gz YSUIWWIHXZLNAF-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193816630 510084550 /nfs/dbraw/zinc/08/45/50/510084550.db2.gz CTUHDZJUCFALGC-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000180758045 510093722 /nfs/dbraw/zinc/09/37/22/510093722.db2.gz NCXFCRFJGYWSPB-ZDUSSCGKSA-N 1 1 370.409 2.823 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268847588 510097122 /nfs/dbraw/zinc/09/71/22/510097122.db2.gz PXYPUVCDOQVYOU-IAGOWNOFSA-N 1 1 355.442 2.819 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000245708360 510099097 /nfs/dbraw/zinc/09/90/97/510099097.db2.gz YRFMJEAGCWRCAT-IINYFYTJSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000193906014 510122596 /nfs/dbraw/zinc/12/25/96/510122596.db2.gz YEGQKDCYUTZPLV-OKILXGFUSA-N 1 1 364.446 2.785 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000193906014 510122604 /nfs/dbraw/zinc/12/26/04/510122604.db2.gz YEGQKDCYUTZPLV-OKILXGFUSA-N 1 1 364.446 2.785 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]2N1C1CC1 ZINC000245788551 510145594 /nfs/dbraw/zinc/14/55/94/510145594.db2.gz NHYOTLHCQRVBOG-LRDDRELGSA-N 1 1 370.409 2.711 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]2N1C1CC1 ZINC000245788551 510145601 /nfs/dbraw/zinc/14/56/01/510145601.db2.gz NHYOTLHCQRVBOG-LRDDRELGSA-N 1 1 370.409 2.711 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](C[C@H]2CCCO2)[C@H]2CCSC2)cc1 ZINC000245903411 510197461 /nfs/dbraw/zinc/19/74/61/510197461.db2.gz QGMQIWIDYIPIGW-DOTOQJQBSA-N 1 1 352.456 2.960 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](C)[NH2+]Cc2ccccc21 ZINC000262241855 510217716 /nfs/dbraw/zinc/21/77/16/510217716.db2.gz PDOJDCXFSLKYKH-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000177788030 510252960 /nfs/dbraw/zinc/25/29/60/510252960.db2.gz MRLUWPJXGYKOCY-GOEBONIOSA-N 1 1 360.458 2.842 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000269266883 510316284 /nfs/dbraw/zinc/31/62/84/510316284.db2.gz KEGBRBDJCNCXDX-UHFFFAOYSA-N 1 1 367.203 2.682 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269288767 510325378 /nfs/dbraw/zinc/32/53/78/510325378.db2.gz UBXZWOHCHHLKLF-MSOLQXFVSA-N 1 1 358.442 2.896 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)CC2)nc(C)[nH+]1 ZINC000174883544 510364942 /nfs/dbraw/zinc/36/49/42/510364942.db2.gz DUOJVGCZSHVCDA-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269365561 510365061 /nfs/dbraw/zinc/36/50/61/510365061.db2.gz VKFZTWSXKWUKKC-SCLBCKFNSA-N 1 1 358.442 2.752 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305702 510417280 /nfs/dbraw/zinc/41/72/80/510417280.db2.gz FQRADVQSLVZYJP-CVEARBPZSA-N 1 1 374.485 2.780 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000246324635 510426752 /nfs/dbraw/zinc/42/67/52/510426752.db2.gz NEDLHSYWAYDNOL-MAUKXSAKSA-N 1 1 362.474 2.899 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C2 ZINC000175031506 510448798 /nfs/dbraw/zinc/44/87/98/510448798.db2.gz TZCUWSDLZFMFRE-UONOGXRCSA-N 1 1 362.386 2.590 20 5 FFBDMO CC[NH+](CC)[C@@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000171953074 510469357 /nfs/dbraw/zinc/46/93/57/510469357.db2.gz JNUVYWPTVFSSKX-HNNXBMFYSA-N 1 1 367.427 2.549 20 5 FFBDMO CC(C)(CNC(=O)c1cccc([N+](=O)[O-])c1N)[N@H+]1CCc2ccccc2C1 ZINC000178179514 510473737 /nfs/dbraw/zinc/47/37/37/510473737.db2.gz FDRIDTVZFPYSCT-UHFFFAOYSA-N 1 1 368.437 2.744 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246653377 510602597 /nfs/dbraw/zinc/60/25/97/510602597.db2.gz JKNIMFFTAQNWCI-OLZOCXBDSA-N 1 1 350.419 2.699 20 5 FFBDMO CCS[C@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181871959 510634902 /nfs/dbraw/zinc/63/49/02/510634902.db2.gz ULFBDGUNVNPSGX-HNNXBMFYSA-N 1 1 372.512 2.976 20 5 FFBDMO CCS[C@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181871959 510634909 /nfs/dbraw/zinc/63/49/09/510634909.db2.gz ULFBDGUNVNPSGX-HNNXBMFYSA-N 1 1 372.512 2.976 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC[N@H+]1C[C@@H](C)O ZINC000191413090 510647143 /nfs/dbraw/zinc/64/71/43/510647143.db2.gz JYMLAMBSZSCVLZ-HUUCEWRRSA-N 1 1 364.446 2.521 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2nc3sccn3c2[N+](=O)[O-])[C@@H](C)C1 ZINC000246829996 510698560 /nfs/dbraw/zinc/69/85/60/510698560.db2.gz PGQQUFPRUIGPID-STQMWFEESA-N 1 1 367.475 2.853 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000175671464 510724745 /nfs/dbraw/zinc/72/47/45/510724745.db2.gz MATUDIORXYAKER-UHFFFAOYSA-N 1 1 374.416 2.708 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000246906193 510737445 /nfs/dbraw/zinc/73/74/45/510737445.db2.gz VOVZGNMBHUQSRW-YJBOKZPZSA-N 1 1 363.458 2.770 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C ZINC000178730426 510743458 /nfs/dbraw/zinc/74/34/58/510743458.db2.gz HIGNNOBBQDMSSD-BEFAXECRSA-N 1 1 370.453 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C ZINC000178730426 510743464 /nfs/dbraw/zinc/74/34/64/510743464.db2.gz HIGNNOBBQDMSSD-BEFAXECRSA-N 1 1 370.453 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C ZINC000246935967 510754512 /nfs/dbraw/zinc/75/45/12/510754512.db2.gz HIGNNOBBQDMSSD-HNAYVOBHSA-N 1 1 370.453 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C ZINC000246935967 510754522 /nfs/dbraw/zinc/75/45/22/510754522.db2.gz HIGNNOBBQDMSSD-HNAYVOBHSA-N 1 1 370.453 2.999 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000182146737 510780147 /nfs/dbraw/zinc/78/01/47/510780147.db2.gz VMXLGUQQEITABK-MNOVXSKESA-N 1 1 357.357 2.751 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000178823276 510790775 /nfs/dbraw/zinc/79/07/75/510790775.db2.gz YJAJTYIQHNYAMS-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1n1ccnc1 ZINC000247014326 510798941 /nfs/dbraw/zinc/79/89/41/510798941.db2.gz DFRWGSJKLRESGA-XJKSGUPXSA-N 1 1 368.397 2.924 20 5 FFBDMO O=C(CCN1CCC[N@H+](C2CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000172582799 510804148 /nfs/dbraw/zinc/80/41/48/510804148.db2.gz KWOUJNYLVKJXDF-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078840 510828199 /nfs/dbraw/zinc/82/81/99/510828199.db2.gz QSLYPOMPHPUGCX-YJBOKZPZSA-N 1 1 365.474 2.830 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260237 510854661 /nfs/dbraw/zinc/85/46/61/510854661.db2.gz XPECEGDJMIGYJN-QFBILLFUSA-N 1 1 369.469 2.911 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000247277522 510855036 /nfs/dbraw/zinc/85/50/36/510855036.db2.gz XBPQWHLJSFMMEP-ZWNOBZJWSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000360306183 510893988 /nfs/dbraw/zinc/89/39/88/510893988.db2.gz SJSGKBYXROOYNU-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C2)C1 ZINC000293913828 510897889 /nfs/dbraw/zinc/89/78/89/510897889.db2.gz HZVQOUHGRAVCQN-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294246438 511003931 /nfs/dbraw/zinc/00/39/31/511003931.db2.gz SHTUHLILXRTRKW-MRXNPFEDSA-N 1 1 353.369 2.631 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000361193019 511011420 /nfs/dbraw/zinc/01/14/20/511011420.db2.gz YQPWDRRWOQPJFS-LPHOPBHVSA-N 1 1 357.385 2.838 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000361193019 511011428 /nfs/dbraw/zinc/01/14/28/511011428.db2.gz YQPWDRRWOQPJFS-LPHOPBHVSA-N 1 1 357.385 2.838 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])Cc1ccncc1 ZINC000271049692 511068621 /nfs/dbraw/zinc/06/86/21/511068621.db2.gz WTIHVEROYCOJNH-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000332445720 511082748 /nfs/dbraw/zinc/08/27/48/511082748.db2.gz MDFPMZASZQHKCB-CYBMUJFWSA-N 1 1 359.348 2.915 20 5 FFBDMO Cn1cc(C[N@H+]2CCC3(C2)CCOCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000271226778 511129169 /nfs/dbraw/zinc/12/91/69/511129169.db2.gz RMPSHUNXPNRYJF-UHFFFAOYSA-N 1 1 356.426 2.998 20 5 FFBDMO C[C@H]1CN(c2ncc(Br)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000294855657 511199602 /nfs/dbraw/zinc/19/96/02/511199602.db2.gz CRBGPMOKZNNOCB-SNVBAGLBSA-N 1 1 355.236 2.673 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000295037292 511260739 /nfs/dbraw/zinc/26/07/39/511260739.db2.gz FREUOJAUBJNINQ-WBVHZDCISA-N 1 1 359.426 2.643 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1SC ZINC000362958218 511278960 /nfs/dbraw/zinc/27/89/60/511278960.db2.gz PDPLYUNKRPDHQR-VXGBXAGGSA-N 1 1 365.455 2.682 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000291726415 511312432 /nfs/dbraw/zinc/31/24/32/511312432.db2.gz HXIJLSLYPDYSSF-KSSFIOAISA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291762542 511328039 /nfs/dbraw/zinc/32/80/39/511328039.db2.gz LGPMXEOESRVMEP-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291762542 511328043 /nfs/dbraw/zinc/32/80/43/511328043.db2.gz LGPMXEOESRVMEP-MGPUTAFESA-N 1 1 369.421 2.558 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272205183 511464447 /nfs/dbraw/zinc/46/44/47/511464447.db2.gz ZDHMXJJIGPLGPU-WFASDCNBSA-N 1 1 353.369 2.629 20 5 FFBDMO COc1ccc(NC(=O)Cn2c[nH+]c3c2C[C@H](C)[C@H](C)C3)c([N+](=O)[O-])c1 ZINC000295716641 511493316 /nfs/dbraw/zinc/49/33/16/511493316.db2.gz GOFGPWQJLSZOIB-NEPJUHHUSA-N 1 1 358.398 2.809 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCN(c2cnccn2)CC1 ZINC000365508992 511493414 /nfs/dbraw/zinc/49/34/14/511493414.db2.gz CGZAJXCCSFTHQV-UHFFFAOYSA-N 1 1 371.441 2.755 20 5 FFBDMO COC(=O)CC1([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCCC1 ZINC000280515947 511495241 /nfs/dbraw/zinc/49/52/41/511495241.db2.gz ROQGLQZJJYVVOQ-UHFFFAOYSA-N 1 1 360.370 2.610 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000283905021 511539129 /nfs/dbraw/zinc/53/91/29/511539129.db2.gz BOZSHPHYWBVPMF-NSHDSACASA-N 1 1 370.365 2.873 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](OCc3ccncc3)C2)c2c(c1)COCO2 ZINC000280719491 511576362 /nfs/dbraw/zinc/57/63/62/511576362.db2.gz BZKXPDPGRMFQNZ-GOSISDBHSA-N 1 1 371.393 2.647 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](OCc3ccncc3)C2)c2c(c1)COCO2 ZINC000280719491 511576365 /nfs/dbraw/zinc/57/63/65/511576365.db2.gz BZKXPDPGRMFQNZ-GOSISDBHSA-N 1 1 371.393 2.647 20 5 FFBDMO COCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000299383600 511616238 /nfs/dbraw/zinc/61/62/38/511616238.db2.gz HVLOTKUTMBTRKZ-AWEZNQCLSA-N 1 1 357.410 2.903 20 5 FFBDMO COCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000299383600 511616240 /nfs/dbraw/zinc/61/62/40/511616240.db2.gz HVLOTKUTMBTRKZ-AWEZNQCLSA-N 1 1 357.410 2.903 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](Cc2cnn(C)c2)C1 ZINC000363559288 511628399 /nfs/dbraw/zinc/62/83/99/511628399.db2.gz ASNICQDCWXMBGB-HNNXBMFYSA-N 1 1 371.441 2.530 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](Cc2cnn(C)c2)C1 ZINC000363559290 511628984 /nfs/dbraw/zinc/62/89/84/511628984.db2.gz ASNICQDCWXMBGB-OAHLLOKOSA-N 1 1 371.441 2.530 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(c3ncc([N+](=O)[O-])cc3Br)C2)C1 ZINC000292691246 511687031 /nfs/dbraw/zinc/68/70/31/511687031.db2.gz FMBSZBCPZNNDKN-AWEZNQCLSA-N 1 1 355.236 2.674 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000292837250 511740493 /nfs/dbraw/zinc/74/04/93/511740493.db2.gz AXDHAWKTMYPGLZ-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO CNC(=O)c1ccc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000311856748 511780579 /nfs/dbraw/zinc/78/05/79/511780579.db2.gz WVIMXQMFMUUQBH-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000324013819 511832987 /nfs/dbraw/zinc/83/29/87/511832987.db2.gz LVXOUIVSQKLNAO-OAHLLOKOSA-N 1 1 368.437 2.771 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000284857420 511901762 /nfs/dbraw/zinc/90/17/62/511901762.db2.gz RVQVVTREFMEGQZ-NVXWUHKLSA-N 1 1 363.414 2.575 20 5 FFBDMO Cn1cc(CN2CC[C@@]3(C2)CCC[N@@H+](C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609980 512025612 /nfs/dbraw/zinc/02/56/12/512025612.db2.gz JXNZFVRREYGQNB-FQEVSTJZSA-N 1 1 369.469 2.913 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@@]3(C2)CCCN(C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609980 512025631 /nfs/dbraw/zinc/02/56/31/512025631.db2.gz JXNZFVRREYGQNB-FQEVSTJZSA-N 1 1 369.469 2.913 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@]3(C2)CCCN(C)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000293609980 512025634 /nfs/dbraw/zinc/02/56/34/512025634.db2.gz JXNZFVRREYGQNB-FQEVSTJZSA-N 1 1 369.469 2.913 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000275112893 512045624 /nfs/dbraw/zinc/04/56/24/512045624.db2.gz NIUMXHOFSGYQKN-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000275112893 512045631 /nfs/dbraw/zinc/04/56/31/512045631.db2.gz NIUMXHOFSGYQKN-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO CC(C)C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCc2cccnc21 ZINC000364342919 512094278 /nfs/dbraw/zinc/09/42/78/512094278.db2.gz WAMBOEGQVRLGSA-MSOLQXFVSA-N 1 1 373.457 2.583 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000375694823 512459513 /nfs/dbraw/zinc/45/95/13/512459513.db2.gz ZLLCTFVVUBEZRP-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(NC(=O)c2ccccc2)CC1 ZINC000373728083 512475394 /nfs/dbraw/zinc/47/53/94/512475394.db2.gz NSKLJGMYRVCTRE-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@@H](CC)O[C@@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806895 512514943 /nfs/dbraw/zinc/51/49/43/512514943.db2.gz TUMZEVHPYBQVMI-QAPCUYQASA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@@H](CC)O[C@@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806895 512514946 /nfs/dbraw/zinc/51/49/46/512514946.db2.gz TUMZEVHPYBQVMI-QAPCUYQASA-N 1 1 350.415 2.763 20 5 FFBDMO O=C(CC[N@H+](CCCO)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411333431 512584565 /nfs/dbraw/zinc/58/45/65/512584565.db2.gz XBRCWWUQRCIHAE-UHFFFAOYSA-N 1 1 357.410 2.808 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4cncs4)CC3)nc2c1 ZINC000411527767 512674822 /nfs/dbraw/zinc/67/48/22/512674822.db2.gz RAIJLZCXCAXYAH-UHFFFAOYSA-N 1 1 372.454 2.682 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSCC[C@@H]1C ZINC000411629040 512726943 /nfs/dbraw/zinc/72/69/43/512726943.db2.gz ZSUZCBBQLMIMCM-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000374347077 512781378 /nfs/dbraw/zinc/78/13/78/512781378.db2.gz ASOXSQFJOAUYAG-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2nnc3n2CCOC3)s1 ZINC000376459334 512827881 /nfs/dbraw/zinc/82/78/81/512827881.db2.gz UCXVMFQHCVLIDU-UHFFFAOYSA-N 1 1 371.422 2.735 20 5 FFBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000378639138 512860624 /nfs/dbraw/zinc/86/06/24/512860624.db2.gz DPBGPSSFWATKAO-KSSFIOAISA-N 1 1 357.410 2.848 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@H](O)C[C@H]3c3ccccc3)o2)cc1 ZINC000411956657 512889467 /nfs/dbraw/zinc/88/94/67/512889467.db2.gz WJUBYKVTVCYENV-SJORKVTESA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@H](O)C[C@H]3c3ccccc3)o2)cc1 ZINC000411956657 512889469 /nfs/dbraw/zinc/88/94/69/512889469.db2.gz WJUBYKVTVCYENV-SJORKVTESA-N 1 1 366.377 2.953 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000411963906 512892441 /nfs/dbraw/zinc/89/24/41/512892441.db2.gz IADPXPPUHVLHII-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000411975385 512898313 /nfs/dbraw/zinc/89/83/13/512898313.db2.gz GTHGUABWDKJVFZ-SFHVURJKSA-N 1 1 361.348 2.502 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000411975385 512898319 /nfs/dbraw/zinc/89/83/19/512898319.db2.gz GTHGUABWDKJVFZ-SFHVURJKSA-N 1 1 361.348 2.502 20 5 FFBDMO NC(=O)c1ccc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000390708095 512910508 /nfs/dbraw/zinc/91/05/08/512910508.db2.gz SXSAVGPIUFEUCI-MRXNPFEDSA-N 1 1 354.410 2.770 20 5 FFBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)CN1CCOCC1 ZINC000412092785 512956243 /nfs/dbraw/zinc/95/62/43/512956243.db2.gz IKXPMPYPKAUCKD-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)CN1CCOCC1 ZINC000412092785 512956247 /nfs/dbraw/zinc/95/62/47/512956247.db2.gz IKXPMPYPKAUCKD-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C ZINC000408169761 513012838 /nfs/dbraw/zinc/01/28/38/513012838.db2.gz POTTWFZZKLPCBJ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000408169761 513012842 /nfs/dbraw/zinc/01/28/42/513012842.db2.gz POTTWFZZKLPCBJ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374865748 513044826 /nfs/dbraw/zinc/04/48/26/513044826.db2.gz SMBUCWNPFOYTFH-WMLDXEAASA-N 1 1 368.437 2.939 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000370739689 513078004 /nfs/dbraw/zinc/07/80/04/513078004.db2.gz OJBTYIZMKQZFMD-QAPCUYQASA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000370739689 513078009 /nfs/dbraw/zinc/07/80/09/513078009.db2.gz OJBTYIZMKQZFMD-QAPCUYQASA-N 1 1 357.410 2.813 20 5 FFBDMO C[N@H+]1CCCC12CCN(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2 ZINC000374976280 513094891 /nfs/dbraw/zinc/09/48/91/513094891.db2.gz FRNBGDCVPICEDR-UHFFFAOYSA-N 1 1 357.414 2.705 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000433854570 513167687 /nfs/dbraw/zinc/16/76/87/513167687.db2.gz XACYUHZBNUTICB-UHFFFAOYSA-N 1 1 359.430 2.645 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000439898856 513206526 /nfs/dbraw/zinc/20/65/26/513206526.db2.gz JAXTYSZEDHFNIV-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1C ZINC000440077457 513240654 /nfs/dbraw/zinc/24/06/54/513240654.db2.gz LFWFUPGXMAVFSJ-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428992591 513242741 /nfs/dbraw/zinc/24/27/41/513242741.db2.gz BHJFLFUFPOWLAJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428992591 513242745 /nfs/dbraw/zinc/24/27/45/513242745.db2.gz BHJFLFUFPOWLAJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428992591 513242755 /nfs/dbraw/zinc/24/27/55/513242755.db2.gz BHJFLFUFPOWLAJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3C)CC2)CC1 ZINC000421381956 513243067 /nfs/dbraw/zinc/24/30/67/513243067.db2.gz XQJOLELYLQVXSQ-UHFFFAOYSA-N 1 1 360.502 2.895 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3C)CC2)CC1 ZINC000421381956 513243077 /nfs/dbraw/zinc/24/30/77/513243077.db2.gz XQJOLELYLQVXSQ-UHFFFAOYSA-N 1 1 360.502 2.895 20 5 FFBDMO COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])c2cnccc12)C(C)C ZINC000450604834 513270024 /nfs/dbraw/zinc/27/00/24/513270024.db2.gz XTAZVIHAOVBGKG-KRWDZBQOSA-N 1 1 360.414 2.732 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc2O1 ZINC000429183463 513301253 /nfs/dbraw/zinc/30/12/53/513301253.db2.gz FLNWKIHXRKQASK-RHSMWYFYSA-N 1 1 358.394 2.618 20 5 FFBDMO CC[N@H+]1CC[C@H](NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000412885468 513323532 /nfs/dbraw/zinc/32/35/32/513323532.db2.gz YPYIPAOEIRFREO-LBPRGKRZSA-N 1 1 371.387 2.784 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421701472 513374367 /nfs/dbraw/zinc/37/43/67/513374367.db2.gz HSIFVKMXPGQNCA-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000421703970 513377313 /nfs/dbraw/zinc/37/73/13/513377313.db2.gz NQNIORNVKZKPPQ-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO COCCO[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000447101480 513399323 /nfs/dbraw/zinc/39/93/23/513399323.db2.gz XKEBAFFYIDRKLY-IRXDYDNUSA-N 1 1 366.458 2.564 20 5 FFBDMO C[C@H]1Cc2[nH+]cn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@@H]1C ZINC000450994362 513447015 /nfs/dbraw/zinc/44/70/15/513447015.db2.gz CHHGGETVZDHPRK-STQMWFEESA-N 1 1 354.410 2.751 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000434960590 513475954 /nfs/dbraw/zinc/47/59/54/513475954.db2.gz VEZANKJCEDEKLJ-QGZVFWFLSA-N 1 1 362.817 2.692 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCSC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000435052965 513500071 /nfs/dbraw/zinc/50/00/71/513500071.db2.gz ZKACLZVOAGXHTC-UHFFFAOYSA-N 1 1 368.455 2.864 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000451075287 513500110 /nfs/dbraw/zinc/50/01/10/513500110.db2.gz AMBOJOGFAWIDFU-QGZVFWFLSA-N 1 1 374.485 2.616 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441191476 513508151 /nfs/dbraw/zinc/50/81/51/513508151.db2.gz BXIZPRVYZKVHGP-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO COC(=O)c1cnc([C@@H](C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000425490818 513595975 /nfs/dbraw/zinc/59/59/75/513595975.db2.gz PVGOVVGTIAWRMA-SNVBAGLBSA-N 1 1 351.384 2.568 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1C[C@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000451262353 513634375 /nfs/dbraw/zinc/63/43/75/513634375.db2.gz KPUZLDQXQCMKHP-APWZRJJASA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000451262353 513634384 /nfs/dbraw/zinc/63/43/84/513634384.db2.gz KPUZLDQXQCMKHP-APWZRJJASA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@@H]3[C@H]3CCCOC3)co2)cc1 ZINC000451302933 513663604 /nfs/dbraw/zinc/66/36/04/513663604.db2.gz LNBRRMVPEVDKEE-BMGDILEWSA-N 1 1 373.409 2.612 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451344438 513690346 /nfs/dbraw/zinc/69/03/46/513690346.db2.gz PQQCJBRYMRLTFB-INMHGKMJSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC3CCS(=O)(=O)CC3)C2)cc1 ZINC000451546312 513823670 /nfs/dbraw/zinc/82/36/70/513823670.db2.gz IQDXEMQRDLHFRW-INIZCTEOSA-N 1 1 352.456 2.599 20 5 FFBDMO O=C(C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21)Nc1ccccc1[N+](=O)[O-] ZINC000451628702 513874330 /nfs/dbraw/zinc/87/43/30/513874330.db2.gz PYWSNMBSNHBLEV-ZBFHGGJFSA-N 1 1 359.426 2.814 20 5 FFBDMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C[C@H](C)[N@@H+]1CCO ZINC000451654249 513890922 /nfs/dbraw/zinc/89/09/22/513890922.db2.gz BFAUZCKFDUGUEE-TXEJJXNPSA-N 1 1 361.364 2.501 20 5 FFBDMO C[C@H]1CN(CC(F)(F)F)CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000451875566 514037902 /nfs/dbraw/zinc/03/79/02/514037902.db2.gz VKWTVHLOSBMOFH-CYBMUJFWSA-N 1 1 361.364 2.790 20 5 FFBDMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000451875566 514037906 /nfs/dbraw/zinc/03/79/06/514037906.db2.gz VKWTVHLOSBMOFH-CYBMUJFWSA-N 1 1 361.364 2.790 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@@H]1CCC[N@H+](C)C1 ZINC000444084785 514118299 /nfs/dbraw/zinc/11/82/99/514118299.db2.gz LLEAGOHUCAPCRN-CYBMUJFWSA-N 1 1 367.424 2.987 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@@H]1CCC[N@@H+](C)C1 ZINC000444084785 514118311 /nfs/dbraw/zinc/11/83/11/514118311.db2.gz LLEAGOHUCAPCRN-CYBMUJFWSA-N 1 1 367.424 2.987 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@H]1c1ccccc1 ZINC000452010800 514133961 /nfs/dbraw/zinc/13/39/61/514133961.db2.gz WFOCZKRHYOJPJL-ZWKOTPCHSA-N 1 1 370.405 2.992 20 5 FFBDMO COC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097504 514188989 /nfs/dbraw/zinc/18/89/89/514188989.db2.gz ZQJGFAPCGWDQDY-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097504 514188997 /nfs/dbraw/zinc/18/89/97/514188997.db2.gz ZQJGFAPCGWDQDY-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H]1C[C@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000420602232 514196986 /nfs/dbraw/zinc/19/69/86/514196986.db2.gz OLQWAHCQYMZJKM-ZFWWWQNUSA-N 1 1 354.410 2.769 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601473 514197118 /nfs/dbraw/zinc/19/71/18/514197118.db2.gz NMMWGPSMGAJJLA-INIZCTEOSA-N 1 1 368.437 2.652 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346341 514199529 /nfs/dbraw/zinc/19/95/29/514199529.db2.gz UZUWWNDFQXUMFA-ZIAGYGMSSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346341 514199532 /nfs/dbraw/zinc/19/95/32/514199532.db2.gz UZUWWNDFQXUMFA-ZIAGYGMSSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346341 514199535 /nfs/dbraw/zinc/19/95/35/514199535.db2.gz UZUWWNDFQXUMFA-ZIAGYGMSSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346341 514199539 /nfs/dbraw/zinc/19/95/39/514199539.db2.gz UZUWWNDFQXUMFA-ZIAGYGMSSA-N 1 1 371.441 2.615 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000444778429 514329878 /nfs/dbraw/zinc/32/98/78/514329878.db2.gz UYSVDFNWTXMEKF-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000444778429 514329884 /nfs/dbraw/zinc/32/98/84/514329884.db2.gz UYSVDFNWTXMEKF-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCSC1 ZINC000433201649 514421254 /nfs/dbraw/zinc/42/12/54/514421254.db2.gz MVPWFIYKPHDPDR-HNNXBMFYSA-N 1 1 368.455 2.805 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415132453 514460371 /nfs/dbraw/zinc/46/03/71/514460371.db2.gz UGJKMBHYPBPFJM-PKOBYXMFSA-N 1 1 363.458 2.712 20 5 FFBDMO O=C1C[C@@H]([N@H+]2CCCC3(CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000445480712 514486074 /nfs/dbraw/zinc/48/60/74/514486074.db2.gz ISWVCRREBFMLAR-MRXNPFEDSA-N 1 1 357.410 2.883 20 5 FFBDMO Cn1c2ccc(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2sc1=O ZINC000475226908 514588732 /nfs/dbraw/zinc/58/87/32/514588732.db2.gz AOQPADCRGKTSGM-UHFFFAOYSA-N 1 1 369.406 2.674 20 5 FFBDMO COC(=O)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000497727946 514613075 /nfs/dbraw/zinc/61/30/75/514613075.db2.gz QABHAGGWFKMUND-LBPRGKRZSA-N 1 1 374.397 2.981 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccc(F)c3cccnc23)CC1 ZINC000453574326 514694076 /nfs/dbraw/zinc/69/40/76/514694076.db2.gz IIPJZZAOBCAOCU-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231143 514761343 /nfs/dbraw/zinc/76/13/43/514761343.db2.gz IPQZPDOHUQGPPA-BFYDXBDKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231143 514761350 /nfs/dbraw/zinc/76/13/50/514761350.db2.gz IPQZPDOHUQGPPA-BFYDXBDKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cccc(C)n1 ZINC000471195930 514792592 /nfs/dbraw/zinc/79/25/92/514792592.db2.gz LWTMOVDORWAKMI-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000466923250 514829731 /nfs/dbraw/zinc/82/97/31/514829731.db2.gz JFNHNDHENWGVBG-KDOFPFPSSA-N 1 1 360.458 2.998 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000462160211 514918335 /nfs/dbraw/zinc/91/83/35/514918335.db2.gz UPJYDKACXWLFAS-KUHUBIRLSA-N 1 1 371.412 2.913 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000462190957 514933441 /nfs/dbraw/zinc/93/34/41/514933441.db2.gz RNCWPDHHSNVFGO-FZKQIMNGSA-N 1 1 357.385 2.984 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000498705635 515031717 /nfs/dbraw/zinc/03/17/17/515031717.db2.gz ITAIVZWCIDWYJH-HOTGVXAUSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000498710592 515035427 /nfs/dbraw/zinc/03/54/27/515035427.db2.gz PYCCSPNIPJWSTG-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000503483696 515050284 /nfs/dbraw/zinc/05/02/84/515050284.db2.gz CGOIJAWPSTVNCE-HNNXBMFYSA-N 1 1 372.425 2.755 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485903448 515249664 /nfs/dbraw/zinc/24/96/64/515249664.db2.gz DXTULWNTUKHQEW-NWDGAFQWSA-N 1 1 355.385 2.652 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000472460616 515276889 /nfs/dbraw/zinc/27/68/89/515276889.db2.gz DSOFNTWOFDWORE-WBVHZDCISA-N 1 1 374.485 2.894 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000499670366 515405620 /nfs/dbraw/zinc/40/56/20/515405620.db2.gz QJEBOZBGKXSUGW-MRXNPFEDSA-N 1 1 371.441 2.775 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000468626818 515443403 /nfs/dbraw/zinc/44/34/03/515443403.db2.gz JKVLOQNSLDDQLW-FSEPTYSPSA-N 1 1 360.502 2.861 20 5 FFBDMO C[C@H]1C[C@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510231774 515476782 /nfs/dbraw/zinc/47/67/82/515476782.db2.gz ZIGDTZGKQLKOPV-HOCLYGCPSA-N 1 1 356.426 2.953 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCCC[C@H]1C ZINC000468710787 515481133 /nfs/dbraw/zinc/48/11/33/515481133.db2.gz IHXNCVXCMSCVOL-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCCC[C@H]1C ZINC000468710787 515481140 /nfs/dbraw/zinc/48/11/40/515481140.db2.gz IHXNCVXCMSCVOL-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000505330416 515506487 /nfs/dbraw/zinc/50/64/87/515506487.db2.gz KCAVQXCGIDJLIC-AWEZNQCLSA-N 1 1 363.805 2.538 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CCN([C@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)n1 ZINC000459425851 515544816 /nfs/dbraw/zinc/54/48/16/515544816.db2.gz MIGVSGKULGNPEC-SFHVURJKSA-N 1 1 355.442 2.703 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+]([C@H]3CCN(Cc4ccccc4)C3)CC2)n1 ZINC000459425851 515544819 /nfs/dbraw/zinc/54/48/19/515544819.db2.gz MIGVSGKULGNPEC-SFHVURJKSA-N 1 1 355.442 2.703 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505483662 515550805 /nfs/dbraw/zinc/55/08/05/515550805.db2.gz KYBFCAOVEUSNLV-SFHVURJKSA-N 1 1 353.422 2.873 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454623402 515615972 /nfs/dbraw/zinc/61/59/72/515615972.db2.gz ASGRCVOFKAOHTB-INIZCTEOSA-N 1 1 357.414 2.689 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1nc2ccccc2cc1[N+](=O)[O-] ZINC000473527137 515648498 /nfs/dbraw/zinc/64/84/98/515648498.db2.gz ZMRLZUHBOQIPAX-UHFFFAOYSA-N 1 1 365.393 2.849 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)c1 ZINC000459568207 515657288 /nfs/dbraw/zinc/65/72/88/515657288.db2.gz BDYUYHIEOBTUQP-MSOLQXFVSA-N 1 1 356.426 2.770 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCC[N@H+]1C ZINC000454785926 515744070 /nfs/dbraw/zinc/74/40/70/515744070.db2.gz NDKQJPWBFVVXRU-KYJSFNMBSA-N 1 1 360.458 2.967 20 5 FFBDMO O=[N+]([O-])c1ccccc1CCNc1ncnc2c1cnn2-c1cc[nH+]cc1 ZINC000506139941 515794859 /nfs/dbraw/zinc/79/48/59/515794859.db2.gz UOXOQWKBDJYCNZ-UHFFFAOYSA-N 1 1 361.365 2.773 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459806273 515818222 /nfs/dbraw/zinc/81/82/22/515818222.db2.gz MNEVEHJZFUDDPH-ZDUSSCGKSA-N 1 1 365.430 2.833 20 5 FFBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000459808461 515821929 /nfs/dbraw/zinc/82/19/29/515821929.db2.gz OWISYXUYBKGMAO-STQMWFEESA-N 1 1 365.430 2.831 20 5 FFBDMO CCN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000478437697 515823235 /nfs/dbraw/zinc/82/32/35/515823235.db2.gz QCGNYTPNZABYCL-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000478437697 515823239 /nfs/dbraw/zinc/82/32/39/515823239.db2.gz QCGNYTPNZABYCL-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000478437697 515823245 /nfs/dbraw/zinc/82/32/45/515823245.db2.gz QCGNYTPNZABYCL-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000494386540 515826818 /nfs/dbraw/zinc/82/68/18/515826818.db2.gz NRJHDLZJNSYKCA-MQIPJXDCSA-N 1 1 350.394 2.928 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000511607984 515960808 /nfs/dbraw/zinc/96/08/08/515960808.db2.gz ANQUJOVMEALUHR-LLVKDONJSA-N 1 1 359.373 2.731 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000469874519 516009862 /nfs/dbraw/zinc/00/98/62/516009862.db2.gz WEWWGSQXOZJVOD-AWEZNQCLSA-N 1 1 361.423 2.535 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000469874519 516009874 /nfs/dbraw/zinc/00/98/74/516009874.db2.gz WEWWGSQXOZJVOD-AWEZNQCLSA-N 1 1 361.423 2.535 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474431920 516043475 /nfs/dbraw/zinc/04/34/75/516043475.db2.gz JCXYYVZIKDHZOT-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000507003300 516049482 /nfs/dbraw/zinc/04/94/82/516049482.db2.gz VRQGWRJIGPKUSX-CJNGLKHVSA-N 1 1 354.410 2.941 20 5 FFBDMO C[C@@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000483407400 516074181 /nfs/dbraw/zinc/07/41/81/516074181.db2.gz OCIHAJFUXPQZMQ-LJQANCHMSA-N 1 1 357.385 2.996 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1OCCc2ccccc21 ZINC000507243642 516137671 /nfs/dbraw/zinc/13/76/71/516137671.db2.gz RPWMGTOBIXOGDK-PXNSSMCTSA-N 1 1 372.421 2.580 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000470137382 516137942 /nfs/dbraw/zinc/13/79/42/516137942.db2.gz JYVWUJFZWRGYPE-OAHLLOKOSA-N 1 1 368.409 2.699 20 5 FFBDMO CCN1CCC[N@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1=O ZINC000470154879 516149781 /nfs/dbraw/zinc/14/97/81/516149781.db2.gz NRZCXJOZAJRPPS-UHFFFAOYSA-N 1 1 373.409 2.918 20 5 FFBDMO CCN1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1=O ZINC000470154879 516149789 /nfs/dbraw/zinc/14/97/89/516149789.db2.gz NRZCXJOZAJRPPS-UHFFFAOYSA-N 1 1 373.409 2.918 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1CCOC ZINC000501596652 516167610 /nfs/dbraw/zinc/16/76/10/516167610.db2.gz ZEDCGJGKSWCMAP-OAHLLOKOSA-N 1 1 374.441 2.649 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3)C[C@@H]21 ZINC000455406819 516181605 /nfs/dbraw/zinc/18/16/05/516181605.db2.gz WDXPNVWDTQTKJV-RNCFNFMXSA-N 1 1 369.219 2.525 20 5 FFBDMO Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000479407746 516184251 /nfs/dbraw/zinc/18/42/51/516184251.db2.gz BSIAXVWWPRKHKW-CYBMUJFWSA-N 1 1 366.414 2.994 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000507382302 516195990 /nfs/dbraw/zinc/19/59/90/516195990.db2.gz QBRICBYJXQOJSY-QGZVFWFLSA-N 1 1 362.474 2.949 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000470297879 516197893 /nfs/dbraw/zinc/19/78/93/516197893.db2.gz QHUKLEWNUICLPZ-UHFFFAOYSA-N 1 1 358.442 2.788 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC000460817585 516256036 /nfs/dbraw/zinc/25/60/36/516256036.db2.gz VBISWZPNKIHUHE-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000512408440 516267867 /nfs/dbraw/zinc/26/78/67/516267867.db2.gz HDBKKYVZOGHKQT-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000557628678 516345962 /nfs/dbraw/zinc/34/59/62/516345962.db2.gz LTJOOEAHGKRWOL-OAHLLOKOSA-N 1 1 361.442 2.858 20 5 FFBDMO COc1cc(NCC[NH+]2CCN(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000531568672 516533037 /nfs/dbraw/zinc/53/30/37/516533037.db2.gz WRXMQDOMPITJBO-UHFFFAOYSA-N 1 1 374.416 2.977 20 5 FFBDMO CCCN(C(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000547758230 516545444 /nfs/dbraw/zinc/54/54/44/516545444.db2.gz XBXZSNMJEVYIIT-INIZCTEOSA-N 1 1 371.441 2.835 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCCCN2CCN(c3cc[nH+]cc3)CC2)n1 ZINC000554621814 516550193 /nfs/dbraw/zinc/55/01/93/516550193.db2.gz GVLOGRUVCIOZKS-UHFFFAOYSA-N 1 1 370.457 2.626 20 5 FFBDMO CCc1ccc(C(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000531663301 516584678 /nfs/dbraw/zinc/58/46/78/516584678.db2.gz DPTQMVDGECVMIV-DLBZAZTESA-N 1 1 361.442 2.530 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000554699309 516593385 /nfs/dbraw/zinc/59/33/85/516593385.db2.gz BWJWVVBPLNDRLV-OCCSQVGLSA-N 1 1 371.441 2.543 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000536029829 516598360 /nfs/dbraw/zinc/59/83/60/516598360.db2.gz UEXJEAZULBDOPB-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000536029829 516598369 /nfs/dbraw/zinc/59/83/69/516598369.db2.gz UEXJEAZULBDOPB-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1O ZINC000544186412 516632254 /nfs/dbraw/zinc/63/22/54/516632254.db2.gz ZYTOGYCYYCSXFD-ZDUSSCGKSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1O ZINC000544186412 516632259 /nfs/dbraw/zinc/63/22/59/516632259.db2.gz ZYTOGYCYYCSXFD-ZDUSSCGKSA-N 1 1 373.409 2.811 20 5 FFBDMO COC(=O)c1cccc(OCC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554836058 516658349 /nfs/dbraw/zinc/65/83/49/516658349.db2.gz XWHMSUJLAMFUHW-UHFFFAOYSA-N 1 1 358.394 2.935 20 5 FFBDMO Cc1nn(C)c(C)c1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656588 516709929 /nfs/dbraw/zinc/70/99/29/516709929.db2.gz VNUBTZOFYRAHHX-GOSISDBHSA-N 1 1 368.441 2.600 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000558460964 516753255 /nfs/dbraw/zinc/75/32/55/516753255.db2.gz BHSBWBZOUXTNOK-IBGZPJMESA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000558460964 516753259 /nfs/dbraw/zinc/75/32/59/516753259.db2.gz BHSBWBZOUXTNOK-IBGZPJMESA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000548094767 516758423 /nfs/dbraw/zinc/75/84/23/516758423.db2.gz OJWUUYCITFPYDK-MJGOQNOKSA-N 1 1 368.437 2.882 20 5 FFBDMO CCCc1n[nH]c(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637203 516775599 /nfs/dbraw/zinc/77/55/99/516775599.db2.gz QDOODUOOWSHPIF-MJBXVCDLSA-N 1 1 363.462 2.748 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637203 516775606 /nfs/dbraw/zinc/77/56/06/516775606.db2.gz QDOODUOOWSHPIF-MJBXVCDLSA-N 1 1 363.462 2.748 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637203 516775612 /nfs/dbraw/zinc/77/56/12/516775612.db2.gz QDOODUOOWSHPIF-MJBXVCDLSA-N 1 1 363.462 2.748 20 5 FFBDMO Cc1cc(N2CCN(c3[nH+]ccn3C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555165649 516813206 /nfs/dbraw/zinc/81/32/06/516813206.db2.gz VJQUAHOOYHJTEI-UHFFFAOYSA-N 1 1 369.347 2.982 20 5 FFBDMO C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000548294180 516878994 /nfs/dbraw/zinc/87/89/94/516878994.db2.gz HXUAHERVSQVGCJ-LJQANCHMSA-N 1 1 354.410 2.774 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000519128054 516894224 /nfs/dbraw/zinc/89/42/24/516894224.db2.gz ALSFPLJVXGYDDZ-AWEZNQCLSA-N 1 1 363.801 2.818 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000525053987 516903579 /nfs/dbraw/zinc/90/35/79/516903579.db2.gz TUMQXMIUMCTRDE-OCCSQVGLSA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC000532397936 516953380 /nfs/dbraw/zinc/95/33/80/516953380.db2.gz ZQZYBTJZZWXFEH-UHFFFAOYSA-N 1 1 368.437 2.974 20 5 FFBDMO Cc1cccc(NCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c1[N+](=O)[O-] ZINC000558887689 516988434 /nfs/dbraw/zinc/98/84/34/516988434.db2.gz BBCQWADHKBPKGT-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC[C@@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000555579139 516989851 /nfs/dbraw/zinc/98/98/51/516989851.db2.gz WLHJTNMJZCNKDG-KRWDZBQOSA-N 1 1 367.409 2.742 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H]1CC[N@H+](CC)[C@H](C)C1 ZINC000525385637 517024765 /nfs/dbraw/zinc/02/47/65/517024765.db2.gz FCQCQYPGIBKAQG-HIFRSBDPSA-N 1 1 369.487 2.651 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525466491 517051045 /nfs/dbraw/zinc/05/10/45/517051045.db2.gz ZYJSMZVFMJIZIX-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525466491 517051050 /nfs/dbraw/zinc/05/10/50/517051050.db2.gz ZYJSMZVFMJIZIX-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000525544407 517072424 /nfs/dbraw/zinc/07/24/24/517072424.db2.gz BZUZIZVFVOFGNC-MBNYWOFBSA-N 1 1 369.849 2.957 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)c3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000552134517 517100259 /nfs/dbraw/zinc/10/02/59/517100259.db2.gz OCWBKDDUNIDBQQ-CQSZACIVSA-N 1 1 374.466 2.954 20 5 FFBDMO C[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@H+]1CCc2ccccc2C1 ZINC000541577661 517121003 /nfs/dbraw/zinc/12/10/03/517121003.db2.gz FFOJMGUPJLXQGY-CQSZACIVSA-N 1 1 363.421 2.819 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@H](C)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000541594294 517130069 /nfs/dbraw/zinc/13/00/69/517130069.db2.gz ALTGBQSKGFTBQR-CQSZACIVSA-N 1 1 372.400 2.890 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](CCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000548761167 517195999 /nfs/dbraw/zinc/19/59/99/517195999.db2.gz LACALNCSLNLMCC-HOTGVXAUSA-N 1 1 362.474 2.881 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000545365087 517200608 /nfs/dbraw/zinc/20/06/08/517200608.db2.gz GNTPLBJQRRSANL-INIZCTEOSA-N 1 1 369.487 2.525 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000532924991 517204327 /nfs/dbraw/zinc/20/43/27/517204327.db2.gz YYCFDDBDBJTGJI-UHFFFAOYSA-N 1 1 368.437 2.770 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000532924991 517204331 /nfs/dbraw/zinc/20/43/31/517204331.db2.gz YYCFDDBDBJTGJI-UHFFFAOYSA-N 1 1 368.437 2.770 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000519844045 517217286 /nfs/dbraw/zinc/21/72/86/517217286.db2.gz OYIRHZZRHLQTSI-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO CN1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccc[nH+]c21 ZINC000537564980 517232000 /nfs/dbraw/zinc/23/20/00/517232000.db2.gz QYARCJWDBJFXIA-UHFFFAOYSA-N 1 1 361.789 2.538 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000541821586 517232555 /nfs/dbraw/zinc/23/25/55/517232555.db2.gz UHRIUMDNCMMCFE-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H]1Cc2ccccc2C[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000532978946 517233150 /nfs/dbraw/zinc/23/31/50/517233150.db2.gz OWJOQQWTFBGEEH-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@H]1Cc2ccccc2C[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000532978946 517233154 /nfs/dbraw/zinc/23/31/54/517233154.db2.gz OWJOQQWTFBGEEH-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO COC(=O)CCC1CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000533344534 517414925 /nfs/dbraw/zinc/41/49/25/517414925.db2.gz KUZHUWLEAIUMJY-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO COC(=O)CCC1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000533482110 517486696 /nfs/dbraw/zinc/48/66/96/517486696.db2.gz QTGVSSUDRWFKPQ-UHFFFAOYSA-N 1 1 374.397 2.810 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542404961 517543181 /nfs/dbraw/zinc/54/31/81/517543181.db2.gz CQCAWXXSPBUPSW-GXFFZTMASA-N 1 1 369.874 2.939 20 5 FFBDMO CC1(C2CC2)CC[NH+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000520905837 517548166 /nfs/dbraw/zinc/54/81/66/517548166.db2.gz BJOSXHQZRHKZEW-MRXNPFEDSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc1)[NH+]1CCOCC1 ZINC000521144562 517627557 /nfs/dbraw/zinc/62/75/57/517627557.db2.gz QLACOOFUOQPCOJ-CYBMUJFWSA-N 1 1 358.398 2.579 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCCc1cn2c([nH+]1)CCCC2 ZINC000553306689 517634912 /nfs/dbraw/zinc/63/49/12/517634912.db2.gz ZZCFYFOSGDDEQD-UHFFFAOYSA-N 1 1 358.398 2.877 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000546565839 517730544 /nfs/dbraw/zinc/73/05/44/517730544.db2.gz RPRWOVMYEGOMTM-CYBMUJFWSA-N 1 1 351.422 2.812 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000542807052 517755827 /nfs/dbraw/zinc/75/58/27/517755827.db2.gz INOGYJQJGKYLBX-INIZCTEOSA-N 1 1 363.801 2.987 20 5 FFBDMO C[N@@H+](CCCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)C1CCCCC1 ZINC000557521203 518051481 /nfs/dbraw/zinc/05/14/81/518051481.db2.gz BJAGLOBLWPFCHW-UHFFFAOYSA-N 1 1 359.430 2.732 20 5 FFBDMO C[C@]1(NC(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000569725656 518260056 /nfs/dbraw/zinc/26/00/56/518260056.db2.gz CYYQUGNPKKSNIS-FQEVSTJZSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1 ZINC000570032330 518408956 /nfs/dbraw/zinc/40/89/56/518408956.db2.gz ZLAAOJDEJHZJBG-QGZVFWFLSA-N 1 1 355.394 2.722 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000585767608 518590739 /nfs/dbraw/zinc/59/07/39/518590739.db2.gz LSACHTBDMXOVIG-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000579393673 518659303 /nfs/dbraw/zinc/65/93/03/518659303.db2.gz OMOYKNZZQLOYQW-LBPRGKRZSA-N 1 1 357.863 2.893 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000579393673 518659305 /nfs/dbraw/zinc/65/93/05/518659305.db2.gz OMOYKNZZQLOYQW-LBPRGKRZSA-N 1 1 357.863 2.893 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000589496437 519018729 /nfs/dbraw/zinc/01/87/29/519018729.db2.gz TYPDTTZCVATYQM-UHFFFAOYSA-N 1 1 364.398 2.547 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CCCO)c2ccccc2)c1 ZINC000589506597 519020373 /nfs/dbraw/zinc/02/03/73/519020373.db2.gz HDGOFTNRLMYTHH-KRWDZBQOSA-N 1 1 358.394 2.985 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000589520490 519023269 /nfs/dbraw/zinc/02/32/69/519023269.db2.gz TWQBDKJUCJCYBR-LLVKDONJSA-N 1 1 358.341 2.624 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC(F)(F)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000589520490 519023276 /nfs/dbraw/zinc/02/32/76/519023276.db2.gz TWQBDKJUCJCYBR-LLVKDONJSA-N 1 1 358.341 2.624 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000589536955 519026583 /nfs/dbraw/zinc/02/65/83/519026583.db2.gz MSNFDAPOXQLGRB-JTQLQIEISA-N 1 1 358.236 2.816 20 5 FFBDMO CCOC(=O)Cn1nc(C)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000568444784 519040923 /nfs/dbraw/zinc/04/09/23/519040923.db2.gz AFDMALVEYOLQFY-UHFFFAOYSA-N 1 1 374.441 2.646 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c1 ZINC000589737652 519074226 /nfs/dbraw/zinc/07/42/26/519074226.db2.gz FUOPERCTVOCWLE-FQEVSTJZSA-N 1 1 370.405 2.517 20 5 FFBDMO COc1ccc(OCC[N@H+]2C[C@@H](c3cnn(C)c3)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000583213072 519133928 /nfs/dbraw/zinc/13/39/28/519133928.db2.gz YOBYHGQBNQIHTQ-INIZCTEOSA-N 1 1 374.441 2.841 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CC2(CCC2)O1 ZINC000583261119 519158740 /nfs/dbraw/zinc/15/87/40/519158740.db2.gz FVYWZQUWYSIZRY-CYBMUJFWSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590177311 519168568 /nfs/dbraw/zinc/16/85/68/519168568.db2.gz SXSCQJQPGHIQPO-LBPRGKRZSA-N 1 1 361.364 2.766 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000580466091 519190038 /nfs/dbraw/zinc/19/00/38/519190038.db2.gz KISDDIGRYMOYRC-CQSZACIVSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000565995813 519236416 /nfs/dbraw/zinc/23/64/16/519236416.db2.gz UNEHZQSEJXFOTD-INIZCTEOSA-N 1 1 373.457 2.743 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000580608935 519262108 /nfs/dbraw/zinc/26/21/08/519262108.db2.gz WAVFVITXKQVYDS-OAHLLOKOSA-N 1 1 350.463 2.899 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000590556006 519263939 /nfs/dbraw/zinc/26/39/39/519263939.db2.gz WILITNIINYTQKL-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000590685687 519316504 /nfs/dbraw/zinc/31/65/04/519316504.db2.gz SHDKAVBCHAQYFO-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000590747518 519346021 /nfs/dbraw/zinc/34/60/21/519346021.db2.gz COEHBKHLAAMURM-OAHLLOKOSA-N 1 1 363.458 2.977 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])c1 ZINC000580906225 519420060 /nfs/dbraw/zinc/42/00/60/519420060.db2.gz LIBVTVBRUZLSHF-UHFFFAOYSA-N 1 1 372.425 2.571 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000583782302 519428828 /nfs/dbraw/zinc/42/88/28/519428828.db2.gz FFUUNBLICGRCBM-MRXNPFEDSA-N 1 1 364.446 2.636 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000583820435 519451188 /nfs/dbraw/zinc/45/11/88/519451188.db2.gz DGNYJRQFLOGEDN-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO CN1CCC([N@@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147579 519530152 /nfs/dbraw/zinc/53/01/52/519530152.db2.gz OJFYLLLZESRSFA-LLVKDONJSA-N 1 1 373.379 2.589 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147579 519530158 /nfs/dbraw/zinc/53/01/58/519530158.db2.gz OJFYLLLZESRSFA-LLVKDONJSA-N 1 1 373.379 2.589 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490201 519578441 /nfs/dbraw/zinc/57/84/41/519578441.db2.gz UIIYWASJIRUUDG-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@@H](C[N@H+](C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490201 519578474 /nfs/dbraw/zinc/57/84/74/519578474.db2.gz UIIYWASJIRUUDG-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@@H](C[N@@H+](C)CCn3ccc([N+](=O)[O-])n3)C2)s1 ZINC000569490201 519578478 /nfs/dbraw/zinc/57/84/78/519578478.db2.gz UIIYWASJIRUUDG-HNNXBMFYSA-N 1 1 363.487 2.615 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC000575319372 519586711 /nfs/dbraw/zinc/58/67/11/519586711.db2.gz FAHPZVCIWBCMPS-CQSZACIVSA-N 1 1 354.410 2.728 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000602855817 519929196 /nfs/dbraw/zinc/92/91/96/519929196.db2.gz PQYMUTUFHUMHHG-AEFFLSMTSA-N 1 1 357.410 2.609 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461702 519973693 /nfs/dbraw/zinc/97/36/93/519973693.db2.gz PTLSUECHYOCVMC-SNVBAGLBSA-N 1 1 362.386 2.888 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1C ZINC000594483931 519992995 /nfs/dbraw/zinc/99/29/95/519992995.db2.gz LFRNTHYRIAXOME-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594484873 519995306 /nfs/dbraw/zinc/99/53/06/519995306.db2.gz WLDZUALZSZYCNI-OLZOCXBDSA-N 1 1 373.862 2.543 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612528999 520005823 /nfs/dbraw/zinc/00/58/23/520005823.db2.gz YKFHWQRAIJKLBZ-MNOVXSKESA-N 1 1 357.332 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2nccc3ccccc32)cc1 ZINC000612591676 520038942 /nfs/dbraw/zinc/03/89/42/520038942.db2.gz VBSXNNDRPAGODI-UHFFFAOYSA-N 1 1 371.418 2.707 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600110239 520054073 /nfs/dbraw/zinc/05/40/73/520054073.db2.gz ZERCQOQVXBSRKG-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO Cc1[nH]c2nc[nH+]c(N3CCN(c4ccccc4[N+](=O)[O-])CC3)c2c1C ZINC000591888772 520070291 /nfs/dbraw/zinc/07/02/91/520070291.db2.gz BKGYCJXZBRJVGV-UHFFFAOYSA-N 1 1 352.398 2.810 20 5 FFBDMO CSc1cccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c1[N+](=O)[O-] ZINC000597581037 520117164 /nfs/dbraw/zinc/11/71/64/520117164.db2.gz OSDJVPXOVUOLIA-STQMWFEESA-N 1 1 353.419 2.575 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 ZINC000608860479 520147315 /nfs/dbraw/zinc/14/73/15/520147315.db2.gz PNHMDNWEESLRBG-LJQANCHMSA-N 1 1 366.421 2.951 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000600297355 520187726 /nfs/dbraw/zinc/18/77/26/520187726.db2.gz BHNYARXZEWYMOY-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000600297355 520187735 /nfs/dbraw/zinc/18/77/35/520187735.db2.gz BHNYARXZEWYMOY-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C2 ZINC000597711497 520191590 /nfs/dbraw/zinc/19/15/90/520191590.db2.gz TZBKDTPYZKXWBR-IBGZPJMESA-N 1 1 359.426 2.502 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000600313845 520201552 /nfs/dbraw/zinc/20/15/52/520201552.db2.gz KOHVRHUSWXJNKC-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1cnn(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)c1 ZINC000592130665 520204517 /nfs/dbraw/zinc/20/45/17/520204517.db2.gz HPQLSEUPYZPKGT-IYARVYRRSA-N 1 1 358.442 2.905 20 5 FFBDMO CC[C@@H](C)NC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131027 520205065 /nfs/dbraw/zinc/20/50/65/520205065.db2.gz QLFUNKMLVIZBBY-DJIMGWMZSA-N 1 1 363.458 2.615 20 5 FFBDMO CC[C@@H](C)NC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131027 520205069 /nfs/dbraw/zinc/20/50/69/520205069.db2.gz QLFUNKMLVIZBBY-DJIMGWMZSA-N 1 1 363.458 2.615 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](n4ccnc4)C3)o2)cc1 ZINC000609157364 520213238 /nfs/dbraw/zinc/21/32/38/520213238.db2.gz GMLIDIQXFDNMEZ-HNNXBMFYSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](n4ccnc4)C3)o2)cc1 ZINC000609157364 520213243 /nfs/dbraw/zinc/21/32/43/520213243.db2.gz GMLIDIQXFDNMEZ-HNNXBMFYSA-N 1 1 354.370 2.678 20 5 FFBDMO COc1ccccc1C1([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000592143074 520218492 /nfs/dbraw/zinc/21/84/92/520218492.db2.gz LKVBQWHIDUNIQD-UHFFFAOYSA-N 1 1 371.393 2.829 20 5 FFBDMO Cc1ccc(C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC2CC2)cn1 ZINC000592145725 520222786 /nfs/dbraw/zinc/22/27/86/520222786.db2.gz ZKGUGJCRMVRLIC-IBGZPJMESA-N 1 1 371.437 2.950 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000594994295 520248017 /nfs/dbraw/zinc/24/80/17/520248017.db2.gz JOWJMWOGSANMIJ-KRWDZBQOSA-N 1 1 360.483 2.562 20 5 FFBDMO CN1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000594994295 520248025 /nfs/dbraw/zinc/24/80/25/520248025.db2.gz JOWJMWOGSANMIJ-KRWDZBQOSA-N 1 1 360.483 2.562 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C/c1nc([C@@H]2C[N@@H+]3CCC[C@@H]3CO2)no1 ZINC000612981974 520255646 /nfs/dbraw/zinc/25/56/46/520255646.db2.gz GXXHGJCBVZQWNY-HNLSUCLVSA-N 1 1 360.345 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C/c1nc([C@@H]2C[N@H+]3CCC[C@@H]3CO2)no1 ZINC000612981974 520255653 /nfs/dbraw/zinc/25/56/53/520255653.db2.gz GXXHGJCBVZQWNY-HNLSUCLVSA-N 1 1 360.345 2.823 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000600473998 520281335 /nfs/dbraw/zinc/28/13/35/520281335.db2.gz VZLYACFLVRAPIV-MRXNPFEDSA-N 1 1 361.442 2.805 20 5 FFBDMO Cc1ccncc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595072092 520281869 /nfs/dbraw/zinc/28/18/69/520281869.db2.gz FGKNUDFQIGZHIS-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC000609383256 520298459 /nfs/dbraw/zinc/29/84/59/520298459.db2.gz YDMNEVXEHRKBDO-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597922679 520325211 /nfs/dbraw/zinc/32/52/11/520325211.db2.gz KPVMRDWWAAAJRN-JTQLQIEISA-N 1 1 357.357 2.799 20 5 FFBDMO O=C([C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000609552835 520355462 /nfs/dbraw/zinc/35/54/62/520355462.db2.gz FBVCQJOEXQGRCI-INIZCTEOSA-N 1 1 361.442 2.698 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000603834242 520370615 /nfs/dbraw/zinc/37/06/15/520370615.db2.gz NAJMODOOHAIZQX-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000609599238 520373595 /nfs/dbraw/zinc/37/35/95/520373595.db2.gz GWTLCHPDKHVJCE-OAHLLOKOSA-N 1 1 364.446 2.537 20 5 FFBDMO CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598040546 520389617 /nfs/dbraw/zinc/38/96/17/520389617.db2.gz HTNPBLQEPSNTMB-OCCSQVGLSA-N 1 1 369.849 2.958 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000592478720 520407041 /nfs/dbraw/zinc/40/70/41/520407041.db2.gz ITGSKIVCVWQHOH-YJBOKZPZSA-N 1 1 360.458 2.696 20 5 FFBDMO Cc1cccc(C[N@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000604016184 520427369 /nfs/dbraw/zinc/42/73/69/520427369.db2.gz IQKSZAFQLPPRRK-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO Cc1cccc(C[N@@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1 ZINC000604016184 520427377 /nfs/dbraw/zinc/42/73/77/520427377.db2.gz IQKSZAFQLPPRRK-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])ccc1OCCO ZINC000595414984 520456662 /nfs/dbraw/zinc/45/66/62/520456662.db2.gz PGHKCKDUACDMAY-LBPRGKRZSA-N 1 1 364.373 2.964 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000598195759 520487098 /nfs/dbraw/zinc/48/70/98/520487098.db2.gz RLBZEKNEKOCHIA-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595535655 520532410 /nfs/dbraw/zinc/53/24/10/520532410.db2.gz IUWOMFAXBVIOCY-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H]1CC[N@@H+](C)C1 ZINC000617559004 520582825 /nfs/dbraw/zinc/58/28/25/520582825.db2.gz QAKMFWKFWNPCLE-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO C[C@@H](CCN1CC[NH+](C)CC1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000613704716 520628044 /nfs/dbraw/zinc/62/80/44/520628044.db2.gz MONWOAUGUNFUPG-LBPRGKRZSA-N 1 1 371.279 2.795 20 5 FFBDMO Cc1c(CC(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000592879819 520629914 /nfs/dbraw/zinc/62/99/14/520629914.db2.gz DWINMOPUXFVURU-MOPGFXCFSA-N 1 1 367.449 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC000592881898 520630746 /nfs/dbraw/zinc/63/07/46/520630746.db2.gz OQGYKBWHHAUWQG-QAPCUYQASA-N 1 1 369.421 2.679 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)N(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105606 520637611 /nfs/dbraw/zinc/63/76/11/520637611.db2.gz DVCUZLAUNBHDDK-KGLIPLIRSA-N 1 1 372.425 2.511 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601147182 520660002 /nfs/dbraw/zinc/66/00/02/520660002.db2.gz XKQHSZKYDQJYQN-KGLIPLIRSA-N 1 1 359.382 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@]4(CCS(=O)(=O)C4)C3)c2c1 ZINC000601171153 520671093 /nfs/dbraw/zinc/67/10/93/520671093.db2.gz GRKHMLQZNYWTRF-KRWDZBQOSA-N 1 1 361.423 2.548 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@H](CCF)C1 ZINC000595757125 520702720 /nfs/dbraw/zinc/70/27/20/520702720.db2.gz ZPDMVDYFBLCEJE-CYBMUJFWSA-N 1 1 351.378 2.964 20 5 FFBDMO CC[C@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000593056275 520713629 /nfs/dbraw/zinc/71/36/29/520713629.db2.gz DQHFURNIMLMQNV-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C[C@H]1C ZINC000598605301 520737971 /nfs/dbraw/zinc/73/79/71/520737971.db2.gz BDQYJAZNMZSWNV-HIFRSBDPSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000593188304 520810600 /nfs/dbraw/zinc/81/06/00/520810600.db2.gz BXNMYMAESILWCW-HBNTYKKESA-N 1 1 370.247 2.910 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC3CC2(c2ccccc2)C3)c1 ZINC000595909784 520814773 /nfs/dbraw/zinc/81/47/73/520814773.db2.gz DITIRONEOAJOCU-RVSXGSNBSA-N 1 1 354.406 2.956 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[NH+](CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000596053077 520880423 /nfs/dbraw/zinc/88/04/23/520880423.db2.gz LMHYRHVOGYFTCD-UHFFFAOYSA-N 1 1 355.822 2.813 20 5 FFBDMO CC(C)(CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[N@H+]1CCc2ccccc2C1 ZINC000596074222 520895176 /nfs/dbraw/zinc/89/51/76/520895176.db2.gz BKDWKYHKBLIOPC-UHFFFAOYSA-N 1 1 368.437 2.943 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593323635 520909977 /nfs/dbraw/zinc/90/99/77/520909977.db2.gz ROUARRHWULPWRM-GOSISDBHSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593323635 520909987 /nfs/dbraw/zinc/90/99/87/520909987.db2.gz ROUARRHWULPWRM-GOSISDBHSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000593324097 520910501 /nfs/dbraw/zinc/91/05/01/520910501.db2.gz WCJFLOPVQSBKOH-LJQANCHMSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000593324097 520910510 /nfs/dbraw/zinc/91/05/10/520910510.db2.gz WCJFLOPVQSBKOH-LJQANCHMSA-N 1 1 353.422 2.902 20 5 FFBDMO Nc1ccc(N2CCC[N@@H+](CCCc3ccccc3)CC2)nc1[N+](=O)[O-] ZINC000596110509 520918038 /nfs/dbraw/zinc/91/80/38/520918038.db2.gz RJFLYZYHVVUBSX-UHFFFAOYSA-N 1 1 355.442 2.717 20 5 FFBDMO C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596144619 520936541 /nfs/dbraw/zinc/93/65/41/520936541.db2.gz MEJPZYZSYBAUTH-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596218884 520976933 /nfs/dbraw/zinc/97/69/33/520976933.db2.gz NGNUZEYLAQDVMC-CXAGYDPISA-N 1 1 354.410 2.626 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000611087789 520978873 /nfs/dbraw/zinc/97/88/73/520978873.db2.gz KJNFATZNNOXLOM-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000611087789 520978883 /nfs/dbraw/zinc/97/88/83/520978883.db2.gz KJNFATZNNOXLOM-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045004 520998024 /nfs/dbraw/zinc/99/80/24/520998024.db2.gz XHJWJJDOWPWYQD-OAHLLOKOSA-N 1 1 355.442 2.723 20 5 FFBDMO C[NH+]1CCC(N2CC[C@@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045004 520998032 /nfs/dbraw/zinc/99/80/32/520998032.db2.gz XHJWJJDOWPWYQD-OAHLLOKOSA-N 1 1 355.442 2.723 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc2oc(=O)n(C)c2c1 ZINC000599081389 521020914 /nfs/dbraw/zinc/02/09/14/521020914.db2.gz JTAPUBLISADLIE-NSHDSACASA-N 1 1 357.366 2.899 20 5 FFBDMO Cc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000599143696 521052606 /nfs/dbraw/zinc/05/26/06/521052606.db2.gz VJHFFUMLRPLNBC-KRWDZBQOSA-N 1 1 357.458 2.984 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NCc1ccc(C[N@@H+]3CC[C@H](O)C3)cc1)CCN2 ZINC000596424585 521065709 /nfs/dbraw/zinc/06/57/09/521065709.db2.gz SRCSDYZLNVEOHK-INIZCTEOSA-N 1 1 368.437 2.742 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611274244 521073918 /nfs/dbraw/zinc/07/39/18/521073918.db2.gz FUDKAENLLDUEMC-UHFFFAOYSA-N 1 1 352.387 2.530 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611274244 521073925 /nfs/dbraw/zinc/07/39/25/521073925.db2.gz FUDKAENLLDUEMC-UHFFFAOYSA-N 1 1 352.387 2.530 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000599183135 521075299 /nfs/dbraw/zinc/07/52/99/521075299.db2.gz HZMFZQHNIWCWPH-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350522 521115978 /nfs/dbraw/zinc/11/59/78/521115978.db2.gz PTCXACIVOZZPHX-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350522 521115988 /nfs/dbraw/zinc/11/59/88/521115988.db2.gz PTCXACIVOZZPHX-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000611400586 521137883 /nfs/dbraw/zinc/13/78/83/521137883.db2.gz SBCPKEVXXQRDEQ-SWLSCSKDSA-N 1 1 367.471 2.544 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000611400586 521137894 /nfs/dbraw/zinc/13/78/94/521137894.db2.gz SBCPKEVXXQRDEQ-SWLSCSKDSA-N 1 1 367.471 2.544 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000611442702 521159831 /nfs/dbraw/zinc/15/98/31/521159831.db2.gz IQDWBKJLLICPDD-UHFFFAOYSA-N 1 1 359.430 2.595 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)CC(=O)Nc1c(C)cc(C)cc1C ZINC000611442702 521159841 /nfs/dbraw/zinc/15/98/41/521159841.db2.gz IQDWBKJLLICPDD-UHFFFAOYSA-N 1 1 359.430 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](N[C@H]2CCC[N@@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712889 521170005 /nfs/dbraw/zinc/17/00/05/521170005.db2.gz QQIIJHZOXVHRKO-DZGCQCFKSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](N[C@H]2CCC[N@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712889 521170012 /nfs/dbraw/zinc/17/00/12/521170012.db2.gz QQIIJHZOXVHRKO-DZGCQCFKSA-N 1 1 361.364 2.635 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000611572153 521226291 /nfs/dbraw/zinc/22/62/91/521226291.db2.gz IJFSHUPMBDKGKP-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000602291268 521262692 /nfs/dbraw/zinc/26/26/92/521262692.db2.gz KMMMPWIRIWFLBW-MAUKXSAKSA-N 1 1 357.454 2.959 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000612030453 521446546 /nfs/dbraw/zinc/44/65/46/521446546.db2.gz KFUHOQDBKQJVJU-PXNSSMCTSA-N 1 1 372.421 2.798 20 5 FFBDMO O=C1CCCN1[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602635002 521449748 /nfs/dbraw/zinc/44/97/48/521449748.db2.gz RHKWJDFKNIQVMS-ZDUSSCGKSA-N 1 1 357.332 2.810 20 5 FFBDMO O=C1CCCN1[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602635002 521449753 /nfs/dbraw/zinc/44/97/53/521449753.db2.gz RHKWJDFKNIQVMS-ZDUSSCGKSA-N 1 1 357.332 2.810 20 5 FFBDMO CCn1cccc(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)c1=O ZINC000602640876 521451956 /nfs/dbraw/zinc/45/19/56/521451956.db2.gz SGMIJZLFKBRVPU-UHFFFAOYSA-N 1 1 372.244 2.890 20 5 FFBDMO COC[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@H]1CCCO1 ZINC000602642611 521453687 /nfs/dbraw/zinc/45/36/87/521453687.db2.gz DAHSZTWIEOFSLH-WDEREUQCSA-N 1 1 365.249 2.702 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000594200287 521466993 /nfs/dbraw/zinc/46/69/93/521466993.db2.gz KMSQHOWGEBEMOB-HZPDHXFCSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594204718 521470023 /nfs/dbraw/zinc/47/00/23/521470023.db2.gz XOKHXFBGRJYQLV-WMZOPIPTSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1(=O)=O ZINC000602711051 521489693 /nfs/dbraw/zinc/48/96/93/521489693.db2.gz WPSHGVKBAIOTDH-JOYOIKCWSA-N 1 1 366.361 2.669 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597090826 521495970 /nfs/dbraw/zinc/49/59/70/521495970.db2.gz SHFQKAOWJCLXAI-UHFFFAOYSA-N 1 1 357.842 2.930 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C[C@@H]1C ZINC000597100978 521505782 /nfs/dbraw/zinc/50/57/82/521505782.db2.gz NPBKMRPNJSWBLI-VHSXEESVSA-N 1 1 355.826 2.777 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)CC[C@H]21 ZINC000597102553 521507582 /nfs/dbraw/zinc/50/75/82/521507582.db2.gz XUCAYUCKMYLIEO-ZWNOBZJWSA-N 1 1 367.837 2.778 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000602786785 521531343 /nfs/dbraw/zinc/53/13/43/521531343.db2.gz YAWOOOLJMFGSFG-RKDXNWHRSA-N 1 1 360.258 2.772 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594284291 521536035 /nfs/dbraw/zinc/53/60/35/521536035.db2.gz UXLCAVWDTNONJK-ROUUACIJSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000602809364 521545582 /nfs/dbraw/zinc/54/55/82/521545582.db2.gz BXADCXHULZBGMD-MAUKXSAKSA-N 1 1 357.458 2.600 20 5 FFBDMO COc1cc(C[NH+]2CC([C@H]3CCOC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000619432178 521563503 /nfs/dbraw/zinc/56/35/03/521563503.db2.gz CMCOIPVZJUFWAY-NSHDSACASA-N 1 1 372.368 2.716 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)o1 ZINC000597235628 521588107 /nfs/dbraw/zinc/58/81/07/521588107.db2.gz IWAZPIXJTQKITK-MRXNPFEDSA-N 1 1 371.437 2.886 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000736264523 598367915 /nfs/dbraw/zinc/36/79/15/598367915.db2.gz FKZFJILZJJUTLS-LBPRGKRZSA-N 1 1 359.434 2.697 20 5 FFBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cccc(-c2nn[nH]n2)c1 ZINC000825914626 608521484 /nfs/dbraw/zinc/52/14/84/608521484.db2.gz MBDXBFFYUKUNIV-WEVVVXLNSA-N 1 1 350.382 2.920 20 5 FFBDMO C[C@@H]1CN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])[C@@H](C)C[N@@H+]1C ZINC001164637570 719238597 /nfs/dbraw/zinc/23/85/97/719238597.db2.gz WKEHKSUGUMAWMA-RQJHMYQMSA-N 1 1 353.732 2.586 20 5 FFBDMO C[C@@H]1CN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC001164637570 719238599 /nfs/dbraw/zinc/23/85/99/719238599.db2.gz WKEHKSUGUMAWMA-RQJHMYQMSA-N 1 1 353.732 2.586 20 5 FFBDMO CC(C)n1nc(C[NH+](C)C)c2c1CN(c1ncc([N+](=O)[O-])cc1F)CC2 ZINC001164649577 719309876 /nfs/dbraw/zinc/30/98/76/719309876.db2.gz PDQAQLSWXBUKAS-UHFFFAOYSA-N 1 1 362.409 2.531 20 5 FFBDMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C)cc(C)c1[N+](=O)[O-])C2 ZINC001164807457 720126939 /nfs/dbraw/zinc/12/69/39/720126939.db2.gz CLLNUJRNILCXSS-XLIONFOSSA-N 1 1 374.485 2.791 20 5 FFBDMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc([N+](=O)[O-])ccn3)CC[C@@H]21 ZINC001164837832 720509005 /nfs/dbraw/zinc/50/90/05/720509005.db2.gz PNZQHSILARIZJG-NJAFHUGGSA-N 1 1 370.457 2.564 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)nn1 ZINC001164770369 721300880 /nfs/dbraw/zinc/30/08/80/721300880.db2.gz RUVCSLFWGDOHKG-UHFFFAOYSA-N 1 1 365.437 2.974 20 5 FFBDMO C[N@H+](CCO)[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000126624780 728704352 /nfs/dbraw/zinc/70/43/52/728704352.db2.gz PCWJPVVVSAIFLR-INIZCTEOSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@@H+](CCO)[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000126624780 728704353 /nfs/dbraw/zinc/70/43/53/728704353.db2.gz PCWJPVVVSAIFLR-INIZCTEOSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCc1nccs1 ZINC000129395493 728711430 /nfs/dbraw/zinc/71/14/30/728711430.db2.gz KJOAHMUEIPIEPX-UHFFFAOYSA-N 1 1 352.391 2.694 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c(C(F)(F)F)c1 ZINC000170774974 728989212 /nfs/dbraw/zinc/98/92/12/728989212.db2.gz CZVXYZFGGLUYGS-ZDUSSCGKSA-N 1 1 359.348 2.915 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@@H]1CC[N@@H+](CC)C1 ZINC000857310872 730390847 /nfs/dbraw/zinc/39/08/47/730390847.db2.gz JKBXBYFCOJNYHG-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO COCCC1CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000859399475 730453276 /nfs/dbraw/zinc/45/32/76/730453276.db2.gz VNCWZEFOEPKNJX-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000925138529 738481241 /nfs/dbraw/zinc/48/12/41/738481241.db2.gz HINXVWRCUKEHSD-HIFRSBDPSA-N 1 1 350.444 2.605 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)CC2)C1 ZINC000865541470 730968246 /nfs/dbraw/zinc/96/82/46/730968246.db2.gz HCGOLVZAWHQRHW-CQSZACIVSA-N 1 1 354.401 2.749 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000868480603 731296678 /nfs/dbraw/zinc/29/66/78/731296678.db2.gz BKYOBZYYSPJTDA-DZGCQCFKSA-N 1 1 366.849 2.526 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000872720488 731819455 /nfs/dbraw/zinc/81/94/55/731819455.db2.gz QRPHTXXZHGRFHV-ZOBUZTSGSA-N 1 1 361.467 2.553 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000877021420 732313682 /nfs/dbraw/zinc/31/36/82/732313682.db2.gz BFZAZCJXPZDUKH-KGLIPLIRSA-N 1 1 359.348 2.566 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000878944463 732619349 /nfs/dbraw/zinc/61/93/49/732619349.db2.gz XBLZAICEDYNOKD-CABCVRRESA-N 1 1 361.364 2.587 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000781715099 738652300 /nfs/dbraw/zinc/65/23/00/738652300.db2.gz YVALFCLKCWIABE-UHFFFAOYSA-N 1 1 355.297 2.948 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320759 732888576 /nfs/dbraw/zinc/88/85/76/732888576.db2.gz XXJYISFUSCZOSO-SWLSCSKDSA-N 1 1 358.423 2.646 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320759 732888581 /nfs/dbraw/zinc/88/85/81/732888581.db2.gz XXJYISFUSCZOSO-SWLSCSKDSA-N 1 1 358.423 2.646 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000880437535 732908040 /nfs/dbraw/zinc/90/80/40/732908040.db2.gz MMQLHCIJCCPMNS-JSGCOSHPSA-N 1 1 359.220 2.593 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000885886581 733726074 /nfs/dbraw/zinc/72/60/74/733726074.db2.gz ZLZAOTJEEKIRPA-CYBMUJFWSA-N 1 1 367.833 2.540 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885974951 733736342 /nfs/dbraw/zinc/73/63/42/733736342.db2.gz GKJZOSGPUUJXLI-CYBMUJFWSA-N 1 1 350.419 2.727 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885974951 733736345 /nfs/dbraw/zinc/73/63/45/733736345.db2.gz GKJZOSGPUUJXLI-CYBMUJFWSA-N 1 1 350.419 2.727 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000886592675 733807592 /nfs/dbraw/zinc/80/75/92/733807592.db2.gz ZVZIKYZCCBSHGD-CYBMUJFWSA-N 1 1 364.789 2.856 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082298 738817616 /nfs/dbraw/zinc/81/76/16/738817616.db2.gz QOVRSANIHALXBJ-AAEUAGOBSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082298 738817621 /nfs/dbraw/zinc/81/76/21/738817621.db2.gz QOVRSANIHALXBJ-AAEUAGOBSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091427 738820104 /nfs/dbraw/zinc/82/01/04/738820104.db2.gz FAQDQJMOYAUUFX-KBPBESRZSA-N 1 1 361.423 2.651 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091427 738820108 /nfs/dbraw/zinc/82/01/08/738820108.db2.gz FAQDQJMOYAUUFX-KBPBESRZSA-N 1 1 361.423 2.651 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3c(Cl)n[nH]c3C3CC3)C2)nc1 ZINC000892078656 734512680 /nfs/dbraw/zinc/51/26/80/734512680.db2.gz PXMSGAAKLXGMNF-LLVKDONJSA-N 1 1 362.821 2.930 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3c(Cl)n[nH]c3C3CC3)C2)nc1 ZINC000892078656 734512684 /nfs/dbraw/zinc/51/26/84/734512684.db2.gz PXMSGAAKLXGMNF-LLVKDONJSA-N 1 1 362.821 2.930 20 5 FFBDMO CN1CCC([NH+]2CCC(NCc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000892762602 734600445 /nfs/dbraw/zinc/60/04/45/734600445.db2.gz GHZNUOBURNHQAE-UHFFFAOYSA-N 1 1 366.893 2.896 20 5 FFBDMO CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000732034219 734712996 /nfs/dbraw/zinc/71/29/96/734712996.db2.gz DHVMNLBEBGIRAY-LBPRGKRZSA-N 1 1 368.231 2.666 20 5 FFBDMO CN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000894047150 734792831 /nfs/dbraw/zinc/79/28/31/734792831.db2.gz HOZDJJAQPZSHNS-CQSZACIVSA-N 1 1 354.838 2.526 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CN1CC1CC1 ZINC000895716070 735046379 /nfs/dbraw/zinc/04/63/79/735046379.db2.gz DKXSXXFVVYYSTE-VIFPVBQESA-N 1 1 374.260 2.519 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2c1cnn2CCO ZINC000740004181 735065061 /nfs/dbraw/zinc/06/50/61/735065061.db2.gz HQHDMTVESDBHHH-CQSZACIVSA-N 1 1 350.806 2.604 20 5 FFBDMO C[NH+]1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2Cl)CC1 ZINC000749225847 735705193 /nfs/dbraw/zinc/70/51/93/735705193.db2.gz PWYGEXGPUJETKL-UHFFFAOYSA-N 1 1 363.805 2.580 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000901105968 735744937 /nfs/dbraw/zinc/74/49/37/735744937.db2.gz WZITTXZVFBIVMU-ZWNOBZJWSA-N 1 1 355.797 2.944 20 5 FFBDMO CO[C@@]1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCSC1 ZINC000903315100 736074441 /nfs/dbraw/zinc/07/44/41/736074441.db2.gz SHMIEESRPDZKRN-NVXWUHKLSA-N 1 1 362.455 2.529 20 5 FFBDMO CC[N@H+]1CCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000754389000 736154908 /nfs/dbraw/zinc/15/49/08/736154908.db2.gz XOPULNIVZMGOGF-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000755025992 736227889 /nfs/dbraw/zinc/22/78/89/736227889.db2.gz PZBUTWBLJZKKAX-ONGXEEELSA-N 1 1 371.235 2.962 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756790248 736361446 /nfs/dbraw/zinc/36/14/46/736361446.db2.gz PXYXJALCEZQAFC-ZDUSSCGKSA-N 1 1 356.879 2.697 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000761051166 736690624 /nfs/dbraw/zinc/69/06/24/736690624.db2.gz UWJSSXRCHOGGDO-SNVBAGLBSA-N 1 1 361.320 2.816 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)ccc1Cl ZINC000768555905 737432584 /nfs/dbraw/zinc/43/25/84/737432584.db2.gz UAFIVAPHJNFRNO-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000769482448 737533957 /nfs/dbraw/zinc/53/39/57/737533957.db2.gz CVLFTFGFYDBWMI-UHFFFAOYSA-N 1 1 366.219 2.855 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C[C@H]1C ZINC000771762311 737753400 /nfs/dbraw/zinc/75/34/00/737753400.db2.gz OCSOSCYBOWEZPE-OLZOCXBDSA-N 1 1 373.450 2.536 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CC[C@@H]([C@@H]4CCOC4)C3)c2c(Cl)c1 ZINC000774637581 738008326 /nfs/dbraw/zinc/00/83/26/738008326.db2.gz BZFOMPMQEGUACJ-VXGBXAGGSA-N 1 1 350.806 2.914 20 5 FFBDMO CC[N@@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@@H]1C(C)C ZINC000922394538 738136968 /nfs/dbraw/zinc/13/69/68/738136968.db2.gz XBJASLBKKKGERX-JHNDHUHGSA-N 1 1 353.488 2.616 20 5 FFBDMO CC[N@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@@H]1C(C)C ZINC000922394538 738136972 /nfs/dbraw/zinc/13/69/72/738136972.db2.gz XBJASLBKKKGERX-JHNDHUHGSA-N 1 1 353.488 2.616 20 5 FFBDMO Cc1cccc(NCCNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000778288946 738370148 /nfs/dbraw/zinc/37/01/48/738370148.db2.gz LICPJBMQAWIDTB-UHFFFAOYSA-N 1 1 350.325 2.618 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@@H]1C ZINC000787238113 739117337 /nfs/dbraw/zinc/11/73/37/739117337.db2.gz ITSRSBZRTNAZQA-KOLCDFICSA-N 1 1 351.384 2.713 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@@H]1C ZINC000787238113 739117338 /nfs/dbraw/zinc/11/73/38/739117338.db2.gz ITSRSBZRTNAZQA-KOLCDFICSA-N 1 1 351.384 2.713 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000931118486 739214855 /nfs/dbraw/zinc/21/48/55/739214855.db2.gz UJTCMQQDTUJFLB-CQSZACIVSA-N 1 1 351.422 2.903 20 5 FFBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932166967 739397517 /nfs/dbraw/zinc/39/75/17/739397517.db2.gz GKKRTJNQOVZRDE-HUUCEWRRSA-N 1 1 352.431 2.614 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000791335178 739549172 /nfs/dbraw/zinc/54/91/72/739549172.db2.gz CTJRHDPTBADDBP-NSHDSACASA-N 1 1 352.410 2.556 20 5 FFBDMO Cn1cc([C@@H]2CSCCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cn1 ZINC000933983574 739715790 /nfs/dbraw/zinc/71/57/90/739715790.db2.gz WKIAVOZSVDCZRD-INIZCTEOSA-N 1 1 362.455 2.887 20 5 FFBDMO CN(C)[S@@](C)(=O)=NCC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000934761508 739834285 /nfs/dbraw/zinc/83/42/85/739834285.db2.gz ZBQXUHJLDVFUAX-VWLOTQADSA-N 1 1 372.466 2.520 20 5 FFBDMO CC[N@H+](CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O)C1CC1 ZINC000795409120 740017528 /nfs/dbraw/zinc/01/75/28/740017528.db2.gz PMHMOSMFZFDYIZ-UHFFFAOYSA-N 1 1 354.204 2.755 20 5 FFBDMO CC[N@@H+](CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O)C1CC1 ZINC000795409120 740017532 /nfs/dbraw/zinc/01/75/32/740017532.db2.gz PMHMOSMFZFDYIZ-UHFFFAOYSA-N 1 1 354.204 2.755 20 5 FFBDMO C[C@@H](CO)[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCC1 ZINC000796549329 740152712 /nfs/dbraw/zinc/15/27/12/740152712.db2.gz WQOLZXAMOWNMSA-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCC[C@@H]2COC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000796554598 740153528 /nfs/dbraw/zinc/15/35/28/740153528.db2.gz QEOOTQJCDFDIBB-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2COC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000796554598 740153531 /nfs/dbraw/zinc/15/35/31/740153531.db2.gz QEOOTQJCDFDIBB-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000805823183 741014022 /nfs/dbraw/zinc/01/40/22/741014022.db2.gz ARPSZTIQEKIBFO-CYBMUJFWSA-N 1 1 368.455 2.830 20 5 FFBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985429587 741395305 /nfs/dbraw/zinc/39/53/05/741395305.db2.gz AMGXZRZPLSGETI-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1cc(Cl)ccc1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985429587 741395311 /nfs/dbraw/zinc/39/53/11/741395311.db2.gz AMGXZRZPLSGETI-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1cc(Cl)ccc1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985429587 741395316 /nfs/dbraw/zinc/39/53/16/741395316.db2.gz AMGXZRZPLSGETI-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000811478312 741527826 /nfs/dbraw/zinc/52/78/26/741527826.db2.gz FYXKGPCHZQTVMT-STQMWFEESA-N 1 1 360.241 2.854 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000811848912 741567087 /nfs/dbraw/zinc/56/70/87/741567087.db2.gz ZQGKWLGBJGCHML-LLVKDONJSA-N 1 1 354.407 2.836 20 5 FFBDMO COC[C@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174062 741685144 /nfs/dbraw/zinc/68/51/44/741685144.db2.gz OYBCONBTXWTWKG-VBQJREDUSA-N 1 1 350.415 2.631 20 5 FFBDMO COC[C@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174062 741685146 /nfs/dbraw/zinc/68/51/46/741685146.db2.gz OYBCONBTXWTWKG-VBQJREDUSA-N 1 1 350.415 2.631 20 5 FFBDMO COC1CC[NH+](C(C)(C)CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815578562 741946306 /nfs/dbraw/zinc/94/63/06/741946306.db2.gz QRIKMYABNYGNNK-CYBMUJFWSA-N 1 1 350.463 2.717 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](CCO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000817299073 742120789 /nfs/dbraw/zinc/12/07/89/742120789.db2.gz UFVMNMODIXLBLX-LBPRGKRZSA-N 1 1 355.822 2.671 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](CCO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000817299073 742120794 /nfs/dbraw/zinc/12/07/94/742120794.db2.gz UFVMNMODIXLBLX-LBPRGKRZSA-N 1 1 355.822 2.671 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3C[N@H+]4CCC[C@H]4CO3)n2)cc1 ZINC000827497333 743589856 /nfs/dbraw/zinc/58/98/56/743589856.db2.gz UMPHOOYDKAPDKA-GJZGRUSLSA-N 1 1 360.439 2.993 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1F ZINC000834476310 745846233 /nfs/dbraw/zinc/84/62/33/745846233.db2.gz VASFYIIARIGPBT-GFCCVEGCSA-N 1 1 353.369 2.928 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839615201 746871999 /nfs/dbraw/zinc/87/19/99/746871999.db2.gz JHQCFAZHZKFJBD-ZDUSSCGKSA-N 1 1 354.838 2.601 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437599 748029745 /nfs/dbraw/zinc/02/97/45/748029745.db2.gz ODFUAHQHNGXEPL-GDBMZVCRSA-N 1 1 351.353 2.821 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437599 748029752 /nfs/dbraw/zinc/02/97/52/748029752.db2.gz ODFUAHQHNGXEPL-GDBMZVCRSA-N 1 1 351.353 2.821 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3cc(Cl)c(F)cc3[N+](=O)[O-])CC2)C1 ZINC000845496239 748269768 /nfs/dbraw/zinc/26/97/68/748269768.db2.gz RMLGVCNMNWLBRK-GFCCVEGCSA-N 1 1 356.829 2.604 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3cc(Cl)c(F)cc3[N+](=O)[O-])CC2)C1 ZINC000845496241 748269841 /nfs/dbraw/zinc/26/98/41/748269841.db2.gz RMLGVCNMNWLBRK-LBPRGKRZSA-N 1 1 356.829 2.604 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848510492 748946357 /nfs/dbraw/zinc/94/63/57/748946357.db2.gz TXEPIJRAFUUAEN-CHWSQXEVSA-N 1 1 373.862 2.543 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000896220228 971344896 /nfs/dbraw/zinc/34/48/96/971344896.db2.gz NBKHGMFXBIHBSW-UZLBHIALSA-N 1 1 370.405 2.709 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@H](N3CC(=O)Nc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000759898888 971921673 /nfs/dbraw/zinc/92/16/73/971921673.db2.gz HWOYBNDAMTZLRF-INIZCTEOSA-N 1 1 366.421 2.936 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121247221 958828030 /nfs/dbraw/zinc/82/80/30/958828030.db2.gz RJDHOXBIFVJXAQ-QGZVFWFLSA-N 1 1 374.441 2.870 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000134883618 960093061 /nfs/dbraw/zinc/09/30/61/960093061.db2.gz LOJGNWBUKQNTKH-CRAIPNDOSA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001174716778 1013286611 /nfs/dbraw/zinc/28/66/11/1013286611.db2.gz TVDKTCKFFUTPPQ-MGPLVRAMSA-N 1 1 366.805 2.749 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001174716778 1013286617 /nfs/dbraw/zinc/28/66/17/1013286617.db2.gz TVDKTCKFFUTPPQ-MGPLVRAMSA-N 1 1 366.805 2.749 20 5 FFBDMO O=[N+]([O-])CCN1CC[NH+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC001175219462 1013416504 /nfs/dbraw/zinc/41/65/04/1013416504.db2.gz ILSFJHKNNZIQMX-UHFFFAOYSA-N 1 1 355.438 2.660 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000825668840 1013433847 /nfs/dbraw/zinc/43/38/47/1013433847.db2.gz YWUYJUOIMMZNEB-UHFFFAOYSA-N 1 1 358.398 2.808 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)Cc1cc[nH]n1 ZINC001175747534 1013548082 /nfs/dbraw/zinc/54/80/82/1013548082.db2.gz ZCXFBEACDAFFLZ-UHFFFAOYSA-N 1 1 361.405 2.861 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[NH+](Cc2ccccc2)CC1 ZINC000121684427 965709463 /nfs/dbraw/zinc/70/94/63/965709463.db2.gz ZGZDJJQUVCNWSQ-UHFFFAOYSA-N 1 1 357.385 2.621 20 5 FFBDMO COc1ccc(Nc2[nH+]c3ccccc3n2CCNC(C)=O)cc1[N+](=O)[O-] ZINC001176363319 1013695490 /nfs/dbraw/zinc/69/54/90/1013695490.db2.gz LTTXFAVECVBVBW-UHFFFAOYSA-N 1 1 369.381 2.833 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C2CCCC2)cc1 ZINC001267241503 967383982 /nfs/dbraw/zinc/38/39/82/967383982.db2.gz ZLNCRIQYCGZYMJ-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCCC2)cc1 ZINC001267241503 967383991 /nfs/dbraw/zinc/38/39/91/967383991.db2.gz ZLNCRIQYCGZYMJ-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCCC2)cc1 ZINC001267241503 967384005 /nfs/dbraw/zinc/38/40/05/967384005.db2.gz ZLNCRIQYCGZYMJ-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c(N)c([N+](=O)[O-])c1 ZINC000729523263 967620945 /nfs/dbraw/zinc/62/09/45/967620945.db2.gz LEJBPDGEZSHGPL-QLFBSQMISA-N 1 1 360.458 2.963 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@@H+](C)CCN1C ZINC000895246129 968758373 /nfs/dbraw/zinc/75/83/73/968758373.db2.gz LRGZWYRJFHRBQU-DYVFJYSZSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895246129 968758377 /nfs/dbraw/zinc/75/83/77/968758377.db2.gz LRGZWYRJFHRBQU-DYVFJYSZSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1CN(C)CC[N@H+]1C ZINC000895246129 968758387 /nfs/dbraw/zinc/75/83/87/968758387.db2.gz LRGZWYRJFHRBQU-DYVFJYSZSA-N 1 1 373.432 2.842 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000072514353 969829222 /nfs/dbraw/zinc/82/92/22/969829222.db2.gz VIXGKBSGJKTBLE-UHFFFAOYSA-N 1 1 362.386 2.669 20 5 FFBDMO C[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000897062348 973213440 /nfs/dbraw/zinc/21/34/40/973213440.db2.gz SVASZGLMLKLIBZ-BFYDXBDKSA-N 1 1 360.458 2.824 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])c1C ZINC000893543462 975137270 /nfs/dbraw/zinc/13/72/70/975137270.db2.gz UZWJVWTUHJWUAY-UHFFFAOYSA-N 1 1 361.398 2.961 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1C ZINC000898977260 976819682 /nfs/dbraw/zinc/81/96/82/976819682.db2.gz GJXIJQWBFVWIBO-IAGOWNOFSA-N 1 1 373.453 2.585 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000126060242 977155072 /nfs/dbraw/zinc/15/50/72/977155072.db2.gz FLAAKCHYGSAAQC-KRWDZBQOSA-N 1 1 362.474 2.805 20 5 FFBDMO Cc1nn(CN2CC[C@@H](C)[N@H+](Cc3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000173531958 985858663 /nfs/dbraw/zinc/85/86/63/985858663.db2.gz MZOSAEQGHOFBBZ-OAHLLOKOSA-N 1 1 357.458 2.962 20 5 FFBDMO COC(=O)[C@@H](C)Oc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000921688032 986655961 /nfs/dbraw/zinc/65/59/61/986655961.db2.gz QMSZPZJOTJZRQB-CYBMUJFWSA-N 1 1 374.393 2.834 20 5 FFBDMO CCOC(=O)Cc1ccc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC000826075963 1015238030 /nfs/dbraw/zinc/23/80/30/1015238030.db2.gz IOLYOEGCDAFOJS-XYPWUTKMSA-N 1 1 361.442 2.762 20 5 FFBDMO O=C(c1c(F)cccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913689105 986842596 /nfs/dbraw/zinc/84/25/96/986842596.db2.gz ZMSIYTYBFZSROJ-GJZGRUSLSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1c(F)cccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913689105 986842611 /nfs/dbraw/zinc/84/26/11/986842611.db2.gz ZMSIYTYBFZSROJ-GJZGRUSLSA-N 1 1 355.369 2.833 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715716984 987220928 /nfs/dbraw/zinc/22/09/28/987220928.db2.gz YIGVHWHQYAYSLA-AWEZNQCLSA-N 1 1 374.828 2.835 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715716984 987220933 /nfs/dbraw/zinc/22/09/33/987220933.db2.gz YIGVHWHQYAYSLA-AWEZNQCLSA-N 1 1 374.828 2.835 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccc(O)cc1 ZINC000451098901 987356207 /nfs/dbraw/zinc/35/62/07/987356207.db2.gz UZDWLHXARJHMKH-RBUKOAKNSA-N 1 1 370.405 2.732 20 5 FFBDMO C[C@H]([N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C(C)(C)C ZINC000914568722 987792216 /nfs/dbraw/zinc/79/22/16/987792216.db2.gz OBAVCWCDIMWTDB-SGTLLEGYSA-N 1 1 362.430 2.686 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCOCC2)c2ccccc2)c2nonc21 ZINC000914863193 988000667 /nfs/dbraw/zinc/00/06/67/988000667.db2.gz NFXKDYRMMPVGFK-OAHLLOKOSA-N 1 1 369.381 2.616 20 5 FFBDMO COc1cc(Cc2noc(CCCn3cc[nH+]c3C)n2)ccc1[N+](=O)[O-] ZINC000762308810 988295377 /nfs/dbraw/zinc/29/53/77/988295377.db2.gz OCESRYFAJKJIHK-UHFFFAOYSA-N 1 1 357.370 2.715 20 5 FFBDMO CCc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)cc1 ZINC000946589185 988763374 /nfs/dbraw/zinc/76/33/74/988763374.db2.gz LHEFPOAJHPLIAN-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccc(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)cc1 ZINC000946589185 988763380 /nfs/dbraw/zinc/76/33/80/988763380.db2.gz LHEFPOAJHPLIAN-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)cc1 ZINC000946589185 988763387 /nfs/dbraw/zinc/76/33/87/988763387.db2.gz LHEFPOAJHPLIAN-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cn1 ZINC000918660669 990463334 /nfs/dbraw/zinc/46/33/34/990463334.db2.gz KVMHBZAJTIIFRS-UITAMQMPSA-N 1 1 363.377 2.814 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+]4CCC[C@@H]4C3)cc2[N+](=O)[O-])CC1 ZINC000195316885 990841829 /nfs/dbraw/zinc/84/18/29/990841829.db2.gz HHJPUWICFAGXNF-QGZVFWFLSA-N 1 1 372.469 2.751 20 5 FFBDMO O=C(NCC1C[NH+](Cc2ccc(-c3ccsc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031662893 990864138 /nfs/dbraw/zinc/86/41/38/990864138.db2.gz OJGXJYYIMMMZEU-QZTJIDSGSA-N 1 1 371.462 2.628 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC001116090757 1032121590 /nfs/dbraw/zinc/12/15/90/1032121590.db2.gz BJZVXDDJRPXCIO-INIZCTEOSA-N 1 1 370.409 2.780 20 5 FFBDMO CCC1([NH2+]Cc2cccc(Cl)c2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001484811998 991760115 /nfs/dbraw/zinc/76/01/15/991760115.db2.gz HONFNVRUTWAMCE-HZPDHXFCSA-N 1 1 365.861 2.866 20 5 FFBDMO COc1cccc2c1CC[C@@]2(CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000880380707 1015821851 /nfs/dbraw/zinc/82/18/51/1015821851.db2.gz WLHQRFWIOFKJLN-IBGZPJMESA-N 1 1 358.394 2.536 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C ZINC000880489241 1015848434 /nfs/dbraw/zinc/84/84/34/1015848434.db2.gz QURAGYRGHLYSEG-PLUODVSUSA-N 1 1 373.453 2.614 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808790632 994265974 /nfs/dbraw/zinc/26/59/74/994265974.db2.gz UYVGTYKGKBCSIE-VBNZEHGJSA-N 1 1 365.430 2.616 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000811448657 995150291 /nfs/dbraw/zinc/15/02/91/995150291.db2.gz XQZPRHYOJHWSJN-KRWDZBQOSA-N 1 1 365.361 2.992 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)[C@H](O)c1cccc(O)c1 ZINC001170677986 995438461 /nfs/dbraw/zinc/43/84/61/995438461.db2.gz DXPRMRYCJRYXNI-BUXKBTBVSA-N 1 1 357.410 2.822 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)[C@H](O)c1cccc(O)c1 ZINC001170677986 995438468 /nfs/dbraw/zinc/43/84/68/995438468.db2.gz DXPRMRYCJRYXNI-BUXKBTBVSA-N 1 1 357.410 2.822 20 5 FFBDMO CC(C)(C)c1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCOCC1 ZINC000880709038 1015952058 /nfs/dbraw/zinc/95/20/58/1015952058.db2.gz JSSHPSJUTXYOLJ-UHFFFAOYSA-N 1 1 364.446 2.736 20 5 FFBDMO CC(C)(C)n1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173871 995633659 /nfs/dbraw/zinc/63/36/59/995633659.db2.gz LQFYQWLMTZHCAO-KRWDZBQOSA-N 1 1 372.425 2.978 20 5 FFBDMO CC(C)(C)n1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173871 995633662 /nfs/dbraw/zinc/63/36/62/995633662.db2.gz LQFYQWLMTZHCAO-KRWDZBQOSA-N 1 1 372.425 2.978 20 5 FFBDMO COc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000825198979 997272274 /nfs/dbraw/zinc/27/22/74/997272274.db2.gz NPGPAMVBIVSSMX-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC001229941257 997281863 /nfs/dbraw/zinc/28/18/63/997281863.db2.gz PXCOVOXPNYBGLW-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1ccnc1 ZINC000845575465 998591853 /nfs/dbraw/zinc/59/18/53/998591853.db2.gz IBURCVZDBWIXJX-YOEHRIQHSA-N 1 1 358.398 2.560 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1ccnc1 ZINC000845575465 998591860 /nfs/dbraw/zinc/59/18/60/998591860.db2.gz IBURCVZDBWIXJX-YOEHRIQHSA-N 1 1 358.398 2.560 20 5 FFBDMO Cc1c(C(=O)OC[C@H]2CC[N@H+]2C(C)(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000845740028 998630935 /nfs/dbraw/zinc/63/09/35/998630935.db2.gz XAKWAPALKRGTDR-OAHLLOKOSA-N 1 1 373.413 2.514 20 5 FFBDMO COc1ccc([C@H]2[C@H](COC(=O)c3cc([N+](=O)[O-])cn3C)CC[N@H+]2C)cc1 ZINC000741120634 999709599 /nfs/dbraw/zinc/70/95/99/999709599.db2.gz JFJQTYCFIOZLFU-KSSFIOAISA-N 1 1 373.409 2.792 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000741724493 999738932 /nfs/dbraw/zinc/73/89/32/999738932.db2.gz MRHRSZXEYXGMSZ-CABCVRRESA-N 1 1 360.458 2.798 20 5 FFBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000742167917 999760405 /nfs/dbraw/zinc/76/04/05/999760405.db2.gz ZYMNIHKGONBTGU-CQSZACIVSA-N 1 1 373.409 2.572 20 5 FFBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000742167917 999760407 /nfs/dbraw/zinc/76/04/07/999760407.db2.gz ZYMNIHKGONBTGU-CQSZACIVSA-N 1 1 373.409 2.572 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153629 999761957 /nfs/dbraw/zinc/76/19/57/999761957.db2.gz RFNIHZPWTIBTSA-HOTGVXAUSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153629 999761959 /nfs/dbraw/zinc/76/19/59/999761959.db2.gz RFNIHZPWTIBTSA-HOTGVXAUSA-N 1 1 359.430 2.946 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[nH+]1 ZINC000742202943 999764224 /nfs/dbraw/zinc/76/42/24/999764224.db2.gz DNCPORWLKGTELK-UHFFFAOYSA-N 1 1 369.425 2.740 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]21 ZINC001169010309 1000015257 /nfs/dbraw/zinc/01/52/57/1000015257.db2.gz COSOLORFHOAUDC-ZJIFWQFVSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169010582 1000015370 /nfs/dbraw/zinc/01/53/70/1000015370.db2.gz DVBRXITVXODCRJ-FPCVCCKLSA-N 1 1 353.463 2.621 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC3(CC2)CN(Cc2ccccc2)CCO3)C1 ZINC001169019595 1000017430 /nfs/dbraw/zinc/01/74/30/1000017430.db2.gz GSNAMIYUYWHECH-VQTJNVASSA-N 1 1 373.497 2.799 20 5 FFBDMO COc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169019015 1000017578 /nfs/dbraw/zinc/01/75/78/1000017578.db2.gz GBCSMECDRHFJBD-RIFZZMRRSA-N 1 1 373.453 2.569 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCC3(CCN(c4ncccn4)CC3)C2)C1 ZINC001169022267 1000017877 /nfs/dbraw/zinc/01/78/77/1000017877.db2.gz RLRKVYGVOWXDKG-IAGOWNOFSA-N 1 1 359.474 2.604 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001148387430 1001130805 /nfs/dbraw/zinc/13/08/05/1001130805.db2.gz CRGSMKCQTNVKAB-LIRRHRJNSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000772150222 1001315751 /nfs/dbraw/zinc/31/57/51/1001315751.db2.gz RXCVRRTYMKSKIG-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1(C)CCCC1 ZINC000786219269 1001559098 /nfs/dbraw/zinc/55/90/98/1001559098.db2.gz SJZXWANURWVANW-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCCOc1cccc([N+](=O)[O-])c1 ZINC000786815788 1001632324 /nfs/dbraw/zinc/63/23/24/1001632324.db2.gz VYOBXPIDKFLULY-UHFFFAOYSA-N 1 1 370.405 2.965 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000788116903 1001756400 /nfs/dbraw/zinc/75/64/00/1001756400.db2.gz LBHBSNCTCDNLNI-JKSUJKDBSA-N 1 1 359.426 2.979 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CC[C@@H](Oc4ccncc4)C3)c2)c1 ZINC000788380574 1001797496 /nfs/dbraw/zinc/79/74/96/1001797496.db2.gz JBEHOKWRHDFVMR-LJQANCHMSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)c2)c1 ZINC000788380574 1001797500 /nfs/dbraw/zinc/79/75/00/1001797500.db2.gz JBEHOKWRHDFVMR-LJQANCHMSA-N 1 1 365.393 2.964 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517600 1001965226 /nfs/dbraw/zinc/96/52/26/1001965226.db2.gz HRLSUBALQLBXDY-IJEWVQPXSA-N 1 1 360.458 2.796 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000789519591 1002107225 /nfs/dbraw/zinc/10/72/25/1002107225.db2.gz LYDQBZUKRMFEAG-GOSISDBHSA-N 1 1 371.441 2.797 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1CCNC1=O ZINC001183011926 1002122154 /nfs/dbraw/zinc/12/21/54/1002122154.db2.gz NFEBSXBHCRGHOT-MRXNPFEDSA-N 1 1 362.433 2.837 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001185421512 1002938299 /nfs/dbraw/zinc/93/82/99/1002938299.db2.gz WZAZKUIHOVDYGF-GFCCVEGCSA-N 1 1 359.386 2.829 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(Cc3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC001170326940 1003113376 /nfs/dbraw/zinc/11/33/76/1003113376.db2.gz CRWKNZWCYAAHCP-INIZCTEOSA-N 1 1 370.453 2.747 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(c3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC001170336299 1003117674 /nfs/dbraw/zinc/11/76/74/1003117674.db2.gz WEJLIFNUGZVDID-OAHLLOKOSA-N 1 1 356.426 2.752 20 5 FFBDMO CCOCc1ncn2c1C[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170342635 1003130205 /nfs/dbraw/zinc/13/02/05/1003130205.db2.gz MNEYVJMVTVFQQA-CQSZACIVSA-N 1 1 374.441 2.783 20 5 FFBDMO CCOCc1ncn2c1C[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170342635 1003130207 /nfs/dbraw/zinc/13/02/07/1003130207.db2.gz MNEYVJMVTVFQQA-CQSZACIVSA-N 1 1 374.441 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(C[C@@]1(O)CC[N@@H+](Cc3ccccc3)C1)CC2 ZINC001191521393 1003865071 /nfs/dbraw/zinc/86/50/71/1003865071.db2.gz QFYIIRGPRPUJPJ-NRFANRHFSA-N 1 1 367.449 2.590 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805776973 1004129092 /nfs/dbraw/zinc/12/90/92/1004129092.db2.gz XGUHLJNGIOGXGW-IRXDYDNUSA-N 1 1 365.430 2.619 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC001192894856 1004312575 /nfs/dbraw/zinc/31/25/75/1004312575.db2.gz DETAAAHTMGRMPN-UHFFFAOYSA-N 1 1 363.867 2.647 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001131095272 1004720504 /nfs/dbraw/zinc/72/05/04/1004720504.db2.gz CTOXBIPYRUKPSR-ZDUSSCGKSA-N 1 1 356.426 2.933 20 5 FFBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1 ZINC001050243640 1016928938 /nfs/dbraw/zinc/92/89/38/1016928938.db2.gz BLGXBDPKWDOJNJ-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001050243640 1016928949 /nfs/dbraw/zinc/92/89/49/1016928949.db2.gz BLGXBDPKWDOJNJ-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001050243640 1016928967 /nfs/dbraw/zinc/92/89/67/1016928967.db2.gz BLGXBDPKWDOJNJ-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]2O[C@@H](c3ccccc3)C[C@H]21 ZINC001195711813 1005027655 /nfs/dbraw/zinc/02/76/55/1005027655.db2.gz FTYJRTDNNKZLJT-GUDVDZBRSA-N 1 1 369.421 2.751 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325384 1016968354 /nfs/dbraw/zinc/96/83/54/1016968354.db2.gz AXZVZNOXYOXGSK-VVHMCBODSA-N 1 1 370.453 2.598 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581022 1005961368 /nfs/dbraw/zinc/96/13/68/1005961368.db2.gz CGLKQSRSKTXPPD-SFHVURJKSA-N 1 1 358.394 2.694 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852306943 1005970185 /nfs/dbraw/zinc/97/01/85/1005970185.db2.gz NIGIFLISDSVKOQ-OAHLLOKOSA-N 1 1 367.446 2.863 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000813824385 1006045309 /nfs/dbraw/zinc/04/53/09/1006045309.db2.gz YCAFVTAHLDVJSP-SJCJKPOMSA-N 1 1 372.400 2.709 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000852514275 1006062138 /nfs/dbraw/zinc/06/21/38/1006062138.db2.gz DWGUQWLZYQUOCP-LEWJYISDSA-N 1 1 369.465 2.877 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505625 1006419042 /nfs/dbraw/zinc/41/90/42/1006419042.db2.gz MSUNXJQQSWXUSA-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853505625 1006419046 /nfs/dbraw/zinc/41/90/46/1006419046.db2.gz MSUNXJQQSWXUSA-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000853593057 1006466007 /nfs/dbraw/zinc/46/60/07/1006466007.db2.gz DDSLRXSQUCLOKP-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000853593057 1006466014 /nfs/dbraw/zinc/46/60/14/1006466014.db2.gz DDSLRXSQUCLOKP-MRXNPFEDSA-N 1 1 353.382 2.759 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000853602184 1006470043 /nfs/dbraw/zinc/47/00/43/1006470043.db2.gz PORMMSASEINZPE-MRXNPFEDSA-N 1 1 371.441 2.652 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000853794197 1006538987 /nfs/dbraw/zinc/53/89/87/1006538987.db2.gz FXRLUTFIBORJLY-HNNXBMFYSA-N 1 1 372.381 2.682 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2c(nc[nH+]c2N(C)C)n1C ZINC001135504823 1006982295 /nfs/dbraw/zinc/98/22/95/1006982295.db2.gz SBOQKNSMKJMHCZ-UHFFFAOYSA-N 1 1 354.370 2.503 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000112695128 1007001436 /nfs/dbraw/zinc/00/14/36/1007001436.db2.gz ILKDFYDEQQSAKY-AWEZNQCLSA-N 1 1 373.457 2.776 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000112695128 1007001450 /nfs/dbraw/zinc/00/14/50/1007001450.db2.gz ILKDFYDEQQSAKY-AWEZNQCLSA-N 1 1 373.457 2.776 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@](O)(c4ccc(F)cc4)C3)c2c1 ZINC000776767236 1007055191 /nfs/dbraw/zinc/05/51/91/1007055191.db2.gz BONWHXGVLWWMPG-GOSISDBHSA-N 1 1 356.357 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@](O)(c4ccc(F)cc4)C3)c2c1 ZINC000776767236 1007055204 /nfs/dbraw/zinc/05/52/04/1007055204.db2.gz BONWHXGVLWWMPG-GOSISDBHSA-N 1 1 356.357 2.635 20 5 FFBDMO O=C(NCc1ccccc1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000885938070 1007842831 /nfs/dbraw/zinc/84/28/31/1007842831.db2.gz RFTWMKAZQQUVGC-UHFFFAOYSA-N 1 1 354.410 2.518 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3cc(C)c([N+](=O)[O-])cn3)C2)ccn1 ZINC000856533285 1007873574 /nfs/dbraw/zinc/87/35/74/1007873574.db2.gz COSNCSJZANQMKI-QGZVFWFLSA-N 1 1 371.441 2.803 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000858780384 1008422622 /nfs/dbraw/zinc/42/26/22/1008422622.db2.gz OMPNTRDZAFDGFM-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C ZINC000886106964 1008564981 /nfs/dbraw/zinc/56/49/81/1008564981.db2.gz HKNDSYPJCNCSNR-MRXNPFEDSA-N 1 1 372.425 2.698 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000861037946 1009243962 /nfs/dbraw/zinc/24/39/62/1009243962.db2.gz PNLOAHYEZXPOFU-HNNXBMFYSA-N 1 1 366.414 2.650 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC001181841689 1010278183 /nfs/dbraw/zinc/27/81/83/1010278183.db2.gz WQVUHQVRMPZCDE-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCC1 ZINC000119725394 1010366111 /nfs/dbraw/zinc/36/61/11/1010366111.db2.gz BHMAKWPJLMQAQS-UHFFFAOYSA-N 1 1 360.458 2.506 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1 ZINC000794589870 1010409768 /nfs/dbraw/zinc/40/97/68/1010409768.db2.gz BUKFSCJKFAHANU-QBUQCISBSA-N 1 1 367.405 2.813 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000794641800 1010438479 /nfs/dbraw/zinc/43/84/79/1010438479.db2.gz XLVCGLUAFBEFDQ-ZIAGYGMSSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000794641800 1010438489 /nfs/dbraw/zinc/43/84/89/1010438489.db2.gz XLVCGLUAFBEFDQ-ZIAGYGMSSA-N 1 1 361.398 2.599 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000865650283 1010835657 /nfs/dbraw/zinc/83/56/57/1010835657.db2.gz BDCCKEMGXVAXHG-AUUYWEPGSA-N 1 1 367.409 2.969 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121141755 1011022799 /nfs/dbraw/zinc/02/27/99/1011022799.db2.gz VYQFKHZAZRZEFJ-OAHLLOKOSA-N 1 1 373.457 2.839 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867955884 1011130833 /nfs/dbraw/zinc/13/08/33/1011130833.db2.gz IQRIMIQCPVHSRT-HEFCMCLBSA-N 1 1 369.421 2.757 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000868316997 1011244833 /nfs/dbraw/zinc/24/48/33/1011244833.db2.gz BUCNHKACHQHOHR-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000868316997 1011244850 /nfs/dbraw/zinc/24/48/50/1011244850.db2.gz BUCNHKACHQHOHR-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000869083295 1011601718 /nfs/dbraw/zinc/60/17/18/1011601718.db2.gz IVTQLFNBBRHZBP-SJORKVTESA-N 1 1 371.412 2.738 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905496 1012077481 /nfs/dbraw/zinc/07/74/81/1012077481.db2.gz CQFSINVMJNCVOT-QAPCUYQASA-N 1 1 370.453 2.817 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905496 1012077484 /nfs/dbraw/zinc/07/74/84/1012077484.db2.gz CQFSINVMJNCVOT-QAPCUYQASA-N 1 1 370.453 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@H](Oc3ncc(F)cn3)C1)CC2 ZINC001172913085 1012125049 /nfs/dbraw/zinc/12/50/49/1012125049.db2.gz OTLFKBLWCWFPRJ-WMZOPIPTSA-N 1 1 372.400 2.925 20 5 FFBDMO C[N@@H+](Cc1cncnc1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018865 1012189584 /nfs/dbraw/zinc/18/95/84/1012189584.db2.gz HSQIEIUTQOGOIM-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO CCCOC1C[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173017854 1012189728 /nfs/dbraw/zinc/18/97/28/1012189728.db2.gz KLSHVMHUGSFGNR-UHFFFAOYSA-N 1 1 355.385 2.953 20 5 FFBDMO CC[N@@H+](CCCC(=O)OC)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173182007 1012326192 /nfs/dbraw/zinc/32/61/92/1012326192.db2.gz RFAQTMSHDGHVKG-GFCCVEGCSA-N 1 1 356.394 2.949 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CCN2c2ncccn2)C1 ZINC001173222942 1012353445 /nfs/dbraw/zinc/35/34/45/1012353445.db2.gz DQNYTBZKAOSCHU-HNAYVOBHSA-N 1 1 353.426 2.671 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(Cc2cccnc2)CC1 ZINC001173224830 1012356947 /nfs/dbraw/zinc/35/69/47/1012356947.db2.gz PGCHAUUPQWZNJF-MRXNPFEDSA-N 1 1 354.454 2.957 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CCN(c3ncccn3)C[C@H]2C1 ZINC001173223847 1012357928 /nfs/dbraw/zinc/35/79/28/1012357928.db2.gz IEZPDWCONSVEDM-JQHSSLGASA-N 1 1 367.453 2.774 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(Cc2cccnc2)CC1 ZINC001173224827 1012359024 /nfs/dbraw/zinc/35/90/24/1012359024.db2.gz PGCHAUUPQWZNJF-INIZCTEOSA-N 1 1 354.454 2.957 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226284 1012360000 /nfs/dbraw/zinc/36/00/00/1012360000.db2.gz LOMUODOVUTXOAC-CYBMUJFWSA-N 1 1 372.425 2.710 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226284 1012360016 /nfs/dbraw/zinc/36/00/16/1012360016.db2.gz LOMUODOVUTXOAC-CYBMUJFWSA-N 1 1 372.425 2.710 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880310 1012616706 /nfs/dbraw/zinc/61/67/06/1012616706.db2.gz YYQNKHAJSAMZAH-PKOBYXMFSA-N 1 1 373.384 2.508 20 5 FFBDMO c1nc2n(c1-c1nc(-c3ccc4ccc5cccnc5c4n3)no1)CC[NH2+]C2 ZINC001217207195 1032649739 /nfs/dbraw/zinc/64/97/39/1032649739.db2.gz IVZFGMPJNNNRAG-UHFFFAOYSA-N 1 1 369.388 2.800 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000827925622 1019006590 /nfs/dbraw/zinc/00/65/90/1019006590.db2.gz BDTXLWBCPKEBBZ-QGZVFWFLSA-N 1 1 373.384 2.545 20 5 FFBDMO COc1ccc(OC)c([C@@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000801602060 1019161503 /nfs/dbraw/zinc/16/15/03/1019161503.db2.gz UVISJLJOTRZUNT-SFHVURJKSA-N 1 1 360.410 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CCC[C@H](C(F)(F)F)O3)C2)nc1 ZINC000929989944 1019797227 /nfs/dbraw/zinc/79/72/27/1019797227.db2.gz TYSHQFMLJZIBCS-KWCYVHTRSA-N 1 1 374.363 2.976 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1=CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525165 1020276282 /nfs/dbraw/zinc/27/62/82/1020276282.db2.gz NWJVARNCBTVMRB-RHQZKXFESA-N 1 1 361.486 2.901 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1=CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525165 1020276289 /nfs/dbraw/zinc/27/62/89/1020276289.db2.gz NWJVARNCBTVMRB-RHQZKXFESA-N 1 1 361.486 2.901 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1=CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525165 1020276294 /nfs/dbraw/zinc/27/62/94/1020276294.db2.gz NWJVARNCBTVMRB-RHQZKXFESA-N 1 1 361.486 2.901 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC001072725421 1020294950 /nfs/dbraw/zinc/29/49/50/1020294950.db2.gz MKADLMSEOAOYRW-QZTJIDSGSA-N 1 1 371.481 2.684 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725421 1020294960 /nfs/dbraw/zinc/29/49/60/1020294960.db2.gz MKADLMSEOAOYRW-QZTJIDSGSA-N 1 1 371.481 2.684 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725421 1020294973 /nfs/dbraw/zinc/29/49/73/1020294973.db2.gz MKADLMSEOAOYRW-QZTJIDSGSA-N 1 1 371.481 2.684 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)n1 ZINC000777953628 1020306437 /nfs/dbraw/zinc/30/64/37/1020306437.db2.gz IIOOHPMFIBZOJW-HNNXBMFYSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)n1 ZINC000777953628 1020306447 /nfs/dbraw/zinc/30/64/47/1020306447.db2.gz IIOOHPMFIBZOJW-HNNXBMFYSA-N 1 1 368.397 2.987 20 5 FFBDMO COCCOC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777955743 1020315311 /nfs/dbraw/zinc/31/53/11/1020315311.db2.gz RTEQLVWBTSNLQL-UHFFFAOYSA-N 1 1 360.414 2.543 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@H](n4ccnc4)C3)c2)c1 ZINC000777956285 1020329877 /nfs/dbraw/zinc/32/98/77/1020329877.db2.gz DIHRUJFDVIJDMZ-SFHVURJKSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@H](n4ccnc4)C3)c2)c1 ZINC000777956285 1020329890 /nfs/dbraw/zinc/32/98/90/1020329890.db2.gz DIHRUJFDVIJDMZ-SFHVURJKSA-N 1 1 352.398 2.949 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2cccnc2N2CCOCC2)cc([N+](=O)[O-])c1 ZINC000903065097 1020659954 /nfs/dbraw/zinc/65/99/54/1020659954.db2.gz GOSUVWVDCXCNOA-AWEZNQCLSA-N 1 1 372.425 2.686 20 5 FFBDMO CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000750116629 1021381029 /nfs/dbraw/zinc/38/10/29/1021381029.db2.gz SLYPZRRFECAFDV-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000750116629 1021381043 /nfs/dbraw/zinc/38/10/43/1021381043.db2.gz SLYPZRRFECAFDV-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000750116629 1021381061 /nfs/dbraw/zinc/38/10/61/1021381061.db2.gz SLYPZRRFECAFDV-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO CC(C)(CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000043750110 1022264939 /nfs/dbraw/zinc/26/49/39/1022264939.db2.gz HOEDQKDBMQYVMY-UHFFFAOYSA-N 1 1 368.437 2.744 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000829338015 1033109849 /nfs/dbraw/zinc/10/98/49/1033109849.db2.gz PHCQVXDYKUCFDB-FQEVSTJZSA-N 1 1 372.421 2.748 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)c2cnn(C)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000753663859 1023365337 /nfs/dbraw/zinc/36/53/37/1023365337.db2.gz NLVIGUQHSQQILT-IEBWSBKVSA-N 1 1 370.409 2.896 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1 ZINC000189961966 1023375776 /nfs/dbraw/zinc/37/57/76/1023375776.db2.gz CLEIPBMAMIHDEB-LJQANCHMSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@@H]2C1 ZINC001124025334 1024233140 /nfs/dbraw/zinc/23/31/40/1024233140.db2.gz LHIPJEDIMDSCFM-JNAXZKDPSA-N 1 1 361.445 2.751 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192752156 1024265724 /nfs/dbraw/zinc/26/57/24/1024265724.db2.gz ZEINMMLMDHDSRH-GOEBONIOSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC[C@H]2C2CCC2)C1=O ZINC000246014319 1025695110 /nfs/dbraw/zinc/69/51/10/1025695110.db2.gz LHSOAHUWIQPKPZ-LPHOPBHVSA-N 1 1 372.425 2.584 20 5 FFBDMO COc1cc(OCC(=O)OC[C@@H]2CCCC[N@H+]2C(C)C)ccc1[N+](=O)[O-] ZINC000837472244 1025831505 /nfs/dbraw/zinc/83/15/05/1025831505.db2.gz KCBUNTMACWOEKM-AWEZNQCLSA-N 1 1 366.414 2.788 20 5 FFBDMO CCCc1[nH]nc(C(=O)O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000837700490 1025971099 /nfs/dbraw/zinc/97/10/99/1025971099.db2.gz UZRZTKBPJQPKQN-CQSZACIVSA-N 1 1 358.398 2.702 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCC12CCOCC2 ZINC000840125972 1026969939 /nfs/dbraw/zinc/96/99/39/1026969939.db2.gz NOZPESQSKNGJSE-KRWDZBQOSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCC12CCOCC2 ZINC000840125972 1026969945 /nfs/dbraw/zinc/96/99/45/1026969945.db2.gz NOZPESQSKNGJSE-KRWDZBQOSA-N 1 1 373.453 2.761 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138874 1026978197 /nfs/dbraw/zinc/97/81/97/1026978197.db2.gz GNYRPFKENNJWFM-IAGOWNOFSA-N 1 1 374.441 2.684 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138874 1026978202 /nfs/dbraw/zinc/97/82/02/1026978202.db2.gz GNYRPFKENNJWFM-IAGOWNOFSA-N 1 1 374.441 2.684 20 5 FFBDMO COc1cccc2c1C[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)CO2 ZINC001160133914 1027605744 /nfs/dbraw/zinc/60/57/44/1027605744.db2.gz ZPGXYXYORZTNSG-NPQIQWPPSA-N 1 1 370.409 2.946 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(C)c1[N+](=O)[O-] ZINC000795690963 1027813656 /nfs/dbraw/zinc/81/36/56/1027813656.db2.gz BTNPHBLLINVNRF-KURKYZTESA-N 1 1 356.426 2.870 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CCNc1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001160970347 1027951720 /nfs/dbraw/zinc/95/17/20/1027951720.db2.gz DULMUKZJSOSSFF-SSDOTTSWSA-N 1 1 353.732 2.953 20 5 FFBDMO COC(=O)C[C@@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1ccccn1 ZINC001161069051 1027995915 /nfs/dbraw/zinc/99/59/15/1027995915.db2.gz HKHQDMYIRPYCMR-LOWQCSRCSA-N 1 1 371.397 2.633 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+]1Cc1ccccc1 ZINC001161749479 1028305064 /nfs/dbraw/zinc/30/50/64/1028305064.db2.gz SVBYASSDAAKDKO-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001161749479 1028305079 /nfs/dbraw/zinc/30/50/79/1028305079.db2.gz SVBYASSDAAKDKO-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1NCCc1cn2c([nH+]1)CCCC2 ZINC001162099675 1028432332 /nfs/dbraw/zinc/43/23/32/1028432332.db2.gz YVAXUNHGNNVVQA-UHFFFAOYSA-N 1 1 355.373 2.891 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N[C@]1(C)CCC[N@@H+](C)C1 ZINC001162341330 1028508454 /nfs/dbraw/zinc/50/84/54/1028508454.db2.gz KRAVQBUKVFFNDP-OAHLLOKOSA-N 1 1 356.810 2.716 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2ccc(-n3ccnn3)cc2)ncc1[N+](=O)[O-] ZINC001162820626 1028671398 /nfs/dbraw/zinc/67/13/98/1028671398.db2.gz BDCVJKXITANVIX-VQHVLOKHSA-N 1 1 365.397 2.715 20 5 FFBDMO COc1cnc(N2CC[NH+](C[C@@H](OC)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001155715410 1028868234 /nfs/dbraw/zinc/86/82/34/1028868234.db2.gz KGPOQLIOOPTJPY-GOSISDBHSA-N 1 1 372.425 2.508 20 5 FFBDMO CN1C(=O)CCC12CCC(Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)CC2 ZINC001155787988 1028912021 /nfs/dbraw/zinc/91/20/21/1028912021.db2.gz QPGSUAIFVVNKIX-YRNVUSSQSA-N 1 1 373.457 2.868 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2Cc3c[nH+]cn3C2)nc1OCc1ccccc1 ZINC001163832054 1029082074 /nfs/dbraw/zinc/08/20/74/1029082074.db2.gz VYWUQPUSDXGFMJ-AWEZNQCLSA-N 1 1 351.366 2.802 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NCC[C@H]1CCC[N@@H+](C)C1 ZINC001156381591 1029172886 /nfs/dbraw/zinc/17/28/86/1029172886.db2.gz SILFTAUGCNOTRM-LLVKDONJSA-N 1 1 370.837 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)cc1 ZINC000782226195 1029616917 /nfs/dbraw/zinc/61/69/17/1029616917.db2.gz HGGCRZKMJJGUOW-LJQANCHMSA-N 1 1 366.377 2.738 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1C1CCOCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782532231 1029734820 /nfs/dbraw/zinc/73/48/20/1029734820.db2.gz ZTGYDJMNIWGFQS-KRWDZBQOSA-N 1 1 365.405 2.954 20 5 FFBDMO CCOCOc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000783405295 1030082213 /nfs/dbraw/zinc/08/22/13/1030082213.db2.gz SDSILDINDPADFG-UHFFFAOYSA-N 1 1 372.425 2.685 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000783999412 1030404368 /nfs/dbraw/zinc/40/43/68/1030404368.db2.gz FCDFRMUGDPGMHU-HNNXBMFYSA-N 1 1 374.441 2.728 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(c3ncccc3F)CC2)cc1[N+](=O)[O-] ZINC000784411926 1030610085 /nfs/dbraw/zinc/61/00/85/1030610085.db2.gz LJJWCULUBRJKFM-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(c3ncccc3F)CC2)cc1[N+](=O)[O-] ZINC000784411926 1030610091 /nfs/dbraw/zinc/61/00/91/1030610091.db2.gz LJJWCULUBRJKFM-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO CCOCCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC001167038857 1030622809 /nfs/dbraw/zinc/62/28/09/1030622809.db2.gz SDVOSTZXYQJMOW-UHFFFAOYSA-N 1 1 353.375 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](c4cccnc4)C3)n2)cc1 ZINC000842623025 1030841658 /nfs/dbraw/zinc/84/16/58/1030841658.db2.gz SEEOBWHFOAPZTJ-MRXNPFEDSA-N 1 1 350.382 2.695 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000797530177 1031144200 /nfs/dbraw/zinc/14/42/00/1031144200.db2.gz PQLFLRLONXYTLZ-VQIMIIECSA-N 1 1 369.421 2.613 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799192514 1031688719 /nfs/dbraw/zinc/68/87/19/1031688719.db2.gz YVKMPUOKRKOZCV-CQSZACIVSA-N 1 1 368.393 2.777 20 5 FFBDMO CCc1cccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001115530820 1031788435 /nfs/dbraw/zinc/78/84/35/1031788435.db2.gz SSESXPAMFLEVHI-QZTJIDSGSA-N 1 1 359.470 2.823 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000830183762 1033498069 /nfs/dbraw/zinc/49/80/69/1033498069.db2.gz XLWKJYSKOMIASN-MGPQQGTHSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@@H](C)[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000830183762 1033498081 /nfs/dbraw/zinc/49/80/81/1033498081.db2.gz XLWKJYSKOMIASN-MGPQQGTHSA-N 1 1 367.450 2.510 20 5 FFBDMO O=C([C@H]1CCCC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001138247075 1034016395 /nfs/dbraw/zinc/01/63/95/1034016395.db2.gz AOERMUDTRUXGCK-LJQANCHMSA-N 1 1 373.453 2.982 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000831572902 1034129275 /nfs/dbraw/zinc/12/92/75/1034129275.db2.gz XDRXJPKVSMQVLT-JHJVBQTASA-N 1 1 371.359 2.998 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])ccc3Cl)C[C@H]1[N@H+]2C ZINC001226810728 1034849082 /nfs/dbraw/zinc/84/90/82/1034849082.db2.gz RGVHIIHQAXFWND-GMZLATJGSA-N 1 1 354.790 2.794 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC001226916002 1034882782 /nfs/dbraw/zinc/88/27/82/1034882782.db2.gz VTTKTCGQDVGLNJ-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227502172 1035588447 /nfs/dbraw/zinc/58/84/47/1035588447.db2.gz WXKADJUHWNVCOD-NSHDSACASA-N 1 1 354.319 2.663 20 5 FFBDMO COC(=O)c1cnc(O[C@@H]2CCCN(c3ccc(C)c[nH+]3)C2)c([N+](=O)[O-])c1 ZINC001233867092 1036797661 /nfs/dbraw/zinc/79/76/61/1036797661.db2.gz SGZNLUGHBNIYOD-CQSZACIVSA-N 1 1 372.381 2.528 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2cccc(I)c2[N+](=O)[O-])C1 ZINC001229656610 1036807142 /nfs/dbraw/zinc/80/71/42/1036807142.db2.gz KBTFRFSZEQHOMX-VIFPVBQESA-N 1 1 362.167 2.672 20 5 FFBDMO Cc1c(Br)cnc(OC2CC[NH+](CCF)CC2)c1[N+](=O)[O-] ZINC001230036297 1037047593 /nfs/dbraw/zinc/04/75/93/1037047593.db2.gz YXQRTCRRFIYSKL-UHFFFAOYSA-N 1 1 362.199 2.873 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1nc2c[nH]cc([N+](=O)[O-])c-2n1 ZINC001230231510 1037163840 /nfs/dbraw/zinc/16/38/40/1037163840.db2.gz LYADDRWDRRKYJV-LRDDRELGSA-N 1 1 353.382 2.765 20 5 FFBDMO COc1cc(N2CCC([NH2+][C@H]3C[C@H]4CC[C@@H](C3)N4C)CC2)ccc1[N+](=O)[O-] ZINC001256086779 1038370389 /nfs/dbraw/zinc/37/03/89/1038370389.db2.gz DSFFHWHGEFMAKV-BJWYYQGGSA-N 1 1 374.485 2.787 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCC[C@](C)(O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093226 1038379012 /nfs/dbraw/zinc/37/90/12/1038379012.db2.gz IIIMGRMMOHYWMG-IBGZPJMESA-N 1 1 363.458 2.809 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCN4CCCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099173 1038384121 /nfs/dbraw/zinc/38/41/21/1038384121.db2.gz MBILKKXIPNUZML-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[N@@H+]4CCCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099173 1038384135 /nfs/dbraw/zinc/38/41/35/1038384135.db2.gz MBILKKXIPNUZML-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[N@H+]4CCCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099173 1038384147 /nfs/dbraw/zinc/38/41/47/1038384147.db2.gz MBILKKXIPNUZML-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCc4oc(C)nc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103553 1038386828 /nfs/dbraw/zinc/38/68/28/1038386828.db2.gz MGBGIHUDATUIOZ-UHFFFAOYSA-N 1 1 372.425 2.927 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCc4oc(C)nc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103553 1038386842 /nfs/dbraw/zinc/38/68/42/1038386842.db2.gz MGBGIHUDATUIOZ-UHFFFAOYSA-N 1 1 372.425 2.927 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H]4CCCC(=O)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103855 1038389234 /nfs/dbraw/zinc/38/92/34/1038389234.db2.gz PKJCJSUDIHNNRO-YOEHRIQHSA-N 1 1 373.453 2.873 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC001256279394 1038462367 /nfs/dbraw/zinc/46/23/67/1038462367.db2.gz OMGXUSGFFONYCK-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC001256279394 1038462372 /nfs/dbraw/zinc/46/23/72/1038462372.db2.gz OMGXUSGFFONYCK-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@@H]3CCCCNC3)CC2)c(F)c1 ZINC001246091825 1039241170 /nfs/dbraw/zinc/24/11/70/1039241170.db2.gz QPNVVFGGKUKFDQ-CYBMUJFWSA-N 1 1 354.401 2.574 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N[C@@H]3CCCC[NH2+]C3)CC2)c(F)c1 ZINC001246091825 1039241182 /nfs/dbraw/zinc/24/11/82/1039241182.db2.gz QPNVVFGGKUKFDQ-CYBMUJFWSA-N 1 1 354.401 2.574 20 5 FFBDMO C[C@@H]1CC[C@@H](C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)NC1 ZINC001246108305 1039245439 /nfs/dbraw/zinc/24/54/39/1039245439.db2.gz UVYGIGRMYHQSQD-OCCSQVGLSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@@H]1CC[C@@H](CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[NH2+]C1 ZINC001246108305 1039245448 /nfs/dbraw/zinc/24/54/48/1039245448.db2.gz UVYGIGRMYHQSQD-OCCSQVGLSA-N 1 1 368.428 2.820 20 5 FFBDMO N[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1F ZINC001246572178 1039401227 /nfs/dbraw/zinc/40/12/27/1039401227.db2.gz UVDNNOUDXGLPRA-BBRMVZONSA-N 1 1 372.391 2.603 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667817 1070231304 /nfs/dbraw/zinc/23/13/04/1070231304.db2.gz LXOYHGJUYJAFKR-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667817 1070231311 /nfs/dbraw/zinc/23/13/11/1070231311.db2.gz LXOYHGJUYJAFKR-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667818 1070231495 /nfs/dbraw/zinc/23/14/95/1070231495.db2.gz LXOYHGJUYJAFKR-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667818 1070231510 /nfs/dbraw/zinc/23/15/10/1070231510.db2.gz LXOYHGJUYJAFKR-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO COc1nc(C)ccc1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248208229 1040173017 /nfs/dbraw/zinc/17/30/17/1040173017.db2.gz KSRPNSRJJPYXKP-CQSZACIVSA-N 1 1 355.354 2.599 20 5 FFBDMO Cc1ccc(CNC(=O)N2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001254249554 1040642364 /nfs/dbraw/zinc/64/23/64/1040642364.db2.gz SJUQKEOKWXTLBA-BGYRXZFFSA-N 1 1 372.469 2.921 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC(N3CC4(C3)CC[N@@H+](CC3CC3)C4)CC2)cc1 ZINC001254473825 1040741000 /nfs/dbraw/zinc/74/10/00/1040741000.db2.gz CCRGHOGKFFNTFU-UHFFFAOYSA-N 1 1 370.497 2.981 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254483449 1040749138 /nfs/dbraw/zinc/74/91/38/1040749138.db2.gz UXHNWVDELQXMEN-OAHLLOKOSA-N 1 1 360.458 2.554 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2C[C@H](C(=O)NC3CC3)C[C@@H]2C1 ZINC001254556951 1040797946 /nfs/dbraw/zinc/79/79/46/1040797946.db2.gz NYBHOCJQKXSLSL-DZUCGIPZSA-N 1 1 357.454 2.762 20 5 FFBDMO CC(C)[N@H+]1CCOC[C@@]2(CCCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822172 /nfs/dbraw/zinc/82/21/72/1040822172.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@@]2(CCC[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822186 /nfs/dbraw/zinc/82/21/86/1040822186.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592720 1040822202 /nfs/dbraw/zinc/82/22/02/1040822202.db2.gz GAANOPWFXBAFGJ-SFTDATJTSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254595674 1040824565 /nfs/dbraw/zinc/82/45/65/1040824565.db2.gz XXSSWIDLHLTGIE-MWDXBVQZSA-N 1 1 359.426 2.517 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@@]3(C[C@H](OCC4CC4)CO3)C1)C2 ZINC001254599924 1040829972 /nfs/dbraw/zinc/82/99/72/1040829972.db2.gz MVANZBUKBBWDBR-HSALFYBXSA-N 1 1 358.438 2.722 20 5 FFBDMO C[C@@H](CNC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1ccccc1[N+](=O)[O-] ZINC001311346222 1043898690 /nfs/dbraw/zinc/89/86/90/1043898690.db2.gz ZBZRHDBHOBDOFC-BBRMVZONSA-N 1 1 360.414 2.893 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313368333 1044332925 /nfs/dbraw/zinc/33/29/25/1044332925.db2.gz DUWSDVNIYIFZJB-DOTOQJQBSA-N 1 1 360.458 2.968 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890846 1044925403 /nfs/dbraw/zinc/92/54/03/1044925403.db2.gz RVWYOFUEBNJFLN-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890846 1044925420 /nfs/dbraw/zinc/92/54/20/1044925420.db2.gz RVWYOFUEBNJFLN-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC001319035679 1044997023 /nfs/dbraw/zinc/99/70/23/1044997023.db2.gz MSDCBYCJTKBAEB-UHFFFAOYSA-N 1 1 366.421 2.809 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001319485172 1045168427 /nfs/dbraw/zinc/16/84/27/1045168427.db2.gz LVSGIQFSJCEXFZ-LPHOPBHVSA-N 1 1 372.400 2.707 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(Cc3cc(C)on3)CC2)cc1[N+](=O)[O-] ZINC001319815273 1045277989 /nfs/dbraw/zinc/27/79/89/1045277989.db2.gz PUDCIZPSCXQTGG-UHFFFAOYSA-N 1 1 360.414 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(Cc3cc(C)on3)CC2)cc1[N+](=O)[O-] ZINC001319815273 1045277995 /nfs/dbraw/zinc/27/79/95/1045277995.db2.gz PUDCIZPSCXQTGG-UHFFFAOYSA-N 1 1 360.414 2.608 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001320174762 1045362491 /nfs/dbraw/zinc/36/24/91/1045362491.db2.gz BKKMEVDGQUJSSA-QZTJIDSGSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001320174762 1045362496 /nfs/dbraw/zinc/36/24/96/1045362496.db2.gz BKKMEVDGQUJSSA-QZTJIDSGSA-N 1 1 372.400 2.951 20 5 FFBDMO CCN(CC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001320734581 1045458399 /nfs/dbraw/zinc/45/83/99/1045458399.db2.gz KSBFUQJFAPUOLW-ZIAGYGMSSA-N 1 1 360.241 2.597 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC001320760968 1045462545 /nfs/dbraw/zinc/46/25/45/1045462545.db2.gz NBQXYEOIGYKCMR-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC001320887277 1045488230 /nfs/dbraw/zinc/48/82/30/1045488230.db2.gz BOPSFMMYMNNIRX-HUUCEWRRSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC001320887277 1045488233 /nfs/dbraw/zinc/48/82/33/1045488233.db2.gz BOPSFMMYMNNIRX-HUUCEWRRSA-N 1 1 352.456 2.881 20 5 FFBDMO COc1ccc(CC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001539647563 1070673633 /nfs/dbraw/zinc/67/36/33/1070673633.db2.gz ZMJCEBXXSUAPRA-INIZCTEOSA-N 1 1 361.442 2.527 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001321744028 1045781236 /nfs/dbraw/zinc/78/12/36/1045781236.db2.gz WAWJLKZTTOMORQ-AWEZNQCLSA-N 1 1 351.359 2.811 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001321744028 1045781250 /nfs/dbraw/zinc/78/12/50/1045781250.db2.gz WAWJLKZTTOMORQ-AWEZNQCLSA-N 1 1 351.359 2.811 20 5 FFBDMO CC(C)n1cnnc1[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001324939957 1046297935 /nfs/dbraw/zinc/29/79/35/1046297935.db2.gz BURRXQQOQIEMFK-WBVHZDCISA-N 1 1 359.430 2.680 20 5 FFBDMO CC[N@H+]1CCC[C@H](CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC001325874433 1046671223 /nfs/dbraw/zinc/67/12/23/1046671223.db2.gz PSSGMDGXGFYNIE-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO Cc1nn(CCO)c(C)c1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001327952294 1048106689 /nfs/dbraw/zinc/10/66/89/1048106689.db2.gz PEKIDXLMFYUACU-QGZVFWFLSA-N 1 1 358.442 2.780 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC3(CCCCO3)CC2)nc1-c1ccncc1 ZINC001332147391 1048267161 /nfs/dbraw/zinc/26/71/61/1048267161.db2.gz LRXFFJHWOMOVQS-UHFFFAOYSA-N 1 1 357.414 2.846 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc(Oc2ccccc2)c1 ZINC001492250632 1050716820 /nfs/dbraw/zinc/71/68/20/1050716820.db2.gz ZEEJCXAGCRVRIY-RTBURBONSA-N 1 1 369.421 2.692 20 5 FFBDMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(Oc2ccccc2)c1 ZINC001492250632 1050716835 /nfs/dbraw/zinc/71/68/35/1050716835.db2.gz ZEEJCXAGCRVRIY-RTBURBONSA-N 1 1 369.421 2.692 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(Oc2ccccc2)c1 ZINC001492250632 1050716848 /nfs/dbraw/zinc/71/68/48/1050716848.db2.gz ZEEJCXAGCRVRIY-RTBURBONSA-N 1 1 369.421 2.692 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)c(N)c([N+](=O)[O-])c1 ZINC001301954338 1051017903 /nfs/dbraw/zinc/01/79/03/1051017903.db2.gz YNPSNNVDIWRRFN-INIZCTEOSA-N 1 1 354.410 2.581 20 5 FFBDMO Cc1c[nH]c(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])[nH+]1 ZINC001340713649 1051074216 /nfs/dbraw/zinc/07/42/16/1051074216.db2.gz OLTQTDDSWOXJPG-UHFFFAOYSA-N 1 1 350.278 2.663 20 5 FFBDMO O=C(OC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC001344932867 1052143071 /nfs/dbraw/zinc/14/30/71/1052143071.db2.gz WLRXLHLWLDSJSA-ZDUSSCGKSA-N 1 1 354.790 2.658 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3c(Br)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001307987302 1052376756 /nfs/dbraw/zinc/37/67/56/1052376756.db2.gz IRJLVEZKKAZNJC-NEPJUHHUSA-N 1 1 354.248 2.741 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1Cc1ccnn1C ZINC001308171012 1052425172 /nfs/dbraw/zinc/42/51/72/1052425172.db2.gz RHNGMGMZTJTBPX-INIZCTEOSA-N 1 1 371.441 2.672 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001335442049 1053366392 /nfs/dbraw/zinc/36/63/92/1053366392.db2.gz VTHHSUALZFKUSH-IAGOWNOFSA-N 1 1 355.442 2.819 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)c1cnn(-c2cc[nH+]cc2)c1C ZINC001348835287 1054952757 /nfs/dbraw/zinc/95/27/57/1054952757.db2.gz XVDHMDQCJBNPNC-UHFFFAOYSA-N 1 1 368.349 2.850 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)[nH+]c1 ZINC001351808754 1055009355 /nfs/dbraw/zinc/00/93/55/1055009355.db2.gz DPGCKGULVPVISI-UHFFFAOYSA-N 1 1 350.325 2.727 20 5 FFBDMO COC(=O)/C=C\c1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1 ZINC000848877486 1055286799 /nfs/dbraw/zinc/28/67/99/1055286799.db2.gz SDUDRQYJNHUHEW-HJWRWDBZSA-N 1 1 371.393 2.696 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001356351145 1055468193 /nfs/dbraw/zinc/46/81/93/1055468193.db2.gz IOHXSDSUZVOODC-DOTOQJQBSA-N 1 1 372.473 2.594 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC001352451514 1055487842 /nfs/dbraw/zinc/48/78/42/1055487842.db2.gz CFFWZQBIJCIVIJ-QWHCGFSZSA-N 1 1 364.475 2.580 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N3CC[C@@H](c4[nH+]ccn4C)C3)c2c1 ZINC001350003399 1055578063 /nfs/dbraw/zinc/57/80/63/1055578063.db2.gz ABFXQAABUZEGJA-GFCCVEGCSA-N 1 1 353.382 2.879 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001544111624 1071596840 /nfs/dbraw/zinc/59/68/40/1071596840.db2.gz DWTYNCINIFEIAT-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3cc(C)cc([N+](=O)[O-])c3)n2C)C1 ZINC001519957327 1059245869 /nfs/dbraw/zinc/24/58/69/1059245869.db2.gz PBRXCWGZRUGODT-OAHLLOKOSA-N 1 1 372.473 2.867 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001455679664 1059863884 /nfs/dbraw/zinc/86/38/84/1059863884.db2.gz TWCCIUMYNIMVLD-QGZVFWFLSA-N 1 1 373.457 2.640 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001355171862 1059955185 /nfs/dbraw/zinc/95/51/85/1059955185.db2.gz PQAVPINKEJSZLQ-BIMULSAOSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1 ZINC001456222378 1060055190 /nfs/dbraw/zinc/05/51/90/1060055190.db2.gz REPLSXUBWRSALB-MRXNPFEDSA-N 1 1 363.458 2.861 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000848485531 1060131388 /nfs/dbraw/zinc/13/13/88/1060131388.db2.gz PHVVTIJODGEMOD-RBUKOAKNSA-N 1 1 373.453 2.759 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC001458239178 1060546693 /nfs/dbraw/zinc/54/66/93/1060546693.db2.gz NCHDSTUFJRADAP-IAGOWNOFSA-N 1 1 355.442 2.819 20 5 FFBDMO C[C@@H]1CN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC001458407530 1060584868 /nfs/dbraw/zinc/58/48/68/1060584868.db2.gz ODVLATVKELANFT-LBPRGKRZSA-N 1 1 371.397 2.972 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)[C@@H]1CCC[C@H]1O ZINC001460797494 1061106811 /nfs/dbraw/zinc/10/68/11/1061106811.db2.gz XXCKCONTDIOOFT-DGCLKSJQSA-N 1 1 352.778 2.643 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)C[C@H](O)CNC(=O)OC(C)(C)C ZINC001462254029 1061556029 /nfs/dbraw/zinc/55/60/29/1061556029.db2.gz DRVPVBGMSMIXHN-CQSZACIVSA-N 1 1 367.446 2.529 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000775575964 1062135097 /nfs/dbraw/zinc/13/50/97/1062135097.db2.gz GETOXRXSRLYMNN-WDEREUQCSA-N 1 1 369.381 2.855 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001463658008 1062202029 /nfs/dbraw/zinc/20/20/29/1062202029.db2.gz VCOPAEGGULTUTF-MRXNPFEDSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001470054103 1064250406 /nfs/dbraw/zinc/25/04/06/1064250406.db2.gz WBUTXXVPGURFEM-NSHDSACASA-N 1 1 374.363 2.897 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001472655519 1065121697 /nfs/dbraw/zinc/12/16/97/1065121697.db2.gz PTPXNJBRGLLPLM-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO C[C@H](Cc1cccc(F)c1)N(C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001576052459 1078190187 /nfs/dbraw/zinc/19/01/87/1078190187.db2.gz JPVCFTDQZMJBBX-BFUOFWGJSA-N 1 1 359.401 2.997 20 5 FFBDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC001474605493 1065560372 /nfs/dbraw/zinc/56/03/72/1065560372.db2.gz YNNLELGLXKRJRV-CYBMUJFWSA-N 1 1 360.366 2.931 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001557033953 1075801129 /nfs/dbraw/zinc/80/11/29/1075801129.db2.gz LHUNCLDDGNMXFI-INIZCTEOSA-N 1 1 359.813 2.964 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001559080730 1076123560 /nfs/dbraw/zinc/12/35/60/1076123560.db2.gz SFLVBJFRNGERJM-KBPBESRZSA-N 1 1 358.442 2.979 20 5 FFBDMO COCCC[N@@H+](C)CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559122922 1076127418 /nfs/dbraw/zinc/12/74/18/1076127418.db2.gz VRGCFXDJVNYIOS-UHFFFAOYSA-N 1 1 352.822 2.599 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H]1CCN1C(=O)OC(C)(C)C ZINC001560177266 1076242058 /nfs/dbraw/zinc/24/20/58/1076242058.db2.gz QUSBMDPJCYTMCH-HNNXBMFYSA-N 1 1 365.430 2.915 20 5 FFBDMO C[C@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001560186684 1076244045 /nfs/dbraw/zinc/24/40/45/1076244045.db2.gz UGGAAYNOWBJDNX-IHETXDGRSA-N 1 1 364.467 2.737 20 5 FFBDMO C[C@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001560186684 1076244048 /nfs/dbraw/zinc/24/40/48/1076244048.db2.gz UGGAAYNOWBJDNX-IHETXDGRSA-N 1 1 364.467 2.737 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC001570352793 1077200813 /nfs/dbraw/zinc/20/08/13/1077200813.db2.gz DGLPFHZTRKFJLH-AWEZNQCLSA-N 1 1 360.801 2.617 20 5 FFBDMO COc1c(C(=O)N2CC3(C2)C[NH+](Cc2ccccc2)C3)cccc1[N+](=O)[O-] ZINC001587222590 1079756817 /nfs/dbraw/zinc/75/68/17/1079756817.db2.gz ANZPGPQEZCKVGI-UHFFFAOYSA-N 1 1 367.405 2.561 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001587500416 1079801273 /nfs/dbraw/zinc/80/12/73/1079801273.db2.gz SGWQRRWYLGGZPW-QGZVFWFLSA-N 1 1 368.437 2.962 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])C1 ZINC001589629850 1080642669 /nfs/dbraw/zinc/64/26/69/1080642669.db2.gz KHORDCGHAAJGJO-ZDUSSCGKSA-N 1 1 359.434 2.555 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000052160013 210061176 /nfs/dbraw/zinc/06/11/76/210061176.db2.gz ARUVNSCZGBXEHI-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000052160013 210061177 /nfs/dbraw/zinc/06/11/77/210061177.db2.gz ARUVNSCZGBXEHI-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1C ZINC000106891510 250296994 /nfs/dbraw/zinc/29/69/94/250296994.db2.gz KOOANLQVTZBLJU-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000152832390 251073368 /nfs/dbraw/zinc/07/33/68/251073368.db2.gz GPCZJRLWTJWWRA-PWSUYJOCSA-N 1 1 360.357 2.940 20 5 FFBDMO Cc1cc(=O)n2nc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)sc2n1 ZINC000153240433 251117049 /nfs/dbraw/zinc/11/70/49/251117049.db2.gz YRIQHQNPGCZXSK-UHFFFAOYSA-N 1 1 371.422 2.532 20 5 FFBDMO Cc1cc(=O)n2nc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)sc2n1 ZINC000153240433 251117055 /nfs/dbraw/zinc/11/70/55/251117055.db2.gz YRIQHQNPGCZXSK-UHFFFAOYSA-N 1 1 371.422 2.532 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000251571724 251297507 /nfs/dbraw/zinc/29/75/07/251297507.db2.gz ARUVNSCZGBXEHI-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000251571724 251297513 /nfs/dbraw/zinc/29/75/13/251297513.db2.gz ARUVNSCZGBXEHI-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc(C)n(CCC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000272552855 252066350 /nfs/dbraw/zinc/06/63/50/252066350.db2.gz RQHSOJHFURBPJV-SFHVURJKSA-N 1 1 368.441 2.911 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272576460 252073091 /nfs/dbraw/zinc/07/30/91/252073091.db2.gz XGPLEQZJHZAMMJ-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)Cc3cccc([N+](=O)[O-])c3)sc2C1 ZINC000273068839 252206789 /nfs/dbraw/zinc/20/67/89/252206789.db2.gz VCUSNVSXTLLLBR-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)Cc3cccc([N+](=O)[O-])c3)sc2C1 ZINC000273068839 252206793 /nfs/dbraw/zinc/20/67/93/252206793.db2.gz VCUSNVSXTLLLBR-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000276321320 256089700 /nfs/dbraw/zinc/08/97/00/256089700.db2.gz YWDCUSAQWDWDJM-FZMZJTMJSA-N 1 1 362.348 2.997 20 5 FFBDMO C[C@@H](CO)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000276448921 256101042 /nfs/dbraw/zinc/10/10/42/256101042.db2.gz MQBRTDSLCIJDFQ-NSHDSACASA-N 1 1 355.822 2.812 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000278621125 256331708 /nfs/dbraw/zinc/33/17/08/256331708.db2.gz KMADMPDASINEEF-UHFFFAOYSA-N 1 1 370.409 2.780 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1c1nc2ccccc2cc1[N+](=O)[O-] ZINC000278836472 256352897 /nfs/dbraw/zinc/35/28/97/256352897.db2.gz VPMSVSANUSSOKS-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279688483 256441402 /nfs/dbraw/zinc/44/14/02/256441402.db2.gz NICBCOLNZPGTFS-CALCHBBNSA-N 1 1 351.406 2.799 20 5 FFBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936530 257012222 /nfs/dbraw/zinc/01/22/22/257012222.db2.gz LZFVDNGBBGPDGH-RDTXWAMCSA-N 1 1 372.425 2.545 20 5 FFBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936530 257012223 /nfs/dbraw/zinc/01/22/23/257012223.db2.gz LZFVDNGBBGPDGH-RDTXWAMCSA-N 1 1 372.425 2.545 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000286718730 257051358 /nfs/dbraw/zinc/05/13/58/257051358.db2.gz OVENGXJSCQUQBF-UHFFFAOYSA-N 1 1 374.441 2.894 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]([C@H](C)CO)C2CCCC2)c([N+](=O)[O-])c1 ZINC000287934709 257131504 /nfs/dbraw/zinc/13/15/04/257131504.db2.gz WZAYTOGFKYNDDL-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](n2cc(Cl)cn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000289790248 257299467 /nfs/dbraw/zinc/29/94/67/257299467.db2.gz HSOFHAYNGPALPY-ZDUSSCGKSA-N 1 1 363.805 2.720 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC(C)(C)C1 ZINC000289889417 257305084 /nfs/dbraw/zinc/30/50/84/257305084.db2.gz RVWXQYINTWCUKC-CVEARBPZSA-N 1 1 352.431 2.614 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000289944441 257307737 /nfs/dbraw/zinc/30/77/37/257307737.db2.gz VQNGXYQNMCMPRL-HUUCEWRRSA-N 1 1 352.431 2.614 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000301231497 258035372 /nfs/dbraw/zinc/03/53/72/258035372.db2.gz FRJWWFZECXLSDQ-HOTGVXAUSA-N 1 1 369.425 2.598 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](Nc3ncc([N+](=O)[O-])cn3)CC[N@H+]2C2CC2)c1 ZINC000302236935 258096969 /nfs/dbraw/zinc/09/69/69/258096969.db2.gz WAFGPRSILACMEN-DLBZAZTESA-N 1 1 355.398 2.783 20 5 FFBDMO Cc1nn(C)c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000312058465 258115614 /nfs/dbraw/zinc/11/56/14/258115614.db2.gz GSQSCKPGJXWNCR-DLBZAZTESA-N 1 1 355.442 2.595 20 5 FFBDMO CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C[C@@H](C)O ZINC000301428784 258049370 /nfs/dbraw/zinc/04/93/70/258049370.db2.gz FEGREVFYOMLCKL-NEPJUHHUSA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1nc(N[C@H](C[NH+]2CCN(C)CC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301626806 258059442 /nfs/dbraw/zinc/05/94/42/258059442.db2.gz HOSXESOOAGFMTL-QGZVFWFLSA-N 1 1 355.442 2.699 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301703868 258063874 /nfs/dbraw/zinc/06/38/74/258063874.db2.gz URWCLHHFNSLDID-CYBMUJFWSA-N 1 1 362.430 2.992 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(C)(C)C1 ZINC000330583870 258166067 /nfs/dbraw/zinc/16/60/67/258166067.db2.gz VIJITNBXKNKYEA-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(C)(C)C1 ZINC000330583870 258166068 /nfs/dbraw/zinc/16/60/68/258166068.db2.gz VIJITNBXKNKYEA-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000331209919 258179594 /nfs/dbraw/zinc/17/95/94/258179594.db2.gz HFQAXMDKMSQPPR-BETUJISGSA-N 1 1 365.478 2.928 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000332088244 258213661 /nfs/dbraw/zinc/21/36/61/258213661.db2.gz JWPLJCBOSSBOOI-HZPDHXFCSA-N 1 1 361.442 2.757 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000332121568 258214901 /nfs/dbraw/zinc/21/49/01/258214901.db2.gz AFSDKPFZQWYSDC-IBGZPJMESA-N 1 1 374.485 2.616 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000371068126 512202976 /nfs/dbraw/zinc/20/29/76/512202976.db2.gz ZABQEUZKQRCXBD-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000066048218 506418285 /nfs/dbraw/zinc/41/82/85/506418285.db2.gz YXLKROGOCMQYOV-ZDUSSCGKSA-N 1 1 355.398 2.507 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000054059330 506486036 /nfs/dbraw/zinc/48/60/36/506486036.db2.gz IRADDXBSSJYOFE-INIZCTEOSA-N 1 1 361.373 2.775 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ccncc3[N+](=O)[O-])cc2)CC1 ZINC000066808991 506648427 /nfs/dbraw/zinc/64/84/27/506648427.db2.gz CTYQFDIRHRQENT-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043238270 506719726 /nfs/dbraw/zinc/71/97/26/506719726.db2.gz DOQOCNSGEDLCEV-QGZVFWFLSA-N 1 1 354.410 2.669 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[NH+](CCC(C)(C)C)CC1 ZINC000055300993 506723331 /nfs/dbraw/zinc/72/33/31/506723331.db2.gz YFPVEMCMLYGENZ-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000043342421 506736043 /nfs/dbraw/zinc/73/60/43/506736043.db2.gz IXWVBQAKXJDAGA-TXEJJXNPSA-N 1 1 370.837 2.869 20 5 FFBDMO COc1ccc(C[N@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067374679 506851211 /nfs/dbraw/zinc/85/12/11/506851211.db2.gz KUAGQJLSRFEIGD-SFHVURJKSA-N 1 1 355.394 2.841 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067374679 506851219 /nfs/dbraw/zinc/85/12/19/506851219.db2.gz KUAGQJLSRFEIGD-SFHVURJKSA-N 1 1 355.394 2.841 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H](c2ccsc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000045809714 507025351 /nfs/dbraw/zinc/02/53/51/507025351.db2.gz HVEGYNIAQCDYLH-HNNXBMFYSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941797 507151587 /nfs/dbraw/zinc/15/15/87/507151587.db2.gz MMNOEDHYMDKCBI-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941797 507151593 /nfs/dbraw/zinc/15/15/93/507151593.db2.gz MMNOEDHYMDKCBI-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000068660725 507289906 /nfs/dbraw/zinc/28/99/06/507289906.db2.gz GIINUNDNSDNWFH-UHFFFAOYSA-N 1 1 359.430 2.522 20 5 FFBDMO Cc1c(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000057778241 507327446 /nfs/dbraw/zinc/32/74/46/507327446.db2.gz KNEWBWLRIGAMLI-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047623465 507367088 /nfs/dbraw/zinc/36/70/88/507367088.db2.gz MLADTFHERIHXJF-QGZVFWFLSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CC[NH+](Cc3ccccc3)CC2)c2c(c1)COCO2 ZINC000023749783 507371356 /nfs/dbraw/zinc/37/13/56/507371356.db2.gz SBRVUMXNBCKEJD-UHFFFAOYSA-N 1 1 369.421 2.779 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000069137674 507418605 /nfs/dbraw/zinc/41/86/05/507418605.db2.gz SFUPNMXZLDQFEO-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO C[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000025634422 507516980 /nfs/dbraw/zinc/51/69/80/507516980.db2.gz RWLDIZSBRMDWOF-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])c1 ZINC000375472966 512348347 /nfs/dbraw/zinc/34/83/47/512348347.db2.gz UVNLRDJAZIVDQS-CYBMUJFWSA-N 1 1 374.397 2.732 20 5 FFBDMO O=C(CC[NH+]1CCN(Cc2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000026751520 507606052 /nfs/dbraw/zinc/60/60/52/507606052.db2.gz LUKLOWUCWSGLSN-UHFFFAOYSA-N 1 1 368.437 2.741 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000052153130 507799390 /nfs/dbraw/zinc/79/93/90/507799390.db2.gz TVYDROIRIRVXPL-UHFFFAOYSA-N 1 1 357.395 2.653 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)c1 ZINC000072580334 507827614 /nfs/dbraw/zinc/82/76/14/507827614.db2.gz FLFJHNSUQVVGGW-IEBWSBKVSA-N 1 1 356.426 2.694 20 5 FFBDMO CCSCC[C@@H](C)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000072901853 507872012 /nfs/dbraw/zinc/87/20/12/507872012.db2.gz QIKSCFUOELHEOW-CYBMUJFWSA-N 1 1 351.472 2.947 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCCC2 ZINC000090550710 507926814 /nfs/dbraw/zinc/92/68/14/507926814.db2.gz ZBNMUCQQFWEKKQ-SJORKVTESA-N 1 1 363.458 2.816 20 5 FFBDMO COc1ccc(C[C@@H](C)C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000090619703 507930803 /nfs/dbraw/zinc/93/08/03/507930803.db2.gz MAUBLNHVWNLZRJ-OAHLLOKOSA-N 1 1 359.426 2.576 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000074322183 508012535 /nfs/dbraw/zinc/01/25/35/508012535.db2.gz DDHDKFTYXOMHPS-OAHLLOKOSA-N 1 1 363.483 2.877 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092010480 508033255 /nfs/dbraw/zinc/03/32/55/508033255.db2.gz VJLOMMCOTSJHGU-KOEAPFFJSA-N 1 1 356.426 2.787 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000110627274 508037963 /nfs/dbraw/zinc/03/79/63/508037963.db2.gz UACJYQOQOGUXQF-QWHCGFSZSA-N 1 1 373.413 2.683 20 5 FFBDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000111269097 508084524 /nfs/dbraw/zinc/08/45/24/508084524.db2.gz OODQFMMFFSAGCZ-OAHLLOKOSA-N 1 1 350.418 2.904 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000111631062 508111740 /nfs/dbraw/zinc/11/17/40/508111740.db2.gz GETSJTWTWNZUPK-ZDUSSCGKSA-N 1 1 359.430 2.521 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nnc4ccccn43)C2)c1 ZINC000076397243 508200869 /nfs/dbraw/zinc/20/08/69/508200869.db2.gz HECLFSSGDQOQGF-OAHLLOKOSA-N 1 1 367.409 2.896 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000076494869 508213976 /nfs/dbraw/zinc/21/39/76/508213976.db2.gz DNFYYRYKUKYJPW-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000076494869 508213978 /nfs/dbraw/zinc/21/39/78/508213978.db2.gz DNFYYRYKUKYJPW-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000113268059 508255827 /nfs/dbraw/zinc/25/58/27/508255827.db2.gz MHGPJHSWEVKVNP-DGCLKSJQSA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1cccn2cc(Cn3nc(-c4cccc([N+](=O)[O-])c4)ccc3=O)[nH+]c12 ZINC000076940356 508265093 /nfs/dbraw/zinc/26/50/93/508265093.db2.gz JYUXAUDJFNKCLJ-UHFFFAOYSA-N 1 1 361.361 2.823 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000113900180 508285044 /nfs/dbraw/zinc/28/50/44/508285044.db2.gz LWVUMMULJBMCBS-CABCVRRESA-N 1 1 360.458 2.904 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C(C)C)C1CCOCC1 ZINC000077323375 508300660 /nfs/dbraw/zinc/30/06/60/508300660.db2.gz HYYYYHALHCAMDZ-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000085636253 508315208 /nfs/dbraw/zinc/31/52/08/508315208.db2.gz SSSVJKQBDNZCIS-INIZCTEOSA-N 1 1 364.446 2.690 20 5 FFBDMO COc1cccc(NC(=O)CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088605516 508378463 /nfs/dbraw/zinc/37/84/63/508378463.db2.gz OCDDILXMUMJQOR-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)NC(=O)Nc1ccccc1 ZINC000088605331 508378469 /nfs/dbraw/zinc/37/84/69/508378469.db2.gz AZJCQIWFNMWASO-UHFFFAOYSA-N 1 1 368.393 2.691 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)NC(=O)Nc1ccccc1 ZINC000088605331 508378471 /nfs/dbraw/zinc/37/84/71/508378471.db2.gz AZJCQIWFNMWASO-UHFFFAOYSA-N 1 1 368.393 2.691 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC[C@@H]21 ZINC000133672104 508432484 /nfs/dbraw/zinc/43/24/84/508432484.db2.gz SPABZKQFWDOCBF-YJBOKZPZSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000133780131 508448387 /nfs/dbraw/zinc/44/83/87/508448387.db2.gz MZMQTUPOBVSRRH-JOYOIKCWSA-N 1 1 357.332 2.969 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000121955872 508456203 /nfs/dbraw/zinc/45/62/03/508456203.db2.gz BHJSKERNBYPUIC-UHFFFAOYSA-N 1 1 367.409 2.905 20 5 FFBDMO CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1 ZINC000122033103 508470898 /nfs/dbraw/zinc/47/08/98/508470898.db2.gz WBRXQXSOVHMICF-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997674 508694375 /nfs/dbraw/zinc/69/43/75/508694375.db2.gz VUSWKWLMXUESLT-IAGOWNOFSA-N 1 1 361.442 2.837 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997674 508694382 /nfs/dbraw/zinc/69/43/82/508694382.db2.gz VUSWKWLMXUESLT-IAGOWNOFSA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C[N@H+]1C1CC1 ZINC000154241839 508744307 /nfs/dbraw/zinc/74/43/07/508744307.db2.gz IUVIJSUCHKKNRE-UKRRQHHQSA-N 1 1 358.442 2.894 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000369458942 512419220 /nfs/dbraw/zinc/41/92/20/512419220.db2.gz SNGWOXXRYFTORW-KBPBESRZSA-N 1 1 367.833 2.760 20 5 FFBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccnc(N3CCN(C)CC3)c2)cc1[N+](=O)[O-] ZINC000159155861 508801079 /nfs/dbraw/zinc/80/10/79/508801079.db2.gz BOCDKXHRQQWHBD-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000159270216 508816740 /nfs/dbraw/zinc/81/67/40/508816740.db2.gz BGZNFYROGILDKC-ZBFHGGJFSA-N 1 1 359.426 2.579 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000131119337 508889661 /nfs/dbraw/zinc/88/96/61/508889661.db2.gz HELHEFSUOJMVHF-UHFFFAOYSA-N 1 1 363.458 2.805 20 5 FFBDMO CC[N@H+](CCO)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000119926224 508891496 /nfs/dbraw/zinc/89/14/96/508891496.db2.gz COQQGBSZXWKEMK-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CCO)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000119926224 508891499 /nfs/dbraw/zinc/89/14/99/508891499.db2.gz COQQGBSZXWKEMK-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150863989 508910912 /nfs/dbraw/zinc/91/09/12/508910912.db2.gz GYUUATNOJBHSBR-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150863989 508910915 /nfs/dbraw/zinc/91/09/15/508910915.db2.gz GYUUATNOJBHSBR-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)sc2C1 ZINC000159973410 508919303 /nfs/dbraw/zinc/91/93/03/508919303.db2.gz AWDXYBZDVZJXOL-UHFFFAOYSA-N 1 1 360.439 2.919 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)Cc3cccc([N+](=O)[O-])c3C)sc2C1 ZINC000159973410 508919308 /nfs/dbraw/zinc/91/93/08/508919308.db2.gz AWDXYBZDVZJXOL-UHFFFAOYSA-N 1 1 360.439 2.919 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155120468 508928466 /nfs/dbraw/zinc/92/84/66/508928466.db2.gz BDTHXDIYRLQRGG-IRXDYDNUSA-N 1 1 372.469 2.751 20 5 FFBDMO Cn1cc(C[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000155124610 508928906 /nfs/dbraw/zinc/92/89/06/508928906.db2.gz QISJQDBXVMWSEE-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000155124610 508928908 /nfs/dbraw/zinc/92/89/08/508928908.db2.gz QISJQDBXVMWSEE-UHFFFAOYSA-N 1 1 358.320 2.858 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000120110402 508930563 /nfs/dbraw/zinc/93/05/63/508930563.db2.gz FQVYEZATUAFGMT-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000120160997 508940819 /nfs/dbraw/zinc/94/08/19/508940819.db2.gz RXCDGLMIJILKEE-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)c1ccco1 ZINC000120417030 508991312 /nfs/dbraw/zinc/99/13/12/508991312.db2.gz ODHDEHNUZUBDCL-OAHLLOKOSA-N 1 1 354.366 2.769 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000132277844 509010046 /nfs/dbraw/zinc/01/00/46/509010046.db2.gz ZGTATODWVDRDGR-CQSZACIVSA-N 1 1 367.471 2.547 20 5 FFBDMO CCN1C(=O)N=NC1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000367298614 512431462 /nfs/dbraw/zinc/43/14/62/512431462.db2.gz CQVMLYHZQWJLSD-UHFFFAOYSA-N 1 1 365.821 2.945 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c([N+](=O)[O-])c1 ZINC000120623166 509033138 /nfs/dbraw/zinc/03/31/38/509033138.db2.gz OSALJVJWSFQNGT-UHFFFAOYSA-N 1 1 355.394 2.812 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)c([N+](=O)[O-])c1 ZINC000120623166 509033143 /nfs/dbraw/zinc/03/31/43/509033143.db2.gz OSALJVJWSFQNGT-UHFFFAOYSA-N 1 1 355.394 2.812 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000132564088 509045537 /nfs/dbraw/zinc/04/55/37/509045537.db2.gz UTSSFONKQHVLMI-ZDUSSCGKSA-N 1 1 369.425 2.672 20 5 FFBDMO CCc1cccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369490138 512434464 /nfs/dbraw/zinc/43/44/64/512434464.db2.gz NJQAOAXXSPFFII-UHFFFAOYSA-N 1 1 357.414 2.629 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[nH+]1 ZINC000126316999 509078954 /nfs/dbraw/zinc/07/89/54/509078954.db2.gz AEWNJEKCZYSOLN-UHFFFAOYSA-N 1 1 369.425 2.740 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000151787632 509082597 /nfs/dbraw/zinc/08/25/97/509082597.db2.gz BYMUIIKQIIOLGS-OXJNMPFZSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000151787632 509082602 /nfs/dbraw/zinc/08/26/02/509082602.db2.gz BYMUIIKQIIOLGS-OXJNMPFZSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000156052461 509117875 /nfs/dbraw/zinc/11/78/75/509117875.db2.gz PVDSUISBSBSFKA-UHFFFAOYSA-N 1 1 353.382 2.858 20 5 FFBDMO C[N@@H+](Cc1nc2ccccc2o1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000156242351 509149423 /nfs/dbraw/zinc/14/94/23/509149423.db2.gz RTTSRYSAHXHYKP-CQSZACIVSA-N 1 1 357.366 2.608 20 5 FFBDMO C[N@H+](Cc1nc2ccccc2o1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000156242351 509149426 /nfs/dbraw/zinc/14/94/26/509149426.db2.gz RTTSRYSAHXHYKP-CQSZACIVSA-N 1 1 357.366 2.608 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000133429165 509159321 /nfs/dbraw/zinc/15/93/21/509159321.db2.gz VXYKVFAEJZBTIO-UHFFFAOYSA-N 1 1 360.439 2.886 20 5 FFBDMO C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000172761876 509218538 /nfs/dbraw/zinc/21/85/38/509218538.db2.gz IUHFWEIRDDDGSW-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[N@H+](Cc1cc(F)c(F)c(F)c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182475216 509256805 /nfs/dbraw/zinc/25/68/05/509256805.db2.gz JIVKBVQIFXRSHM-GFCCVEGCSA-N 1 1 370.327 2.884 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000248447718 509326390 /nfs/dbraw/zinc/32/63/90/509326390.db2.gz HKDMMOJWTYNQEY-HZPDHXFCSA-N 1 1 352.431 2.616 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182641930 509346885 /nfs/dbraw/zinc/34/68/85/509346885.db2.gz OTXONTMVUPLZOP-LBPRGKRZSA-N 1 1 357.863 2.941 20 5 FFBDMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000192211004 509404562 /nfs/dbraw/zinc/40/45/62/509404562.db2.gz PUYDJSMYRJAXEF-LJQANCHMSA-N 1 1 369.421 2.616 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000267286720 509429987 /nfs/dbraw/zinc/42/99/87/509429987.db2.gz WNYUUNAVFLUBGL-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000186075036 509512132 /nfs/dbraw/zinc/51/21/32/509512132.db2.gz GDURXNYYXWUVHB-KBPBESRZSA-N 1 1 367.471 2.526 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000267506143 509521182 /nfs/dbraw/zinc/52/11/82/509521182.db2.gz WWYJOIMHOMMXBD-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183029221 509556154 /nfs/dbraw/zinc/55/61/54/509556154.db2.gz CLVYCIKZBKRTBV-UONOGXRCSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@H](NCc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173428986 509593241 /nfs/dbraw/zinc/59/32/41/509593241.db2.gz DJTMYFMVEFSTHI-HNNXBMFYSA-N 1 1 370.453 2.737 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000249096879 509602910 /nfs/dbraw/zinc/60/29/10/509602910.db2.gz UDDICBNIMIRRQW-VXGBXAGGSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000249096879 509602919 /nfs/dbraw/zinc/60/29/19/509602919.db2.gz UDDICBNIMIRRQW-VXGBXAGGSA-N 1 1 353.444 2.615 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000173598919 509668434 /nfs/dbraw/zinc/66/84/34/509668434.db2.gz QELPZMXCFXLOMK-AWEZNQCLSA-N 1 1 356.426 2.939 20 5 FFBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000179938445 509681276 /nfs/dbraw/zinc/68/12/76/509681276.db2.gz FLGOMTJAYBLUDL-GFCCVEGCSA-N 1 1 373.384 2.982 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000249822341 509768040 /nfs/dbraw/zinc/76/80/40/509768040.db2.gz OILDRRMLQTWFIJ-ADAWSYLGSA-N 1 1 363.458 2.906 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180142720 509774714 /nfs/dbraw/zinc/77/47/14/509774714.db2.gz OHISILKNUUWCOI-HKUYNNGSSA-N 1 1 355.394 2.535 20 5 FFBDMO COc1cc(C[N@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180146498 509776494 /nfs/dbraw/zinc/77/64/94/509776494.db2.gz UGGGOURISXUHKD-UHFFFAOYSA-N 1 1 370.356 2.576 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180146498 509776504 /nfs/dbraw/zinc/77/65/04/509776504.db2.gz UGGGOURISXUHKD-UHFFFAOYSA-N 1 1 370.356 2.576 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000264962732 509799407 /nfs/dbraw/zinc/79/94/07/509799407.db2.gz XJPRPBXGZLEUSB-UHFFFAOYSA-N 1 1 357.414 2.840 20 5 FFBDMO CC(C)(O)C[N@H+](Cc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000180222903 509820845 /nfs/dbraw/zinc/82/08/45/509820845.db2.gz VFVFQJFBWNZQPN-GOSISDBHSA-N 1 1 374.437 2.608 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000193217229 509822268 /nfs/dbraw/zinc/82/22/68/509822268.db2.gz XKHHLCOQCDFLNC-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000193217229 509822277 /nfs/dbraw/zinc/82/22/77/509822277.db2.gz XKHHLCOQCDFLNC-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-] ZINC000173998153 509896733 /nfs/dbraw/zinc/89/67/33/509896733.db2.gz CPWNXAOOTAPDSN-KGLIPLIRSA-N 1 1 362.430 2.618 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[C@@H](N2CCOCC2)C1 ZINC000177226344 509948098 /nfs/dbraw/zinc/94/80/98/509948098.db2.gz DLIYXHHXNCPSQT-QAPCUYQASA-N 1 1 363.458 2.535 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000193585043 509978421 /nfs/dbraw/zinc/97/84/21/509978421.db2.gz RUJQZKYSENXXBL-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000180595028 510004520 /nfs/dbraw/zinc/00/45/20/510004520.db2.gz CNPIHDYAZXXZDE-HNNXBMFYSA-N 1 1 358.398 2.727 20 5 FFBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000190214125 510009023 /nfs/dbraw/zinc/00/90/23/510009023.db2.gz DNTRSECHQREIJK-LJQANCHMSA-N 1 1 358.442 2.980 20 5 FFBDMO CN(Cc1ccco1)C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174248774 510023293 /nfs/dbraw/zinc/02/32/93/510023293.db2.gz CXEGDWKOCLYQSG-UHFFFAOYSA-N 1 1 373.409 2.690 20 5 FFBDMO C[C@@H](C[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000183926797 510042808 /nfs/dbraw/zinc/04/28/08/510042808.db2.gz PYJGLKXKTLCEJO-LBPRGKRZSA-N 1 1 360.439 2.676 20 5 FFBDMO C[C@@H](C[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000183926797 510042814 /nfs/dbraw/zinc/04/28/14/510042814.db2.gz PYJGLKXKTLCEJO-LBPRGKRZSA-N 1 1 360.439 2.676 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000177427352 510052150 /nfs/dbraw/zinc/05/21/50/510052150.db2.gz ZSECVFFEADPNMJ-GOSISDBHSA-N 1 1 359.382 2.677 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000180758063 510093036 /nfs/dbraw/zinc/09/30/36/510093036.db2.gz NCXFCRFJGYWSPB-CYBMUJFWSA-N 1 1 370.409 2.823 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190482088 510156498 /nfs/dbraw/zinc/15/64/98/510156498.db2.gz UDDICBNIMIRRQW-NEPJUHHUSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190482088 510156504 /nfs/dbraw/zinc/15/65/04/510156504.db2.gz UDDICBNIMIRRQW-NEPJUHHUSA-N 1 1 353.444 2.615 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000174526497 510160523 /nfs/dbraw/zinc/16/05/23/510160523.db2.gz UGWFWZBXFSVNEV-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000262096070 510176121 /nfs/dbraw/zinc/17/61/21/510176121.db2.gz YXLKVZMUORRYCU-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000265861273 510269434 /nfs/dbraw/zinc/26/94/34/510269434.db2.gz KDWQNEQCXDJYTA-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc(C)cs1 ZINC000184356774 510283719 /nfs/dbraw/zinc/28/37/19/510283719.db2.gz BHTDZVCUELNFBY-CQSZACIVSA-N 1 1 360.439 2.990 20 5 FFBDMO O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[NH2+]Cc2ccccc21 ZINC000269194944 510284873 /nfs/dbraw/zinc/28/48/73/510284873.db2.gz ZZTBVIMGYVXHJG-UHFFFAOYSA-N 1 1 352.394 2.919 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000184482892 510349460 /nfs/dbraw/zinc/34/94/60/510349460.db2.gz OSOKDXXMJDZMHY-OAHLLOKOSA-N 1 1 364.446 2.690 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2c(C)cccc2[N+](=O)[O-])cn1 ZINC000194470646 510382389 /nfs/dbraw/zinc/38/23/89/510382389.db2.gz FVKATGZRGZOBCM-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO CC(C)[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000194635605 510457671 /nfs/dbraw/zinc/45/76/71/510457671.db2.gz IGWGVXRPYUPZED-RKVPGOIHSA-N 1 1 363.458 2.687 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C1 ZINC000175164479 510512959 /nfs/dbraw/zinc/51/29/59/510512959.db2.gz PYBDFRVHWILZBW-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000191337236 510611160 /nfs/dbraw/zinc/61/11/60/510611160.db2.gz DLEYWDZUBHWPCA-AWEZNQCLSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000246692299 510620070 /nfs/dbraw/zinc/62/00/70/510620070.db2.gz JPBTZHVVUBAOGU-HOTGVXAUSA-N 1 1 363.461 2.915 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000246692299 510620074 /nfs/dbraw/zinc/62/00/74/510620074.db2.gz JPBTZHVVUBAOGU-HOTGVXAUSA-N 1 1 363.461 2.915 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000246711587 510628480 /nfs/dbraw/zinc/62/84/80/510628480.db2.gz SWIHHEMBYOMPGL-INIZCTEOSA-N 1 1 370.409 2.660 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000246711587 510628487 /nfs/dbraw/zinc/62/84/87/510628487.db2.gz SWIHHEMBYOMPGL-INIZCTEOSA-N 1 1 370.409 2.660 20 5 FFBDMO O=c1cc(C[N@@H+]2CCC[C@H](OCCO)C2)c2c(ccc3ccccc32)o1 ZINC000172302440 510657487 /nfs/dbraw/zinc/65/74/87/510657487.db2.gz RFTJKGWVKPVCTG-KRWDZBQOSA-N 1 1 353.418 2.920 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000246764804 510660025 /nfs/dbraw/zinc/66/00/25/510660025.db2.gz HWCALUSISDRHGN-SWLSCSKDSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)nc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181953455 510676446 /nfs/dbraw/zinc/67/64/46/510676446.db2.gz ZCZPTRFUAJUHME-CYBMUJFWSA-N 1 1 351.790 2.515 20 5 FFBDMO Cc1c(CN(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695040 /nfs/dbraw/zinc/69/50/40/510695040.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1c(C[N@@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695046 /nfs/dbraw/zinc/69/50/46/510695046.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1c(C[N@H+](C)C[C@]2(O)CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000188294247 510695054 /nfs/dbraw/zinc/69/50/54/510695054.db2.gz FBRXSKNKJVNYTK-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000182028885 510718725 /nfs/dbraw/zinc/71/87/25/510718725.db2.gz WAMOLBFHFJLFSY-DOTOQJQBSA-N 1 1 357.410 2.875 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1ccnc1 ZINC000246907341 510739281 /nfs/dbraw/zinc/73/92/81/510739281.db2.gz BLEBKEBRXYASDH-XJKSGUPXSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1ccnc1 ZINC000246907341 510739286 /nfs/dbraw/zinc/73/92/86/510739286.db2.gz BLEBKEBRXYASDH-XJKSGUPXSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000182176766 510797103 /nfs/dbraw/zinc/79/71/03/510797103.db2.gz DERNYAARKJEQHM-NSHDSACASA-N 1 1 370.377 2.998 20 5 FFBDMO CCSCC[C@@H](C)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182194329 510806650 /nfs/dbraw/zinc/80/66/50/510806650.db2.gz SOYIKOOBTMVAKO-CYBMUJFWSA-N 1 1 360.501 2.832 20 5 FFBDMO CCSCC[C@@H](C)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182194329 510806659 /nfs/dbraw/zinc/80/66/59/510806659.db2.gz SOYIKOOBTMVAKO-CYBMUJFWSA-N 1 1 360.501 2.832 20 5 FFBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000247504405 510863577 /nfs/dbraw/zinc/86/35/77/510863577.db2.gz XVFITMASNUQPND-IINYFYTJSA-N 1 1 370.247 2.816 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](N2CCCC2)C[C@H]1C ZINC000285415680 510897674 /nfs/dbraw/zinc/89/76/74/510897674.db2.gz DIMAHPCRGTWKSC-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](N2CCCC2)C[C@H]1C ZINC000285415680 510897681 /nfs/dbraw/zinc/89/76/81/510897681.db2.gz DIMAHPCRGTWKSC-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO COc1cccc(C=C2CC[NH+](CCn3cc([N+](=O)[O-])ccc3=O)CC2)c1 ZINC000270595623 510917466 /nfs/dbraw/zinc/91/74/66/510917466.db2.gz UWIXUPWTGYXVLE-UHFFFAOYSA-N 1 1 369.421 2.945 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000364579555 510951831 /nfs/dbraw/zinc/95/18/31/510951831.db2.gz LSHAJJXEIMIBGH-CQSZACIVSA-N 1 1 367.833 2.714 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000285682652 511008066 /nfs/dbraw/zinc/00/80/66/511008066.db2.gz GKOLIQOXZUBDFF-LJQANCHMSA-N 1 1 355.394 2.926 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000271099426 511082580 /nfs/dbraw/zinc/08/25/80/511082580.db2.gz JUKKCDBHZUDHLE-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO O=C1CC2(CN1)CC[NH+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CC2 ZINC000271202066 511118394 /nfs/dbraw/zinc/11/83/94/511118394.db2.gz UTERNISNHOXVNA-UHFFFAOYSA-N 1 1 372.450 2.820 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000282824616 511125254 /nfs/dbraw/zinc/12/52/54/511125254.db2.gz RUTITDUKKFFYIS-CQSZACIVSA-N 1 1 373.409 2.525 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000282898521 511153937 /nfs/dbraw/zinc/15/39/37/511153937.db2.gz WPZKEHYPGCIFFC-CQSZACIVSA-N 1 1 367.471 2.546 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)ccc1Cl ZINC000364963632 511179819 /nfs/dbraw/zinc/17/98/19/511179819.db2.gz QLKVSNTZLLKIFZ-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Br)CC[N@@H+](C2CC2)C1 ZINC000294856973 511200291 /nfs/dbraw/zinc/20/02/91/511200291.db2.gz CSIHHYDGWQOCQL-JTQLQIEISA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2Br)CC[N@H+](C2CC2)C1 ZINC000294856973 511200295 /nfs/dbraw/zinc/20/02/95/511200295.db2.gz CSIHHYDGWQOCQL-JTQLQIEISA-N 1 1 355.236 2.673 20 5 FFBDMO CCOC1(C)CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000298188744 511204175 /nfs/dbraw/zinc/20/41/75/511204175.db2.gz AYJCSOCJTLIPID-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3C[N@H+]4CCC[C@@H]4CO3)cs2)c1 ZINC000362719299 511224713 /nfs/dbraw/zinc/22/47/13/511224713.db2.gz IGTGPQPUVQPKDS-SJORKVTESA-N 1 1 374.466 2.671 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000362776421 511236162 /nfs/dbraw/zinc/23/61/62/511236162.db2.gz UZUNJGCMPSLDGW-ZBFHGGJFSA-N 1 1 361.442 2.979 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](C)(O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000279854679 511241263 /nfs/dbraw/zinc/24/12/63/511241263.db2.gz BFNJCFZBFBYOQQ-INIZCTEOSA-N 1 1 360.357 2.942 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291678539 511294687 /nfs/dbraw/zinc/29/46/87/511294687.db2.gz CCGRDFZDNIAUAR-BBRMVZONSA-N 1 1 354.410 2.570 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]([C@H](C)CO)C1CCCC1 ZINC000298491752 511303323 /nfs/dbraw/zinc/30/33/23/511303323.db2.gz JOMYVAWYSTUZOM-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271772689 511318405 /nfs/dbraw/zinc/31/84/05/511318405.db2.gz QUZHHFSATUCDFA-AWEZNQCLSA-N 1 1 357.410 2.913 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271783239 511322517 /nfs/dbraw/zinc/32/25/17/511322517.db2.gz SOIPAEDCIKAOFF-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO CC(C)(CCC(=O)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1)[N+](=O)[O-] ZINC000295305929 511357468 /nfs/dbraw/zinc/35/74/68/511357468.db2.gz ONLVNRJWGXOUBH-FQEVSTJZSA-N 1 1 359.470 2.947 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000298667494 511368721 /nfs/dbraw/zinc/36/87/21/511368721.db2.gz YHBKQLQPQKGCEC-WBVHZDCISA-N 1 1 363.414 2.575 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000292023462 511434953 /nfs/dbraw/zinc/43/49/53/511434953.db2.gz YMYUEPUXBILDAS-HXUWFJFHSA-N 1 1 372.421 2.618 20 5 FFBDMO COCc1cccc(CNC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000292102107 511465454 /nfs/dbraw/zinc/46/54/54/511465454.db2.gz IASURKQRKXBIRW-UHFFFAOYSA-N 1 1 371.437 2.882 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC[N@H+](C2CC2)C1 ZINC000295756999 511506439 /nfs/dbraw/zinc/50/64/39/511506439.db2.gz VMGXATLJYHZHAR-HNNXBMFYSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+](C2CCC2)C1 ZINC000292235936 511516917 /nfs/dbraw/zinc/51/69/17/511516917.db2.gz CSLLFSXZPMMONB-CQSZACIVSA-N 1 1 370.453 2.951 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)C2)C1 ZINC000292331829 511556489 /nfs/dbraw/zinc/55/64/89/511556489.db2.gz UGKIFSNCZPRHTA-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO Cc1cccc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000280672598 511557394 /nfs/dbraw/zinc/55/73/94/511557394.db2.gz UIHYPRIOVIOENP-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C1CC1 ZINC000280897053 511645330 /nfs/dbraw/zinc/64/53/30/511645330.db2.gz HEVLXOCTBCYIIQ-UHFFFAOYSA-N 1 1 354.410 2.871 20 5 FFBDMO O=c1[nH]c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000281027217 511694303 /nfs/dbraw/zinc/69/43/03/511694303.db2.gz SZUDZEJXQMXVCT-CQSZACIVSA-N 1 1 365.393 2.930 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(c2nnc[nH]2)CC1 ZINC000365926014 511731975 /nfs/dbraw/zinc/73/19/75/511731975.db2.gz ZPVRKVVREDJLML-NSHDSACASA-N 1 1 369.385 2.704 20 5 FFBDMO COc1cc(Cc2noc([C@H]3CCn4cc[nH+]c4C3)n2)ccc1[N+](=O)[O-] ZINC000350182214 511738189 /nfs/dbraw/zinc/73/81/89/511738189.db2.gz KNRLZDZVTMMBAR-LBPRGKRZSA-N 1 1 355.354 2.504 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000303653304 511746845 /nfs/dbraw/zinc/74/68/45/511746845.db2.gz XLCQQALHLURLON-GASCZTMLSA-N 1 1 362.474 2.759 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@H]2C1 ZINC000284550284 511768585 /nfs/dbraw/zinc/76/85/85/511768585.db2.gz HHLDLYHSLCXYIK-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313072432 511786843 /nfs/dbraw/zinc/78/68/43/511786843.db2.gz VPYPMRJWGUBJNJ-HOCLYGCPSA-N 1 1 368.437 2.817 20 5 FFBDMO CNc1c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000323745837 511831481 /nfs/dbraw/zinc/83/14/81/511831481.db2.gz RCNGCDVWJXNYCP-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@H]2C1 ZINC000284734932 511844180 /nfs/dbraw/zinc/84/41/80/511844180.db2.gz WBRPACSDOKFBNM-IRXDYDNUSA-N 1 1 374.466 2.623 20 5 FFBDMO C[C@H]1CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CC2)C1 ZINC000296699629 511859823 /nfs/dbraw/zinc/85/98/23/511859823.db2.gz KTXZQYQRQITJRK-LBPRGKRZSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc1SC ZINC000274525138 511863502 /nfs/dbraw/zinc/86/35/02/511863502.db2.gz SSYLZSYKZVWBPL-GFCCVEGCSA-N 1 1 367.471 2.928 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293184527 511873157 /nfs/dbraw/zinc/87/31/57/511873157.db2.gz PVSMCQGOIMXBLZ-SUMWQHHRSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293184527 511873159 /nfs/dbraw/zinc/87/31/59/511873159.db2.gz PVSMCQGOIMXBLZ-SUMWQHHRSA-N 1 1 365.430 2.677 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+](C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000296801147 511903547 /nfs/dbraw/zinc/90/35/47/511903547.db2.gz UECRVMFMPWIILU-ZFWWWQNUSA-N 1 1 360.458 2.646 20 5 FFBDMO CC(C)N1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])c4cccnc43)C2)CC1 ZINC000364070866 511942563 /nfs/dbraw/zinc/94/25/63/511942563.db2.gz KIACMAMDNMZNIX-INIZCTEOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](O)Cc1ccccc1 ZINC000293441372 511967384 /nfs/dbraw/zinc/96/73/84/511967384.db2.gz VBWHWRCJNSUGHK-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](O)Cc1ccccc1 ZINC000293441372 511967388 /nfs/dbraw/zinc/96/73/88/511967388.db2.gz VBWHWRCJNSUGHK-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000281880842 511999068 /nfs/dbraw/zinc/99/90/68/511999068.db2.gz GFDHKYZXBQTVLU-CHWSQXEVSA-N 1 1 350.419 2.940 20 5 FFBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3ncc([N+](=O)[O-])c(C)n3)CC2)c1 ZINC000297156105 512040086 /nfs/dbraw/zinc/04/00/86/512040086.db2.gz ONQNZDWZYNTOBY-CQSZACIVSA-N 1 1 357.414 2.585 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COCc1cccs1 ZINC000285328495 512078405 /nfs/dbraw/zinc/07/84/05/512078405.db2.gz NQKJJXFEFJVARE-HNNXBMFYSA-N 1 1 350.440 2.708 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000377937674 512520780 /nfs/dbraw/zinc/52/07/80/512520780.db2.gz GXCUYNVTOCEMNT-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)CCCc1cc(-c2cccc(F)c2)n[nH]1 ZINC000377937674 512520782 /nfs/dbraw/zinc/52/07/82/512520782.db2.gz GXCUYNVTOCEMNT-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO Cn1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(-c2cccnc2)n1 ZINC000373913219 512568482 /nfs/dbraw/zinc/56/84/82/512568482.db2.gz SNXSUASVHCPQRY-UHFFFAOYSA-N 1 1 363.381 2.556 20 5 FFBDMO COc1cc(CNc2ccc(-n3cc[nH+]c3C)nc2)c([N+](=O)[O-])cc1O ZINC000367605805 512581248 /nfs/dbraw/zinc/58/12/48/512581248.db2.gz CSDCPHPBTRNGCP-UHFFFAOYSA-N 1 1 355.354 2.810 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411536789 512678874 /nfs/dbraw/zinc/67/88/74/512678874.db2.gz HYPUDZBURBXUFW-ZDUSSCGKSA-N 1 1 360.414 2.953 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccccn2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000372217959 512766986 /nfs/dbraw/zinc/76/69/86/512766986.db2.gz MYSFZPZJPYGTDL-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000378540254 512814415 /nfs/dbraw/zinc/81/44/15/512814415.db2.gz KBRCJKDKXUCWIR-MRXNPFEDSA-N 1 1 368.437 2.819 20 5 FFBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137233 512818078 /nfs/dbraw/zinc/81/80/78/512818078.db2.gz YKUHLSSWYYGSMP-LLVKDONJSA-N 1 1 352.341 2.919 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000372330093 512818586 /nfs/dbraw/zinc/81/85/86/512818586.db2.gz DRZXIVZSRBBWNB-YJBOKZPZSA-N 1 1 358.442 2.896 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000376483654 512838009 /nfs/dbraw/zinc/83/80/09/512838009.db2.gz FZAGFKXJGLDFIV-ZDUSSCGKSA-N 1 1 358.398 2.807 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000411920923 512875477 /nfs/dbraw/zinc/87/54/77/512875477.db2.gz CUAIMRAAEPBEFY-MAUKXSAKSA-N 1 1 355.394 2.731 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)c1 ZINC000374531874 512877351 /nfs/dbraw/zinc/87/73/51/512877351.db2.gz SXXDQKHSZOELGS-UXHICEINSA-N 1 1 356.422 2.654 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)o2)cc1 ZINC000411956653 512888923 /nfs/dbraw/zinc/88/89/23/512888923.db2.gz WJUBYKVTVCYENV-DLBZAZTESA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)o2)cc1 ZINC000411956653 512888925 /nfs/dbraw/zinc/88/89/25/512888925.db2.gz WJUBYKVTVCYENV-DLBZAZTESA-N 1 1 366.377 2.953 20 5 FFBDMO COC(=O)c1cn([C@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nn1 ZINC000368356453 512912107 /nfs/dbraw/zinc/91/21/07/512912107.db2.gz AOFWSSUYXXFJPK-HIFRSBDPSA-N 1 1 373.413 2.679 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000370493707 512963059 /nfs/dbraw/zinc/96/30/59/512963059.db2.gz XBCRGYQNCIXDBS-HNNXBMFYSA-N 1 1 355.394 2.910 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000370493707 512963064 /nfs/dbraw/zinc/96/30/64/512963064.db2.gz XBCRGYQNCIXDBS-HNNXBMFYSA-N 1 1 355.394 2.910 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000374787872 513003276 /nfs/dbraw/zinc/00/32/76/513003276.db2.gz KJWOVQCLIBMXEN-OAHLLOKOSA-N 1 1 357.414 2.964 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000374793958 513006813 /nfs/dbraw/zinc/00/68/13/513006813.db2.gz NBXYEAZDOHZIAD-AWEZNQCLSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374881058 513052731 /nfs/dbraw/zinc/05/27/31/513052731.db2.gz VYDIYBQKKOSPFG-HOCLYGCPSA-N 1 1 354.410 2.630 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000428992581 513242456 /nfs/dbraw/zinc/24/24/56/513242456.db2.gz BHAUZZYUBWEZOP-CKEIUWERSA-N 1 1 371.441 2.807 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1ccc2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000429273536 513323377 /nfs/dbraw/zinc/32/33/77/513323377.db2.gz MUFYYYKGEUNDLH-UHFFFAOYSA-N 1 1 371.393 2.829 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000418121605 513380597 /nfs/dbraw/zinc/38/05/97/513380597.db2.gz XGPFNDQHPGTYPX-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)CN1CCO ZINC000418121605 513380606 /nfs/dbraw/zinc/38/06/06/513380606.db2.gz XGPFNDQHPGTYPX-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)CN1CCO ZINC000418121605 513380611 /nfs/dbraw/zinc/38/06/11/513380611.db2.gz XGPFNDQHPGTYPX-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C ZINC000421711381 513381679 /nfs/dbraw/zinc/38/16/79/513381679.db2.gz ONQPRGNPWHPNSF-NSHDSACASA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c1[N+](=O)[O-] ZINC000440744586 513396221 /nfs/dbraw/zinc/39/62/21/513396221.db2.gz GKIZTCGDZBOEBH-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)CN1CCOCC1 ZINC000434701854 513398082 /nfs/dbraw/zinc/39/80/82/513398082.db2.gz IEXUVLLYCJVEMC-HNNXBMFYSA-N 1 1 351.447 2.535 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)CN1CCOCC1 ZINC000434701854 513398087 /nfs/dbraw/zinc/39/80/87/513398087.db2.gz IEXUVLLYCJVEMC-HNNXBMFYSA-N 1 1 351.447 2.535 20 5 FFBDMO CC[NH+]1CCN(CC(C)(C)Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000450921492 513406354 /nfs/dbraw/zinc/40/63/54/513406354.db2.gz IFXJZLZOQHSHFV-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO COc1cc(C[NH2+]Cc2cccc(N3CCC3=O)c2)c([N+](=O)[O-])cc1OC ZINC000441209788 513513305 /nfs/dbraw/zinc/51/33/05/513513305.db2.gz ZPMAFNXSTLEFIY-UHFFFAOYSA-N 1 1 371.393 2.639 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1c(Cl)cc([N+](=O)[O-])cc1C(=O)OC ZINC000447802622 513573199 /nfs/dbraw/zinc/57/31/99/513573199.db2.gz MAGZXCOHBPTTTA-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO CN1C(=O)NCC12CC[NH+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC2 ZINC000425541884 513629463 /nfs/dbraw/zinc/62/94/63/513629463.db2.gz NPQSFIJLILZIQD-UHFFFAOYSA-N 1 1 372.347 2.603 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)[C@@H](C)C[N@H+]1CCO ZINC000418993580 513710276 /nfs/dbraw/zinc/71/02/76/513710276.db2.gz HCHVNPXWVHKTED-KGLIPLIRSA-N 1 1 374.416 2.687 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000430662861 513715431 /nfs/dbraw/zinc/71/54/31/513715431.db2.gz KSFDTVUAOZOSFK-GDBMZVCRSA-N 1 1 356.426 2.716 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)o2)cc1 ZINC000451413370 513734213 /nfs/dbraw/zinc/73/42/13/513734213.db2.gz GYWMJTHVVZRYPU-XHSDSOJGSA-N 1 1 358.398 2.770 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000451429465 513745907 /nfs/dbraw/zinc/74/59/07/513745907.db2.gz XJFUIENKAIMNBX-ZMSDIMECSA-N 1 1 350.415 2.608 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000416406204 513754716 /nfs/dbraw/zinc/75/47/16/513754716.db2.gz FCGKTBUNWDOOMI-LSDHHAIUSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000419340195 513782800 /nfs/dbraw/zinc/78/28/00/513782800.db2.gz NAYPZTJSWGAJKH-NWDGAFQWSA-N 1 1 361.364 2.501 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000426068455 513839782 /nfs/dbraw/zinc/83/97/82/513839782.db2.gz YHYBJVIRRUYHLJ-GXFFZTMASA-N 1 1 374.363 2.896 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448723773 513866905 /nfs/dbraw/zinc/86/69/05/513866905.db2.gz IVAJDXYFKRMOSJ-VXGBXAGGSA-N 1 1 357.332 2.970 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444035228 514105909 /nfs/dbraw/zinc/10/59/09/514105909.db2.gz JBSDIZJFLNUTFU-GFCCVEGCSA-N 1 1 371.387 2.784 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000452005157 514129870 /nfs/dbraw/zinc/12/98/70/514129870.db2.gz LQKWGCLBVUYQAA-IAGOWNOFSA-N 1 1 370.405 2.862 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437345549 514145429 /nfs/dbraw/zinc/14/54/29/514145429.db2.gz LEJYLWNQWNBMQR-XPTSAGLGSA-N 1 1 357.332 2.826 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cc1[N+](=O)[O-] ZINC000437355938 514147157 /nfs/dbraw/zinc/14/71/57/514147157.db2.gz PGKQAJTUJQCKAA-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cc1[N+](=O)[O-] ZINC000437355938 514147162 /nfs/dbraw/zinc/14/71/62/514147162.db2.gz PGKQAJTUJQCKAA-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000420585804 514192657 /nfs/dbraw/zinc/19/26/57/514192657.db2.gz NCQBOCKPKTVMSY-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601934 514197552 /nfs/dbraw/zinc/19/75/52/514197552.db2.gz AKIBCHRISHFJPG-CJNGLKHVSA-N 1 1 354.410 2.626 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000420601219 514197635 /nfs/dbraw/zinc/19/76/35/514197635.db2.gz NDVQRGZMSYRDPC-OAHLLOKOSA-N 1 1 354.410 2.770 20 5 FFBDMO C[C@@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+](C2CC2)C1 ZINC000452167760 514225401 /nfs/dbraw/zinc/22/54/01/514225401.db2.gz CGVFRKMJDLAOGR-ZDUSSCGKSA-N 1 1 363.433 2.954 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000437856105 514252188 /nfs/dbraw/zinc/25/21/88/514252188.db2.gz TVVSFUFBGONGAU-MRXNPFEDSA-N 1 1 360.458 2.920 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000444616387 514273827 /nfs/dbraw/zinc/27/38/27/514273827.db2.gz IMRIKTMATUMWKW-UHFFFAOYSA-N 1 1 372.425 2.700 20 5 FFBDMO NC(=O)[C@H]1CCC[N@H+](CCCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300243 514282370 /nfs/dbraw/zinc/28/23/70/514282370.db2.gz ACJRQTGEETXVIU-LPHOPBHVSA-N 1 1 374.485 2.539 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300243 514282379 /nfs/dbraw/zinc/28/23/79/514282379.db2.gz ACJRQTGEETXVIU-LPHOPBHVSA-N 1 1 374.485 2.539 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCO1 ZINC000432880948 514312194 /nfs/dbraw/zinc/31/21/94/514312194.db2.gz VPUDIYMMGCYRLG-MRXNPFEDSA-N 1 1 370.453 2.992 20 5 FFBDMO Cc1cc(N(C)CC[N@H+]2CCOC(C)(C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000432935659 514329066 /nfs/dbraw/zinc/32/90/66/514329066.db2.gz AJFOWEPFLKLYDA-UHFFFAOYSA-N 1 1 358.442 2.998 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433060742 514365756 /nfs/dbraw/zinc/36/57/56/514365756.db2.gz MSIIRQIFBFVNKQ-NVXWUHKLSA-N 1 1 371.437 2.766 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000420944442 514391912 /nfs/dbraw/zinc/39/19/12/514391912.db2.gz QVAOGTRLRVIJRA-GHMZBOCLSA-N 1 1 360.357 2.655 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@@H](C3CCCC3)C2)cc1 ZINC000420967667 514408204 /nfs/dbraw/zinc/40/82/04/514408204.db2.gz YXSNUKLYLNKJSQ-OAHLLOKOSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@@H](C3CCCC3)C2)cc1 ZINC000420967667 514408212 /nfs/dbraw/zinc/40/82/12/514408212.db2.gz YXSNUKLYLNKJSQ-OAHLLOKOSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H]1CC2(CN1Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)CC[NH2+]CC2 ZINC000424283767 514446660 /nfs/dbraw/zinc/44/66/60/514446660.db2.gz BZQZSBFUZHLKIU-CYBMUJFWSA-N 1 1 357.414 2.609 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@H](C)C[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462007 514479876 /nfs/dbraw/zinc/47/98/76/514479876.db2.gz PNVASOYCUOYZHE-SJCJKPOMSA-N 1 1 373.409 2.949 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](C)C[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462007 514479883 /nfs/dbraw/zinc/47/98/83/514479883.db2.gz PNVASOYCUOYZHE-SJCJKPOMSA-N 1 1 373.409 2.949 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000445583326 514495708 /nfs/dbraw/zinc/49/57/08/514495708.db2.gz MZNQLJQWSGFOPW-ZDUSSCGKSA-N 1 1 354.370 2.715 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000445583326 514495712 /nfs/dbraw/zinc/49/57/12/514495712.db2.gz MZNQLJQWSGFOPW-ZDUSSCGKSA-N 1 1 354.370 2.715 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000461261765 514554536 /nfs/dbraw/zinc/55/45/36/514554536.db2.gz GUGCKSHPBAHOQL-MRXNPFEDSA-N 1 1 358.442 2.882 20 5 FFBDMO Cn1c(C(=O)N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000461434744 514616349 /nfs/dbraw/zinc/61/63/49/514616349.db2.gz ZCIHLPUNTABPJA-IRXDYDNUSA-N 1 1 368.437 2.527 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470808050 514619392 /nfs/dbraw/zinc/61/93/92/514619392.db2.gz KWMKFCIGLYPKMN-JYJNAYRXSA-N 1 1 373.432 2.990 20 5 FFBDMO Cc1cccc(NCCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000461593460 514659199 /nfs/dbraw/zinc/65/91/99/514659199.db2.gz VKNFBTNZWIMJOU-UHFFFAOYSA-N 1 1 357.414 2.719 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461965810 514808523 /nfs/dbraw/zinc/80/85/23/514808523.db2.gz NWXVXXNPLWQGKW-CYBMUJFWSA-N 1 1 374.363 2.674 20 5 FFBDMO CC(C)[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCOCC1 ZINC000462085154 514872421 /nfs/dbraw/zinc/87/24/21/514872421.db2.gz QRQGACREBZBHGB-AWEZNQCLSA-N 1 1 359.373 2.965 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000490204022 515139676 /nfs/dbraw/zinc/13/96/76/515139676.db2.gz SKPSJCBKKVNGSV-SUNYJGFJSA-N 1 1 360.458 2.775 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000462776126 515237485 /nfs/dbraw/zinc/23/74/85/515237485.db2.gz DWOSZURTWAOTNI-MAUKXSAKSA-N 1 1 354.410 2.812 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@]3(CCCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000477051876 515303324 /nfs/dbraw/zinc/30/33/24/515303324.db2.gz RBZSOYHJYGJXED-PKOBYXMFSA-N 1 1 359.426 2.593 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CCN([C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)n1 ZINC000459425849 515543761 /nfs/dbraw/zinc/54/37/61/515543761.db2.gz MIGVSGKULGNPEC-GOSISDBHSA-N 1 1 355.442 2.703 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+]([C@@H]3CCN(Cc4ccccc4)C3)CC2)n1 ZINC000459425849 515543770 /nfs/dbraw/zinc/54/37/70/515543770.db2.gz MIGVSGKULGNPEC-GOSISDBHSA-N 1 1 355.442 2.703 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CC(C)(C)CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000492751153 515559920 /nfs/dbraw/zinc/55/99/20/515559920.db2.gz RVDWFRWWJFBMOR-UHFFFAOYSA-N 1 1 365.474 2.784 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3OC)CC[NH2+]2)cc1 ZINC000505508875 515565089 /nfs/dbraw/zinc/56/50/89/515565089.db2.gz XXTWAINLJKKXLA-GOSISDBHSA-N 1 1 369.421 2.953 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492831435 515565994 /nfs/dbraw/zinc/56/59/94/515565994.db2.gz NVSOCSVKSPQONR-GOEBONIOSA-N 1 1 359.426 2.579 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000505569324 515587653 /nfs/dbraw/zinc/58/76/53/515587653.db2.gz UCMVHPLOLCDEDJ-FZMZJTMJSA-N 1 1 374.384 2.840 20 5 FFBDMO CCOc1cc(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000500122870 515601623 /nfs/dbraw/zinc/60/16/23/515601623.db2.gz QAYBRNPHBFVTLU-QWHCGFSZSA-N 1 1 365.430 2.557 20 5 FFBDMO CC[C@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1N1CCOCC1 ZINC000493365548 515626729 /nfs/dbraw/zinc/62/67/29/515626729.db2.gz QUNSEXUJHGFBHA-GUYCJALGSA-N 1 1 353.850 2.791 20 5 FFBDMO CCOc1cc(C(=O)NCC[N@H+]2CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000457076446 515631313 /nfs/dbraw/zinc/63/13/13/515631313.db2.gz NTDVNUHOQZFFOK-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)C1CC1 ZINC000457171081 515703059 /nfs/dbraw/zinc/70/30/59/515703059.db2.gz RQFUYBTZZSMRFJ-UHFFFAOYSA-N 1 1 357.414 2.589 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000457213401 515728631 /nfs/dbraw/zinc/72/86/31/515728631.db2.gz YXEGVCCPEKCZGU-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000459681516 515740018 /nfs/dbraw/zinc/74/00/18/515740018.db2.gz XRWSFDRYWCKIDL-HNNXBMFYSA-N 1 1 366.414 2.538 20 5 FFBDMO COc1cccc(CNC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511071382 515766210 /nfs/dbraw/zinc/76/62/10/515766210.db2.gz DLCPIWUQZSIKRF-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO COc1cccc(CNC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511071382 515766217 /nfs/dbraw/zinc/76/62/17/515766217.db2.gz DLCPIWUQZSIKRF-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(=O)OC(C)(C)C ZINC000459778957 515799223 /nfs/dbraw/zinc/79/92/23/515799223.db2.gz UHGQFPXDDSKJJJ-GFCCVEGCSA-N 1 1 366.414 2.871 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(=O)OC(C)(C)C ZINC000459778958 515799464 /nfs/dbraw/zinc/79/94/64/515799464.db2.gz UHGQFPXDDSKJJJ-LBPRGKRZSA-N 1 1 366.414 2.871 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459818736 515828063 /nfs/dbraw/zinc/82/80/63/515828063.db2.gz YNLACTPQWUMUCG-CHWSQXEVSA-N 1 1 365.430 2.831 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[N@@H+](C)CC12CCCCC2 ZINC000487418339 515855635 /nfs/dbraw/zinc/85/56/35/515855635.db2.gz XOOWIZYVDXRZPO-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000487418339 515855641 /nfs/dbraw/zinc/85/56/41/515855641.db2.gz XOOWIZYVDXRZPO-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000501087494 515973573 /nfs/dbraw/zinc/97/35/73/515973573.db2.gz UQWQGTDFMDRWST-KOLCDFICSA-N 1 1 371.235 2.962 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501119728 515989753 /nfs/dbraw/zinc/98/97/53/515989753.db2.gz LTVOVHBSQHBZBW-UHFFFAOYSA-N 1 1 368.191 2.684 20 5 FFBDMO C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000464884181 516004887 /nfs/dbraw/zinc/00/48/87/516004887.db2.gz GUAASWFFBISBHT-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000464884182 516005063 /nfs/dbraw/zinc/00/50/63/516005063.db2.gz GUAASWFFBISBHT-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+]Cc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000474357330 516008215 /nfs/dbraw/zinc/00/82/15/516008215.db2.gz XHPQCAICOKBIIT-UHFFFAOYSA-N 1 1 366.320 2.715 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000507003301 516049957 /nfs/dbraw/zinc/04/99/57/516049957.db2.gz VRQGWRJIGPKUSX-CZUORRHYSA-N 1 1 354.410 2.941 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000495181091 516092380 /nfs/dbraw/zinc/09/23/80/516092380.db2.gz BTBYDRUJCWNAGZ-LBPRGKRZSA-N 1 1 372.347 2.650 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470114198 516125830 /nfs/dbraw/zinc/12/58/30/516125830.db2.gz JTLBPPOWQPGWAD-UHFFFAOYSA-N 1 1 364.402 2.975 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470114198 516125840 /nfs/dbraw/zinc/12/58/40/516125840.db2.gz JTLBPPOWQPGWAD-UHFFFAOYSA-N 1 1 364.402 2.975 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1OCCc2ccccc21 ZINC000507243641 516137540 /nfs/dbraw/zinc/13/75/40/516137540.db2.gz RPWMGTOBIXOGDK-FXAWDEMLSA-N 1 1 372.421 2.580 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000470152535 516146539 /nfs/dbraw/zinc/14/65/39/516146539.db2.gz NJMZDIUJHQDUSU-YEWDVWPNSA-N 1 1 355.394 2.941 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000470285141 516194251 /nfs/dbraw/zinc/19/42/51/516194251.db2.gz HNRSMSSARXBLKL-UHFFFAOYSA-N 1 1 356.426 2.995 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470290660 516195710 /nfs/dbraw/zinc/19/57/10/516195710.db2.gz WFJWPLQUCVKIMU-SFHVURJKSA-N 1 1 359.426 2.591 20 5 FFBDMO C[N@@H+](CC(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1 ZINC000501729339 516208188 /nfs/dbraw/zinc/20/81/88/516208188.db2.gz LEKPWNPLOLWQHR-GOEBONIOSA-N 1 1 367.496 2.606 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000512248329 516210407 /nfs/dbraw/zinc/21/04/07/516210407.db2.gz FOPUZZQNUVAORP-QGZVFWFLSA-N 1 1 353.378 2.667 20 5 FFBDMO Cc1ccccc1C[N@H+](C)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000512248329 516210414 /nfs/dbraw/zinc/21/04/14/516210414.db2.gz FOPUZZQNUVAORP-QGZVFWFLSA-N 1 1 353.378 2.667 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000512420953 516272214 /nfs/dbraw/zinc/27/22/14/516272214.db2.gz ORAWUNPIHFCYSA-CABCVRRESA-N 1 1 352.431 2.998 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488714511 516291902 /nfs/dbraw/zinc/29/19/02/516291902.db2.gz NCEXXZOOIOFYEJ-HBUWYVDXSA-N 1 1 372.469 2.654 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1C ZINC000497544744 516325875 /nfs/dbraw/zinc/32/58/75/516325875.db2.gz ZVCCAVRVXZRPOZ-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@@H]1C ZINC000497558322 516326347 /nfs/dbraw/zinc/32/63/47/516326347.db2.gz NZNYULTUHCWNQF-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO CC(C)c1ncc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000543619435 516331302 /nfs/dbraw/zinc/33/13/02/516331302.db2.gz PQXSAFFCMVJFBB-UHFFFAOYSA-N 1 1 369.468 2.738 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@@H](C)C2)n1 ZINC000561118442 516390514 /nfs/dbraw/zinc/39/05/14/516390514.db2.gz DQWJIKPTNZIZBK-CYBMUJFWSA-N 1 1 350.419 2.700 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000517641154 516396059 /nfs/dbraw/zinc/39/60/59/516396059.db2.gz GNQZULOPRNHINU-OAHLLOKOSA-N 1 1 363.458 2.990 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000513111072 516478768 /nfs/dbraw/zinc/47/87/68/516478768.db2.gz XUMNIMDMIBOOJZ-INIZCTEOSA-N 1 1 356.426 2.953 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](CC(C)C)[NH+]2CCOCC2)c1 ZINC000543899224 516487544 /nfs/dbraw/zinc/48/75/44/516487544.db2.gz WBYMHRTWVHSHJN-OAHLLOKOSA-N 1 1 365.430 2.540 20 5 FFBDMO CCOc1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)ccc1OC ZINC000535785580 516508027 /nfs/dbraw/zinc/50/80/27/516508027.db2.gz FWQOGTRCJCBLNW-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2)C1 ZINC000547730559 516524642 /nfs/dbraw/zinc/52/46/42/516524642.db2.gz ZOHSRBBGNAZIJB-ZDUSSCGKSA-N 1 1 369.425 2.887 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000558024820 516556343 /nfs/dbraw/zinc/55/63/43/516556343.db2.gz HGBIIFBWBIBQFB-SQWLQELKSA-N 1 1 361.442 2.796 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637303 516559146 /nfs/dbraw/zinc/55/91/46/516559146.db2.gz RUTNNNZVMUTTGM-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637303 516559156 /nfs/dbraw/zinc/55/91/56/516559156.db2.gz RUTNNNZVMUTTGM-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO C[NH+](C)C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000554655970 516570938 /nfs/dbraw/zinc/57/09/38/516570938.db2.gz SSOLVJLNTWXLFL-INIZCTEOSA-N 1 1 371.372 2.643 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000536029831 516598545 /nfs/dbraw/zinc/59/85/45/516598545.db2.gz UEXJEAZULBDOPB-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000536029831 516598555 /nfs/dbraw/zinc/59/85/55/516598555.db2.gz UEXJEAZULBDOPB-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000531727031 516613079 /nfs/dbraw/zinc/61/30/79/516613079.db2.gz IYIDIZCJVJFFON-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000536193837 516671439 /nfs/dbraw/zinc/67/14/39/516671439.db2.gz ULNOVEBZFLGNOY-OALUTQOASA-N 1 1 368.437 2.882 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccc(F)cc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000561611899 516681605 /nfs/dbraw/zinc/68/16/05/516681605.db2.gz NZAJCLNISKQCPX-AWEZNQCLSA-N 1 1 367.764 2.649 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000524774909 516825891 /nfs/dbraw/zinc/82/58/91/516825891.db2.gz ISKREEUHUPHXHP-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000555338925 516888842 /nfs/dbraw/zinc/88/88/42/516888842.db2.gz PTQAANZCMIYVRK-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514191135 516897114 /nfs/dbraw/zinc/89/71/14/516897114.db2.gz VYWOXDPGHRGYMY-LLVKDONJSA-N 1 1 374.363 2.613 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000525040927 516900974 /nfs/dbraw/zinc/90/09/74/516900974.db2.gz VIQGSLLLMHTHOU-BLLLJJGKSA-N 1 1 362.455 2.808 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCc1ccccc1O ZINC000541394465 517029897 /nfs/dbraw/zinc/02/98/97/517029897.db2.gz VUIKQSFTTDYYBX-UHFFFAOYSA-N 1 1 373.409 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC=C(c3ccccn3)C2)c1 ZINC000562443024 517111738 /nfs/dbraw/zinc/11/17/38/517111738.db2.gz CKOYHBUSAFNGJX-KRWDZBQOSA-N 1 1 355.394 2.519 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444484 517113703 /nfs/dbraw/zinc/11/37/03/517113703.db2.gz RSHCLIMNMKTWTG-DZGCQCFKSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444484 517113714 /nfs/dbraw/zinc/11/37/14/517113714.db2.gz RSHCLIMNMKTWTG-DZGCQCFKSA-N 1 1 371.441 2.781 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000555808199 517135777 /nfs/dbraw/zinc/13/57/77/517135777.db2.gz FFZYLVNDIFMHGK-MRXNPFEDSA-N 1 1 358.442 2.679 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1[C@@H]1C[C@H]1c1ccccc1 ZINC000537315849 517140903 /nfs/dbraw/zinc/14/09/03/517140903.db2.gz YAJXXHYKKQTXOA-HRCADAONSA-N 1 1 357.435 2.903 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccccc1)C[C@H](C)O ZINC000532972178 517229985 /nfs/dbraw/zinc/22/99/85/517229985.db2.gz PJZOBOZXHHRUSR-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)C[C@H](C)O ZINC000532972178 517229993 /nfs/dbraw/zinc/22/99/93/517229993.db2.gz PJZOBOZXHHRUSR-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000519869397 517230958 /nfs/dbraw/zinc/23/09/58/517230958.db2.gz OUTUVAYKJTXMGV-HNNXBMFYSA-N 1 1 367.427 2.549 20 5 FFBDMO COCC[N@H+](CCc1ccccc1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000533255372 517366259 /nfs/dbraw/zinc/36/62/59/517366259.db2.gz JJWYSPIXXPRSHL-UHFFFAOYSA-N 1 1 357.410 2.724 20 5 FFBDMO COCC[N@@H+](CCc1ccccc1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000533255372 517366275 /nfs/dbraw/zinc/36/62/75/517366275.db2.gz JJWYSPIXXPRSHL-UHFFFAOYSA-N 1 1 357.410 2.724 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000515559464 517406291 /nfs/dbraw/zinc/40/62/91/517406291.db2.gz PVAUTWNIMLYKHE-UHFFFAOYSA-N 1 1 364.402 2.975 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000515559464 517406301 /nfs/dbraw/zinc/40/63/01/517406301.db2.gz PVAUTWNIMLYKHE-UHFFFAOYSA-N 1 1 364.402 2.975 20 5 FFBDMO COC(=O)CCC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000533344963 517416720 /nfs/dbraw/zinc/41/67/20/517416720.db2.gz CGFINBOQGWJRLA-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO CCOc1ccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000542210641 517440270 /nfs/dbraw/zinc/44/02/70/517440270.db2.gz VTQLKRIHYBNZSX-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(c2ccc(Br)cc2)CC1 ZINC000538178042 517493550 /nfs/dbraw/zinc/49/35/50/517493550.db2.gz OLIANOYSYXQSQY-UHFFFAOYSA-N 1 1 351.204 2.870 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@@H]2CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496326 517595590 /nfs/dbraw/zinc/59/55/90/517595590.db2.gz KXDRLEYQNHKQKO-DKSSEZFCSA-N 1 1 360.410 2.827 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000533801225 517616929 /nfs/dbraw/zinc/61/69/29/517616929.db2.gz HJDRHDJEXRTGBD-GASCZTMLSA-N 1 1 360.458 2.925 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563178519 517715778 /nfs/dbraw/zinc/71/57/78/517715778.db2.gz WCHIKPROORVLTA-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563178519 517715786 /nfs/dbraw/zinc/71/57/86/517715786.db2.gz WCHIKPROORVLTA-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556882793 517726836 /nfs/dbraw/zinc/72/68/36/517726836.db2.gz DTCLEMLNEIPBHS-OAHLLOKOSA-N 1 1 374.441 2.969 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000556934254 517756131 /nfs/dbraw/zinc/75/61/31/517756131.db2.gz QVSNWPPSKVPOSS-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000521769652 517851105 /nfs/dbraw/zinc/85/11/05/517851105.db2.gz FNKCTWHSTMVGJZ-NWDGAFQWSA-N 1 1 367.833 2.616 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](CCCc2ccccc2)CC1 ZINC000550112920 517867591 /nfs/dbraw/zinc/86/75/91/517867591.db2.gz WKFCIJARPDQWFY-UHFFFAOYSA-N 1 1 353.422 2.985 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000543185952 517954489 /nfs/dbraw/zinc/95/44/89/517954489.db2.gz BKOBWQLZFRATCT-IAGOWNOFSA-N 1 1 372.421 2.735 20 5 FFBDMO C[C@@H]1COc2ccccc2C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543188374 517955945 /nfs/dbraw/zinc/95/59/45/517955945.db2.gz YWZRDLKIFJWYCW-ZBFHGGJFSA-N 1 1 358.394 2.618 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557537023 518062635 /nfs/dbraw/zinc/06/26/35/518062635.db2.gz KXPRUUWQWLZFEQ-HOTGVXAUSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557537023 518062646 /nfs/dbraw/zinc/06/26/46/518062646.db2.gz KXPRUUWQWLZFEQ-HOTGVXAUSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c21 ZINC000543435059 518088672 /nfs/dbraw/zinc/08/86/72/518088672.db2.gz CTVYKKKYZQINBC-BBRMVZONSA-N 1 1 353.426 2.991 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000535035604 518130622 /nfs/dbraw/zinc/13/06/22/518130622.db2.gz BSUGGUWVLXMAMD-CABCVRRESA-N 1 1 354.410 2.725 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000535035604 518130628 /nfs/dbraw/zinc/13/06/28/518130628.db2.gz BSUGGUWVLXMAMD-CABCVRRESA-N 1 1 354.410 2.725 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1C ZINC000531141291 518151942 /nfs/dbraw/zinc/15/19/42/518151942.db2.gz QCCGODROAOLRSH-DZGCQCFKSA-N 1 1 359.430 2.949 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000539810159 518166225 /nfs/dbraw/zinc/16/62/25/518166225.db2.gz SUVVYSMOBVDUGL-NSHDSACASA-N 1 1 357.357 2.656 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCCC[C@@H]1C ZINC000535282378 518173039 /nfs/dbraw/zinc/17/30/39/518173039.db2.gz VVUAHSCYWNADNB-LSDHHAIUSA-N 1 1 360.458 2.925 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)CC1 ZINC000578516816 518248453 /nfs/dbraw/zinc/24/84/53/518248453.db2.gz ZQGKIXCQYOWUIG-UHFFFAOYSA-N 1 1 356.430 2.720 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000584562102 518398065 /nfs/dbraw/zinc/39/80/65/518398065.db2.gz RKNSBGCRMIRDJD-HZPDHXFCSA-N 1 1 354.410 2.517 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(F)c1 ZINC000586760548 518632396 /nfs/dbraw/zinc/63/23/96/518632396.db2.gz LEVBJTMJCFGYCJ-AWEZNQCLSA-N 1 1 355.385 2.560 20 5 FFBDMO CC(C)[C@@H](O)C1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000586791522 518644464 /nfs/dbraw/zinc/64/44/64/518644464.db2.gz RYHACIBZQBXGBO-IAGOWNOFSA-N 1 1 358.442 2.804 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000573478609 518685427 /nfs/dbraw/zinc/68/54/27/518685427.db2.gz QLRIWIUUCXZEPR-ROUUACIJSA-N 1 1 371.441 2.545 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H]1CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483367 518703734 /nfs/dbraw/zinc/70/37/34/518703734.db2.gz MTSIFRQFFIEUEC-HUUCEWRRSA-N 1 1 361.364 2.899 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483367 518703739 /nfs/dbraw/zinc/70/37/39/518703739.db2.gz MTSIFRQFFIEUEC-HUUCEWRRSA-N 1 1 361.364 2.899 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CSCc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000564959112 518713630 /nfs/dbraw/zinc/71/36/30/518713630.db2.gz VZMMJBKEUCKICK-GFCCVEGCSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@@H](CSCc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000564959112 518713640 /nfs/dbraw/zinc/71/36/40/518713640.db2.gz VZMMJBKEUCKICK-GFCCVEGCSA-N 1 1 361.261 2.921 20 5 FFBDMO C[C@@]1(CNc2nccc(C(N)=O)c2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000579656676 518784506 /nfs/dbraw/zinc/78/45/06/518784506.db2.gz ACDFLUGAWRKTRU-IBGZPJMESA-N 1 1 369.425 2.555 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)O1 ZINC000579674132 518794039 /nfs/dbraw/zinc/79/40/39/518794039.db2.gz JALAYFIFTSGFIH-GUTXKFCHSA-N 1 1 359.430 2.549 20 5 FFBDMO Cc1ccccc1-n1cc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)nn1 ZINC000588925690 518871654 /nfs/dbraw/zinc/87/16/54/518871654.db2.gz ZIMGQZRYTXODMJ-UHFFFAOYSA-N 1 1 353.382 2.653 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000589502868 519019610 /nfs/dbraw/zinc/01/96/10/519019610.db2.gz DOKCKHNGKXXVPJ-UHFFFAOYSA-N 1 1 352.387 2.545 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCC(=O)OC(C)(C)C)c1 ZINC000589502868 519019615 /nfs/dbraw/zinc/01/96/15/519019615.db2.gz DOKCKHNGKXXVPJ-UHFFFAOYSA-N 1 1 352.387 2.545 20 5 FFBDMO CC[N@@H+](CCNC(=O)NCc1cccc([N+](=O)[O-])c1)CCC(F)(F)F ZINC000577337998 519027288 /nfs/dbraw/zinc/02/72/88/519027288.db2.gz LVPCWOOKXKUMTO-UHFFFAOYSA-N 1 1 362.352 2.668 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000577341617 519029796 /nfs/dbraw/zinc/02/97/96/519029796.db2.gz FRNLBBRFKVITJG-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000577341617 519029799 /nfs/dbraw/zinc/02/97/99/519029799.db2.gz FRNLBBRFKVITJG-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@H](SC[C@H]1C[N@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509784 519075172 /nfs/dbraw/zinc/07/51/72/519075172.db2.gz ZVXNFKRHBGCQSM-CMPLNLGQSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@H](SC[C@H]1C[N@@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509784 519075179 /nfs/dbraw/zinc/07/51/79/519075179.db2.gz ZVXNFKRHBGCQSM-CMPLNLGQSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H](C)C1 ZINC000590174900 519169290 /nfs/dbraw/zinc/16/92/90/519169290.db2.gz DFXCIZNUWNMRSN-RYUDHWBXSA-N 1 1 361.364 2.501 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000590378298 519210604 /nfs/dbraw/zinc/21/06/04/519210604.db2.gz SUZDPAPXZAUIFZ-SFHVURJKSA-N 1 1 350.415 2.597 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000571758298 519260089 /nfs/dbraw/zinc/26/00/89/519260089.db2.gz NHLHEYXCQBIJCC-OALUTQOASA-N 1 1 367.405 2.853 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000571758298 519260095 /nfs/dbraw/zinc/26/00/95/519260095.db2.gz NHLHEYXCQBIJCC-OALUTQOASA-N 1 1 367.405 2.853 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590806562 519380481 /nfs/dbraw/zinc/38/04/81/519380481.db2.gz RMMICKYRKJIOBK-ZWKOTPCHSA-N 1 1 372.469 2.968 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](Cc2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000580860971 519395093 /nfs/dbraw/zinc/39/50/93/519395093.db2.gz PQZDYDVRQUQTSW-UHFFFAOYSA-N 1 1 373.409 2.952 20 5 FFBDMO CC(C)C[C@@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[NH+]1CCOCC1 ZINC000575190258 519547281 /nfs/dbraw/zinc/54/72/81/519547281.db2.gz MRPCWYQEHUMGIA-LBPRGKRZSA-N 1 1 365.459 2.758 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000566570146 519556875 /nfs/dbraw/zinc/55/68/75/519556875.db2.gz GBIRBHZVXBOMHQ-UHFFFAOYSA-N 1 1 367.396 2.750 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000566632841 519587598 /nfs/dbraw/zinc/58/75/98/519587598.db2.gz RBUCQLIVSOAPPJ-VQIMIIECSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000566632841 519587606 /nfs/dbraw/zinc/58/76/06/519587606.db2.gz RBUCQLIVSOAPPJ-VQIMIIECSA-N 1 1 360.385 2.905 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)CC1 ZINC000602875811 519941963 /nfs/dbraw/zinc/94/19/63/519941963.db2.gz ASBCQQMOHVYXAM-UHFFFAOYSA-N 1 1 357.414 2.563 20 5 FFBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000602894096 519956932 /nfs/dbraw/zinc/95/69/32/519956932.db2.gz YKBGAXPLMZRILQ-LBPRGKRZSA-N 1 1 371.363 2.930 20 5 FFBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000602894096 519956939 /nfs/dbraw/zinc/95/69/39/519956939.db2.gz YKBGAXPLMZRILQ-LBPRGKRZSA-N 1 1 371.363 2.930 20 5 FFBDMO CC[C@H](C)[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599995517 519991771 /nfs/dbraw/zinc/99/17/71/519991771.db2.gz DFRLIKLRVUXDSE-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC(C)N(C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000602962367 519994064 /nfs/dbraw/zinc/99/40/64/519994064.db2.gz JYVIZECFGYRMHR-LJQANCHMSA-N 1 1 363.458 2.572 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000616492520 520039656 /nfs/dbraw/zinc/03/96/56/520039656.db2.gz ZEACTIVWVURZJA-GOSISDBHSA-N 1 1 354.410 2.579 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000616492520 520039663 /nfs/dbraw/zinc/03/96/63/520039663.db2.gz ZEACTIVWVURZJA-GOSISDBHSA-N 1 1 354.410 2.579 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000597604757 520130626 /nfs/dbraw/zinc/13/06/26/520130626.db2.gz KFIKXRAZOPWMJQ-ZDUSSCGKSA-N 1 1 370.247 2.914 20 5 FFBDMO CCn1ccc(C[N@@H+](C)CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616785508 520139365 /nfs/dbraw/zinc/13/93/65/520139365.db2.gz WYTIIXZHASBEIT-UHFFFAOYSA-N 1 1 360.414 2.885 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000594793940 520161737 /nfs/dbraw/zinc/16/17/37/520161737.db2.gz WUTUVIZDBSJQCT-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[NH+](CC)Cc1cn(Cc2ccc(Br)cc2[N+](=O)[O-])nn1 ZINC000603239292 520174538 /nfs/dbraw/zinc/17/45/38/520174538.db2.gz DVFIPTLETZFRBG-UHFFFAOYSA-N 1 1 368.235 2.839 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)cc1SC ZINC000600314791 520200372 /nfs/dbraw/zinc/20/03/72/520200372.db2.gz POZFCMHXWNOVFZ-LBPRGKRZSA-N 1 1 367.471 2.787 20 5 FFBDMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC2CC2)cn1 ZINC000592145727 520224648 /nfs/dbraw/zinc/22/46/48/520224648.db2.gz ZKGUGJCRMVRLIC-LJQANCHMSA-N 1 1 371.437 2.950 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@@H]3C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000603399450 520246805 /nfs/dbraw/zinc/24/68/05/520246805.db2.gz ATQPTGNZQFKEDM-LBPRGKRZSA-N 1 1 369.849 2.946 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000603401249 520247292 /nfs/dbraw/zinc/24/72/92/520247292.db2.gz KNKYFHBSICDLGW-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000603756468 520355475 /nfs/dbraw/zinc/35/54/75/520355475.db2.gz QQEHUXYIZRTSEZ-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO COc1cc(CNC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000592376482 520358272 /nfs/dbraw/zinc/35/82/72/520358272.db2.gz SJRIHDCRGJPKLG-SJORKVTESA-N 1 1 371.437 2.744 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609758170 520422228 /nfs/dbraw/zinc/42/22/28/520422228.db2.gz NOUKHRXLUCVXKX-WMLDXEAASA-N 1 1 356.426 2.635 20 5 FFBDMO CO[C@@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CCCC1 ZINC000595504954 520515415 /nfs/dbraw/zinc/51/54/15/520515415.db2.gz LERPBSZTIDSIDC-SFHVURJKSA-N 1 1 361.442 2.558 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341602 520563928 /nfs/dbraw/zinc/56/39/28/520563928.db2.gz DLQOANIIEYDNCN-YPMHNXCESA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610161470 520564308 /nfs/dbraw/zinc/56/43/08/520564308.db2.gz VVGWTVJLMFAGNX-CQSZACIVSA-N 1 1 358.394 2.844 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610161470 520564313 /nfs/dbraw/zinc/56/43/13/520564313.db2.gz VVGWTVJLMFAGNX-CQSZACIVSA-N 1 1 358.394 2.844 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000595596568 520581234 /nfs/dbraw/zinc/58/12/34/520581234.db2.gz OTRSVYLOMUCONR-INIZCTEOSA-N 1 1 360.410 2.518 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](CO)Cc1ccccc1 ZINC000595599573 520582271 /nfs/dbraw/zinc/58/22/71/520582271.db2.gz YTASPECUXZLEBE-GOSISDBHSA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1ccnc(N3CCCC3)c1)OCCO2 ZINC000604532496 520591813 /nfs/dbraw/zinc/59/18/13/520591813.db2.gz WFCVGFIKRAMDIW-UHFFFAOYSA-N 1 1 370.409 2.651 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc21 ZINC000595613116 520593105 /nfs/dbraw/zinc/59/31/05/520593105.db2.gz HOFNAXBCYFVUQB-INIZCTEOSA-N 1 1 372.425 2.732 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc21 ZINC000595613116 520593113 /nfs/dbraw/zinc/59/31/13/520593113.db2.gz HOFNAXBCYFVUQB-INIZCTEOSA-N 1 1 372.425 2.732 20 5 FFBDMO CCCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000592828859 520605126 /nfs/dbraw/zinc/60/51/26/520605126.db2.gz KFWMLAZFEMPZQU-GFCCVEGCSA-N 1 1 357.357 2.753 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC2(CCC2)OC[C@H]1C ZINC000595684062 520645497 /nfs/dbraw/zinc/64/54/97/520645497.db2.gz ZXGKIWXTBBCNLH-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCOC[C@@H]3[C@H]3CCCC[C@@H]3O)c2c1 ZINC000601164263 520668909 /nfs/dbraw/zinc/66/89/09/520668909.db2.gz RFBXFYJKRIJVOT-ZMYBRWDISA-N 1 1 357.410 2.899 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000601185702 520678293 /nfs/dbraw/zinc/67/82/93/520678293.db2.gz ZFGXYKVHGFLLBY-NSHDSACASA-N 1 1 350.806 2.715 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1)Nc1ccccc1[N+](=O)[O-] ZINC000595748529 520696329 /nfs/dbraw/zinc/69/63/29/520696329.db2.gz WONGBQXMQJIKGJ-DLBZAZTESA-N 1 1 369.421 2.631 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1)Nc1ccccc1[N+](=O)[O-] ZINC000595748529 520696337 /nfs/dbraw/zinc/69/63/37/520696337.db2.gz WONGBQXMQJIKGJ-DLBZAZTESA-N 1 1 369.421 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@]2(CO)CCC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000610481134 520709095 /nfs/dbraw/zinc/70/90/95/520709095.db2.gz JUWSGSCHFSIKGZ-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000610481134 520709103 /nfs/dbraw/zinc/70/91/03/520709103.db2.gz JUWSGSCHFSIKGZ-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)n1 ZINC000610484879 520710673 /nfs/dbraw/zinc/71/06/73/520710673.db2.gz XKMGUXXZZAQNBN-UHFFFAOYSA-N 1 1 358.398 2.965 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000593054904 520711631 /nfs/dbraw/zinc/71/16/31/520711631.db2.gz HQYIOLWWGWBHCH-OAHLLOKOSA-N 1 1 365.430 2.821 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000598585925 520727578 /nfs/dbraw/zinc/72/75/78/520727578.db2.gz BKXJHXKSRDFYBG-ZDUSSCGKSA-N 1 1 370.409 2.635 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598620473 520748320 /nfs/dbraw/zinc/74/83/20/520748320.db2.gz AYBVJCPUGSIXCJ-OAHLLOKOSA-N 1 1 370.409 2.710 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000595825703 520749194 /nfs/dbraw/zinc/74/91/94/520749194.db2.gz FVCQERGXTLSCMK-MOPGFXCFSA-N 1 1 371.437 2.545 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900242 520806130 /nfs/dbraw/zinc/80/61/30/520806130.db2.gz BYWQFHGDNHUXNU-INIZCTEOSA-N 1 1 360.458 2.553 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900787 520808321 /nfs/dbraw/zinc/80/83/21/520808321.db2.gz LFQWOIBPDUZOLK-HOCLYGCPSA-N 1 1 360.458 2.633 20 5 FFBDMO O=C1[C@@H]([N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595909281 520814197 /nfs/dbraw/zinc/81/41/97/520814197.db2.gz LDMOJZSHHDKQKT-YSIASYRMSA-N 1 1 371.437 2.593 20 5 FFBDMO C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@](C)(C(F)F)O1 ZINC000595918104 520823170 /nfs/dbraw/zinc/82/31/70/520823170.db2.gz ONQJNPLCEVQMHZ-MEDUHNTESA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@](C)(C(F)F)O1 ZINC000595918104 520823181 /nfs/dbraw/zinc/82/31/81/520823181.db2.gz ONQJNPLCEVQMHZ-MEDUHNTESA-N 1 1 357.357 2.668 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593320266 520908474 /nfs/dbraw/zinc/90/84/74/520908474.db2.gz BYFYCPUPOWDCCM-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593320266 520908479 /nfs/dbraw/zinc/90/84/79/520908479.db2.gz BYFYCPUPOWDCCM-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596121230 520924978 /nfs/dbraw/zinc/92/49/78/520924978.db2.gz XRELUSDNAHJEMT-LLVKDONJSA-N 1 1 353.806 2.931 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596121231 520925393 /nfs/dbraw/zinc/92/53/93/520925393.db2.gz XRELUSDNAHJEMT-NSHDSACASA-N 1 1 353.806 2.931 20 5 FFBDMO COc1ccc(CC(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)cc1[N+](=O)[O-] ZINC000611057453 520964447 /nfs/dbraw/zinc/96/44/47/520964447.db2.gz RTAHDRDFOABQHH-UHFFFAOYSA-N 1 1 367.365 2.674 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593406137 520971307 /nfs/dbraw/zinc/97/13/07/520971307.db2.gz BHQOZWMEAYGQHZ-CQSZACIVSA-N 1 1 351.422 2.905 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593419612 520981150 /nfs/dbraw/zinc/98/11/50/520981150.db2.gz HYOAHERHGMZXEV-HZSPNIEDSA-N 1 1 351.422 2.759 20 5 FFBDMO NC(=O)c1cc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000596227096 520983099 /nfs/dbraw/zinc/98/30/99/520983099.db2.gz NGISSUFLYYMEPZ-ZDUSSCGKSA-N 1 1 369.425 2.611 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC000611093891 520983305 /nfs/dbraw/zinc/98/33/05/520983305.db2.gz MHTIDANJOLBLOE-JTQLQIEISA-N 1 1 358.345 2.754 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593463437 521009495 /nfs/dbraw/zinc/00/94/95/521009495.db2.gz VIIQRIMMHSRSFS-QGZVFWFLSA-N 1 1 369.469 2.749 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309861 521021543 /nfs/dbraw/zinc/02/15/43/521021543.db2.gz YSDHJNLWDCRFCV-INIZCTEOSA-N 1 1 362.474 2.712 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](CCOC)C1 ZINC000611204217 521034571 /nfs/dbraw/zinc/03/45/71/521034571.db2.gz CCIVAQAEFPCPKX-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[NH2+]CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601970004 521048134 /nfs/dbraw/zinc/04/81/34/521048134.db2.gz IJTJWTUDHHWFSM-MRXNPFEDSA-N 1 1 357.458 2.863 20 5 FFBDMO C[C@@H]1C[NH+](CCOC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H](C)O1 ZINC000611339293 521105793 /nfs/dbraw/zinc/10/57/93/521105793.db2.gz PKMVPAHAQHEHQA-HZPDHXFCSA-N 1 1 363.458 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc2c(ccnc2N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1 ZINC000596515391 521109104 /nfs/dbraw/zinc/10/91/04/521109104.db2.gz UZQSSJXWAGKNOD-QZTJIDSGSA-N 1 1 368.437 2.620 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596570441 521137655 /nfs/dbraw/zinc/13/76/55/521137655.db2.gz LCAIPLJARBFHSJ-CQSZACIVSA-N 1 1 367.471 2.532 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](N[C@@H]2CCC[N@@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712891 521169898 /nfs/dbraw/zinc/16/98/98/521169898.db2.gz QQIIJHZOXVHRKO-UKRRQHHQSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](N[C@@H]2CCC[N@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712891 521169903 /nfs/dbraw/zinc/16/99/03/521169903.db2.gz QQIIJHZOXVHRKO-UKRRQHHQSA-N 1 1 361.364 2.635 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000611554933 521216732 /nfs/dbraw/zinc/21/67/32/521216732.db2.gz CJWKJWYKDQNEHI-MBNYWOFBSA-N 1 1 362.348 2.997 20 5 FFBDMO COC(=O)[C@H]1CCCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611576180 521230023 /nfs/dbraw/zinc/23/00/23/521230023.db2.gz ODAFVNWTVIBZQC-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO COC(=O)[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000611578649 521232231 /nfs/dbraw/zinc/23/22/31/521232231.db2.gz UDXIZOXNCGMZJN-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO COC(=O)[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000611578649 521232240 /nfs/dbraw/zinc/23/22/40/521232240.db2.gz UDXIZOXNCGMZJN-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1cc(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)ccc1[N+](=O)[O-] ZINC000611582703 521237227 /nfs/dbraw/zinc/23/72/27/521237227.db2.gz ANDVGRSCMFSKSI-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000602291266 521263141 /nfs/dbraw/zinc/26/31/41/521263141.db2.gz KMMMPWIRIWFLBW-CRAIPNDOSA-N 1 1 357.454 2.959 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000611705689 521287969 /nfs/dbraw/zinc/28/79/69/521287969.db2.gz GVHIGJLCMLQRQD-AWEZNQCLSA-N 1 1 364.409 2.816 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000599639630 521351248 /nfs/dbraw/zinc/35/12/48/521351248.db2.gz KQLODDVPDVHQLE-YVEFUNNKSA-N 1 1 372.368 2.799 20 5 FFBDMO Cn1cc(CN2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c([N+](=O)[O-])n1 ZINC000602459841 521359679 /nfs/dbraw/zinc/35/96/79/521359679.db2.gz VCZMDIKFXSYDLT-UHFFFAOYSA-N 1 1 357.458 2.672 20 5 FFBDMO CCOC(=O)CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C ZINC000594051714 521374071 /nfs/dbraw/zinc/37/40/71/521374071.db2.gz NCSYOGULALPKKB-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C ZINC000594051714 521374073 /nfs/dbraw/zinc/37/40/73/521374073.db2.gz NCSYOGULALPKKB-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1F ZINC000599677128 521391562 /nfs/dbraw/zinc/39/15/62/521391562.db2.gz HCXPCWCIFHSSSL-CQSZACIVSA-N 1 1 373.384 2.831 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000599699190 521410773 /nfs/dbraw/zinc/41/07/73/521410773.db2.gz XMDZMAASSCNRJG-BTTYYORXSA-N 1 1 363.414 2.585 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000594199245 521465372 /nfs/dbraw/zinc/46/53/72/521465372.db2.gz IHWVGXQXVXBBLG-RDJZCZTQSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000599831195 521499383 /nfs/dbraw/zinc/49/93/83/521499383.db2.gz PQNDBQBVFYTTCI-STQMWFEESA-N 1 1 355.398 2.891 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597093425 521499776 /nfs/dbraw/zinc/49/97/76/521499776.db2.gz ULQWWNAZOBAGDX-NSHDSACASA-N 1 1 355.826 2.826 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000602780775 521529784 /nfs/dbraw/zinc/52/97/84/521529784.db2.gz LRPQQIVJXNNXBX-UHFFFAOYSA-N 1 1 360.258 2.916 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000602780775 521529788 /nfs/dbraw/zinc/52/97/88/521529788.db2.gz LRPQQIVJXNNXBX-UHFFFAOYSA-N 1 1 360.258 2.916 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000602786051 521531451 /nfs/dbraw/zinc/53/14/51/521531451.db2.gz VFQKAHVFULNEDO-UHFFFAOYSA-N 1 1 352.398 2.765 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000602847046 521567987 /nfs/dbraw/zinc/56/79/87/521567987.db2.gz RBPSRNNHIJLXKI-GDBMZVCRSA-N 1 1 350.806 2.561 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000602847046 521567993 /nfs/dbraw/zinc/56/79/93/521567993.db2.gz RBPSRNNHIJLXKI-GDBMZVCRSA-N 1 1 350.806 2.561 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]2N1 ZINC000597204735 521573521 /nfs/dbraw/zinc/57/35/21/521573521.db2.gz FTIYXYURHZAXIG-CZUORRHYSA-N 1 1 355.394 2.955 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000619586473 521785133 /nfs/dbraw/zinc/78/51/33/521785133.db2.gz RUNBOELFRDRHEU-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[N@@H+]1CCCN(CCCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000619586473 521785139 /nfs/dbraw/zinc/78/51/39/521785139.db2.gz RUNBOELFRDRHEU-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000619586473 521785146 /nfs/dbraw/zinc/78/51/46/521785146.db2.gz RUNBOELFRDRHEU-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCCOCC2)nc1-c1ccc(F)cc1 ZINC000485401281 561318321 /nfs/dbraw/zinc/31/83/21/561318321.db2.gz DKNSHOMGYZKPQJ-UHFFFAOYSA-N 1 1 360.389 2.930 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[NH+]1CCN(C)CC1 ZINC000485416563 561318673 /nfs/dbraw/zinc/31/86/73/561318673.db2.gz KWRFAKPGUCXGGM-CQSZACIVSA-N 1 1 373.432 2.844 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000736264522 598367480 /nfs/dbraw/zinc/36/74/80/598367480.db2.gz FKZFJILZJJUTLS-GFCCVEGCSA-N 1 1 359.434 2.697 20 5 FFBDMO C[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000824648957 609313892 /nfs/dbraw/zinc/31/38/92/609313892.db2.gz JZBURIHZBFYHHJ-OCCSQVGLSA-N 1 1 371.445 2.840 20 5 FFBDMO Cc1ccnc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c1[N+](=O)[O-] ZINC001164647117 719308361 /nfs/dbraw/zinc/30/83/61/719308361.db2.gz KXKTYMBIDJFEQP-UHFFFAOYSA-N 1 1 358.446 2.700 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726104 720334536 /nfs/dbraw/zinc/33/45/36/720334536.db2.gz PSUQZVGVXFCUDF-HOTGVXAUSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726104 720334541 /nfs/dbraw/zinc/33/45/41/720334541.db2.gz PSUQZVGVXFCUDF-HOTGVXAUSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721712 720334576 /nfs/dbraw/zinc/33/45/76/720334576.db2.gz DBOXSGZSFROOPK-GJZGRUSLSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(N3CC[C@@H]4[C@H]3CC[N@H+]4Cc3cccnc3)nc21 ZINC001164724696 720404346 /nfs/dbraw/zinc/40/43/46/720404346.db2.gz KOCZLXGWUSWNIN-HZPDHXFCSA-N 1 1 364.409 2.719 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000897987245 735300742 /nfs/dbraw/zinc/30/07/42/735300742.db2.gz OXYYIQCUCJZPSN-LBPRGKRZSA-N 1 1 364.789 2.856 20 5 FFBDMO CC(C)C[C@H]1COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128646422 728709256 /nfs/dbraw/zinc/70/92/56/728709256.db2.gz LRXUISGRCGMSAP-AWEZNQCLSA-N 1 1 353.394 2.809 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000130214177 728715916 /nfs/dbraw/zinc/71/59/16/728715916.db2.gz GAZQGQJZHNTSRE-ZDUSSCGKSA-N 1 1 357.332 2.828 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172179716 729020873 /nfs/dbraw/zinc/02/08/73/729020873.db2.gz SJKDWRQKKFTWCZ-KRWDZBQOSA-N 1 1 366.893 2.850 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174853021 729081641 /nfs/dbraw/zinc/08/16/41/729081641.db2.gz FZLZQYAIMGTUDS-QGZVFWFLSA-N 1 1 366.893 2.850 20 5 FFBDMO CCOC(=O)N(C)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000778943631 738423361 /nfs/dbraw/zinc/42/33/61/738423361.db2.gz ZATAGZIXMSNMQS-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccc1Cl ZINC000195133920 729530267 /nfs/dbraw/zinc/53/02/67/729530267.db2.gz QSIKIDASXIQVSB-MRXNPFEDSA-N 1 1 362.817 2.863 20 5 FFBDMO CC(C)[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)N1CCN(C)CC1 ZINC000236695358 729554843 /nfs/dbraw/zinc/55/48/43/729554843.db2.gz XQLNJHARGAUOML-QGZVFWFLSA-N 1 1 354.882 2.610 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246607884 729588330 /nfs/dbraw/zinc/58/83/30/729588330.db2.gz HPTORXQLSDURJJ-WMLDXEAASA-N 1 1 350.415 2.684 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000857635689 730403474 /nfs/dbraw/zinc/40/34/74/730403474.db2.gz ZLXIIKCSBPRLBW-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)c1ccc(SC)c([N+](=O)[O-])c1 ZINC000861032254 730568874 /nfs/dbraw/zinc/56/88/74/730568874.db2.gz MGAXCTMSBJTUNH-ZDUSSCGKSA-N 1 1 354.428 2.584 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@]1(C)C[C@H](OC)C[N@H+]1C ZINC000861350680 730602992 /nfs/dbraw/zinc/60/29/92/730602992.db2.gz QNRDTFWQIFAFLU-SUMWQHHRSA-N 1 1 368.455 2.973 20 5 FFBDMO NC(CCC(F)(F)F)=[NH+]O[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863489191 730785760 /nfs/dbraw/zinc/78/57/60/730785760.db2.gz BACUSJVKEMNFLB-NSHDSACASA-N 1 1 360.292 2.541 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769508686 737537108 /nfs/dbraw/zinc/53/71/08/737537108.db2.gz UQGIEANHWWKCIS-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769508686 737537109 /nfs/dbraw/zinc/53/71/09/737537109.db2.gz UQGIEANHWWKCIS-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000865183683 730922106 /nfs/dbraw/zinc/92/21/06/730922106.db2.gz KUDRAHHGJMQAQD-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO CNC(=O)C[NH+]1CCC(Nc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC000865438390 730955013 /nfs/dbraw/zinc/95/50/13/730955013.db2.gz WRKOWPQXVLJMQR-UHFFFAOYSA-N 1 1 361.229 2.524 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCN1CCC(O)CC1 ZINC000872026537 731721712 /nfs/dbraw/zinc/72/17/12/731721712.db2.gz FULAEXALPQERHG-CYBMUJFWSA-N 1 1 353.488 2.814 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000876734691 732273963 /nfs/dbraw/zinc/27/39/63/732273963.db2.gz ITMCEDPYBFNAOH-AWEZNQCLSA-N 1 1 359.348 2.807 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000876734691 732273966 /nfs/dbraw/zinc/27/39/66/732273966.db2.gz ITMCEDPYBFNAOH-AWEZNQCLSA-N 1 1 359.348 2.807 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877834966 732444348 /nfs/dbraw/zinc/44/43/48/732444348.db2.gz CDHSIQWABNQIKT-LLVKDONJSA-N 1 1 360.357 2.798 20 5 FFBDMO COC[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878123033 732486208 /nfs/dbraw/zinc/48/62/08/732486208.db2.gz OTBSALJHUJFFQO-JTQLQIEISA-N 1 1 352.778 2.767 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@](O)(c2ccc(Cl)cc2)C1 ZINC000878802346 732596476 /nfs/dbraw/zinc/59/64/76/732596476.db2.gz FKSFHYGJWBIKOA-KRWDZBQOSA-N 1 1 364.833 2.737 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000878836095 732602638 /nfs/dbraw/zinc/60/26/38/732602638.db2.gz HUCWATGRXBZBDR-FRRDWIJNSA-N 1 1 368.865 2.990 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C(C)(C)C ZINC000878841804 732603454 /nfs/dbraw/zinc/60/34/54/732603454.db2.gz ZTWAXPJSKFGJQB-OAHLLOKOSA-N 1 1 368.865 2.849 20 5 FFBDMO NC(=O)[C@H](F)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000879043621 732636003 /nfs/dbraw/zinc/63/60/03/732636003.db2.gz JMDFJIAPIPOQBB-CYBMUJFWSA-N 1 1 363.311 2.649 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879560976 732723349 /nfs/dbraw/zinc/72/33/49/732723349.db2.gz JSVSCEVMOKQDBT-QWHCGFSZSA-N 1 1 365.455 2.617 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000880437537 732908088 /nfs/dbraw/zinc/90/80/88/732908088.db2.gz MMQLHCIJCCPMNS-TZMCWYRMSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269585 733767945 /nfs/dbraw/zinc/76/79/45/733767945.db2.gz ZMPFJTBNDAPFKV-OCCSQVGLSA-N 1 1 350.419 2.867 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269585 733767947 /nfs/dbraw/zinc/76/79/47/733767947.db2.gz ZMPFJTBNDAPFKV-OCCSQVGLSA-N 1 1 350.419 2.867 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000927645663 738764845 /nfs/dbraw/zinc/76/48/45/738764845.db2.gz PBQMBTAPKYUONC-ZDUSSCGKSA-N 1 1 368.821 2.623 20 5 FFBDMO COc1c(O)ccc(CNC[C@@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200029 734667080 /nfs/dbraw/zinc/66/70/80/734667080.db2.gz LISATHOMXTZGEM-AWEZNQCLSA-N 1 1 351.447 2.767 20 5 FFBDMO CC(C)[N@@H+](C)CCCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000731970319 734710619 /nfs/dbraw/zinc/71/06/19/734710619.db2.gz XORWQJUPOATTMF-UHFFFAOYSA-N 1 1 365.402 2.733 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735491017 734948073 /nfs/dbraw/zinc/94/80/73/734948073.db2.gz ZZJIATBZBNXKPU-QWHCGFSZSA-N 1 1 369.849 2.611 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735491016 734948090 /nfs/dbraw/zinc/94/80/90/734948090.db2.gz ZZJIATBZBNXKPU-OLZOCXBDSA-N 1 1 369.849 2.611 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c(C(F)(F)F)c1 ZINC000896521037 735172477 /nfs/dbraw/zinc/17/24/77/735172477.db2.gz CAKQQGUZQWCOQE-NSHDSACASA-N 1 1 360.336 2.674 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756790247 736361474 /nfs/dbraw/zinc/36/14/74/736361474.db2.gz PXYXJALCEZQAFC-CYBMUJFWSA-N 1 1 356.879 2.697 20 5 FFBDMO O=[N+]([O-])c1ccc(NC(=S)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1 ZINC000763129416 736904675 /nfs/dbraw/zinc/90/46/75/736904675.db2.gz MGYMMSNZKMLIEF-HZPDHXFCSA-N 1 1 364.471 2.525 20 5 FFBDMO COC[C@H]1CCCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767951954 737385691 /nfs/dbraw/zinc/38/56/91/737385691.db2.gz ZSPSRFPBCOACFD-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767951954 737385694 /nfs/dbraw/zinc/38/56/94/737385694.db2.gz ZSPSRFPBCOACFD-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000913538110 737417228 /nfs/dbraw/zinc/41/72/28/737417228.db2.gz SYONPFTVPSYBPD-OKILXGFUSA-N 1 1 358.423 2.637 20 5 FFBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000913538110 737417231 /nfs/dbraw/zinc/41/72/31/737417231.db2.gz SYONPFTVPSYBPD-OKILXGFUSA-N 1 1 358.423 2.637 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000773917932 737945107 /nfs/dbraw/zinc/94/51/07/737945107.db2.gz AXWLQBFNNVEIHR-FUHWJXTLSA-N 1 1 350.415 2.539 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCS[C@@H]4COCC[C@@H]43)c2)c1 ZINC000777963191 738335730 /nfs/dbraw/zinc/33/57/30/738335730.db2.gz IDFGLOMOXRFWEV-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)c2)c1 ZINC000777963191 738335732 /nfs/dbraw/zinc/33/57/32/738335732.db2.gz IDFGLOMOXRFWEV-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO C[C@@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000923982878 738352759 /nfs/dbraw/zinc/35/27/59/738352759.db2.gz IYJPYGBXHDGTAL-XPKDYRNWSA-N 1 1 364.471 2.535 20 5 FFBDMO C[C@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)C1 ZINC000778231250 738365422 /nfs/dbraw/zinc/36/54/22/738365422.db2.gz FKQDNZCHWLLUPM-QWHCGFSZSA-N 1 1 355.385 2.923 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](CCOC2CCSCC2)CC1 ZINC000929246216 738959654 /nfs/dbraw/zinc/95/96/54/738959654.db2.gz DEYJKZXWFARQEW-UHFFFAOYSA-N 1 1 351.472 2.629 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000929342933 738973357 /nfs/dbraw/zinc/97/33/57/738973357.db2.gz UPAACDFKMATRCR-UHFFFAOYSA-N 1 1 370.247 2.705 20 5 FFBDMO COCC[N@H+](Cc1scnc1C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000785989776 739017312 /nfs/dbraw/zinc/01/73/12/739017312.db2.gz BMOZCTULWGEUSH-OAHLLOKOSA-N 1 1 351.428 2.542 20 5 FFBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932170548 739398104 /nfs/dbraw/zinc/39/81/04/739398104.db2.gz GKKRTJNQOVZRDE-GJZGRUSLSA-N 1 1 352.431 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CCCO2)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871479 739714260 /nfs/dbraw/zinc/71/42/60/739714260.db2.gz LPUOZHMMCUXXAW-HUUCEWRRSA-N 1 1 367.427 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCCO2)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871479 739714264 /nfs/dbraw/zinc/71/42/64/739714264.db2.gz LPUOZHMMCUXXAW-HUUCEWRRSA-N 1 1 367.427 2.990 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792925004 739719453 /nfs/dbraw/zinc/71/94/53/739719453.db2.gz JQKAVNJOTOLRMA-UKRRQHHQSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792925004 739719457 /nfs/dbraw/zinc/71/94/57/739719457.db2.gz JQKAVNJOTOLRMA-UKRRQHHQSA-N 1 1 353.806 2.830 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCSC[C@H]2C)c([N+](=O)[O-])c1 ZINC000934299080 739762409 /nfs/dbraw/zinc/76/24/09/739762409.db2.gz CCPXVGZCTYMEPJ-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934331826 739766740 /nfs/dbraw/zinc/76/67/40/739766740.db2.gz FRJZFJRVPHRMIU-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934331826 739766741 /nfs/dbraw/zinc/76/67/41/739766741.db2.gz FRJZFJRVPHRMIU-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796165545 740110498 /nfs/dbraw/zinc/11/04/98/740110498.db2.gz VQWHUDLARDRJRP-HNNXBMFYSA-N 1 1 351.403 2.574 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCC[C@H]2COC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000796554593 740153353 /nfs/dbraw/zinc/15/33/53/740153353.db2.gz QEOOTQJCDFDIBB-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1ccc(C[N@H+]2CCCC[C@H]2COC(=O)N(C)C)cc1[N+](=O)[O-] ZINC000796554593 740153354 /nfs/dbraw/zinc/15/33/54/740153354.db2.gz QEOOTQJCDFDIBB-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO CCC[N@@H+](C)CC(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000803546392 740809947 /nfs/dbraw/zinc/80/99/47/740809947.db2.gz FZOFLNXRXNTTPK-UHFFFAOYSA-N 1 1 370.247 2.584 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810844739 741455258 /nfs/dbraw/zinc/45/52/58/741455258.db2.gz QOVDCCJGOABDMI-VXGBXAGGSA-N 1 1 356.325 2.980 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000811448647 741523943 /nfs/dbraw/zinc/52/39/43/741523943.db2.gz ZLBXXYDUZMMBCX-QGZVFWFLSA-N 1 1 352.362 2.533 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000811448647 741523946 /nfs/dbraw/zinc/52/39/46/741523946.db2.gz ZLBXXYDUZMMBCX-QGZVFWFLSA-N 1 1 352.362 2.533 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1Cl ZINC000814908936 741874210 /nfs/dbraw/zinc/87/42/10/741874210.db2.gz HQJPWHOJSCOHQO-KRWDZBQOSA-N 1 1 367.833 2.957 20 5 FFBDMO Cc1cc(N(C)S(=O)(=O)c2cc(Cl)c(F)cc2[N+](=O)[O-])cc[nH+]1 ZINC000815034348 741887996 /nfs/dbraw/zinc/88/79/96/741887996.db2.gz LNGFYLOFAMWXRU-UHFFFAOYSA-N 1 1 359.766 2.916 20 5 FFBDMO Cc1cccc(Cl)c1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005381056 742253267 /nfs/dbraw/zinc/25/32/67/742253267.db2.gz IDKFTAGSNOOHAD-RHSMWYFYSA-N 1 1 365.861 2.736 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl ZINC000819151006 742344170 /nfs/dbraw/zinc/34/41/70/742344170.db2.gz VHEOTJGVJULXLM-QGZVFWFLSA-N 1 1 363.845 2.831 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000822152975 742702776 /nfs/dbraw/zinc/70/27/76/742702776.db2.gz VZSGLPZKJJPSIK-SECBINFHSA-N 1 1 358.801 2.524 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643235 742927641 /nfs/dbraw/zinc/92/76/41/742927641.db2.gz KXBVVRDUSWJTKG-IXYNUQLISA-N 1 1 369.824 2.661 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000823724454 742969799 /nfs/dbraw/zinc/96/97/99/742969799.db2.gz ZEVFBPAERCXZMX-CYBMUJFWSA-N 1 1 369.849 2.643 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCCC[N@H+]1CCO ZINC000824583200 743111339 /nfs/dbraw/zinc/11/13/39/743111339.db2.gz JHYDRLALDSZZLS-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCCC[N@@H+]1CCO ZINC000824583200 743111346 /nfs/dbraw/zinc/11/13/46/743111346.db2.gz JHYDRLALDSZZLS-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3c(Br)cccc3[N+](=O)[O-])CC[C@@H]21 ZINC000827216706 743535226 /nfs/dbraw/zinc/53/52/26/743535226.db2.gz CNUKZOBDCKAFTH-JQWIXIFHSA-N 1 1 368.231 2.524 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000830019986 745295109 /nfs/dbraw/zinc/29/51/09/745295109.db2.gz AEFLQVVWDGXYRQ-UONOGXRCSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000830019986 745295113 /nfs/dbraw/zinc/29/51/13/745295113.db2.gz AEFLQVVWDGXYRQ-UONOGXRCSA-N 1 1 367.496 2.626 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCN(CC(F)(F)F)CC1 ZINC000832621640 745727931 /nfs/dbraw/zinc/72/79/31/745727931.db2.gz YXGCROWQGZNIHI-OAHLLOKOSA-N 1 1 361.364 2.587 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498318 746841023 /nfs/dbraw/zinc/84/10/23/746841023.db2.gz SDRUMQMHTUHIIQ-CABCVRRESA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498318 746841029 /nfs/dbraw/zinc/84/10/29/746841029.db2.gz SDRUMQMHTUHIIQ-CABCVRRESA-N 1 1 355.822 2.812 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000839502879 746841961 /nfs/dbraw/zinc/84/19/61/746841961.db2.gz IEDPIEAYSRRDAM-GXTWGEPZSA-N 1 1 368.865 2.991 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCS(=O)(=O)C3CC3)o2)c1 ZINC000840964099 747244928 /nfs/dbraw/zinc/24/49/28/747244928.db2.gz IEZZAAAHYXVXHA-UHFFFAOYSA-N 1 1 350.396 2.522 20 5 FFBDMO Cc1[nH+]ccn1CCCOc1cc(Br)cc([N+](=O)[O-])c1N ZINC000842050063 747509654 /nfs/dbraw/zinc/50/96/54/747509654.db2.gz FUDYPAQTKMHWEN-UHFFFAOYSA-N 1 1 355.192 2.914 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000844025353 747952904 /nfs/dbraw/zinc/95/29/04/747952904.db2.gz ZAUCHFVGOSNGMA-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000844025353 747952907 /nfs/dbraw/zinc/95/29/07/747952907.db2.gz ZAUCHFVGOSNGMA-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCn2cnc(Br)n2)C2CC2)c1 ZINC000851816291 749686197 /nfs/dbraw/zinc/68/61/97/749686197.db2.gz GDLCZUAJDHRFOW-UHFFFAOYSA-N 1 1 366.219 2.613 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422561 749856671 /nfs/dbraw/zinc/85/66/71/749856671.db2.gz FLELHZMGHJSVSH-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422561 749856674 /nfs/dbraw/zinc/85/66/74/749856674.db2.gz FLELHZMGHJSVSH-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422722 749856694 /nfs/dbraw/zinc/85/66/94/749856694.db2.gz HPDKRBYXLKAPQU-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422722 749856699 /nfs/dbraw/zinc/85/66/99/749856699.db2.gz HPDKRBYXLKAPQU-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852424267 749856908 /nfs/dbraw/zinc/85/69/08/749856908.db2.gz ALMMOYBKNPETQS-BLLLJJGKSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@H]1COC2(CCC2)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852445170 749860966 /nfs/dbraw/zinc/86/09/66/749860966.db2.gz WDXWYZOAWCBDGV-LBPRGKRZSA-N 1 1 351.378 2.706 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])CC2)C1 ZINC000853341740 750050698 /nfs/dbraw/zinc/05/06/98/750050698.db2.gz VLFAEEIFHKWDFW-CQSZACIVSA-N 1 1 354.401 2.749 20 5 FFBDMO Cc1cc(NC[C@@H]2CC[N@@H+]2C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000896520514 971534967 /nfs/dbraw/zinc/53/49/67/971534967.db2.gz DALUVAPWFDVKAW-INIZCTEOSA-N 1 1 356.426 2.539 20 5 FFBDMO Cc1cc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000896520514 971534976 /nfs/dbraw/zinc/53/49/76/971534976.db2.gz DALUVAPWFDVKAW-INIZCTEOSA-N 1 1 356.426 2.539 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000120098789 958860717 /nfs/dbraw/zinc/86/07/17/958860717.db2.gz SYRLSGNTKNCUSP-GUYCJALGSA-N 1 1 357.385 2.984 20 5 FFBDMO O=[N+]([O-])c1cc(-c2ccc(N3CCc4[nH+]ccn4CC3)nn2)ccc1Cl ZINC001167181464 960367619 /nfs/dbraw/zinc/36/76/19/960367619.db2.gz BIZJKFRBODOMRF-UHFFFAOYSA-N 1 1 370.800 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H](c3ccncc3)C3(CO)CCC3)nc2c1 ZINC001174891829 1013333841 /nfs/dbraw/zinc/33/38/41/1013333841.db2.gz XFDBMKQOEUHXMW-SFHVURJKSA-N 1 1 367.409 2.860 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001174964780 1013354410 /nfs/dbraw/zinc/35/44/10/1013354410.db2.gz HOYHTNMAXQORLR-CQSZACIVSA-N 1 1 358.398 2.527 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226927 962759484 /nfs/dbraw/zinc/75/94/84/962759484.db2.gz CDSMSRAZFPCNML-AUUYWEPGSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226927 962759497 /nfs/dbraw/zinc/75/94/97/962759497.db2.gz CDSMSRAZFPCNML-AUUYWEPGSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C ZINC001175390986 1013467893 /nfs/dbraw/zinc/46/78/93/1013467893.db2.gz UPWAULQUHBCLGL-ZIAGYGMSSA-N 1 1 367.446 2.815 20 5 FFBDMO CC[C@H](c1ccc(F)cc1)[NH+]1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC001175906274 1013586498 /nfs/dbraw/zinc/58/64/98/1013586498.db2.gz GYRWPLRTIXHNHW-QGZVFWFLSA-N 1 1 361.421 2.736 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C2)c1[N+](=O)[O-] ZINC001176745583 1013764956 /nfs/dbraw/zinc/76/49/56/1013764956.db2.gz WKBIZHKFABUOPJ-CHWSQXEVSA-N 1 1 366.418 2.580 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C2)c1[N+](=O)[O-] ZINC001176745583 1013764962 /nfs/dbraw/zinc/76/49/62/1013764962.db2.gz WKBIZHKFABUOPJ-CHWSQXEVSA-N 1 1 366.418 2.580 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1C[N@@H+](C)CCN1C ZINC000895247766 968761957 /nfs/dbraw/zinc/76/19/57/968761957.db2.gz WFFKBKSARSTFMK-YOEHRIQHSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895247766 968761962 /nfs/dbraw/zinc/76/19/62/968761962.db2.gz WFFKBKSARSTFMK-YOEHRIQHSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1CN(C)CC[N@H+]1C ZINC000895247766 968761971 /nfs/dbraw/zinc/76/19/71/968761971.db2.gz WFFKBKSARSTFMK-YOEHRIQHSA-N 1 1 355.442 2.703 20 5 FFBDMO Cc1cc(C)c(OC(=O)[C@@H]2CC[N@H+](C)C[C@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000875062454 1013960285 /nfs/dbraw/zinc/96/02/85/1013960285.db2.gz UPODVVIIRNWLCB-CVEARBPZSA-N 1 1 372.425 2.586 20 5 FFBDMO COCc1ncc2c(n1)CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C2 ZINC000895414266 970597783 /nfs/dbraw/zinc/59/77/83/970597783.db2.gz CCAKGYAOWWKKDW-RIYZIHGNSA-N 1 1 354.410 2.993 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313084850 972643600 /nfs/dbraw/zinc/64/36/00/972643600.db2.gz XHVWLXQZHIKJFD-GDBMZVCRSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000897016386 973155258 /nfs/dbraw/zinc/15/52/58/973155258.db2.gz GRHSAGVYWSAMQL-YOEHRIQHSA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897060585 973205365 /nfs/dbraw/zinc/20/53/65/973205365.db2.gz BKDZDDIATZEVTE-AWEZNQCLSA-N 1 1 359.430 2.935 20 5 FFBDMO O=C1CCCN1C1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000104655967 974665879 /nfs/dbraw/zinc/66/58/79/974665879.db2.gz IQYZRZLDHJEDLY-UHFFFAOYSA-N 1 1 369.425 2.503 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000796705372 975546501 /nfs/dbraw/zinc/54/65/01/975546501.db2.gz QBBRUMUXOCMLMG-OAHLLOKOSA-N 1 1 365.430 2.963 20 5 FFBDMO CC(C)Oc1cc(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000842334231 977351675 /nfs/dbraw/zinc/35/16/75/977351675.db2.gz QRAVUBLDWOPNLN-HNNXBMFYSA-N 1 1 366.414 2.648 20 5 FFBDMO CC(C)Oc1cc(C(=O)OC[C@@H]2C[N@H+](C(C)C)CCO2)ccc1[N+](=O)[O-] ZINC000842334231 977351681 /nfs/dbraw/zinc/35/16/81/977351681.db2.gz QRAVUBLDWOPNLN-HNNXBMFYSA-N 1 1 366.414 2.648 20 5 FFBDMO C[C@@H]1CN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000893958851 977615851 /nfs/dbraw/zinc/61/58/51/977615851.db2.gz DYFVSINLNGYQMU-AWEZNQCLSA-N 1 1 370.453 2.757 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687086 1014677609 /nfs/dbraw/zinc/67/76/09/1014677609.db2.gz DBINMQBFJGUUFV-MSOLQXFVSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687086 1014677615 /nfs/dbraw/zinc/67/76/15/1014677615.db2.gz DBINMQBFJGUUFV-MSOLQXFVSA-N 1 1 354.410 2.599 20 5 FFBDMO CC(C)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC(C)(C)C ZINC001168202033 981062787 /nfs/dbraw/zinc/06/27/87/981062787.db2.gz PUZGUIWMUBOZDI-UHFFFAOYSA-N 1 1 365.430 2.976 20 5 FFBDMO CC(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC(C)(C)C ZINC001168202033 981062791 /nfs/dbraw/zinc/06/27/91/981062791.db2.gz PUZGUIWMUBOZDI-UHFFFAOYSA-N 1 1 365.430 2.976 20 5 FFBDMO CCCCCNC(=O)C1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000054489977 981359511 /nfs/dbraw/zinc/35/95/11/981359511.db2.gz KFJGWNFZROBDLC-UHFFFAOYSA-N 1 1 373.457 2.920 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC000908308702 981412575 /nfs/dbraw/zinc/41/25/75/981412575.db2.gz ZSAOCZLJAFVXBO-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@H](C)C1 ZINC000910270148 981880290 /nfs/dbraw/zinc/88/02/90/981880290.db2.gz KXVPDQBLAKPZSF-CYBMUJFWSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[N@@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000910270148 981880297 /nfs/dbraw/zinc/88/02/97/981880297.db2.gz KXVPDQBLAKPZSF-CYBMUJFWSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000910270148 981880303 /nfs/dbraw/zinc/88/03/03/981880303.db2.gz KXVPDQBLAKPZSF-CYBMUJFWSA-N 1 1 357.414 2.541 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000826010374 1014842929 /nfs/dbraw/zinc/84/29/29/1014842929.db2.gz PDGMGSAOEYGAIB-HNNXBMFYSA-N 1 1 372.425 2.818 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000045518938 984454767 /nfs/dbraw/zinc/45/47/67/984454767.db2.gz HAMODZFHIWPORI-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2cccc3ccccc32)CC1 ZINC000997771527 985733663 /nfs/dbraw/zinc/73/36/63/985733663.db2.gz HWENBUVXYDNCFV-WOJBJXKFSA-N 1 1 367.449 2.833 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547153 985878807 /nfs/dbraw/zinc/87/88/07/985878807.db2.gz VDODDESSZBNWOG-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547153 985878820 /nfs/dbraw/zinc/87/88/20/985878820.db2.gz VDODDESSZBNWOG-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913685611 986826443 /nfs/dbraw/zinc/82/64/43/986826443.db2.gz YRBJLEIWMWMYRH-ROUUACIJSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1cc(F)cc([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913685611 986826455 /nfs/dbraw/zinc/82/64/55/986826455.db2.gz YRBJLEIWMWMYRH-ROUUACIJSA-N 1 1 355.369 2.833 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000765943200 987206029 /nfs/dbraw/zinc/20/60/29/987206029.db2.gz HBOFQJAEICZXOR-CQSZACIVSA-N 1 1 362.386 2.558 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000130277324 987580524 /nfs/dbraw/zinc/58/05/24/987580524.db2.gz MVSHGEURNXLLOJ-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000915297943 988396248 /nfs/dbraw/zinc/39/62/48/988396248.db2.gz DLLSLDBKXRXSDX-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO C/C(=C\C(=O)NCCC[N@H+]1CCCO[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000762612346 988512456 /nfs/dbraw/zinc/51/24/56/988512456.db2.gz KSQLXDAWSVRMPA-QJPKHSJYSA-N 1 1 361.442 2.615 20 5 FFBDMO CC[N@@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@H]1C(C)C ZINC000922392709 988553410 /nfs/dbraw/zinc/55/34/10/988553410.db2.gz GOGRAJNCOPJJOR-NCXUSEDFSA-N 1 1 365.449 2.693 20 5 FFBDMO CC[N@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@H]1C(C)C ZINC000922392709 988553417 /nfs/dbraw/zinc/55/34/17/988553417.db2.gz GOGRAJNCOPJJOR-NCXUSEDFSA-N 1 1 365.449 2.693 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000922748262 988865544 /nfs/dbraw/zinc/86/55/44/988865544.db2.gz QVPSERTXLJFFJN-HNNXBMFYSA-N 1 1 358.398 2.812 20 5 FFBDMO CCCc1ccc(C[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001005381496 989740152 /nfs/dbraw/zinc/74/01/52/989740152.db2.gz LTBYBXWQBDELLX-RTBURBONSA-N 1 1 359.470 2.727 20 5 FFBDMO CCc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cc1 ZINC001034816334 990276336 /nfs/dbraw/zinc/27/63/36/990276336.db2.gz NFOFHWPLZBFYSW-WOJBJXKFSA-N 1 1 367.449 2.820 20 5 FFBDMO CC1(C)CCC(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)CC1 ZINC001035704239 990528665 /nfs/dbraw/zinc/52/86/65/990528665.db2.gz HKQUQNCPRSCMGX-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373105464 990716929 /nfs/dbraw/zinc/71/69/29/990716929.db2.gz YHCHDCTWFNWBKQ-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373105464 990716935 /nfs/dbraw/zinc/71/69/35/990716935.db2.gz YHCHDCTWFNWBKQ-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000919763098 990725548 /nfs/dbraw/zinc/72/55/48/990725548.db2.gz QXXNIQWKMCUEAV-XJKSGUPXSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1noc(COC(=O)[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000923851165 990840661 /nfs/dbraw/zinc/84/06/61/990840661.db2.gz QJWGWUGKVSQISP-DOMZBBRYSA-N 1 1 359.382 2.703 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000920451836 990850917 /nfs/dbraw/zinc/85/09/17/990850917.db2.gz URKZVMZHKPAPTQ-HNNXBMFYSA-N 1 1 373.457 2.715 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC000879575105 1015592932 /nfs/dbraw/zinc/59/29/32/1015592932.db2.gz GONKOHABASDEKG-XPKDYRNWSA-N 1 1 357.414 2.732 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000880028524 1015737564 /nfs/dbraw/zinc/73/75/64/1015737564.db2.gz ZMZVZTLMJZCNCT-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)COc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001116100048 1032127080 /nfs/dbraw/zinc/12/70/80/1032127080.db2.gz BGUHTRFSBYEPPT-OAHLLOKOSA-N 1 1 370.409 2.780 20 5 FFBDMO O=C(NC1CC1)OC[C@@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000810037958 994683733 /nfs/dbraw/zinc/68/37/33/994683733.db2.gz YDDRFRZGLXGQFS-HNNXBMFYSA-N 1 1 363.414 2.717 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810844484 994951137 /nfs/dbraw/zinc/95/11/37/994951137.db2.gz NWXKAYNKIOHPBR-HZPDHXFCSA-N 1 1 356.382 2.564 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810844092 994951779 /nfs/dbraw/zinc/95/17/79/994951779.db2.gz ZZGGYGNEJDKQIM-LSDHHAIUSA-N 1 1 356.382 2.564 20 5 FFBDMO Cn1cc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810848503 994953473 /nfs/dbraw/zinc/95/34/73/994953473.db2.gz VSJLCJMOPDGURP-HZPDHXFCSA-N 1 1 370.409 2.779 20 5 FFBDMO COC(=O)c1cc(NC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000813009015 995597095 /nfs/dbraw/zinc/59/70/95/995597095.db2.gz CWWSWKMNKHLROF-QGZVFWFLSA-N 1 1 367.377 2.532 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000727767344 995938902 /nfs/dbraw/zinc/93/89/02/995938902.db2.gz WWCOHFLDXXBWKH-MRXNPFEDSA-N 1 1 368.437 2.880 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1CCCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054265184 1015996478 /nfs/dbraw/zinc/99/64/78/1015996478.db2.gz HIKXRVQZGYVRHQ-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CC1CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054265184 1015996487 /nfs/dbraw/zinc/99/64/87/1015996487.db2.gz HIKXRVQZGYVRHQ-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054265184 1015996491 /nfs/dbraw/zinc/99/64/91/1015996491.db2.gz HIKXRVQZGYVRHQ-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(N)=O ZINC000824608145 997009122 /nfs/dbraw/zinc/00/91/22/997009122.db2.gz BITVRKKFIOLLMW-GFCCVEGCSA-N 1 1 364.402 2.617 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(N)=O ZINC000824608145 997009133 /nfs/dbraw/zinc/00/91/33/997009133.db2.gz BITVRKKFIOLLMW-GFCCVEGCSA-N 1 1 364.402 2.617 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cn1 ZINC000731456653 997950977 /nfs/dbraw/zinc/95/09/77/997950977.db2.gz ADAKDKDTSDTYET-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000734145942 999216629 /nfs/dbraw/zinc/21/66/29/999216629.db2.gz AYHFELWFOYWRRM-AWEZNQCLSA-N 1 1 352.398 2.521 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1 ZINC000742423416 999773407 /nfs/dbraw/zinc/77/34/07/999773407.db2.gz PQVOWLLCHCYXKD-CQSZACIVSA-N 1 1 353.382 2.842 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC[C@H]21 ZINC001169010725 1000015434 /nfs/dbraw/zinc/01/54/34/1000015434.db2.gz FUIAMHHSKRWEKK-KLHDSHLOSA-N 1 1 353.463 2.763 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCN(Cc3ccncc3)c3ncccc3C2)C1 ZINC001169019627 1000017610 /nfs/dbraw/zinc/01/76/10/1000017610.db2.gz GYPXVDAEUCDBIS-MJGOQNOKSA-N 1 1 367.453 2.744 20 5 FFBDMO CCn1ncc2c1C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169021687 1000017655 /nfs/dbraw/zinc/01/76/55/1000017655.db2.gz PKYRZNXQZPFUHB-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO CCn1ncc2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169021687 1000017657 /nfs/dbraw/zinc/01/76/57/1000017657.db2.gz PKYRZNXQZPFUHB-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024549 1000017906 /nfs/dbraw/zinc/01/79/06/1000017906.db2.gz XAQVAYBZNGNWSS-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024549 1000017907 /nfs/dbraw/zinc/01/79/07/1000017907.db2.gz XAQVAYBZNGNWSS-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767618680 1000131738 /nfs/dbraw/zinc/13/17/38/1000131738.db2.gz WRNZJEXBMXGRAQ-UHFFFAOYSA-N 1 1 355.354 2.533 20 5 FFBDMO COc1cccc(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)c1[N+](=O)[O-] ZINC000767619452 1000131786 /nfs/dbraw/zinc/13/17/86/1000131786.db2.gz BYQJTACDNGLSFT-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](c2ccncc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000846908639 1000484744 /nfs/dbraw/zinc/48/47/44/1000484744.db2.gz WDHXKEFQUAWFLM-CQSZACIVSA-N 1 1 358.373 2.947 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000676231 1016422362 /nfs/dbraw/zinc/42/23/62/1016422362.db2.gz ZRYGZBBNEJOPNS-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCC1=CC[N@H+](Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000676231 1016422369 /nfs/dbraw/zinc/42/23/69/1016422369.db2.gz ZRYGZBBNEJOPNS-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000676231 1016422382 /nfs/dbraw/zinc/42/23/82/1016422382.db2.gz ZRYGZBBNEJOPNS-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nnc(-c4cccc(F)c4)o3)CC2)n1 ZINC000785861546 1001497928 /nfs/dbraw/zinc/49/79/28/1001497928.db2.gz FAEDLIQQRBMCCS-UHFFFAOYSA-N 1 1 372.360 2.818 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 ZINC001116135622 1032148060 /nfs/dbraw/zinc/14/80/60/1032148060.db2.gz GKXMHVMBMQOSQW-UHFFFAOYSA-N 1 1 352.394 2.940 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1OC ZINC000788113771 1001763260 /nfs/dbraw/zinc/76/32/60/1001763260.db2.gz BWRPFHAQPZZLTL-QWHCGFSZSA-N 1 1 364.398 2.786 20 5 FFBDMO COc1c(O)ccc(C[N@H+](C)C[C@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001183168948 1002198044 /nfs/dbraw/zinc/19/80/44/1002198044.db2.gz AWNQEAKRNMGHIE-NSHDSACASA-N 1 1 369.418 2.654 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001183168948 1002198047 /nfs/dbraw/zinc/19/80/47/1002198047.db2.gz AWNQEAKRNMGHIE-NSHDSACASA-N 1 1 369.418 2.654 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(c2ccc([N+](=O)[O-])c3nonc32)CC1 ZINC000774736878 1002554662 /nfs/dbraw/zinc/55/46/62/1002554662.db2.gz SBPVNQQYXYICAF-UHFFFAOYSA-N 1 1 355.354 2.882 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791208354 1002617931 /nfs/dbraw/zinc/61/79/31/1002617931.db2.gz HIPICOKYZPVVDL-STQMWFEESA-N 1 1 366.437 2.650 20 5 FFBDMO COC(=O)[C@@H]1CC[C@@H](C)[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170336151 1003117769 /nfs/dbraw/zinc/11/77/69/1003117769.db2.gz UUYHXSMASAVHFH-VNHYZAJKSA-N 1 1 350.415 2.808 20 5 FFBDMO COCC[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCN(C)CC1 ZINC001170342100 1003130388 /nfs/dbraw/zinc/13/03/88/1003130388.db2.gz MAKQEJLLQJLDNU-HNNXBMFYSA-N 1 1 365.474 2.577 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])c3cnccc13)C2 ZINC001186895522 1003462476 /nfs/dbraw/zinc/46/24/76/1003462476.db2.gz GEXJGDOWZVSXKB-CYBMUJFWSA-N 1 1 367.409 2.610 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001399995 1016782350 /nfs/dbraw/zinc/78/23/50/1016782350.db2.gz PATXVIWXAOMXTO-RTBURBONSA-N 1 1 357.454 2.557 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001198148090 1004508459 /nfs/dbraw/zinc/50/84/59/1004508459.db2.gz VRIHBPVZOJHJLU-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001198148090 1004508467 /nfs/dbraw/zinc/50/84/67/1004508467.db2.gz VRIHBPVZOJHJLU-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F ZINC001050326127 1016968081 /nfs/dbraw/zinc/96/80/81/1016968081.db2.gz SGPIGICHXRXOHV-GFOCRRMGSA-N 1 1 363.433 2.564 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001490372577 1005701320 /nfs/dbraw/zinc/70/13/20/1005701320.db2.gz SWURKIUAYVWRBP-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCCC[N@H+](Cc1ccc2ccccc2c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001490372577 1005701321 /nfs/dbraw/zinc/70/13/21/1005701321.db2.gz SWURKIUAYVWRBP-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001490372577 1005701323 /nfs/dbraw/zinc/70/13/23/1005701323.db2.gz SWURKIUAYVWRBP-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO C[N@H+](Cc1cnn(-c2ccccc2)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575305 1005953601 /nfs/dbraw/zinc/95/36/01/1005953601.db2.gz PUYUOJIKZDRPIJ-LJQANCHMSA-N 1 1 352.394 2.946 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000852497647 1006054636 /nfs/dbraw/zinc/05/46/36/1006054636.db2.gz XHRRMYZCUHZKEY-BDXSIMOUSA-N 1 1 362.426 2.682 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(c3ccnc(F)c3[N+](=O)[O-])CC2)cc1 ZINC000881780971 1006215068 /nfs/dbraw/zinc/21/50/68/1006215068.db2.gz IAUZVRGXOGOSFY-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO Cc1cccc(CCC[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c1 ZINC001050516791 1017035811 /nfs/dbraw/zinc/03/58/11/1017035811.db2.gz JUWXBNDDQDUUIY-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3ccccn3)C2)nc1-c1ccccn1 ZINC000853510844 1006421480 /nfs/dbraw/zinc/42/14/80/1006421480.db2.gz MGGMXWKTSQQNHK-AWEZNQCLSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3ccccn3)C2)nc1-c1ccccn1 ZINC000853510844 1006421486 /nfs/dbraw/zinc/42/14/86/1006421486.db2.gz MGGMXWKTSQQNHK-AWEZNQCLSA-N 1 1 350.382 2.695 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000853569743 1006449730 /nfs/dbraw/zinc/44/97/30/1006449730.db2.gz ARSSUAKCBWTVRW-ZFWWWQNUSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000853569743 1006449738 /nfs/dbraw/zinc/44/97/38/1006449738.db2.gz ARSSUAKCBWTVRW-ZFWWWQNUSA-N 1 1 361.398 2.741 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980906 1006588071 /nfs/dbraw/zinc/58/80/71/1006588071.db2.gz WTWNHDXAGZFGAR-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980906 1006588080 /nfs/dbraw/zinc/58/80/80/1006588080.db2.gz WTWNHDXAGZFGAR-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO CO[C@@H]1CCC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092419 1006898183 /nfs/dbraw/zinc/89/81/83/1006898183.db2.gz CMNAMOMJJJFGRZ-NXHRZFHOSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@@H]1CCC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092419 1006898194 /nfs/dbraw/zinc/89/81/94/1006898194.db2.gz CMNAMOMJJJFGRZ-NXHRZFHOSA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001189253715 1006976948 /nfs/dbraw/zinc/97/69/48/1006976948.db2.gz OXGOZMKJXZWKEB-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H]1C[C@@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000817376775 1007569467 /nfs/dbraw/zinc/56/94/67/1007569467.db2.gz CSGCWUUJURQOLU-MCIONIFRSA-N 1 1 367.450 2.620 20 5 FFBDMO C[C@@H]1C[C@@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000817376775 1007569471 /nfs/dbraw/zinc/56/94/71/1007569471.db2.gz CSGCWUUJURQOLU-MCIONIFRSA-N 1 1 367.450 2.620 20 5 FFBDMO CCN(CC(F)(F)F)C(=O)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886020917 1008518660 /nfs/dbraw/zinc/51/86/60/1008518660.db2.gz KLRRBIBFHHDWJF-ZDUSSCGKSA-N 1 1 374.363 2.613 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000822089200 1008519826 /nfs/dbraw/zinc/51/98/26/1008519826.db2.gz IUUYQVAXQCTWSQ-QGZVFWFLSA-N 1 1 357.385 2.840 20 5 FFBDMO O=C(C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)NCc1ccccc1 ZINC001177244524 1008536002 /nfs/dbraw/zinc/53/60/02/1008536002.db2.gz BAPHSLCOAYTVFP-UHFFFAOYSA-N 1 1 365.336 2.602 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859613053 1008588539 /nfs/dbraw/zinc/58/85/39/1008588539.db2.gz VZKZAGFPRUOJHC-KBRIMQKVSA-N 1 1 364.442 2.928 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000137512937 1008617262 /nfs/dbraw/zinc/61/72/62/1008617262.db2.gz LBFADFHJRCWQJZ-GDBMZVCRSA-N 1 1 368.437 2.878 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000886435556 1008681752 /nfs/dbraw/zinc/68/17/52/1008681752.db2.gz BVHDBXFCHFIUAM-QGZVFWFLSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000886435556 1008681761 /nfs/dbraw/zinc/68/17/61/1008681761.db2.gz BVHDBXFCHFIUAM-QGZVFWFLSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000886435532 1008682382 /nfs/dbraw/zinc/68/23/82/1008682382.db2.gz BBZBMNAGPIMKGJ-GOSISDBHSA-N 1 1 357.410 2.531 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000886435532 1008682386 /nfs/dbraw/zinc/68/23/86/1008682386.db2.gz BBZBMNAGPIMKGJ-GOSISDBHSA-N 1 1 357.410 2.531 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000886592841 1008762968 /nfs/dbraw/zinc/76/29/68/1008762968.db2.gz CIWNFSGPYYOWNM-AWEZNQCLSA-N 1 1 372.425 2.651 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178463898 1008996603 /nfs/dbraw/zinc/99/66/03/1008996603.db2.gz MJBIZABHTPBNDQ-IAGOWNOFSA-N 1 1 351.422 2.566 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000823921564 1009283160 /nfs/dbraw/zinc/28/31/60/1009283160.db2.gz YIBCCMDAANBTDC-INIZCTEOSA-N 1 1 369.425 2.568 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000823921564 1009283171 /nfs/dbraw/zinc/28/31/71/1009283171.db2.gz YIBCCMDAANBTDC-INIZCTEOSA-N 1 1 369.425 2.568 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cnn(-c2ccc(F)cc2)c1)c1cccc([N+](=O)[O-])c1 ZINC001179352573 1009314203 /nfs/dbraw/zinc/31/42/03/1009314203.db2.gz GEULBYYAIBGQFJ-LJQANCHMSA-N 1 1 370.384 2.917 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@]1(C)C[C@@H](OC)C[N@H+]1C ZINC000861348301 1009365628 /nfs/dbraw/zinc/36/56/28/1009365628.db2.gz NZBJXQKSXAWCAH-SUMDDJOVSA-N 1 1 364.442 2.816 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)c1C ZINC000887861645 1009656030 /nfs/dbraw/zinc/65/60/30/1009656030.db2.gz YDBIRHSUAQIYHS-ZIAGYGMSSA-N 1 1 363.458 2.829 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000862038202 1009675517 /nfs/dbraw/zinc/67/55/17/1009675517.db2.gz YGHXMCREFKDVAF-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO COC(=O)COc1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001181153819 1009995605 /nfs/dbraw/zinc/99/56/05/1009995605.db2.gz HNAMDJQRFSLYRX-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000863032055 1010089259 /nfs/dbraw/zinc/08/92/59/1010089259.db2.gz DLQGLVJHCMUSSV-CYBMUJFWSA-N 1 1 362.386 2.558 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000863035250 1010091266 /nfs/dbraw/zinc/09/12/66/1010091266.db2.gz UNUNJBKXXUSJEE-QGZVFWFLSA-N 1 1 372.469 2.942 20 5 FFBDMO COc1ccc([C@@H]2CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)cc1 ZINC000794625859 1010446644 /nfs/dbraw/zinc/44/66/44/1010446644.db2.gz CJJKLRASIMSCRT-CQSZACIVSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)cc1 ZINC000794625859 1010446648 /nfs/dbraw/zinc/44/66/48/1010446648.db2.gz CJJKLRASIMSCRT-CQSZACIVSA-N 1 1 369.377 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cnccn3)CC2)c(C(F)F)c1 ZINC000866120353 1010932175 /nfs/dbraw/zinc/93/21/75/1010932175.db2.gz XBYIHVVTPSHGSJ-UHFFFAOYSA-N 1 1 363.368 2.687 20 5 FFBDMO CN1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000867962525 1011133316 /nfs/dbraw/zinc/13/33/16/1011133316.db2.gz QFMQJVWAYLIICH-LJQANCHMSA-N 1 1 354.410 2.642 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001171890043 1011522752 /nfs/dbraw/zinc/52/27/52/1011522752.db2.gz DEJWHOCTZJVRQA-OAHLLOKOSA-N 1 1 353.422 2.966 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001171890043 1011522765 /nfs/dbraw/zinc/52/27/65/1011522765.db2.gz DEJWHOCTZJVRQA-OAHLLOKOSA-N 1 1 353.422 2.966 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870086973 1012116929 /nfs/dbraw/zinc/11/69/29/1012116929.db2.gz HRCPLYLPGRFVIJ-LUQQZNFBSA-N 1 1 367.405 2.877 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@H]21 ZINC001172912619 1012125501 /nfs/dbraw/zinc/12/55/01/1012125501.db2.gz KTESXICHUNMFKP-ZIFCJYIRSA-N 1 1 357.454 2.785 20 5 FFBDMO C[C@@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H]1CO ZINC001173009675 1012179351 /nfs/dbraw/zinc/17/93/51/1012179351.db2.gz HAAJSOCHXHKDPK-SJKOYZFVSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1O ZINC001173010222 1012179369 /nfs/dbraw/zinc/17/93/69/1012179369.db2.gz OAAAXZNQKIHBSE-MEDUHNTESA-N 1 1 355.385 2.545 20 5 FFBDMO C[C@H]1CC[C@H](CO)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009341 1012179583 /nfs/dbraw/zinc/17/95/83/1012179583.db2.gz BHHSUEARBCVSLM-STQMWFEESA-N 1 1 369.412 2.935 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000870138569 1012184582 /nfs/dbraw/zinc/18/45/82/1012184582.db2.gz MPWRKDMXMLWWRX-PHPVXXBSSA-N 1 1 367.405 2.790 20 5 FFBDMO C[C@@H]1CO[C@@H]2C[N@H+](C3CCN(c4c(F)cc([N+](=O)[O-])cc4F)CC3)C[C@H]12 ZINC001173015923 1012186309 /nfs/dbraw/zinc/18/63/09/1012186309.db2.gz WWYLAJDYYQTDQS-JDSLSITLSA-N 1 1 367.396 2.809 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3CCCC[C@@H]3CO)CC2)c(F)c1 ZINC001173014930 1012187669 /nfs/dbraw/zinc/18/76/69/1012187669.db2.gz WPZYYLHCABUVCK-CYBMUJFWSA-N 1 1 355.385 2.689 20 5 FFBDMO CC[N@@H+]([C@@H](C)C(=O)OC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017137 1012189895 /nfs/dbraw/zinc/18/98/95/1012189895.db2.gz XNPVUBZDWKOXKB-NSHDSACASA-N 1 1 371.384 2.725 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173190324 1012331469 /nfs/dbraw/zinc/33/14/69/1012331469.db2.gz SUSLOGAQHRZUOK-CHWSQXEVSA-N 1 1 368.405 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H]3CCCC(=O)[C@H]3C2)c1F ZINC001173194671 1012338086 /nfs/dbraw/zinc/33/80/86/1012338086.db2.gz YBLREOFAKGAITN-OBJOEFQTSA-N 1 1 350.390 2.975 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](c3nc(C)no3)C2)c1F ZINC001173197574 1012340078 /nfs/dbraw/zinc/34/00/78/1012340078.db2.gz UPZIWBKKIMTOLF-CMPLNLGQSA-N 1 1 364.377 2.854 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c1F ZINC001173196574 1012340719 /nfs/dbraw/zinc/34/07/19/1012340719.db2.gz NSRSFARAJAPTBY-GIRXQMHSSA-N 1 1 350.390 2.783 20 5 FFBDMO Cc1noc(C[C@H]2C[C@H]3C[N@H+]([C@@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3O2)n1 ZINC001173223766 1012354807 /nfs/dbraw/zinc/35/48/07/1012354807.db2.gz CJBAHZNKCWEWPF-PWUKJLEFSA-N 1 1 372.425 2.549 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cn(C)nc21 ZINC001173223447 1012356173 /nfs/dbraw/zinc/35/61/73/1012356173.db2.gz FXJMCWBBAJQOGG-WMLDXEAASA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(Cc2ccccn2)CC1 ZINC001173224079 1012357777 /nfs/dbraw/zinc/35/77/77/1012357777.db2.gz LLEOWPIEDMYYBC-INIZCTEOSA-N 1 1 354.454 2.957 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227723 1012362452 /nfs/dbraw/zinc/36/24/52/1012362452.db2.gz VIRLWRKLZXORJF-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227723 1012362465 /nfs/dbraw/zinc/36/24/65/1012362465.db2.gz VIRLWRKLZXORJF-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@H](C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000925235034 1017673084 /nfs/dbraw/zinc/67/30/84/1017673084.db2.gz DQDFZPAOTSMKPS-OAHLLOKOSA-N 1 1 369.425 2.891 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@H]1C[N@H+](C(C)C)CCO1 ZINC000802138835 1019791897 /nfs/dbraw/zinc/79/18/97/1019791897.db2.gz PVFWYZVRTZHDOO-SJLPKXTDSA-N 1 1 364.442 2.816 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)CC[C@@H](O)c1ccccc1 ZINC000930442225 1020035964 /nfs/dbraw/zinc/03/59/64/1020035964.db2.gz WHWBIOZAOLPYIX-UYAOXDASSA-N 1 1 358.438 2.944 20 5 FFBDMO CCc1cccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)c1 ZINC001048525238 1020276458 /nfs/dbraw/zinc/27/64/58/1020276458.db2.gz PNVVRXZAQDVYQN-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1cccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525238 1020276465 /nfs/dbraw/zinc/27/64/65/1020276465.db2.gz PNVVRXZAQDVYQN-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1cccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525238 1020276471 /nfs/dbraw/zinc/27/64/71/1020276471.db2.gz PNVVRXZAQDVYQN-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO C[N@@H+](CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000777954578 1020296101 /nfs/dbraw/zinc/29/61/01/1020296101.db2.gz LGIHMXYHIHDOOG-UHFFFAOYSA-N 1 1 363.364 2.935 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000931308299 1020415315 /nfs/dbraw/zinc/41/53/15/1020415315.db2.gz SLXMNQOGOUOSOC-ZNOIYHFQSA-N 1 1 371.441 2.979 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2cccc(N3CCOCC3)n2)cc([N+](=O)[O-])c1 ZINC000903151277 1020705454 /nfs/dbraw/zinc/70/54/54/1020705454.db2.gz CUDRPBVNBSTXGO-CQSZACIVSA-N 1 1 372.425 2.686 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000900980375 1020763293 /nfs/dbraw/zinc/76/32/93/1020763293.db2.gz KSOASDZKRNVSOL-GASCZTMLSA-N 1 1 363.458 2.831 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000749601111 1021012349 /nfs/dbraw/zinc/01/23/49/1021012349.db2.gz CBZMWIDRQZHYJC-AWEZNQCLSA-N 1 1 367.421 2.884 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001116374421 1021183369 /nfs/dbraw/zinc/18/33/69/1021183369.db2.gz IGKNBNNCJNJSMR-IEBWSBKVSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001116374421 1021183372 /nfs/dbraw/zinc/18/33/72/1021183372.db2.gz IGKNBNNCJNJSMR-IEBWSBKVSA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc(C)[nH+]1 ZINC001116408502 1021203742 /nfs/dbraw/zinc/20/37/42/1021203742.db2.gz FMSBWEOFQUXQSY-UHFFFAOYSA-N 1 1 354.410 2.884 20 5 FFBDMO Cc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc(C)[nH+]1 ZINC001116494741 1021247190 /nfs/dbraw/zinc/24/71/90/1021247190.db2.gz JEGLXPNNYXIVTC-UHFFFAOYSA-N 1 1 364.199 2.972 20 5 FFBDMO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808505 1022397708 /nfs/dbraw/zinc/39/77/08/1022397708.db2.gz DRDBXFBGOZIZDH-WMLDXEAASA-N 1 1 365.405 2.730 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808505 1022397727 /nfs/dbraw/zinc/39/77/27/1022397727.db2.gz DRDBXFBGOZIZDH-WMLDXEAASA-N 1 1 365.405 2.730 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCC1=CCCCC1)CC2 ZINC001040700747 1022954591 /nfs/dbraw/zinc/95/45/91/1022954591.db2.gz QXDQHGIJVUUHBB-QZTJIDSGSA-N 1 1 361.486 2.857 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CCc2ccccc21 ZINC000829359100 1033118861 /nfs/dbraw/zinc/11/88/61/1033118861.db2.gz WPTZGXFVVCNVCU-HXUWFJFHSA-N 1 1 369.421 2.689 20 5 FFBDMO O=C(O[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779207090 1023357682 /nfs/dbraw/zinc/35/76/82/1023357682.db2.gz XLXBUHLVXMAWNP-OAHLLOKOSA-N 1 1 370.361 2.755 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000756953724 1023773483 /nfs/dbraw/zinc/77/34/83/1023773483.db2.gz QBLZZGWHZPYUTK-OAHLLOKOSA-N 1 1 372.381 2.902 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000756953724 1023773488 /nfs/dbraw/zinc/77/34/88/1023773488.db2.gz QBLZZGWHZPYUTK-OAHLLOKOSA-N 1 1 372.381 2.902 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000758158415 1023944787 /nfs/dbraw/zinc/94/47/87/1023944787.db2.gz SJVGFKJBVCKWQN-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)[C@@H]2C1 ZINC001123705340 1023949477 /nfs/dbraw/zinc/94/94/77/1023949477.db2.gz MLSLFPTUOFHCQX-BMGDILEWSA-N 1 1 358.442 2.609 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@H]2C1 ZINC001124025332 1024233111 /nfs/dbraw/zinc/23/31/11/1024233111.db2.gz LHIPJEDIMDSCFM-GZRFBZBPSA-N 1 1 361.445 2.751 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000779867437 1025179471 /nfs/dbraw/zinc/17/94/71/1025179471.db2.gz IJEBYJYBLAXIHK-OAHLLOKOSA-N 1 1 354.414 2.880 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2Cn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000779867437 1025179475 /nfs/dbraw/zinc/17/94/75/1025179475.db2.gz IJEBYJYBLAXIHK-OAHLLOKOSA-N 1 1 354.414 2.880 20 5 FFBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000840117174 1026965142 /nfs/dbraw/zinc/96/51/42/1026965142.db2.gz SKSGVOHMYIMWDP-UAGQMJEPSA-N 1 1 359.430 2.621 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001154937438 1028519160 /nfs/dbraw/zinc/51/91/60/1028519160.db2.gz OFZFKLWNTGHIFI-UHFFFAOYSA-N 1 1 354.288 2.686 20 5 FFBDMO CC(C)(C)CC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162811043 1028663759 /nfs/dbraw/zinc/66/37/59/1028663759.db2.gz XZMLCVXHUDFLRI-QZTJIDSGSA-N 1 1 361.486 2.749 20 5 FFBDMO Cc1c[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1[N+](=O)[O-] ZINC001164485327 1029293426 /nfs/dbraw/zinc/29/34/26/1029293426.db2.gz IJLQOCDLZVBTQD-RCCFBDPRSA-N 1 1 368.437 2.859 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c1 ZINC001165089302 1029381218 /nfs/dbraw/zinc/38/12/18/1029381218.db2.gz TUBMRDFKGLAKAP-GDBMZVCRSA-N 1 1 374.828 2.592 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncnc3cc([N+](=O)[O-])ccc32)CC1 ZINC001165110185 1029396619 /nfs/dbraw/zinc/39/66/19/1029396619.db2.gz YPVHEGWFGHSSEP-INIZCTEOSA-N 1 1 371.441 2.618 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncnc3cc([N+](=O)[O-])ccc32)CC1 ZINC001165110186 1029397212 /nfs/dbraw/zinc/39/72/12/1029397212.db2.gz YPVHEGWFGHSSEP-MRXNPFEDSA-N 1 1 371.441 2.618 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1ccc([N+](=O)[O-])c(N)n1 ZINC001165180454 1029435450 /nfs/dbraw/zinc/43/54/50/1029435450.db2.gz AXOVQHZQXBIURK-PBHICJAKSA-N 1 1 355.442 2.919 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(C(F)(F)c3cnc(Cl)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC001157691519 1029647119 /nfs/dbraw/zinc/64/71/19/1029647119.db2.gz XDXAHMGYPHMBOH-PHIMTYICSA-N 1 1 360.792 2.966 20 5 FFBDMO Cc1[nH+]cc2n1CCN(c1cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n1)C2 ZINC001165385586 1029963973 /nfs/dbraw/zinc/96/39/73/1029963973.db2.gz RJDQZWVFIYHDAM-UHFFFAOYSA-N 1 1 350.382 2.885 20 5 FFBDMO O=C1N(C[NH+]2CCC([C@H]3CCOC3)CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000784004028 1030409624 /nfs/dbraw/zinc/40/96/24/1030409624.db2.gz AXABFMJKVYMUOV-INIZCTEOSA-N 1 1 374.441 2.543 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000842311358 1030679450 /nfs/dbraw/zinc/67/94/50/1030679450.db2.gz WFRCVURZEGBTNL-FGTMMUONSA-N 1 1 362.426 2.598 20 5 FFBDMO C[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C[C@@]1(O)CCc2ccccc21 ZINC000842623976 1030847201 /nfs/dbraw/zinc/84/72/01/1030847201.db2.gz MCONMUJSPGEDSD-IBGZPJMESA-N 1 1 352.394 2.668 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000796705371 1030887016 /nfs/dbraw/zinc/88/70/16/1030887016.db2.gz QBBRUMUXOCMLMG-HNNXBMFYSA-N 1 1 365.430 2.963 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](COC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000842835093 1030986392 /nfs/dbraw/zinc/98/63/92/1030986392.db2.gz DEFWBKVDNMDNCP-AWEZNQCLSA-N 1 1 360.414 2.608 20 5 FFBDMO O=C(CCN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000843363259 1031355290 /nfs/dbraw/zinc/35/52/90/1031355290.db2.gz UVFASRNUZDALMQ-BBRMVZONSA-N 1 1 364.421 2.527 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830183760 1033497936 /nfs/dbraw/zinc/49/79/36/1033497936.db2.gz XLWKJYSKOMIASN-MELADBBJSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830183760 1033497946 /nfs/dbraw/zinc/49/79/46/1033497946.db2.gz XLWKJYSKOMIASN-MELADBBJSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000830183759 1033498294 /nfs/dbraw/zinc/49/82/94/1033498294.db2.gz XLWKJYSKOMIASN-HZSPNIEDSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000830183759 1033498299 /nfs/dbraw/zinc/49/82/99/1033498299.db2.gz XLWKJYSKOMIASN-HZSPNIEDSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@H]([NH3+])c1ncc(C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)s1 ZINC001219255690 1033575355 /nfs/dbraw/zinc/57/53/55/1033575355.db2.gz JTSFMGPFNNPFGM-JTQLQIEISA-N 1 1 364.430 2.853 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]2CC3(CC[C@@H]21)OCCO3 ZINC000832041535 1034511394 /nfs/dbraw/zinc/51/13/94/1034511394.db2.gz XXVHCDFAQKKCPY-CVEARBPZSA-N 1 1 362.426 2.981 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C12CCC2 ZINC000832208862 1034632203 /nfs/dbraw/zinc/63/22/03/1034632203.db2.gz DLDVAIHUFVGTLP-HZPDHXFCSA-N 1 1 365.405 2.952 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001227502283 1035588977 /nfs/dbraw/zinc/58/89/77/1035588977.db2.gz ZPZCNWFDSPQTAZ-WDAIWFPHSA-N 1 1 366.330 2.520 20 5 FFBDMO COC(=O)C1=C[C@H](Oc2ccc([N+](=O)[O-])cc2)C[N@@H+](Cc2ccccc2)C1 ZINC001227524007 1035595247 /nfs/dbraw/zinc/59/52/47/1035595247.db2.gz VYCBCSKHNOIOCW-IBGZPJMESA-N 1 1 368.389 2.957 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3cncc([N+](=O)[O-])c3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001227990343 1035852930 /nfs/dbraw/zinc/85/29/30/1035852930.db2.gz KMUGWQAMEAZHFV-KYNGSXCRSA-N 1 1 353.378 2.743 20 5 FFBDMO Cc1nc(O[C@H]2CCc3[nH+]ccn3C2)c(Br)cc1[N+](=O)[O-] ZINC001228623358 1036213231 /nfs/dbraw/zinc/21/32/31/1036213231.db2.gz OTJQMXBRCZWBME-VIFPVBQESA-N 1 1 353.176 2.651 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001229455650 1036685357 /nfs/dbraw/zinc/68/53/57/1036685357.db2.gz KXPCFAAUCYWHRA-LZLYRXPVSA-N 1 1 355.394 2.518 20 5 FFBDMO Cc1cc(Br)cc([N+](=O)[O-])c1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C ZINC001230934199 1037411805 /nfs/dbraw/zinc/41/18/05/1037411805.db2.gz KUGMSQMQJCOKTL-SUHUHFCYSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1cc(Br)cc([N+](=O)[O-])c1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C ZINC001230934199 1037411814 /nfs/dbraw/zinc/41/18/14/1037411814.db2.gz KUGMSQMQJCOKTL-SUHUHFCYSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1cc(O)c([N+](=O)[O-])c(OC[C@@H]2C[N@H+](Cc3ccccc3)CCCO2)n1 ZINC001231265155 1037518542 /nfs/dbraw/zinc/51/85/42/1037518542.db2.gz ZFRCWTQHASFIRD-INIZCTEOSA-N 1 1 373.409 2.674 20 5 FFBDMO Cc1cc(O)c([N+](=O)[O-])c(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001231265155 1037518546 /nfs/dbraw/zinc/51/85/46/1037518546.db2.gz ZFRCWTQHASFIRD-INIZCTEOSA-N 1 1 373.409 2.674 20 5 FFBDMO CCN1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 ZINC001256095056 1038380507 /nfs/dbraw/zinc/38/05/07/1038380507.db2.gz WRALOMZNMMXMPO-UHFFFAOYSA-N 1 1 362.474 2.600 20 5 FFBDMO CC[N@@H+]1CCCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 ZINC001256095056 1038380520 /nfs/dbraw/zinc/38/05/20/1038380520.db2.gz WRALOMZNMMXMPO-UHFFFAOYSA-N 1 1 362.474 2.600 20 5 FFBDMO CC[N@H+]1CCCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 ZINC001256095056 1038380533 /nfs/dbraw/zinc/38/05/33/1038380533.db2.gz WRALOMZNMMXMPO-UHFFFAOYSA-N 1 1 362.474 2.600 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(Cc2nnc(CC[NH+]3C[C@@H](C)O[C@H](C)C3)o2)c1 ZINC001258089636 1039163742 /nfs/dbraw/zinc/16/37/42/1039163742.db2.gz AKZWGEPJMKRETB-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO N[C@]1(C(F)(F)F)CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246570371 1039401214 /nfs/dbraw/zinc/40/12/14/1039401214.db2.gz POZCQNXWQLIANF-OAHLLOKOSA-N 1 1 358.364 2.529 20 5 FFBDMO [NH3+][C@H](Cc1ccc(F)c(F)c1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001248005084 1040095142 /nfs/dbraw/zinc/09/51/42/1040095142.db2.gz KFOOSVPNZZAZGW-LLVKDONJSA-N 1 1 365.271 2.700 20 5 FFBDMO C[N@@H+]([C@@H]1CCC2(C1)OCCO2)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254483999 1040750188 /nfs/dbraw/zinc/75/01/88/1040750188.db2.gz ZYPNRFMIMYXSLF-GOSISDBHSA-N 1 1 361.442 2.791 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 ZINC001254558495 1040797786 /nfs/dbraw/zinc/79/77/86/1040797786.db2.gz BWSVRNGVIQWKPU-HFTRVMKXSA-N 1 1 366.421 2.516 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C[C@H]2COC ZINC001254563399 1040802241 /nfs/dbraw/zinc/80/22/41/1040802241.db2.gz ZTFBPUOIJFQFPR-HOCLYGCPSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C[C@H]2COC ZINC001254563399 1040802256 /nfs/dbraw/zinc/80/22/56/1040802256.db2.gz ZTFBPUOIJFQFPR-HOCLYGCPSA-N 1 1 358.442 2.988 20 5 FFBDMO COc1cc(C)nc(O[C@@H]2CC[N@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254568508 1040806030 /nfs/dbraw/zinc/80/60/30/1040806030.db2.gz GKHPSJPTXJXPQF-GDBMZVCRSA-N 1 1 372.425 2.786 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593978 1040822915 /nfs/dbraw/zinc/82/29/15/1040822915.db2.gz OPARRKRNDZHZLL-ZACQAIPSSA-N 1 1 359.426 2.756 20 5 FFBDMO O=C(c1ccco1)N1CC[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254593812 1040823096 /nfs/dbraw/zinc/82/30/96/1040823096.db2.gz BXHITUKTUOBVOP-BMGDILEWSA-N 1 1 367.405 2.502 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH2+]Cc1nccc(OCC(F)(F)F)n1)C2 ZINC001254596388 1040825336 /nfs/dbraw/zinc/82/53/36/1040825336.db2.gz CXNVAAMPEOFQTA-GFCCVEGCSA-N 1 1 368.315 2.583 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254601375 1040832336 /nfs/dbraw/zinc/83/23/36/1040832336.db2.gz YZEYEOSWEWKRCV-DYVFJYSZSA-N 1 1 361.442 2.909 20 5 FFBDMO Cc1nccnc1O[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611805 1040841620 /nfs/dbraw/zinc/84/16/20/1040841620.db2.gz TUQCUNWPNNYOSK-ZWKOTPCHSA-N 1 1 354.410 2.704 20 5 FFBDMO Cc1nccnc1O[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611802 1040842365 /nfs/dbraw/zinc/84/23/65/1040842365.db2.gz TUQCUNWPNNYOSK-ROUUACIJSA-N 1 1 354.410 2.704 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)[C@H]2C1 ZINC001538046059 1070324601 /nfs/dbraw/zinc/32/46/01/1070324601.db2.gz GUMXWPGOKJRZEV-WBAXXEDZSA-N 1 1 372.469 2.655 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c(F)c1N1CCOCC1 ZINC001262678647 1041789433 /nfs/dbraw/zinc/78/94/33/1041789433.db2.gz IXWLTGOIKHIGFF-DZGCQCFKSA-N 1 1 364.421 2.609 20 5 FFBDMO CC[N@H+]1CCC[C@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001313895000 1044439932 /nfs/dbraw/zinc/43/99/32/1044439932.db2.gz FOTAKDIFAHZPED-KRWDZBQOSA-N 1 1 370.457 2.938 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001319335427 1045114395 /nfs/dbraw/zinc/11/43/95/1045114395.db2.gz CYJIAMOYOBEYEO-OAHLLOKOSA-N 1 1 360.458 2.988 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@@H]3CCCC[C@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001318012021 1045191342 /nfs/dbraw/zinc/19/13/42/1045191342.db2.gz AEBIYFKNEGHRDO-ZQIUZPCESA-N 1 1 357.410 2.739 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001319572175 1045199265 /nfs/dbraw/zinc/19/92/65/1045199265.db2.gz LQPYDBACRGDYRR-WMZOPIPTSA-N 1 1 372.400 2.979 20 5 FFBDMO COc1cc(C(=O)Nc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC001319583461 1045203599 /nfs/dbraw/zinc/20/35/99/1045203599.db2.gz NRBBALBEYYJOKH-UHFFFAOYSA-N 1 1 367.308 2.891 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]1C ZINC001320950278 1045500328 /nfs/dbraw/zinc/50/03/28/1045500328.db2.gz DUGVGSKMSCVQSU-SKDRFNHKSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]1C ZINC001320950278 1045500334 /nfs/dbraw/zinc/50/03/34/1045500334.db2.gz DUGVGSKMSCVQSU-SKDRFNHKSA-N 1 1 357.204 2.741 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001321744029 1045782505 /nfs/dbraw/zinc/78/25/05/1045782505.db2.gz WAWJLKZTTOMORQ-CQSZACIVSA-N 1 1 351.359 2.811 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001321744029 1045782513 /nfs/dbraw/zinc/78/25/13/1045782513.db2.gz WAWJLKZTTOMORQ-CQSZACIVSA-N 1 1 351.359 2.811 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC001322221606 1046001625 /nfs/dbraw/zinc/00/16/25/1046001625.db2.gz HJAFDULSYLSOLF-MAUKXSAKSA-N 1 1 374.437 2.906 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)C12CCCC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001331344655 1047879119 /nfs/dbraw/zinc/87/91/19/1047879119.db2.gz FBXIIXFKVBLCBZ-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)C12CCCC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001331344655 1047879130 /nfs/dbraw/zinc/87/91/30/1047879130.db2.gz FBXIIXFKVBLCBZ-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC001332103705 1048247943 /nfs/dbraw/zinc/24/79/43/1048247943.db2.gz GDGBKUFNTYKRSD-RCBQFDQVSA-N 1 1 371.359 2.960 20 5 FFBDMO C[C@H]([NH2+]CCN1C(=O)COc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC001329644786 1048827376 /nfs/dbraw/zinc/82/73/76/1048827376.db2.gz YADQWYORHUUHAC-LBPRGKRZSA-N 1 1 359.357 2.810 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001333708506 1049068662 /nfs/dbraw/zinc/06/86/62/1049068662.db2.gz WSDCRFPMEBMNJO-UHFFFAOYSA-N 1 1 355.398 2.844 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccncc3[N+](=O)[O-])C2)O1 ZINC001330829253 1049350768 /nfs/dbraw/zinc/35/07/68/1049350768.db2.gz JRXKTHHIRXNDMR-JXFKEZNVSA-N 1 1 368.437 2.860 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC(c3c[nH+]cn3C)CC2)c([N+](=O)[O-])c1 ZINC001340027920 1050439458 /nfs/dbraw/zinc/43/94/58/1050439458.db2.gz NZNZBSQORFLBIR-UHFFFAOYSA-N 1 1 372.425 2.818 20 5 FFBDMO COc1cc(C[N@@H+]2C3CCC2(CO)CC3)c([N+](=O)[O-])cc1OCC(F)F ZINC001342001815 1050599195 /nfs/dbraw/zinc/59/91/95/1050599195.db2.gz VPZYTJNSGRLGKR-UHFFFAOYSA-N 1 1 372.368 2.737 20 5 FFBDMO COc1cc(C[N@H+]2C3CCC2(CO)CC3)c([N+](=O)[O-])cc1OCC(F)F ZINC001342001815 1050599204 /nfs/dbraw/zinc/59/92/04/1050599204.db2.gz VPZYTJNSGRLGKR-UHFFFAOYSA-N 1 1 372.368 2.737 20 5 FFBDMO CNc1ccc(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)cc1[N+](=O)[O-] ZINC001301746422 1050970956 /nfs/dbraw/zinc/97/09/56/1050970956.db2.gz KVRTVOZWDFFISA-IRXDYDNUSA-N 1 1 366.421 2.735 20 5 FFBDMO CNc1ccc(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1[N+](=O)[O-] ZINC001301746422 1050970966 /nfs/dbraw/zinc/97/09/66/1050970966.db2.gz KVRTVOZWDFFISA-IRXDYDNUSA-N 1 1 366.421 2.735 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001344875643 1052091602 /nfs/dbraw/zinc/09/16/02/1052091602.db2.gz MUWIVLIFMUONSA-AWEZNQCLSA-N 1 1 350.419 2.526 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCCC[C@@H]2CO)o1 ZINC001307413839 1052305091 /nfs/dbraw/zinc/30/50/91/1052305091.db2.gz AZISCTPZTWCYON-LLVKDONJSA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCCC[C@@H]2CO)o1 ZINC001307413839 1052305095 /nfs/dbraw/zinc/30/50/95/1052305095.db2.gz AZISCTPZTWCYON-LLVKDONJSA-N 1 1 352.778 2.645 20 5 FFBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001307748385 1052344497 /nfs/dbraw/zinc/34/44/97/1052344497.db2.gz ORGJUKLHIMCHGV-CYBMUJFWSA-N 1 1 373.413 2.526 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@H]1c1ncccn1)Nc1cc([N+](=O)[O-])ccc1F ZINC001307947536 1052370353 /nfs/dbraw/zinc/37/03/53/1052370353.db2.gz UWBKFVJPEZOQJF-HNNXBMFYSA-N 1 1 359.361 2.690 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1c1ncccn1)Nc1cc([N+](=O)[O-])ccc1F ZINC001307947536 1052370360 /nfs/dbraw/zinc/37/03/60/1052370360.db2.gz UWBKFVJPEZOQJF-HNNXBMFYSA-N 1 1 359.361 2.690 20 5 FFBDMO O=[N+]([O-])c1cccc(OCCN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1 ZINC001307967718 1052372561 /nfs/dbraw/zinc/37/25/61/1052372561.db2.gz KMSRYDQPSIOPCT-OALUTQOASA-N 1 1 353.422 2.932 20 5 FFBDMO CCc1ccc2c(c1)CC[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC001308170966 1052425262 /nfs/dbraw/zinc/42/52/62/1052425262.db2.gz PULAEWXNDSQTOH-SFHVURJKSA-N 1 1 356.422 2.955 20 5 FFBDMO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001308573894 1052472205 /nfs/dbraw/zinc/47/22/05/1052472205.db2.gz PCUWLVUVGRJNLV-OAHLLOKOSA-N 1 1 359.405 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001346068362 1052731585 /nfs/dbraw/zinc/73/15/85/1052731585.db2.gz MPDVNYXPZIHNJX-STQMWFEESA-N 1 1 359.348 2.649 20 5 FFBDMO COC/C(C)=C/C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001335786918 1053564895 /nfs/dbraw/zinc/56/48/95/1053564895.db2.gz SWYICBCMUWTPMN-MKMNVTDBSA-N 1 1 359.430 2.576 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000847253263 1055321043 /nfs/dbraw/zinc/32/10/43/1055321043.db2.gz ABGUWEGCRWYPIG-CABCVRRESA-N 1 1 362.386 2.558 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001356351150 1055468090 /nfs/dbraw/zinc/46/80/90/1055468090.db2.gz IOHXSDSUZVOODC-RDJZCZTQSA-N 1 1 372.473 2.594 20 5 FFBDMO O=C(c1ccc2[nH]c3ccccc3c(=O)c2c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001338554835 1055619699 /nfs/dbraw/zinc/61/96/99/1055619699.db2.gz MHUWYYJQAHWOSW-MRXNPFEDSA-N 1 1 361.445 2.992 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC001350442084 1055777353 /nfs/dbraw/zinc/77/73/53/1055777353.db2.gz XMXATXKMMQCCJG-CQSZACIVSA-N 1 1 366.437 2.714 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245319 1056224668 /nfs/dbraw/zinc/22/46/68/1056224668.db2.gz LBTHZCOGCUYLSZ-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@H+](C)C[C@H]1c1cnn(C)c1 ZINC000849483720 1056869271 /nfs/dbraw/zinc/86/92/71/1056869271.db2.gz IVHVJYKGVKESEK-HOTGVXAUSA-N 1 1 371.441 2.619 20 5 FFBDMO C[N@@H+](CCc1cccc(NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC001446972929 1058579330 /nfs/dbraw/zinc/57/93/30/1058579330.db2.gz LBHGJCDBEIEJFX-LJQANCHMSA-N 1 1 369.421 2.904 20 5 FFBDMO C[N@@H+](CCC1CCCC1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001501663072 1058697681 /nfs/dbraw/zinc/69/76/81/1058697681.db2.gz LUQWAWUQNMEWGH-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO C[N@H+](CCC1CCCC1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001501663072 1058697694 /nfs/dbraw/zinc/69/76/94/1058697694.db2.gz LUQWAWUQNMEWGH-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO C[N@@H+](CCC1CCCC1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001501663072 1058697705 /nfs/dbraw/zinc/69/77/05/1058697705.db2.gz LUQWAWUQNMEWGH-RTBURBONSA-N 1 1 359.470 2.980 20 5 FFBDMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc21)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001451468553 1059118677 /nfs/dbraw/zinc/11/86/77/1059118677.db2.gz GWSIMFLSMVBCDM-SFHVURJKSA-N 1 1 350.378 2.863 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001453494855 1059376026 /nfs/dbraw/zinc/37/60/26/1059376026.db2.gz SFYKGWCPIIQBHF-CYBMUJFWSA-N 1 1 356.426 2.792 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001454633563 1059590146 /nfs/dbraw/zinc/59/01/46/1059590146.db2.gz KFDDQRVMLJCEMH-ZBFHGGJFSA-N 1 1 368.437 2.675 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC(C3OCCO3)CC2)c1 ZINC000848479233 1060106980 /nfs/dbraw/zinc/10/69/80/1060106980.db2.gz UYNXXMAQTOUSGE-UHFFFAOYSA-N 1 1 358.398 2.501 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481051 1060112013 /nfs/dbraw/zinc/11/20/13/1060112013.db2.gz VQNAJGRWCPLDFI-QFBILLFUSA-N 1 1 374.485 2.532 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000848480976 1060113836 /nfs/dbraw/zinc/11/38/36/1060113836.db2.gz UALIWOPKIRWZHV-QUCCMNQESA-N 1 1 373.453 2.761 20 5 FFBDMO CC(C)[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC001457091747 1060273810 /nfs/dbraw/zinc/27/38/10/1060273810.db2.gz ZOVWMKGFIARFCA-PBHICJAKSA-N 1 1 371.441 2.806 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1 ZINC000848582084 1060309047 /nfs/dbraw/zinc/30/90/47/1060309047.db2.gz GJJGQNMAQIDZKE-NSHDSACASA-N 1 1 368.340 2.524 20 5 FFBDMO CSc1ccc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001517120650 1060355956 /nfs/dbraw/zinc/35/59/56/1060355956.db2.gz CARUZYRFCFZMDE-AWEZNQCLSA-N 1 1 366.439 2.727 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)[C@H]2[NH2+]CCOc3ccccc32)cc1[N+](=O)[O-] ZINC001521402543 1060576515 /nfs/dbraw/zinc/57/65/15/1060576515.db2.gz STWOGSFLDUMBFU-ACJLOTCBSA-N 1 1 355.394 2.804 20 5 FFBDMO O=C(OCc1cc(O)ccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000848778090 1060675341 /nfs/dbraw/zinc/67/53/41/1060675341.db2.gz VJCIWRHNVIUPNB-HNNXBMFYSA-N 1 1 356.378 2.866 20 5 FFBDMO O=C(OCc1cc(O)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000848778090 1060675349 /nfs/dbraw/zinc/67/53/49/1060675349.db2.gz VJCIWRHNVIUPNB-HNNXBMFYSA-N 1 1 356.378 2.866 20 5 FFBDMO C[C@@H]1[C@@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227605 1060925090 /nfs/dbraw/zinc/92/50/90/1060925090.db2.gz RJIFMRAXXULWKV-GHMZBOCLSA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@@H]1[C@@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227605 1060925109 /nfs/dbraw/zinc/92/51/09/1060925109.db2.gz RJIFMRAXXULWKV-GHMZBOCLSA-N 1 1 366.805 2.891 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](C3CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460834748 1061120855 /nfs/dbraw/zinc/12/08/55/1061120855.db2.gz NNBYRLLFUFTTAV-APWZRJJASA-N 1 1 373.453 2.839 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001463269465 1062023918 /nfs/dbraw/zinc/02/39/18/1062023918.db2.gz DZZCVMSASMLNFP-VNHYZAJKSA-N 1 1 369.487 2.548 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC001478578286 1062055681 /nfs/dbraw/zinc/05/56/81/1062055681.db2.gz SPVKNCDXXVPRQV-ZDUSSCGKSA-N 1 1 374.363 2.849 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)n1 ZINC001523663843 1062568520 /nfs/dbraw/zinc/56/85/20/1062568520.db2.gz XJPDDKNELGDKAZ-INIZCTEOSA-N 1 1 358.398 2.848 20 5 FFBDMO CCOc1cc(NC(=O)c2cnn(-c3cc[nH+]cc3)c2)ccc1[N+](=O)[O-] ZINC001531646662 1062837961 /nfs/dbraw/zinc/83/79/61/1062837961.db2.gz OFJMNBYERSQLCY-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001440641128 1063323583 /nfs/dbraw/zinc/32/35/83/1063323583.db2.gz XENHDISBRMYEOO-SNVBAGLBSA-N 1 1 372.828 2.964 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001468936156 1064060900 /nfs/dbraw/zinc/06/09/00/1064060900.db2.gz MUCOIXTXLFSXJV-UHFFFAOYSA-N 1 1 358.801 2.574 20 5 FFBDMO COc1cccc(C[NH+]2CCN(CCOc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001473727806 1065336662 /nfs/dbraw/zinc/33/66/62/1065336662.db2.gz IRMULCNVJLNVPU-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO COc1cccc(CN2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001473727806 1065336669 /nfs/dbraw/zinc/33/66/69/1065336669.db2.gz IRMULCNVJLNVPU-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001473767812 1065352339 /nfs/dbraw/zinc/35/23/39/1065352339.db2.gz NDQYNFRSGCODTP-ZIAGYGMSSA-N 1 1 363.414 2.587 20 5 FFBDMO COCC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001473801134 1065368519 /nfs/dbraw/zinc/36/85/19/1065368519.db2.gz CQXCXAIRRCHECB-UHFFFAOYSA-N 1 1 371.437 2.959 20 5 FFBDMO COCC[N@@H+](Cc1ccc(C)c(C)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001473801134 1065368527 /nfs/dbraw/zinc/36/85/27/1065368527.db2.gz CQXCXAIRRCHECB-UHFFFAOYSA-N 1 1 371.437 2.959 20 5 FFBDMO Cn1ccc(C2CC[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC2)n1 ZINC001473810165 1065373530 /nfs/dbraw/zinc/37/35/30/1065373530.db2.gz VYIDIAHWSDEXSV-UHFFFAOYSA-N 1 1 368.397 2.758 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ncccc1C ZINC001473879790 1065402725 /nfs/dbraw/zinc/40/27/25/1065402725.db2.gz MPNUVFLTTAYWDE-STQMWFEESA-N 1 1 358.398 2.985 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC001473894937 1065409794 /nfs/dbraw/zinc/40/97/94/1065409794.db2.gz VOJKZJYQFIPFOC-UHFFFAOYSA-N 1 1 368.397 2.758 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001556098830 1075700400 /nfs/dbraw/zinc/70/04/00/1075700400.db2.gz ZLXFLOFEBDPKCL-RDTXWAMCSA-N 1 1 371.412 2.913 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001557282234 1075833138 /nfs/dbraw/zinc/83/31/38/1075833138.db2.gz RXYGOPRXDIHHKV-OAHLLOKOSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001557282234 1075833142 /nfs/dbraw/zinc/83/31/42/1075833142.db2.gz RXYGOPRXDIHHKV-OAHLLOKOSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC001559226689 1076137211 /nfs/dbraw/zinc/13/72/11/1076137211.db2.gz MZRSBBJGNVJGMW-CYBMUJFWSA-N 1 1 367.409 2.610 20 5 FFBDMO Nc1nc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001559300480 1076147941 /nfs/dbraw/zinc/14/79/41/1076147941.db2.gz RQBLICGGBFDYLZ-OWCLPIDISA-N 1 1 368.441 2.680 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1CO ZINC001559753924 1076187797 /nfs/dbraw/zinc/18/77/97/1076187797.db2.gz XUPROBMXIIYKKT-RNCFNFMXSA-N 1 1 352.778 2.501 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1ccc2c(c1)OCO2 ZINC001560147963 1076236160 /nfs/dbraw/zinc/23/61/60/1076236160.db2.gz FOUDWEYGJJZXNU-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1cc(C[N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])sn1 ZINC001560173459 1076241148 /nfs/dbraw/zinc/24/11/48/1076241148.db2.gz GUBSFCAPPUSVLS-UHFFFAOYSA-N 1 1 353.400 2.579 20 5 FFBDMO COc1cc(C[N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])sn1 ZINC001560173459 1076241150 /nfs/dbraw/zinc/24/11/50/1076241150.db2.gz GUBSFCAPPUSVLS-UHFFFAOYSA-N 1 1 353.400 2.579 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001561474305 1076381456 /nfs/dbraw/zinc/38/14/56/1076381456.db2.gz ATOXSZNSVCBZEX-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001568640292 1077104462 /nfs/dbraw/zinc/10/44/62/1077104462.db2.gz CEOJGGFRUHLPLY-LLVKDONJSA-N 1 1 372.828 2.820 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001586420035 1079624291 /nfs/dbraw/zinc/62/42/91/1079624291.db2.gz CTYKYVLHBBELSR-ZDUSSCGKSA-N 1 1 353.850 2.981 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055482 1079728866 /nfs/dbraw/zinc/72/88/66/1079728866.db2.gz RQAPGHDYCLIYBK-YOEHRIQHSA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055482 1079728872 /nfs/dbraw/zinc/72/88/72/1079728872.db2.gz RQAPGHDYCLIYBK-YOEHRIQHSA-N 1 1 369.421 2.798 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589695790 1080674079 /nfs/dbraw/zinc/67/40/79/1080674079.db2.gz VYRLIIXAKJGRCK-UHFFFAOYSA-N 1 1 373.442 2.685 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876086 1080823587 /nfs/dbraw/zinc/82/35/87/1080823587.db2.gz NSNMLOZCANJMOS-LLVKDONJSA-N 1 1 373.442 2.769 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC001590227452 1081108686 /nfs/dbraw/zinc/10/86/86/1081108686.db2.gz OZFFPCNJZRFHMY-GUTXKFCHSA-N 1 1 371.445 2.617 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590259550 1081129035 /nfs/dbraw/zinc/12/90/35/1081129035.db2.gz KSIFCPGQJDHDES-SNVBAGLBSA-N 1 1 351.436 2.513 20 5 FFBDMO O=C(NC1CC1)[C@@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104666873 250182851 /nfs/dbraw/zinc/18/28/51/250182851.db2.gz IOWAFPNVIPOARJ-INIZCTEOSA-N 1 1 370.409 2.535 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153334683 251125330 /nfs/dbraw/zinc/12/53/30/251125330.db2.gz MUWAPVRAXUHACS-NVXWUHKLSA-N 1 1 373.453 2.839 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCc1cnccn1 ZINC000271312050 251757981 /nfs/dbraw/zinc/75/79/81/251757981.db2.gz IFVHTQJIFFIZNA-LLVKDONJSA-N 1 1 363.805 2.540 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCc1cnccn1 ZINC000271312050 251757984 /nfs/dbraw/zinc/75/79/84/251757984.db2.gz IFVHTQJIFFIZNA-LLVKDONJSA-N 1 1 363.805 2.540 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O ZINC000272283288 252000429 /nfs/dbraw/zinc/00/04/29/252000429.db2.gz DFVQPWLHNPQSPO-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O ZINC000272283288 252000433 /nfs/dbraw/zinc/00/04/33/252000433.db2.gz DFVQPWLHNPQSPO-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272401409 252029781 /nfs/dbraw/zinc/02/97/81/252029781.db2.gz VHRQUNXBDCUDPU-CYBMUJFWSA-N 1 1 355.385 2.877 20 5 FFBDMO COc1cc(CNC[C@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272525881 252059714 /nfs/dbraw/zinc/05/97/14/252059714.db2.gz YYCZLQYCIOPSSV-NSHDSACASA-N 1 1 373.400 2.820 20 5 FFBDMO COc1cc(C[NH2+]C[C@H](C)N(C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272525881 252059719 /nfs/dbraw/zinc/05/97/19/252059719.db2.gz YYCZLQYCIOPSSV-NSHDSACASA-N 1 1 373.400 2.820 20 5 FFBDMO COc1cc(CNCC2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272639284 252087761 /nfs/dbraw/zinc/08/77/61/252087761.db2.gz OFSUVCRZQCYBRO-UHFFFAOYSA-N 1 1 371.384 2.599 20 5 FFBDMO COc1cc(CNCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272639284 252087763 /nfs/dbraw/zinc/08/77/63/252087763.db2.gz OFSUVCRZQCYBRO-UHFFFAOYSA-N 1 1 371.384 2.599 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C1=CC[N@@H+](C)CC1 ZINC000272761519 252124050 /nfs/dbraw/zinc/12/40/50/252124050.db2.gz PRIKZBUKPXMEKQ-SNVBAGLBSA-N 1 1 355.341 2.576 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Br)C1=CC[N@@H+](C)CC1 ZINC000272958179 252175195 /nfs/dbraw/zinc/17/51/95/252175195.db2.gz NGDHFRPWNVUNNM-SNVBAGLBSA-N 1 1 368.231 2.738 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C1=CC[N@@H+](C)CC1 ZINC000273007127 252189918 /nfs/dbraw/zinc/18/99/18/252189918.db2.gz RVPCVIVXTHVHMW-OAHLLOKOSA-N 1 1 372.469 2.965 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)nc1 ZINC000274044787 255827350 /nfs/dbraw/zinc/82/73/50/255827350.db2.gz YDLIHYLRKMPFIM-SJLPKXTDSA-N 1 1 353.426 2.876 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3N)sc2C1 ZINC000276288457 256087206 /nfs/dbraw/zinc/08/72/06/256087206.db2.gz VFELMGUTVZZYFO-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3N)sc2C1 ZINC000276288457 256087208 /nfs/dbraw/zinc/08/72/08/256087208.db2.gz VFELMGUTVZZYFO-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277463562 256200468 /nfs/dbraw/zinc/20/04/68/256200468.db2.gz PINSLCZPNNCFBT-HNNXBMFYSA-N 1 1 360.414 2.980 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000278214200 256288206 /nfs/dbraw/zinc/28/82/06/256288206.db2.gz DLOYJCLYLZZFSV-UHFFFAOYSA-N 1 1 355.394 2.911 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N2CC[NH+](Cc3cccc(O)c3)CC2)s1 ZINC000286049136 257017781 /nfs/dbraw/zinc/01/77/81/257017781.db2.gz AQVGVGMGBGMHGW-UHFFFAOYSA-N 1 1 371.422 2.627 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000286128377 257021721 /nfs/dbraw/zinc/02/17/21/257021721.db2.gz HEGXLIJKCVKZAG-CZUORRHYSA-N 1 1 374.441 2.538 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1N1CCOC1=O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286236860 257027060 /nfs/dbraw/zinc/02/70/60/257027060.db2.gz CZYSMGWQCWUNCS-NNQSOWQGSA-N 1 1 360.414 2.613 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1 ZINC000289403846 257279294 /nfs/dbraw/zinc/27/92/94/257279294.db2.gz GDZWVQIKPIXANS-QUCCMNQESA-N 1 1 353.422 2.765 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCc2occc2C1 ZINC000288977326 257243204 /nfs/dbraw/zinc/24/32/04/257243204.db2.gz ZEBOKZXRLITGEQ-UHFFFAOYSA-N 1 1 359.382 2.973 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] ZINC000290201644 257320009 /nfs/dbraw/zinc/32/00/09/257320009.db2.gz NSFOJSFPIDJNAH-ZDUSSCGKSA-N 1 1 367.446 2.852 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)cc1SC ZINC000290943412 257366568 /nfs/dbraw/zinc/36/65/68/257366568.db2.gz OWMVOLVGGODHPK-LLVKDONJSA-N 1 1 355.460 2.784 20 5 FFBDMO CN(CCC[NH+]1CCCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000296337305 257696481 /nfs/dbraw/zinc/69/64/81/257696481.db2.gz VERRPIXYXMBMBR-UHFFFAOYSA-N 1 1 357.414 2.543 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@]1(C)CCCO ZINC000299646485 258013465 /nfs/dbraw/zinc/01/34/65/258013465.db2.gz KSPVYYGIHBNWNO-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000301652843 258061426 /nfs/dbraw/zinc/06/14/26/258061426.db2.gz GVSXAVRDTICODK-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO C[C@@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1Cc1ccccc1 ZINC000301967029 258078792 /nfs/dbraw/zinc/07/87/92/258078792.db2.gz KZJZEXOPBYHILA-OAHLLOKOSA-N 1 1 366.425 2.738 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000330783051 258170643 /nfs/dbraw/zinc/17/06/43/258170643.db2.gz HRWUWZBYUGSXLM-PWSUYJOCSA-N 1 1 357.357 2.751 20 5 FFBDMO CC[C@H]1C[C@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCO1 ZINC000330785478 258170652 /nfs/dbraw/zinc/17/06/52/258170652.db2.gz UDSSDBAHKOGNFC-KGLIPLIRSA-N 1 1 367.471 2.619 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)cc1SC ZINC000331138720 258178258 /nfs/dbraw/zinc/17/82/58/258178258.db2.gz LIRNKPLSSZTQDK-CQSZACIVSA-N 1 1 367.471 2.738 20 5 FFBDMO CC(C)CN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000331210519 258179745 /nfs/dbraw/zinc/17/97/45/258179745.db2.gz HUZGXMMEMPWKBJ-UHFFFAOYSA-N 1 1 351.451 2.634 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000331458510 258186949 /nfs/dbraw/zinc/18/69/49/258186949.db2.gz ARTNHMNOJJAHBU-ZIAGYGMSSA-N 1 1 354.410 2.821 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000332262037 258222007 /nfs/dbraw/zinc/22/20/07/258222007.db2.gz DTRZMIWVQSIOTM-UHFFFAOYSA-N 1 1 357.863 2.895 20 5 FFBDMO Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC[C@H]1CCCC[N@H+]1C ZINC000332502240 258232410 /nfs/dbraw/zinc/23/24/10/258232410.db2.gz RMBMFBMNUKWQCM-GFCCVEGCSA-N 1 1 362.455 2.808 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000052861543 506265839 /nfs/dbraw/zinc/26/58/39/506265839.db2.gz SMCYCGFNZFJFQF-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000052861543 506265848 /nfs/dbraw/zinc/26/58/48/506265848.db2.gz SMCYCGFNZFJFQF-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1 ZINC000053245456 506342012 /nfs/dbraw/zinc/34/20/12/506342012.db2.gz YABRTVCBZSCUJG-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000065791802 506366986 /nfs/dbraw/zinc/36/69/86/506366986.db2.gz OCPMFHINRRNKLB-KBPBESRZSA-N 1 1 369.487 2.556 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053615334 506415398 /nfs/dbraw/zinc/41/53/98/506415398.db2.gz OQYCSRHYKYMSIX-CQSZACIVSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053615334 506415405 /nfs/dbraw/zinc/41/54/05/506415405.db2.gz OQYCSRHYKYMSIX-CQSZACIVSA-N 1 1 360.370 2.562 20 5 FFBDMO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(F)c1 ZINC000041888243 506564718 /nfs/dbraw/zinc/56/47/18/506564718.db2.gz KAOBUCIZDZIZME-UHFFFAOYSA-N 1 1 374.372 2.633 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(F)c1 ZINC000041888243 506564726 /nfs/dbraw/zinc/56/47/26/506564726.db2.gz KAOBUCIZDZIZME-UHFFFAOYSA-N 1 1 374.372 2.633 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 ZINC000054546176 506576565 /nfs/dbraw/zinc/57/65/65/506576565.db2.gz SKWPEMWFIZRPLP-UHFFFAOYSA-N 1 1 359.382 2.545 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 ZINC000054546176 506576569 /nfs/dbraw/zinc/57/65/69/506576569.db2.gz SKWPEMWFIZRPLP-UHFFFAOYSA-N 1 1 359.382 2.545 20 5 FFBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 ZINC000011364706 506773116 /nfs/dbraw/zinc/77/31/16/506773116.db2.gz WKIIEIJIAQIRNZ-UHFFFAOYSA-N 1 1 371.393 2.808 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 ZINC000011364706 506773123 /nfs/dbraw/zinc/77/31/23/506773123.db2.gz WKIIEIJIAQIRNZ-UHFFFAOYSA-N 1 1 371.393 2.808 20 5 FFBDMO Cc1c(C(=O)N2CC[NH+](CCc3cccs3)CC2)cccc1[N+](=O)[O-] ZINC000055642677 506811589 /nfs/dbraw/zinc/81/15/89/506811589.db2.gz DLXKYVGLTKAOSH-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000067725047 506990082 /nfs/dbraw/zinc/99/00/82/506990082.db2.gz BXRKXMDRVXILBB-QGZVFWFLSA-N 1 1 372.425 2.706 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCOc2ccccc2C)c([N+](=O)[O-])c1 ZINC000015099211 507020172 /nfs/dbraw/zinc/02/01/72/507020172.db2.gz JEYYBYIGXIDIJA-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCOc2ccccc2C)c([N+](=O)[O-])c1 ZINC000015099211 507020176 /nfs/dbraw/zinc/02/01/76/507020176.db2.gz JEYYBYIGXIDIJA-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000045948328 507050094 /nfs/dbraw/zinc/05/00/94/507050094.db2.gz OSDWFBGASOZICW-STQMWFEESA-N 1 1 350.419 2.988 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1F ZINC000375424181 512319225 /nfs/dbraw/zinc/31/92/25/512319225.db2.gz GDHOTIZBXCXWEX-LLVKDONJSA-N 1 1 362.361 2.992 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1F ZINC000375424181 512319229 /nfs/dbraw/zinc/31/92/29/512319229.db2.gz GDHOTIZBXCXWEX-LLVKDONJSA-N 1 1 362.361 2.992 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1cccc([N+](=O)[O-])c1 ZINC000046783320 507194439 /nfs/dbraw/zinc/19/44/39/507194439.db2.gz YZKQISPRIFCNSN-UHFFFAOYSA-N 1 1 353.378 2.713 20 5 FFBDMO CCOc1cc(C(=O)NCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000046859891 507211069 /nfs/dbraw/zinc/21/10/69/507211069.db2.gz XODXREMPIKAWDL-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000021055870 507242343 /nfs/dbraw/zinc/24/23/43/507242343.db2.gz XKOROVXRGNTPIJ-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H](CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[N@@H+](C)C1CC1 ZINC000057705537 507311195 /nfs/dbraw/zinc/31/11/95/507311195.db2.gz SOBMHICBXORJHT-NSHDSACASA-N 1 1 360.439 2.931 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCOC1)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000047405769 507323795 /nfs/dbraw/zinc/32/37/95/507323795.db2.gz XUJWXRVYMVLHNB-LLVKDONJSA-N 1 1 353.806 2.688 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](c1ccccc1)N1CC[NH+](C)CC1 ZINC000057778210 507327650 /nfs/dbraw/zinc/32/76/50/507327650.db2.gz UYPWEFIXHIOUIX-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000068800673 507328785 /nfs/dbraw/zinc/32/87/85/507328785.db2.gz UBCBIIMWMOMTTC-UHFFFAOYSA-N 1 1 374.485 2.754 20 5 FFBDMO COC(=O)c1cccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000047742861 507387137 /nfs/dbraw/zinc/38/71/37/507387137.db2.gz HYMDFUXWDLTHHJ-UHFFFAOYSA-N 1 1 355.394 2.704 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000048397389 507516641 /nfs/dbraw/zinc/51/66/41/507516641.db2.gz DKUACNYGDJLVOY-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC000027389341 507653601 /nfs/dbraw/zinc/65/36/01/507653601.db2.gz IQCNVMXEOLOIOU-UHFFFAOYSA-N 1 1 356.426 2.590 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3c[nH]cn3)CC2)cccc1[N+](=O)[O-] ZINC000369341283 512359428 /nfs/dbraw/zinc/35/94/28/512359428.db2.gz CVEVSZOXXKVIEE-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO CC[C@@](C)([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000072683493 507841332 /nfs/dbraw/zinc/84/13/32/507841332.db2.gz QJMOKXBVKJBSAQ-QGZVFWFLSA-N 1 1 360.439 2.855 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCN(C)c1ccccc1 ZINC000107682999 507862826 /nfs/dbraw/zinc/86/28/26/507862826.db2.gz CAZABQGFQCSANX-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCN(C)c1ccccc1 ZINC000107682999 507862828 /nfs/dbraw/zinc/86/28/28/507862828.db2.gz CAZABQGFQCSANX-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000107891513 507872916 /nfs/dbraw/zinc/87/29/16/507872916.db2.gz STIAYMQLRSDGTE-INIZCTEOSA-N 1 1 363.461 2.613 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892661 507879741 /nfs/dbraw/zinc/87/97/41/507879741.db2.gz CWSCGZSEHHKMQD-CYBMUJFWSA-N 1 1 358.398 2.727 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089892661 507879743 /nfs/dbraw/zinc/87/97/43/507879743.db2.gz CWSCGZSEHHKMQD-CYBMUJFWSA-N 1 1 358.398 2.727 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072977548 507879924 /nfs/dbraw/zinc/87/99/24/507879924.db2.gz UTPWFSWXVHGRIE-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072977548 507879927 /nfs/dbraw/zinc/87/99/27/507879927.db2.gz UTPWFSWXVHGRIE-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986911 507881964 /nfs/dbraw/zinc/88/19/64/507881964.db2.gz SLNLQIGKHUEVJJ-RDTXWAMCSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986911 507881966 /nfs/dbraw/zinc/88/19/66/507881966.db2.gz SLNLQIGKHUEVJJ-RDTXWAMCSA-N 1 1 354.410 2.832 20 5 FFBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558825 507883634 /nfs/dbraw/zinc/88/36/34/507883634.db2.gz WFXJCCQBXOLVAX-INIZCTEOSA-N 1 1 365.393 2.823 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000089926080 507884854 /nfs/dbraw/zinc/88/48/54/507884854.db2.gz ZHLLVVMVBZOZNC-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000090092300 507908194 /nfs/dbraw/zinc/90/81/94/507908194.db2.gz SDEROKAAMUBDKM-UHFFFAOYSA-N 1 1 369.469 2.731 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000109010369 507932293 /nfs/dbraw/zinc/93/22/93/507932293.db2.gz NDVMJQUAMQPPRD-UHFFFAOYSA-N 1 1 357.410 2.742 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCCN(CC(F)F)CC2)cccc1[N+](=O)[O-] ZINC000091083369 507952982 /nfs/dbraw/zinc/95/29/82/507952982.db2.gz QNVGHTHPXYRGAK-UHFFFAOYSA-N 1 1 370.400 2.505 20 5 FFBDMO O=C(NC1CC1)c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000091479619 507988647 /nfs/dbraw/zinc/98/86/47/507988647.db2.gz RLUDJKKWXRLYNZ-CYBMUJFWSA-N 1 1 355.398 2.594 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000110652048 508039776 /nfs/dbraw/zinc/03/97/76/508039776.db2.gz KQLWXKXSDWELGB-XHSDSOJGSA-N 1 1 374.485 2.759 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000111269098 508084164 /nfs/dbraw/zinc/08/41/64/508084164.db2.gz OODQFMMFFSAGCZ-HNNXBMFYSA-N 1 1 350.418 2.904 20 5 FFBDMO C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000111475320 508102864 /nfs/dbraw/zinc/10/28/64/508102864.db2.gz LKCKBEAGPDCACX-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075886705 508140403 /nfs/dbraw/zinc/14/04/03/508140403.db2.gz VBPIHOAOPHWRNW-GBESFXJTSA-N 1 1 358.442 2.729 20 5 FFBDMO Cn1cc(C[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC(F)F)C2)cn1 ZINC000093870631 508157731 /nfs/dbraw/zinc/15/77/31/508157731.db2.gz PLRITPUOJKYHKL-GFCCVEGCSA-N 1 1 366.368 2.994 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000081632064 508199314 /nfs/dbraw/zinc/19/93/14/508199314.db2.gz BZWGIUILZCKVGB-HNNXBMFYSA-N 1 1 371.441 2.809 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000081635798 508200231 /nfs/dbraw/zinc/20/02/31/508200231.db2.gz LBYGMCYYAKFNHB-INIZCTEOSA-N 1 1 360.458 2.505 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000112699497 508210969 /nfs/dbraw/zinc/21/09/69/508210969.db2.gz UXIFJKQREWSCOO-HNNXBMFYSA-N 1 1 363.458 2.848 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000097152728 508219945 /nfs/dbraw/zinc/21/99/45/508219945.db2.gz DWXOYQCDNSFYKX-LBPRGKRZSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000097152728 508219948 /nfs/dbraw/zinc/21/99/48/508219948.db2.gz DWXOYQCDNSFYKX-LBPRGKRZSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000097152728 508219951 /nfs/dbraw/zinc/21/99/51/508219951.db2.gz DWXOYQCDNSFYKX-LBPRGKRZSA-N 1 1 359.430 2.711 20 5 FFBDMO CNC(=O)[C@H](CC(C)C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113329905 508261848 /nfs/dbraw/zinc/26/18/48/508261848.db2.gz IJHUDTGQAJWWDQ-HNNXBMFYSA-N 1 1 362.455 2.969 20 5 FFBDMO CC(C)[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CCOCC1 ZINC000077323623 508300746 /nfs/dbraw/zinc/30/07/46/508300746.db2.gz QOQSVMOWHSYUJN-UHFFFAOYSA-N 1 1 363.414 2.782 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000114799329 508348495 /nfs/dbraw/zinc/34/84/95/508348495.db2.gz DOMCHPBJTGCIPV-HNNXBMFYSA-N 1 1 371.441 2.665 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(c2noc3cc(F)ccc32)CC1 ZINC000377678592 512393242 /nfs/dbraw/zinc/39/32/42/512393242.db2.gz KBLBRIQKAUMCPD-UHFFFAOYSA-N 1 1 359.361 2.988 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2nc3sccn3c2[N+](=O)[O-])[C@H](C)C1 ZINC000115521388 508405262 /nfs/dbraw/zinc/40/52/62/508405262.db2.gz PGQQUFPRUIGPID-OLZOCXBDSA-N 1 1 367.475 2.853 20 5 FFBDMO COc1cc(CN(C)C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374010 508433536 /nfs/dbraw/zinc/43/35/36/508433536.db2.gz QZARPZAOMNARQL-LBPRGKRZSA-N 1 1 373.400 2.978 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000133690678 508435646 /nfs/dbraw/zinc/43/56/46/508435646.db2.gz YRRTXMKILAAHQJ-RISCZKNCSA-N 1 1 367.833 2.955 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1O ZINC000156820686 508482329 /nfs/dbraw/zinc/48/23/29/508482329.db2.gz YHHNSXFPQOFQRG-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1O ZINC000156820686 508482331 /nfs/dbraw/zinc/48/23/31/508482331.db2.gz YHHNSXFPQOFQRG-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000134234798 508511070 /nfs/dbraw/zinc/51/10/70/508511070.db2.gz WKDOCOGDMNNWAB-CFLQYTFWSA-N 1 1 372.421 2.659 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000157158538 508530776 /nfs/dbraw/zinc/53/07/76/508530776.db2.gz WRKFBIYPXKWIRK-SJORKVTESA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000116727795 508551878 /nfs/dbraw/zinc/55/18/78/508551878.db2.gz YZIZYSNIDCUPIP-CYBMUJFWSA-N 1 1 369.849 2.865 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341323 508593861 /nfs/dbraw/zinc/59/38/61/508593861.db2.gz LOERFPSHDCWJEX-GDBMZVCRSA-N 1 1 363.414 2.518 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000153581637 508602467 /nfs/dbraw/zinc/60/24/67/508602467.db2.gz LTZXVXYXQGKPJV-HOTGVXAUSA-N 1 1 364.490 2.528 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128687801 508629210 /nfs/dbraw/zinc/62/92/10/508629210.db2.gz PANLCJGDJSBBKI-CVEARBPZSA-N 1 1 353.394 2.688 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@H](C)[C@@H]1C ZINC000118415719 508650171 /nfs/dbraw/zinc/65/01/71/508650171.db2.gz DAXZMQJOJIKWGS-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO Cc1nc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000118866939 508688666 /nfs/dbraw/zinc/68/86/66/508688666.db2.gz HVXZZRBQSBALRP-CQSZACIVSA-N 1 1 364.409 2.928 20 5 FFBDMO Cc1nc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000118866939 508688669 /nfs/dbraw/zinc/68/86/69/508688669.db2.gz HVXZZRBQSBALRP-CQSZACIVSA-N 1 1 364.409 2.928 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000153986410 508692874 /nfs/dbraw/zinc/69/28/74/508692874.db2.gz FNRGESWEXNJCAR-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997752 508694703 /nfs/dbraw/zinc/69/47/03/508694703.db2.gz VUSWKWLMXUESLT-SJORKVTESA-N 1 1 361.442 2.837 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997752 508694705 /nfs/dbraw/zinc/69/47/05/508694705.db2.gz VUSWKWLMXUESLT-SJORKVTESA-N 1 1 361.442 2.837 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](CCCc3ccccc3)C2)c1 ZINC000158601127 508727286 /nfs/dbraw/zinc/72/72/86/508727286.db2.gz IPEAQTFDEDSXDG-ICSRJNTNSA-N 1 1 372.469 2.887 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000123821974 508743659 /nfs/dbraw/zinc/74/36/59/508743659.db2.gz QWWJLNYJTOPESM-CQSZACIVSA-N 1 1 358.442 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000119249002 508756344 /nfs/dbraw/zinc/75/63/44/508756344.db2.gz BKIKHGDKIWUGMV-CQSZACIVSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000119249002 508756346 /nfs/dbraw/zinc/75/63/46/508756346.db2.gz BKIKHGDKIWUGMV-CQSZACIVSA-N 1 1 353.850 2.935 20 5 FFBDMO CC1CC[NH+]([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000137883906 508766426 /nfs/dbraw/zinc/76/64/26/508766426.db2.gz ZLDGQRPLRXWVOJ-HNNXBMFYSA-N 1 1 357.414 2.521 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000124169131 508792500 /nfs/dbraw/zinc/79/25/00/508792500.db2.gz JAWPXYWBNHCTRJ-MJGOQNOKSA-N 1 1 356.422 2.899 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139854115 508795849 /nfs/dbraw/zinc/79/58/49/508795849.db2.gz UVHXXHFGUIQRJF-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139854115 508795852 /nfs/dbraw/zinc/79/58/52/508795852.db2.gz UVHXXHFGUIQRJF-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000124255183 508804968 /nfs/dbraw/zinc/80/49/68/508804968.db2.gz HILGDLKZYURNOK-CYBMUJFWSA-N 1 1 359.430 2.569 20 5 FFBDMO CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000124255183 508804972 /nfs/dbraw/zinc/80/49/72/508804972.db2.gz HILGDLKZYURNOK-CYBMUJFWSA-N 1 1 359.430 2.569 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000124255183 508804976 /nfs/dbraw/zinc/80/49/76/508804976.db2.gz HILGDLKZYURNOK-CYBMUJFWSA-N 1 1 359.430 2.569 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000124276366 508808067 /nfs/dbraw/zinc/80/80/67/508808067.db2.gz IAQYFARFWAMPIM-GOSISDBHSA-N 1 1 360.458 2.783 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000119588164 508824021 /nfs/dbraw/zinc/82/40/21/508824021.db2.gz BWGZVRNRUNFATM-PBHICJAKSA-N 1 1 369.421 2.854 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOC3(C2)CCCCCC3)c1 ZINC000119715522 508848888 /nfs/dbraw/zinc/84/88/88/508848888.db2.gz CKKHEGYAKDODAJ-QGZVFWFLSA-N 1 1 364.442 2.760 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000159568739 508859709 /nfs/dbraw/zinc/85/97/09/508859709.db2.gz GSSYJAFYXRIVIN-KDOFPFPSSA-N 1 1 357.410 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000159568739 508859714 /nfs/dbraw/zinc/85/97/14/508859714.db2.gz GSSYJAFYXRIVIN-KDOFPFPSSA-N 1 1 357.410 2.896 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000131096801 508886292 /nfs/dbraw/zinc/88/62/92/508886292.db2.gz PPXYAGMMNTXIAF-UHFFFAOYSA-N 1 1 363.458 2.805 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000131116148 508888949 /nfs/dbraw/zinc/88/89/49/508888949.db2.gz PURLVOVOLNCZFX-CQSZACIVSA-N 1 1 356.426 2.752 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000120053971 508918043 /nfs/dbraw/zinc/91/80/43/508918043.db2.gz AHOOFBDXDJXUKM-OAHLLOKOSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000120079462 508924156 /nfs/dbraw/zinc/92/41/56/508924156.db2.gz ZGWNKOIOHPAFKS-SCLBCKFNSA-N 1 1 354.410 2.549 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000125070953 508926993 /nfs/dbraw/zinc/92/69/93/508926993.db2.gz FHRHQICFCVXZMH-KRWDZBQOSA-N 1 1 369.487 2.525 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)CCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000150953023 508929425 /nfs/dbraw/zinc/92/94/25/508929425.db2.gz BFTSJVRXMHQRBK-CYBMUJFWSA-N 1 1 365.430 2.894 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000150953023 508929427 /nfs/dbraw/zinc/92/94/27/508929427.db2.gz BFTSJVRXMHQRBK-CYBMUJFWSA-N 1 1 365.430 2.894 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000125258285 508956518 /nfs/dbraw/zinc/95/65/18/508956518.db2.gz SFTJWVZINUOMFS-QGZVFWFLSA-N 1 1 362.474 2.805 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000125307758 508963623 /nfs/dbraw/zinc/96/36/23/508963623.db2.gz VITWQEXIQBCVHF-LSDHHAIUSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000155311584 508973785 /nfs/dbraw/zinc/97/37/85/508973785.db2.gz PMBDRUPDLYWVCY-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126741342 509120949 /nfs/dbraw/zinc/12/09/49/509120949.db2.gz WKSZFBPPBYIQKQ-KBXCAEBGSA-N 1 1 372.469 2.750 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000266785914 509192747 /nfs/dbraw/zinc/19/27/47/509192747.db2.gz WBMOZTNVRAPIHV-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(O)(c3ccccc3)CC2)c2c(c1)COCO2 ZINC000185505129 509210259 /nfs/dbraw/zinc/21/02/59/509210259.db2.gz FSXRXOWHUGVECR-UHFFFAOYSA-N 1 1 370.405 2.945 20 5 FFBDMO C[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000172771631 509226017 /nfs/dbraw/zinc/22/60/17/509226017.db2.gz QGDAJHDYSQJOPL-ZDUSSCGKSA-N 1 1 359.451 2.762 20 5 FFBDMO C[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000172771631 509226023 /nfs/dbraw/zinc/22/60/23/509226023.db2.gz QGDAJHDYSQJOPL-ZDUSSCGKSA-N 1 1 359.451 2.762 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1c(C)noc1C ZINC000182444009 509240185 /nfs/dbraw/zinc/24/01/85/509240185.db2.gz GSKWCKVJQCQZQN-OAHLLOKOSA-N 1 1 358.398 2.830 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172802767 509246031 /nfs/dbraw/zinc/24/60/31/509246031.db2.gz LLPXYKKWZXEULX-CZUORRHYSA-N 1 1 357.414 2.876 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)n2)c1 ZINC000266901436 509248964 /nfs/dbraw/zinc/24/89/64/509248964.db2.gz GSUWBODCTWHPPK-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)n2)c1 ZINC000266901436 509248971 /nfs/dbraw/zinc/24/89/71/509248971.db2.gz GSUWBODCTWHPPK-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@@H]21 ZINC000179292221 509359356 /nfs/dbraw/zinc/35/93/56/509359356.db2.gz ZEDGMNHWNUPXDM-ACJLOTCBSA-N 1 1 356.426 2.561 20 5 FFBDMO Cc1ncsc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000188996388 509360368 /nfs/dbraw/zinc/36/03/68/509360368.db2.gz NPTKCPUXPOLAJY-UHFFFAOYSA-N 1 1 352.391 2.959 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCC2)cc1OC ZINC000264181187 509367658 /nfs/dbraw/zinc/36/76/58/509367658.db2.gz MQOHIOZWNPKOAO-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO NC(=O)c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000264261651 509420481 /nfs/dbraw/zinc/42/04/81/509420481.db2.gz DAYCIXBYCXIOEU-INIZCTEOSA-N 1 1 368.437 2.670 20 5 FFBDMO C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831088 509447709 /nfs/dbraw/zinc/44/77/09/509447709.db2.gz GUIWDXQROKXZCK-CHWSQXEVSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182831088 509447719 /nfs/dbraw/zinc/44/77/19/509447719.db2.gz GUIWDXQROKXZCK-CHWSQXEVSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831088 509447729 /nfs/dbraw/zinc/44/77/29/509447729.db2.gz GUIWDXQROKXZCK-CHWSQXEVSA-N 1 1 371.441 2.854 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000182853681 509460008 /nfs/dbraw/zinc/46/00/08/509460008.db2.gz QVWKZBNAOFQLKP-QWHCGFSZSA-N 1 1 363.462 2.653 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000192464477 509530803 /nfs/dbraw/zinc/53/08/03/509530803.db2.gz FKNWIXYOJCSTJX-HNNXBMFYSA-N 1 1 355.442 2.592 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183007781 509545032 /nfs/dbraw/zinc/54/50/32/509545032.db2.gz PKKMYGOERXEZNF-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183007781 509545039 /nfs/dbraw/zinc/54/50/39/509545039.db2.gz PKKMYGOERXEZNF-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000249003687 509570354 /nfs/dbraw/zinc/57/03/54/509570354.db2.gz IURMUFVGYSUBAH-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000249003687 509570358 /nfs/dbraw/zinc/57/03/58/509570358.db2.gz IURMUFVGYSUBAH-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000165698291 509581235 /nfs/dbraw/zinc/58/12/35/509581235.db2.gz UYCFNYULFVNXQG-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000179707822 509583989 /nfs/dbraw/zinc/58/39/89/509583989.db2.gz RFYXGTMCGOXLAZ-GFCCVEGCSA-N 1 1 360.389 2.566 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3cc(C)ccn3)CC2)c([N+](=O)[O-])c1 ZINC000166184291 509597925 /nfs/dbraw/zinc/59/79/25/509597925.db2.gz WMRRCBRGDHYOCP-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1C ZINC000173668505 509708923 /nfs/dbraw/zinc/70/89/23/509708923.db2.gz AOIUTEMNVPELPV-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@@H](C)O)C1CCCCC1 ZINC000170691608 509724916 /nfs/dbraw/zinc/72/49/16/509724916.db2.gz VRPMPGWKKMKMPP-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1c1c(F)cccc1F ZINC000180215091 509816683 /nfs/dbraw/zinc/81/66/83/509816683.db2.gz LSOUIRGDQKRASI-SNVBAGLBSA-N 1 1 353.350 2.830 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1 ZINC000173950972 509871476 /nfs/dbraw/zinc/87/14/76/509871476.db2.gz NCSOMBHAELAGGE-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000177138836 509896557 /nfs/dbraw/zinc/89/65/57/509896557.db2.gz ARNKXHQDMMWDEA-SFHVURJKSA-N 1 1 369.421 2.527 20 5 FFBDMO CC[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1c1ccccc1 ZINC000245437376 509932291 /nfs/dbraw/zinc/93/22/91/509932291.db2.gz RMABLHTUTRQBLT-LZQZEXGQSA-N 1 1 358.442 2.668 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000193491483 509939545 /nfs/dbraw/zinc/93/95/45/509939545.db2.gz MXFDTTBYFMEVBO-UHFFFAOYSA-N 1 1 350.463 2.752 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1 ZINC000190169235 509983550 /nfs/dbraw/zinc/98/35/50/509983550.db2.gz DSIUMGLUAPIMRP-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177306498 509988281 /nfs/dbraw/zinc/98/82/81/509988281.db2.gz RVWHGSSBACDECV-ZBFHGGJFSA-N 1 1 357.414 2.703 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1cnn(-c3ccc([N+](=O)[O-])cc3)c1)C2 ZINC000174188371 509991511 /nfs/dbraw/zinc/99/15/11/509991511.db2.gz ZZYLCVCZTDOZCS-DODVFSASSA-N 1 1 369.425 2.526 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177330920 509998565 /nfs/dbraw/zinc/99/85/65/509998565.db2.gz NBRHOFKWXZSYNB-OCCSQVGLSA-N 1 1 366.849 2.745 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000177350222 510008854 /nfs/dbraw/zinc/00/88/54/510008854.db2.gz KATSTGFNDTUMHJ-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1CCO ZINC000190241790 510021779 /nfs/dbraw/zinc/02/17/79/510021779.db2.gz CHDXDGLCHLQYGI-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1CCO ZINC000190241790 510021797 /nfs/dbraw/zinc/02/17/97/510021797.db2.gz CHDXDGLCHLQYGI-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1CCO ZINC000190241790 510021806 /nfs/dbraw/zinc/02/18/06/510021806.db2.gz CHDXDGLCHLQYGI-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000193697879 510024940 /nfs/dbraw/zinc/02/49/40/510024940.db2.gz COIRKVMIMJKFNC-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000193697879 510024949 /nfs/dbraw/zinc/02/49/49/510024949.db2.gz COIRKVMIMJKFNC-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@@H](C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])c1nccs1 ZINC000183938122 510048011 /nfs/dbraw/zinc/04/80/11/510048011.db2.gz CMNRERSHIQYUIH-STQMWFEESA-N 1 1 351.428 2.527 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265443701 510057158 /nfs/dbraw/zinc/05/71/58/510057158.db2.gz AGUFLYAOXWNGMB-CHWSQXEVSA-N 1 1 368.865 2.849 20 5 FFBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245754655 510130543 /nfs/dbraw/zinc/13/05/43/510130543.db2.gz OJTOOUOATZAZCU-ISIQUDIPSA-N 1 1 352.456 2.896 20 5 FFBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000245754655 510130550 /nfs/dbraw/zinc/13/05/50/510130550.db2.gz OJTOOUOATZAZCU-ISIQUDIPSA-N 1 1 352.456 2.896 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000193949955 510144489 /nfs/dbraw/zinc/14/44/89/510144489.db2.gz POPSUPGUXIQWFN-AWEZNQCLSA-N 1 1 364.446 2.667 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000174526485 510160562 /nfs/dbraw/zinc/16/05/62/510160562.db2.gz UGWFWZBXFSVNEV-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000194019944 510179374 /nfs/dbraw/zinc/17/93/74/510179374.db2.gz LYWSHBOHKIOZEV-MRXNPFEDSA-N 1 1 372.425 2.582 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Br ZINC000265757255 510212236 /nfs/dbraw/zinc/21/22/36/510212236.db2.gz JHWQPNODCMDALK-UONOGXRCSA-N 1 1 368.231 2.714 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)c1 ZINC000174655603 510234066 /nfs/dbraw/zinc/23/40/66/510234066.db2.gz WVWBFBZHIOAAMK-ZFWWWQNUSA-N 1 1 373.438 2.599 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000177880816 510305775 /nfs/dbraw/zinc/30/57/75/510305775.db2.gz RZXWCOFYZBQEGI-KRWDZBQOSA-N 1 1 362.474 2.901 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000177880832 510306335 /nfs/dbraw/zinc/30/63/35/510306335.db2.gz RZXWCOFYZBQEGI-QGZVFWFLSA-N 1 1 362.474 2.901 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184449928 510331013 /nfs/dbraw/zinc/33/10/13/510331013.db2.gz GUDPLZMRLRPOGW-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)CCn1cc([N+](=O)[O-])cn1 ZINC000174853259 510344249 /nfs/dbraw/zinc/34/42/49/510344249.db2.gz YFRKVTLYIKPIJH-UHFFFAOYSA-N 1 1 372.404 2.885 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000266009065 510355907 /nfs/dbraw/zinc/35/59/07/510355907.db2.gz RZTUZWHSDQDPKR-IAQYHMDHSA-N 1 1 364.402 2.614 20 5 FFBDMO C[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000174870545 510356323 /nfs/dbraw/zinc/35/63/23/510356323.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870545 510356328 /nfs/dbraw/zinc/35/63/28/510356328.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870545 510356331 /nfs/dbraw/zinc/35/63/31/510356331.db2.gz PNJOUZXSNYLMQL-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000266024505 510365559 /nfs/dbraw/zinc/36/55/59/510365559.db2.gz MHOSTMVIFJYHSG-NVXWUHKLSA-N 1 1 363.458 2.770 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000266024507 510366253 /nfs/dbraw/zinc/36/62/53/510366253.db2.gz MHOSTMVIFJYHSG-RDJZCZTQSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000269446743 510411494 /nfs/dbraw/zinc/41/14/94/510411494.db2.gz CNQJORSOVKWZEA-UHFFFAOYSA-N 1 1 365.821 2.985 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184620870 510422618 /nfs/dbraw/zinc/42/26/18/510422618.db2.gz LQRPUEUYLDOCMF-AWEZNQCLSA-N 1 1 354.838 2.922 20 5 FFBDMO CCc1nc([C@H](C)[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000184749994 510497990 /nfs/dbraw/zinc/49/79/90/510497990.db2.gz UUAHZZRCHXHGNS-RYUDHWBXSA-N 1 1 351.428 2.704 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000191138363 510521352 /nfs/dbraw/zinc/52/13/52/510521352.db2.gz FRNYQYVOZAYHED-DHHPTOIESA-N 1 1 360.357 2.939 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000191138363 510521360 /nfs/dbraw/zinc/52/13/60/510521360.db2.gz FRNYQYVOZAYHED-DHHPTOIESA-N 1 1 360.357 2.939 20 5 FFBDMO C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181664757 510529089 /nfs/dbraw/zinc/52/90/89/510529089.db2.gz WZQCCOGTNQAXCM-CABCVRRESA-N 1 1 361.442 2.743 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000181730691 510564199 /nfs/dbraw/zinc/56/41/99/510564199.db2.gz UCHQYXVPGVVAQY-CQSZACIVSA-N 1 1 366.437 2.726 20 5 FFBDMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000175440346 510647993 /nfs/dbraw/zinc/64/79/93/510647993.db2.gz CJCZLGBGKHJRLS-AHIWAGSCSA-N 1 1 366.849 2.930 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000175484704 510661969 /nfs/dbraw/zinc/66/19/69/510661969.db2.gz CSEKNQNSBVFZQS-INIZCTEOSA-N 1 1 371.393 2.695 20 5 FFBDMO O=C1C[C@H](c2ccccc2)[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000195199091 510714473 /nfs/dbraw/zinc/71/44/73/510714473.db2.gz GYIZLNSPBHHITC-GOSISDBHSA-N 1 1 355.394 2.537 20 5 FFBDMO COc1ccc(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000182104396 510759574 /nfs/dbraw/zinc/75/95/74/510759574.db2.gz IBEXHKVMGHPCHI-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CCC1(CC)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000185243381 510767743 /nfs/dbraw/zinc/76/77/43/510767743.db2.gz KJXAUVIRJPHKEF-DEOSSOPVSA-N 1 1 354.472 2.987 20 5 FFBDMO CCC1(CC)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000185243381 510767751 /nfs/dbraw/zinc/76/77/51/510767751.db2.gz KJXAUVIRJPHKEF-DEOSSOPVSA-N 1 1 354.472 2.987 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)c1ccccc1Cl ZINC000175755181 510772342 /nfs/dbraw/zinc/77/23/42/510772342.db2.gz YMUHYTAZIBBXTG-OAHLLOKOSA-N 1 1 362.817 2.863 20 5 FFBDMO Cc1cnc([C@H]([NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C2CC2)s1 ZINC000185324948 510806608 /nfs/dbraw/zinc/80/66/08/510806608.db2.gz SVVLHPTVOPTBNB-QGZVFWFLSA-N 1 1 372.450 2.990 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247241012 510853729 /nfs/dbraw/zinc/85/37/29/510853729.db2.gz OQWYIBLHSJJRCO-WMLDXEAASA-N 1 1 364.446 2.853 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@@H+](C)C[C@H]1C ZINC000247267797 510854927 /nfs/dbraw/zinc/85/49/27/510854927.db2.gz FIQCKGSRMPODET-WWGRRREGSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)N1CC[NH+](C2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000270472852 510879560 /nfs/dbraw/zinc/87/95/60/510879560.db2.gz NSEBXSXSTCCZTP-UHFFFAOYSA-N 1 1 367.881 2.638 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C2)C1 ZINC000293925720 510901295 /nfs/dbraw/zinc/90/12/95/510901295.db2.gz PWSLZSASJVOIQW-HXUWFJFHSA-N 1 1 366.421 2.825 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000282659656 511064890 /nfs/dbraw/zinc/06/48/90/511064890.db2.gz GFTHNEYVJFMFCM-KRWDZBQOSA-N 1 1 362.474 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)n2)cc1 ZINC000361955601 511108454 /nfs/dbraw/zinc/10/84/54/511108454.db2.gz SQXHPHCMRYQBPX-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCn3cccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000298086182 511170197 /nfs/dbraw/zinc/17/01/97/511170197.db2.gz KPSXRUAZJDXQHF-CYBMUJFWSA-N 1 1 358.398 2.810 20 5 FFBDMO O=C(c1csc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279686651 511176743 /nfs/dbraw/zinc/17/67/43/511176743.db2.gz NCWPDLOYNXVXJS-IYBDPMFKSA-N 1 1 357.435 2.860 20 5 FFBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])c2C1 ZINC000271401155 511191729 /nfs/dbraw/zinc/19/17/29/511191729.db2.gz MUROLACTUUWSQM-UHFFFAOYSA-N 1 1 357.414 2.942 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298327265 511246985 /nfs/dbraw/zinc/24/69/85/511246985.db2.gz RELLLHJUVUDSTI-GOEBONIOSA-N 1 1 369.368 2.909 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000298404325 511272948 /nfs/dbraw/zinc/27/29/48/511272948.db2.gz FHPADQFGEVTSIY-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000283257713 511296648 /nfs/dbraw/zinc/29/66/48/511296648.db2.gz ABPXNTBUYGZQSL-LLVKDONJSA-N 1 1 370.247 2.737 20 5 FFBDMO COC(=O)c1ccc(C)c(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271792689 511325697 /nfs/dbraw/zinc/32/56/97/511325697.db2.gz UYYFQURAMWTKBB-CYBMUJFWSA-N 1 1 371.393 2.979 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4cncc(F)c4)CC3)nc2c1 ZINC000280127788 511345419 /nfs/dbraw/zinc/34/54/19/511345419.db2.gz APYZKUBBTRBSLY-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000283544641 511408695 /nfs/dbraw/zinc/40/86/95/511408695.db2.gz SMNXULCIJGASMS-LBPRGKRZSA-N 1 1 352.410 2.558 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000272123831 511438982 /nfs/dbraw/zinc/43/89/82/511438982.db2.gz TWDRVQOSRLTKMN-ZDUSSCGKSA-N 1 1 353.325 2.699 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCN(c2[nH+]ccn2C)CC1 ZINC000365447298 511455677 /nfs/dbraw/zinc/45/56/77/511455677.db2.gz MIFLHYAXGYXILW-UHFFFAOYSA-N 1 1 371.441 2.652 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272250232 511479732 /nfs/dbraw/zinc/47/97/32/511479732.db2.gz YHBNMAYDDJLTNJ-QWHCGFSZSA-N 1 1 355.341 2.553 20 5 FFBDMO CCOC(=O)c1cc(N2CCC[C@H](c3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000365545004 511518537 /nfs/dbraw/zinc/51/85/37/511518537.db2.gz ARKSFYCCUZMQHM-ZDUSSCGKSA-N 1 1 358.398 2.889 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)sc2C1 ZINC000363389971 511519844 /nfs/dbraw/zinc/51/98/44/511519844.db2.gz HKDYRIQNPUVWGI-UHFFFAOYSA-N 1 1 361.427 2.572 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc(C)cc([N+](=O)[O-])c3N)sc2C1 ZINC000363389971 511519851 /nfs/dbraw/zinc/51/98/51/511519851.db2.gz HKDYRIQNPUVWGI-UHFFFAOYSA-N 1 1 361.427 2.572 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194959 511547453 /nfs/dbraw/zinc/54/74/53/511547453.db2.gz MHHUBJVFHCIQHU-YQQAZPJKSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000363561411 511629040 /nfs/dbraw/zinc/62/90/40/511629040.db2.gz YZDUZENNIFBOLH-CABCVRRESA-N 1 1 371.441 2.528 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273846517 511629060 /nfs/dbraw/zinc/62/90/60/511629060.db2.gz GTYXDUFQMOSIBD-SUMWQHHRSA-N 1 1 363.433 2.954 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH+](CCC(C)(C)C)CC1 ZINC000302834085 511717045 /nfs/dbraw/zinc/71/70/45/511717045.db2.gz SMSZEVWIFAZFGJ-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H](CO)c1ccc(Cl)cc1 ZINC000296409040 511731291 /nfs/dbraw/zinc/73/12/91/511731291.db2.gz UHUOLXWVMOWHSJ-IAGOWNOFSA-N 1 1 350.802 2.947 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312662575 511785994 /nfs/dbraw/zinc/78/59/94/511785994.db2.gz MMYDWXDGCWHWQZ-INIZCTEOSA-N 1 1 368.437 2.819 20 5 FFBDMO COC[C@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000363829656 511793271 /nfs/dbraw/zinc/79/32/71/511793271.db2.gz WRYMKIACDNJEHK-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO COC[C@@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000363829659 511793688 /nfs/dbraw/zinc/79/36/88/511793688.db2.gz WRYMKIACDNJEHK-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1c(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000350402009 511802406 /nfs/dbraw/zinc/80/24/06/511802406.db2.gz RRQDZJNPNZZUDP-GUYCJALGSA-N 1 1 360.370 2.579 20 5 FFBDMO CCC(=O)c1ccc(N2CC[N@H+](C3CCOCC3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000281433442 511845849 /nfs/dbraw/zinc/84/58/49/511845849.db2.gz JNIRBJNTYUIFIB-AWEZNQCLSA-N 1 1 361.442 2.877 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000325456608 511847902 /nfs/dbraw/zinc/84/79/02/511847902.db2.gz ZDBPFDSWYXTMPI-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCO1 ZINC000325456608 511847910 /nfs/dbraw/zinc/84/79/10/511847910.db2.gz ZDBPFDSWYXTMPI-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)C1=NOC2(C1)CC[NH+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC2 ZINC000274608597 511886957 /nfs/dbraw/zinc/88/69/57/511886957.db2.gz NREZIGUZQYSVBN-UHFFFAOYSA-N 1 1 367.789 2.532 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cn1 ZINC000274750902 511930737 /nfs/dbraw/zinc/93/07/37/511930737.db2.gz HLKVMCPMKZUSCU-LLVKDONJSA-N 1 1 369.830 2.768 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](O)Cc1ccccc1 ZINC000293432332 511962967 /nfs/dbraw/zinc/96/29/67/511962967.db2.gz UKHMVNBBGZXKKN-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](O)Cc1ccccc1 ZINC000293432332 511962974 /nfs/dbraw/zinc/96/29/74/511962974.db2.gz UKHMVNBBGZXKKN-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000371557828 512464027 /nfs/dbraw/zinc/46/40/27/512464027.db2.gz IABAZUIKIXMAPT-HNNXBMFYSA-N 1 1 371.441 2.522 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CCCN(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC000375812105 512520323 /nfs/dbraw/zinc/52/03/23/512520323.db2.gz XOULJNCXBYWHIJ-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCN(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC000375812105 512520326 /nfs/dbraw/zinc/52/03/26/512520326.db2.gz XOULJNCXBYWHIJ-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)NCc1ccccc1Cl ZINC000411478978 512655185 /nfs/dbraw/zinc/65/51/85/512655185.db2.gz LKBQBTYSJCJZDH-UHFFFAOYSA-N 1 1 374.828 2.708 20 5 FFBDMO O=C(CC[N@H+](CCO)Cc1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411631856 512727890 /nfs/dbraw/zinc/72/78/90/512727890.db2.gz NWBHTLPQKCBNGU-UHFFFAOYSA-N 1 1 361.373 2.557 20 5 FFBDMO CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000378406447 512743698 /nfs/dbraw/zinc/74/36/98/512743698.db2.gz UONIMWCDACWSTO-HOCLYGCPSA-N 1 1 371.441 2.626 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@H]1C[C@H](C)O ZINC000411681008 512755574 /nfs/dbraw/zinc/75/55/74/512755574.db2.gz VQHHDLBJNFAFON-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO COCC[C@@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000376376629 512791774 /nfs/dbraw/zinc/79/17/74/512791774.db2.gz OZDJSSLAVCDWPL-HNNXBMFYSA-N 1 1 370.471 2.507 20 5 FFBDMO COCC[C@@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000376376629 512791776 /nfs/dbraw/zinc/79/17/76/512791776.db2.gz OZDJSSLAVCDWPL-HNNXBMFYSA-N 1 1 370.471 2.507 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)CC2 ZINC000378520707 512804327 /nfs/dbraw/zinc/80/43/27/512804327.db2.gz PIASFRYSHWVCRO-UHFFFAOYSA-N 1 1 372.469 2.895 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](CO)CC(C)(C)C ZINC000411788691 512812182 /nfs/dbraw/zinc/81/21/82/512812182.db2.gz GZYVMUKJVFDYBO-AWEZNQCLSA-N 1 1 367.446 2.661 20 5 FFBDMO CC(C)(O)C[N@H+]1CCc2c(cccc2NC(=O)c2ccc([N+](=O)[O-])o2)C1 ZINC000368166877 512828483 /nfs/dbraw/zinc/82/84/83/512828483.db2.gz KFOKKLRJBUYVGN-UHFFFAOYSA-N 1 1 359.382 2.569 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411823431 512832546 /nfs/dbraw/zinc/83/25/46/512832546.db2.gz PWFKZMFDDQREIS-HNNXBMFYSA-N 1 1 365.430 2.823 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000411957884 512888991 /nfs/dbraw/zinc/88/89/91/512888991.db2.gz BQZSNQRHYQJDLM-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000411962554 512891648 /nfs/dbraw/zinc/89/16/48/512891648.db2.gz GNGBBLFFRHSMNA-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1 ZINC000376741099 512966775 /nfs/dbraw/zinc/96/67/75/512966775.db2.gz CWGTUAVNAVFLRY-UHFFFAOYSA-N 1 1 355.398 2.826 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H](C)[N@H+](C)C[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075216 512994291 /nfs/dbraw/zinc/99/42/91/512994291.db2.gz YJUPZGBGZZHJJX-OWCLPIDISA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H](C)[N@@H+](C)C[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075216 512994293 /nfs/dbraw/zinc/99/42/93/512994293.db2.gz YJUPZGBGZZHJJX-OWCLPIDISA-N 1 1 374.485 2.996 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1F ZINC000412210456 512998028 /nfs/dbraw/zinc/99/80/28/512998028.db2.gz SBURSMHXXWGCQX-CYBMUJFWSA-N 1 1 367.421 2.522 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000368855094 513122747 /nfs/dbraw/zinc/12/27/47/513122747.db2.gz QRZRPMQWCGVATG-OAHLLOKOSA-N 1 1 361.398 2.870 20 5 FFBDMO C[C@H]([C@H](C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[NH+]1CCOCC1 ZINC000450313998 513137513 /nfs/dbraw/zinc/13/75/13/513137513.db2.gz SPHICFDTXLEGPV-QWHCGFSZSA-N 1 1 362.455 2.661 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](CO)C2)cc1OC ZINC000446027452 513167629 /nfs/dbraw/zinc/16/76/29/513167629.db2.gz XJPMGWDYAIQZKG-ZIAGYGMSSA-N 1 1 352.431 2.843 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](CO)C2)cc1OC ZINC000446027452 513167633 /nfs/dbraw/zinc/16/76/33/513167633.db2.gz XJPMGWDYAIQZKG-ZIAGYGMSSA-N 1 1 352.431 2.843 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000412703008 513235443 /nfs/dbraw/zinc/23/54/43/513235443.db2.gz XKZITQRGONRXQJ-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000412703008 513235447 /nfs/dbraw/zinc/23/54/47/513235447.db2.gz XKZITQRGONRXQJ-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000417859825 513243079 /nfs/dbraw/zinc/24/30/79/513243079.db2.gz XBIDJXLJGKOGEW-KDOFPFPSSA-N 1 1 369.425 2.715 20 5 FFBDMO CNC(=O)[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000421396793 513247517 /nfs/dbraw/zinc/24/75/17/513247517.db2.gz ZUKNAQAIQBEFMU-MRXNPFEDSA-N 1 1 368.437 2.931 20 5 FFBDMO CO[C@H](Cc1ccccc1)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450561484 513251673 /nfs/dbraw/zinc/25/16/73/513251673.db2.gz FWHODNXLEFAXHT-SJLPKXTDSA-N 1 1 356.426 2.734 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000450571280 513256169 /nfs/dbraw/zinc/25/61/69/513256169.db2.gz RMVYLTXGCBZZED-ZDUSSCGKSA-N 1 1 353.369 2.788 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H]3Cc4cccc(O)c4C3)n2)cc1 ZINC000429317634 513338624 /nfs/dbraw/zinc/33/86/24/513338624.db2.gz OMWCGRNRFQUQBW-ZDUSSCGKSA-N 1 1 352.350 2.607 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNc3ncc([N+](=O)[O-])cc3F)c2)CCO1 ZINC000413068244 513421778 /nfs/dbraw/zinc/42/17/78/513421778.db2.gz GATSKAKJTAHYDB-ZDUSSCGKSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ncc([N+](=O)[O-])cc3F)c2)CCO1 ZINC000413068244 513421784 /nfs/dbraw/zinc/42/17/84/513421784.db2.gz GATSKAKJTAHYDB-ZDUSSCGKSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@@H]1CN(c2cccc3cnccc32)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000447390286 513463484 /nfs/dbraw/zinc/46/34/84/513463484.db2.gz FVDDJADYQFWFGI-OAHLLOKOSA-N 1 1 366.425 2.550 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000451078586 513502056 /nfs/dbraw/zinc/50/20/56/513502056.db2.gz MXHBCDWFHQXWMW-CYBMUJFWSA-N 1 1 353.369 2.788 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1 ZINC000441177177 513505708 /nfs/dbraw/zinc/50/57/08/513505708.db2.gz MSZHOGRLLNGGNT-UHFFFAOYSA-N 1 1 360.366 2.843 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)Cc1ccc(Cl)cc1 ZINC000441271719 513526694 /nfs/dbraw/zinc/52/66/94/513526694.db2.gz ROZLKTNBWCTNNI-ZIAGYGMSSA-N 1 1 366.849 2.759 20 5 FFBDMO CCC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccccc1OC ZINC000441289775 513531670 /nfs/dbraw/zinc/53/16/70/513531670.db2.gz VHFJHCXESKTZDD-ZBFHGGJFSA-N 1 1 362.430 2.634 20 5 FFBDMO C[N@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1csc([N+](=O)[O-])c1 ZINC000425371423 513534089 /nfs/dbraw/zinc/53/40/89/513534089.db2.gz LITSJHGWDQPTDS-UHFFFAOYSA-N 1 1 359.407 2.774 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1csc([N+](=O)[O-])c1 ZINC000425371423 513534093 /nfs/dbraw/zinc/53/40/93/513534093.db2.gz LITSJHGWDQPTDS-UHFFFAOYSA-N 1 1 359.407 2.774 20 5 FFBDMO C[C@@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@H+]1CCc2sccc2C1 ZINC000447670914 513536664 /nfs/dbraw/zinc/53/66/64/513536664.db2.gz OPXGEOVELSJEFZ-NSHDSACASA-N 1 1 357.439 2.813 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H]1C(C)C ZINC000430145754 513568339 /nfs/dbraw/zinc/56/83/39/513568339.db2.gz JXTYMEIIOQKJGB-GUYCJALGSA-N 1 1 366.414 2.632 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000430211260 513588182 /nfs/dbraw/zinc/58/81/82/513588182.db2.gz XHOPTXFDWRHADD-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000430211260 513588191 /nfs/dbraw/zinc/58/81/91/513588191.db2.gz XHOPTXFDWRHADD-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000430211260 513588201 /nfs/dbraw/zinc/58/82/01/513588201.db2.gz XHOPTXFDWRHADD-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@H]3[C@@H]3CCCOC3)co2)cc1 ZINC000451302934 513663638 /nfs/dbraw/zinc/66/36/38/513663638.db2.gz LNBRRMVPEVDKEE-OLMNPRSZSA-N 1 1 373.409 2.612 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451342295 513688765 /nfs/dbraw/zinc/68/87/65/513688765.db2.gz MKJQLUNJDGLUNP-KBAYOESNSA-N 1 1 361.442 2.857 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cc(Br)c1=O)Cc1ccccc1 ZINC000418920514 513690826 /nfs/dbraw/zinc/69/08/26/513690826.db2.gz LAPNHKLNDMKNIC-UHFFFAOYSA-N 1 1 366.215 2.651 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451417262 513738877 /nfs/dbraw/zinc/73/88/77/513738877.db2.gz KYOCQLBIZNWGDC-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451432884 513749465 /nfs/dbraw/zinc/74/94/65/513749465.db2.gz ZZFWPUNNXRUBIU-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1(C)C ZINC000451558519 513832753 /nfs/dbraw/zinc/83/27/53/513832753.db2.gz DCBBYPIQJBVNGJ-MRXNPFEDSA-N 1 1 363.414 2.640 20 5 FFBDMO CC[C@@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000436383805 513842734 /nfs/dbraw/zinc/84/27/34/513842734.db2.gz CQYGDFZZULFUCH-LLVKDONJSA-N 1 1 362.352 2.556 20 5 FFBDMO CC[C@@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000436383805 513842740 /nfs/dbraw/zinc/84/27/40/513842740.db2.gz CQYGDFZZULFUCH-LLVKDONJSA-N 1 1 362.352 2.556 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000448825085 513916243 /nfs/dbraw/zinc/91/62/43/513916243.db2.gz UWGSMTDHKHMHDD-HNNXBMFYSA-N 1 1 371.441 2.631 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000448923418 513973236 /nfs/dbraw/zinc/97/32/36/513973236.db2.gz FUIJROUCKZXKHO-OAHLLOKOSA-N 1 1 359.426 2.691 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000427095926 514114960 /nfs/dbraw/zinc/11/49/60/514114960.db2.gz ZALMWWCCLFCZDZ-HOCLYGCPSA-N 1 1 369.421 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CCC[C@]4(CC[NH2+]C4)C3)o2)c1 ZINC000420386758 514122775 /nfs/dbraw/zinc/12/27/75/514122775.db2.gz VOSVCFBYWYZIES-LJQANCHMSA-N 1 1 356.426 2.868 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000432193677 514123592 /nfs/dbraw/zinc/12/35/92/514123592.db2.gz WRZPZZHQCOLBQO-INIZCTEOSA-N 1 1 363.458 2.766 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414467947 514136370 /nfs/dbraw/zinc/13/63/70/514136370.db2.gz CEZMSYFRPXCXJU-SFHVURJKSA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000414467947 514136375 /nfs/dbraw/zinc/13/63/75/514136375.db2.gz CEZMSYFRPXCXJU-SFHVURJKSA-N 1 1 356.426 2.996 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437345546 514145461 /nfs/dbraw/zinc/14/54/61/514145461.db2.gz LEJYLWNQWNBMQR-LKFCYVNXSA-N 1 1 357.332 2.826 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C(=O)N(C)C)C3)o2)c([N+](=O)[O-])c1 ZINC000414494902 514148556 /nfs/dbraw/zinc/14/85/56/514148556.db2.gz FVTCZZZQOOGYGY-CYBMUJFWSA-N 1 1 373.409 2.774 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420602873 514197661 /nfs/dbraw/zinc/19/76/61/514197661.db2.gz OWQXDYKJQUIUHL-GJZGRUSLSA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](CCCO)C1 ZINC000452130253 514211163 /nfs/dbraw/zinc/21/11/63/514211163.db2.gz NQDUMQMZATVCNM-NWDGAFQWSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](CCCO)C1 ZINC000452130253 514211171 /nfs/dbraw/zinc/21/11/71/514211171.db2.gz NQDUMQMZATVCNM-NWDGAFQWSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CF)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000449490226 514227955 /nfs/dbraw/zinc/22/79/55/514227955.db2.gz WWIHYDSBOVUQRB-MRXNPFEDSA-N 1 1 362.405 2.774 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+](C2CC2)C1 ZINC000452171070 514229838 /nfs/dbraw/zinc/22/98/38/514229838.db2.gz JSPBFZABEANDPR-CYBMUJFWSA-N 1 1 354.410 2.699 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437987925 514283562 /nfs/dbraw/zinc/28/35/62/514283562.db2.gz RMXSVURGFNEJAY-GUYCJALGSA-N 1 1 358.442 2.752 20 5 FFBDMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677696 514298799 /nfs/dbraw/zinc/29/87/99/514298799.db2.gz NKYLZBUTRPWCKW-LRDDRELGSA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677696 514298806 /nfs/dbraw/zinc/29/88/06/514298806.db2.gz NKYLZBUTRPWCKW-LRDDRELGSA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]1[NH2+]CCc2ccccc21 ZINC000414941913 514366723 /nfs/dbraw/zinc/36/67/23/514366723.db2.gz BGYNRQHGHMRWPQ-IFXJQAMLSA-N 1 1 368.437 2.789 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000415132449 514459209 /nfs/dbraw/zinc/45/92/09/514459209.db2.gz UGJKMBHYPBPFJM-IEBWSBKVSA-N 1 1 363.458 2.712 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000450019508 514468061 /nfs/dbraw/zinc/46/80/61/514468061.db2.gz UXMYBHBYWSOYLN-INIZCTEOSA-N 1 1 373.453 2.748 20 5 FFBDMO CCc1n[nH]c(C(=O)NCC2([N@@H+](C)Cc3ccccc3)CCC2)c1[N+](=O)[O-] ZINC000452728114 514476642 /nfs/dbraw/zinc/47/66/42/514476642.db2.gz HWLKRCUDCIPUCG-UHFFFAOYSA-N 1 1 371.441 2.665 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)c1 ZINC000428531926 514489899 /nfs/dbraw/zinc/48/98/99/514489899.db2.gz AXJLRSCBVGQFQT-INIZCTEOSA-N 1 1 355.394 2.722 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])c1 ZINC000439110772 514495256 /nfs/dbraw/zinc/49/52/56/514495256.db2.gz VQXNJNDLLPIXRV-UHFFFAOYSA-N 1 1 358.398 2.840 20 5 FFBDMO CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475305355 514611249 /nfs/dbraw/zinc/61/12/49/514611249.db2.gz NPLLDKRTQSZKKE-SFHVURJKSA-N 1 1 353.422 2.870 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475309827 514612422 /nfs/dbraw/zinc/61/24/22/514612422.db2.gz YQYDBOQVIQHODO-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO Cn1c(C(=O)N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000461434742 514615970 /nfs/dbraw/zinc/61/59/70/514615970.db2.gz ZCIHLPUNTABPJA-DLBZAZTESA-N 1 1 368.437 2.527 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000461620778 514670136 /nfs/dbraw/zinc/67/01/36/514670136.db2.gz XLRPCKHYXYNOCL-CQSZACIVSA-N 1 1 373.457 2.846 20 5 FFBDMO O=C([C@@H]1CC[N@@H+]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000475516009 514697872 /nfs/dbraw/zinc/69/78/72/514697872.db2.gz CXMKZYVKBYIMMO-IBGZPJMESA-N 1 1 351.406 2.754 20 5 FFBDMO O=C([C@@H]1CC[N@H+]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000475516009 514697883 /nfs/dbraw/zinc/69/78/83/514697883.db2.gz CXMKZYVKBYIMMO-IBGZPJMESA-N 1 1 351.406 2.754 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCCN(CC[NH+]1CCOCC1)c1ccccc1 ZINC000471172946 514782569 /nfs/dbraw/zinc/78/25/69/514782569.db2.gz NMAXEKGALSKXNZ-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO Cc1cc(NC(=O)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cn2cc[nH+]c12 ZINC000502850242 514810057 /nfs/dbraw/zinc/81/00/57/514810057.db2.gz PCAPYNHZBDWISE-UHFFFAOYSA-N 1 1 368.349 2.503 20 5 FFBDMO Cc1cc(NC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cn2cc[nH+]c12 ZINC000502980424 514867591 /nfs/dbraw/zinc/86/75/91/514867591.db2.gz GFLFUZXOTKZHKX-UHFFFAOYSA-N 1 1 362.349 2.989 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000467047270 514876722 /nfs/dbraw/zinc/87/67/22/514876722.db2.gz RKLRRIRYOIAUQV-IAQYHMDHSA-N 1 1 372.450 2.931 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000508763565 514888738 /nfs/dbraw/zinc/88/87/38/514888738.db2.gz IDRZQGIRUWMXME-XHSDSOJGSA-N 1 1 362.474 2.879 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])nn1C ZINC000476059067 514901684 /nfs/dbraw/zinc/90/16/84/514901684.db2.gz FUZPFNQQSKIUIE-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO COCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CC=CCC1 ZINC000485119527 514922153 /nfs/dbraw/zinc/92/21/53/514922153.db2.gz GIIJNTMMQJJREA-MRXNPFEDSA-N 1 1 361.442 2.862 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000467217809 514943244 /nfs/dbraw/zinc/94/32/44/514943244.db2.gz OOCBKCMOQGXVQZ-STQMWFEESA-N 1 1 352.822 2.674 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000485204216 514954356 /nfs/dbraw/zinc/95/43/56/514954356.db2.gz NFGNNDSBSOTSQO-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000485204216 514954366 /nfs/dbraw/zinc/95/43/66/514954366.db2.gz NFGNNDSBSOTSQO-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000498553577 514965520 /nfs/dbraw/zinc/96/55/20/514965520.db2.gz GLRMFRUHADSWCK-OLZOCXBDSA-N 1 1 369.849 2.958 20 5 FFBDMO CCc1ccc(C(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000471672825 514976838 /nfs/dbraw/zinc/97/68/38/514976838.db2.gz YYDWNBUDJOJJKR-QGZVFWFLSA-N 1 1 363.458 2.634 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000485555542 515087271 /nfs/dbraw/zinc/08/72/71/515087271.db2.gz XSEGOPZKGLJOAF-HNNXBMFYSA-N 1 1 368.437 2.885 20 5 FFBDMO CCC1(O)CC[NH+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000490396631 515196992 /nfs/dbraw/zinc/19/69/92/515196992.db2.gz DPUJOPJHYOUPQX-UHFFFAOYSA-N 1 1 374.384 2.984 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000490653733 515274440 /nfs/dbraw/zinc/27/44/40/515274440.db2.gz RJTKRTBXVOLBJD-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000490653733 515274447 /nfs/dbraw/zinc/27/44/47/515274447.db2.gz RJTKRTBXVOLBJD-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000485959684 515274667 /nfs/dbraw/zinc/27/46/67/515274667.db2.gz RPQDOSRQKRUKHK-UHFFFAOYSA-N 1 1 355.385 2.796 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCN([C@@H]4CC[NH2+]C4)CC3)s2)cc1 ZINC000491250233 515400984 /nfs/dbraw/zinc/40/09/84/515400984.db2.gz QGMGNQNDRSRVQD-QGZVFWFLSA-N 1 1 372.494 2.803 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1 ZINC000499660746 515403965 /nfs/dbraw/zinc/40/39/65/515403965.db2.gz ZOJZMNJGSFIUEU-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO Cn1c(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000477298948 515404831 /nfs/dbraw/zinc/40/48/31/515404831.db2.gz YJGHXWKUSSZBTR-QGZVFWFLSA-N 1 1 356.426 2.574 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000486478897 515501291 /nfs/dbraw/zinc/50/12/91/515501291.db2.gz BHXCSXPYLFBZKJ-HNNXBMFYSA-N 1 1 354.838 2.730 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456982188 515563574 /nfs/dbraw/zinc/56/35/74/515563574.db2.gz GIVFJYXQZXTFSE-MRXNPFEDSA-N 1 1 355.394 2.780 20 5 FFBDMO CCOc1cc(CN2CCN(c3cc(OC)cc[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000492792177 515564025 /nfs/dbraw/zinc/56/40/25/515564025.db2.gz SINALGHFUVAYDO-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456998028 515574201 /nfs/dbraw/zinc/57/42/01/515574201.db2.gz RJDADNVAJSBNEM-MRXNPFEDSA-N 1 1 355.394 2.537 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)cc1OC ZINC000500124131 515601573 /nfs/dbraw/zinc/60/15/73/515601573.db2.gz UTFVEKWHFGEIJZ-CHWSQXEVSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]3Cn3ccnn3)o2)c1 ZINC000493345735 515624478 /nfs/dbraw/zinc/62/44/78/515624478.db2.gz VOYRQVLEALRFRW-INIZCTEOSA-N 1 1 368.397 2.548 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000457083580 515636657 /nfs/dbraw/zinc/63/66/57/515636657.db2.gz FNWVPDHPZLJSIU-CYBMUJFWSA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000457089853 515641473 /nfs/dbraw/zinc/64/14/73/515641473.db2.gz LORTXBXYVJROKS-LBPRGKRZSA-N 1 1 357.357 2.751 20 5 FFBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCN(c2cnccn2)CC1 ZINC000510790547 515670403 /nfs/dbraw/zinc/67/04/03/515670403.db2.gz HYBYMERSJYAJAN-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCN(c2cnccn2)CC1 ZINC000510790547 515670410 /nfs/dbraw/zinc/67/04/10/515670410.db2.gz HYBYMERSJYAJAN-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)n1 ZINC000478037375 515675660 /nfs/dbraw/zinc/67/56/60/515675660.db2.gz PQYZSWYADXDWNJ-FQEVSTJZSA-N 1 1 369.469 2.779 20 5 FFBDMO COc1ccc(OCC[N@H+](Cc2cnn(C)c2)CC(C)C)c([N+](=O)[O-])c1 ZINC000459594837 515678354 /nfs/dbraw/zinc/67/83/54/515678354.db2.gz PSNDWHPFUBBUGR-UHFFFAOYSA-N 1 1 362.430 2.874 20 5 FFBDMO CC(C)[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC[N@H+]1C ZINC000487138629 515774062 /nfs/dbraw/zinc/77/40/62/515774062.db2.gz NRORSSUEDMMSHU-SFHVURJKSA-N 1 1 360.458 2.607 20 5 FFBDMO CNc1nc(C(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000454958051 515857290 /nfs/dbraw/zinc/85/72/90/515857290.db2.gz VHHNTFBPTUDSBS-HIFRSBDPSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000511471402 515917979 /nfs/dbraw/zinc/91/79/79/515917979.db2.gz AORYDJHUBHUQQH-HZPDHXFCSA-N 1 1 362.474 2.899 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C3(CC3)C2)cc1OC ZINC000494683634 515922687 /nfs/dbraw/zinc/92/26/87/515922687.db2.gz WHLQXCYGDIJTOW-FZKQIMNGSA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C3(CC3)C2)cc1OC ZINC000494683634 515922694 /nfs/dbraw/zinc/92/26/94/515922694.db2.gz WHLQXCYGDIJTOW-FZKQIMNGSA-N 1 1 364.442 2.985 20 5 FFBDMO CC(C)[C@H]1CN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000487960524 516053446 /nfs/dbraw/zinc/05/34/46/516053446.db2.gz FJIHAGQBYKWISX-CZUORRHYSA-N 1 1 359.430 2.978 20 5 FFBDMO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470301705 516198894 /nfs/dbraw/zinc/19/88/94/516198894.db2.gz BCWACRQXMSDVFV-HNNXBMFYSA-N 1 1 373.453 2.839 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000507470137 516218919 /nfs/dbraw/zinc/21/89/19/516218919.db2.gz TXTKTYVFQAQGLF-HIFRSBDPSA-N 1 1 357.414 2.616 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000470368114 516222655 /nfs/dbraw/zinc/22/26/55/516222655.db2.gz XJYWHCRBNWRYIM-INIZCTEOSA-N 1 1 362.474 2.805 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C1 ZINC000507845366 516313047 /nfs/dbraw/zinc/31/30/47/516313047.db2.gz RXPBDZKTMRGKRB-AWEZNQCLSA-N 1 1 358.446 2.558 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000497544291 516325860 /nfs/dbraw/zinc/32/58/60/516325860.db2.gz WKEBOALATLKCGO-AWEZNQCLSA-N 1 1 369.487 2.922 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2(CO)CC2)cc1OC ZINC000512835322 516381463 /nfs/dbraw/zinc/38/14/63/516381463.db2.gz WDOMTEFRUVJENG-ZDUSSCGKSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2(CO)CC2)cc1OC ZINC000512835322 516381474 /nfs/dbraw/zinc/38/14/74/516381474.db2.gz WDOMTEFRUVJENG-ZDUSSCGKSA-N 1 1 352.431 2.985 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC1CCN(c2[nH+]ccn2C)CC1 ZINC000557684938 516383508 /nfs/dbraw/zinc/38/35/08/516383508.db2.gz MKQFEMXCNJXHAM-UHFFFAOYSA-N 1 1 373.413 2.504 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000517641152 516395084 /nfs/dbraw/zinc/39/50/84/516395084.db2.gz GNQZULOPRNHINU-HNNXBMFYSA-N 1 1 363.458 2.990 20 5 FFBDMO COc1ccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000517765855 516443378 /nfs/dbraw/zinc/44/33/78/516443378.db2.gz KREYZAHJHGLVPZ-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000531388796 516444663 /nfs/dbraw/zinc/44/46/63/516444663.db2.gz CVOMBFKJRMAUAF-RHSMWYFYSA-N 1 1 356.426 2.574 20 5 FFBDMO CNc1ccc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000561281879 516498954 /nfs/dbraw/zinc/49/89/54/516498954.db2.gz XIZKKBBONWAZIC-UHFFFAOYSA-N 1 1 354.410 2.593 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000531624600 516560310 /nfs/dbraw/zinc/56/03/10/516560310.db2.gz XMSJWCZYYQTXFE-IBGZPJMESA-N 1 1 368.437 2.803 20 5 FFBDMO CC1(C)C[N@H+](C2(CNC(=O)c3ccc([N+](=O)[O-])o3)CCCCC2)CCO1 ZINC000518184122 516568601 /nfs/dbraw/zinc/56/86/01/516568601.db2.gz ATMVESALXZGSDW-UHFFFAOYSA-N 1 1 365.430 2.731 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000540479951 516575131 /nfs/dbraw/zinc/57/51/31/516575131.db2.gz CWZQRVNTUGETNG-AWEZNQCLSA-N 1 1 357.410 2.913 20 5 FFBDMO COC(=O)c1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000540479067 516575434 /nfs/dbraw/zinc/57/54/34/516575434.db2.gz TVFHLFRXYICHSN-LBPRGKRZSA-N 1 1 357.366 2.671 20 5 FFBDMO CCc1ccc([C@H]2CCC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000513400946 516606274 /nfs/dbraw/zinc/60/62/74/516606274.db2.gz IGAWCINNALTFLK-PKOBYXMFSA-N 1 1 358.442 2.594 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])c1 ZINC000554861417 516668188 /nfs/dbraw/zinc/66/81/88/516668188.db2.gz XHNYXCYLWDSDBS-UHFFFAOYSA-N 1 1 354.370 2.938 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000518596613 516717832 /nfs/dbraw/zinc/71/78/32/516717832.db2.gz GRNLUWOADMWEGW-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000524434776 516720089 /nfs/dbraw/zinc/72/00/89/516720089.db2.gz KMPQTZLBTXYCGU-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000561721659 516732242 /nfs/dbraw/zinc/73/22/42/516732242.db2.gz VKVUDDDZKWVUPT-QGZVFWFLSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000544392830 516739901 /nfs/dbraw/zinc/73/99/01/516739901.db2.gz BFBMFHMWOUIOFE-ONGXEEELSA-N 1 1 357.252 2.980 20 5 FFBDMO COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000536389769 516747515 /nfs/dbraw/zinc/74/75/15/516747515.db2.gz HFNNSMKCHTYISS-UHFFFAOYSA-N 1 1 356.426 2.815 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000561777385 516768028 /nfs/dbraw/zinc/76/80/28/516768028.db2.gz WBJFMQRYPWKQTB-QGZVFWFLSA-N 1 1 362.474 2.899 20 5 FFBDMO CN1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc[nH+]c21 ZINC000536471526 516780080 /nfs/dbraw/zinc/78/00/80/516780080.db2.gz RNMXTQLBRQQONO-UHFFFAOYSA-N 1 1 361.789 2.538 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(Nc2ccc(N3CCOCC3)[nH+]c2C)c1 ZINC000541114267 516882512 /nfs/dbraw/zinc/88/25/12/516882512.db2.gz PEBDYJQHFHMMCO-UHFFFAOYSA-N 1 1 372.381 2.665 20 5 FFBDMO Cc1ccsc1[C@H](CO)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548298493 516883238 /nfs/dbraw/zinc/88/32/38/516883238.db2.gz FMUXOAQMVNKCOO-AWEZNQCLSA-N 1 1 350.396 2.654 20 5 FFBDMO CO[C@H](CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000552066039 517059907 /nfs/dbraw/zinc/05/99/07/517059907.db2.gz WZXXBJMCPDSYBS-KGLIPLIRSA-N 1 1 372.347 2.975 20 5 FFBDMO COC(C)(C)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000532645009 517077591 /nfs/dbraw/zinc/07/75/91/517077591.db2.gz XXBCSSNECLXMIG-UHFFFAOYSA-N 1 1 374.235 2.653 20 5 FFBDMO COC(C)(C)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000532645009 517077594 /nfs/dbraw/zinc/07/75/94/517077594.db2.gz XXBCSSNECLXMIG-UHFFFAOYSA-N 1 1 374.235 2.653 20 5 FFBDMO C[C@@H]1C[C@H]1N1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000525708446 517129645 /nfs/dbraw/zinc/12/96/45/517129645.db2.gz PKHPQBYBAKCWBY-PVXIVEMSSA-N 1 1 372.450 2.817 20 5 FFBDMO Cc1sc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000552201021 517138692 /nfs/dbraw/zinc/13/86/92/517138692.db2.gz YFEUUZNZXHUTFY-AWEZNQCLSA-N 1 1 361.423 2.784 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249644 517162206 /nfs/dbraw/zinc/16/22/06/517162206.db2.gz GUCOCHMWSQSCCZ-SFHVURJKSA-N 1 1 357.458 2.882 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000555880039 517164645 /nfs/dbraw/zinc/16/46/45/517164645.db2.gz IEWPLZPDWLHSIM-OAHLLOKOSA-N 1 1 371.441 2.783 20 5 FFBDMO Cc1ccc(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000552269774 517170732 /nfs/dbraw/zinc/17/07/32/517170732.db2.gz QBGUZGHDFDNYRV-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000559425463 517248678 /nfs/dbraw/zinc/24/86/78/517248678.db2.gz MHRNVMRQXWUZQV-GOSISDBHSA-N 1 1 360.414 2.875 20 5 FFBDMO CC(C)[C@H](CNc1ccc([N+](=O)[O-])cc1OC(F)F)N1CC[NH+](C)CC1 ZINC000545484731 517263161 /nfs/dbraw/zinc/26/31/61/517263161.db2.gz LKJHGIMAYZZKKW-HNNXBMFYSA-N 1 1 372.416 2.880 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000515335787 517304831 /nfs/dbraw/zinc/30/48/31/517304831.db2.gz OCEWOJOQKMLFTK-XJKSGUPXSA-N 1 1 367.421 2.601 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000541964599 517313328 /nfs/dbraw/zinc/31/33/28/517313328.db2.gz MQFXDLXZGDEANV-NSHDSACASA-N 1 1 357.357 2.610 20 5 FFBDMO C[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000520379809 517369728 /nfs/dbraw/zinc/36/97/28/517369728.db2.gz QBVUTBJIDSUSKF-OAHLLOKOSA-N 1 1 368.437 2.570 20 5 FFBDMO C[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000520379809 517369734 /nfs/dbraw/zinc/36/97/34/517369734.db2.gz QBVUTBJIDSUSKF-OAHLLOKOSA-N 1 1 368.437 2.570 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000552999992 517471001 /nfs/dbraw/zinc/47/10/01/517471001.db2.gz ZIFZNMPTLXMVMK-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000552999992 517471009 /nfs/dbraw/zinc/47/10/09/517471009.db2.gz ZIFZNMPTLXMVMK-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N1CCC(c2ccccc2)=N1)c1cccc([N+](=O)[O-])c1 ZINC000538176825 517493799 /nfs/dbraw/zinc/49/37/99/517493799.db2.gz NMGUQLKJRAVVAA-CQSZACIVSA-N 1 1 352.394 2.882 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000527090000 517498419 /nfs/dbraw/zinc/49/84/19/517498419.db2.gz JLPDEUBJCPMLGG-IRXDYDNUSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000542351052 517516395 /nfs/dbraw/zinc/51/63/95/517516395.db2.gz DDIFBZCRSLTWIW-LLVKDONJSA-N 1 1 357.863 2.798 20 5 FFBDMO CC[C@@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000553161375 517550709 /nfs/dbraw/zinc/55/07/09/517550709.db2.gz MZVSQYPVUIUSQQ-MRXNPFEDSA-N 1 1 368.437 2.795 20 5 FFBDMO Cc1c(Br)c(N[C@H]2C[N@H+](C3CC3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000542506324 517600906 /nfs/dbraw/zinc/60/09/06/517600906.db2.gz JFYOXRDUONKYMS-KCJUWKMLSA-N 1 1 355.236 2.955 20 5 FFBDMO Cc1c(Br)c(N[C@H]2C[N@@H+](C3CC3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000542506324 517600915 /nfs/dbraw/zinc/60/09/15/517600915.db2.gz JFYOXRDUONKYMS-KCJUWKMLSA-N 1 1 355.236 2.955 20 5 FFBDMO Cc1c(Br)c(N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000542506327 517601619 /nfs/dbraw/zinc/60/16/19/517601619.db2.gz JFYOXRDUONKYMS-KWQFWETISA-N 1 1 355.236 2.955 20 5 FFBDMO Cc1c(Br)c(N[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000542506327 517601629 /nfs/dbraw/zinc/60/16/29/517601629.db2.gz JFYOXRDUONKYMS-KWQFWETISA-N 1 1 355.236 2.955 20 5 FFBDMO Cn1ccnc1[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519238 517607336 /nfs/dbraw/zinc/60/73/36/517607336.db2.gz MTVDLUMBPODQME-CQSZACIVSA-N 1 1 353.382 2.973 20 5 FFBDMO COc1ccc(S(=O)(=O)[N-]c2ccc3nc(C)[nH]c3c2)c([N+](=O)[O-])c1 ZINC000533949345 517680377 /nfs/dbraw/zinc/68/03/77/517680377.db2.gz QMSVBTNIMDFSDD-UHFFFAOYSA-N 1 1 362.367 2.589 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000534020780 517710155 /nfs/dbraw/zinc/71/01/55/517710155.db2.gz SSKZULORQKJTJW-WMZOPIPTSA-N 1 1 354.410 2.812 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC2 ZINC000553534845 517768763 /nfs/dbraw/zinc/76/87/63/517768763.db2.gz QPKJFQKWDNFVHT-OAHLLOKOSA-N 1 1 354.410 2.853 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCNc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000560524466 517871355 /nfs/dbraw/zinc/87/13/55/517871355.db2.gz BJLDVTUZXCYKPB-SFHVURJKSA-N 1 1 366.425 2.905 20 5 FFBDMO Cc1ccc(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000534400585 517880776 /nfs/dbraw/zinc/88/07/76/517880776.db2.gz PZCVHZODPOIWDW-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000557152348 517886341 /nfs/dbraw/zinc/88/63/41/517886341.db2.gz GQGLWMKKXKTLIQ-UHFFFAOYSA-N 1 1 361.398 2.547 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000521907691 517896191 /nfs/dbraw/zinc/89/61/91/517896191.db2.gz LJDGYDGQGLYNHH-DZGCQCFKSA-N 1 1 371.441 2.836 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000530709895 517933494 /nfs/dbraw/zinc/93/34/94/517933494.db2.gz KJSDWHRIPIZBGT-GDBMZVCRSA-N 1 1 356.426 2.716 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000543178711 517949300 /nfs/dbraw/zinc/94/93/00/517949300.db2.gz UVNUFBKLQTUPNF-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000543178711 517949310 /nfs/dbraw/zinc/94/93/10/517949310.db2.gz UVNUFBKLQTUPNF-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1)[NH+]1CCOCC1 ZINC000522020349 517954062 /nfs/dbraw/zinc/95/40/62/517954062.db2.gz PZMIEQWBIAYBFN-ZDUSSCGKSA-N 1 1 358.398 2.579 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1 ZINC000522107144 517986391 /nfs/dbraw/zinc/98/63/91/517986391.db2.gz UYCQLOKTOQVQOM-UHFFFAOYSA-N 1 1 360.458 2.798 20 5 FFBDMO O=C(C[NH2+]C1(c2ccc3c(c2)OCO3)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000539336547 517998475 /nfs/dbraw/zinc/99/84/75/517998475.db2.gz XHKFFBCDNPTONY-UHFFFAOYSA-N 1 1 355.350 2.541 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000522195069 518027954 /nfs/dbraw/zinc/02/79/54/518027954.db2.gz QHRYYAZPEVCTMS-CQSZACIVSA-N 1 1 359.430 2.856 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000522195069 518027955 /nfs/dbraw/zinc/02/79/55/518027955.db2.gz QHRYYAZPEVCTMS-CQSZACIVSA-N 1 1 359.430 2.856 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000522195069 518027960 /nfs/dbraw/zinc/02/79/60/518027960.db2.gz QHRYYAZPEVCTMS-CQSZACIVSA-N 1 1 359.430 2.856 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=C(C)CC2)cc1SC ZINC000547274278 518049167 /nfs/dbraw/zinc/04/91/67/518049167.db2.gz NYVBGTCCPDZARB-UHFFFAOYSA-N 1 1 365.455 2.707 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000522386959 518095257 /nfs/dbraw/zinc/09/52/57/518095257.db2.gz QKRGINYGRBIKTN-STQMWFEESA-N 1 1 369.849 2.816 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000517268949 518100170 /nfs/dbraw/zinc/10/01/70/518100170.db2.gz RMCPFEAZJAFLOX-HNNXBMFYSA-N 1 1 374.441 2.516 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558265 518111941 /nfs/dbraw/zinc/11/19/41/518111941.db2.gz FPNFCBZDYRRKKI-GUYCJALGSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558265 518111951 /nfs/dbraw/zinc/11/19/51/518111951.db2.gz FPNFCBZDYRRKKI-GUYCJALGSA-N 1 1 365.430 2.677 20 5 FFBDMO CC[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cn1 ZINC000543596101 518149752 /nfs/dbraw/zinc/14/97/52/518149752.db2.gz YNPSHAHLTSSFKB-OAHLLOKOSA-N 1 1 367.402 2.644 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522830459 518168166 /nfs/dbraw/zinc/16/81/66/518168166.db2.gz VGABNXYUYUMTTB-KRWDZBQOSA-N 1 1 354.410 2.518 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000578569180 518268595 /nfs/dbraw/zinc/26/85/95/518268595.db2.gz MJMZNQQUDIBHSM-ZFWWWQNUSA-N 1 1 373.457 2.743 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000584357220 518300111 /nfs/dbraw/zinc/30/01/11/518300111.db2.gz XHAOQOFVXXVHEW-IBGZPJMESA-N 1 1 366.465 2.991 20 5 FFBDMO C[N@H+]1CCN(CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1(C)C ZINC000564091576 518303549 /nfs/dbraw/zinc/30/35/49/518303549.db2.gz WRSIDBOSJIYDCZ-OAHLLOKOSA-N 1 1 374.407 2.814 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000569941558 518367651 /nfs/dbraw/zinc/36/76/51/518367651.db2.gz UFZMQJUGWLAXHW-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000569941558 518367656 /nfs/dbraw/zinc/36/76/56/518367656.db2.gz UFZMQJUGWLAXHW-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000585808423 518613571 /nfs/dbraw/zinc/61/35/71/518613571.db2.gz BRGPOXDCCXBGGP-SNVBAGLBSA-N 1 1 357.208 2.573 20 5 FFBDMO CC(C)[C@@H](O)C1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000586791521 518644161 /nfs/dbraw/zinc/64/41/61/518644161.db2.gz RYHACIBZQBXGBO-DLBZAZTESA-N 1 1 358.442 2.804 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000573478614 518685606 /nfs/dbraw/zinc/68/56/06/518685606.db2.gz QLRIWIUUCXZEPR-ZWKOTPCHSA-N 1 1 371.441 2.545 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000576957812 518847777 /nfs/dbraw/zinc/84/77/77/518847777.db2.gz SWCNXSNQQLGBST-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000576957812 518847784 /nfs/dbraw/zinc/84/77/84/518847784.db2.gz SWCNXSNQQLGBST-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576986122 518861987 /nfs/dbraw/zinc/86/19/87/518861987.db2.gz OEOBXALYWNBPMY-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576986122 518861990 /nfs/dbraw/zinc/86/19/90/518861990.db2.gz OEOBXALYWNBPMY-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000568143656 518894171 /nfs/dbraw/zinc/89/41/71/518894171.db2.gz DEJUITDPKYNMSY-LJQANCHMSA-N 1 1 371.441 2.836 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000568460504 519046490 /nfs/dbraw/zinc/04/64/90/519046490.db2.gz YQIKYJFLWSAMPF-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000590022643 519131076 /nfs/dbraw/zinc/13/10/76/519131076.db2.gz QCZZAICLZXTATL-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO CC(C)Oc1nc(NC(C)(C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000580465874 519190945 /nfs/dbraw/zinc/19/09/45/519190945.db2.gz ZNOFKKSZDWYBDR-UHFFFAOYSA-N 1 1 365.478 2.605 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680775 519199103 /nfs/dbraw/zinc/19/91/03/519199103.db2.gz SVNIBFLAHZULNZ-YJBOKZPZSA-N 1 1 358.398 2.689 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680775 519199108 /nfs/dbraw/zinc/19/91/08/519199108.db2.gz SVNIBFLAHZULNZ-YJBOKZPZSA-N 1 1 358.398 2.689 20 5 FFBDMO CSc1ccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000590538037 519259420 /nfs/dbraw/zinc/25/94/20/519259420.db2.gz IOOURGHOERRGPV-OLZOCXBDSA-N 1 1 353.419 2.575 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000577884383 519306480 /nfs/dbraw/zinc/30/64/80/519306480.db2.gz KUAKRITWHUVUJO-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[N@H+]1C1CC1 ZINC000583666818 519367029 /nfs/dbraw/zinc/36/70/29/519367029.db2.gz SQXBXSHQHPQYIB-HIFRSBDPSA-N 1 1 358.442 2.868 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccns1 ZINC000602880731 519946588 /nfs/dbraw/zinc/94/65/88/519946588.db2.gz CCRMKMOOIGFVOK-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1ccns1 ZINC000602880731 519946591 /nfs/dbraw/zinc/94/65/91/519946591.db2.gz CCRMKMOOIGFVOK-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000594417591 519954132 /nfs/dbraw/zinc/95/41/32/519954132.db2.gz CCRYPJQOOHITKG-QAPCUYQASA-N 1 1 369.425 2.732 20 5 FFBDMO COCc1ncc2c(n1)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C2 ZINC000602929398 519978220 /nfs/dbraw/zinc/97/82/20/519978220.db2.gz ZNECUELVLOSWMH-UHFFFAOYSA-N 1 1 372.425 2.877 20 5 FFBDMO COCc1ncc2c(n1)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C2 ZINC000602929398 519978228 /nfs/dbraw/zinc/97/82/28/519978228.db2.gz ZNECUELVLOSWMH-UHFFFAOYSA-N 1 1 372.425 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c(Cl)c1 ZINC000594483197 519992976 /nfs/dbraw/zinc/99/29/76/519992976.db2.gz CVLWAUGWVTYTPD-KBPBESRZSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1C ZINC000594484042 519993112 /nfs/dbraw/zinc/99/31/12/519993112.db2.gz QERPHDQMDQERJK-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO CCN(C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000602965536 519996170 /nfs/dbraw/zinc/99/61/70/519996170.db2.gz IATLMYZYAAWOGO-LJQANCHMSA-N 1 1 363.458 2.573 20 5 FFBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602965527 519996397 /nfs/dbraw/zinc/99/63/97/519996397.db2.gz HXDAQJOCYBPHDA-YWZLYKJASA-N 1 1 371.437 2.612 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC2CC2)CC1 ZINC000597406395 520006298 /nfs/dbraw/zinc/00/62/98/520006298.db2.gz IUTJFHXWPIMPTI-UHFFFAOYSA-N 1 1 370.457 2.795 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)ccc1[N+](=O)[O-] ZINC000597574910 520112032 /nfs/dbraw/zinc/11/20/32/520112032.db2.gz IVBIASRDWMOPEL-CABCVRRESA-N 1 1 365.405 2.640 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597576362 520113761 /nfs/dbraw/zinc/11/37/61/520113761.db2.gz BSDWHQLVJNLGHM-KBAYOESNSA-N 1 1 363.433 2.808 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000600311206 520197747 /nfs/dbraw/zinc/19/77/47/520197747.db2.gz OKQBIKFVZRYIIF-MRXNPFEDSA-N 1 1 374.485 2.659 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000600312017 520198717 /nfs/dbraw/zinc/19/87/17/520198717.db2.gz DHUDJKJBYLLUHR-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000603399556 520247958 /nfs/dbraw/zinc/24/79/58/520247958.db2.gz CFJUYGBSCBMMCP-LBPRGKRZSA-N 1 1 371.384 2.886 20 5 FFBDMO COCCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cn1 ZINC000595016760 520256636 /nfs/dbraw/zinc/25/66/36/520256636.db2.gz WOJGJVLCTUNKBG-CYBMUJFWSA-N 1 1 361.398 2.874 20 5 FFBDMO CCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OCC)[C@H]1CC[N@@H+](C)C1 ZINC000592258741 520295882 /nfs/dbraw/zinc/29/58/82/520295882.db2.gz UHHTWOIJFGNXAP-AWEZNQCLSA-N 1 1 350.419 2.942 20 5 FFBDMO CC(C)[C@H]([NH3+])CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000595121937 520304599 /nfs/dbraw/zinc/30/45/99/520304599.db2.gz VGINJHYDCXWSHJ-SNVBAGLBSA-N 1 1 370.258 2.553 20 5 FFBDMO CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CC[N@@H+](C)C1 ZINC000597945589 520344688 /nfs/dbraw/zinc/34/46/88/520344688.db2.gz JCDDCGGZZKMXQX-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCCC[C@H]1C ZINC000609547774 520353547 /nfs/dbraw/zinc/35/35/47/520353547.db2.gz JIPGANJFJUELJK-CHWSQXEVSA-N 1 1 372.425 2.841 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(=O)NCc1cccs1 ZINC000592374869 520356117 /nfs/dbraw/zinc/35/61/17/520356117.db2.gz NHHHVBGNHVVJSV-HNNXBMFYSA-N 1 1 351.403 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000592479451 520407644 /nfs/dbraw/zinc/40/76/44/520407644.db2.gz ZQFOKSJASCDSOH-WBVHZDCISA-N 1 1 360.458 2.696 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595446829 520475194 /nfs/dbraw/zinc/47/51/94/520475194.db2.gz IZSHHGPEMWFCBE-QGZVFWFLSA-N 1 1 354.410 2.669 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604197930 520481251 /nfs/dbraw/zinc/48/12/51/520481251.db2.gz BTIWOZKUGOMFDK-HOCLYGCPSA-N 1 1 360.458 2.655 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505524 520515125 /nfs/dbraw/zinc/51/51/25/520515125.db2.gz VOGAPSXVLLCXER-DNVCBOLYSA-N 1 1 360.458 2.648 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610135242 520554577 /nfs/dbraw/zinc/55/45/77/520554577.db2.gz NLQKOJUTGKOLOF-GJZGRUSLSA-N 1 1 369.487 2.705 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000595585876 520570201 /nfs/dbraw/zinc/57/02/01/520570201.db2.gz SGHGPBJNNZCSNQ-CQSZACIVSA-N 1 1 354.838 2.574 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000604473156 520571590 /nfs/dbraw/zinc/57/15/90/520571590.db2.gz ONDMLVHQYFYVCL-CABCVRRESA-N 1 1 369.425 2.598 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610197835 520574678 /nfs/dbraw/zinc/57/46/78/520574678.db2.gz ANNYGBSWXJOTBI-AWEZNQCLSA-N 1 1 365.430 2.606 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484457 520574969 /nfs/dbraw/zinc/57/49/69/520574969.db2.gz OXEBWQAPJBAMPL-PKOBYXMFSA-N 1 1 358.394 2.877 20 5 FFBDMO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)C(=O)OC(C)(C)C ZINC000595599641 520583338 /nfs/dbraw/zinc/58/33/38/520583338.db2.gz ARAUUAUAYLYRSF-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)C(=O)OC(C)(C)C ZINC000595599641 520583340 /nfs/dbraw/zinc/58/33/40/520583340.db2.gz ARAUUAUAYLYRSF-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO CCCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000592829603 520606639 /nfs/dbraw/zinc/60/66/39/520606639.db2.gz RWBRGTZUILYFBM-GFCCVEGCSA-N 1 1 370.247 2.914 20 5 FFBDMO CCCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000592833219 520607985 /nfs/dbraw/zinc/60/79/85/520607985.db2.gz WRSXGMPYCOWGCC-TZMCWYRMSA-N 1 1 369.849 2.958 20 5 FFBDMO COCCCNC(=O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601106615 520638387 /nfs/dbraw/zinc/63/83/87/520638387.db2.gz SFUBRXSBRZHANK-UHFFFAOYSA-N 1 1 372.425 2.512 20 5 FFBDMO O=C([C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1)N1CCCC1 ZINC000601115541 520643069 /nfs/dbraw/zinc/64/30/69/520643069.db2.gz IDMXXBZEXDNJAD-AWEZNQCLSA-N 1 1 354.410 2.982 20 5 FFBDMO COc1c(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598509062 520668282 /nfs/dbraw/zinc/66/82/82/520668282.db2.gz FZMOABZQEOSWPD-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1c(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598509062 520668292 /nfs/dbraw/zinc/66/82/92/520668292.db2.gz FZMOABZQEOSWPD-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCOC[C@@H]3[C@@H]3CCCC[C@H]3O)c2c1 ZINC000601164257 520669247 /nfs/dbraw/zinc/66/92/47/520669247.db2.gz RFBXFYJKRIJVOT-GDIGMMSISA-N 1 1 357.410 2.899 20 5 FFBDMO COc1cccc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598511586 520671574 /nfs/dbraw/zinc/67/15/74/520671574.db2.gz TUWLSPHOIGISAN-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cccc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598511586 520671579 /nfs/dbraw/zinc/67/15/79/520671579.db2.gz TUWLSPHOIGISAN-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]2N1 ZINC000595729202 520676093 /nfs/dbraw/zinc/67/60/93/520676093.db2.gz RCSNZQODRRLEAR-IINYFYTJSA-N 1 1 357.332 2.714 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]2N1 ZINC000595729202 520676099 /nfs/dbraw/zinc/67/60/99/520676099.db2.gz RCSNZQODRRLEAR-IINYFYTJSA-N 1 1 357.332 2.714 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000601183152 520676100 /nfs/dbraw/zinc/67/61/00/520676100.db2.gz AGGBSJPQMMNTLM-ZFWWWQNUSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000593028118 520693079 /nfs/dbraw/zinc/69/30/79/520693079.db2.gz CUDZHXKAUSYCEP-AWEZNQCLSA-N 1 1 371.412 2.839 20 5 FFBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000610489203 520711424 /nfs/dbraw/zinc/71/14/24/520711424.db2.gz MQMBMGHIOKGNKU-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO CC(C)(C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)S(C)(=O)=O ZINC000610511576 520721921 /nfs/dbraw/zinc/72/19/21/520721921.db2.gz IAIANIZURDLRKO-UHFFFAOYSA-N 1 1 369.468 2.631 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595788980 520725744 /nfs/dbraw/zinc/72/57/44/520725744.db2.gz ORIQCFFAMLUADY-VQIMIIECSA-N 1 1 373.453 2.765 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593089374 520737367 /nfs/dbraw/zinc/73/73/67/520737367.db2.gz RZZLLTPQVZPYCR-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593089374 520737372 /nfs/dbraw/zinc/73/73/72/520737372.db2.gz RZZLLTPQVZPYCR-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593089374 520737381 /nfs/dbraw/zinc/73/73/81/520737381.db2.gz RZZLLTPQVZPYCR-GOSISDBHSA-N 1 1 355.438 2.832 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000598607146 520738593 /nfs/dbraw/zinc/73/85/93/520738593.db2.gz ODHBMLVVHNOWDI-ZDUSSCGKSA-N 1 1 350.419 2.556 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCN1CCOCC1)CC1CC1 ZINC000595807412 520739771 /nfs/dbraw/zinc/73/97/71/520739771.db2.gz ITRASCDVYOPIBK-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO O=C1CCCN1C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595828571 520750981 /nfs/dbraw/zinc/75/09/81/520750981.db2.gz LDYIODXPVHNRGR-CQSZACIVSA-N 1 1 370.409 2.694 20 5 FFBDMO O=C1CCCN1C[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595828571 520750989 /nfs/dbraw/zinc/75/09/89/520750989.db2.gz LDYIODXPVHNRGR-CQSZACIVSA-N 1 1 370.409 2.694 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCc2ccccc21 ZINC000595882214 520789762 /nfs/dbraw/zinc/78/97/62/520789762.db2.gz ZJNUHGMBYWTYNV-WMZOPIPTSA-N 1 1 356.422 2.996 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595912029 520817409 /nfs/dbraw/zinc/81/74/09/520817409.db2.gz XVOVWPAKIAHOAN-ZMYBRWDISA-N 1 1 359.426 2.814 20 5 FFBDMO O=C(N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601537541 520831387 /nfs/dbraw/zinc/83/13/87/520831387.db2.gz FOCMONVYCUGQFX-IRXDYDNUSA-N 1 1 361.417 2.661 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000610798637 520849582 /nfs/dbraw/zinc/84/95/82/520849582.db2.gz IBNHHVDMGCKPBP-GOSISDBHSA-N 1 1 360.502 2.532 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CNC[C@@H]1CCC[N@@H+](CC3CC3)C1)OCCO2 ZINC000596058773 520886064 /nfs/dbraw/zinc/88/60/64/520886064.db2.gz JDHOJLITJQQJEX-HNNXBMFYSA-N 1 1 361.442 2.578 20 5 FFBDMO NC(=O)c1cc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596079654 520899381 /nfs/dbraw/zinc/89/93/81/520899381.db2.gz VBXNHWIODBTYRA-MRXNPFEDSA-N 1 1 354.410 2.770 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596110598 520918500 /nfs/dbraw/zinc/91/85/00/520918500.db2.gz QLMTZGZPKKUPEW-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951111 520918563 /nfs/dbraw/zinc/91/85/63/520918563.db2.gz GZESEVVKGXVFRX-OCCSQVGLSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951111 520918568 /nfs/dbraw/zinc/91/85/68/520918568.db2.gz GZESEVVKGXVFRX-OCCSQVGLSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951111 520918575 /nfs/dbraw/zinc/91/85/75/520918575.db2.gz GZESEVVKGXVFRX-OCCSQVGLSA-N 1 1 361.446 2.530 20 5 FFBDMO C[C@@]1(NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000593342470 520924434 /nfs/dbraw/zinc/92/44/34/520924434.db2.gz PJBOFHMWKGCYMT-HXUWFJFHSA-N 1 1 369.421 2.754 20 5 FFBDMO C[C@H]1[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596236442 520988921 /nfs/dbraw/zinc/98/89/21/520988921.db2.gz VVAVVEVENPRDAN-SUMWQHHRSA-N 1 1 354.410 2.769 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cnc3C)C2)cc1 ZINC000601878479 521001474 /nfs/dbraw/zinc/00/14/74/521001474.db2.gz AFJLEAXPXFIUCW-MRXNPFEDSA-N 1 1 354.410 2.611 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000611198205 521034147 /nfs/dbraw/zinc/03/41/47/521034147.db2.gz ZDDMLCAYTMUCNR-FQEVSTJZSA-N 1 1 366.421 2.951 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](CCOC)C1 ZINC000611204216 521034654 /nfs/dbraw/zinc/03/46/54/521034654.db2.gz CCIVAQAEFPCPKX-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO CC(=O)c1cc(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)ccc1[N+](=O)[O-] ZINC000596422592 521062091 /nfs/dbraw/zinc/06/20/91/521062091.db2.gz FVYADGPVTRKTEF-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC(c3cccnc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000611258358 521062721 /nfs/dbraw/zinc/06/27/21/521062721.db2.gz IYFOQDRMJMNDOB-IBGZPJMESA-N 1 1 366.421 2.975 20 5 FFBDMO CC(C)[N@H+](C)CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611262642 521064295 /nfs/dbraw/zinc/06/42/95/521064295.db2.gz WSLDUXYJMSUGPP-UHFFFAOYSA-N 1 1 363.458 2.918 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1 ZINC000611262642 521064300 /nfs/dbraw/zinc/06/43/00/521064300.db2.gz WSLDUXYJMSUGPP-UHFFFAOYSA-N 1 1 363.458 2.918 20 5 FFBDMO CC(C)[NH+]1CCN([C@@H]2CCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000611276065 521075458 /nfs/dbraw/zinc/07/54/58/521075458.db2.gz JVUMXUPXUYEJOG-SUOMESGTSA-N 1 1 358.486 2.708 20 5 FFBDMO Cc1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000596537424 521122454 /nfs/dbraw/zinc/12/24/54/521122454.db2.gz FRKCCELBELLYQO-CYBMUJFWSA-N 1 1 373.375 2.957 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599288899 521129308 /nfs/dbraw/zinc/12/93/08/521129308.db2.gz YPLLXYPJYDFXRV-SNVBAGLBSA-N 1 1 358.236 2.817 20 5 FFBDMO COC(=O)Cc1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000596558306 521130715 /nfs/dbraw/zinc/13/07/15/521130715.db2.gz QDNVZBQVLFGKSU-QGZVFWFLSA-N 1 1 369.421 2.997 20 5 FFBDMO CC1(C)Cc2n[nH]cc2C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000596598128 521157651 /nfs/dbraw/zinc/15/76/51/521157651.db2.gz BVJXAICLCWMERS-UHFFFAOYSA-N 1 1 357.414 2.731 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611579335 521231784 /nfs/dbraw/zinc/23/17/84/521231784.db2.gz VLTRMUIDJJTFAF-GFCCVEGCSA-N 1 1 373.356 2.636 20 5 FFBDMO COC(=O)[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000611578650 521232771 /nfs/dbraw/zinc/23/27/71/521232771.db2.gz UDXIZOXNCGMZJN-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO COC(=O)[C@H]1CCCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000611578650 521232779 /nfs/dbraw/zinc/23/27/79/521232779.db2.gz UDXIZOXNCGMZJN-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO Cc1ccc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000611581898 521235251 /nfs/dbraw/zinc/23/52/51/521235251.db2.gz ZWEMCTCDTAIONJ-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000618806530 521246699 /nfs/dbraw/zinc/24/66/99/521246699.db2.gz PUJLJXFMYDPXSR-LBPRGKRZSA-N 1 1 360.336 2.507 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](C)[C@@H](O)C2)cc1OC ZINC000611668763 521272168 /nfs/dbraw/zinc/27/21/68/521272168.db2.gz VGXCGRFESWXFMH-ZENOOKHLSA-N 1 1 352.431 2.841 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](C)[C@@H](O)C2)cc1OC ZINC000611668763 521272176 /nfs/dbraw/zinc/27/21/76/521272176.db2.gz VGXCGRFESWXFMH-ZENOOKHLSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536107 521282197 /nfs/dbraw/zinc/28/21/97/521282197.db2.gz FIRIMUITFNTSJN-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536107 521282207 /nfs/dbraw/zinc/28/22/07/521282207.db2.gz FIRIMUITFNTSJN-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599567841 521303932 /nfs/dbraw/zinc/30/39/32/521303932.db2.gz POBTVZMUECJYRO-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000596828956 521314888 /nfs/dbraw/zinc/31/48/88/521314888.db2.gz OUWKNHYMRYAOTM-INIZCTEOSA-N 1 1 370.409 2.999 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](c3cnn(C)c3)C(C)(C)C2)c1 ZINC000593998004 521338799 /nfs/dbraw/zinc/33/87/99/521338799.db2.gz MJISEABPUVJTMR-INIZCTEOSA-N 1 1 372.425 2.741 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)C3(CCCCC3)C2)c1 ZINC000593998364 521338993 /nfs/dbraw/zinc/33/89/93/521338993.db2.gz YIPUHDFFFMFLGK-UHFFFAOYSA-N 1 1 361.442 2.832 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@H]1CCCC2 ZINC000594016291 521349368 /nfs/dbraw/zinc/34/93/68/521349368.db2.gz KNLBGSXHJWBAIE-KZULUSFZSA-N 1 1 358.398 2.636 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCCC2)O1 ZINC000594058298 521377988 /nfs/dbraw/zinc/37/79/88/521377988.db2.gz RLHPVRQWPFRBJT-RDJZCZTQSA-N 1 1 364.442 2.758 20 5 FFBDMO COC[C@@H](C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCc2ccccc21 ZINC000599682856 521397259 /nfs/dbraw/zinc/39/72/59/521397259.db2.gz MHUKSMGVPWCPIY-BEFAXECRSA-N 1 1 371.437 2.781 20 5 FFBDMO C[N@@H+]1CCc2[nH]c3ccc(C(=O)NCc4cccc([N+](=O)[O-])c4)cc3c2C1 ZINC000596972228 521413292 /nfs/dbraw/zinc/41/32/92/521413292.db2.gz SPKNYYBVBVNKQB-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO C[N@H+]1CCc2[nH]c3ccc(C(=O)NCc4cccc([N+](=O)[O-])c4)cc3c2C1 ZINC000596972228 521413297 /nfs/dbraw/zinc/41/32/97/521413297.db2.gz SPKNYYBVBVNKQB-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO Cc1cccc2nc(C[NH2+]C3CCN(c4ccc([N+](=O)[O-])nc4)CC3)[nH]c21 ZINC000602579824 521421939 /nfs/dbraw/zinc/42/19/39/521421939.db2.gz KTAFLJDUCFXIAW-UHFFFAOYSA-N 1 1 366.425 2.933 20 5 FFBDMO C[C@@H]1OCC[C@]12C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000619175820 521433261 /nfs/dbraw/zinc/43/32/61/521433261.db2.gz QAJGADKAROAKEV-VKJFTORMSA-N 1 1 350.415 2.632 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C1CCN([C@@H]2CCOC2)CC1 ZINC000602717881 521493348 /nfs/dbraw/zinc/49/33/48/521493348.db2.gz JPIOXBWLOMFLQG-OAHLLOKOSA-N 1 1 373.375 2.957 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597105077 521508732 /nfs/dbraw/zinc/50/87/32/521508732.db2.gz VYUWPAAJCQLOQU-JTQLQIEISA-N 1 1 355.826 2.636 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1Cn1c(C)nc2ccccc21 ZINC000602795361 521537877 /nfs/dbraw/zinc/53/78/77/521537877.db2.gz MOSONJVRTASLOL-MRXNPFEDSA-N 1 1 368.441 2.922 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C ZINC000602808857 521546301 /nfs/dbraw/zinc/54/63/01/521546301.db2.gz FGXGHVCYZDOGHH-HZPDHXFCSA-N 1 1 371.485 2.846 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)n1 ZINC000602816382 521549152 /nfs/dbraw/zinc/54/91/52/521549152.db2.gz ILXQACFPIVQTST-OAHLLOKOSA-N 1 1 354.414 2.553 20 5 FFBDMO COc1cc(Br)ccc1[C@@H](C)[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602814102 521550140 /nfs/dbraw/zinc/55/01/40/521550140.db2.gz CCHPVFPWHLJCFH-SECBINFHSA-N 1 1 369.219 2.950 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000602826204 521554909 /nfs/dbraw/zinc/55/49/09/521554909.db2.gz MYGLKDFFLBHNMZ-HNNXBMFYSA-N 1 1 358.446 2.512 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000602834300 521560869 /nfs/dbraw/zinc/56/08/69/521560869.db2.gz YKLOTPVMLQSGHR-KURKYZTESA-N 1 1 356.426 2.604 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000821846552 599370339 /nfs/dbraw/zinc/37/03/39/599370339.db2.gz UGLBGIZNHNBFFW-NSHDSACASA-N 1 1 354.370 2.634 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000826170119 608564144 /nfs/dbraw/zinc/56/41/44/608564144.db2.gz OTVXFCYIMORAIC-NSHDSACASA-N 1 1 354.370 2.634 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc4ccc5ccc(Cl)nc5c4n3)C[C@@H]21 ZINC001164671919 719396843 /nfs/dbraw/zinc/39/68/43/719396843.db2.gz ZWAGWDILYQGQTP-LSDHHAIUSA-N 1 1 354.841 2.956 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nc2[nH]ccc21 ZINC001164732940 720413525 /nfs/dbraw/zinc/41/35/25/720413525.db2.gz OWDBUASTGOEGRH-CVEARBPZSA-N 1 1 364.409 2.719 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164784892 721390442 /nfs/dbraw/zinc/39/04/42/721390442.db2.gz KBGUISIUVQNLFJ-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926758 721855271 /nfs/dbraw/zinc/85/52/71/721855271.db2.gz JFJNMFVORBXGNZ-RBUKOAKNSA-N 1 1 361.493 2.998 20 5 FFBDMO C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926758 721855272 /nfs/dbraw/zinc/85/52/72/721855272.db2.gz JFJNMFVORBXGNZ-RBUKOAKNSA-N 1 1 361.493 2.998 20 5 FFBDMO Cc1ccc([C@@H](CNS(=O)(=O)c2csc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000119661206 728598230 /nfs/dbraw/zinc/59/82/30/728598230.db2.gz SEXOTKIMWZGCQB-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000120308402 728609632 /nfs/dbraw/zinc/60/96/32/728609632.db2.gz IFHZWWMZUHARGS-RYUDHWBXSA-N 1 1 373.500 2.588 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000127270069 728705869 /nfs/dbraw/zinc/70/58/69/728705869.db2.gz YHUALRLNKFAUBD-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000178771951 729169676 /nfs/dbraw/zinc/16/96/76/729169676.db2.gz JLTSPRDFZGJSCO-JTQLQIEISA-N 1 1 351.384 2.857 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000178771951 729169679 /nfs/dbraw/zinc/16/96/79/729169679.db2.gz JLTSPRDFZGJSCO-JTQLQIEISA-N 1 1 351.384 2.857 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C1CCCCC1 ZINC000194341913 729507665 /nfs/dbraw/zinc/50/76/65/729507665.db2.gz MEICAUWYOPTUOO-UHFFFAOYSA-N 1 1 373.450 2.667 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000861345979 730602032 /nfs/dbraw/zinc/60/20/32/730602032.db2.gz BXUMUVXWNGKSAY-QAPCUYQASA-N 1 1 350.415 2.525 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)N1CCN(C)CC1 ZINC000872021173 731721213 /nfs/dbraw/zinc/72/12/13/731721213.db2.gz NVJYADBRRIXSQP-AWEZNQCLSA-N 1 1 366.531 2.993 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@H]2CCC[N@H+]3C)ncc1[N+](=O)[O-] ZINC000872778393 731830217 /nfs/dbraw/zinc/83/02/17/731830217.db2.gz AEDHIYARZUMZJR-GHMZBOCLSA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)ncc1[N+](=O)[O-] ZINC000872778393 731830220 /nfs/dbraw/zinc/83/02/20/731830220.db2.gz AEDHIYARZUMZJR-GHMZBOCLSA-N 1 1 355.236 2.734 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000874839250 732106387 /nfs/dbraw/zinc/10/63/87/732106387.db2.gz UPBQAJVRTYQZAX-ZIAGYGMSSA-N 1 1 367.833 2.712 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000877021418 732313540 /nfs/dbraw/zinc/31/35/40/732313540.db2.gz BFZAZCJXPZDUKH-KBPBESRZSA-N 1 1 359.348 2.566 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC3(COC3)C2)o1 ZINC000878991140 732627770 /nfs/dbraw/zinc/62/77/70/732627770.db2.gz GIOWQYKOKKNENP-UHFFFAOYSA-N 1 1 350.762 2.521 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC3(COC3)C2)o1 ZINC000878991140 732627773 /nfs/dbraw/zinc/62/77/73/732627773.db2.gz GIOWQYKOKKNENP-UHFFFAOYSA-N 1 1 350.762 2.521 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879556934 732721869 /nfs/dbraw/zinc/72/18/69/732721869.db2.gz AKPKEHGPFBTCTL-QWHCGFSZSA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879556934 732721872 /nfs/dbraw/zinc/72/18/72/732721872.db2.gz AKPKEHGPFBTCTL-QWHCGFSZSA-N 1 1 365.455 2.617 20 5 FFBDMO CO[C@]1(C(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000880304952 732883732 /nfs/dbraw/zinc/88/37/32/732883732.db2.gz UKWFVAUJDDFKNJ-CQSZACIVSA-N 1 1 361.320 2.577 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CCC1(C)C ZINC000881388931 733047700 /nfs/dbraw/zinc/04/77/00/733047700.db2.gz SWYJWGXILIGHAL-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000881466476 733058470 /nfs/dbraw/zinc/05/84/70/733058470.db2.gz XIRIIRASFGQBJF-RYUDHWBXSA-N 1 1 368.231 2.666 20 5 FFBDMO O=[N+]([O-])c1c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)cccc1C(F)(F)F ZINC000884560365 733539434 /nfs/dbraw/zinc/53/94/34/733539434.db2.gz VSLWREXYEZSOBF-LBPRGKRZSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(n2cc(Br)cn2)CC1 ZINC000886006614 733739931 /nfs/dbraw/zinc/73/99/31/733739931.db2.gz TWOQHQXDKPTDFD-UHFFFAOYSA-N 1 1 366.219 2.786 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)ccc1[N+](=O)[O-] ZINC000888834753 734103814 /nfs/dbraw/zinc/10/38/14/734103814.db2.gz PSKLQOVGECGRHK-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO CC(C)(C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000928079376 738816838 /nfs/dbraw/zinc/81/68/38/738816838.db2.gz IOMJWIRWDDRDDB-GDBMZVCRSA-N 1 1 363.483 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CC2(N3CCCC3)CCOCC2)cc1Cl ZINC000783621098 738820055 /nfs/dbraw/zinc/82/00/55/738820055.db2.gz YABVRRJRNMZXHA-UHFFFAOYSA-N 1 1 353.850 2.983 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678298 738826011 /nfs/dbraw/zinc/82/60/11/738826011.db2.gz ZBFBVNGXOPGCCK-CHWSQXEVSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678298 738826017 /nfs/dbraw/zinc/82/60/17/738826017.db2.gz ZBFBVNGXOPGCCK-CHWSQXEVSA-N 1 1 356.806 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2sc(N3CCOCC3)nc2Cl)cc1 ZINC000894384402 734849873 /nfs/dbraw/zinc/84/98/73/734849873.db2.gz FZNYEOCNWZVHNN-UHFFFAOYSA-N 1 1 368.846 2.831 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894417825 734854239 /nfs/dbraw/zinc/85/42/39/734854239.db2.gz BKLBGRPOATZTDL-CQSZACIVSA-N 1 1 364.320 2.588 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894417825 734854244 /nfs/dbraw/zinc/85/42/44/734854244.db2.gz BKLBGRPOATZTDL-CQSZACIVSA-N 1 1 364.320 2.588 20 5 FFBDMO CON(C)C(=O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000895041460 734956620 /nfs/dbraw/zinc/95/66/20/734956620.db2.gz UYEMMCAOMJOWRJ-UHFFFAOYSA-N 1 1 353.762 2.618 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cn2cc(Br)c([N+](=O)[O-])n2)CC1 ZINC000738089723 735021094 /nfs/dbraw/zinc/02/10/94/735021094.db2.gz LCDMOWYMYYILFL-UHFFFAOYSA-N 1 1 374.283 2.564 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cccc1C(F)(F)F ZINC000897216013 735207145 /nfs/dbraw/zinc/20/71/45/735207145.db2.gz GRBYLLJFFFBNES-OLZOCXBDSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cc1C(F)(F)F ZINC000897221196 735208101 /nfs/dbraw/zinc/20/81/01/735208101.db2.gz JFFGCOWIDLFFBF-GJZGRUSLSA-N 1 1 359.348 2.649 20 5 FFBDMO NC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C2 ZINC000897624374 735256658 /nfs/dbraw/zinc/25/66/58/735256658.db2.gz XXFMIIDFKYGXAP-SDBXPKJASA-N 1 1 374.260 2.506 20 5 FFBDMO NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(Br)c([N+](=O)[O-])s1)C2 ZINC000897624374 735256663 /nfs/dbraw/zinc/25/66/63/735256663.db2.gz XXFMIIDFKYGXAP-SDBXPKJASA-N 1 1 374.260 2.506 20 5 FFBDMO C[C@H]([NH2+]Cc1cn(C)nc1Br)c1ccc(N)c([N+](=O)[O-])c1 ZINC000903188454 736051463 /nfs/dbraw/zinc/05/14/63/736051463.db2.gz REBIORAXUFUQBY-QMMMGPOBSA-N 1 1 354.208 2.524 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000766253168 737212643 /nfs/dbraw/zinc/21/26/43/737212643.db2.gz JATYXDAGLZYRPN-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766950827 737278772 /nfs/dbraw/zinc/27/87/72/737278772.db2.gz RFGKUNGYFOUJEF-HOCLYGCPSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])c(Br)cc1F ZINC000771998029 737774640 /nfs/dbraw/zinc/77/46/40/737774640.db2.gz ZGTXEENVYLQIFY-UHFFFAOYSA-N 1 1 372.150 2.858 20 5 FFBDMO Cn1nc2c(c1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])CCC2 ZINC000922333557 738123266 /nfs/dbraw/zinc/12/32/66/738123266.db2.gz RAZWSWLJJQWHLB-UHFFFAOYSA-N 1 1 365.231 2.869 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776597751 738212822 /nfs/dbraw/zinc/21/28/22/738212822.db2.gz MECYMXMUXMJSMG-GDBMZVCRSA-N 1 1 350.415 2.539 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000778147208 738358513 /nfs/dbraw/zinc/35/85/13/738358513.db2.gz KSYOQSMCELPZAS-UHFFFAOYSA-N 1 1 350.806 2.892 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CC[C@@H](C(F)(F)F)O3)C2)nc1 ZINC000929986950 739045534 /nfs/dbraw/zinc/04/55/34/739045534.db2.gz IDLZNCHOFBODIA-WXHSDQCUSA-N 1 1 360.336 2.586 20 5 FFBDMO CCN1C(=O)N=NC1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000788457389 739246783 /nfs/dbraw/zinc/24/67/83/739246783.db2.gz YLIYGVAONPHDDQ-UHFFFAOYSA-N 1 1 365.821 2.945 20 5 FFBDMO C[C@@H](c1cccc(S(N)(=O)=O)c1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788492291 739249944 /nfs/dbraw/zinc/24/99/44/739249944.db2.gz CJTVSXNKXGXTFA-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788492291 739249947 /nfs/dbraw/zinc/24/99/47/739249947.db2.gz CJTVSXNKXGXTFA-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)COC(=O)N1 ZINC000932020669 739374449 /nfs/dbraw/zinc/37/44/49/739374449.db2.gz KJFLLGVDUBFLBL-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)COC(=O)N1 ZINC000932093740 739385340 /nfs/dbraw/zinc/38/53/40/739385340.db2.gz RDMPFZCRABPQOX-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000790270646 739431527 /nfs/dbraw/zinc/43/15/27/739431527.db2.gz CQXNGUPSFIQIGW-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO COCC[N@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@@H]1CC[C@@H](C)C1 ZINC000790475941 739459524 /nfs/dbraw/zinc/45/95/24/739459524.db2.gz CLGOLXZNKPNJBP-GHMZBOCLSA-N 1 1 361.240 2.648 20 5 FFBDMO COCC[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@@H]1CC[C@@H](C)C1 ZINC000790475941 739459525 /nfs/dbraw/zinc/45/95/25/739459525.db2.gz CLGOLXZNKPNJBP-GHMZBOCLSA-N 1 1 361.240 2.648 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H]1CC1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000933209924 739583762 /nfs/dbraw/zinc/58/37/62/739583762.db2.gz RZJYEUBEHHMUTR-AWEZNQCLSA-N 1 1 351.378 2.563 20 5 FFBDMO O=C(CC[N@@H+]1CCCCC[C@@H]1CCO)Nc1cc([N+](=O)[O-])ccc1F ZINC000792922890 739718922 /nfs/dbraw/zinc/71/89/22/739718922.db2.gz BUTDRRMYGHZVHW-CYBMUJFWSA-N 1 1 353.394 2.690 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](Cc2nccs2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000934331199 739766200 /nfs/dbraw/zinc/76/62/00/739766200.db2.gz ZANSBOJMPHEPKT-ZDUSSCGKSA-N 1 1 360.439 2.945 20 5 FFBDMO Cc1cc(Cl)c(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000810091278 741384911 /nfs/dbraw/zinc/38/49/11/741384911.db2.gz NOPTVYKFHHFZRM-LLVKDONJSA-N 1 1 363.867 2.564 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811445382 741522172 /nfs/dbraw/zinc/52/21/72/741522172.db2.gz QMPROLVSJNPNQS-KRWDZBQOSA-N 1 1 354.378 2.859 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000811583657 741540312 /nfs/dbraw/zinc/54/03/12/741540312.db2.gz SNGKPMFYPXDRHE-NSHDSACASA-N 1 1 352.391 2.662 20 5 FFBDMO Cc1nn(C[N@H+](C)CCc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000812302755 741607259 /nfs/dbraw/zinc/60/72/59/741607259.db2.gz XUFPPEXIRNZRMN-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000812302755 741607262 /nfs/dbraw/zinc/60/72/62/741607262.db2.gz XUFPPEXIRNZRMN-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000812393838 741616433 /nfs/dbraw/zinc/61/64/33/741616433.db2.gz TYZVXUNPUOVNRX-NSHDSACASA-N 1 1 352.391 2.662 20 5 FFBDMO CC(C)(C)SCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000815265000 741918751 /nfs/dbraw/zinc/91/87/51/741918751.db2.gz IKOGCVBQBQMGOC-UHFFFAOYSA-N 1 1 351.472 2.884 20 5 FFBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000821587903 742644155 /nfs/dbraw/zinc/64/41/55/742644155.db2.gz RGERWUBCDIKLGW-OKILXGFUSA-N 1 1 362.407 2.830 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C[C@@H]2C1 ZINC000823784771 742979695 /nfs/dbraw/zinc/97/96/95/742979695.db2.gz YJRJBAGJXWPITJ-OLZOCXBDSA-N 1 1 351.834 2.591 20 5 FFBDMO Cc1cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)cs1 ZINC001048525028 743404956 /nfs/dbraw/zinc/40/49/56/743404956.db2.gz HAXXXKAMRMRMPF-GWZLXJJCSA-N 1 1 363.483 2.581 20 5 FFBDMO Cc1cc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cs1 ZINC001048525028 743404963 /nfs/dbraw/zinc/40/49/63/743404963.db2.gz HAXXXKAMRMRMPF-GWZLXJJCSA-N 1 1 363.483 2.581 20 5 FFBDMO Cc1cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cs1 ZINC001048525028 743404968 /nfs/dbraw/zinc/40/49/68/743404968.db2.gz HAXXXKAMRMRMPF-GWZLXJJCSA-N 1 1 363.483 2.581 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC000827328406 743556199 /nfs/dbraw/zinc/55/61/99/743556199.db2.gz FBFVVMRUPXHCRM-SGMGOOAPSA-N 1 1 367.833 2.568 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000827588842 743607102 /nfs/dbraw/zinc/60/71/02/743607102.db2.gz PRKSPFPWQXUREL-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000827588842 743607105 /nfs/dbraw/zinc/60/71/05/743607105.db2.gz PRKSPFPWQXUREL-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO Cc1ccc(NC[C@H]2CCC[N@H+]2CCCO)c([N+](=O)[O-])c1Br ZINC000828422054 745064764 /nfs/dbraw/zinc/06/47/64/745064764.db2.gz NZVUJBYAXUPBBY-GFCCVEGCSA-N 1 1 372.263 2.924 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c1F ZINC000830000576 745291172 /nfs/dbraw/zinc/29/11/72/745291172.db2.gz ZXYUEHULRXLTCB-LBPRGKRZSA-N 1 1 355.385 2.889 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc1Cl ZINC000834598246 745864731 /nfs/dbraw/zinc/86/47/31/745864731.db2.gz JVVHCJBCQZOZID-ZIAGYGMSSA-N 1 1 355.797 2.815 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])ccc1Br)C1CC1 ZINC000839439753 746828551 /nfs/dbraw/zinc/82/85/51/746828551.db2.gz RIUVRVUIQUHBJC-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000846911860 748572971 /nfs/dbraw/zinc/57/29/71/748572971.db2.gz KQICBBFSUSRONK-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO C[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847181705 748637493 /nfs/dbraw/zinc/63/74/93/748637493.db2.gz SBHJPNMPBGVENG-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847181705 748637500 /nfs/dbraw/zinc/63/75/00/748637500.db2.gz SBHJPNMPBGVENG-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000848490229 748939351 /nfs/dbraw/zinc/93/93/51/748939351.db2.gz XQRJRXGDJFWJJD-ZBFHGGJFSA-N 1 1 351.353 2.599 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000848490229 748939354 /nfs/dbraw/zinc/93/93/54/748939354.db2.gz XQRJRXGDJFWJJD-ZBFHGGJFSA-N 1 1 351.353 2.599 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422724 749856954 /nfs/dbraw/zinc/85/69/54/749856954.db2.gz HPDKRBYXLKAPQU-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422724 749856962 /nfs/dbraw/zinc/85/69/62/749856962.db2.gz HPDKRBYXLKAPQU-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1ccccc1CCC[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001267923853 971636042 /nfs/dbraw/zinc/63/60/42/971636042.db2.gz BAPAFCATPPOGRO-NCXUSEDFSA-N 1 1 359.470 2.610 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](OC2CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000872279997 1013197662 /nfs/dbraw/zinc/19/76/62/1013197662.db2.gz OMBLRKRUOXPHAN-GOSISDBHSA-N 1 1 361.442 2.981 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001174965641 1013355381 /nfs/dbraw/zinc/35/53/81/1013355381.db2.gz OVSYQKPZVHVTHO-LLVKDONJSA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001174965641 1013355388 /nfs/dbraw/zinc/35/53/88/1013355388.db2.gz OVSYQKPZVHVTHO-LLVKDONJSA-N 1 1 362.361 2.623 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000825655095 1013368204 /nfs/dbraw/zinc/36/82/04/1013368204.db2.gz IDLFYHWTNAZEEN-SFHVURJKSA-N 1 1 368.437 2.827 20 5 FFBDMO COC(=O)Cc1ccc(N2CC([N@@H+](C)Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000828178468 963920925 /nfs/dbraw/zinc/92/09/25/963920925.db2.gz MMILCWTZYIKQOW-UHFFFAOYSA-N 1 1 369.421 2.631 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCN1C(=O)OC(C)(C)C ZINC000933467410 964426270 /nfs/dbraw/zinc/42/62/70/964426270.db2.gz KVUWJYYEPFEWFX-HZPDHXFCSA-N 1 1 365.430 2.569 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000176231297 965637522 /nfs/dbraw/zinc/63/75/22/965637522.db2.gz LPCYHWALKCTNAU-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO Cc1ccccc1C[NH2+]CCc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001267097001 966295197 /nfs/dbraw/zinc/29/51/97/966295197.db2.gz OICZVFLKDIYWIB-WOJBJXKFSA-N 1 1 367.449 2.609 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000781738508 966308415 /nfs/dbraw/zinc/30/84/15/966308415.db2.gz XNCPILWQPXQUMA-UHFFFAOYSA-N 1 1 362.342 2.574 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1sccc1Cl ZINC001267257697 967497774 /nfs/dbraw/zinc/49/77/74/967497774.db2.gz QXHSLFFROCLTOC-DGCLKSJQSA-N 1 1 359.879 2.783 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1sccc1Cl ZINC001267257697 967497783 /nfs/dbraw/zinc/49/77/83/967497783.db2.gz QXHSLFFROCLTOC-DGCLKSJQSA-N 1 1 359.879 2.783 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1sccc1Cl ZINC001267257697 967497789 /nfs/dbraw/zinc/49/77/89/967497789.db2.gz QXHSLFFROCLTOC-DGCLKSJQSA-N 1 1 359.879 2.783 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC001267257804 967499187 /nfs/dbraw/zinc/49/91/87/967499187.db2.gz WCONOVQHJVMQKF-IAGOWNOFSA-N 1 1 359.426 2.815 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC001267257804 967499194 /nfs/dbraw/zinc/49/91/94/967499194.db2.gz WCONOVQHJVMQKF-IAGOWNOFSA-N 1 1 359.426 2.815 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC001267257804 967499200 /nfs/dbraw/zinc/49/92/00/967499200.db2.gz WCONOVQHJVMQKF-IAGOWNOFSA-N 1 1 359.426 2.815 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000892437713 968744152 /nfs/dbraw/zinc/74/41/52/968744152.db2.gz AVKYTFQMKWWZQT-MRXNPFEDSA-N 1 1 357.410 2.673 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000892437713 968744160 /nfs/dbraw/zinc/74/41/60/968744160.db2.gz AVKYTFQMKWWZQT-MRXNPFEDSA-N 1 1 357.410 2.673 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1F ZINC000311819281 970176760 /nfs/dbraw/zinc/17/67/60/970176760.db2.gz PZUOWEBWAULPFT-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1)c1ccccc1[N+](=O)[O-] ZINC000897060947 973204936 /nfs/dbraw/zinc/20/49/36/973204936.db2.gz DOSMQOGNWVHTEB-VYDXJSESSA-N 1 1 360.458 2.824 20 5 FFBDMO C[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000897062351 973214208 /nfs/dbraw/zinc/21/42/08/973214208.db2.gz SVASZGLMLKLIBZ-VYDXJSESSA-N 1 1 360.458 2.824 20 5 FFBDMO CN(C)C(=O)OC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000796548640 1014261517 /nfs/dbraw/zinc/26/15/17/1014261517.db2.gz BTQYBPXPQICZAG-INIZCTEOSA-N 1 1 365.430 2.916 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(Cl)c(NCC[NH+]3CCSCC3)nc2c1 ZINC001167835105 976403526 /nfs/dbraw/zinc/40/35/26/976403526.db2.gz SGZRGLVWYDHWEM-UHFFFAOYSA-N 1 1 353.835 2.652 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCCC1CCCC1)C2 ZINC000982278722 977376293 /nfs/dbraw/zinc/37/62/93/977376293.db2.gz PQAYTFSZLVZKPG-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CCCC1CCCC1)C2 ZINC000982278722 977376297 /nfs/dbraw/zinc/37/62/97/977376297.db2.gz PQAYTFSZLVZKPG-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCCC1CCCC1)C2 ZINC000982278722 977376298 /nfs/dbraw/zinc/37/62/98/977376298.db2.gz PQAYTFSZLVZKPG-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn(C[C@@H]4CCCO4)nn3)C2)cc1 ZINC000877565358 1014629316 /nfs/dbraw/zinc/62/93/16/1014629316.db2.gz GCIZIAGUSHMIAE-LPHOPBHVSA-N 1 1 371.441 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn(C[C@@H]4CCCO4)nn3)C2)cc1 ZINC000877565358 1014629324 /nfs/dbraw/zinc/62/93/24/1014629324.db2.gz GCIZIAGUSHMIAE-LPHOPBHVSA-N 1 1 371.441 2.745 20 5 FFBDMO CC[N@H+](CCc1ccccn1)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000764315323 984417008 /nfs/dbraw/zinc/41/70/08/984417008.db2.gz NSSFLZVACYORJH-AWEZNQCLSA-N 1 1 372.425 2.890 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000764315323 984417009 /nfs/dbraw/zinc/41/70/09/984417009.db2.gz NSSFLZVACYORJH-AWEZNQCLSA-N 1 1 372.425 2.890 20 5 FFBDMO Cc1noc(C2CC[NH+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)CC2)n1 ZINC000764923285 984815454 /nfs/dbraw/zinc/81/54/54/984815454.db2.gz WAVVOMUFAXVDEH-UHFFFAOYSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](N3CCCCC3=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764992441 984903884 /nfs/dbraw/zinc/90/38/84/984903884.db2.gz ZZVFORRGCQBROG-MRXNPFEDSA-N 1 1 371.441 2.687 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](N3CCCCC3=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764992441 984903892 /nfs/dbraw/zinc/90/38/92/984903892.db2.gz ZZVFORRGCQBROG-MRXNPFEDSA-N 1 1 371.441 2.687 20 5 FFBDMO CN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000878608267 1015129401 /nfs/dbraw/zinc/12/94/01/1015129401.db2.gz NHGXVWDMNXNFRG-PBWFPOADSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1cc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000843828884 988436872 /nfs/dbraw/zinc/43/68/72/988436872.db2.gz WNMOYXQIFUNMSB-INIZCTEOSA-N 1 1 368.437 2.832 20 5 FFBDMO C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000194488048 989299642 /nfs/dbraw/zinc/29/96/42/989299642.db2.gz YVSQOQBHGDDXJC-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000194488048 989299649 /nfs/dbraw/zinc/29/96/49/989299649.db2.gz YVSQOQBHGDDXJC-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO COc1cccc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000194844348 990591195 /nfs/dbraw/zinc/59/11/95/990591195.db2.gz FODHMQFWOKRBOQ-ZIAGYGMSSA-N 1 1 361.442 2.986 20 5 FFBDMO COc1ccc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)c1OC ZINC000922970488 990774638 /nfs/dbraw/zinc/77/46/38/990774638.db2.gz FFOHPCLXVWMOFC-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000923266906 991001945 /nfs/dbraw/zinc/00/19/45/991001945.db2.gz CCMPIVSZPMATIM-JKSUJKDBSA-N 1 1 366.421 2.966 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c1 ZINC000175252889 991180748 /nfs/dbraw/zinc/18/07/48/991180748.db2.gz HRRQGXBYIPDLJT-KRWDZBQOSA-N 1 1 360.414 2.562 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184519503 992805695 /nfs/dbraw/zinc/80/56/95/992805695.db2.gz UNUSIBXJDUEVPX-UHFFFAOYSA-N 1 1 356.426 2.817 20 5 FFBDMO Cn1nncc1C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000808436698 994117987 /nfs/dbraw/zinc/11/79/87/994117987.db2.gz PRYBEZCDPUZYRW-UHFFFAOYSA-N 1 1 357.345 2.945 20 5 FFBDMO C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@@H]1C[N@@H+](C)CCO1 ZINC000880709486 1015952233 /nfs/dbraw/zinc/95/22/33/1015952233.db2.gz NVOBHUWRGXKXNA-LRDDRELGSA-N 1 1 364.446 2.733 20 5 FFBDMO C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@@H]1C[N@H+](C)CCO1 ZINC000880709486 1015952225 /nfs/dbraw/zinc/95/22/25/1015952225.db2.gz NVOBHUWRGXKXNA-LRDDRELGSA-N 1 1 364.446 2.733 20 5 FFBDMO Nc1ccc(NC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000823987330 996773171 /nfs/dbraw/zinc/77/31/71/996773171.db2.gz PWZKBVFOEMQMQE-INIZCTEOSA-N 1 1 369.425 2.963 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000824827939 997118522 /nfs/dbraw/zinc/11/85/22/997118522.db2.gz JUAUQOQEVCDOIO-ZIAGYGMSSA-N 1 1 371.359 2.746 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH2+][C@@H](c2ccccc2C)C1 ZINC000825170290 997234393 /nfs/dbraw/zinc/23/43/93/997234393.db2.gz WHZGYCSVHFRMBH-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO O=C(NC1(C2CC[NH+](CC3CCCCCC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000156400 1016250621 /nfs/dbraw/zinc/25/06/21/1016250621.db2.gz YTQCWOUBPTWPLB-QZTJIDSGSA-N 1 1 363.502 2.983 20 5 FFBDMO C[N@@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n[nH]1 ZINC000823774285 999077243 /nfs/dbraw/zinc/07/72/43/999077243.db2.gz RRBOGWTTZCZXKK-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@H]1c1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n[nH]1 ZINC000823774285 999077245 /nfs/dbraw/zinc/07/72/45/999077245.db2.gz RRBOGWTTZCZXKK-SFHVURJKSA-N 1 1 369.425 2.889 20 5 FFBDMO C[C@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000742200448 999764162 /nfs/dbraw/zinc/76/41/62/999764162.db2.gz XYJBWAQPSDBWPF-NSHDSACASA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@H]1CN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000742200448 999764164 /nfs/dbraw/zinc/76/41/64/999764164.db2.gz XYJBWAQPSDBWPF-NSHDSACASA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000745867784 999934596 /nfs/dbraw/zinc/93/45/96/999934596.db2.gz LYCPGODOZYBYIM-MJBXVCDLSA-N 1 1 367.421 2.595 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000745943343 999938059 /nfs/dbraw/zinc/93/80/59/999938059.db2.gz BKAQEOJSPKZDSW-OAHLLOKOSA-N 1 1 365.430 2.915 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC[C@@H]2C1 ZINC001169010586 1000015406 /nfs/dbraw/zinc/01/54/06/1000015406.db2.gz DVBRXITVXODCRJ-LVQVYYBASA-N 1 1 353.463 2.621 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(CC3CC3)nc21 ZINC001169021692 1000017399 /nfs/dbraw/zinc/01/73/99/1000017399.db2.gz PKYVTVNDSHDRPA-SZMVWBNQSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019190 1000017404 /nfs/dbraw/zinc/01/74/04/1000017404.db2.gz FJIHNJWRMDVLAJ-CSFFLVESSA-N 1 1 361.442 2.528 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2cnc(F)c([N+](=O)[O-])c2)c2ccccc12 ZINC001169116396 1000022536 /nfs/dbraw/zinc/02/25/36/1000022536.db2.gz NDZVHSOMPZHDIM-GOSISDBHSA-N 1 1 372.356 2.506 20 5 FFBDMO CCC[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000767122665 1000100305 /nfs/dbraw/zinc/10/03/05/1000100305.db2.gz HVFPVNIGLGZRAR-IEODJVTJSA-N 1 1 361.442 2.567 20 5 FFBDMO C[N@@H+](CCOC(=O)COc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC000769071974 1000428584 /nfs/dbraw/zinc/42/85/84/1000428584.db2.gz GMTGSHNEFFOYNS-UHFFFAOYSA-N 1 1 362.357 2.788 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2cccc(C(F)F)c2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000673125 1016420928 /nfs/dbraw/zinc/42/09/28/1016420928.db2.gz FCVIUOTUWILXSO-HZPDHXFCSA-N 1 1 365.380 2.538 20 5 FFBDMO CC(C)[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)COc1ccccc1 ZINC000770038683 1000661393 /nfs/dbraw/zinc/66/13/93/1000661393.db2.gz DHTXGNQTYIEXOM-ICSRJNTNSA-N 1 1 374.437 2.779 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000746882861 1002288946 /nfs/dbraw/zinc/28/89/46/1002288946.db2.gz MQKVVMVARGIMLB-AWEZNQCLSA-N 1 1 358.442 2.552 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCC[N@H+]1CCc2ccccc2C1 ZINC001184776031 1002716560 /nfs/dbraw/zinc/71/65/60/1002716560.db2.gz VWIGIWXXBXKAGB-UHFFFAOYSA-N 1 1 369.347 2.817 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000792088690 1002915574 /nfs/dbraw/zinc/91/55/74/1002915574.db2.gz QFSFAVYGCJRGLJ-UHFFFAOYSA-N 1 1 374.441 2.649 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](NC(=O)C3CC3)C2)c([N+](=O)[O-])c1 ZINC001170355180 1003123156 /nfs/dbraw/zinc/12/31/56/1003123156.db2.gz WYAAUFSKEFNWAL-CZUORRHYSA-N 1 1 361.442 2.525 20 5 FFBDMO C[N@@H+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000804719906 1003800260 /nfs/dbraw/zinc/80/02/60/1003800260.db2.gz JWQBZCFASZTFLZ-HNNXBMFYSA-N 1 1 356.382 2.866 20 5 FFBDMO C[N@H+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000804719906 1003800278 /nfs/dbraw/zinc/80/02/78/1003800278.db2.gz JWQBZCFASZTFLZ-HNNXBMFYSA-N 1 1 356.382 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001130613517 1004304392 /nfs/dbraw/zinc/30/43/92/1004304392.db2.gz DEJTUBGRKUMOKS-IBGZPJMESA-N 1 1 354.410 2.693 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ncccn2)C1 ZINC001197864853 1004405340 /nfs/dbraw/zinc/40/53/40/1004405340.db2.gz QJEPOJMSHQQOCB-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO CC[C@@]1(C(=O)OC(C)(C)C)CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC001198310473 1004588134 /nfs/dbraw/zinc/58/81/34/1004588134.db2.gz QPXMPLACSPNXNL-GOSISDBHSA-N 1 1 366.462 2.934 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(c3ccncn3)CC2)o1 ZINC001195104000 1004882374 /nfs/dbraw/zinc/88/23/74/1004882374.db2.gz NJCAFHJGYUHDLV-UHFFFAOYSA-N 1 1 366.381 2.814 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000108346333 1005654895 /nfs/dbraw/zinc/65/48/95/1005654895.db2.gz UIHHIGHOAPXUTP-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@@H]1CO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000851415944 1005884980 /nfs/dbraw/zinc/88/49/80/1005884980.db2.gz QXXFOEYPUDVSSF-NVXWUHKLSA-N 1 1 364.442 2.655 20 5 FFBDMO C[C@@H]1CO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000851415944 1005884982 /nfs/dbraw/zinc/88/49/82/1005884982.db2.gz QXXFOEYPUDVSSF-NVXWUHKLSA-N 1 1 364.442 2.655 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1ccccn1)[C@H]1CC[C@H](O)CC1 ZINC000852204642 1005950884 /nfs/dbraw/zinc/95/08/84/1005950884.db2.gz QBDSIBDMHSTQQR-ZWOKBUDYSA-N 1 1 371.437 2.829 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000776595894 1006038443 /nfs/dbraw/zinc/03/84/43/1006038443.db2.gz CEBRWAIZVCYMSC-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595894 1006038458 /nfs/dbraw/zinc/03/84/58/1006038458.db2.gz CEBRWAIZVCYMSC-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595894 1006038465 /nfs/dbraw/zinc/03/84/65/1006038465.db2.gz CEBRWAIZVCYMSC-GOEBONIOSA-N 1 1 357.414 2.503 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]12 ZINC000852497655 1006055627 /nfs/dbraw/zinc/05/56/27/1006055627.db2.gz XHRRMYZCUHZKEY-TVFCKZIOSA-N 1 1 362.426 2.682 20 5 FFBDMO CC(C)(C(=O)Nc1cc[nH+]c(N2CCCCC2)c1)n1cc([N+](=O)[O-])cn1 ZINC001134221326 1006230847 /nfs/dbraw/zinc/23/08/47/1006230847.db2.gz UBCANIFSNUYZLM-UHFFFAOYSA-N 1 1 358.402 2.550 20 5 FFBDMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC(C)(CN2CC[NH+](C)CC2)CC1 ZINC000882182868 1006313826 /nfs/dbraw/zinc/31/38/26/1006313826.db2.gz OELZFESMZSYYCC-UHFFFAOYSA-N 1 1 374.485 2.651 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC001152413011 1032162899 /nfs/dbraw/zinc/16/28/99/1032162899.db2.gz WCTKURGVCNEBHT-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000113197509 1007220801 /nfs/dbraw/zinc/22/08/01/1007220801.db2.gz VKLBHTUFMXMMOI-CYBMUJFWSA-N 1 1 364.402 2.806 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)[C@@H]1CC[N@@H+](CC)C1 ZINC000855490184 1007366494 /nfs/dbraw/zinc/36/64/94/1007366494.db2.gz FBDQIAJPNOWEAZ-CYBMUJFWSA-N 1 1 364.402 2.676 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@](O)(c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000859588997 1008581402 /nfs/dbraw/zinc/58/14/02/1008581402.db2.gz ZFUTYBDSTXVADX-FQEVSTJZSA-N 1 1 369.421 2.907 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000886241276 1008610201 /nfs/dbraw/zinc/61/02/01/1008610201.db2.gz TXDDOYHIIUSUNM-ZFWWWQNUSA-N 1 1 364.446 2.973 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000886241276 1008610206 /nfs/dbraw/zinc/61/02/06/1008610206.db2.gz TXDDOYHIIUSUNM-ZFWWWQNUSA-N 1 1 364.446 2.973 20 5 FFBDMO COc1ccc(C[NH2+][C@H](CC(N)=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC001178342913 1008948220 /nfs/dbraw/zinc/94/82/20/1008948220.db2.gz KQMFDNOHOSBUEV-CQSZACIVSA-N 1 1 363.801 2.963 20 5 FFBDMO Cc1c(C[N@@H+]2[C@@H]3CC[C@H]2C[C@](O)(c2ccnn2C)C3)cccc1[N+](=O)[O-] ZINC000887049987 1008997174 /nfs/dbraw/zinc/99/71/74/1008997174.db2.gz WFADZOZWLBWVDY-MNZLEMJZSA-N 1 1 356.426 2.651 20 5 FFBDMO Cc1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000126434823 1009229630 /nfs/dbraw/zinc/22/96/30/1009229630.db2.gz XQYUQPDFDBSYET-CJNGLKHVSA-N 1 1 358.442 2.574 20 5 FFBDMO C[C@](CO)([NH2+]Cc1ccc(Br)nc1)c1cccc([N+](=O)[O-])c1 ZINC001179352830 1009315464 /nfs/dbraw/zinc/31/54/64/1009315464.db2.gz IVXGHOYRAONTNT-OAHLLOKOSA-N 1 1 366.215 2.750 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2c3ccc(OC)cc3ncc2[N+](=O)[O-])C[C@@H]1C ZINC000826632116 1009901091 /nfs/dbraw/zinc/90/10/91/1009901091.db2.gz CJURHZJVARBNTN-OKILXGFUSA-N 1 1 374.441 2.697 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)CCOc4ccccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001181504332 1010123336 /nfs/dbraw/zinc/12/33/36/1010123336.db2.gz AWXCHQOHFCMDAI-BGYRXZFFSA-N 1 1 373.453 2.698 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000715594840 1010351853 /nfs/dbraw/zinc/35/18/53/1010351853.db2.gz JMLRLVXIMWXNNT-CYBMUJFWSA-N 1 1 361.348 2.877 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000715594840 1010351863 /nfs/dbraw/zinc/35/18/63/1010351863.db2.gz JMLRLVXIMWXNNT-CYBMUJFWSA-N 1 1 361.348 2.877 20 5 FFBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CCC1(C)C ZINC000866115325 1010930671 /nfs/dbraw/zinc/93/06/71/1010930671.db2.gz ZFJCIZWSGVFKQS-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001171862406 1011512332 /nfs/dbraw/zinc/51/23/32/1011512332.db2.gz ZBQDAESGLPMSPV-CYBMUJFWSA-N 1 1 364.421 2.843 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870092393 1012125471 /nfs/dbraw/zinc/12/54/71/1012125471.db2.gz GUTMCOBWUDSCNS-IPMKNSEASA-N 1 1 367.405 2.577 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1O ZINC001173010220 1012179282 /nfs/dbraw/zinc/17/92/82/1012179282.db2.gz OAAAXZNQKIHBSE-BDJLRTHQSA-N 1 1 355.385 2.545 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCCC4(COC4)C3)CC2)c(F)c1 ZINC001173009608 1012179639 /nfs/dbraw/zinc/17/96/39/1012179639.db2.gz FISNURLWFYHYNJ-UHFFFAOYSA-N 1 1 367.396 2.954 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCN4CCC3CC4)CC2)c(F)c1 ZINC001173015607 1012187012 /nfs/dbraw/zinc/18/70/12/1012187012.db2.gz TZBGLZANUIVPCU-UHFFFAOYSA-N 1 1 366.412 2.622 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N3CC[NH+]4CCC3CC4)CC2)c(F)c1 ZINC001173015607 1012187024 /nfs/dbraw/zinc/18/70/24/1012187024.db2.gz TZBGLZANUIVPCU-UHFFFAOYSA-N 1 1 366.412 2.622 20 5 FFBDMO CC(=O)[C@@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015556 1012187149 /nfs/dbraw/zinc/18/71/49/1012187149.db2.gz FJBKVRCYRMJVIG-INIZCTEOSA-N 1 1 353.369 2.895 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870146449 1012200318 /nfs/dbraw/zinc/20/03/18/1012200318.db2.gz YWTQGONZQDESPB-AUUYWEPGSA-N 1 1 369.421 2.880 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@](O)(C(F)(F)F)C2)c1F ZINC001173183578 1012326452 /nfs/dbraw/zinc/32/64/52/1012326452.db2.gz ZNYLEGPWNFOWLT-YMTOWFKASA-N 1 1 366.311 2.673 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@](O)(C(F)(F)F)C2)c1F ZINC001173183578 1012326466 /nfs/dbraw/zinc/32/64/66/1012326466.db2.gz ZNYLEGPWNFOWLT-YMTOWFKASA-N 1 1 366.311 2.673 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173188141 1012328183 /nfs/dbraw/zinc/32/81/83/1012328183.db2.gz CRGUYOIDJLWRDB-VXGBXAGGSA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173185912 1012328578 /nfs/dbraw/zinc/32/85/78/1012328578.db2.gz QAQJIZYDRHVNLA-VXGBXAGGSA-N 1 1 354.378 2.559 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173188138 1012328861 /nfs/dbraw/zinc/32/88/61/1012328861.db2.gz CRGUYOIDJLWRDB-RYUDHWBXSA-N 1 1 354.378 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2nc(C3CC3)no2)c1F ZINC001173189760 1012332017 /nfs/dbraw/zinc/33/20/17/1012332017.db2.gz QVPSOGKZKZEIJY-SECBINFHSA-N 1 1 350.350 2.724 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ncc2ccccn21 ZINC000870378603 1012341754 /nfs/dbraw/zinc/34/17/54/1012341754.db2.gz WAOREGWAFFSFNK-KRWDZBQOSA-N 1 1 366.377 2.674 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ncc2ccccn21 ZINC000870378603 1012341767 /nfs/dbraw/zinc/34/17/67/1012341767.db2.gz WAOREGWAFFSFNK-KRWDZBQOSA-N 1 1 366.377 2.674 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cn(C)nc21 ZINC001173223445 1012353513 /nfs/dbraw/zinc/35/35/13/1012353513.db2.gz FXJMCWBBAJQOGG-RHSMWYFYSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cn(C)nc21 ZINC001173223450 1012355005 /nfs/dbraw/zinc/35/50/05/1012355005.db2.gz FXJMCWBBAJQOGG-YOEHRIQHSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001173235398 1012366640 /nfs/dbraw/zinc/36/66/40/1012366640.db2.gz WQDQRSIWNHIMFM-HNNXBMFYSA-N 1 1 357.410 2.967 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880307 1012617451 /nfs/dbraw/zinc/61/74/51/1012617451.db2.gz YYQNKHAJSAMZAH-IEBWSBKVSA-N 1 1 373.384 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC[C@@H](OCC4CC4)C3)n2)cc1 ZINC000777551258 1017662560 /nfs/dbraw/zinc/66/25/60/1017662560.db2.gz LYNMMMIDUAUOIC-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H](OCC4CC4)C3)n2)cc1 ZINC000777551258 1017662573 /nfs/dbraw/zinc/66/25/73/1017662573.db2.gz LYNMMMIDUAUOIC-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000828490100 1032724831 /nfs/dbraw/zinc/72/48/31/1032724831.db2.gz XEVVKIFSCMRJDD-SFHVURJKSA-N 1 1 357.385 2.969 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000828490100 1032724841 /nfs/dbraw/zinc/72/48/41/1032724841.db2.gz XEVVKIFSCMRJDD-SFHVURJKSA-N 1 1 357.385 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)nc1 ZINC000801524811 1019076277 /nfs/dbraw/zinc/07/62/77/1019076277.db2.gz OBRRKXPUURMBLA-GFCCVEGCSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)nc1 ZINC000801524811 1019076291 /nfs/dbraw/zinc/07/62/91/1019076291.db2.gz OBRRKXPUURMBLA-GFCCVEGCSA-N 1 1 361.333 2.724 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)C[C@H]1COCC2 ZINC000475546332 1019498575 /nfs/dbraw/zinc/49/85/75/1019498575.db2.gz DNEWQFQNXVHFCE-YLIRLVPWSA-N 1 1 360.410 2.510 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525255 1020275506 /nfs/dbraw/zinc/27/55/06/1020275506.db2.gz QHGQZMQFKVEQAK-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC1CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525255 1020275516 /nfs/dbraw/zinc/27/55/16/1020275516.db2.gz QHGQZMQFKVEQAK-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525255 1020275527 /nfs/dbraw/zinc/27/55/27/1020275527.db2.gz QHGQZMQFKVEQAK-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C[C@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931307641 1020414110 /nfs/dbraw/zinc/41/41/10/1020414110.db2.gz NOKLCXGXDPBTRT-OALUTQOASA-N 1 1 360.458 2.505 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@H]3C2)cc1 ZINC001048814452 1020522329 /nfs/dbraw/zinc/52/23/29/1020522329.db2.gz LXULPNATEDVRGB-UKBAYJJMSA-N 1 1 371.481 2.540 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)cc1 ZINC001048814452 1020522335 /nfs/dbraw/zinc/52/23/35/1020522335.db2.gz LXULPNATEDVRGB-UKBAYJJMSA-N 1 1 371.481 2.540 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)cc1 ZINC001048814452 1020522340 /nfs/dbraw/zinc/52/23/40/1020522340.db2.gz LXULPNATEDVRGB-UKBAYJJMSA-N 1 1 371.481 2.540 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc([N+](=O)[O-])c1 ZINC000903123907 1020689518 /nfs/dbraw/zinc/68/95/18/1020689518.db2.gz CTPURCUYXAYGLV-MJXNMMHHSA-N 1 1 363.458 2.632 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2c2ccnn2C)cccc1[N+](=O)[O-] ZINC000932267068 1020760171 /nfs/dbraw/zinc/76/01/71/1020760171.db2.gz YBHIJQDALCLJMZ-KRWDZBQOSA-N 1 1 357.414 2.802 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])C[C@@H]2C1 ZINC000932727432 1020887058 /nfs/dbraw/zinc/88/70/58/1020887058.db2.gz OLJURAZYOCTOLN-UKRRQHHQSA-N 1 1 362.430 2.679 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])nc1 ZINC000934343792 1021204228 /nfs/dbraw/zinc/20/42/28/1021204228.db2.gz PLYVPNHFKIJCRI-WMLDXEAASA-N 1 1 373.409 2.575 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]12CC[C@@H]1CC[N@@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660785 1021328785 /nfs/dbraw/zinc/32/87/85/1021328785.db2.gz ZTQSGDQRSNJCGQ-RDTXWAMCSA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]12CC[C@@H]1CC[N@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660785 1021328803 /nfs/dbraw/zinc/32/88/03/1021328803.db2.gz ZTQSGDQRSNJCGQ-RDTXWAMCSA-N 1 1 362.430 2.869 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001116886169 1021471634 /nfs/dbraw/zinc/47/16/34/1021471634.db2.gz HGTDXTKQULVHSW-ZIAGYGMSSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001116886169 1021471637 /nfs/dbraw/zinc/47/16/37/1021471637.db2.gz HGTDXTKQULVHSW-ZIAGYGMSSA-N 1 1 358.398 2.881 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000155241342 1022230397 /nfs/dbraw/zinc/23/03/97/1022230397.db2.gz JQZPADGHZCPBKF-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC([N@H+](CC2=CCCCC2)CC2CC2)CC1 ZINC001039485656 1022759563 /nfs/dbraw/zinc/75/95/63/1022759563.db2.gz IKZSZWLSKPKOFR-RTBURBONSA-N 1 1 361.486 2.855 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@@H+](CC2=CCCCC2)CC2CC2)CC1 ZINC001039485656 1022759574 /nfs/dbraw/zinc/75/95/74/1022759574.db2.gz IKZSZWLSKPKOFR-RTBURBONSA-N 1 1 361.486 2.855 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@H+](CC2=CCCCC2)CC2CC2)CC1 ZINC001039485656 1022759586 /nfs/dbraw/zinc/75/95/86/1022759586.db2.gz IKZSZWLSKPKOFR-RTBURBONSA-N 1 1 361.486 2.855 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](C3CCOCC3)C2)nc1-c1ccncc1 ZINC000754784938 1023517791 /nfs/dbraw/zinc/51/77/91/1023517791.db2.gz RMFVOTSVFAPGQP-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)O[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000755835393 1023642709 /nfs/dbraw/zinc/64/27/09/1023642709.db2.gz YQWGSEWGNRSYRX-ZBFHGGJFSA-N 1 1 372.425 2.879 20 5 FFBDMO O=C(OC[C@@H]1CC[N@H+]1C1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001123346932 1023755398 /nfs/dbraw/zinc/75/53/98/1023755398.db2.gz PSDFOLMGGXRDTE-AWEZNQCLSA-N 1 1 354.790 2.658 20 5 FFBDMO Cc1c(C(=O)NCC[C@H]2CCC[N@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000838142759 1026224649 /nfs/dbraw/zinc/22/46/49/1026224649.db2.gz PRVNGNUYKXVRAA-CYBMUJFWSA-N 1 1 364.402 2.582 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000839097170 1026588222 /nfs/dbraw/zinc/58/82/22/1026588222.db2.gz DEMGKYZKKXCPBN-GUDVDZBRSA-N 1 1 370.405 2.517 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000247010297 1026619467 /nfs/dbraw/zinc/61/94/67/1026619467.db2.gz LDOUXNSCMXYNRX-PKOBYXMFSA-N 1 1 355.442 2.735 20 5 FFBDMO O=[N+]([O-])c1cccc(N[C@H]2CC[C@H](N3CC[NH+](CC4CC4)CC3)CC2)n1 ZINC001159626298 1027448843 /nfs/dbraw/zinc/44/88/43/1027448843.db2.gz NNSCGKVBLRQOQS-QAQDUYKDSA-N 1 1 359.474 2.741 20 5 FFBDMO CSc1nc(Cl)nc(-n2cc(CC[NH3+])c3cnccc32)c1[N+](=O)[O-] ZINC001160945772 1027934308 /nfs/dbraw/zinc/93/43/08/1027934308.db2.gz LLNFWMHOLDGYOW-UHFFFAOYSA-N 1 1 364.818 2.600 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CCC[C@@H](C(F)(F)F)[C@H]2CO)ncc1[N+](=O)[O-] ZINC001164301308 1029236672 /nfs/dbraw/zinc/23/66/72/1029236672.db2.gz BAMNQZXWXXGEDY-RCOIXESOSA-N 1 1 374.363 2.662 20 5 FFBDMO Cc1cc(N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164378887 1029267786 /nfs/dbraw/zinc/26/77/86/1029267786.db2.gz DAEFHPVTASFRST-USXIJHARSA-N 1 1 353.426 2.534 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164490605 1029296033 /nfs/dbraw/zinc/29/60/33/1029296033.db2.gz NXZFLFBCAZQCHL-HZPDHXFCSA-N 1 1 365.861 2.690 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cc(Cl)cc([N+](=O)[O-])n2)CC1 ZINC001165107090 1029391784 /nfs/dbraw/zinc/39/17/84/1029391784.db2.gz FGFXFUQQTUEUPF-CQSZACIVSA-N 1 1 354.838 2.723 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ccc3[nH]cc([N+](=O)[O-])c3n2)CC1 ZINC001165112359 1029400472 /nfs/dbraw/zinc/40/04/72/1029400472.db2.gz ZNEFNPZTLFQFIQ-CQSZACIVSA-N 1 1 359.430 2.551 20 5 FFBDMO COc1nc(N(C)[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)ncc1[N+](=O)[O-] ZINC001165184601 1029440295 /nfs/dbraw/zinc/44/02/95/1029440295.db2.gz XQFHDLZIBPQBPZ-WMLDXEAASA-N 1 1 371.441 2.740 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000136515857 1029571554 /nfs/dbraw/zinc/57/15/54/1029571554.db2.gz GWJQEMWZAJLVLG-INIZCTEOSA-N 1 1 370.453 2.999 20 5 FFBDMO C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000888092491 1029618274 /nfs/dbraw/zinc/61/82/74/1029618274.db2.gz XFOCXZYYRGKCKJ-PXAZEXFGSA-N 1 1 366.801 2.826 20 5 FFBDMO C[C@@H]1C[N@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@H]2CCCC[C@H]12 ZINC000782278102 1029637614 /nfs/dbraw/zinc/63/76/14/1029637614.db2.gz TWJJDWQQKIFWBA-WQVCFCJDSA-N 1 1 358.398 2.880 20 5 FFBDMO C[C@@H]1C[N@@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@H]2CCCC[C@H]12 ZINC000782278102 1029637619 /nfs/dbraw/zinc/63/76/19/1029637619.db2.gz TWJJDWQQKIFWBA-WQVCFCJDSA-N 1 1 358.398 2.880 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000782286567 1029640014 /nfs/dbraw/zinc/64/00/14/1029640014.db2.gz BYBBVHWORANLFL-HNNXBMFYSA-N 1 1 352.398 2.565 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2nccc(C)c2[N+](=O)[O-])c2ccccc12 ZINC001158236638 1029766753 /nfs/dbraw/zinc/76/67/53/1029766753.db2.gz NSOCWGWOBGEZMB-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1C[C@@H](C)[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001165202298 1029888059 /nfs/dbraw/zinc/88/80/59/1029888059.db2.gz MHVVUUQMGARVTF-CABCVRRESA-N 1 1 356.426 2.636 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCN(c3ncccc3F)CC2)c1 ZINC000784405396 1030606927 /nfs/dbraw/zinc/60/69/27/1030606927.db2.gz JVFMPWYLUIGNGW-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000842311359 1030678532 /nfs/dbraw/zinc/67/85/32/1030678532.db2.gz WFRCVURZEGBTNL-OKZBNKHCSA-N 1 1 362.426 2.598 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)C1=O ZINC000842616760 1030831416 /nfs/dbraw/zinc/83/14/16/1030831416.db2.gz NIKPGBKIXBGMTO-IYJAJMOOSA-N 1 1 372.425 2.584 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000796880917 1030942747 /nfs/dbraw/zinc/94/27/47/1030942747.db2.gz ACLJKYJPHCPPDS-HNNXBMFYSA-N 1 1 364.442 2.772 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)CCC(N)=O ZINC001142953622 1031094586 /nfs/dbraw/zinc/09/45/86/1031094586.db2.gz SXNMSQLSYSVPBH-UHFFFAOYSA-N 1 1 350.422 2.966 20 5 FFBDMO Cc1cccc(C)c1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001115530718 1031786820 /nfs/dbraw/zinc/78/68/20/1031786820.db2.gz NHMBXZCEDFTCLY-SJLPKXTDSA-N 1 1 359.470 2.877 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000312696211 1033680689 /nfs/dbraw/zinc/68/06/89/1033680689.db2.gz QZAGCVIEWWLYLF-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC001220409125 1034156310 /nfs/dbraw/zinc/15/63/10/1034156310.db2.gz ABQPNTYMEOMVGF-ZIAGYGMSSA-N 1 1 364.446 2.913 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccccc2)C[C@H](COc2[nH]ccc(=O)c2[N+](=O)[O-])O1 ZINC001225664952 1034359169 /nfs/dbraw/zinc/35/91/69/1034359169.db2.gz VDZAFRANQNDLFR-OAHLLOKOSA-N 1 1 373.409 2.754 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)C[C@H](COc2[nH]ccc(=O)c2[N+](=O)[O-])O1 ZINC001225664952 1034359177 /nfs/dbraw/zinc/35/91/77/1034359177.db2.gz VDZAFRANQNDLFR-OAHLLOKOSA-N 1 1 373.409 2.754 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226165513 1034554445 /nfs/dbraw/zinc/55/44/45/1034554445.db2.gz LLWMESBQOZWIPA-AUUYWEPGSA-N 1 1 369.421 2.983 20 5 FFBDMO COC(=O)Cc1ccc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001226215510 1034575206 /nfs/dbraw/zinc/57/52/06/1034575206.db2.gz XRSGHOSTUWNUGI-KRWDZBQOSA-N 1 1 370.405 2.964 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)c1 ZINC001227044709 1034919098 /nfs/dbraw/zinc/91/90/98/1034919098.db2.gz QXVNLPBPSLVOLS-DZGCQCFKSA-N 1 1 371.393 2.991 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC001229455649 1036685314 /nfs/dbraw/zinc/68/53/14/1036685314.db2.gz KXPCFAAUCYWHRA-JFIYKMOQSA-N 1 1 355.394 2.518 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])c(C)cc3F)C[C@H]1[N@H+]2C ZINC001234058525 1036898115 /nfs/dbraw/zinc/89/81/15/1036898115.db2.gz FNQRIUHWEAQXCT-VGWHQZGPSA-N 1 1 352.362 2.588 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2ccc(I)c([N+](=O)[O-])c2)C1 ZINC001229952178 1036995237 /nfs/dbraw/zinc/99/52/37/1036995237.db2.gz XHMLLLRECDDGPP-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO C[NH+]1CCN(c2ncc(-c3ccnc4c3ccc3cccnc34)cn2)CC1 ZINC001235923098 1037838866 /nfs/dbraw/zinc/83/88/66/1037838866.db2.gz YZXOCSMLBKTQSS-UHFFFAOYSA-N 1 1 356.433 2.992 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H]2CC[C@H](SC)C2)cc1[N+](=O)[O-] ZINC001255648830 1038100977 /nfs/dbraw/zinc/10/09/77/1038100977.db2.gz KNKDZHRVQCSYPC-KBPBESRZSA-N 1 1 368.455 2.863 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](C)[C@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256092955 1038378568 /nfs/dbraw/zinc/37/85/68/1038378568.db2.gz CFALUFULMPRPMP-RDTXWAMCSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC(=O)C(C)(C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100784 1038384613 /nfs/dbraw/zinc/38/46/13/1038384613.db2.gz OZCPOWYQHDLUNM-UHFFFAOYSA-N 1 1 361.442 2.873 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](N(C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101205 1038384880 /nfs/dbraw/zinc/38/48/80/1038384880.db2.gz CAIQRLPEQCLSQX-GOSISDBHSA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@@H]([N@H+](C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101205 1038384889 /nfs/dbraw/zinc/38/48/89/1038384889.db2.gz CAIQRLPEQCLSQX-GOSISDBHSA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@@H]([N@@H+](C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101205 1038384902 /nfs/dbraw/zinc/38/49/02/1038384902.db2.gz CAIQRLPEQCLSQX-GOSISDBHSA-N 1 1 374.485 2.741 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1N1CCN(CC[N@H+](C)Cc2ccccc2)CC1 ZINC001258055185 1039146007 /nfs/dbraw/zinc/14/60/07/1039146007.db2.gz HHTOALNKRDRPDH-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO CC1(C)C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCN1 ZINC001246816929 1039491850 /nfs/dbraw/zinc/49/18/50/1039491850.db2.gz MXNHURQVFLXAPP-UHFFFAOYSA-N 1 1 354.401 2.526 20 5 FFBDMO CC1(C)C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCN1 ZINC001246816929 1039491858 /nfs/dbraw/zinc/49/18/58/1039491858.db2.gz MXNHURQVFLXAPP-UHFFFAOYSA-N 1 1 354.401 2.526 20 5 FFBDMO COc1ccc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)cc1OC ZINC001247666520 1039876056 /nfs/dbraw/zinc/87/60/56/1039876056.db2.gz PIXLBFTXGQEHSD-ZDUSSCGKSA-N 1 1 370.365 2.905 20 5 FFBDMO CCOCc1nnn2c1C[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC001254557417 1040795925 /nfs/dbraw/zinc/79/59/25/1040795925.db2.gz PXRCXNBIFPIKEG-CQSZACIVSA-N 1 1 359.430 2.560 20 5 FFBDMO CCOCc1nnn2c1C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CCC2 ZINC001254557417 1040795939 /nfs/dbraw/zinc/79/59/39/1040795939.db2.gz PXRCXNBIFPIKEG-CQSZACIVSA-N 1 1 359.430 2.560 20 5 FFBDMO COCCN1CC[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cccnc21 ZINC001254557331 1040796856 /nfs/dbraw/zinc/79/68/56/1040796856.db2.gz PPODURYJSAAUIJ-INIZCTEOSA-N 1 1 370.453 2.889 20 5 FFBDMO COc1ccnc(O[C@@H]2CCC[N@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254567329 1040805974 /nfs/dbraw/zinc/80/59/74/1040805974.db2.gz BPDGQZPBHQOSIN-GDBMZVCRSA-N 1 1 372.425 2.868 20 5 FFBDMO CCn1ncc2c1[C@H](COC)C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597625 1040828376 /nfs/dbraw/zinc/82/83/76/1040828376.db2.gz UIFBMOKVQPWTLT-FUHWJXTLSA-N 1 1 356.426 2.524 20 5 FFBDMO COc1cccnc1O[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611008 1040838961 /nfs/dbraw/zinc/83/89/61/1040838961.db2.gz NVCCHTVFNWVVKD-DLBZAZTESA-N 1 1 355.394 2.619 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001319691113 1045241681 /nfs/dbraw/zinc/24/16/81/1045241681.db2.gz NAAVHYQBGHARSX-MSOLQXFVSA-N 1 1 372.400 2.979 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2[nH]1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC001320887251 1045488209 /nfs/dbraw/zinc/48/82/09/1045488209.db2.gz AVZGBUCOXXUECP-INIZCTEOSA-N 1 1 355.394 2.948 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001324255791 1045939315 /nfs/dbraw/zinc/93/93/15/1045939315.db2.gz SMCUEYCIEPYERQ-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001324255791 1045939322 /nfs/dbraw/zinc/93/93/22/1045939322.db2.gz SMCUEYCIEPYERQ-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CSCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001326492117 1046955282 /nfs/dbraw/zinc/95/52/82/1046955282.db2.gz WKRVHOWYTATKIB-GFCCVEGCSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@@H](CSCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001326492117 1046955293 /nfs/dbraw/zinc/95/52/93/1046955293.db2.gz WKRVHOWYTATKIB-GFCCVEGCSA-N 1 1 361.261 2.921 20 5 FFBDMO Cc1n[nH]c(=O)c(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1C ZINC001327396269 1047878851 /nfs/dbraw/zinc/87/88/51/1047878851.db2.gz HTDLZRLWCXCWSS-UHFFFAOYSA-N 1 1 354.313 2.598 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001328436695 1048304273 /nfs/dbraw/zinc/30/42/73/1048304273.db2.gz KJMVXGXHWHJHML-LJQANCHMSA-N 1 1 366.421 2.895 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001332911451 1048617374 /nfs/dbraw/zinc/61/73/74/1048617374.db2.gz JDZPKTIYFWELES-CHWSQXEVSA-N 1 1 351.834 2.924 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001291871877 1048960051 /nfs/dbraw/zinc/96/00/51/1048960051.db2.gz NQHDCWQJGNUCDY-UHFFFAOYSA-N 1 1 353.382 2.655 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC001292072409 1049101295 /nfs/dbraw/zinc/10/12/95/1049101295.db2.gz RGTMZRXYEHAKMQ-CYBMUJFWSA-N 1 1 351.422 2.903 20 5 FFBDMO Cc1c[nH]c(Nc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])[nH+]1 ZINC001340713211 1051074571 /nfs/dbraw/zinc/07/45/71/1051074571.db2.gz JWHZHNAQNWZBDK-UHFFFAOYSA-N 1 1 365.415 2.545 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001341133153 1051482264 /nfs/dbraw/zinc/48/22/64/1051482264.db2.gz LHSWBSNSARIFOE-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001341133153 1051482271 /nfs/dbraw/zinc/48/22/71/1051482271.db2.gz LHSWBSNSARIFOE-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO C[C@](CO)([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC001307999854 1052380288 /nfs/dbraw/zinc/38/02/88/1052380288.db2.gz PUBUJVSXQBPCQX-MRXNPFEDSA-N 1 1 366.320 2.914 20 5 FFBDMO Cc1c(NC(=O)CC[NH2+][C@H](c2ncccn2)C2CC2)cccc1[N+](=O)[O-] ZINC001308093297 1052405143 /nfs/dbraw/zinc/40/51/43/1052405143.db2.gz RLRYSTDACJBQFN-KRWDZBQOSA-N 1 1 355.398 2.763 20 5 FFBDMO CC1(C)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1c1ccccc1 ZINC001308113290 1052410257 /nfs/dbraw/zinc/41/02/57/1052410257.db2.gz MIFOILXVHXNLHG-QZTJIDSGSA-N 1 1 358.442 2.668 20 5 FFBDMO CC1(C)CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1 ZINC001308113292 1052410662 /nfs/dbraw/zinc/41/06/62/1052410662.db2.gz MIFOILXVHXNLHG-ROUUACIJSA-N 1 1 358.442 2.668 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001308162435 1052421164 /nfs/dbraw/zinc/42/11/64/1052421164.db2.gz XRMOIUISSAPLRW-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001308162435 1052421167 /nfs/dbraw/zinc/42/11/67/1052421167.db2.gz XRMOIUISSAPLRW-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CN(C)CCN1C ZINC001308949276 1052525099 /nfs/dbraw/zinc/52/50/99/1052525099.db2.gz XPOVVTKPVNKLNI-IINYFYTJSA-N 1 1 361.273 2.626 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@H]2C1 ZINC001337834525 1055046824 /nfs/dbraw/zinc/04/68/24/1055046824.db2.gz PPBQMVYJPSBEAS-LJUAHTATSA-N 1 1 358.225 2.972 20 5 FFBDMO O=C([C@@H]1CC[N@@H+](Cc2ccccc2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001349788171 1055468839 /nfs/dbraw/zinc/46/88/39/1055468839.db2.gz WMLULGUHIBRDGI-QGZVFWFLSA-N 1 1 351.406 2.959 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001349833941 1055492727 /nfs/dbraw/zinc/49/27/27/1055492727.db2.gz NYGNNSDUIWXAQT-MSOLQXFVSA-N 1 1 358.442 2.679 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC001352660040 1055692082 /nfs/dbraw/zinc/69/20/82/1055692082.db2.gz BOIAKXXDGXTOBP-OAHLLOKOSA-N 1 1 358.446 2.652 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC001350441694 1055776162 /nfs/dbraw/zinc/77/61/62/1055776162.db2.gz UIFQGJLYBURZJF-HNNXBMFYSA-N 1 1 360.458 2.975 20 5 FFBDMO C[C@H]([C@H](C)Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12)[NH+]1CCOCC1 ZINC001350456340 1055783169 /nfs/dbraw/zinc/78/31/69/1055783169.db2.gz JUOUSPAEYQFFGL-WDEREUQCSA-N 1 1 365.821 2.713 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001351229309 1056145112 /nfs/dbraw/zinc/14/51/12/1056145112.db2.gz YHPTWPGYBBGTFI-HNNXBMFYSA-N 1 1 370.457 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)o2)cc1 ZINC001200267439 1056189110 /nfs/dbraw/zinc/18/91/10/1056189110.db2.gz FYBIJGJDIHRLNH-SJLPKXTDSA-N 1 1 357.410 2.808 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001544368181 1071634738 /nfs/dbraw/zinc/63/47/38/1071634738.db2.gz SKVWCNHOZLTLLY-UHFFFAOYSA-N 1 1 369.784 2.685 20 5 FFBDMO Cn1c([C@@H]2CCC[N@@H+]2C)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001339484630 1056498451 /nfs/dbraw/zinc/49/84/51/1056498451.db2.gz CKFNVMDFBCPQMI-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@@H]2CCC[N@H+]2C)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001339484630 1056498468 /nfs/dbraw/zinc/49/84/68/1056498468.db2.gz CKFNVMDFBCPQMI-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO CC(C)[N@H+]1CCCN(c2nnc([C@H](C)[N+](=O)[O-])n2Cc2ccccc2)CC1 ZINC001354296894 1058823735 /nfs/dbraw/zinc/82/37/35/1058823735.db2.gz JCKQYPQKBFOZNI-INIZCTEOSA-N 1 1 372.473 2.585 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C(C)C)[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001454899628 1059642553 /nfs/dbraw/zinc/64/25/53/1059642553.db2.gz KTNUDDFWFFEMSN-MPGHIAIKSA-N 1 1 363.458 2.653 20 5 FFBDMO COCCCOC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848480274 1060110491 /nfs/dbraw/zinc/11/04/91/1060110491.db2.gz PKRYWQCNDIFDPR-UHFFFAOYSA-N 1 1 374.441 2.933 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481982 1060116122 /nfs/dbraw/zinc/11/61/22/1060116122.db2.gz IZRLGRVAOKMKNG-GOSISDBHSA-N 1 1 361.442 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000848485263 1060126245 /nfs/dbraw/zinc/12/62/45/1060126245.db2.gz XFTNUYWYGQKLCP-RTBURBONSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000848485263 1060126252 /nfs/dbraw/zinc/12/62/52/1060126252.db2.gz XFTNUYWYGQKLCP-RTBURBONSA-N 1 1 373.453 2.759 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491414 1060149001 /nfs/dbraw/zinc/14/90/01/1060149001.db2.gz WAFSMCSKRMOCFM-ROUUACIJSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491414 1060149010 /nfs/dbraw/zinc/14/90/10/1060149010.db2.gz WAFSMCSKRMOCFM-ROUUACIJSA-N 1 1 361.442 2.615 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000848584808 1060315531 /nfs/dbraw/zinc/31/55/31/1060315531.db2.gz ISXIXAZOMNXWMO-SWLSCSKDSA-N 1 1 369.368 2.509 20 5 FFBDMO COCC[NH+]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC001458082294 1060507244 /nfs/dbraw/zinc/50/72/44/1060507244.db2.gz FBZODUWGRJNJOB-UHFFFAOYSA-N 1 1 350.806 2.565 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000848783914 1060689694 /nfs/dbraw/zinc/68/96/94/1060689694.db2.gz GKAJAKWLSTVLHX-UONOGXRCSA-N 1 1 364.402 2.733 20 5 FFBDMO CCc1ccc(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001475269109 1061028295 /nfs/dbraw/zinc/02/82/95/1061028295.db2.gz GAMDHOQAZOKRJH-MRXNPFEDSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c(C)c1[N+](=O)[O-] ZINC001475269532 1061028435 /nfs/dbraw/zinc/02/84/35/1061028435.db2.gz KHFXWKQTNDYOED-OAHLLOKOSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cccc(C[NH+]2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)c1 ZINC001460646289 1061045928 /nfs/dbraw/zinc/04/59/28/1061045928.db2.gz QFAAEXAQZAIAGR-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001460722983 1061077296 /nfs/dbraw/zinc/07/72/96/1061077296.db2.gz ZOLWKYXMSWTSAJ-CQSZACIVSA-N 1 1 363.414 2.589 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001475524782 1061125092 /nfs/dbraw/zinc/12/50/92/1061125092.db2.gz RRFVCAOLPYMGTF-UHFFFAOYSA-N 1 1 357.476 2.610 20 5 FFBDMO O=C(Nc1nccc2c1cccc2[N+](=O)[O-])c1cnn(-c2cc[nH+]cc2)c1 ZINC001461449831 1061319918 /nfs/dbraw/zinc/31/99/18/1061319918.db2.gz JSPPKDQINACLNV-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Nc2c(C)cncc2[N+](=O)[O-])C1 ZINC001476375830 1061402264 /nfs/dbraw/zinc/40/22/64/1061402264.db2.gz MKJMCXBUJJEHJC-CQSZACIVSA-N 1 1 363.462 2.742 20 5 FFBDMO CCc1ccc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001463526938 1062145880 /nfs/dbraw/zinc/14/58/80/1062145880.db2.gz KGCQKRZQBMKAIF-KGLIPLIRSA-N 1 1 369.487 2.556 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc2ccccc2c1[N+](=O)[O-] ZINC001464364825 1062571226 /nfs/dbraw/zinc/57/12/26/1062571226.db2.gz QFAWYOTVBWDKMP-GFCCVEGCSA-N 1 1 354.410 2.544 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001532368586 1063049698 /nfs/dbraw/zinc/04/96/98/1063049698.db2.gz DSIVQFUXPKJGJX-SFHVURJKSA-N 1 1 354.410 2.700 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001532368586 1063049718 /nfs/dbraw/zinc/04/97/18/1063049718.db2.gz DSIVQFUXPKJGJX-SFHVURJKSA-N 1 1 354.410 2.700 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001493841276 1063234114 /nfs/dbraw/zinc/23/41/14/1063234114.db2.gz FPXFGMDWVCQWBA-AWEZNQCLSA-N 1 1 370.457 2.936 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC001466026516 1063299557 /nfs/dbraw/zinc/29/95/57/1063299557.db2.gz FGBVIELVLLGLNR-HIFRSBDPSA-N 1 1 350.444 2.605 20 5 FFBDMO Cc1cc(NC(=O)c2ccc(C[NH+]3CCN(C)CC3)cc2)cc([N+](=O)[O-])c1 ZINC001472373987 1065035928 /nfs/dbraw/zinc/03/59/28/1065035928.db2.gz BOINHBJIRVVWKM-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC001472634524 1065118338 /nfs/dbraw/zinc/11/83/38/1065118338.db2.gz WWGIMBPKUBNWGV-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO COC(=O)c1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1F ZINC001473713588 1065328274 /nfs/dbraw/zinc/32/82/74/1065328274.db2.gz BGKNQTHIJMAHGT-SFHVURJKSA-N 1 1 362.357 2.518 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001473906611 1065416984 /nfs/dbraw/zinc/41/69/84/1065416984.db2.gz LAYXJLUCAFIPEO-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO CN(CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1c[nH]nn1 ZINC001576809960 1078277112 /nfs/dbraw/zinc/27/71/12/1078277112.db2.gz UYFZNZNUMSRINC-UHFFFAOYSA-N 1 1 370.413 2.585 20 5 FFBDMO COc1c(F)cc(F)cc1NC(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001579134877 1078573308 /nfs/dbraw/zinc/57/33/08/1078573308.db2.gz RPPIAXYSMFZFSF-INIZCTEOSA-N 1 1 351.309 2.694 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC001580494248 1078814856 /nfs/dbraw/zinc/81/48/56/1078814856.db2.gz RJCCYGUCKANUHB-KKMIYCERSA-N 1 1 355.369 2.920 20 5 FFBDMO Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)[NH+]2CCCC2)o1 ZINC001584306819 1079337332 /nfs/dbraw/zinc/33/73/32/1079337332.db2.gz PMZBOSNIKJOUGO-MRXNPFEDSA-N 1 1 358.398 2.767 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001585629529 1079482315 /nfs/dbraw/zinc/48/23/15/1079482315.db2.gz XCSLMYUZUBDOIK-KGLIPLIRSA-N 1 1 354.410 2.687 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)n1 ZINC001559058045 1076122044 /nfs/dbraw/zinc/12/20/44/1076122044.db2.gz XPNINVWOOQNUNN-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC001559136013 1076128740 /nfs/dbraw/zinc/12/87/40/1076128740.db2.gz FASPWBVHTQRBHC-UHFFFAOYSA-N 1 1 356.213 2.962 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC001559255627 1076140360 /nfs/dbraw/zinc/14/03/60/1076140360.db2.gz YBYQXLDZMSUXFL-ZBFHGGJFSA-N 1 1 368.437 2.874 20 5 FFBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1 ZINC001560034135 1076214852 /nfs/dbraw/zinc/21/48/52/1076214852.db2.gz MZTXCADGFVXBGX-AWEZNQCLSA-N 1 1 361.364 2.932 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC001560077495 1076222603 /nfs/dbraw/zinc/22/26/03/1076222603.db2.gz ODUGDNFBXCDJTP-WFASDCNBSA-N 1 1 354.248 2.883 20 5 FFBDMO CN(CCn1ccc([N+](=O)[O-])n1)C[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001560112751 1076228676 /nfs/dbraw/zinc/22/86/76/1076228676.db2.gz MOUBJGVCXDEQMX-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@H]1CCCCN1Cc1ccccc1 ZINC001560112751 1076228682 /nfs/dbraw/zinc/22/86/82/1076228682.db2.gz MOUBJGVCXDEQMX-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@H]1CCCCN1Cc1ccccc1 ZINC001560112751 1076228686 /nfs/dbraw/zinc/22/86/86/1076228686.db2.gz MOUBJGVCXDEQMX-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CC[N@H+]2CC)c([N+](=O)[O-])cc1OCC ZINC001562067175 1076474053 /nfs/dbraw/zinc/47/40/53/1076474053.db2.gz FDDMGGJTWQVFAM-LBPRGKRZSA-N 1 1 366.418 2.608 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001569328252 1077139657 /nfs/dbraw/zinc/13/96/57/1077139657.db2.gz JIBXABUGOCGGQJ-UHFFFAOYSA-N 1 1 361.442 2.759 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589899445 1080847417 /nfs/dbraw/zinc/84/74/17/1080847417.db2.gz IYOBSNBQIOBGMG-LBPRGKRZSA-N 1 1 368.397 2.544 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000093639087 250039848 /nfs/dbraw/zinc/03/98/48/250039848.db2.gz YBZOQNDGQFZZMT-HIFRSBDPSA-N 1 1 351.447 2.774 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000105008166 250194358 /nfs/dbraw/zinc/19/43/58/250194358.db2.gz BTOMPIKAQYXNQR-LBPRGKRZSA-N 1 1 370.356 2.898 20 5 FFBDMO C[C@H]1SCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H]1C ZINC000118419497 250385110 /nfs/dbraw/zinc/38/51/10/250385110.db2.gz BQEWRORZHSFFTD-NWDGAFQWSA-N 1 1 351.428 2.719 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H](C)[N@H+]1C ZINC000132222460 251057108 /nfs/dbraw/zinc/05/71/08/251057108.db2.gz WXNLNGZHGOVFOX-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H](C)[N@@H+]1C ZINC000132222460 251057111 /nfs/dbraw/zinc/05/71/11/251057111.db2.gz WXNLNGZHGOVFOX-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)[C@@H]2C1 ZINC000272383854 252025286 /nfs/dbraw/zinc/02/52/86/252025286.db2.gz CCDKXXOIKPULTE-BLLLJJGKSA-N 1 1 372.450 2.885 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272569938 252071309 /nfs/dbraw/zinc/07/13/09/252071309.db2.gz TULDXKIZZVSERX-SWLSCSKDSA-N 1 1 368.865 2.772 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272599293 252077379 /nfs/dbraw/zinc/07/73/79/252077379.db2.gz UYINQUMXGHONBC-CYBMUJFWSA-N 1 1 355.385 2.923 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000272934440 252168740 /nfs/dbraw/zinc/16/87/40/252168740.db2.gz LVQKKTJXKMYVFS-GFCCVEGCSA-N 1 1 352.387 2.858 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c([N+](=O)[O-])cc1OC ZINC000273196319 252248454 /nfs/dbraw/zinc/24/84/54/252248454.db2.gz QOCWTWWUSQSPHO-AWEZNQCLSA-N 1 1 366.414 2.587 20 5 FFBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000276321327 256089825 /nfs/dbraw/zinc/08/98/25/256089825.db2.gz YWDCUSAQWDWDJM-SMDDNHRTSA-N 1 1 362.348 2.997 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)ccc1[N+](=O)[O-] ZINC000276900774 256140973 /nfs/dbraw/zinc/14/09/73/256140973.db2.gz LTOLOEDAHQMWRL-OAHLLOKOSA-N 1 1 371.441 2.911 20 5 FFBDMO COC(=O)c1cnc(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000276690045 256122032 /nfs/dbraw/zinc/12/20/32/256122032.db2.gz HBGCPSHNAVSIPV-QWHCGFSZSA-N 1 1 362.430 2.841 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277354684 256188437 /nfs/dbraw/zinc/18/84/37/256188437.db2.gz GERDHQRSYLLNIH-OAHLLOKOSA-N 1 1 364.446 2.834 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])cc2Br)CCCO1 ZINC000277568703 256212518 /nfs/dbraw/zinc/21/25/18/256212518.db2.gz AZWQIWOYENESRC-NSHDSACASA-N 1 1 373.251 2.665 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000278219346 256288706 /nfs/dbraw/zinc/28/87/06/256288706.db2.gz WZDKDMGFXUBTFT-UHFFFAOYSA-N 1 1 371.393 2.747 20 5 FFBDMO C[N@@H+](CCn1cc(Br)c(=O)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000278482723 256317655 /nfs/dbraw/zinc/31/76/55/256317655.db2.gz ADKSFXRPQICZRF-UHFFFAOYSA-N 1 1 366.215 2.651 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(N4CCCC4)nc3)nc2c1 ZINC000278695636 256339234 /nfs/dbraw/zinc/33/92/34/256339234.db2.gz NDVRNJUNBOKHJD-UHFFFAOYSA-N 1 1 352.398 2.756 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000279683103 256441192 /nfs/dbraw/zinc/44/11/92/256441192.db2.gz AOOFZRIUNKMCQG-IAQYHMDHSA-N 1 1 369.824 2.873 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4nc(-c5ccc([N+](=O)[O-])cc5)no4)[C@H]1[C@H]3C2 ZINC000286461484 257038057 /nfs/dbraw/zinc/03/80/57/257038057.db2.gz KKRDMXVILFUFDW-UOYADTOYSA-N 1 1 356.382 2.500 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2ccncc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000289344298 257275691 /nfs/dbraw/zinc/27/56/91/257275691.db2.gz MFOUAUNSBZYIQL-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2ccncc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000289344298 257275692 /nfs/dbraw/zinc/27/56/92/257275692.db2.gz MFOUAUNSBZYIQL-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000289790243 257299646 /nfs/dbraw/zinc/29/96/46/257299646.db2.gz HSOFHAYNGPALPY-CYBMUJFWSA-N 1 1 363.805 2.720 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1F ZINC000294992129 257611501 /nfs/dbraw/zinc/61/15/01/257611501.db2.gz OQAWDBMHSCXAKE-GFCCVEGCSA-N 1 1 353.394 2.689 20 5 FFBDMO COc1cccc([C@H](C)[NH+]2CCN(c3ncc([N+](=O)[O-])c(C)n3)CC2)c1 ZINC000297156103 257795277 /nfs/dbraw/zinc/79/52/77/257795277.db2.gz ONQNZDWZYNTOBY-AWEZNQCLSA-N 1 1 357.414 2.585 20 5 FFBDMO Cc1nn(C)c(C)c1C[NH+]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301066477 258022905 /nfs/dbraw/zinc/02/29/05/258022905.db2.gz AZGQXTBREIEVGN-UHFFFAOYSA-N 1 1 363.849 2.921 20 5 FFBDMO C[N@@H+](CCCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)C1CCCCC1 ZINC000301121378 258026847 /nfs/dbraw/zinc/02/68/47/258026847.db2.gz ZEPVXPIOUPZEHU-UHFFFAOYSA-N 1 1 362.430 2.992 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000301367574 258045113 /nfs/dbraw/zinc/04/51/13/258045113.db2.gz STCLRWFBHMTUAJ-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO Cc1ccnc(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)c1[N+](=O)[O-] ZINC000302069137 258085984 /nfs/dbraw/zinc/08/59/84/258085984.db2.gz XKQQDAAASWNQGZ-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cccc([N+](=O)[O-])c1Br ZINC000317301723 258115770 /nfs/dbraw/zinc/11/57/70/258115770.db2.gz MONWWBKHWFMQLP-MNOVXSKESA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1[NH+]1CCOCC1 ZINC000301544110 258054804 /nfs/dbraw/zinc/05/48/04/258054804.db2.gz DABSSHPIQHBLRV-NHYWBVRUSA-N 1 1 359.348 2.771 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1[NH+]1CCOCC1 ZINC000301544109 258054903 /nfs/dbraw/zinc/05/49/03/258054903.db2.gz DABSSHPIQHBLRV-IAQYHMDHSA-N 1 1 359.348 2.771 20 5 FFBDMO CC[C@H]1CCCC[N@@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301887640 258072903 /nfs/dbraw/zinc/07/29/03/258072903.db2.gz MUNPFFYWBQJLNB-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301887640 258072904 /nfs/dbraw/zinc/07/29/04/258072904.db2.gz MUNPFFYWBQJLNB-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO C[C@@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)[N@H+]1CCc2sccc2C1 ZINC000301914046 258074854 /nfs/dbraw/zinc/07/48/54/258074854.db2.gz HYBMZSHEUKHPHW-NSHDSACASA-N 1 1 358.427 2.558 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@@H]2CC[C@@H](O)C[C@H]2C1 ZINC000332238934 258220809 /nfs/dbraw/zinc/22/08/09/258220809.db2.gz OOBSNOVTJSRJRT-VHRBIJSZSA-N 1 1 355.232 2.950 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757814 258199404 /nfs/dbraw/zinc/19/94/04/258199404.db2.gz BDRCIYKNQRZUME-IHRRRGAJSA-N 1 1 363.462 2.919 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000366841465 512212272 /nfs/dbraw/zinc/21/22/72/512212272.db2.gz ALJQJDZQXBKYPO-HNAYVOBHSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000366841465 512212277 /nfs/dbraw/zinc/21/22/77/512212277.db2.gz ALJQJDZQXBKYPO-HNAYVOBHSA-N 1 1 373.384 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4cn[nH]c4)CC3)n2)cc1 ZINC000377361827 512233739 /nfs/dbraw/zinc/23/37/39/512233739.db2.gz IITBYPDJMLAJOY-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375302868 512257655 /nfs/dbraw/zinc/25/76/55/512257655.db2.gz MCKVVZQBEIIDIF-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375302868 512257659 /nfs/dbraw/zinc/25/76/59/512257659.db2.gz MCKVVZQBEIIDIF-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000375302369 512257881 /nfs/dbraw/zinc/25/78/81/512257881.db2.gz KXHBDQYGQAFBQZ-UHFFFAOYSA-N 1 1 350.325 2.536 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000041577837 506532678 /nfs/dbraw/zinc/53/26/78/506532678.db2.gz UOZMEVPLMKCZRO-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO Cc1cc(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1[N+](=O)[O-] ZINC000041576948 506533750 /nfs/dbraw/zinc/53/37/50/506533750.db2.gz LASKQIBKYORWEI-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)n1 ZINC000054676378 506600990 /nfs/dbraw/zinc/60/09/90/506600990.db2.gz UBODFHDEQSBRRW-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)n1 ZINC000054676378 506601002 /nfs/dbraw/zinc/60/10/02/506601002.db2.gz UBODFHDEQSBRRW-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000008088771 506620922 /nfs/dbraw/zinc/62/09/22/506620922.db2.gz ZQGMPQHDXRZIGH-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043126913 506703711 /nfs/dbraw/zinc/70/37/11/506703711.db2.gz LZECXJHVZRHHQF-HNNXBMFYSA-N 1 1 370.409 2.999 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043341701 506735861 /nfs/dbraw/zinc/73/58/61/506735861.db2.gz ZLSLGLABRXBIRJ-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043341701 506735867 /nfs/dbraw/zinc/73/58/67/506735867.db2.gz ZLSLGLABRXBIRJ-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO COc1ccc(C[N@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067374676 506850281 /nfs/dbraw/zinc/85/02/81/506850281.db2.gz KUAGQJLSRFEIGD-GOSISDBHSA-N 1 1 355.394 2.841 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000067374676 506850284 /nfs/dbraw/zinc/85/02/84/506850284.db2.gz KUAGQJLSRFEIGD-GOSISDBHSA-N 1 1 355.394 2.841 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000067536167 506914793 /nfs/dbraw/zinc/91/47/93/506914793.db2.gz HVKGTMXNOKQCIP-UHFFFAOYSA-N 1 1 374.466 2.726 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000068085440 507104453 /nfs/dbraw/zinc/10/44/53/507104453.db2.gz OXWAEQIICRSNFG-OKILXGFUSA-N 1 1 373.457 2.959 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085440 507104461 /nfs/dbraw/zinc/10/44/61/507104461.db2.gz OXWAEQIICRSNFG-OKILXGFUSA-N 1 1 373.457 2.959 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085440 507104469 /nfs/dbraw/zinc/10/44/69/507104469.db2.gz OXWAEQIICRSNFG-OKILXGFUSA-N 1 1 373.457 2.959 20 5 FFBDMO CC(=O)c1ccc(NC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000046479044 507141828 /nfs/dbraw/zinc/14/18/28/507141828.db2.gz CIAAWACXMVCGFB-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO CC(=O)c1ccc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000046479044 507141832 /nfs/dbraw/zinc/14/18/32/507141832.db2.gz CIAAWACXMVCGFB-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068352531 507197942 /nfs/dbraw/zinc/19/79/42/507197942.db2.gz SDHPHTOANKNQFZ-GFCCVEGCSA-N 1 1 357.838 2.862 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000022498465 507296929 /nfs/dbraw/zinc/29/69/29/507296929.db2.gz CFQXLHWRFZMOAQ-UHFFFAOYSA-N 1 1 369.421 2.708 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)[NH+](C)C ZINC000023694114 507365819 /nfs/dbraw/zinc/36/58/19/507365819.db2.gz WFHQJIQPFZUEGS-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)c2ccccc2C1 ZINC000069090907 507405900 /nfs/dbraw/zinc/40/59/00/507405900.db2.gz QZZCVVQUJGCAFE-CQSZACIVSA-N 1 1 354.410 2.874 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000069090907 507405908 /nfs/dbraw/zinc/40/59/08/507405908.db2.gz QZZCVVQUJGCAFE-CQSZACIVSA-N 1 1 354.410 2.874 20 5 FFBDMO COc1cc(C)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1OC ZINC000026485319 507592912 /nfs/dbraw/zinc/59/29/12/507592912.db2.gz XRTHGZQKJIUKHG-UHFFFAOYSA-N 1 1 372.425 2.638 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000367126098 512350242 /nfs/dbraw/zinc/35/02/42/512350242.db2.gz KQRVQTZJGQVBEH-AWEZNQCLSA-N 1 1 372.400 2.568 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCOc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000029120847 507761910 /nfs/dbraw/zinc/76/19/10/507761910.db2.gz ATSOYYBCPJMLIW-UHFFFAOYSA-N 1 1 361.373 2.708 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCOc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000029120847 507761914 /nfs/dbraw/zinc/76/19/14/507761914.db2.gz ATSOYYBCPJMLIW-UHFFFAOYSA-N 1 1 361.373 2.708 20 5 FFBDMO CCC(CC)[C@H](CNc1nc2sccn2c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000029147583 507762781 /nfs/dbraw/zinc/76/27/81/507762781.db2.gz PERAZNYEDBDUAA-ZDUSSCGKSA-N 1 1 367.475 2.853 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000063722739 507764679 /nfs/dbraw/zinc/76/46/79/507764679.db2.gz AYYXQEZFISNSHZ-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000052247560 507804047 /nfs/dbraw/zinc/80/40/47/507804047.db2.gz SNRPHQMZDZBBLO-AWEZNQCLSA-N 1 1 369.487 2.922 20 5 FFBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000072772027 507851250 /nfs/dbraw/zinc/85/12/50/507851250.db2.gz MXCKZZLWLULZGD-CYBMUJFWSA-N 1 1 357.410 2.765 20 5 FFBDMO CC(=O)c1ccc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643912 507853567 /nfs/dbraw/zinc/85/35/67/507853567.db2.gz LIZOKBMDPBKRFD-ZWKOTPCHSA-N 1 1 369.421 2.845 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCS1 ZINC000072862685 507866135 /nfs/dbraw/zinc/86/61/35/507866135.db2.gz OCABZYKSEHATSX-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000078438226 507871115 /nfs/dbraw/zinc/87/11/15/507871115.db2.gz MPTHXZADSYNXEV-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974868 507879292 /nfs/dbraw/zinc/87/92/92/507879292.db2.gz FQRADVQSLVZYJP-HZPDHXFCSA-N 1 1 374.485 2.780 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000078562483 507883679 /nfs/dbraw/zinc/88/36/79/507883679.db2.gz MCIZSJMCNNQZHD-CQSZACIVSA-N 1 1 360.458 2.655 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](C[C@H]2CCCO2)[C@@H]2CCSC2)cc1 ZINC000089952229 507890433 /nfs/dbraw/zinc/89/04/33/507890433.db2.gz QGMQIWIDYIPIGW-NVXWUHKLSA-N 1 1 352.456 2.960 20 5 FFBDMO CCCO[C@@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000108394642 507892695 /nfs/dbraw/zinc/89/26/95/507892695.db2.gz MEJSIHOWFIRYAS-OAHLLOKOSA-N 1 1 365.430 2.823 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000108394642 507892698 /nfs/dbraw/zinc/89/26/98/507892698.db2.gz MEJSIHOWFIRYAS-OAHLLOKOSA-N 1 1 365.430 2.823 20 5 FFBDMO C[N@@H+](CCCOc1ccc(Cl)cc1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090518862 507924611 /nfs/dbraw/zinc/92/46/11/507924611.db2.gz UZTJISARSQDAPX-UHFFFAOYSA-N 1 1 365.817 2.811 20 5 FFBDMO CC(C)(C)C[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000109747488 507984070 /nfs/dbraw/zinc/98/40/70/507984070.db2.gz XJGHQKCJKBAVCK-UHFFFAOYSA-N 1 1 357.838 2.917 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000074325847 508012433 /nfs/dbraw/zinc/01/24/33/508012433.db2.gz KLPQJQGKXFJDJO-CQSZACIVSA-N 1 1 356.426 2.880 20 5 FFBDMO Cc1cc(N2CCN(CC[N@H+](C)Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000074748095 508052280 /nfs/dbraw/zinc/05/22/80/508052280.db2.gz LCQUNIMLMKJXOW-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000080255401 508057526 /nfs/dbraw/zinc/05/75/26/508057526.db2.gz GNMDIUIWAKWZHN-CYBMUJFWSA-N 1 1 368.397 2.553 20 5 FFBDMO Cc1cc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000080640982 508091134 /nfs/dbraw/zinc/09/11/34/508091134.db2.gz GUILHMVEYBYWKX-AWEZNQCLSA-N 1 1 352.866 2.773 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CCC(C[N@H+](C)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000075639690 508125335 /nfs/dbraw/zinc/12/53/35/508125335.db2.gz NQHXDMYZWDRHQU-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075752833 508132793 /nfs/dbraw/zinc/13/27/93/508132793.db2.gz BQNUUJUJPRPIIS-MNEFBYGVSA-N 1 1 358.442 2.934 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000093280807 508134498 /nfs/dbraw/zinc/13/44/98/508134498.db2.gz NHCORNMBXAXXQY-CQSZACIVSA-N 1 1 350.415 2.885 20 5 FFBDMO Cc1ccc(-c2n[nH]cc2C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000093534285 508148461 /nfs/dbraw/zinc/14/84/61/508148461.db2.gz LDIJPAXMVLXAPM-AWEZNQCLSA-N 1 1 368.397 2.968 20 5 FFBDMO CC[N@@H+](CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])C(C)C ZINC000112079443 508149696 /nfs/dbraw/zinc/14/96/96/508149696.db2.gz TVJRHICVBPQNNC-UHFFFAOYSA-N 1 1 359.430 2.702 20 5 FFBDMO CC(C)OCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000093586873 508150153 /nfs/dbraw/zinc/15/01/53/508150153.db2.gz KPWHBELBFWMFOD-UHFFFAOYSA-N 1 1 373.400 2.739 20 5 FFBDMO CC(C)c1ccc(C[N@H+](CCC(F)(F)F)C[C@H](O)CO)cc1[N+](=O)[O-] ZINC000093814330 508155975 /nfs/dbraw/zinc/15/59/75/508155975.db2.gz IEGMLJOPTVRKRW-ZDUSSCGKSA-N 1 1 364.364 2.826 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](CCC(F)(F)F)C[C@H](O)CO)cc1[N+](=O)[O-] ZINC000093814330 508155978 /nfs/dbraw/zinc/15/59/78/508155978.db2.gz IEGMLJOPTVRKRW-ZDUSSCGKSA-N 1 1 364.364 2.826 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000081570372 508191575 /nfs/dbraw/zinc/19/15/75/508191575.db2.gz ACQZRTRJXQKVBG-ZDUSSCGKSA-N 1 1 368.865 2.850 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)cc1 ZINC000076396450 508200232 /nfs/dbraw/zinc/20/02/32/508200232.db2.gz RPEXUYOQGQIRRT-HNNXBMFYSA-N 1 1 367.409 2.896 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081634875 508200326 /nfs/dbraw/zinc/20/03/26/508200326.db2.gz RCPXTMKWCQEBEZ-MRXNPFEDSA-N 1 1 360.458 2.505 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000112699515 508211015 /nfs/dbraw/zinc/21/10/15/508211015.db2.gz VOPWXPWCNBFZJQ-HNNXBMFYSA-N 1 1 363.458 2.848 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000367204491 512383826 /nfs/dbraw/zinc/38/38/26/512383826.db2.gz DABJWLYUILPJAF-HXUWFJFHSA-N 1 1 368.437 2.940 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2COc2ccccc2)c([N+](=O)[O-])c1 ZINC000112985127 508238043 /nfs/dbraw/zinc/23/80/43/508238043.db2.gz JGZJGVPIZGKDLR-INIZCTEOSA-N 1 1 355.394 2.737 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000076805928 508255413 /nfs/dbraw/zinc/25/54/13/508255413.db2.gz OXYKSAUPQJJPLV-AWEZNQCLSA-N 1 1 357.385 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000114467898 508318745 /nfs/dbraw/zinc/31/87/45/508318745.db2.gz YUFYNVGWXPWFNC-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000114467898 508318747 /nfs/dbraw/zinc/31/87/47/508318747.db2.gz YUFYNVGWXPWFNC-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO COCC[N@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000127135742 508405155 /nfs/dbraw/zinc/40/51/55/508405155.db2.gz BLXFGHIHBURRHP-UHFFFAOYSA-N 1 1 352.309 2.623 20 5 FFBDMO COCC[N@@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000127135742 508405158 /nfs/dbraw/zinc/40/51/58/508405158.db2.gz BLXFGHIHBURRHP-UHFFFAOYSA-N 1 1 352.309 2.623 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121859620 508434409 /nfs/dbraw/zinc/43/44/09/508434409.db2.gz YRFMJEAGCWRCAT-YGRLFVJLSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000116163517 508480757 /nfs/dbraw/zinc/48/07/57/508480757.db2.gz BALUMBFQKDXASZ-KRWDZBQOSA-N 1 1 369.421 2.909 20 5 FFBDMO Cc1c(CC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134078562 508489547 /nfs/dbraw/zinc/48/95/47/508489547.db2.gz XWBPAHZHUKUXKQ-APWZRJJASA-N 1 1 357.454 2.921 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134205987 508507394 /nfs/dbraw/zinc/50/73/94/508507394.db2.gz DYKZRTWQGLQAKX-ACJLOTCBSA-N 1 1 355.394 2.857 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134205987 508507397 /nfs/dbraw/zinc/50/73/97/508507397.db2.gz DYKZRTWQGLQAKX-ACJLOTCBSA-N 1 1 355.394 2.857 20 5 FFBDMO COC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCCC1 ZINC000134247571 508513422 /nfs/dbraw/zinc/51/34/22/508513422.db2.gz JBTXILBDFADJPE-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO NC(=O)[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000157175010 508532851 /nfs/dbraw/zinc/53/28/51/508532851.db2.gz RHTWXPAMMXBTEK-CYBMUJFWSA-N 1 1 359.357 2.833 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153357203 508575251 /nfs/dbraw/zinc/57/52/51/508575251.db2.gz QHYJHEWHLGACIJ-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153357203 508575255 /nfs/dbraw/zinc/57/52/55/508575255.db2.gz QHYJHEWHLGACIJ-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000122852911 508597030 /nfs/dbraw/zinc/59/70/30/508597030.db2.gz ARXPRQLCHVBUEH-ZBFHGGJFSA-N 1 1 356.426 2.704 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128645516 508622931 /nfs/dbraw/zinc/62/29/31/508622931.db2.gz WOBIERHCDFMCNP-ZDUSSCGKSA-N 1 1 353.394 2.811 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000119057940 508716437 /nfs/dbraw/zinc/71/64/37/508716437.db2.gz WTCRCVMXJQKHFU-CYBMUJFWSA-N 1 1 359.430 2.754 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137431550 508756145 /nfs/dbraw/zinc/75/61/45/508756145.db2.gz YVMAOMFZVKPBQA-DOMZBBRYSA-N 1 1 372.400 2.709 20 5 FFBDMO CC1CC[NH+]([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000137884003 508766578 /nfs/dbraw/zinc/76/65/78/508766578.db2.gz ZLDGQRPLRXWVOJ-OAHLLOKOSA-N 1 1 357.414 2.521 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000138259291 508771626 /nfs/dbraw/zinc/77/16/26/508771626.db2.gz YXIPDVNOKWTSOC-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000130000385 508786775 /nfs/dbraw/zinc/78/67/75/508786775.db2.gz ULCCJJBTRPFZGE-UHFFFAOYSA-N 1 1 371.441 2.910 20 5 FFBDMO COc1cc(N(C)CC(C)(C)C[NH+]2CCOCC2)c([N+](=O)[O-])cc1F ZINC000130149441 508799668 /nfs/dbraw/zinc/79/96/68/508799668.db2.gz HHHHRDHWRLQOMA-UHFFFAOYSA-N 1 1 355.410 2.537 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCn2ccnc2)c([N+](=O)[O-])cc1OC(F)F ZINC000124304098 508812568 /nfs/dbraw/zinc/81/25/68/508812568.db2.gz RGTQOYCHHIXYJN-UHFFFAOYSA-N 1 1 370.356 2.923 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000119532952 508813949 /nfs/dbraw/zinc/81/39/49/508813949.db2.gz ZOSIHJPEXJGQDK-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000124347225 508819199 /nfs/dbraw/zinc/81/91/99/508819199.db2.gz RQDJBZULLPNUTG-UHFFFAOYSA-N 1 1 365.393 2.733 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150804664 508896804 /nfs/dbraw/zinc/89/68/04/508896804.db2.gz VNAWACPNCUUOTC-MRXNPFEDSA-N 1 1 360.458 2.650 20 5 FFBDMO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000131378531 508923175 /nfs/dbraw/zinc/92/31/75/508923175.db2.gz IQLNCBIONWLVBB-OAHLLOKOSA-N 1 1 359.382 2.770 20 5 FFBDMO COCc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000131378531 508923179 /nfs/dbraw/zinc/92/31/79/508923179.db2.gz IQLNCBIONWLVBB-OAHLLOKOSA-N 1 1 359.382 2.770 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125257127 508956419 /nfs/dbraw/zinc/95/64/19/508956419.db2.gz FKVCWPLYQLQRDL-APWZRJJASA-N 1 1 372.469 2.796 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](Oc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000131802134 508970999 /nfs/dbraw/zinc/97/09/99/508970999.db2.gz ZGDXOVSAERBZHL-INIZCTEOSA-N 1 1 359.382 2.531 20 5 FFBDMO O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000160333307 508971864 /nfs/dbraw/zinc/97/18/64/508971864.db2.gz WDZGCADVJJOQNY-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000155540670 509022102 /nfs/dbraw/zinc/02/21/02/509022102.db2.gz BUAWCHMKOYZQTH-HOTGVXAUSA-N 1 1 363.461 2.706 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000155599762 509035019 /nfs/dbraw/zinc/03/50/19/509035019.db2.gz IWOGOPDOCXJNGW-ZBFHGGJFSA-N 1 1 360.458 2.654 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000155627022 509040611 /nfs/dbraw/zinc/04/06/11/509040611.db2.gz BAXYQSVNBFRLIY-LBPRGKRZSA-N 1 1 357.357 2.544 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000155627022 509040616 /nfs/dbraw/zinc/04/06/16/509040616.db2.gz BAXYQSVNBFRLIY-LBPRGKRZSA-N 1 1 357.357 2.544 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704065 509048487 /nfs/dbraw/zinc/04/84/87/509048487.db2.gz TXLLIBZEKBYGHF-JKSUJKDBSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704065 509048488 /nfs/dbraw/zinc/04/84/88/509048488.db2.gz TXLLIBZEKBYGHF-JKSUJKDBSA-N 1 1 365.430 2.677 20 5 FFBDMO CC(C)(C)[N@H+](Cc1ccc(F)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000132775717 509073366 /nfs/dbraw/zinc/07/33/66/509073366.db2.gz DOTWZZBCOXXNMR-MRXNPFEDSA-N 1 1 350.394 2.592 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000120837848 509073690 /nfs/dbraw/zinc/07/36/90/509073690.db2.gz ZMADWKHRMDXPCG-UHFFFAOYSA-N 1 1 364.446 2.522 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000133214116 509133047 /nfs/dbraw/zinc/13/30/47/509133047.db2.gz MXJQNUWRXBAYMT-HNNXBMFYSA-N 1 1 358.442 2.753 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1 ZINC000172788105 509236377 /nfs/dbraw/zinc/23/63/77/509236377.db2.gz BSRGAWGDDGTNRZ-OAHLLOKOSA-N 1 1 362.474 2.901 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000217214728 509267627 /nfs/dbraw/zinc/26/76/27/509267627.db2.gz BPKRHJBPGNVKRD-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000176009552 509270656 /nfs/dbraw/zinc/27/06/56/509270656.db2.gz MBTURBLSCHOODY-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000179132803 509279516 /nfs/dbraw/zinc/27/95/16/509279516.db2.gz RYKUPPNLPHJJEU-MOPGFXCFSA-N 1 1 368.437 2.882 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC)Cc2ccc(C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000179166771 509299551 /nfs/dbraw/zinc/29/95/51/509299551.db2.gz MAYDKLVCUHVPDO-UHFFFAOYSA-N 1 1 359.430 2.604 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000185719558 509323369 /nfs/dbraw/zinc/32/33/69/509323369.db2.gz CXMZWUNPSHEECM-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000185719558 509323375 /nfs/dbraw/zinc/32/33/75/509323375.db2.gz CXMZWUNPSHEECM-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000185719558 509323382 /nfs/dbraw/zinc/32/33/82/509323382.db2.gz CXMZWUNPSHEECM-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO C[C@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766411 509345660 /nfs/dbraw/zinc/34/56/60/509345660.db2.gz QYARXUCIYQMNAB-JKSUJKDBSA-N 1 1 374.485 2.800 20 5 FFBDMO C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182841568 509454881 /nfs/dbraw/zinc/45/48/81/509454881.db2.gz VNFJQGBDRFUPQC-NWDGAFQWSA-N 1 1 364.421 2.699 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186013129 509478904 /nfs/dbraw/zinc/47/89/04/509478904.db2.gz NRTMMNYWPMHBNV-AWEZNQCLSA-N 1 1 354.838 2.874 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000264374017 509488644 /nfs/dbraw/zinc/48/86/44/509488644.db2.gz DCNMCKJSZFXKHP-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183018810 509550123 /nfs/dbraw/zinc/55/01/23/509550123.db2.gz OKONZCAESCBHFO-VXGBXAGGSA-N 1 1 373.500 2.588 20 5 FFBDMO COc1cc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000267670812 509591153 /nfs/dbraw/zinc/59/11/53/509591153.db2.gz OBYZXTYVIXESKL-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192823685 509658889 /nfs/dbraw/zinc/65/88/89/509658889.db2.gz DIVNSLQBRXHOEZ-JXFKEZNVSA-N 1 1 360.502 2.835 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)C1CC1 ZINC000186415810 509699362 /nfs/dbraw/zinc/69/93/62/509699362.db2.gz ZKRGZZWZHMPFGB-INIZCTEOSA-N 1 1 366.425 2.960 20 5 FFBDMO CN1CCN(CCC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180018288 509711670 /nfs/dbraw/zinc/71/16/70/509711670.db2.gz YCCJKFILROMMDA-OAQYLSRUSA-N 1 1 368.481 2.911 20 5 FFBDMO C[N@H+](CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189723320 509720967 /nfs/dbraw/zinc/72/09/67/509720967.db2.gz XJKOVCKJZWNXSC-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)Cc1ccccc1 ZINC000189723320 509720973 /nfs/dbraw/zinc/72/09/73/509720973.db2.gz XJKOVCKJZWNXSC-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO CC1(C2CC[NH+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC2)OCCO1 ZINC000268101911 509755069 /nfs/dbraw/zinc/75/50/69/509755069.db2.gz KVUARHWSEJZCEC-UHFFFAOYSA-N 1 1 374.397 2.620 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177011094 509817756 /nfs/dbraw/zinc/81/77/56/509817756.db2.gz AMFUSPSGNCNLQE-SNVBAGLBSA-N 1 1 368.231 2.571 20 5 FFBDMO O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000238120178 509823951 /nfs/dbraw/zinc/82/39/51/509823951.db2.gz SSWLKEYAWBEIRJ-MVHVFESUSA-N 1 1 367.449 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1/C=C/CNC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000238120178 509823956 /nfs/dbraw/zinc/82/39/56/509823956.db2.gz SSWLKEYAWBEIRJ-MVHVFESUSA-N 1 1 367.449 2.617 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000189952222 509849674 /nfs/dbraw/zinc/84/96/74/509849674.db2.gz LREYSRGJQDMBAE-HZPDHXFCSA-N 1 1 357.458 2.538 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000253542020 509889289 /nfs/dbraw/zinc/88/92/89/509889289.db2.gz IKLDQANEDPJOKK-OLZOCXBDSA-N 1 1 372.425 2.699 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000253544381 509891972 /nfs/dbraw/zinc/89/19/72/509891972.db2.gz IXYKFMQSHJIWOB-YVEFUNNKSA-N 1 1 372.425 2.651 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177194396 509931239 /nfs/dbraw/zinc/93/12/39/509931239.db2.gz CQXTYVFYLUJIET-DOTOQJQBSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@@H]2CCCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177194396 509931246 /nfs/dbraw/zinc/93/12/46/509931246.db2.gz CQXTYVFYLUJIET-DOTOQJQBSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)NCc1cccc([N+](=O)[O-])c1 ZINC000171168774 509982817 /nfs/dbraw/zinc/98/28/17/509982817.db2.gz HFVYQIOQTSDCBX-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)NCc1cccc([N+](=O)[O-])c1 ZINC000171168774 509982822 /nfs/dbraw/zinc/98/28/22/509982822.db2.gz HFVYQIOQTSDCBX-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1Br)C1CC1 ZINC000180558281 509983717 /nfs/dbraw/zinc/98/37/17/509983717.db2.gz NHBSJQLBBOPSFZ-UHFFFAOYSA-N 1 1 356.220 2.571 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000174184744 509989523 /nfs/dbraw/zinc/98/95/23/509989523.db2.gz QEFSZUAFWIXEKZ-OAHLLOKOSA-N 1 1 364.446 2.619 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)OCCO1 ZINC000183843026 510001979 /nfs/dbraw/zinc/00/19/79/510001979.db2.gz GSRCKXNDFNHXTN-AWEZNQCLSA-N 1 1 374.397 2.620 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)OCCO1 ZINC000183868999 510013956 /nfs/dbraw/zinc/01/39/56/510013956.db2.gz CLXATWOGVXYSOQ-CQSZACIVSA-N 1 1 374.397 2.620 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1C[C@H](C)O ZINC000245577559 510019064 /nfs/dbraw/zinc/01/90/64/510019064.db2.gz GTESIBBZRWAMNC-ZFWWWQNUSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@@]([NH2+]CCOc1ccccc1[N+](=O)[O-])(C(N)=O)c1cccc(Cl)c1 ZINC000177414455 510045462 /nfs/dbraw/zinc/04/54/62/510045462.db2.gz OOGJIMMWBZCNQA-KRWDZBQOSA-N 1 1 363.801 2.617 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000193772854 510062286 /nfs/dbraw/zinc/06/22/86/510062286.db2.gz PWXGWGOHBONKCU-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265492893 510083162 /nfs/dbraw/zinc/08/31/62/510083162.db2.gz NMVVJNZLVUJTEC-LBPRGKRZSA-N 1 1 373.413 2.533 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261863047 510094003 /nfs/dbraw/zinc/09/40/03/510094003.db2.gz WQUDMJXRZMISPB-DYVFJYSZSA-N 1 1 372.450 2.644 20 5 FFBDMO C[C@@H](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000174411969 510102324 /nfs/dbraw/zinc/10/23/24/510102324.db2.gz WYSKSCKYXYMFIC-ZDUSSCGKSA-N 1 1 374.416 2.957 20 5 FFBDMO COc1cc(C[N@H+](CCO)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000180845214 510141309 /nfs/dbraw/zinc/14/13/09/510141309.db2.gz GMJHUHUAMRFVSB-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1cc(C[N@@H+](CCO)Cc2ccc(C)cc2)c([N+](=O)[O-])cc1OC ZINC000180845214 510141316 /nfs/dbraw/zinc/14/13/16/510141316.db2.gz GMJHUHUAMRFVSB-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC[C@@H](C)C1 ZINC000190479562 510153809 /nfs/dbraw/zinc/15/38/09/510153809.db2.gz GQJUDVJYCQLXFY-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](C[C@@H]1CCCO1)[C@H]1CCSC1 ZINC000245995768 510241874 /nfs/dbraw/zinc/24/18/74/510241874.db2.gz XNJRZFVBNBUUJQ-GJZGRUSLSA-N 1 1 352.456 2.960 20 5 FFBDMO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174735668 510281350 /nfs/dbraw/zinc/28/13/50/510281350.db2.gz RIBGCXSIPQSHMR-INIZCTEOSA-N 1 1 352.822 2.716 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCCC[NH+]1CCOCC1 ZINC000171950721 510467563 /nfs/dbraw/zinc/46/75/63/510467563.db2.gz WATVYDYVYQVKJE-UHFFFAOYSA-N 1 1 369.849 2.709 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000175224800 510538863 /nfs/dbraw/zinc/53/88/63/510538863.db2.gz FIXIXTAIOJORGC-MRXNPFEDSA-N 1 1 363.458 2.538 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000175224800 510538865 /nfs/dbraw/zinc/53/88/65/510538865.db2.gz FIXIXTAIOJORGC-MRXNPFEDSA-N 1 1 363.458 2.538 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172109841 510548203 /nfs/dbraw/zinc/54/82/03/510548203.db2.gz GVZFEKUFPWHYBJ-LLVKDONJSA-N 1 1 350.806 2.748 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000172109837 510548758 /nfs/dbraw/zinc/54/87/58/510548758.db2.gz GVZFEKUFPWHYBJ-NSHDSACASA-N 1 1 350.806 2.748 20 5 FFBDMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2(CCCCC2)C1 ZINC000178402057 510584696 /nfs/dbraw/zinc/58/46/96/510584696.db2.gz FBLRQVHENWMFTJ-UHFFFAOYSA-N 1 1 361.442 2.912 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000188107057 510596980 /nfs/dbraw/zinc/59/69/80/510596980.db2.gz FDXQCXFTKCLNTQ-GUYCJALGSA-N 1 1 372.425 2.626 20 5 FFBDMO CC(C)N(C)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000191383789 510633001 /nfs/dbraw/zinc/63/30/01/510633001.db2.gz FNUZEGNGKXLXQQ-INIZCTEOSA-N 1 1 370.457 2.916 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931925 510666627 /nfs/dbraw/zinc/66/66/27/510666627.db2.gz PFQSUCAYYYMJLK-HUUCEWRRSA-N 1 1 372.512 2.975 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931925 510666632 /nfs/dbraw/zinc/66/66/32/510666632.db2.gz PFQSUCAYYYMJLK-HUUCEWRRSA-N 1 1 372.512 2.975 20 5 FFBDMO COC(=O)c1ccc(F)c(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000182006444 510703955 /nfs/dbraw/zinc/70/39/55/510703955.db2.gz CYYRNNABRRJPLU-AWEZNQCLSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(F)c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000182006444 510703959 /nfs/dbraw/zinc/70/39/59/510703959.db2.gz CYYRNNABRRJPLU-AWEZNQCLSA-N 1 1 374.372 2.602 20 5 FFBDMO O=C(C[NH+]1CCC(OC2CCCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000195324376 510785130 /nfs/dbraw/zinc/78/51/30/510785130.db2.gz YFLZEWFOBMJFMB-UHFFFAOYSA-N 1 1 373.453 2.908 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCO1 ZINC000178857133 510806771 /nfs/dbraw/zinc/80/67/71/510806771.db2.gz LMFUQBCREJBPLI-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCO1 ZINC000178857133 510806774 /nfs/dbraw/zinc/80/67/74/510806774.db2.gz LMFUQBCREJBPLI-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000172596966 510812715 /nfs/dbraw/zinc/81/27/15/510812715.db2.gz LSPNYEPTYXPNNE-CQSZACIVSA-N 1 1 374.466 2.597 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000247267792 510854942 /nfs/dbraw/zinc/85/49/42/510854942.db2.gz FIQCKGSRMPODET-HEHGZKQESA-N 1 1 351.472 2.874 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+]C(C)(C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000285494655 510928663 /nfs/dbraw/zinc/92/86/63/510928663.db2.gz CIHAXNAEZIJEHT-UHFFFAOYSA-N 1 1 362.386 2.672 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1 ZINC000277737115 510971257 /nfs/dbraw/zinc/97/12/57/510971257.db2.gz KLKWETBLMHHZSK-IUODEOHRSA-N 1 1 362.348 2.999 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000294246435 511003473 /nfs/dbraw/zinc/00/34/73/511003473.db2.gz SHTUHLILXRTRKW-INIZCTEOSA-N 1 1 353.369 2.631 20 5 FFBDMO CC[N@@H+](CCCO)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000271175447 511107107 /nfs/dbraw/zinc/10/71/07/511107107.db2.gz FPNNRYYIOMGCQV-UHFFFAOYSA-N 1 1 366.336 2.749 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000271177403 511109432 /nfs/dbraw/zinc/10/94/32/511109432.db2.gz GDPXAPCMWLFODJ-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO CS(=O)(=O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000282785227 511110369 /nfs/dbraw/zinc/11/03/69/511110369.db2.gz QRXRZSYHUJJMMQ-OAHLLOKOSA-N 1 1 366.464 2.942 20 5 FFBDMO CS(=O)(=O)[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000282785227 511110375 /nfs/dbraw/zinc/11/03/75/511110375.db2.gz QRXRZSYHUJJMMQ-OAHLLOKOSA-N 1 1 366.464 2.942 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000289977372 511124505 /nfs/dbraw/zinc/12/45/05/511124505.db2.gz ZLYJMHXQUCKMMP-MRXNPFEDSA-N 1 1 364.446 2.516 20 5 FFBDMO C[C@@H](NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000279627749 511151773 /nfs/dbraw/zinc/15/17/73/511151773.db2.gz IGNVYBXIAGSCSL-SNVBAGLBSA-N 1 1 355.797 2.696 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCn2cccc2[C@H]1C ZINC000298083991 511169622 /nfs/dbraw/zinc/16/96/22/511169622.db2.gz JWWDSEJNNBVNQY-CYBMUJFWSA-N 1 1 358.398 2.810 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000362390241 511184943 /nfs/dbraw/zinc/18/49/43/511184943.db2.gz UBMSUHNAWKJXIH-SJORKVTESA-N 1 1 372.469 2.554 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000362390238 511185253 /nfs/dbraw/zinc/18/52/53/511185253.db2.gz UBMSUHNAWKJXIH-DLBZAZTESA-N 1 1 372.469 2.554 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000364985036 511191846 /nfs/dbraw/zinc/19/18/46/511191846.db2.gz IHCUZBOQSZDHKH-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000294964769 511236735 /nfs/dbraw/zinc/23/67/35/511236735.db2.gz PRKLQVXGHXKSJH-LBPRGKRZSA-N 1 1 353.394 2.737 20 5 FFBDMO C[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000271569675 511248246 /nfs/dbraw/zinc/24/82/46/511248246.db2.gz BNRCLNZIYDDQGT-LLVKDONJSA-N 1 1 361.489 2.594 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000295078321 511274195 /nfs/dbraw/zinc/27/41/95/511274195.db2.gz WOUBJMBMGKXXRT-DOTOQJQBSA-N 1 1 359.426 2.500 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+](C2CC2)C1 ZINC000295382125 511385532 /nfs/dbraw/zinc/38/55/32/511385532.db2.gz PPJZSYMHPSSCEL-NSHDSACASA-N 1 1 369.368 2.753 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000272035607 511407922 /nfs/dbraw/zinc/40/79/22/511407922.db2.gz NVDGJFIAZQOWSC-CYBMUJFWSA-N 1 1 359.430 2.692 20 5 FFBDMO C[C@H]1OCC[C@@]12C[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)CCO2 ZINC000280334814 511425847 /nfs/dbraw/zinc/42/58/47/511425847.db2.gz HMOSARWONYKYLZ-AUUYWEPGSA-N 1 1 373.409 2.672 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)C2)C1 ZINC000292106802 511468279 /nfs/dbraw/zinc/46/82/79/511468279.db2.gz IOXSROHFCFGVOS-HNNXBMFYSA-N 1 1 354.248 2.885 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000295667271 511475853 /nfs/dbraw/zinc/47/58/53/511475853.db2.gz IVHDXAQAGNVRTL-AWEZNQCLSA-N 1 1 361.442 2.939 20 5 FFBDMO COc1ccc(CNC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000292144901 511482259 /nfs/dbraw/zinc/48/22/59/511482259.db2.gz MWWQHSVXHDSCDJ-UHFFFAOYSA-N 1 1 357.410 2.745 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000363416268 511536502 /nfs/dbraw/zinc/53/65/02/511536502.db2.gz BHAQXWSBQOZYKC-AEFFLSMTSA-N 1 1 360.458 2.844 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292352548 511563293 /nfs/dbraw/zinc/56/32/93/511563293.db2.gz PVJLRUUBTMIGRR-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C2CC2)O1 ZINC000280743857 511585047 /nfs/dbraw/zinc/58/50/47/511585047.db2.gz ZYYAGUAIMYYLQU-SCLBCKFNSA-N 1 1 356.426 2.995 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C2CC2)O1 ZINC000280743857 511585044 /nfs/dbraw/zinc/58/50/44/511585044.db2.gz ZYYAGUAIMYYLQU-SCLBCKFNSA-N 1 1 356.426 2.995 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(c3ncc([N+](=O)[O-])cc3Br)C2)C1 ZINC000292691253 511686942 /nfs/dbraw/zinc/68/69/42/511686942.db2.gz FMBSZBCPZNNDKN-CQSZACIVSA-N 1 1 355.236 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](CN3CCOCC3)C2)c1 ZINC000292729371 511701249 /nfs/dbraw/zinc/70/12/49/511701249.db2.gz GLMGYTXJXUTISF-ZDUSSCGKSA-N 1 1 373.375 2.768 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)c1 ZINC000292729371 511701251 /nfs/dbraw/zinc/70/12/51/511701251.db2.gz GLMGYTXJXUTISF-ZDUSSCGKSA-N 1 1 373.375 2.768 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000284452002 511728074 /nfs/dbraw/zinc/72/80/74/511728074.db2.gz RBTHUKZCYIZYGP-AWEZNQCLSA-N 1 1 372.400 2.663 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000303511240 511739502 /nfs/dbraw/zinc/73/95/02/511739502.db2.gz BNIXTSVMSHLRBT-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@@H]2C1 ZINC000284521964 511757649 /nfs/dbraw/zinc/75/76/49/511757649.db2.gz FPXOQCPTWFDTIP-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO NC(=O)c1ccc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311246233 511776059 /nfs/dbraw/zinc/77/60/59/511776059.db2.gz HQSXGEWNZXAWLE-INIZCTEOSA-N 1 1 354.410 2.770 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)n1 ZINC000312597582 511785943 /nfs/dbraw/zinc/78/59/43/511785943.db2.gz FIHSRZPESIZCOC-HIFRSBDPSA-N 1 1 370.409 2.851 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000296549026 511792304 /nfs/dbraw/zinc/79/23/04/511792304.db2.gz BSYJSRBGEBBHKR-QGZVFWFLSA-N 1 1 359.426 2.691 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281334913 511808170 /nfs/dbraw/zinc/80/81/70/511808170.db2.gz UIMXDIDYNTZHHA-CQSZACIVSA-N 1 1 360.414 2.630 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293387286 511945705 /nfs/dbraw/zinc/94/57/05/511945705.db2.gz GREZKZGGSHHGMB-LBPRGKRZSA-N 1 1 359.348 2.962 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293387286 511945710 /nfs/dbraw/zinc/94/57/10/511945710.db2.gz GREZKZGGSHHGMB-LBPRGKRZSA-N 1 1 359.348 2.962 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000281912228 512008607 /nfs/dbraw/zinc/00/86/07/512008607.db2.gz JACLQGLKSQJNNC-BBRMVZONSA-N 1 1 362.430 2.942 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNc3ncc([N+](=O)[O-])c(C)n3)CC2)oc1C ZINC000297136194 512033127 /nfs/dbraw/zinc/03/31/27/512033127.db2.gz NIOGKQGONKBNKF-UHFFFAOYSA-N 1 1 360.418 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC3(CCOCC3)CC2)cc1 ZINC000364264615 512054190 /nfs/dbraw/zinc/05/41/90/512054190.db2.gz RNWGWPZTWPADLA-UHFFFAOYSA-N 1 1 350.415 2.635 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000360037880 512065337 /nfs/dbraw/zinc/06/53/37/512065337.db2.gz SEHBFYYRSKOHCV-GDBMZVCRSA-N 1 1 371.397 2.521 20 5 FFBDMO CC(C)C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCc2cccnc21 ZINC000364342920 512094300 /nfs/dbraw/zinc/09/43/00/512094300.db2.gz WAMBOEGQVRLGSA-ROUUACIJSA-N 1 1 373.457 2.583 20 5 FFBDMO O=C(CC[N@@H+]1CCOC[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411306227 512573387 /nfs/dbraw/zinc/57/33/87/512573387.db2.gz YQJTYZKLVSTKFZ-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411306227 512573392 /nfs/dbraw/zinc/57/33/92/512573392.db2.gz YQJTYZKLVSTKFZ-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(c4cn[nH]c4)CC3)o2)cc1 ZINC000373987959 512607855 /nfs/dbraw/zinc/60/78/55/512607855.db2.gz NQELXYAZUKSTLV-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](CCO)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000411402689 512618799 /nfs/dbraw/zinc/61/87/99/512618799.db2.gz UKAVYBLRXCIFPH-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000376328384 512770432 /nfs/dbraw/zinc/77/04/32/512770432.db2.gz RWNPPQKYHJZSSZ-INIZCTEOSA-N 1 1 360.458 2.796 20 5 FFBDMO CN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000376402203 512803262 /nfs/dbraw/zinc/80/32/62/512803262.db2.gz HEDNCWBXDOZRKF-ONXXMXGDSA-N 1 1 370.409 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)n2)cc1 ZINC000411933584 512879690 /nfs/dbraw/zinc/87/96/90/512879690.db2.gz GVEGQKPGNXTNNG-DLBZAZTESA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@@H](O)C[C@@H]3c3ccccc3)n2)cc1 ZINC000411933584 512879693 /nfs/dbraw/zinc/87/96/93/512879693.db2.gz GVEGQKPGNXTNNG-DLBZAZTESA-N 1 1 366.377 2.953 20 5 FFBDMO C[C@@H](C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000411996280 512907264 /nfs/dbraw/zinc/90/72/64/512907264.db2.gz GEQJXDHFJOITQK-TUAOUCFPSA-N 1 1 358.402 2.580 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000368364991 512914959 /nfs/dbraw/zinc/91/49/59/512914959.db2.gz OORUGWSGCSLVBP-MAUKXSAKSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000368364991 512914961 /nfs/dbraw/zinc/91/49/61/512914961.db2.gz OORUGWSGCSLVBP-MAUKXSAKSA-N 1 1 357.410 2.813 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062529 512938063 /nfs/dbraw/zinc/93/80/63/512938063.db2.gz ASDYPLZYKSHJOQ-MNOVXSKESA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062529 512938067 /nfs/dbraw/zinc/93/80/67/512938067.db2.gz ASDYPLZYKSHJOQ-MNOVXSKESA-N 1 1 360.357 2.798 20 5 FFBDMO CCOC(=O)c1ccnc(N2CCC(n3c[nH+]cc3C)CC2)c1[N+](=O)[O-] ZINC000376742964 512968062 /nfs/dbraw/zinc/96/80/62/512968062.db2.gz RGAPGMHQUDGJLB-UHFFFAOYSA-N 1 1 359.386 2.513 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412151643 512978374 /nfs/dbraw/zinc/97/83/74/512978374.db2.gz DFQKEOUPQASMBC-AYOQOUSVSA-N 1 1 357.454 2.889 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C ZINC000408003326 512982479 /nfs/dbraw/zinc/98/24/79/512982479.db2.gz DZSIQOLWKVYIFY-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000408003326 512982484 /nfs/dbraw/zinc/98/24/84/512982484.db2.gz DZSIQOLWKVYIFY-UWVGGRQHSA-N 1 1 370.247 2.830 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000412214344 513000209 /nfs/dbraw/zinc/00/02/09/513000209.db2.gz GHQYQPGQECJZFR-YRPNKDGESA-N 1 1 365.433 2.912 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000372715912 513012230 /nfs/dbraw/zinc/01/22/30/513012230.db2.gz NURPOKRIEMTQCY-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000372715912 513012233 /nfs/dbraw/zinc/01/22/33/513012233.db2.gz NURPOKRIEMTQCY-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)nc2c1 ZINC000374898553 513061513 /nfs/dbraw/zinc/06/15/13/513061513.db2.gz ODWFQCAURHCSKF-SFHVURJKSA-N 1 1 357.341 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)nc2c1 ZINC000374898553 513061519 /nfs/dbraw/zinc/06/15/19/513061519.db2.gz ODWFQCAURHCSKF-SFHVURJKSA-N 1 1 357.341 2.969 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000374918555 513072235 /nfs/dbraw/zinc/07/22/35/513072235.db2.gz SJQHOKSZOQACML-BLLLJJGKSA-N 1 1 372.450 2.885 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@H]2C1 ZINC000374918556 513072814 /nfs/dbraw/zinc/07/28/14/513072814.db2.gz SJQHOKSZOQACML-LRDDRELGSA-N 1 1 372.450 2.885 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)C1 ZINC000439883651 513203515 /nfs/dbraw/zinc/20/35/15/513203515.db2.gz PVYIJTMXTQJAQM-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@H]1CCCC[N@@H+]1CCO ZINC000450621485 513277107 /nfs/dbraw/zinc/27/71/07/513277107.db2.gz XFDFUPWJPNPLGP-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000429140479 513289203 /nfs/dbraw/zinc/28/92/03/513289203.db2.gz ZLRRLQCJKISWIF-HOCLYGCPSA-N 1 1 358.394 2.618 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1nnc(-c2ccco2)o1)c1ccccc1[N+](=O)[O-] ZINC000429244712 513315076 /nfs/dbraw/zinc/31/50/76/513315076.db2.gz MFVRGCUAVKNICZ-UHFFFAOYSA-N 1 1 371.353 2.701 20 5 FFBDMO Cc1ccc2nc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])cc(=O)n2c1 ZINC000429246025 513315219 /nfs/dbraw/zinc/31/52/19/513315219.db2.gz MOEXJAZQMQXMOH-UHFFFAOYSA-N 1 1 352.394 2.936 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425016808 513373314 /nfs/dbraw/zinc/37/33/14/513373314.db2.gz XSJXPGMAPAYFDA-MAUKXSAKSA-N 1 1 366.421 2.524 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000421710157 513381908 /nfs/dbraw/zinc/38/19/08/513381908.db2.gz JDBMOWFXVOQDKS-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000425056743 513394471 /nfs/dbraw/zinc/39/44/71/513394471.db2.gz KPVSTLHUPGUVNS-TYNCELHUSA-N 1 1 367.833 2.568 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 ZINC000413034541 513397001 /nfs/dbraw/zinc/39/70/01/513397001.db2.gz BHLMKVMSHFHMIZ-PHIMTYICSA-N 1 1 362.352 2.920 20 5 FFBDMO CCOc1cc(NC(C)(C)CN2CC[NH+](CC)CC2)ccc1[N+](=O)[O-] ZINC000450925297 513406752 /nfs/dbraw/zinc/40/67/52/513406752.db2.gz XWUHNYFSODDNIS-UHFFFAOYSA-N 1 1 350.463 2.822 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000429723306 513451756 /nfs/dbraw/zinc/45/17/56/513451756.db2.gz JUPRJYHZNJAMIZ-CQSZACIVSA-N 1 1 371.441 2.964 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441278844 513528765 /nfs/dbraw/zinc/52/87/65/513528765.db2.gz QNMHCIQVVVQVII-XHSDSOJGSA-N 1 1 361.442 2.979 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425390980 513540113 /nfs/dbraw/zinc/54/01/13/513540113.db2.gz CRYBDJPVUPOBIV-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425390980 513540119 /nfs/dbraw/zinc/54/01/19/513540119.db2.gz CRYBDJPVUPOBIV-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c1 ZINC000451311863 513669889 /nfs/dbraw/zinc/66/98/89/513669889.db2.gz ZHNTWAOGJUNOOE-DJSGYFEHSA-N 1 1 374.359 2.975 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000448080291 513670769 /nfs/dbraw/zinc/67/07/69/513670769.db2.gz LXYDLAGVAIYIKR-HNNXBMFYSA-N 1 1 350.419 2.845 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451340827 513686432 /nfs/dbraw/zinc/68/64/32/513686432.db2.gz KJIZTYLGQCPKFA-KYJSFNMBSA-N 1 1 361.442 2.939 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451343684 513690061 /nfs/dbraw/zinc/69/00/61/513690061.db2.gz OSIQADPCXAQWBR-WJFTUGDTSA-N 1 1 373.453 2.716 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451349116 513694135 /nfs/dbraw/zinc/69/41/35/513694135.db2.gz WOZOJSTWEUACDM-BVPBIZIASA-N 1 1 361.442 2.937 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCSC[C@H]1C1CCC1 ZINC000419375388 513792388 /nfs/dbraw/zinc/79/23/88/513792388.db2.gz QLKWRPRVJPFHIR-ZBFHGGJFSA-N 1 1 352.456 2.552 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000426068459 513839682 /nfs/dbraw/zinc/83/96/82/513839682.db2.gz YHYBJVIRRUYHLJ-ZWNOBZJWSA-N 1 1 374.363 2.896 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000451729169 513942109 /nfs/dbraw/zinc/94/21/09/513942109.db2.gz URGWSJUNVHEIAD-KRWDZBQOSA-N 1 1 355.394 2.796 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000451729169 513942119 /nfs/dbraw/zinc/94/21/19/513942119.db2.gz URGWSJUNVHEIAD-KRWDZBQOSA-N 1 1 355.394 2.796 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](CO)CC(C)(C)C ZINC000451785865 513979933 /nfs/dbraw/zinc/97/99/33/513979933.db2.gz VVYWDFOGOGEUFP-HNNXBMFYSA-N 1 1 351.447 2.961 20 5 FFBDMO COc1ccc(CN[C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422947970 513987516 /nfs/dbraw/zinc/98/75/16/513987516.db2.gz RHSOOZTZMNKITJ-OXQOHEQNSA-N 1 1 369.421 2.949 20 5 FFBDMO CN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000448963915 513996380 /nfs/dbraw/zinc/99/63/80/513996380.db2.gz UGZLVEKDHBLLFB-GFCCVEGCSA-N 1 1 357.332 2.922 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448985468 514007582 /nfs/dbraw/zinc/00/75/82/514007582.db2.gz XGKHNFKMLHYXHI-MRXNPFEDSA-N 1 1 361.442 2.938 20 5 FFBDMO CC(C)[N@@H+]1CCO[C@H](c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)C1 ZINC000420497632 514172990 /nfs/dbraw/zinc/17/29/90/514172990.db2.gz CRCYBIZHRZTXQK-HNNXBMFYSA-N 1 1 373.413 2.785 20 5 FFBDMO CC(C)[N@H+]1CCO[C@H](c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)C1 ZINC000420497632 514172996 /nfs/dbraw/zinc/17/29/96/514172996.db2.gz CRCYBIZHRZTXQK-HNNXBMFYSA-N 1 1 373.413 2.785 20 5 FFBDMO COC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452106476 514195262 /nfs/dbraw/zinc/19/52/62/514195262.db2.gz QQXQKQVOUZDKGK-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000437873678 514258127 /nfs/dbraw/zinc/25/81/27/514258127.db2.gz IYNXGZIYTURYDL-INIZCTEOSA-N 1 1 361.442 2.887 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000427597802 514261064 /nfs/dbraw/zinc/26/10/64/514261064.db2.gz YTVNOUQEMHZDBY-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000427597802 514261071 /nfs/dbraw/zinc/26/10/71/514261071.db2.gz YTVNOUQEMHZDBY-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO CCOC(=O)c1cc(NCCC[N@H+]2CCCO[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000432861962 514305400 /nfs/dbraw/zinc/30/54/00/514305400.db2.gz CQQCAABJCBIMFE-CQSZACIVSA-N 1 1 365.430 2.684 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000427910115 514345381 /nfs/dbraw/zinc/34/53/81/514345381.db2.gz WVUXZQSHUCQPMZ-JKSUJKDBSA-N 1 1 354.410 2.517 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433060745 514366149 /nfs/dbraw/zinc/36/61/49/514366149.db2.gz MSIIRQIFBFVNKQ-RDJZCZTQSA-N 1 1 371.437 2.766 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CNCCO3)o2)c(Cl)c1 ZINC000415090645 514438754 /nfs/dbraw/zinc/43/87/54/514438754.db2.gz AWPLDPRVJDGTSV-CYBMUJFWSA-N 1 1 351.790 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCN3CCc4ccccc43)C2)nc1 ZINC000428386151 514462977 /nfs/dbraw/zinc/46/29/77/514462977.db2.gz WQJKEKUMVKUYCO-MRXNPFEDSA-N 1 1 353.426 2.539 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000439255290 514515006 /nfs/dbraw/zinc/51/50/06/514515006.db2.gz GLMOHBAZBLSHQF-INIZCTEOSA-N 1 1 363.458 2.805 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2ccccc2O)cc1[N+](=O)[O-] ZINC000475086341 514552214 /nfs/dbraw/zinc/55/22/14/514552214.db2.gz HNZRQTAZKYIGFV-UHFFFAOYSA-N 1 1 374.393 2.527 20 5 FFBDMO O=C([C@H]1CC[N@H+](C2CCCCC2)C1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461412224 514604915 /nfs/dbraw/zinc/60/49/15/514604915.db2.gz ZQTVCCNURSXDHN-HNNXBMFYSA-N 1 1 373.453 2.970 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C[C@@H](C)C1 ZINC000453427490 514632221 /nfs/dbraw/zinc/63/22/21/514632221.db2.gz PEOCDDLVCHOUNX-JJRVBVJISA-N 1 1 370.457 2.557 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000470963176 514696596 /nfs/dbraw/zinc/69/65/96/514696596.db2.gz ZCKDSQMQINCBIC-HNNXBMFYSA-N 1 1 371.441 2.809 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H](O)COCc2ccccc2)ccc1[N+](=O)[O-] ZINC000489102135 514710892 /nfs/dbraw/zinc/71/08/92/514710892.db2.gz HLAFONPKVSZNIQ-KRWDZBQOSA-N 1 1 360.410 2.613 20 5 FFBDMO CNC(=O)C[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000461783136 514735876 /nfs/dbraw/zinc/73/58/76/514735876.db2.gz BQVMPMRZWKYMRH-UHFFFAOYSA-N 1 1 374.363 2.544 20 5 FFBDMO Cc1cc(NC[C@@H](C)[NH+]2CCN(C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461783346 514736105 /nfs/dbraw/zinc/73/61/05/514736105.db2.gz DUWFZAHZATXXDT-GFCCVEGCSA-N 1 1 360.380 2.970 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000489342762 514807095 /nfs/dbraw/zinc/80/70/95/514807095.db2.gz YJCFBZHKDRFSMR-MRXNPFEDSA-N 1 1 351.422 2.810 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000467047268 514876510 /nfs/dbraw/zinc/87/65/10/514876510.db2.gz RKLRRIRYOIAUQV-ABAIWWIYSA-N 1 1 372.450 2.931 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000467047273 514876665 /nfs/dbraw/zinc/87/66/65/514876665.db2.gz RKLRRIRYOIAUQV-XHDPSFHLSA-N 1 1 372.450 2.931 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000476090291 514912372 /nfs/dbraw/zinc/91/23/72/514912372.db2.gz KHGXNNLWTRJLKO-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000476090291 514912379 /nfs/dbraw/zinc/91/23/79/514912379.db2.gz KHGXNNLWTRJLKO-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498473896 514919500 /nfs/dbraw/zinc/91/95/00/514919500.db2.gz OKBYOVTWDLGGGI-ZDUSSCGKSA-N 1 1 368.865 2.774 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H]1C ZINC000498555470 514963704 /nfs/dbraw/zinc/96/37/04/514963704.db2.gz QTCVJEMRQKOVCQ-CVEARBPZSA-N 1 1 374.485 2.752 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000485348540 515004695 /nfs/dbraw/zinc/00/46/95/515004695.db2.gz LPGCGDDFLAVHEF-CHWSQXEVSA-N 1 1 367.471 2.546 20 5 FFBDMO COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000485416991 515031906 /nfs/dbraw/zinc/03/19/06/515031906.db2.gz LFZAGSGRBMIJML-UHFFFAOYSA-N 1 1 374.416 2.954 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCn3cc[nH+]c3C2)nc1-c1ccc(F)cc1 ZINC000485417423 515034034 /nfs/dbraw/zinc/03/40/34/515034034.db2.gz MQXNOTWDOJIXKN-AWEZNQCLSA-N 1 1 353.357 2.841 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000489946955 515043228 /nfs/dbraw/zinc/04/32/28/515043228.db2.gz RGJWHKVRAFUAGL-MPGHIAIKSA-N 1 1 360.458 2.509 20 5 FFBDMO COCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCOC1 ZINC000490047437 515080030 /nfs/dbraw/zinc/08/00/30/515080030.db2.gz SWMOGSAKDCPIOR-INIZCTEOSA-N 1 1 361.398 2.530 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485548179 515084543 /nfs/dbraw/zinc/08/45/43/515084543.db2.gz PEKKKLTUNPRUES-LBPRGKRZSA-N 1 1 355.385 2.796 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490063891 515087477 /nfs/dbraw/zinc/08/74/77/515087477.db2.gz OVYJHGJJQVLWER-HNNXBMFYSA-N 1 1 359.430 2.839 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000456325125 515095031 /nfs/dbraw/zinc/09/50/31/515095031.db2.gz FRQJSZKVBMMFDW-OAHLLOKOSA-N 1 1 356.426 2.527 20 5 FFBDMO CCN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000472440709 515271368 /nfs/dbraw/zinc/27/13/68/515271368.db2.gz RXUJBCSFGWFXKA-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000472440709 515271378 /nfs/dbraw/zinc/27/13/78/515271378.db2.gz RXUJBCSFGWFXKA-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000472440709 515271388 /nfs/dbraw/zinc/27/13/88/515271388.db2.gz RXUJBCSFGWFXKA-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000490652305 515274179 /nfs/dbraw/zinc/27/41/79/515274179.db2.gz NPYBLHIPZWBLGR-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490842 515347084 /nfs/dbraw/zinc/34/70/84/515347084.db2.gz HAYHZHZHALWEST-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490842 515347093 /nfs/dbraw/zinc/34/70/93/515347093.db2.gz HAYHZHZHALWEST-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](CCNc1ncc(C)cc1[N+](=O)[O-])CC2 ZINC000463054274 515350770 /nfs/dbraw/zinc/35/07/70/515350770.db2.gz QABUGEPFLOFOKS-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](CCNc1ncc(C)cc1[N+](=O)[O-])CC2 ZINC000463054274 515350779 /nfs/dbraw/zinc/35/07/79/515350779.db2.gz QABUGEPFLOFOKS-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000468484709 515379876 /nfs/dbraw/zinc/37/98/76/515379876.db2.gz UXDCMMUKQWKNID-MRXNPFEDSA-N 1 1 356.426 2.993 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491152181 515387181 /nfs/dbraw/zinc/38/71/81/515387181.db2.gz YWFNRJFEOIURCU-LBPRGKRZSA-N 1 1 373.400 2.773 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000491322046 515413779 /nfs/dbraw/zinc/41/37/79/515413779.db2.gz KHODGBBNKRQASE-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463426785 515489636 /nfs/dbraw/zinc/48/96/36/515489636.db2.gz QIQJZROMALORFV-INIZCTEOSA-N 1 1 370.405 2.588 20 5 FFBDMO CCCN(CC[NH+]1CCCCC1)S(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000510485354 515552719 /nfs/dbraw/zinc/55/27/19/515552719.db2.gz KMZSMIPSZUSDSC-UHFFFAOYSA-N 1 1 373.450 2.621 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486596291 515553298 /nfs/dbraw/zinc/55/32/98/515553298.db2.gz GEAWPUMKTVXPCL-GFCCVEGCSA-N 1 1 355.385 2.606 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486632036 515571357 /nfs/dbraw/zinc/57/13/57/515571357.db2.gz DESKSQXJJDOOPS-GFCCVEGCSA-N 1 1 355.385 2.510 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000487091152 515754735 /nfs/dbraw/zinc/75/47/35/515754735.db2.gz ZETOPVILTNXGLF-QGZVFWFLSA-N 1 1 353.422 2.889 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000464358970 515794666 /nfs/dbraw/zinc/79/46/66/515794666.db2.gz WSBUGLRVWZSTFW-QGZVFWFLSA-N 1 1 370.453 2.930 20 5 FFBDMO COc1cc(C[NH+]2CCC(O[C@H]3CCOC3)CC2)c([N+](=O)[O-])cc1F ZINC000464675956 515918625 /nfs/dbraw/zinc/91/86/25/515918625.db2.gz DIRDIPJEVALMQP-AWEZNQCLSA-N 1 1 354.378 2.512 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000494679473 515919436 /nfs/dbraw/zinc/91/94/36/515919436.db2.gz FJLGEAISPKKKCE-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1OC)[NH+](C)C ZINC000474190512 515926617 /nfs/dbraw/zinc/92/66/17/515926617.db2.gz OCRBHGUDCXISLA-MRXNPFEDSA-N 1 1 373.409 2.645 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@@H]21 ZINC000455097882 515957837 /nfs/dbraw/zinc/95/78/37/515957837.db2.gz KYCVLKOHGYQPIG-RNCFNFMXSA-N 1 1 358.320 2.781 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000464819722 515972590 /nfs/dbraw/zinc/97/25/90/515972590.db2.gz BXKBGIFLSRBZND-QFBILLFUSA-N 1 1 361.442 2.619 20 5 FFBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1 ZINC000483189281 515974233 /nfs/dbraw/zinc/97/42/33/515974233.db2.gz BZNQRSFOCSWOCA-GOSISDBHSA-N 1 1 350.415 2.634 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(CN2CCN(C)CC2)c1 ZINC000501192098 516013202 /nfs/dbraw/zinc/01/32/02/516013202.db2.gz OEORWILMCXUDBE-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCCOC2)O1 ZINC000483358994 516048868 /nfs/dbraw/zinc/04/88/68/516048868.db2.gz RUFVTDIWRLKTDX-SFHVURJKSA-N 1 1 350.415 2.634 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000470203753 516171866 /nfs/dbraw/zinc/17/18/66/516171866.db2.gz FBKSNTAYBSCNBY-VDBIKXPHSA-N 1 1 371.359 2.999 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000474774896 516190517 /nfs/dbraw/zinc/19/05/17/516190517.db2.gz KVPZQUGLGYJDER-LBPRGKRZSA-N 1 1 369.263 2.920 20 5 FFBDMO C[N@@H+](CC(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000501729342 516207065 /nfs/dbraw/zinc/20/70/65/516207065.db2.gz LEKPWNPLOLWQHR-ZBFHGGJFSA-N 1 1 367.496 2.606 20 5 FFBDMO C[N@@H+](CCNC(=O)CSc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000507452760 516215358 /nfs/dbraw/zinc/21/53/58/516215358.db2.gz XBZUXSRKAWKGLH-UHFFFAOYSA-N 1 1 359.451 2.935 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000488475658 516234706 /nfs/dbraw/zinc/23/47/06/516234706.db2.gz JRGBBCHHLSPYIU-GDBMZVCRSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1cc(OCC(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000484147698 516305331 /nfs/dbraw/zinc/30/53/31/516305331.db2.gz QISFBYHKQOEYKN-HNNXBMFYSA-N 1 1 363.458 2.910 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000543691717 516369326 /nfs/dbraw/zinc/36/93/26/516369326.db2.gz LQBZQRLABUDDBI-UHFFFAOYSA-N 1 1 354.410 2.861 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512817292 516371333 /nfs/dbraw/zinc/37/13/33/516371333.db2.gz LJLCXGUNLHQRIW-GFCCVEGCSA-N 1 1 357.357 2.793 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000561126426 516396192 /nfs/dbraw/zinc/39/61/92/516396192.db2.gz AZNYAYSTSXBZQD-UHFFFAOYSA-N 1 1 364.446 2.641 20 5 FFBDMO Cn1c(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572614 516404590 /nfs/dbraw/zinc/40/45/90/516404590.db2.gz IEGPBFWAANQUCS-CZUORRHYSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572614 516404596 /nfs/dbraw/zinc/40/45/96/516404596.db2.gz IEGPBFWAANQUCS-CZUORRHYSA-N 1 1 362.817 2.762 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1 ZINC000535731139 516474221 /nfs/dbraw/zinc/47/42/21/516474221.db2.gz CSXXQCVRFKGLHU-UHFFFAOYSA-N 1 1 369.487 2.555 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000523622364 516522941 /nfs/dbraw/zinc/52/29/41/516522941.db2.gz BLMJQBRIXWEUNS-OAHLLOKOSA-N 1 1 369.487 2.836 20 5 FFBDMO CCc1ccc(C(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000531663303 516584586 /nfs/dbraw/zinc/58/45/86/516584586.db2.gz DPTQMVDGECVMIV-IRXDYDNUSA-N 1 1 361.442 2.530 20 5 FFBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544147271 516614129 /nfs/dbraw/zinc/61/41/29/516614129.db2.gz YSRSHCDXRVZLEY-DOTOQJQBSA-N 1 1 374.437 2.906 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000536169436 516662140 /nfs/dbraw/zinc/66/21/40/516662140.db2.gz MEHWUSCXZGQORR-OAHLLOKOSA-N 1 1 370.453 2.809 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@H+]([C@@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000540977322 516812518 /nfs/dbraw/zinc/81/25/18/516812518.db2.gz HQKVGPVGTWTIJX-NRXGSXMXSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@H](CO)[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CCCC1 ZINC000561887396 516816412 /nfs/dbraw/zinc/81/64/12/516816412.db2.gz WRPJBCOXDHTGMQ-CYBMUJFWSA-N 1 1 363.414 2.518 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccccc2Cl)cc1 ZINC000544599701 516831033 /nfs/dbraw/zinc/83/10/33/516831033.db2.gz JKIBUMNEKWRQTO-UHFFFAOYSA-N 1 1 354.815 2.812 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541014511 516831798 /nfs/dbraw/zinc/83/17/98/516831798.db2.gz SNBILQHBBHLWEM-NSHDSACASA-N 1 1 357.357 2.800 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000532169368 516837992 /nfs/dbraw/zinc/83/79/92/516837992.db2.gz NMNPOYBYQWVWLS-DOTOQJQBSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598234 516843766 /nfs/dbraw/zinc/84/37/66/516843766.db2.gz RMNASKZUCCNPSB-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598234 516843776 /nfs/dbraw/zinc/84/37/76/516843776.db2.gz RMNASKZUCCNPSB-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)nc2sccn21 ZINC000548334524 516908871 /nfs/dbraw/zinc/90/88/71/516908871.db2.gz SGANQMXYVUYFER-LLVKDONJSA-N 1 1 358.427 2.831 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ccc2ncccc2c1[N+](=O)[O-] ZINC000555495235 516945344 /nfs/dbraw/zinc/94/53/44/516945344.db2.gz NSOXNCOHNCMXMZ-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000519512551 517018001 /nfs/dbraw/zinc/01/80/01/517018001.db2.gz WASDLXFSMVWUSB-UONOGXRCSA-N 1 1 351.472 2.922 20 5 FFBDMO NC(=O)[C@H]1CCC[N@H+]1CCCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000514747416 517036573 /nfs/dbraw/zinc/03/65/73/517036573.db2.gz TVIJXDOCSIYOFS-LLVKDONJSA-N 1 1 361.229 2.653 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532587603 517049896 /nfs/dbraw/zinc/04/98/96/517049896.db2.gz XKIAMROTIKCBDV-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532587603 517049910 /nfs/dbraw/zinc/04/99/10/517049910.db2.gz XKIAMROTIKCBDV-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000552062009 517058020 /nfs/dbraw/zinc/05/80/20/517058020.db2.gz IHDHCOYHKMSWRR-GOSISDBHSA-N 1 1 374.441 2.593 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444485 517113639 /nfs/dbraw/zinc/11/36/39/517113639.db2.gz RSHCLIMNMKTWTG-HIFRSBDPSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000562444485 517113651 /nfs/dbraw/zinc/11/36/51/517113651.db2.gz RSHCLIMNMKTWTG-HIFRSBDPSA-N 1 1 371.441 2.781 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552252770 517163367 /nfs/dbraw/zinc/16/33/67/517163367.db2.gz WQSOGEXHGRHCKE-PKOBYXMFSA-N 1 1 366.421 2.783 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](CS(C)(=O)=O)C1 ZINC000552274507 517173805 /nfs/dbraw/zinc/17/38/05/517173805.db2.gz XRICHCTYSYLOPL-IDJPSDCMSA-N 1 1 352.456 2.755 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](CS(C)(=O)=O)C1 ZINC000552274507 517173814 /nfs/dbraw/zinc/17/38/14/517173814.db2.gz XRICHCTYSYLOPL-IDJPSDCMSA-N 1 1 352.456 2.755 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000548751549 517188674 /nfs/dbraw/zinc/18/86/74/517188674.db2.gz HRATVAVKIOCZMN-SFHVURJKSA-N 1 1 368.437 2.561 20 5 FFBDMO Cc1c(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)cnn1C ZINC000562608190 517231968 /nfs/dbraw/zinc/23/19/68/517231968.db2.gz QLAYHUUOZGTQRK-UHFFFAOYSA-N 1 1 355.398 2.966 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618193 517263100 /nfs/dbraw/zinc/26/31/00/517263100.db2.gz PSLKXCJVJROUFU-DZGCQCFKSA-N 1 1 351.447 2.917 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618195 517263223 /nfs/dbraw/zinc/26/32/23/517263223.db2.gz PSLKXCJVJROUFU-UKRRQHHQSA-N 1 1 351.447 2.917 20 5 FFBDMO C[C@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000533114544 517303735 /nfs/dbraw/zinc/30/37/35/517303735.db2.gz YBEQVECVFSDZRX-DOTOQJQBSA-N 1 1 370.453 2.964 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000541964598 517312865 /nfs/dbraw/zinc/31/28/65/517312865.db2.gz MQFXDLXZGDEANV-LLVKDONJSA-N 1 1 357.357 2.610 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1)CC1CC1 ZINC000537815982 517357842 /nfs/dbraw/zinc/35/78/42/517357842.db2.gz MDLQGIHMDVRDMT-UHFFFAOYSA-N 1 1 362.474 2.908 20 5 FFBDMO Cc1cc(C[C@H](C)[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000520439422 517393746 /nfs/dbraw/zinc/39/37/46/517393746.db2.gz UVUDXQXYXGFWSQ-SJCJKPOMSA-N 1 1 354.414 2.670 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COCc1cccs1 ZINC000549156543 517428766 /nfs/dbraw/zinc/42/87/66/517428766.db2.gz HUAJNMXFQUTXNV-INIZCTEOSA-N 1 1 350.440 2.708 20 5 FFBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000533438256 517465407 /nfs/dbraw/zinc/46/54/07/517465407.db2.gz KUOVKNVPEKSNLL-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@@H]1Cc2ccccc2C[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000533438256 517465416 /nfs/dbraw/zinc/46/54/16/517465416.db2.gz KUOVKNVPEKSNLL-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1cc(C(C)(C)C)nn1C)c1ccccc1[N+](=O)[O-] ZINC000538275894 517536347 /nfs/dbraw/zinc/53/63/47/517536347.db2.gz KSEGXNBLQJZADO-GFCCVEGCSA-N 1 1 359.430 2.915 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000538378996 517595097 /nfs/dbraw/zinc/59/50/97/517595097.db2.gz PYKSHFZBBIKQOT-IBGZPJMESA-N 1 1 371.437 2.971 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000563063687 517626627 /nfs/dbraw/zinc/62/66/27/517626627.db2.gz LVPXDDUZZAKHND-CQSZACIVSA-N 1 1 373.457 2.650 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000556858920 517712999 /nfs/dbraw/zinc/71/29/99/517712999.db2.gz BVFLCDQIXAYBLT-CQSZACIVSA-N 1 1 372.347 2.976 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000542744739 517713694 /nfs/dbraw/zinc/71/36/94/517713694.db2.gz IETPOWHUPMYGRC-HIFRSBDPSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000546540140 517716591 /nfs/dbraw/zinc/71/65/91/517716591.db2.gz SRKHJYDXAPSIHT-OLZOCXBDSA-N 1 1 351.422 2.953 20 5 FFBDMO C[C@@H]1C[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000553446419 517719739 /nfs/dbraw/zinc/71/97/39/517719739.db2.gz FQIIDKXWSVQGCJ-HIFRSBDPSA-N 1 1 354.410 2.769 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000546550978 517722063 /nfs/dbraw/zinc/72/20/63/517722063.db2.gz NRSRNSILMMHLKG-ZDUSSCGKSA-N 1 1 351.422 2.860 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553768748 517893108 /nfs/dbraw/zinc/89/31/08/517893108.db2.gz SZTYJEMKCCNRTC-XJKCOSOUSA-N 1 1 361.442 2.714 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000557165742 517894682 /nfs/dbraw/zinc/89/46/82/517894682.db2.gz UWBYOWAOJVOHGT-UHFFFAOYSA-N 1 1 361.398 2.547 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000521907693 517895385 /nfs/dbraw/zinc/89/53/85/517895385.db2.gz LJDGYDGQGLYNHH-UKRRQHHQSA-N 1 1 371.441 2.836 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000553785596 517903935 /nfs/dbraw/zinc/90/39/35/517903935.db2.gz GXIBDXRTQQWTOC-DEYYWGMASA-N 1 1 372.469 2.971 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000522010338 517948263 /nfs/dbraw/zinc/94/82/63/517948263.db2.gz AGEFAQOIWYMNLW-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO CCNc1ccc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534585586 517954379 /nfs/dbraw/zinc/95/43/79/517954379.db2.gz BGHHFEIBKWPZHL-KRWDZBQOSA-N 1 1 354.410 2.943 20 5 FFBDMO CCNc1ccc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534585586 517954387 /nfs/dbraw/zinc/95/43/87/517954387.db2.gz BGHHFEIBKWPZHL-KRWDZBQOSA-N 1 1 354.410 2.943 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000522091400 517981388 /nfs/dbraw/zinc/98/13/88/517981388.db2.gz BJUZBDKASQMFOH-ZDUSSCGKSA-N 1 1 362.455 2.637 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534722126 518012674 /nfs/dbraw/zinc/01/26/74/518012674.db2.gz OYRNAOGJJXENFK-KRWDZBQOSA-N 1 1 360.458 2.511 20 5 FFBDMO COc1cccc(NC(=O)CC[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000517205091 518059370 /nfs/dbraw/zinc/05/93/70/518059370.db2.gz LWHDCLXECIVNHA-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1cccc(NC(=O)CC[N@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000517205091 518059379 /nfs/dbraw/zinc/05/93/79/518059379.db2.gz LWHDCLXECIVNHA-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000522364766 518088305 /nfs/dbraw/zinc/08/83/05/518088305.db2.gz BJLIFOBMXLCTDQ-DYVFJYSZSA-N 1 1 367.421 2.601 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000535274869 518172554 /nfs/dbraw/zinc/17/25/54/518172554.db2.gz DCTCEBGVHNKHJY-MRXNPFEDSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000535274869 518172555 /nfs/dbraw/zinc/17/25/55/518172555.db2.gz DCTCEBGVHNKHJY-MRXNPFEDSA-N 1 1 350.378 2.993 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000566967038 518288202 /nfs/dbraw/zinc/28/82/02/518288202.db2.gz MJBPIJRDXNYIAF-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000566967038 518288209 /nfs/dbraw/zinc/28/82/09/518288209.db2.gz MJBPIJRDXNYIAF-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO CC(C)[C@@H](CNc1nc2c(cc1[N+](=O)[O-])CCCC2)N1CC[NH+](C)CC1 ZINC000569922220 518357709 /nfs/dbraw/zinc/35/77/09/518357709.db2.gz CEWXOFDMGOQJRY-GOSISDBHSA-N 1 1 361.490 2.553 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000564223482 518359290 /nfs/dbraw/zinc/35/92/90/518359290.db2.gz NHVZNWLDMGGWAQ-UHFFFAOYSA-N 1 1 363.458 2.933 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC000578784646 518371619 /nfs/dbraw/zinc/37/16/19/518371619.db2.gz QTRNDRJKSYNSCC-HNNXBMFYSA-N 1 1 360.458 2.872 20 5 FFBDMO C[C@H]1CCSCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000576129023 518444224 /nfs/dbraw/zinc/44/42/24/518444224.db2.gz KPMXUPUMFPTDHE-LBPRGKRZSA-N 1 1 351.428 2.720 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000576524548 518633929 /nfs/dbraw/zinc/63/39/29/518633929.db2.gz VULDVDWTSBQIOR-KDOFPFPSSA-N 1 1 372.450 2.936 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000567784737 518708620 /nfs/dbraw/zinc/70/86/20/518708620.db2.gz UKKUHKSPXNMLFO-CQSZACIVSA-N 1 1 373.457 2.650 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)C[C@@H]1Cc1ccccc1 ZINC000588053402 518711306 /nfs/dbraw/zinc/71/13/06/518711306.db2.gz KTLHEJXOGFLYCJ-KRWDZBQOSA-N 1 1 363.421 2.901 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579608257 518764079 /nfs/dbraw/zinc/76/40/79/518764079.db2.gz MZXNEGPIINCPLX-KRWDZBQOSA-N 1 1 368.437 2.645 20 5 FFBDMO CC[N@H+](C)[C@@H](c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)c1ccccc1 ZINC000589149922 518930770 /nfs/dbraw/zinc/93/07/70/518930770.db2.gz GHFMGYPJRIKDNU-CYBMUJFWSA-N 1 1 356.386 2.728 20 5 FFBDMO CC[N@@H+](C)[C@@H](c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)c1ccccc1 ZINC000589149922 518930777 /nfs/dbraw/zinc/93/07/77/518930777.db2.gz GHFMGYPJRIKDNU-CYBMUJFWSA-N 1 1 356.386 2.728 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000582919209 518986895 /nfs/dbraw/zinc/98/68/95/518986895.db2.gz WJQOCVUZBJKSHE-OAHLLOKOSA-N 1 1 370.409 2.771 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](c3ccnc(C)n3)C2)c1 ZINC000589497250 519018159 /nfs/dbraw/zinc/01/81/59/519018159.db2.gz JHNHOAUKDLBYQQ-OAHLLOKOSA-N 1 1 370.409 2.859 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](c3ccnc(C)n3)C2)c1 ZINC000589497250 519018163 /nfs/dbraw/zinc/01/81/63/519018163.db2.gz JHNHOAUKDLBYQQ-OAHLLOKOSA-N 1 1 370.409 2.859 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000577389890 519057342 /nfs/dbraw/zinc/05/73/42/519057342.db2.gz BXWSELGHVYGDNJ-XJKSGUPXSA-N 1 1 369.487 2.508 20 5 FFBDMO Cc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590138735 519159791 /nfs/dbraw/zinc/15/97/91/519159791.db2.gz YRAFZTPOLVOWBN-UHFFFAOYSA-N 1 1 361.364 2.815 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590158192 519164030 /nfs/dbraw/zinc/16/40/30/519164030.db2.gz FTMVXKVELBDBID-GHMZBOCLSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H](C)C1 ZINC000590174902 519169097 /nfs/dbraw/zinc/16/90/97/519169097.db2.gz DFXCIZNUWNMRSN-VXGBXAGGSA-N 1 1 361.364 2.501 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000571675461 519214470 /nfs/dbraw/zinc/21/44/70/519214470.db2.gz HTUZDQOVHCHDDS-RISCZKNCSA-N 1 1 372.368 2.858 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862261 519255620 /nfs/dbraw/zinc/25/56/20/519255620.db2.gz JASLCQHYTUTCAX-CRAIPNDOSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862261 519255630 /nfs/dbraw/zinc/25/56/30/519255630.db2.gz JASLCQHYTUTCAX-CRAIPNDOSA-N 1 1 352.394 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[NH+]([C@H]4CCOC4)CC3)n2)cc1 ZINC000590694690 519320387 /nfs/dbraw/zinc/32/03/87/519320387.db2.gz ZDWBFXVFJJWHNT-HNNXBMFYSA-N 1 1 360.439 2.629 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000572056758 519420598 /nfs/dbraw/zinc/42/05/98/519420598.db2.gz ZUNHPEZXHJRWBZ-MBNYWOFBSA-N 1 1 366.849 2.744 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000578140332 519439734 /nfs/dbraw/zinc/43/97/34/519439734.db2.gz GMSIUVSJVQFFAU-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)OC(C)(C)C ZINC000590972806 519465540 /nfs/dbraw/zinc/46/55/40/519465540.db2.gz WBHUSBFEOMQNEJ-GFCCVEGCSA-N 1 1 366.414 2.776 20 5 FFBDMO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000569350987 519506024 /nfs/dbraw/zinc/50/60/24/519506024.db2.gz GNAISZDUMFHEGD-CQSZACIVSA-N 1 1 372.429 2.763 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000566552991 519548228 /nfs/dbraw/zinc/54/82/28/519548228.db2.gz CSQNHMYKLNCIPQ-AWEZNQCLSA-N 1 1 365.430 2.558 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000581213266 519579323 /nfs/dbraw/zinc/57/93/23/519579323.db2.gz YBGNYAITGNVNLH-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1cc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)ccc1[N+](=O)[O-] ZINC000575322811 519587846 /nfs/dbraw/zinc/58/78/46/519587846.db2.gz WAOWMZAGXJAWSP-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@@H](C(=O)OC(C)(C)C)CC[C@H]1C ZINC000602848465 519924270 /nfs/dbraw/zinc/92/42/70/519924270.db2.gz VNCCRDVNUCOIGI-OCCSQVGLSA-N 1 1 352.435 2.542 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000591510767 519933846 /nfs/dbraw/zinc/93/38/46/519933846.db2.gz JISDUFZCNFUMHH-SJORKVTESA-N 1 1 361.442 2.585 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594482975 519992738 /nfs/dbraw/zinc/99/27/38/519992738.db2.gz GSLZUZDGZIDMNJ-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H](c1ccccc1)N(C)C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602965526 519997507 /nfs/dbraw/zinc/99/75/07/519997507.db2.gz HXDAQJOCYBPHDA-QRWLVFNGSA-N 1 1 371.437 2.612 20 5 FFBDMO CC(=O)N1CC([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000594508984 520009047 /nfs/dbraw/zinc/00/90/47/520009047.db2.gz GEGAJKRDJNLGJC-UHFFFAOYSA-N 1 1 359.357 2.847 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000600038252 520011919 /nfs/dbraw/zinc/01/19/19/520011919.db2.gz ORRLJDMLHGXWIW-GXFFZTMASA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997285 520013107 /nfs/dbraw/zinc/01/31/07/520013107.db2.gz HBIBDXLGRJJDST-NJAFHUGGSA-N 1 1 361.442 2.857 20 5 FFBDMO C[N@H+]1C[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)[C@H](c2ccccc2)C1 ZINC000591986554 520122453 /nfs/dbraw/zinc/12/24/53/520122453.db2.gz SAFTUOLQVUIZTJ-QAPCUYQASA-N 1 1 363.421 2.717 20 5 FFBDMO Cn1cc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600207208 520124359 /nfs/dbraw/zinc/12/43/59/520124359.db2.gz KPXLFWMTECVICF-QFBILLFUSA-N 1 1 356.426 2.590 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000600252632 520159058 /nfs/dbraw/zinc/15/90/58/520159058.db2.gz KSLFAQJHVUYXLG-SFHVURJKSA-N 1 1 356.426 2.906 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000600299224 520188909 /nfs/dbraw/zinc/18/89/09/520188909.db2.gz RHHNCEOUPVUUPA-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000600299224 520188915 /nfs/dbraw/zinc/18/89/15/520188915.db2.gz RHHNCEOUPVUUPA-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000600311275 520197426 /nfs/dbraw/zinc/19/74/26/520197426.db2.gz ONCJQALHURYYPL-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO Cc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)ncn1 ZINC000592133156 520207265 /nfs/dbraw/zinc/20/72/65/520207265.db2.gz TVLOJVGRQOGTLU-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)ncn1 ZINC000592133156 520207271 /nfs/dbraw/zinc/20/72/71/520207271.db2.gz TVLOJVGRQOGTLU-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO CCOc1cc(C(=O)NCC[N@@H+](C)C2CCCC2)c([N+](=O)[O-])cc1OC ZINC000609190180 520224058 /nfs/dbraw/zinc/22/40/58/520224058.db2.gz PRAWDBVGFQAKIB-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](CCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000609203912 520231831 /nfs/dbraw/zinc/23/18/31/520231831.db2.gz CURRJFLYFXOSSC-LLVKDONJSA-N 1 1 360.357 2.799 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000609203912 520231835 /nfs/dbraw/zinc/23/18/35/520231835.db2.gz CURRJFLYFXOSSC-LLVKDONJSA-N 1 1 360.357 2.799 20 5 FFBDMO COc1ccc(N2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2=O)cc1 ZINC000594967363 520232492 /nfs/dbraw/zinc/23/24/92/520232492.db2.gz XBNOMDCEHUIABF-CYBMUJFWSA-N 1 1 359.357 2.638 20 5 FFBDMO O=[N+]([O-])c1ccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c(F)c1 ZINC000594975859 520239063 /nfs/dbraw/zinc/23/90/63/520239063.db2.gz VZOQVDXGURLHRT-SFHVURJKSA-N 1 1 359.401 2.590 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@H](CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993105 520246226 /nfs/dbraw/zinc/24/62/26/520246226.db2.gz BKXMMJCUIKBBKA-HXUWFJFHSA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993105 520246233 /nfs/dbraw/zinc/24/62/33/520246233.db2.gz BKXMMJCUIKBBKA-HXUWFJFHSA-N 1 1 354.454 2.501 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000603401269 520248150 /nfs/dbraw/zinc/24/81/50/520248150.db2.gz KTYFWYQRDRIMTQ-NSHDSACASA-N 1 1 374.363 2.698 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000603401266 520248196 /nfs/dbraw/zinc/24/81/96/520248196.db2.gz KTYFWYQRDRIMTQ-LLVKDONJSA-N 1 1 374.363 2.698 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609522433 520342675 /nfs/dbraw/zinc/34/26/75/520342675.db2.gz KYHHSACEENKCSA-LBPRGKRZSA-N 1 1 355.822 2.570 20 5 FFBDMO CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CC[N@@H+](C)C1 ZINC000597945588 520344193 /nfs/dbraw/zinc/34/41/93/520344193.db2.gz JCDDCGGZZKMXQX-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597944994 520344848 /nfs/dbraw/zinc/34/48/48/520344848.db2.gz FZINUEJGPXUIFP-LBPRGKRZSA-N 1 1 356.220 2.524 20 5 FFBDMO CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598042839 520390768 /nfs/dbraw/zinc/39/07/68/520390768.db2.gz YWLLCJAEDMOUEE-CYBMUJFWSA-N 1 1 370.247 2.914 20 5 FFBDMO Cc1noc(C[NH+]2CCC(n3cc(Br)cn3)CC2)c1[N+](=O)[O-] ZINC000595314703 520403579 /nfs/dbraw/zinc/40/35/79/520403579.db2.gz JUOOWAWIXMZQAI-UHFFFAOYSA-N 1 1 370.207 2.687 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592478845 520407183 /nfs/dbraw/zinc/40/71/83/520407183.db2.gz KBSYNKOONYQHQZ-WBVHZDCISA-N 1 1 360.458 2.696 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)n2)cc1 ZINC000592492983 520416924 /nfs/dbraw/zinc/41/69/24/520416924.db2.gz LAFKKPKJURYOSQ-CVEARBPZSA-N 1 1 371.441 2.856 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609758171 520422403 /nfs/dbraw/zinc/42/24/03/520422403.db2.gz NOUKHRXLUCVXKX-YOEHRIQHSA-N 1 1 356.426 2.635 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000595471303 520492359 /nfs/dbraw/zinc/49/23/59/520492359.db2.gz ZBYGLEQHAINILF-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000595471303 520492366 /nfs/dbraw/zinc/49/23/66/520492366.db2.gz ZBYGLEQHAINILF-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595477835 520496003 /nfs/dbraw/zinc/49/60/03/520496003.db2.gz VQWVUSWVKNOVEL-SFHVURJKSA-N 1 1 354.410 2.669 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000595585875 520570717 /nfs/dbraw/zinc/57/07/17/520570717.db2.gz SGHGPBJNNZCSNQ-AWEZNQCLSA-N 1 1 354.838 2.574 20 5 FFBDMO Cc1cc(C(=O)N[C@@H](C)C2([NH+]3CCOCC3)CCCC2)ccc1[N+](=O)[O-] ZINC000610247336 520598975 /nfs/dbraw/zinc/59/89/75/520598975.db2.gz ZGVCYTLWXTZTFK-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1 ZINC000610283858 520621368 /nfs/dbraw/zinc/62/13/68/520621368.db2.gz DWYNFMAXIUDMRL-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000592879665 520629406 /nfs/dbraw/zinc/62/94/06/520629406.db2.gz BGEDRFRNYVVEKF-QUCCMNQESA-N 1 1 367.449 2.989 20 5 FFBDMO Cc1cccc(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000592879680 520629881 /nfs/dbraw/zinc/62/98/81/520629881.db2.gz BJPUNGTZQVLOEE-AEFFLSMTSA-N 1 1 353.422 2.978 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000592883090 520633008 /nfs/dbraw/zinc/63/30/08/520633008.db2.gz WBMZDHQEFFHGFQ-QAPCUYQASA-N 1 1 369.421 2.679 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000592883403 520633279 /nfs/dbraw/zinc/63/32/79/520633279.db2.gz ZOXRFPDXXXMKAC-SJORKVTESA-N 1 1 369.421 2.679 20 5 FFBDMO CCCC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccc(C)o1 ZINC000610368243 520654935 /nfs/dbraw/zinc/65/49/35/520654935.db2.gz PYDQZVDCNOYKHN-GDBMZVCRSA-N 1 1 350.419 2.917 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000593012740 520684667 /nfs/dbraw/zinc/68/46/67/520684667.db2.gz YIGAHXAHLDCRKY-KRWDZBQOSA-N 1 1 357.385 2.667 20 5 FFBDMO C[N@@H+](CCCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000593015039 520686074 /nfs/dbraw/zinc/68/60/74/520686074.db2.gz KUJXNTLMAQLLAM-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000598560486 520705492 /nfs/dbraw/zinc/70/54/92/520705492.db2.gz MVOZLOQPKDDKIZ-AWEZNQCLSA-N 1 1 356.426 2.928 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595790886 520727711 /nfs/dbraw/zinc/72/77/11/520727711.db2.gz ZJUCSCFRNMUJNU-NUJGCVRESA-N 1 1 364.442 2.616 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000598607144 520738772 /nfs/dbraw/zinc/73/87/72/520738772.db2.gz ODHBMLVVHNOWDI-CYBMUJFWSA-N 1 1 350.419 2.556 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000598624200 520749259 /nfs/dbraw/zinc/74/92/59/520749259.db2.gz GCANYZPVDYJSOV-CQSZACIVSA-N 1 1 362.430 2.985 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000595837668 520757813 /nfs/dbraw/zinc/75/78/13/520757813.db2.gz QOIUZUNWOKMXCL-ZDUSSCGKSA-N 1 1 361.398 2.774 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000595837668 520757825 /nfs/dbraw/zinc/75/78/25/520757825.db2.gz QOIUZUNWOKMXCL-ZDUSSCGKSA-N 1 1 361.398 2.774 20 5 FFBDMO CC[N@@H+](CCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1CCCCC1 ZINC000593250484 520856215 /nfs/dbraw/zinc/85/62/15/520856215.db2.gz OJISDLJXHWXFCM-UHFFFAOYSA-N 1 1 365.478 2.687 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)C(=O)Nc1ccccc1 ZINC000610844463 520867639 /nfs/dbraw/zinc/86/76/39/520867639.db2.gz SXVLIEZZNPNGPO-UHFFFAOYSA-N 1 1 370.409 2.849 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[N@H+]1CCc2sccc2C1 ZINC000596075317 520897333 /nfs/dbraw/zinc/89/73/33/520897333.db2.gz MFJGLNXXDBHSPH-LLVKDONJSA-N 1 1 360.439 2.614 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000593316803 520904965 /nfs/dbraw/zinc/90/49/65/520904965.db2.gz XSTOSIDBOQRWFF-QOKNQOGYSA-N 1 1 363.458 2.712 20 5 FFBDMO Cc1cc(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c([N+](=O)[O-])s1 ZINC000596097258 520909098 /nfs/dbraw/zinc/90/90/98/520909098.db2.gz DFFXGOJTQPFVOF-OKILXGFUSA-N 1 1 352.504 2.960 20 5 FFBDMO C[C@@H](c1cccc(Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)c1)[NH+]1CCOCC1 ZINC000596113061 520919971 /nfs/dbraw/zinc/91/99/71/520919971.db2.gz KHRRGMKYGBJHJF-ZDUSSCGKSA-N 1 1 370.409 2.831 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598975447 520954419 /nfs/dbraw/zinc/95/44/19/520954419.db2.gz ILGUCCZAGAGZNC-SFHVURJKSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596231494 520985433 /nfs/dbraw/zinc/98/54/33/520985433.db2.gz JVQKNRLEXYFJHQ-YPMHNXCESA-N 1 1 359.348 2.913 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@H]1CCC[N@H+]1CCCO ZINC000596260171 520997959 /nfs/dbraw/zinc/99/79/59/520997959.db2.gz YTPLEFJTMRAOBY-LLVKDONJSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@H]1CCC[N@@H+]1CCCO ZINC000596260171 520997965 /nfs/dbraw/zinc/99/79/65/520997965.db2.gz YTPLEFJTMRAOBY-LLVKDONJSA-N 1 1 358.236 2.616 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000599140438 521050641 /nfs/dbraw/zinc/05/06/41/521050641.db2.gz SKWKESUXKHSPKS-HNNXBMFYSA-N 1 1 367.409 2.588 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599203755 521085629 /nfs/dbraw/zinc/08/56/29/521085629.db2.gz POODYXFDEQOCSJ-KRWDZBQOSA-N 1 1 360.458 2.796 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)cc1OC(F)F ZINC000611296515 521085868 /nfs/dbraw/zinc/08/58/68/521085868.db2.gz DWHMAXSQUOWSNV-CQSZACIVSA-N 1 1 371.384 2.887 20 5 FFBDMO CCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000596546786 521125310 /nfs/dbraw/zinc/12/53/10/521125310.db2.gz UYNCYPLZYIGYQU-AWEZNQCLSA-N 1 1 354.838 2.526 20 5 FFBDMO CNC(=O)c1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000596556877 521128779 /nfs/dbraw/zinc/12/87/79/521128779.db2.gz CGPYYTBXPMMMEB-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO CNC(=O)c1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000596556876 521129025 /nfs/dbraw/zinc/12/90/25/521129025.db2.gz CGPYYTBXPMMMEB-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000593686499 521158532 /nfs/dbraw/zinc/15/85/32/521158532.db2.gz FYBCEGHBOSGACI-SFHVURJKSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000593686499 521158540 /nfs/dbraw/zinc/15/85/40/521158540.db2.gz FYBCEGHBOSGACI-SFHVURJKSA-N 1 1 371.412 2.662 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@H]2CCCC[N@H+]2CCO)C(F)(F)F)cc1 ZINC000593712022 521169526 /nfs/dbraw/zinc/16/95/26/521169526.db2.gz GOTKWBYNNHLOMT-HUUCEWRRSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@H]2CCCC[N@@H+]2CCO)C(F)(F)F)cc1 ZINC000593712022 521169533 /nfs/dbraw/zinc/16/95/33/521169533.db2.gz GOTKWBYNNHLOMT-HUUCEWRRSA-N 1 1 361.364 2.635 20 5 FFBDMO Cc1ccc(NC(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)cc1[N+](=O)[O-] ZINC000596627173 521173695 /nfs/dbraw/zinc/17/36/95/521173695.db2.gz VWNSFNBWTVRPSJ-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772757 521206377 /nfs/dbraw/zinc/20/63/77/521206377.db2.gz ZNFGYSFPJDNOOQ-AEGPPILISA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772757 521206381 /nfs/dbraw/zinc/20/63/81/521206381.db2.gz ZNFGYSFPJDNOOQ-AEGPPILISA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772757 521206391 /nfs/dbraw/zinc/20/63/91/521206391.db2.gz ZNFGYSFPJDNOOQ-AEGPPILISA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772757 521206395 /nfs/dbraw/zinc/20/63/95/521206395.db2.gz ZNFGYSFPJDNOOQ-AEGPPILISA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1C ZINC000599464731 521240217 /nfs/dbraw/zinc/24/02/17/521240217.db2.gz RNWRREOZKGGMCV-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO CCn1cc(C[N@@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)cn1 ZINC000611616413 521250651 /nfs/dbraw/zinc/25/06/51/521250651.db2.gz MMNVBAXZRNRTRJ-UHFFFAOYSA-N 1 1 358.446 2.535 20 5 FFBDMO CCn1cc(C[N@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)cn1 ZINC000611616413 521250658 /nfs/dbraw/zinc/25/06/58/521250658.db2.gz MMNVBAXZRNRTRJ-UHFFFAOYSA-N 1 1 358.446 2.535 20 5 FFBDMO CCn1c(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)nc2ccccc21 ZINC000618822858 521253811 /nfs/dbraw/zinc/25/38/11/521253811.db2.gz PSJFYURFXNPOGX-UHFFFAOYSA-N 1 1 354.414 2.998 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000593987389 521331584 /nfs/dbraw/zinc/33/15/84/521331584.db2.gz OWIDHWXYSDHKGX-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO COc1cc(C[NH+]2CCC(Oc3ncc(C)cn3)CC2)ccc1[N+](=O)[O-] ZINC000594020462 521354021 /nfs/dbraw/zinc/35/40/21/521354021.db2.gz JBYFFSCIAXLILI-UHFFFAOYSA-N 1 1 358.398 2.745 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599664459 521377166 /nfs/dbraw/zinc/37/71/66/521377166.db2.gz NVPYQZDHSCTMJX-BXKDBHETSA-N 1 1 368.231 2.570 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCCC2)O1 ZINC000594058299 521378621 /nfs/dbraw/zinc/37/86/21/521378621.db2.gz RLHPVRQWPFRBJT-WBVHZDCISA-N 1 1 364.442 2.758 20 5 FFBDMO Cc1ccc2nc(C[NH2+]C3CCN(c4ccc([N+](=O)[O-])nc4)CC3)[nH]c2c1 ZINC000602558502 521412594 /nfs/dbraw/zinc/41/25/94/521412594.db2.gz BWJSAXALSRRRKB-UHFFFAOYSA-N 1 1 366.425 2.933 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739586 521440739 /nfs/dbraw/zinc/44/07/39/521440739.db2.gz NQTRZVPGPCWRDD-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739586 521440740 /nfs/dbraw/zinc/44/07/40/521440740.db2.gz NQTRZVPGPCWRDD-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612030190 521446649 /nfs/dbraw/zinc/44/66/49/521446649.db2.gz ABLFUYVACQPYNO-HUUCEWRRSA-N 1 1 358.394 2.790 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000594199234 521465315 /nfs/dbraw/zinc/46/53/15/521465315.db2.gz IGRAZEJQHLSKPD-QZTJIDSGSA-N 1 1 369.425 2.527 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000602728695 521500248 /nfs/dbraw/zinc/50/02/48/521500248.db2.gz FVXJMILMBSRTKF-DJJJIMSYSA-N 1 1 372.425 2.626 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597095335 521501637 /nfs/dbraw/zinc/50/16/37/521501637.db2.gz SUUWQCYKAWPCFA-SNVBAGLBSA-N 1 1 355.826 2.684 20 5 FFBDMO COc1cccc(C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]2CCCO2)c1 ZINC000602762955 521520291 /nfs/dbraw/zinc/52/02/91/521520291.db2.gz ICMHJBYCDSRMSF-SFHVURJKSA-N 1 1 374.441 2.790 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000602801549 521540428 /nfs/dbraw/zinc/54/04/28/521540428.db2.gz FNVRNVHXKMTMOL-LBPRGKRZSA-N 1 1 372.351 2.652 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000602826205 521554408 /nfs/dbraw/zinc/55/44/08/521554408.db2.gz MYGLKDFFLBHNMZ-OAHLLOKOSA-N 1 1 358.446 2.512 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000602834298 521560660 /nfs/dbraw/zinc/56/06/60/521560660.db2.gz YKLOTPVMLQSGHR-FGTMMUONSA-N 1 1 356.426 2.604 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+]([C@@H]4CCOC4)CC3)o2)cc1 ZINC000597203340 521570708 /nfs/dbraw/zinc/57/07/08/521570708.db2.gz OFMAJWHAKDHPDX-QGZVFWFLSA-N 1 1 357.410 2.761 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN([C@@H]4CCOC4)CC3)o2)cc1 ZINC000597203340 521570714 /nfs/dbraw/zinc/57/07/14/521570714.db2.gz OFMAJWHAKDHPDX-QGZVFWFLSA-N 1 1 357.410 2.761 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000619583812 521783903 /nfs/dbraw/zinc/78/39/03/521783903.db2.gz OKCRBKZVMLLPHD-CVEARBPZSA-N 1 1 361.442 2.757 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000619820166 521891542 /nfs/dbraw/zinc/89/15/42/521891542.db2.gz QYPXGWFXIAABEP-LJQANCHMSA-N 1 1 368.437 2.965 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000619820166 521891547 /nfs/dbraw/zinc/89/15/47/521891547.db2.gz QYPXGWFXIAABEP-LJQANCHMSA-N 1 1 368.437 2.965 20 5 FFBDMO C[C@H](C[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)(C)C ZINC000619844093 521901392 /nfs/dbraw/zinc/90/13/92/521901392.db2.gz QPMFKOGLGJFZOQ-CQSZACIVSA-N 1 1 369.487 2.583 20 5 FFBDMO CC(C)C[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[NH+]1CCOCC1 ZINC000509039141 561782295 /nfs/dbraw/zinc/78/22/95/561782295.db2.gz JLHZMPVOGFCJLI-AWEZNQCLSA-N 1 1 359.430 2.697 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CN(c3ccc4ccc5ccc(Cl)nc5c4n3)C[C@H]21 ZINC001164671917 719396242 /nfs/dbraw/zinc/39/62/42/719396242.db2.gz ZWAGWDILYQGQTP-HUUCEWRRSA-N 1 1 354.841 2.956 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786261 721413831 /nfs/dbraw/zinc/41/38/31/721413831.db2.gz ORGQKABLDAKTPJ-OKILXGFUSA-N 1 1 359.455 2.631 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786261 721413834 /nfs/dbraw/zinc/41/38/34/721413834.db2.gz ORGQKABLDAKTPJ-OKILXGFUSA-N 1 1 359.455 2.631 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N2CCC[C@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164993999 722191623 /nfs/dbraw/zinc/19/16/23/722191623.db2.gz KOLZSTKRISSYDJ-IBGZPJMESA-N 1 1 372.400 2.612 20 5 FFBDMO C[N@H+](CCC[N-]C(=O)C(F)(F)F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000154259750 728800075 /nfs/dbraw/zinc/80/00/75/728800075.db2.gz NFNIXAFDTYJXQV-UHFFFAOYSA-N 1 1 353.728 2.749 20 5 FFBDMO C[N@@H+](CCC[N-]C(=O)C(F)(F)F)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000154259750 728800078 /nfs/dbraw/zinc/80/00/78/728800078.db2.gz NFNIXAFDTYJXQV-UHFFFAOYSA-N 1 1 353.728 2.749 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000745428353 735420453 /nfs/dbraw/zinc/42/04/53/735420453.db2.gz SSTXZNJUFFRQIB-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000745428353 735420455 /nfs/dbraw/zinc/42/04/55/735420455.db2.gz SSTXZNJUFFRQIB-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO CC[N@@H+]1CC[C@@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000899223293 735461688 /nfs/dbraw/zinc/46/16/88/735461688.db2.gz DSPWWWGTZUKDEW-SSDOTTSWSA-N 1 1 350.177 2.865 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000899223293 735461690 /nfs/dbraw/zinc/46/16/90/735461690.db2.gz DSPWWWGTZUKDEW-SSDOTTSWSA-N 1 1 350.177 2.865 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](C)[C@@H](C)C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000129540404 728712023 /nfs/dbraw/zinc/71/20/23/728712023.db2.gz KYRQHNCMWYMHIW-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000129540404 728712024 /nfs/dbraw/zinc/71/20/24/728712024.db2.gz KYRQHNCMWYMHIW-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778943551 738423508 /nfs/dbraw/zinc/42/35/08/738423508.db2.gz HEWBRINQZMPARM-CYBMUJFWSA-N 1 1 351.403 2.702 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778943551 738423512 /nfs/dbraw/zinc/42/35/12/738423512.db2.gz HEWBRINQZMPARM-CYBMUJFWSA-N 1 1 351.403 2.702 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000856800462 730358727 /nfs/dbraw/zinc/35/87/27/730358727.db2.gz YRHLBEPRIMBKSM-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000857303716 730390180 /nfs/dbraw/zinc/39/01/80/730390180.db2.gz LTLKTIPQZXIBLN-SNVBAGLBSA-N 1 1 370.247 2.960 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N(CCC(F)(F)F)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000867966108 731246580 /nfs/dbraw/zinc/24/65/80/731246580.db2.gz LLRSIZDAJCQYNM-HNNXBMFYSA-N 1 1 359.348 2.960 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CCC1(C)C ZINC000871159303 731601241 /nfs/dbraw/zinc/60/12/41/731601241.db2.gz RGQJKEMTMTWLFM-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2ncc(Br)s2)c1 ZINC000872240510 731744544 /nfs/dbraw/zinc/74/45/44/731744544.db2.gz ROYQZKVUYLLDAM-JTQLQIEISA-N 1 1 358.217 2.637 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000781674419 738647981 /nfs/dbraw/zinc/64/79/81/738647981.db2.gz GBZPFZGPHHROAD-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO C[C@H]1COCC[N@@H+]1C1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000882539994 733241578 /nfs/dbraw/zinc/24/15/78/733241578.db2.gz HFURWORKMOEZMJ-LBPRGKRZSA-N 1 1 362.455 2.894 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000882539994 733241583 /nfs/dbraw/zinc/24/15/83/733241583.db2.gz HFURWORKMOEZMJ-LBPRGKRZSA-N 1 1 362.455 2.894 20 5 FFBDMO CCn1nnc(C)c1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000883288204 733360444 /nfs/dbraw/zinc/36/04/44/733360444.db2.gz VUQXTSPZNQNLFD-UHFFFAOYSA-N 1 1 354.208 2.567 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000886319847 733773241 /nfs/dbraw/zinc/77/32/41/733773241.db2.gz QTGLHVLEYSCGME-KGLIPLIRSA-N 1 1 355.316 2.614 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827425 733845257 /nfs/dbraw/zinc/84/52/57/733845257.db2.gz KSVGEOFTWPFUNJ-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827425 733845259 /nfs/dbraw/zinc/84/52/59/733845259.db2.gz KSVGEOFTWPFUNJ-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000886829650 733845966 /nfs/dbraw/zinc/84/59/66/733845966.db2.gz DTAHCHCJZBRYFN-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO C[N@H+](CCCF)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000887140314 733882065 /nfs/dbraw/zinc/88/20/65/733882065.db2.gz ZJZDKUBIMGIYHU-UHFFFAOYSA-N 1 1 352.391 2.948 20 5 FFBDMO C[N@@H+](CCCF)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000887140314 733882068 /nfs/dbraw/zinc/88/20/68/733882068.db2.gz ZJZDKUBIMGIYHU-UHFFFAOYSA-N 1 1 352.391 2.948 20 5 FFBDMO COc1c(O)ccc(CN2CC[NH+](Cc3cccs3)CC2)c1[N+](=O)[O-] ZINC000891508113 734438638 /nfs/dbraw/zinc/43/86/38/734438638.db2.gz CPNAEBMMVLEZRO-UHFFFAOYSA-N 1 1 363.439 2.688 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C2CCN(C[C@@H]3CCCO3)CC2)cc1Cl ZINC000783628805 738821153 /nfs/dbraw/zinc/82/11/53/738821153.db2.gz MFNFCUWWQRNSSE-HNNXBMFYSA-N 1 1 353.850 2.981 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105075 738825391 /nfs/dbraw/zinc/82/53/91/738825391.db2.gz ZDTNSSAOIBHGGM-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105075 738825398 /nfs/dbraw/zinc/82/53/98/738825398.db2.gz ZDTNSSAOIBHGGM-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3c(Cl)n[nH]c3C3CC3)CC2)n1 ZINC000894077580 734797708 /nfs/dbraw/zinc/79/77/08/734797708.db2.gz CEMFSGLXJRVQFK-UHFFFAOYSA-N 1 1 350.810 2.882 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(c3ncc([N+](=O)[O-])cc3Br)C[C@@]2(C)C1 ZINC000894797497 734918734 /nfs/dbraw/zinc/91/87/34/734918734.db2.gz MGLWISKGRRNGAZ-OKILXGFUSA-N 1 1 355.236 2.530 20 5 FFBDMO CC[NH+](CC)Cc1cn(Cc2c(Br)cccc2[N+](=O)[O-])nn1 ZINC000900641566 735673502 /nfs/dbraw/zinc/67/35/02/735673502.db2.gz XWVVCPNBUVBSPL-UHFFFAOYSA-N 1 1 368.235 2.839 20 5 FFBDMO C[NH+](C)CCSc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000756765203 736360085 /nfs/dbraw/zinc/36/00/85/736360085.db2.gz DDNKDDJXBWURIT-UHFFFAOYSA-N 1 1 358.363 2.542 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc2c(c1)CCS2(=O)=O ZINC000757693690 736420018 /nfs/dbraw/zinc/42/00/18/736420018.db2.gz MWXKYRLAKXNHBT-UHFFFAOYSA-N 1 1 366.826 2.868 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854697 736674907 /nfs/dbraw/zinc/67/49/07/736674907.db2.gz PKDXTIZKEFBNNP-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854697 736674910 /nfs/dbraw/zinc/67/49/10/736674910.db2.gz PKDXTIZKEFBNNP-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(NC(=S)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1 ZINC000763129405 736904396 /nfs/dbraw/zinc/90/43/96/736904396.db2.gz MGYMMSNZKMLIEF-CVEARBPZSA-N 1 1 364.471 2.525 20 5 FFBDMO CC[N@@H+](C[C@@H]1CCOC1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764197671 737000760 /nfs/dbraw/zinc/00/07/60/737000760.db2.gz PQEPPNYUUJSXAO-RYUDHWBXSA-N 1 1 355.822 2.934 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=S)Nc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000764503424 737024874 /nfs/dbraw/zinc/02/48/74/737024874.db2.gz LZDFKJJZQMPJRD-UHFFFAOYSA-N 1 1 357.439 2.817 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766950824 737278813 /nfs/dbraw/zinc/27/88/13/737278813.db2.gz RFGKUNGYFOUJEF-GOEBONIOSA-N 1 1 350.415 2.682 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000913759903 737443925 /nfs/dbraw/zinc/44/39/25/737443925.db2.gz BXRJIGPGHPFKGE-CJNGLKHVSA-N 1 1 351.834 2.733 20 5 FFBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000769410921 737525723 /nfs/dbraw/zinc/52/57/23/737525723.db2.gz FJDTZPUPSPWTRC-KXQLTZBTSA-N 1 1 357.332 2.703 20 5 FFBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000769410921 737525726 /nfs/dbraw/zinc/52/57/26/737525726.db2.gz FJDTZPUPSPWTRC-KXQLTZBTSA-N 1 1 357.332 2.703 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1F ZINC000771730118 737750250 /nfs/dbraw/zinc/75/02/50/737750250.db2.gz BEBIBRNAXXHZTD-CHWSQXEVSA-N 1 1 373.450 2.584 20 5 FFBDMO C[C@H]1[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000922226256 738108070 /nfs/dbraw/zinc/10/80/70/738108070.db2.gz USWXYTVQZPSAJK-TVQRCGJNSA-N 1 1 360.336 2.505 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879939 738134872 /nfs/dbraw/zinc/13/48/72/738134872.db2.gz MGIHIWQYJBXFGN-QWHCGFSZSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879939 738134877 /nfs/dbraw/zinc/13/48/77/738134877.db2.gz MGIHIWQYJBXFGN-QWHCGFSZSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C1([N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000776591890 738212160 /nfs/dbraw/zinc/21/21/60/738212160.db2.gz QVKFZNZCEJMLPS-MRXNPFEDSA-N 1 1 350.415 2.826 20 5 FFBDMO CCOC(=O)C1([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000776591890 738212165 /nfs/dbraw/zinc/21/21/65/738212165.db2.gz QVKFZNZCEJMLPS-MRXNPFEDSA-N 1 1 350.415 2.826 20 5 FFBDMO CCOC(=O)C1([N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000776591889 738212283 /nfs/dbraw/zinc/21/22/83/738212283.db2.gz QVKFZNZCEJMLPS-INIZCTEOSA-N 1 1 350.415 2.826 20 5 FFBDMO CCOC(=O)C1([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000776591889 738212284 /nfs/dbraw/zinc/21/22/84/738212284.db2.gz QVKFZNZCEJMLPS-INIZCTEOSA-N 1 1 350.415 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c1 ZINC000923333075 738272079 /nfs/dbraw/zinc/27/20/79/738272079.db2.gz TWKSDSDLYWDOPA-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(CN2CCC3(C2)CC[NH2+]CC3)c1 ZINC000923333075 738272084 /nfs/dbraw/zinc/27/20/84/738272084.db2.gz TWKSDSDLYWDOPA-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](C)C1CCCCC1 ZINC000777978020 738338169 /nfs/dbraw/zinc/33/81/69/738338169.db2.gz RIBOKWSUBOAGHB-UHFFFAOYSA-N 1 1 373.450 2.585 20 5 FFBDMO C[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000778231248 738365246 /nfs/dbraw/zinc/36/52/46/738365246.db2.gz FKQDNZCHWLLUPM-OLZOCXBDSA-N 1 1 355.385 2.923 20 5 FFBDMO C[C@H](CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000778237137 738365794 /nfs/dbraw/zinc/36/57/94/738365794.db2.gz SWUMTKQWJZSJRH-WDEREUQCSA-N 1 1 363.443 2.592 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546170 738976177 /nfs/dbraw/zinc/97/61/77/738976177.db2.gz NBWHLJPGIHJFMU-SUNKGSAMSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546170 738976180 /nfs/dbraw/zinc/97/61/80/738976180.db2.gz NBWHLJPGIHJFMU-SUNKGSAMSA-N 1 1 355.822 2.668 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000930160743 739066940 /nfs/dbraw/zinc/06/69/40/739066940.db2.gz XWUTVCFAISUQPK-ZDUSSCGKSA-N 1 1 368.821 2.623 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000787588603 739149087 /nfs/dbraw/zinc/14/90/87/739149087.db2.gz CYNHHNBFCKWMBU-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000931296832 739239886 /nfs/dbraw/zinc/23/98/86/739239886.db2.gz ALAMZDJIFJOQFB-GXFFZTMASA-N 1 1 370.862 2.950 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@H](C)O1 ZINC000788565881 739259024 /nfs/dbraw/zinc/25/90/24/739259024.db2.gz NSMHGUTVTDLSCE-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@H](C)O1 ZINC000788565881 739259027 /nfs/dbraw/zinc/25/90/27/739259027.db2.gz NSMHGUTVTDLSCE-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)s1 ZINC000932663228 739487421 /nfs/dbraw/zinc/48/74/21/739487421.db2.gz HCDVOLYZCZMNCJ-SNVBAGLBSA-N 1 1 353.425 2.889 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)s1 ZINC000932663228 739487424 /nfs/dbraw/zinc/48/74/24/739487424.db2.gz HCDVOLYZCZMNCJ-SNVBAGLBSA-N 1 1 353.425 2.889 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000792087808 739637196 /nfs/dbraw/zinc/63/71/96/739637196.db2.gz GIVIKNIBJUSPLS-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934335795 739768421 /nfs/dbraw/zinc/76/84/21/739768421.db2.gz KPCZKJSHSRXJGO-ZDUSSCGKSA-N 1 1 360.439 2.579 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934335795 739768425 /nfs/dbraw/zinc/76/84/25/739768425.db2.gz KPCZKJSHSRXJGO-ZDUSSCGKSA-N 1 1 360.439 2.579 20 5 FFBDMO CN(C)[S@](C)(=O)=NCC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000934758109 739833955 /nfs/dbraw/zinc/83/39/55/739833955.db2.gz ZTMBMLKQDUQNAW-RUZDIDTESA-N 1 1 372.466 2.520 20 5 FFBDMO C[N@H+](CC1CC1)CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795413887 740018362 /nfs/dbraw/zinc/01/83/62/740018362.db2.gz WSAMSWGBJOFKAO-UHFFFAOYSA-N 1 1 354.204 2.612 20 5 FFBDMO C[N@@H+](CC1CC1)CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795413887 740018365 /nfs/dbraw/zinc/01/83/65/740018365.db2.gz WSAMSWGBJOFKAO-UHFFFAOYSA-N 1 1 354.204 2.612 20 5 FFBDMO Cc1cc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc(Cl)n1 ZINC000797602940 740259001 /nfs/dbraw/zinc/25/90/01/740259001.db2.gz YSEUCLWABORWFO-UHFFFAOYSA-N 1 1 369.830 2.515 20 5 FFBDMO C[N@H+]1CCN(CCNc2cc(Br)ccc2[N+](=O)[O-])CC1(C)C ZINC000799325780 740408678 /nfs/dbraw/zinc/40/86/78/740408678.db2.gz KWPOHWGKIMFBAB-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO COC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965028 741367575 /nfs/dbraw/zinc/36/75/75/741367575.db2.gz XVGUMENCUAWBBA-AWEZNQCLSA-N 1 1 365.213 2.959 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000816835907 742065006 /nfs/dbraw/zinc/06/50/06/742065006.db2.gz XSTGPTPJQRMBDY-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000816835907 742065015 /nfs/dbraw/zinc/06/50/15/742065015.db2.gz XSTGPTPJQRMBDY-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO O=C(NCC1CC[NH+](CCC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001399607 742118874 /nfs/dbraw/zinc/11/88/74/742118874.db2.gz LMQGGDWXGXTDHB-QZTJIDSGSA-N 1 1 351.491 2.840 20 5 FFBDMO O=C(NC1CC[NH+](CCCc2ccccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002789028 742173923 /nfs/dbraw/zinc/17/39/23/742173923.db2.gz QWJKFAWTJWKICA-NVXWUHKLSA-N 1 1 365.861 2.518 20 5 FFBDMO Cc1cccc(F)c1C[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000819113330 742338530 /nfs/dbraw/zinc/33/85/30/742338530.db2.gz OUFHVEFKTBACDY-UHFFFAOYSA-N 1 1 352.387 2.606 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034642894 742927441 /nfs/dbraw/zinc/92/74/41/742927441.db2.gz HKBIOYZZCCOPLV-IXYNUQLISA-N 1 1 369.824 2.661 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034644027 742928587 /nfs/dbraw/zinc/92/85/87/742928587.db2.gz YLHUROOXPAVUAV-QBPKDAKJSA-N 1 1 365.861 2.831 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CCC[N@@H+](CCCO)C1 ZINC000824583173 743111242 /nfs/dbraw/zinc/11/12/42/743111242.db2.gz IQPUCBIRMLPYET-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CCC[N@H+](CCCO)C1 ZINC000824583173 743111247 /nfs/dbraw/zinc/11/12/47/743111247.db2.gz IQPUCBIRMLPYET-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]CC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048606629 743414568 /nfs/dbraw/zinc/41/45/68/743414568.db2.gz ADLYZEQUAXLGIK-BRSBDYLESA-N 1 1 351.491 2.744 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000831159550 745492843 /nfs/dbraw/zinc/49/28/43/745492843.db2.gz WTGLYMFSMYURSH-JGGQBBKZSA-N 1 1 367.833 2.812 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](CO)CC(C)(C)C ZINC000832093812 745635333 /nfs/dbraw/zinc/63/53/33/745635333.db2.gz JKFGLKUKSQSASV-CYBMUJFWSA-N 1 1 355.410 2.791 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000839106001 746775749 /nfs/dbraw/zinc/77/57/49/746775749.db2.gz ZGIAADXVXYTMFI-CRAIPNDOSA-N 1 1 350.415 2.682 20 5 FFBDMO C[C@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000839193656 746799017 /nfs/dbraw/zinc/79/90/17/746799017.db2.gz UTOPNICWQMKRNZ-LLVKDONJSA-N 1 1 353.375 2.913 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000839193656 746799020 /nfs/dbraw/zinc/79/90/20/746799020.db2.gz UTOPNICWQMKRNZ-LLVKDONJSA-N 1 1 353.375 2.913 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1C1(O)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839619467 746873569 /nfs/dbraw/zinc/87/35/69/746873569.db2.gz WXKFNDQDBBMBFP-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@H]1C1(O)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839619467 746873575 /nfs/dbraw/zinc/87/35/75/746873575.db2.gz WXKFNDQDBBMBFP-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000839641337 746879382 /nfs/dbraw/zinc/87/93/82/746879382.db2.gz RVTLEVBUAJNBFZ-LSDHHAIUSA-N 1 1 359.813 2.949 20 5 FFBDMO Cc1[nH+]ccn1CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000840526830 747116324 /nfs/dbraw/zinc/11/63/24/747116324.db2.gz JQNGPQWKNTZWKQ-CYBMUJFWSA-N 1 1 360.267 2.659 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](CC)CO1 ZINC000844388416 748019213 /nfs/dbraw/zinc/01/92/13/748019213.db2.gz YWMSPDDYQLJDQT-TZMCWYRMSA-N 1 1 353.394 2.952 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000844640413 748062197 /nfs/dbraw/zinc/06/21/97/748062197.db2.gz HIHULKSWUCLNLS-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000844903341 748133369 /nfs/dbraw/zinc/13/33/69/748133369.db2.gz XQEUCXROZXHCAV-MJEQTWJJSA-N 1 1 353.850 2.967 20 5 FFBDMO CC[C@@H](CSC)[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483501 748937738 /nfs/dbraw/zinc/93/77/38/748937738.db2.gz IIOYSEWZTACRQG-HOCLYGCPSA-N 1 1 351.472 2.942 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852019015 749752458 /nfs/dbraw/zinc/75/24/58/749752458.db2.gz SUCRCKCBBGVETF-INIZCTEOSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852019015 749752462 /nfs/dbraw/zinc/75/24/62/749752462.db2.gz SUCRCKCBBGVETF-INIZCTEOSA-N 1 1 354.407 2.628 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000852167703 749791970 /nfs/dbraw/zinc/79/19/70/749791970.db2.gz YVKVIQSHWSUYAJ-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000044564360 845095988 /nfs/dbraw/zinc/09/59/88/845095988.db2.gz DJIOJIZONJEASN-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872281722 1013200990 /nfs/dbraw/zinc/20/09/90/1013200990.db2.gz YLIOHUBPBWPKIM-WBVHZDCISA-N 1 1 364.442 2.758 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000175817801 961594949 /nfs/dbraw/zinc/59/49/49/961594949.db2.gz JYWXCGZGCWWVKK-UHFFFAOYSA-N 1 1 361.358 2.527 20 5 FFBDMO COc1ccc(OC)c(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000126120839 963370327 /nfs/dbraw/zinc/37/03/27/963370327.db2.gz PZWBSQVNIYFSJO-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cccc(F)c2Cl)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001482218037 964147114 /nfs/dbraw/zinc/14/71/14/964147114.db2.gz HLSIIPXXSQLLBV-TZMCWYRMSA-N 1 1 369.824 2.663 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]Cc2ccc(CF)cc2)CC1 ZINC001269858740 964372586 /nfs/dbraw/zinc/37/25/86/964372586.db2.gz CJNMNPVHHFCETF-QZTJIDSGSA-N 1 1 363.433 2.540 20 5 FFBDMO COc1c(O)ccc(C[N@H+](CCO)[C@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000892043368 965875762 /nfs/dbraw/zinc/87/57/62/965875762.db2.gz WXTQCRGRKLWYPO-INIZCTEOSA-N 1 1 358.394 2.791 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000892043368 965875771 /nfs/dbraw/zinc/87/57/71/965875771.db2.gz WXTQCRGRKLWYPO-INIZCTEOSA-N 1 1 358.394 2.791 20 5 FFBDMO C/C(=C/C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785109942 966003268 /nfs/dbraw/zinc/00/32/68/966003268.db2.gz QRQRLSJDFBWYFM-REJXWNQVSA-N 1 1 361.442 2.614 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCC2(CC2)CC1 ZINC001267256907 967485256 /nfs/dbraw/zinc/48/52/56/967485256.db2.gz HQOFJOZPEQSIEY-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC2(CC2)CC1 ZINC001267256907 967485261 /nfs/dbraw/zinc/48/52/61/967485261.db2.gz HQOFJOZPEQSIEY-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC2(CC2)CC1 ZINC001267256907 967485265 /nfs/dbraw/zinc/48/52/65/967485265.db2.gz HQOFJOZPEQSIEY-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901679 968104302 /nfs/dbraw/zinc/10/43/02/968104302.db2.gz CODVXQRPHGCTAW-HNNXBMFYSA-N 1 1 359.430 2.530 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825827646 1014092202 /nfs/dbraw/zinc/09/22/02/1014092202.db2.gz WZOYLLWBUYIQMR-YOEHRIQHSA-N 1 1 363.458 2.645 20 5 FFBDMO CC(C)(C)Oc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-] ZINC000897221804 973460757 /nfs/dbraw/zinc/46/07/57/973460757.db2.gz OWVNAUDDDQJVKT-CVEARBPZSA-N 1 1 363.458 2.808 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000178855236 978124436 /nfs/dbraw/zinc/12/44/36/978124436.db2.gz CKAJYHHWWBMEFZ-SJORKVTESA-N 1 1 358.394 2.790 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000877146267 1014489107 /nfs/dbraw/zinc/48/91/07/1014489107.db2.gz VLUKSQCCTFWZKN-VMBOVVBDSA-N 1 1 370.388 2.747 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)C ZINC000128963486 980366770 /nfs/dbraw/zinc/36/67/70/980366770.db2.gz ILZAXGAEDHDPKJ-UHFFFAOYSA-N 1 1 369.393 2.726 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccc(C3CC3)cc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963791897 1014766235 /nfs/dbraw/zinc/76/62/35/1014766235.db2.gz UKOXCUFGKQCWSB-JGQKGBITSA-N 1 1 369.465 2.746 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@@H](C)C1 ZINC000910270149 981879447 /nfs/dbraw/zinc/87/94/47/981879447.db2.gz KXVPDQBLAKPZSF-ZDUSSCGKSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[N@@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000910270149 981879459 /nfs/dbraw/zinc/87/94/59/981879459.db2.gz KXVPDQBLAKPZSF-ZDUSSCGKSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000910270149 981879467 /nfs/dbraw/zinc/87/94/67/981879467.db2.gz KXVPDQBLAKPZSF-ZDUSSCGKSA-N 1 1 357.414 2.541 20 5 FFBDMO CC(C)(CC[NH+]1CCOCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000912953570 984157188 /nfs/dbraw/zinc/15/71/88/984157188.db2.gz GBCDJPKPSAGLCX-UHFFFAOYSA-N 1 1 361.398 2.572 20 5 FFBDMO CC[N@H+](CCc1ccccn1)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000764315326 984417676 /nfs/dbraw/zinc/41/76/76/984417676.db2.gz NSSFLZVACYORJH-CQSZACIVSA-N 1 1 372.425 2.890 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000764315326 984417678 /nfs/dbraw/zinc/41/76/78/984417678.db2.gz NSSFLZVACYORJH-CQSZACIVSA-N 1 1 372.425 2.890 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000056315374 984432903 /nfs/dbraw/zinc/43/29/03/984432903.db2.gz XHYQAOKKDSZJRX-CQSZACIVSA-N 1 1 365.430 2.963 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000056315374 984432904 /nfs/dbraw/zinc/43/29/04/984432904.db2.gz XHYQAOKKDSZJRX-CQSZACIVSA-N 1 1 365.430 2.963 20 5 FFBDMO O=C(NC1(C2CC[NH+](CCCc3ccccc3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000151233 986725866 /nfs/dbraw/zinc/72/58/66/986725866.db2.gz SKTBXZLHQHXCQE-RTBURBONSA-N 1 1 371.481 2.645 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@@H](O)COCc1ccccc1 ZINC000114462505 987739627 /nfs/dbraw/zinc/73/96/27/987739627.db2.gz LIBILNCIWSUAMQ-GOSISDBHSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](O)COCc1ccccc1 ZINC000114462505 987739632 /nfs/dbraw/zinc/73/96/32/987739632.db2.gz LIBILNCIWSUAMQ-GOSISDBHSA-N 1 1 360.410 2.613 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000370061886 987984796 /nfs/dbraw/zinc/98/47/96/987984796.db2.gz IACAHHQJSKOHJR-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000915469773 988589101 /nfs/dbraw/zinc/58/91/01/988589101.db2.gz SZANSESFTGEWJL-CQSZACIVSA-N 1 1 358.398 2.812 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc3c(c2)ncn3C)c([N+](=O)[O-])cc1OC ZINC000922481054 988624182 /nfs/dbraw/zinc/62/41/82/988624182.db2.gz BAHSAJWFXKQBRD-UHFFFAOYSA-N 1 1 356.382 2.789 20 5 FFBDMO CCN(C(=O)C[NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000922477249 988628215 /nfs/dbraw/zinc/62/82/15/988628215.db2.gz YNKKWMCFFSXCIK-UHFFFAOYSA-N 1 1 373.409 2.755 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001005374157 989740258 /nfs/dbraw/zinc/74/02/58/989740258.db2.gz CABXMSPTQYRKTP-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO COc1ccc([C@H]2CC[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000154554431 990293008 /nfs/dbraw/zinc/29/30/08/990293008.db2.gz LPVXGMWAQKOVSP-AWEZNQCLSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000154554431 990293018 /nfs/dbraw/zinc/29/30/18/990293018.db2.gz LPVXGMWAQKOVSP-AWEZNQCLSA-N 1 1 369.377 2.958 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000923310611 991063492 /nfs/dbraw/zinc/06/34/92/991063492.db2.gz LJKHRRSRIRXKMQ-DLBZAZTESA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H]1CCC[N@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237669972 991300044 /nfs/dbraw/zinc/30/00/44/991300044.db2.gz LYBPNILWYICGRJ-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237669972 991300054 /nfs/dbraw/zinc/30/00/54/991300054.db2.gz LYBPNILWYICGRJ-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000068975457 991552729 /nfs/dbraw/zinc/55/27/29/991552729.db2.gz PQYRXDRKDJZNKF-KRWDZBQOSA-N 1 1 367.421 2.601 20 5 FFBDMO C[N@H+](Cc1ccc2cc[nH]c2c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000879725283 1015654823 /nfs/dbraw/zinc/65/48/23/1015654823.db2.gz XUEGNDGXMJUWFQ-MRXNPFEDSA-N 1 1 355.394 2.948 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267453 991727943 /nfs/dbraw/zinc/72/79/43/991727943.db2.gz PKBXXNBFBQHASF-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267453 991727954 /nfs/dbraw/zinc/72/79/54/991727954.db2.gz PKBXXNBFBQHASF-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810844091 994951409 /nfs/dbraw/zinc/95/14/09/994951409.db2.gz ZZGGYGNEJDKQIM-HUUCEWRRSA-N 1 1 356.382 2.564 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851779 995554098 /nfs/dbraw/zinc/55/40/98/995554098.db2.gz ZAOFRHXBPWJBEL-RIFZZMRRSA-N 1 1 374.437 2.779 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1COc2ccccc21 ZINC000813170582 995632286 /nfs/dbraw/zinc/63/22/86/995632286.db2.gz IBCORCOEAWJONM-WMZOPIPTSA-N 1 1 368.389 2.889 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1COc2ccccc21 ZINC000813170582 995632291 /nfs/dbraw/zinc/63/22/91/995632291.db2.gz IBCORCOEAWJONM-WMZOPIPTSA-N 1 1 368.389 2.889 20 5 FFBDMO C[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCOCC1 ZINC000813172633 995633602 /nfs/dbraw/zinc/63/36/02/995633602.db2.gz LTIXVDDMQXLDSS-KSSFIOAISA-N 1 1 362.426 2.775 20 5 FFBDMO C[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCOCC1 ZINC000813172633 995633605 /nfs/dbraw/zinc/63/36/05/995633605.db2.gz LTIXVDDMQXLDSS-KSSFIOAISA-N 1 1 362.426 2.775 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271089 995916115 /nfs/dbraw/zinc/91/61/15/995916115.db2.gz SXOMQJCKKUTJES-ZIAGYGMSSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271089 995916109 /nfs/dbraw/zinc/91/61/09/995916109.db2.gz SXOMQJCKKUTJES-ZIAGYGMSSA-N 1 1 359.220 2.593 20 5 FFBDMO COc1ccc(CC(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000825182268 997243303 /nfs/dbraw/zinc/24/33/03/997243303.db2.gz ZOZVPLWKRSAFOO-KRWDZBQOSA-N 1 1 369.421 2.627 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCCC[C@H]1C ZINC000825460550 997386716 /nfs/dbraw/zinc/38/67/16/997386716.db2.gz AHPAKNJVZGSREG-OLZOCXBDSA-N 1 1 366.437 2.793 20 5 FFBDMO Cc1c(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000731991715 998400755 /nfs/dbraw/zinc/40/07/55/998400755.db2.gz WABKBDKIRSOBHG-UHFFFAOYSA-N 1 1 368.309 2.644 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000822443961 998874696 /nfs/dbraw/zinc/87/46/96/998874696.db2.gz UBLSSAWWZPCRCB-JTQLQIEISA-N 1 1 355.797 2.944 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C ZINC000741019623 999703013 /nfs/dbraw/zinc/70/30/13/999703013.db2.gz WMVZOZORCFJOHP-MCIONIFRSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1c(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000741579293 999732435 /nfs/dbraw/zinc/73/24/35/999732435.db2.gz LBKYRFSFRUIMJM-YGRLFVJLSA-N 1 1 364.402 2.532 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000745085793 999891175 /nfs/dbraw/zinc/89/11/75/999891175.db2.gz GBWWCHVSAOIRRZ-CZUORRHYSA-N 1 1 363.414 2.585 20 5 FFBDMO COc1ccc(OCCOC(=O)[C@@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000745091359 999892006 /nfs/dbraw/zinc/89/20/06/999892006.db2.gz GMMATVMQCANJCV-HZSPNIEDSA-N 1 1 366.414 2.787 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000746307287 999958417 /nfs/dbraw/zinc/95/84/17/999958417.db2.gz XGCXIVIBCMHHEW-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Cc1nn(CN2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000766376520 999989881 /nfs/dbraw/zinc/98/98/81/999989881.db2.gz NZJJPPXONHQCEJ-CABCVRRESA-N 1 1 357.458 2.960 20 5 FFBDMO CC(C)(C)OC(=O)N1CC([C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169014444 1000015522 /nfs/dbraw/zinc/01/55/22/1000015522.db2.gz ZVDFNZMKEUNOPR-LZWOXQAQSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011964 1000015576 /nfs/dbraw/zinc/01/55/76/1000015576.db2.gz NYYQCMDXDIIWTO-JONQDZQNSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011814 1000015705 /nfs/dbraw/zinc/01/57/05/1000015705.db2.gz MLGMBZGUDFVQEU-RVKKMQEKSA-N 1 1 353.463 2.907 20 5 FFBDMO CCOC(=O)C[N@H+](Cc1ccc(OC)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038241 1000017054 /nfs/dbraw/zinc/01/70/54/1000017054.db2.gz XIBAIIKFMDZTGD-HZPDHXFCSA-N 1 1 350.415 2.506 20 5 FFBDMO CCOC(=O)C[N@@H+](Cc1ccc(OC)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038241 1000017055 /nfs/dbraw/zinc/01/70/55/1000017055.db2.gz XIBAIIKFMDZTGD-HZPDHXFCSA-N 1 1 350.415 2.506 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCN(Cc3ccncc3)c3ncccc3C2)C1 ZINC001169019626 1000017514 /nfs/dbraw/zinc/01/75/14/1000017514.db2.gz GYPXVDAEUCDBIS-IEBWSBKVSA-N 1 1 367.453 2.744 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+](C2CC2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169048692 1000018676 /nfs/dbraw/zinc/01/86/76/1000018676.db2.gz APTKGIJMMDTWNL-CWRNSKLLSA-N 1 1 353.463 2.906 20 5 FFBDMO CC(C)[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H](O)COc1ccccc1 ZINC000770044654 1000663338 /nfs/dbraw/zinc/66/33/38/1000663338.db2.gz RHXJSRSMLDLSKA-ICSRJNTNSA-N 1 1 374.437 2.779 20 5 FFBDMO CC(C)[N@@H+](C)[C@@H]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C1 ZINC001157021915 1001331779 /nfs/dbraw/zinc/33/17/79/1001331779.db2.gz RZUQGGWEYPEXJV-MRVPVSSYSA-N 1 1 367.759 2.976 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000789521872 1002107218 /nfs/dbraw/zinc/10/72/18/1002107218.db2.gz UJFZAZBXQLXOGE-AWEZNQCLSA-N 1 1 359.430 2.591 20 5 FFBDMO C/C(=C/C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790121838 1002291032 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DIRPAAJJFPDALI-HXUWFJFHSA-N 1 1 354.406 2.932 20 5 FFBDMO C[N@@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC001133923546 1006041263 /nfs/dbraw/zinc/04/12/63/1006041263.db2.gz PMMKCHDCZQGCBN-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO C[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC001133923546 1006041276 /nfs/dbraw/zinc/04/12/76/1006041276.db2.gz PMMKCHDCZQGCBN-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000813824384 1006046172 /nfs/dbraw/zinc/04/61/72/1006046172.db2.gz YCAFVTAHLDVJSP-PXAZEXFGSA-N 1 1 372.400 2.709 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001134056744 1006107924 /nfs/dbraw/zinc/10/79/24/1006107924.db2.gz UCQZAMIFZDTDPL-INIZCTEOSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001134056744 1006107929 /nfs/dbraw/zinc/10/79/29/1006107929.db2.gz UCQZAMIFZDTDPL-INIZCTEOSA-N 1 1 371.441 2.583 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000882041733 1006285463 /nfs/dbraw/zinc/28/54/63/1006285463.db2.gz DCFATUKTFYITRL-OAHLLOKOSA-N 1 1 372.469 2.655 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499104 1006414918 /nfs/dbraw/zinc/41/49/18/1006414918.db2.gz IRNCLZAGVWWQEH-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499104 1006414922 /nfs/dbraw/zinc/41/49/22/1006414922.db2.gz IRNCLZAGVWWQEH-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[N@@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000853655283 1006494167 /nfs/dbraw/zinc/49/41/67/1006494167.db2.gz DWXZELXOLRKZAH-UHFFFAOYSA-N 1 1 361.442 2.765 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000853796098 1006539193 /nfs/dbraw/zinc/53/91/93/1006539193.db2.gz RFJKCVQRMUTFTN-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO Cc1cc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000111631326 1006544875 /nfs/dbraw/zinc/54/48/75/1006544875.db2.gz BQHBKYRPYICCOK-AWEZNQCLSA-N 1 1 356.426 2.736 20 5 FFBDMO COCCn1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815616726 1006713930 /nfs/dbraw/zinc/71/39/30/1006713930.db2.gz WWOQNWUVIRHRML-BLLLJJGKSA-N 1 1 359.430 2.748 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCC[NH+]3CC=CC3)cc2[N+](=O)[O-])C1 ZINC001116195176 1032184601 /nfs/dbraw/zinc/18/46/01/1032184601.db2.gz FCHFEDCSBUTGDD-HZPDHXFCSA-N 1 1 372.469 2.679 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000855166198 1007149374 /nfs/dbraw/zinc/14/93/74/1007149374.db2.gz FHACLQSDWVSFDC-OAHLLOKOSA-N 1 1 360.458 2.798 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C)n3)C2)ccn1 ZINC000856533273 1007873804 /nfs/dbraw/zinc/87/38/04/1007873804.db2.gz COCZSWMJNNGUPA-QGZVFWFLSA-N 1 1 371.441 2.803 20 5 FFBDMO 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COc1ncnc2c1CC[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172908246 1012081146 /nfs/dbraw/zinc/08/11/46/1012081146.db2.gz MXPRSSGKGBPHFW-INIZCTEOSA-N 1 1 368.437 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCN3CC(F)(F)C[C@H]3C1)CC2 ZINC001172922469 1012102325 /nfs/dbraw/zinc/10/23/25/1012102325.db2.gz XZYXFOBDQVRXDK-WBVHZDCISA-N 1 1 351.397 2.867 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000870121921 1012168148 /nfs/dbraw/zinc/16/81/48/1012168148.db2.gz FADQTYONIACBSI-CYBMUJFWSA-N 1 1 372.400 2.835 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@@H](O)CC3)CC2)c(F)c1 ZINC001173009252 1012176373 /nfs/dbraw/zinc/17/63/73/1012176373.db2.gz AJIHWWKDFDRCRC-CQSZACIVSA-N 1 1 355.385 2.689 20 5 FFBDMO C[C@@H]1[C@H](CO)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010239 1012179424 /nfs/dbraw/zinc/17/94/24/1012179424.db2.gz OQZMTEOLWMDTFY-NEPJUHHUSA-N 1 1 355.385 2.545 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N3CC[N@H+]4CCC[C@H]4C3)CC2)c(F)c1 ZINC001173013389 1012184474 /nfs/dbraw/zinc/18/44/74/1012184474.db2.gz RSZTTZUQVRJJBP-AWEZNQCLSA-N 1 1 366.412 2.622 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)c1F ZINC001173183576 1012326910 /nfs/dbraw/zinc/32/69/10/1012326910.db2.gz ZNYLEGPWNFOWLT-OTYXRUKQSA-N 1 1 366.311 2.673 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@@](O)(C(F)(F)F)C2)c1F ZINC001173183576 1012326925 /nfs/dbraw/zinc/32/69/25/1012326925.db2.gz ZNYLEGPWNFOWLT-OTYXRUKQSA-N 1 1 366.311 2.673 20 5 FFBDMO CC[N@@H+](CCn1cccn1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173195111 1012337116 /nfs/dbraw/zinc/33/71/16/1012337116.db2.gz BZCBEQAVKOKLOX-CYBMUJFWSA-N 1 1 350.394 2.892 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@@H]2COC ZINC001173222004 1012352446 /nfs/dbraw/zinc/35/24/46/1012352446.db2.gz OHHDORIDGHJYAG-GDBMZVCRSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@@H]2COC ZINC001173222004 1012352460 /nfs/dbraw/zinc/35/24/60/1012352460.db2.gz OHHDORIDGHJYAG-GDBMZVCRSA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870863288 1012609024 /nfs/dbraw/zinc/60/90/24/1012609024.db2.gz XWKQVVODOXSQQC-MJGOQNOKSA-N 1 1 373.384 2.508 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC[C@H]21 ZINC000827330624 1017640657 /nfs/dbraw/zinc/64/06/57/1017640657.db2.gz QBULSIVHDZNGPY-XJKSGUPXSA-N 1 1 372.450 2.885 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC001072725508 1020294523 /nfs/dbraw/zinc/29/45/23/1020294523.db2.gz NTWBHYBOLOHJRO-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725508 1020294532 /nfs/dbraw/zinc/29/45/32/1020294532.db2.gz NTWBHYBOLOHJRO-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725508 1020294539 /nfs/dbraw/zinc/29/45/39/1020294539.db2.gz NTWBHYBOLOHJRO-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C(=O)OC(C)(C)C ZINC000828917415 1032904789 /nfs/dbraw/zinc/90/47/89/1032904789.db2.gz GNKMNPSRINAPKF-XYPHTWIQSA-N 1 1 364.442 2.928 20 5 FFBDMO COc1cc([C@@H](C)NC2CC[NH+](C[C@@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096358 1020674295 /nfs/dbraw/zinc/67/42/95/1020674295.db2.gz BSSKFJZWTWLEJT-KDOFPFPSSA-N 1 1 363.458 2.897 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136304 1020716848 /nfs/dbraw/zinc/71/68/48/1020716848.db2.gz ZNHYRLMITFNVTJ-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136304 1020716856 /nfs/dbraw/zinc/71/68/56/1020716856.db2.gz ZNHYRLMITFNVTJ-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749944953 1021155142 /nfs/dbraw/zinc/15/51/42/1021155142.db2.gz MVQFOQZUMYVJBI-UHFFFAOYSA-N 1 1 371.397 2.625 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749944953 1021155149 /nfs/dbraw/zinc/15/51/49/1021155149.db2.gz MVQFOQZUMYVJBI-UHFFFAOYSA-N 1 1 371.397 2.625 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[NH+]3CCC(Cn4ccnn4)CC3)c2c1 ZINC000157021935 1022410343 /nfs/dbraw/zinc/41/03/43/1022410343.db2.gz HJPBYSHJKDQXQC-UHFFFAOYSA-N 1 1 374.426 2.833 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC001118913025 1022471183 /nfs/dbraw/zinc/47/11/83/1022471183.db2.gz HZAKGEFNYUKKIY-ZDUSSCGKSA-N 1 1 357.414 2.996 20 5 FFBDMO O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020140414 1022564543 /nfs/dbraw/zinc/56/45/43/1022564543.db2.gz GMUFTRYMLQOYAF-UAFMIMERSA-N 1 1 365.433 2.756 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000751935429 1022981548 /nfs/dbraw/zinc/98/15/48/1022981548.db2.gz VXNLYOZSQXXCAF-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000751935431 1022982169 /nfs/dbraw/zinc/98/21/69/1022982169.db2.gz VXNLYOZSQXXCAF-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC(C[N@@H+](C)C(C)C)CC1 ZINC001122822981 1023495623 /nfs/dbraw/zinc/49/56/23/1023495623.db2.gz MMKUMGGZSBWJMW-OAHLLOKOSA-N 1 1 366.510 2.828 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@@H](C3CCOCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000754786546 1023517723 /nfs/dbraw/zinc/51/77/23/1023517723.db2.gz VROQFGMDRFJRBZ-MRXNPFEDSA-N 1 1 374.441 2.543 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1C[N@@H+](C)CCN1C ZINC001120959330 1023544601 /nfs/dbraw/zinc/54/46/01/1023544601.db2.gz IHHWXLLDRPUTAB-BBRMVZONSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1CN(C)CC[N@@H+]1C ZINC001120959330 1023544602 /nfs/dbraw/zinc/54/46/02/1023544602.db2.gz IHHWXLLDRPUTAB-BBRMVZONSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@@H]1CN(C)CC[N@H+]1C ZINC001120959330 1023544603 /nfs/dbraw/zinc/54/46/03/1023544603.db2.gz IHHWXLLDRPUTAB-BBRMVZONSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1CN(C)CC[N@@H+]1C ZINC001120960111 1023544652 /nfs/dbraw/zinc/54/46/52/1023544652.db2.gz QUJIQTBXFLJSOU-MLGOLLRUSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1CN(C)CC[N@H+]1C ZINC001120960111 1023544657 /nfs/dbraw/zinc/54/46/57/1023544657.db2.gz QUJIQTBXFLJSOU-MLGOLLRUSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1C[N@H+](C)CCN1C ZINC001120960111 1023544665 /nfs/dbraw/zinc/54/46/65/1023544665.db2.gz QUJIQTBXFLJSOU-MLGOLLRUSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1C[N@@H+](C)CCN1C ZINC001120960111 1023544672 /nfs/dbraw/zinc/54/46/72/1023544672.db2.gz QUJIQTBXFLJSOU-MLGOLLRUSA-N 1 1 361.471 2.765 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000193704922 1024643391 /nfs/dbraw/zinc/64/33/91/1024643391.db2.gz BJNDAPMEDNSJFJ-UHFFFAOYSA-N 1 1 372.381 2.673 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)C[NH+]1CCOCC1 ZINC001218704876 1033291249 /nfs/dbraw/zinc/29/12/49/1033291249.db2.gz QLYMEMGLSYBFLA-LLVKDONJSA-N 1 1 370.837 2.646 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)C[NH+]1CCOCC1 ZINC001218704878 1033291276 /nfs/dbraw/zinc/29/12/76/1033291276.db2.gz QLYMEMGLSYBFLA-NSHDSACASA-N 1 1 370.837 2.646 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000839097172 1026588125 /nfs/dbraw/zinc/58/81/25/1026588125.db2.gz DEMGKYZKKXCPBN-QRVBRYPASA-N 1 1 370.405 2.517 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000839101362 1026591475 /nfs/dbraw/zinc/59/14/75/1026591475.db2.gz WZJYWPXXVDUSKW-QRVBRYPASA-N 1 1 370.405 2.517 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001159187696 1027301166 /nfs/dbraw/zinc/30/11/66/1027301166.db2.gz CCYCYSMUCQMXGL-XDSKUXDFSA-N 1 1 363.417 2.855 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC=C(c4ccncc4)C3)n2)cc1 ZINC000795739297 1028078425 /nfs/dbraw/zinc/07/84/25/1028078425.db2.gz WRQQKRMHPBNOBI-UHFFFAOYSA-N 1 1 362.393 2.995 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC=C(c4ccncc4)C3)n2)cc1 ZINC000795739297 1028078445 /nfs/dbraw/zinc/07/84/45/1028078445.db2.gz WRQQKRMHPBNOBI-UHFFFAOYSA-N 1 1 362.393 2.995 20 5 FFBDMO COc1ccc(OC)c([C@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000796110450 1028473673 /nfs/dbraw/zinc/47/36/73/1028473673.db2.gz CWGALJCHDYRLFV-GOSISDBHSA-N 1 1 360.410 2.820 20 5 FFBDMO COc1c(C)c[nH+]c(CCCOC(=O)c2ccc(N)c([N+](=O)[O-])c2)c1C ZINC000780599318 1028744013 /nfs/dbraw/zinc/74/40/13/1028744013.db2.gz CYQNFRVPYQKCEE-UHFFFAOYSA-N 1 1 359.382 2.987 20 5 FFBDMO CC(C)(C)c1ccc(NCc2cc(=O)n3c(n2)C[NH2+]CCC3)c([N+](=O)[O-])c1 ZINC001163118450 1028805439 /nfs/dbraw/zinc/80/54/39/1028805439.db2.gz UIHYETLIWRGCRY-UHFFFAOYSA-N 1 1 371.441 2.554 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001156318187 1029143419 /nfs/dbraw/zinc/14/34/19/1029143419.db2.gz QBMZISQPEFCCKX-OKZBNKHCSA-N 1 1 368.437 2.859 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1cc([N+](=O)[O-])cc[n+]1[O-] ZINC001156332114 1029149960 /nfs/dbraw/zinc/14/99/60/1029149960.db2.gz DJOKKRVZWNATSW-YJBOKZPZSA-N 1 1 356.426 2.575 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC001164124143 1029179443 /nfs/dbraw/zinc/17/94/43/1029179443.db2.gz BNEGHRNHAWOFPK-CMPLNLGQSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001164124143 1029179451 /nfs/dbraw/zinc/17/94/51/1029179451.db2.gz BNEGHRNHAWOFPK-CMPLNLGQSA-N 1 1 373.276 2.744 20 5 FFBDMO Cn1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc([N+](=O)[O-])c1=O ZINC001164491802 1029298700 /nfs/dbraw/zinc/29/87/00/1029298700.db2.gz GKNLCTLIEWJBHX-RYQLBKOJSA-N 1 1 368.437 2.616 20 5 FFBDMO COc1cc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)ncc1[N+](=O)[O-] ZINC001165086718 1029374845 /nfs/dbraw/zinc/37/48/45/1029374845.db2.gz OBMGJZQUKRTGPO-WBVHZDCISA-N 1 1 354.410 2.709 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782509784 1029725934 /nfs/dbraw/zinc/72/59/34/1029725934.db2.gz QVRDQORDRXMNDS-KGLIPLIRSA-N 1 1 366.437 2.867 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C ZINC000782509784 1029725942 /nfs/dbraw/zinc/72/59/42/1029725942.db2.gz QVRDQORDRXMNDS-KGLIPLIRSA-N 1 1 366.437 2.867 20 5 FFBDMO Cc1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)cn2cc[nH+]c12 ZINC001534366912 1069638629 /nfs/dbraw/zinc/63/86/29/1069638629.db2.gz FAXSYEFHGZGCIT-UHFFFAOYSA-N 1 1 368.349 2.965 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001142303915 1030288489 /nfs/dbraw/zinc/28/84/89/1030288489.db2.gz WQFDCPSJKCYXSA-JQWIXIFHSA-N 1 1 363.805 2.537 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@H+](Cn2cc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1 ZINC000842620179 1030834214 /nfs/dbraw/zinc/83/42/14/1030834214.db2.gz MGXYJJGKSWFLIS-DLBZAZTESA-N 1 1 372.425 2.806 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@@H+](Cn2cc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1 ZINC000842620179 1030834233 /nfs/dbraw/zinc/83/42/33/1030834233.db2.gz MGXYJJGKSWFLIS-DLBZAZTESA-N 1 1 372.425 2.806 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000797530174 1031143880 /nfs/dbraw/zinc/14/38/80/1031143880.db2.gz PQLFLRLONXYTLZ-APWZRJJASA-N 1 1 369.421 2.613 20 5 FFBDMO Cc1ccc(C)c(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001115529233 1031786696 /nfs/dbraw/zinc/78/66/96/1031786696.db2.gz HMLZWDVELBCCER-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(Cl)s2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530849 1031789079 /nfs/dbraw/zinc/78/90/79/1031789079.db2.gz VCHMFGDSFUXXBZ-CHWSQXEVSA-N 1 1 371.890 2.975 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000830195824 1033503650 /nfs/dbraw/zinc/50/36/50/1033503650.db2.gz KDXZPHFLWBCSDF-HNNXBMFYSA-N 1 1 357.385 2.872 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCOCC1 ZINC000831609283 1034156244 /nfs/dbraw/zinc/15/62/44/1034156244.db2.gz BQAQMERSFNVIEC-UHFFFAOYSA-N 1 1 373.409 2.599 20 5 FFBDMO COc1cc(Br)c(O[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1 ZINC001226279332 1034609942 /nfs/dbraw/zinc/60/99/42/1034609942.db2.gz JMELJBPAVZJBGD-VIFPVBQESA-N 1 1 368.187 2.956 20 5 FFBDMO COc1cc(O[C@@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC001226579774 1034745597 /nfs/dbraw/zinc/74/55/97/1034745597.db2.gz USSPUCPGHXOVEC-ZIAGYGMSSA-N 1 1 358.398 2.998 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001227108097 1034937853 /nfs/dbraw/zinc/93/78/53/1034937853.db2.gz JRGCIWUKZUYQLV-OAHLLOKOSA-N 1 1 358.354 2.941 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)CC1 ZINC000834314909 1035361096 /nfs/dbraw/zinc/36/10/96/1035361096.db2.gz ROYHDINRSJRRGN-HNAYVOBHSA-N 1 1 372.469 2.607 20 5 FFBDMO C[NH+]1C(C)(C)CC(Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1(C)C ZINC001228602364 1036198958 /nfs/dbraw/zinc/19/89/58/1036198958.db2.gz AHFZSPDRTAWKGS-UHFFFAOYSA-N 1 1 350.419 2.998 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377407 1036639740 /nfs/dbraw/zinc/63/97/40/1036639740.db2.gz CWKRXDGMDPPCOQ-BZUAXINKSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377407 1036639744 /nfs/dbraw/zinc/63/97/44/1036639744.db2.gz CWKRXDGMDPPCOQ-BZUAXINKSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377407 1036639749 /nfs/dbraw/zinc/63/97/49/1036639749.db2.gz CWKRXDGMDPPCOQ-BZUAXINKSA-N 1 1 370.409 2.688 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2c3nccc4c5ccccc5n(c43)c(=O)c2OC)C1 ZINC001234718999 1037155160 /nfs/dbraw/zinc/15/51/60/1037155160.db2.gz WOZCBZIVTRBZQH-ZDUSSCGKSA-N 1 1 363.417 2.920 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cccc(Cl)c3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001230915312 1037405198 /nfs/dbraw/zinc/40/51/98/1037405198.db2.gz PNXZYKSFSXJVPU-HTTKSJEASA-N 1 1 354.790 2.794 20 5 FFBDMO NC(=O)[C@H]1C[N@@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)CCN1 ZINC001235753659 1037725578 /nfs/dbraw/zinc/72/55/78/1037725578.db2.gz AGGUDZBZBBYQRL-LJQANCHMSA-N 1 1 359.429 2.950 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H]2CC[C@@H](SC)C2)cc1[N+](=O)[O-] ZINC001255648838 1038101288 /nfs/dbraw/zinc/10/12/88/1038101288.db2.gz KNKDZHRVQCSYPC-UONOGXRCSA-N 1 1 368.455 2.863 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@](C)(O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092946 1038377522 /nfs/dbraw/zinc/37/75/22/1038377522.db2.gz BTHQBGBBDLZDSI-IBGZPJMESA-N 1 1 363.458 2.809 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](C)[C@@H](O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092914 1038377550 /nfs/dbraw/zinc/37/75/50/1038377550.db2.gz BAVBIQLQVUHDCF-KDOFPFPSSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCC[C@@](C)(O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093227 1038378776 /nfs/dbraw/zinc/37/87/76/1038378776.db2.gz IIIMGRMMOHYWMG-LJQANCHMSA-N 1 1 363.458 2.809 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(F)c([N+](=O)[O-])cc3F)o2)C[C@H](C)O1 ZINC001258138979 1039219129 /nfs/dbraw/zinc/21/91/29/1039219129.db2.gz PQGZBPOWGJOIMF-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2cccc3ccnn32)no1 ZINC001247673326 1039881194 /nfs/dbraw/zinc/88/11/94/1039881194.db2.gz OVHFUDJIPJIDSW-ZDUSSCGKSA-N 1 1 350.338 2.535 20 5 FFBDMO CN1C[C@@]2(CC1=O)CCCC[N@H+]2C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254473826 1040738723 /nfs/dbraw/zinc/73/87/23/1040738723.db2.gz CCUPOUPAEGDSMR-FQEVSTJZSA-N 1 1 372.469 2.650 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC[N@@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001254550986 1040791642 /nfs/dbraw/zinc/79/16/42/1040791642.db2.gz UXMUGNRTCIOWSM-PXNSSMCTSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001254550986 1040791666 /nfs/dbraw/zinc/79/16/66/1040791666.db2.gz UXMUGNRTCIOWSM-PXNSSMCTSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001254550986 1040791682 /nfs/dbraw/zinc/79/16/82/1040791682.db2.gz UXMUGNRTCIOWSM-PXNSSMCTSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1 ZINC001254560957 1040799350 /nfs/dbraw/zinc/79/93/50/1040799350.db2.gz IOPSDROTWBMVTC-QRQLOZEOSA-N 1 1 366.465 2.985 20 5 FFBDMO COCC[C@@H]1CO[C@]2(C1)CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595263 1040824482 /nfs/dbraw/zinc/82/44/82/1040824482.db2.gz HZNKYTAZIFEJHK-BEVDRBHNSA-N 1 1 360.454 2.970 20 5 FFBDMO O=C(NC1CCC1)[C@H]1C[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2C1 ZINC001254595470 1040825194 /nfs/dbraw/zinc/82/51/94/1040825194.db2.gz KARDGEQUQUQKPQ-PDOICOKGSA-N 1 1 369.465 2.689 20 5 FFBDMO CC(C)Oc1ncnc2c1CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254597594 1040826743 /nfs/dbraw/zinc/82/67/43/1040826743.db2.gz TWDNACCMJJHNQO-QGZVFWFLSA-N 1 1 368.437 2.740 20 5 FFBDMO Cc1ccnc(O[C@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610865 1040840199 /nfs/dbraw/zinc/84/01/99/1040840199.db2.gz MMJYSWPXUFCDSQ-ROUUACIJSA-N 1 1 354.410 2.704 20 5 FFBDMO Cc1cc(NC(=O)c2cnn(-c3cc[nH+]cc3)c2)c2cc([N+](=O)[O-])ccc2n1 ZINC001538169394 1070357778 /nfs/dbraw/zinc/35/77/78/1070357778.db2.gz GBYHJPYIPMLACS-UHFFFAOYSA-N 1 1 374.360 2.706 20 5 FFBDMO O=C(Cc1cc(C2CC2)no1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001263502276 1042346065 /nfs/dbraw/zinc/34/60/65/1042346065.db2.gz OPVBZTCXGSJZTL-INIZCTEOSA-N 1 1 371.393 2.820 20 5 FFBDMO O=C(Cc1cc(C2CC2)no1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001263502276 1042346069 /nfs/dbraw/zinc/34/60/69/1042346069.db2.gz OPVBZTCXGSJZTL-INIZCTEOSA-N 1 1 371.393 2.820 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCC2CCCC2)CC1 ZINC001265338767 1042852675 /nfs/dbraw/zinc/85/26/75/1042852675.db2.gz KEMCHNJZJMCNAN-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@H+](C2CCCC2)[C@H](C)C1 ZINC001309860263 1043561123 /nfs/dbraw/zinc/56/11/23/1043561123.db2.gz QHYRLGCZHYCKIG-CQSZACIVSA-N 1 1 367.471 2.541 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001309860263 1043561128 /nfs/dbraw/zinc/56/11/28/1043561128.db2.gz QHYRLGCZHYCKIG-CQSZACIVSA-N 1 1 367.471 2.541 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313376432 1044337269 /nfs/dbraw/zinc/33/72/69/1044337269.db2.gz PORJMMRTUKBVMV-WMZOPIPTSA-N 1 1 360.458 2.968 20 5 FFBDMO O=C(NCC1([NH2+]C/C=C\c2ccc(Cl)cc2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480118 1044662361 /nfs/dbraw/zinc/66/23/61/1044662361.db2.gz BPMSADHFKVBXDJ-GCMXGRHNSA-N 1 1 363.845 2.647 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC001319572165 1045199253 /nfs/dbraw/zinc/19/92/53/1045199253.db2.gz LQPYDBACRGDYRR-FUHWJXTLSA-N 1 1 372.400 2.979 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001295041979 1049869979 /nfs/dbraw/zinc/86/99/79/1049869979.db2.gz UOPXWWABZDBXJG-SNVBAGLBSA-N 1 1 372.828 2.677 20 5 FFBDMO CCOc1ccc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC001343372392 1052189241 /nfs/dbraw/zinc/18/92/41/1052189241.db2.gz YORCMSVGCSXJJZ-KRWDZBQOSA-N 1 1 371.393 2.820 20 5 FFBDMO CCOc1ccc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC001343372392 1052189246 /nfs/dbraw/zinc/18/92/46/1052189246.db2.gz YORCMSVGCSXJJZ-KRWDZBQOSA-N 1 1 371.393 2.820 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)cc1F ZINC001307145575 1052257517 /nfs/dbraw/zinc/25/75/17/1052257517.db2.gz OSGDXAVQHUZNBW-QRWLVFNGSA-N 1 1 371.412 2.937 20 5 FFBDMO O=[N+]([O-])c1cc2c(nc1N1CC[NH+](Cc3ccc(O)cc3)CC1)CCCC2 ZINC001307192267 1052264102 /nfs/dbraw/zinc/26/41/02/1052264102.db2.gz UQXLCNWLYGCBQA-UHFFFAOYSA-N 1 1 368.437 2.896 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC001307699097 1052338473 /nfs/dbraw/zinc/33/84/73/1052338473.db2.gz UAOJYGVJJSOFOZ-UHFFFAOYSA-N 1 1 374.393 2.657 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001308140016 1052415759 /nfs/dbraw/zinc/41/57/59/1052415759.db2.gz IXTRLTFLSGXLDB-LSDHHAIUSA-N 1 1 374.268 2.933 20 5 FFBDMO COC(=O)COc1ccc(CNc2[nH+]c3ccccc3n2C)cc1[N+](=O)[O-] ZINC001308500560 1052461592 /nfs/dbraw/zinc/46/15/92/1052461592.db2.gz DGUGCIUGKQJKKT-UHFFFAOYSA-N 1 1 370.365 2.645 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC001347395698 1053934274 /nfs/dbraw/zinc/93/42/74/1053934274.db2.gz ONIJIVNRGVTCHX-OAHLLOKOSA-N 1 1 356.426 2.553 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC001347395698 1053934283 /nfs/dbraw/zinc/93/42/83/1053934283.db2.gz ONIJIVNRGVTCHX-OAHLLOKOSA-N 1 1 356.426 2.553 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC001347505295 1054052368 /nfs/dbraw/zinc/05/23/68/1054052368.db2.gz WQZZRNVWHPSOBZ-MRXNPFEDSA-N 1 1 363.461 2.755 20 5 FFBDMO CN1CC[NH+](C(C)(C)CNc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC001347919686 1054458207 /nfs/dbraw/zinc/45/82/07/1054458207.db2.gz ZUSFJFIRDBOWGP-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2cnn(C)c2)C1 ZINC000849483058 1056870364 /nfs/dbraw/zinc/87/03/64/1056870364.db2.gz VJAQJTAPKCBPTD-ZWKOTPCHSA-N 1 1 371.441 2.781 20 5 FFBDMO COc1cc(C(=O)OCC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000847828279 1058174826 /nfs/dbraw/zinc/17/48/26/1058174826.db2.gz PSCGJHQQRBCOJX-SNVBAGLBSA-N 1 1 374.340 2.703 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC)CC[NH2+]2)cc1 ZINC001448451022 1058777221 /nfs/dbraw/zinc/77/72/21/1058777221.db2.gz NKUPUSGKBFDEJC-SFHVURJKSA-N 1 1 369.421 2.953 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001451478838 1059118936 /nfs/dbraw/zinc/11/89/36/1059118936.db2.gz ZONOHWKXQCEVIP-KRWDZBQOSA-N 1 1 362.389 2.930 20 5 FFBDMO COc1cccc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1[N+](=O)[O-] ZINC001515003764 1059212971 /nfs/dbraw/zinc/21/29/71/1059212971.db2.gz YOYIHDCUISOIIB-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2[nH]ncc2[N+](=O)[O-])CCCCC1 ZINC001455494030 1059801993 /nfs/dbraw/zinc/80/19/93/1059801993.db2.gz DAOGBAZTUGOCRQ-UHFFFAOYSA-N 1 1 371.441 2.883 20 5 FFBDMO C[N@H+](Cc1ccccc1)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCCC1 ZINC001455494030 1059802013 /nfs/dbraw/zinc/80/20/13/1059802013.db2.gz DAOGBAZTUGOCRQ-UHFFFAOYSA-N 1 1 371.441 2.883 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCCC1 ZINC001455494030 1059802033 /nfs/dbraw/zinc/80/20/33/1059802033.db2.gz DAOGBAZTUGOCRQ-UHFFFAOYSA-N 1 1 371.441 2.883 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848473986 1060087701 /nfs/dbraw/zinc/08/77/01/1060087701.db2.gz SSHISFGVOOGFTJ-CQSZACIVSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848473986 1060087724 /nfs/dbraw/zinc/08/77/24/1060087724.db2.gz SSHISFGVOOGFTJ-CQSZACIVSA-N 1 1 358.398 2.691 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c1 ZINC000848479254 1060107414 /nfs/dbraw/zinc/10/74/14/1060107414.db2.gz VERLBCNACQQREF-CQSZACIVSA-N 1 1 358.398 2.501 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCCC2(CCOCC2)C1 ZINC000848479804 1060112208 /nfs/dbraw/zinc/11/22/08/1060112208.db2.gz JOYGMIBVFSAWGR-SFHVURJKSA-N 1 1 373.453 2.761 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2cccc(Br)c2[N+](=O)[O-])C[C@@H]1C ZINC001458457130 1060594737 /nfs/dbraw/zinc/59/47/37/1060594737.db2.gz ZFNWVDFAZKQTKC-TXEJJXNPSA-N 1 1 372.263 2.903 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848784344 1060690233 /nfs/dbraw/zinc/69/02/33/1060690233.db2.gz ZIZRZWZLSWGIJR-GOEBONIOSA-N 1 1 360.414 2.980 20 5 FFBDMO C[C@]1(O)CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001459787638 1060818265 /nfs/dbraw/zinc/81/82/65/1060818265.db2.gz KRWWQNSTVZQBFA-HNNXBMFYSA-N 1 1 352.778 2.645 20 5 FFBDMO C[C@]1(O)CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001459787638 1060818279 /nfs/dbraw/zinc/81/82/79/1060818279.db2.gz KRWWQNSTVZQBFA-HNNXBMFYSA-N 1 1 352.778 2.645 20 5 FFBDMO CCc1ccc(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001475269108 1061025743 /nfs/dbraw/zinc/02/57/43/1061025743.db2.gz GAMDHOQAZOKRJH-INIZCTEOSA-N 1 1 369.487 2.556 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](CO)c1ccccc1 ZINC001460693196 1061064508 /nfs/dbraw/zinc/06/45/08/1061064508.db2.gz RYWAFLYHLPDBRV-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](CO)c1ccccc1 ZINC001460693196 1061064524 /nfs/dbraw/zinc/06/45/24/1061064524.db2.gz RYWAFLYHLPDBRV-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO CCOC(=O)[C@@]1(F)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC001460752900 1061088744 /nfs/dbraw/zinc/08/87/44/1061088744.db2.gz HXWPMLRSSPQQPP-SUMWQHHRSA-N 1 1 354.378 2.587 20 5 FFBDMO CCOC(=O)[C@@]1(F)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1CC ZINC001460752900 1061088749 /nfs/dbraw/zinc/08/87/49/1061088749.db2.gz HXWPMLRSSPQQPP-SUMWQHHRSA-N 1 1 354.378 2.587 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@]1(CO)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC001460961611 1061167187 /nfs/dbraw/zinc/16/71/87/1061167187.db2.gz XSWQZDGVQOYXBZ-HXUWFJFHSA-N 1 1 369.421 2.907 20 5 FFBDMO CC(C)(O)C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC001477223454 1061631532 /nfs/dbraw/zinc/63/15/32/1061631532.db2.gz ZQCGAVMDFIUQNX-UHFFFAOYSA-N 1 1 372.425 2.668 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC001441359651 1063428272 /nfs/dbraw/zinc/42/82/72/1063428272.db2.gz HCQVPESHTQDPFL-MNOVXSKESA-N 1 1 354.838 2.681 20 5 FFBDMO Cc1cc(F)ccc1C[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001495517899 1063503876 /nfs/dbraw/zinc/50/38/76/1063503876.db2.gz SEDLNUUULNVMOP-QZTJIDSGSA-N 1 1 363.433 2.518 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@H]2C1 ZINC001467071000 1063629237 /nfs/dbraw/zinc/62/92/37/1063629237.db2.gz ZURZCCPDJRVEFR-PJODQICGSA-N 1 1 355.398 2.605 20 5 FFBDMO C[N@@H+](CCOc1ccccc1)Cc1ccc(NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001471881735 1064834866 /nfs/dbraw/zinc/83/48/66/1064834866.db2.gz PKQQBCUEBGYDDO-RTBURBONSA-N 1 1 369.421 2.801 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001472811054 1065148979 /nfs/dbraw/zinc/14/89/79/1065148979.db2.gz HUOHBZUPRZIGIE-LLVKDONJSA-N 1 1 358.236 2.880 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001472811054 1065148984 /nfs/dbraw/zinc/14/89/84/1065148984.db2.gz HUOHBZUPRZIGIE-LLVKDONJSA-N 1 1 358.236 2.880 20 5 FFBDMO CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ncccc1[N+](=O)[O-] ZINC001472808693 1065149211 /nfs/dbraw/zinc/14/92/11/1065149211.db2.gz XXFMFTNUANJTRH-SJLPKXTDSA-N 1 1 356.426 2.939 20 5 FFBDMO C[C@@H](Cc1cccc(F)c1)N(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001576052461 1078190367 /nfs/dbraw/zinc/19/03/67/1078190367.db2.gz JPVCFTDQZMJBBX-DJJJIMSYSA-N 1 1 359.401 2.997 20 5 FFBDMO C[C@@]([NH3+])(C(=O)Nc1n[nH]c2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC001576084832 1078193932 /nfs/dbraw/zinc/19/39/32/1078193932.db2.gz FWJBWDUDOQKUJW-INIZCTEOSA-N 1 1 359.773 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(Cc3noc(C)n3)CC2)c1 ZINC001473817261 1065374905 /nfs/dbraw/zinc/37/49/05/1065374905.db2.gz LMBVBPGSGGAVKV-UHFFFAOYSA-N 1 1 374.397 2.528 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)c(Br)c1 ZINC001473859440 1065393635 /nfs/dbraw/zinc/39/36/35/1065393635.db2.gz LMXDYWJAAPVAQO-AAEUAGOBSA-N 1 1 358.211 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)c(Br)c1 ZINC001473859440 1065393638 /nfs/dbraw/zinc/39/36/38/1065393638.db2.gz LMXDYWJAAPVAQO-AAEUAGOBSA-N 1 1 358.211 2.585 20 5 FFBDMO CS(=O)(=O)Nc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC001474069536 1065449952 /nfs/dbraw/zinc/44/99/52/1065449952.db2.gz HGPRPNUEXURXQC-UHFFFAOYSA-N 1 1 369.830 2.910 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001556098829 1075700312 /nfs/dbraw/zinc/70/03/12/1075700312.db2.gz ZLXFLOFEBDPKCL-KSSFIOAISA-N 1 1 371.412 2.913 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC001557273748 1075831300 /nfs/dbraw/zinc/83/13/00/1075831300.db2.gz SWDJAICIVJXCFT-PHIMTYICSA-N 1 1 357.813 2.871 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559486020 1076166610 /nfs/dbraw/zinc/16/66/10/1076166610.db2.gz BLBIAOZQHIPWHD-SECBINFHSA-N 1 1 368.777 2.539 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559486020 1076166612 /nfs/dbraw/zinc/16/66/12/1076166612.db2.gz BLBIAOZQHIPWHD-SECBINFHSA-N 1 1 368.777 2.539 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(=O)OCC ZINC001559806415 1076192821 /nfs/dbraw/zinc/19/28/21/1076192821.db2.gz VHBBMRCBIXHCRM-CQSZACIVSA-N 1 1 365.430 2.895 20 5 FFBDMO O=C(CC[N@@H+]1CCS[C@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560147071 1076235681 /nfs/dbraw/zinc/23/56/81/1076235681.db2.gz HMMORGKNXVDWIF-LBPRGKRZSA-N 1 1 363.361 2.903 20 5 FFBDMO O=C(CC[N@H+]1CCS[C@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560147071 1076235684 /nfs/dbraw/zinc/23/56/84/1076235684.db2.gz HMMORGKNXVDWIF-LBPRGKRZSA-N 1 1 363.361 2.903 20 5 FFBDMO Cn1cc([C@@H]2CCC[N@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)nn1 ZINC001560217732 1076248918 /nfs/dbraw/zinc/24/89/18/1076248918.db2.gz NIFBFNOUOYCHDY-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1cc([C@@H]2CCC[N@@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)nn1 ZINC001560217732 1076248921 /nfs/dbraw/zinc/24/89/21/1076248921.db2.gz NIFBFNOUOYCHDY-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]Cc2cccc(Cl)c2)CC1 ZINC001568085203 1077070363 /nfs/dbraw/zinc/07/03/63/1077070363.db2.gz SJOJFAULXDRYTF-IAGOWNOFSA-N 1 1 365.861 2.724 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC001570352794 1077200675 /nfs/dbraw/zinc/20/06/75/1077200675.db2.gz DGLPFHZTRKFJLH-CQSZACIVSA-N 1 1 360.801 2.617 20 5 FFBDMO C[C@H](CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589877016 1080825935 /nfs/dbraw/zinc/82/59/35/1080825935.db2.gz FQJIJZDANYLLKE-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589899444 1080848693 /nfs/dbraw/zinc/84/86/93/1080848693.db2.gz IYOBSNBQIOBGMG-GFCCVEGCSA-N 1 1 368.397 2.544 20 5 FFBDMO NC(=O)C[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093808464 250044019 /nfs/dbraw/zinc/04/40/19/250044019.db2.gz ONERBNTXQPGQOK-LBPRGKRZSA-N 1 1 360.439 2.806 20 5 FFBDMO CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCC[N@@H+](C)C1 ZINC000153414435 251135323 /nfs/dbraw/zinc/13/53/23/251135323.db2.gz CATXVTZJKNGVJM-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)CC[N@@H+](C)C1CC1 ZINC000186763317 251259870 /nfs/dbraw/zinc/25/98/70/251259870.db2.gz LTUNYKSGBATYBU-NSHDSACASA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](CCn4ccc([N+](=O)[O-])n4)C3)nc2c1 ZINC000181141513 251246615 /nfs/dbraw/zinc/24/66/15/251246615.db2.gz FMVNTBMCBXHKBM-CQSZACIVSA-N 1 1 354.414 2.856 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000272415054 252033318 /nfs/dbraw/zinc/03/33/18/252033318.db2.gz GAXDPHAGXPFEKE-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1 ZINC000273090053 252213342 /nfs/dbraw/zinc/21/33/42/252213342.db2.gz ISLIMYSJCUUSHS-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+](CCO)C3CCOCC3)cs2)c1 ZINC000276046272 256068401 /nfs/dbraw/zinc/06/84/01/256068401.db2.gz TYSCGQIVMRRLCN-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276089075 256071538 /nfs/dbraw/zinc/07/15/38/256071538.db2.gz PWGKVBJFHFMZCI-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000277094243 256160876 /nfs/dbraw/zinc/16/08/76/256160876.db2.gz VZNXILFRYZBSPY-INIZCTEOSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@H+]1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000277094243 256160878 /nfs/dbraw/zinc/16/08/78/256160878.db2.gz VZNXILFRYZBSPY-INIZCTEOSA-N 1 1 371.462 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277278217 256180206 /nfs/dbraw/zinc/18/02/06/256180206.db2.gz BAAUQXOGKIWWEZ-AWEZNQCLSA-N 1 1 350.419 2.526 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000285777956 257004544 /nfs/dbraw/zinc/00/45/44/257004544.db2.gz TYRACKDVVOXCLY-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000285777956 257004545 /nfs/dbraw/zinc/00/45/45/257004545.db2.gz TYRACKDVVOXCLY-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)CC1 ZINC000278381544 256306196 /nfs/dbraw/zinc/30/61/96/256306196.db2.gz LRHGEUMUVPGBJX-UHFFFAOYSA-N 1 1 373.501 2.558 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000278430114 256311800 /nfs/dbraw/zinc/31/18/00/256311800.db2.gz CYGFRFPWNGESIH-XJKSGUPXSA-N 1 1 371.441 2.521 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000281280346 256624271 /nfs/dbraw/zinc/62/42/71/256624271.db2.gz QDEWIQRPCRJJOV-MRXNPFEDSA-N 1 1 363.458 2.909 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CCC(F)(F)CC1 ZINC000287010855 257066832 /nfs/dbraw/zinc/06/68/32/257066832.db2.gz QSKLFMPGLPMWDX-UHFFFAOYSA-N 1 1 353.369 2.994 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000287528672 257094353 /nfs/dbraw/zinc/09/43/53/257094353.db2.gz UJEDOCKOVMPSSK-UHFFFAOYSA-N 1 1 359.430 2.764 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1 ZINC000288320521 257174780 /nfs/dbraw/zinc/17/47/80/257174780.db2.gz HVSWCODPKBIMDI-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1 ZINC000288320521 257174782 /nfs/dbraw/zinc/17/47/82/257174782.db2.gz HVSWCODPKBIMDI-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1 ZINC000288680375 257217752 /nfs/dbraw/zinc/21/77/52/257217752.db2.gz CRJXSCPJMDHXTE-PMACEKPBSA-N 1 1 374.412 2.694 20 5 FFBDMO Cc1cc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290599156 257345117 /nfs/dbraw/zinc/34/51/17/257345117.db2.gz RMVWRQHUMUDSOX-UHFFFAOYSA-N 1 1 372.429 2.675 20 5 FFBDMO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301275068 258039181 /nfs/dbraw/zinc/03/91/81/258039181.db2.gz OODJQTQYHVYDLU-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301275068 258039182 /nfs/dbraw/zinc/03/91/82/258039182.db2.gz OODJQTQYHVYDLU-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299641441 258012974 /nfs/dbraw/zinc/01/29/74/258012974.db2.gz NEDGJYLFARRQTI-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299641441 258012975 /nfs/dbraw/zinc/01/29/75/258012975.db2.gz NEDGJYLFARRQTI-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302444188 258101989 /nfs/dbraw/zinc/10/19/89/258101989.db2.gz NRLLIHYEELDBAK-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO CC1(C)CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1CCO ZINC000302505047 258103869 /nfs/dbraw/zinc/10/38/69/258103869.db2.gz DNXXRPOBSADNKG-UHFFFAOYSA-N 1 1 356.426 2.550 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc(Br)cc1[N+](=O)[O-] ZINC000302568639 258106351 /nfs/dbraw/zinc/10/63/51/258106351.db2.gz XXHTXVRDPQRFPF-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO CC[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302611453 258106846 /nfs/dbraw/zinc/10/68/46/258106846.db2.gz FCAWZZNDOVATEC-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302611453 258106847 /nfs/dbraw/zinc/10/68/47/258106847.db2.gz FCAWZZNDOVATEC-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1)CCN2 ZINC000302882847 258113536 /nfs/dbraw/zinc/11/35/36/258113536.db2.gz KGOXRUGFHDRWFC-HZPDHXFCSA-N 1 1 368.437 2.610 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N1CC[C@@H]([NH+]2CC=CC2)C1 ZINC000301416796 258048377 /nfs/dbraw/zinc/04/83/77/258048377.db2.gz AVDPLVONTLNGRI-LLVKDONJSA-N 1 1 372.303 2.972 20 5 FFBDMO COc1cc2[nH+]c(NCCc3ccccc3[N+](=O)[O-])nc(N)c2cc1OC ZINC000301428848 258049032 /nfs/dbraw/zinc/04/90/32/258049032.db2.gz FKJMTKXKHLRNQJ-UHFFFAOYSA-N 1 1 369.381 2.792 20 5 FFBDMO COc1cc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc(OC)c1 ZINC000301471646 258051191 /nfs/dbraw/zinc/05/11/91/258051191.db2.gz KBHUYVMYOZCPJT-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO C[N@@H+](CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000301534604 258054370 /nfs/dbraw/zinc/05/43/70/258054370.db2.gz MCLFXKXWZBSRIM-UHFFFAOYSA-N 1 1 371.372 2.927 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000301732620 258065485 /nfs/dbraw/zinc/06/54/85/258065485.db2.gz YRRTXMKILAAHQJ-SMDDNHRTSA-N 1 1 367.833 2.955 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000301757283 258066612 /nfs/dbraw/zinc/06/66/12/258066612.db2.gz DXZSLNAUZCZUHZ-CQSZACIVSA-N 1 1 369.487 2.778 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301856876 258071090 /nfs/dbraw/zinc/07/10/90/258071090.db2.gz CGMOCXMMSVMWRN-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000331124114 258178010 /nfs/dbraw/zinc/17/80/10/258178010.db2.gz HEWLUVJYLCLMPO-BBRMVZONSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000331124114 258178011 /nfs/dbraw/zinc/17/80/11/258178011.db2.gz HEWLUVJYLCLMPO-BBRMVZONSA-N 1 1 351.472 2.874 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-] ZINC000331953703 258207704 /nfs/dbraw/zinc/20/77/04/258207704.db2.gz PFBGRGVZFMOKDM-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000332317602 258225089 /nfs/dbraw/zinc/22/50/89/258225089.db2.gz VFVXEAXMWFJIQL-GASCZTMLSA-N 1 1 361.442 2.837 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000332485919 258232011 /nfs/dbraw/zinc/23/20/11/258232011.db2.gz AWAGWPRYPZUFAR-CHWSQXEVSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332659279 258239276 /nfs/dbraw/zinc/23/92/76/258239276.db2.gz WOYUNVWDZNIXGX-JQWIXIFHSA-N 1 1 355.341 2.505 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332659281 258239304 /nfs/dbraw/zinc/23/93/04/258239304.db2.gz WOYUNVWDZNIXGX-PWSUYJOCSA-N 1 1 355.341 2.505 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000032428486 506251296 /nfs/dbraw/zinc/25/12/96/506251296.db2.gz RDHSQPXHLYWKDM-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000032428486 506251306 /nfs/dbraw/zinc/25/13/06/506251306.db2.gz RDHSQPXHLYWKDM-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000052842944 506261082 /nfs/dbraw/zinc/26/10/82/506261082.db2.gz KWHPXEZZFFAJTD-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000052862433 506268736 /nfs/dbraw/zinc/26/87/36/506268736.db2.gz WOPIYHVSKLMQPU-AWEZNQCLSA-N 1 1 373.413 2.803 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000371063016 512199221 /nfs/dbraw/zinc/19/92/21/512199221.db2.gz MQNMTFMQZGDEQC-IEBWSBKVSA-N 1 1 357.385 2.838 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000366834645 512208254 /nfs/dbraw/zinc/20/82/54/512208254.db2.gz VHIRZLBOCGQHAQ-LLVKDONJSA-N 1 1 362.361 2.638 20 5 FFBDMO COc1cc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cc([N+](=O)[O-])c1C ZINC000369101244 512228580 /nfs/dbraw/zinc/22/85/80/512228580.db2.gz VNRFMKCZPSZJDO-UHFFFAOYSA-N 1 1 358.398 2.894 20 5 FFBDMO Cc1ccc(CN2CCC(C)(C[NH+]3CCN(C)CC3)CC2)cc1[N+](=O)[O-] ZINC000375245649 512229460 /nfs/dbraw/zinc/22/94/60/512229460.db2.gz OMSOLLPCVDAAJY-UHFFFAOYSA-N 1 1 360.502 2.753 20 5 FFBDMO CC(C)C[C@@H](C)C[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000410304237 512236828 /nfs/dbraw/zinc/23/68/28/512236828.db2.gz BWTDNIMZAWXYHH-OAHLLOKOSA-N 1 1 369.487 2.583 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000375311672 512261974 /nfs/dbraw/zinc/26/19/74/512261974.db2.gz XSFCIVVFESZROD-LJQANCHMSA-N 1 1 353.378 2.569 20 5 FFBDMO Cc1ccc(S(=O)(=O)N(C)CC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000065971454 506402732 /nfs/dbraw/zinc/40/27/32/506402732.db2.gz RWNZXYNWNHEJLT-UHFFFAOYSA-N 1 1 369.487 2.788 20 5 FFBDMO CCCC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000066543604 506549728 /nfs/dbraw/zinc/54/97/28/506549728.db2.gz QJOCAMQWOKQITD-MRXNPFEDSA-N 1 1 370.471 2.653 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cn1 ZINC000054626417 506590983 /nfs/dbraw/zinc/59/09/83/506590983.db2.gz VGCRVWKOQULQLG-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000008111656 506622335 /nfs/dbraw/zinc/62/23/35/506622335.db2.gz RADGZRQQZSLJBT-UHFFFAOYSA-N 1 1 370.409 2.953 20 5 FFBDMO Cc1c(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000043347435 506737459 /nfs/dbraw/zinc/73/74/59/506737459.db2.gz AZGYFPAOBAMYKB-CHWSQXEVSA-N 1 1 364.446 2.913 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCc1c[nH+]c2n1CCCC2 ZINC000367015468 512297445 /nfs/dbraw/zinc/29/74/45/512297445.db2.gz KSPMVLPGJZZVNT-UHFFFAOYSA-N 1 1 359.386 2.848 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000369260154 512314405 /nfs/dbraw/zinc/31/44/05/512314405.db2.gz SRKUNMOOSRNELI-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000369260154 512314406 /nfs/dbraw/zinc/31/44/06/512314406.db2.gz SRKUNMOOSRNELI-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000046479123 507141345 /nfs/dbraw/zinc/14/13/45/507141345.db2.gz VPEGLZXAFJOIGV-LLVKDONJSA-N 1 1 360.439 2.614 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941830 507154153 /nfs/dbraw/zinc/15/41/53/507154153.db2.gz VHYVBNYIZWBSIK-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941830 507154158 /nfs/dbraw/zinc/15/41/58/507154158.db2.gz VHYVBNYIZWBSIK-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068359126 507201226 /nfs/dbraw/zinc/20/12/26/507201226.db2.gz VESMTBOYPICUGR-NSHDSACASA-N 1 1 366.805 2.727 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000068383049 507210002 /nfs/dbraw/zinc/21/00/02/507210002.db2.gz RCRMYMIPRFFEBW-IACUBPJLSA-N 1 1 367.833 2.759 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000046859956 507210959 /nfs/dbraw/zinc/21/09/59/507210959.db2.gz YNJZWEGFSPDWPO-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047142646 507271668 /nfs/dbraw/zinc/27/16/68/507271668.db2.gz PMWMGYSTOWZITO-OAHLLOKOSA-N 1 1 360.458 2.799 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000047142648 507272405 /nfs/dbraw/zinc/27/24/05/507272405.db2.gz PMWMGYSTOWZITO-HNNXBMFYSA-N 1 1 360.458 2.799 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047226952 507287671 /nfs/dbraw/zinc/28/76/71/507287671.db2.gz OLMPWWDAEBKMAH-IAGOWNOFSA-N 1 1 372.469 2.554 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000058500564 507429734 /nfs/dbraw/zinc/42/97/34/507429734.db2.gz PSXRZXGIVMTYMI-XQQFMLRXSA-N 1 1 373.500 2.682 20 5 FFBDMO CCOc1ccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000026483745 507591495 /nfs/dbraw/zinc/59/14/95/507591495.db2.gz AHKVQZXUAZTAMU-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CC(=O)N2CCCC2)CC1 ZINC000061048196 507594379 /nfs/dbraw/zinc/59/43/79/507594379.db2.gz QJFZSFUOUQBTKK-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000027909441 507692480 /nfs/dbraw/zinc/69/24/80/507692480.db2.gz PWNCYJICNCWSIU-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1ccc(C(N)=O)cc1)C1CC1 ZINC000027909441 507692486 /nfs/dbraw/zinc/69/24/86/507692486.db2.gz PWNCYJICNCWSIU-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000052153132 507799153 /nfs/dbraw/zinc/79/91/53/507799153.db2.gz LXHHFQCTPPFYAI-UHFFFAOYSA-N 1 1 357.395 2.653 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000064736550 507807610 /nfs/dbraw/zinc/80/76/10/507807610.db2.gz KKNJGXGMXRDMIK-AWEZNQCLSA-N 1 1 371.441 2.766 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000072725330 507848012 /nfs/dbraw/zinc/84/80/12/507848012.db2.gz OFANTYOTYCZJFT-CYBMUJFWSA-N 1 1 368.865 2.993 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCN(C)c1ccccc1 ZINC000107683027 507862625 /nfs/dbraw/zinc/86/26/25/507862625.db2.gz HLVQWHGLSPGFBO-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN(C)c1ccccc1 ZINC000107683027 507862628 /nfs/dbraw/zinc/86/26/28/507862628.db2.gz HLVQWHGLSPGFBO-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO CNC(=O)c1ccc(N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000078506450 507877920 /nfs/dbraw/zinc/87/79/20/507877920.db2.gz ARSUSXYKLIYTHI-QGZVFWFLSA-N 1 1 368.437 2.665 20 5 FFBDMO CCOCCO[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089933844 507886328 /nfs/dbraw/zinc/88/63/28/507886328.db2.gz KOFLKECAYBUCMA-KRWDZBQOSA-N 1 1 361.398 2.877 20 5 FFBDMO CCOCCO[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089933844 507886330 /nfs/dbraw/zinc/88/63/30/507886330.db2.gz KOFLKECAYBUCMA-KRWDZBQOSA-N 1 1 361.398 2.877 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCCC2 ZINC000090550706 507926889 /nfs/dbraw/zinc/92/68/89/507926889.db2.gz ZBNMUCQQFWEKKQ-IRXDYDNUSA-N 1 1 363.458 2.816 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCCO)CC(C)(C)C ZINC000109747654 507984147 /nfs/dbraw/zinc/98/41/47/507984147.db2.gz BMNPMLYECCHIMG-UHFFFAOYSA-N 1 1 351.447 2.962 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@]3(C2)C(=O)Nc2ccccc23)c([N+](=O)[O-])cc1F ZINC000373514970 512372423 /nfs/dbraw/zinc/37/24/23/512372423.db2.gz WPGDTYWLKRSTEG-IBGZPJMESA-N 1 1 371.368 2.838 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000110353450 508023212 /nfs/dbraw/zinc/02/32/12/508023212.db2.gz PSNHYSYYQQJESQ-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092010484 508033182 /nfs/dbraw/zinc/03/31/82/508033182.db2.gz VJLOMMCOTSJHGU-NQMAARMTSA-N 1 1 356.426 2.787 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H](Cn3ccnn3)C2)c1 ZINC000092070925 508039781 /nfs/dbraw/zinc/03/97/81/508039781.db2.gz BNVRZDMFMYZLCR-GFCCVEGCSA-N 1 1 367.356 2.700 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H](Cn3ccnn3)C2)c1 ZINC000092070925 508039783 /nfs/dbraw/zinc/03/97/83/508039783.db2.gz BNVRZDMFMYZLCR-GFCCVEGCSA-N 1 1 367.356 2.700 20 5 FFBDMO C[C@H]1C[NH+](CC2CC[NH+](Cc3cc([O-])ccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000092586997 508084699 /nfs/dbraw/zinc/08/46/99/508084699.db2.gz KNKSHHSNXHKHEO-GJZGRUSLSA-N 1 1 363.458 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCCC[C@@H]2C[NH+]2CCOCC2)cc1OC(F)F ZINC000092652980 508090771 /nfs/dbraw/zinc/09/07/71/508090771.db2.gz QTZOCZCDAXZGRQ-CQSZACIVSA-N 1 1 371.384 2.887 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092660740 508092002 /nfs/dbraw/zinc/09/20/02/508092002.db2.gz QMZGWFUUPRGSEG-NSHDSACASA-N 1 1 357.357 2.674 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092660740 508092005 /nfs/dbraw/zinc/09/20/05/508092005.db2.gz QMZGWFUUPRGSEG-NSHDSACASA-N 1 1 357.357 2.674 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000080708018 508095925 /nfs/dbraw/zinc/09/59/25/508095925.db2.gz KHQFQYLKAUKBHJ-MRXNPFEDSA-N 1 1 360.458 2.511 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cccc(O)c1 ZINC000080921653 508112084 /nfs/dbraw/zinc/11/20/84/508112084.db2.gz VISDKWVKMUNATD-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000081129008 508140984 /nfs/dbraw/zinc/14/09/84/508140984.db2.gz CWYRRJPPVCLTNU-GOSISDBHSA-N 1 1 369.421 2.707 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000081129012 508141037 /nfs/dbraw/zinc/14/10/37/508141037.db2.gz CWYRRJPPVCLTNU-SFHVURJKSA-N 1 1 369.421 2.707 20 5 FFBDMO O=C(C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1)N1CCCCC1 ZINC000083128415 508237067 /nfs/dbraw/zinc/23/70/67/508237067.db2.gz PNMBPTHDAHSQCD-UHFFFAOYSA-N 1 1 372.425 2.961 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000113900182 508285075 /nfs/dbraw/zinc/28/50/75/508285075.db2.gz LWVUMMULJBMCBS-GJZGRUSLSA-N 1 1 360.458 2.904 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000085457856 508309564 /nfs/dbraw/zinc/30/95/64/508309564.db2.gz STOVDBPNMBZSAO-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000087355040 508348931 /nfs/dbraw/zinc/34/89/31/508348931.db2.gz VZYYJHNYTOWRNW-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606242 508378880 /nfs/dbraw/zinc/37/88/80/508378880.db2.gz AIXRUMPYNQVVEO-UHFFFAOYSA-N 1 1 365.389 2.639 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088606242 508378883 /nfs/dbraw/zinc/37/88/83/508378883.db2.gz AIXRUMPYNQVVEO-UHFFFAOYSA-N 1 1 365.389 2.639 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000156906206 508494547 /nfs/dbraw/zinc/49/45/47/508494547.db2.gz IMFIILHRNFTMNZ-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000156906206 508494551 /nfs/dbraw/zinc/49/45/51/508494551.db2.gz IMFIILHRNFTMNZ-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cn1 ZINC000122511542 508546508 /nfs/dbraw/zinc/54/65/08/508546508.db2.gz QJAZYFDFXZBHMR-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134929276 508576144 /nfs/dbraw/zinc/57/61/44/508576144.db2.gz NJYNWJUTOZPPFZ-QMTMVMCOSA-N 1 1 372.469 2.871 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)ccc1OC(F)F ZINC000157633573 508590418 /nfs/dbraw/zinc/59/04/18/508590418.db2.gz CGGPVYRAWZGVLG-UHFFFAOYSA-N 1 1 370.356 2.923 20 5 FFBDMO Cc1sc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000122870842 508599613 /nfs/dbraw/zinc/59/96/13/508599613.db2.gz NEUCXARRMBREEG-NSHDSACASA-N 1 1 361.489 2.508 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000153581432 508602683 /nfs/dbraw/zinc/60/26/83/508602683.db2.gz LTZXVXYXQGKPJV-CVEARBPZSA-N 1 1 364.490 2.528 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153825557 508656856 /nfs/dbraw/zinc/65/68/56/508656856.db2.gz WTLIIOIYQAAPKG-ZVZYQTTQSA-N 1 1 363.458 2.645 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C[N@H+]1C1CC1 ZINC000123436148 508686686 /nfs/dbraw/zinc/68/66/86/508686686.db2.gz DCBZCEJZKQHZFA-UKRRQHHQSA-N 1 1 358.442 2.894 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866855 508688731 /nfs/dbraw/zinc/68/87/31/508688731.db2.gz ZNLPOHWEPJHQSX-HIFRSBDPSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866855 508688733 /nfs/dbraw/zinc/68/87/33/508688733.db2.gz ZNLPOHWEPJHQSX-HIFRSBDPSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137455645 508756450 /nfs/dbraw/zinc/75/64/50/508756450.db2.gz WDRKRUHYXLLZEF-WBVHZDCISA-N 1 1 369.421 2.753 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000119403417 508789518 /nfs/dbraw/zinc/78/95/18/508789518.db2.gz UAXQOBSNXIIFFA-INIZCTEOSA-N 1 1 360.458 2.701 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000124321628 508815111 /nfs/dbraw/zinc/81/51/11/508815111.db2.gz LFHSQGZGOXFUBT-NVXWUHKLSA-N 1 1 358.442 2.753 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000159289362 508819714 /nfs/dbraw/zinc/81/97/14/508819714.db2.gz OOOBGPUYZUEUJX-UHFFFAOYSA-N 1 1 370.453 2.959 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCn1ccnc1 ZINC000124382669 508823718 /nfs/dbraw/zinc/82/37/18/508823718.db2.gz TVZPMYLCKUCDQK-LBPRGKRZSA-N 1 1 365.821 2.794 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@H](C(N)=O)CC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000159604402 508864428 /nfs/dbraw/zinc/86/44/28/508864428.db2.gz KTFZZGLSCLWPBM-QWHCGFSZSA-N 1 1 373.409 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000119841097 508874186 /nfs/dbraw/zinc/87/41/86/508874186.db2.gz RPWNZFGHIWXNIO-KDOFPFPSSA-N 1 1 369.421 2.854 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000124785304 508884103 /nfs/dbraw/zinc/88/41/03/508884103.db2.gz ITGRVCOEUMBYDD-UHFFFAOYSA-N 1 1 372.263 2.748 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000155001421 508901192 /nfs/dbraw/zinc/90/11/92/508901192.db2.gz DBKKRYMNZCMEMW-ZDUSSCGKSA-N 1 1 358.320 2.513 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000155001421 508901196 /nfs/dbraw/zinc/90/11/96/508901196.db2.gz DBKKRYMNZCMEMW-ZDUSSCGKSA-N 1 1 358.320 2.513 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000369473331 512426670 /nfs/dbraw/zinc/42/66/70/512426670.db2.gz WDUYUQRWUQUCBG-AWEZNQCLSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000160061750 508932605 /nfs/dbraw/zinc/93/26/05/508932605.db2.gz GLAMVDKMKIXNKZ-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-] ZINC000120226750 508954221 /nfs/dbraw/zinc/95/42/21/508954221.db2.gz YXJAJVKLLWNASM-UHFFFAOYSA-N 1 1 359.430 2.764 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155343534 508981443 /nfs/dbraw/zinc/98/14/43/508981443.db2.gz WPNPIWPFMAVVIH-YOEHRIQHSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000120509402 509010727 /nfs/dbraw/zinc/01/07/27/509010727.db2.gz CKUCIAZYQPYRRM-RDJZCZTQSA-N 1 1 374.485 2.610 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000160710402 509023345 /nfs/dbraw/zinc/02/33/45/509023345.db2.gz JCGZICOKOHMMKG-QGZVFWFLSA-N 1 1 360.458 2.999 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000132410899 509028200 /nfs/dbraw/zinc/02/82/00/509028200.db2.gz WBDWXGKMYFMZCD-FPOVZHCZSA-N 1 1 374.529 2.778 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704542 509048453 /nfs/dbraw/zinc/04/84/53/509048453.db2.gz TXLLIBZEKBYGHF-CVEARBPZSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704542 509048455 /nfs/dbraw/zinc/04/84/55/509048455.db2.gz TXLLIBZEKBYGHF-CVEARBPZSA-N 1 1 365.430 2.677 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000185491960 509204099 /nfs/dbraw/zinc/20/40/99/509204099.db2.gz DZMNDKSUUPEUIR-KBPBESRZSA-N 1 1 351.422 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3ccc(Cl)cc3)CC2)cn1 ZINC000198693705 509228337 /nfs/dbraw/zinc/22/83/37/509228337.db2.gz GXRJTUARLHSMOQ-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000172788277 509236224 /nfs/dbraw/zinc/23/62/24/509236224.db2.gz CMUMGVASWYOMED-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO COCCO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000188821407 509279394 /nfs/dbraw/zinc/27/93/94/509279394.db2.gz GEUMJIZGCDYLBI-INIZCTEOSA-N 1 1 363.439 2.956 20 5 FFBDMO COCCO[C@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000188821407 509279397 /nfs/dbraw/zinc/27/93/97/509279397.db2.gz GEUMJIZGCDYLBI-INIZCTEOSA-N 1 1 363.439 2.956 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)[C@H](C)C1 ZINC000191987346 509280517 /nfs/dbraw/zinc/28/05/17/509280517.db2.gz LYCWYXDUBRLMPV-HUUCEWRRSA-N 1 1 369.487 2.562 20 5 FFBDMO COc1cccc([C@H](C)[NH+]2CCN(c3c([N+](=O)[O-])c(C)nn3C)CC2)c1 ZINC000264088611 509324652 /nfs/dbraw/zinc/32/46/52/509324652.db2.gz AXPFLXZOYROEKB-AWEZNQCLSA-N 1 1 359.430 2.529 20 5 FFBDMO CCN(C)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000248803960 509491714 /nfs/dbraw/zinc/49/17/14/509491714.db2.gz AVQNSFNMEREWHY-OAHLLOKOSA-N 1 1 356.430 2.527 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000183057276 509571260 /nfs/dbraw/zinc/57/12/60/509571260.db2.gz VAAXHDNTQISGTM-HNNXBMFYSA-N 1 1 365.336 2.789 20 5 FFBDMO CCOc1cccc(NC[C@H](C)CN2CC[NH+](CC)CC2)c1[N+](=O)[O-] ZINC000189444952 509578270 /nfs/dbraw/zinc/57/82/70/509578270.db2.gz UQLWVICYXNISEH-HNNXBMFYSA-N 1 1 350.463 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035607 509578432 /nfs/dbraw/zinc/57/84/32/509578432.db2.gz SNHQXWXIHBPPGF-GUYCJALGSA-N 1 1 360.414 2.952 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000165697632 509581920 /nfs/dbraw/zinc/58/19/20/509581920.db2.gz LZAXJACHHVYIEO-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1ccc(COC[C@@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000192707305 509606889 /nfs/dbraw/zinc/60/68/89/509606889.db2.gz IDYYKXUCNNRWBZ-KRWDZBQOSA-N 1 1 360.410 2.613 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000176684731 509639514 /nfs/dbraw/zinc/63/95/14/509639514.db2.gz FWHNOCFGKZLXJD-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO CC(C)[NH+]1CCN(CCCN(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000192775309 509640562 /nfs/dbraw/zinc/64/05/62/509640562.db2.gz USWJJXVLBZDRST-UHFFFAOYSA-N 1 1 360.502 2.975 20 5 FFBDMO O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000264695694 509652377 /nfs/dbraw/zinc/65/23/77/509652377.db2.gz IPWWNYASKVASNV-MQVJKMGUSA-N 1 1 354.410 2.848 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000249474349 509690951 /nfs/dbraw/zinc/69/09/51/509690951.db2.gz JEAYUQVOYFNGJR-GJZGRUSLSA-N 1 1 369.487 2.562 20 5 FFBDMO CN1CCN(CCC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180018275 509711606 /nfs/dbraw/zinc/71/16/06/509711606.db2.gz YCCJKFILROMMDA-NRFANRHFSA-N 1 1 368.481 2.911 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)nc(C)[nH+]1 ZINC000176891644 509747140 /nfs/dbraw/zinc/74/71/40/509747140.db2.gz PJSRAOZCPQNVAU-UHFFFAOYSA-N 1 1 370.413 2.792 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000180159399 509786482 /nfs/dbraw/zinc/78/64/82/509786482.db2.gz GSUYHCFTRNZADW-WMZOPIPTSA-N 1 1 355.394 2.779 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180175154 509795328 /nfs/dbraw/zinc/79/53/28/509795328.db2.gz KWFZLMWZPVVDJY-XLIONFOSSA-N 1 1 368.437 2.958 20 5 FFBDMO O=C(CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1)N1CCCC1 ZINC000177011154 509816938 /nfs/dbraw/zinc/81/69/38/509816938.db2.gz KQQACBYLGMAIIF-UHFFFAOYSA-N 1 1 372.425 2.961 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C1 ZINC000173951668 509871622 /nfs/dbraw/zinc/87/16/22/509871622.db2.gz DHVYTWRZQCLJJT-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO COc1cccc(S(=O)(=O)CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180416443 509914874 /nfs/dbraw/zinc/91/48/74/509914874.db2.gz LYVOORWBBQIDNP-CYBMUJFWSA-N 1 1 364.423 2.728 20 5 FFBDMO COC(=O)c1cnc(NCCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000190164994 509980677 /nfs/dbraw/zinc/98/06/77/509980677.db2.gz PSUUCERIMJDSOM-UHFFFAOYSA-N 1 1 358.398 2.710 20 5 FFBDMO COC(=O)c1cnc(NCCCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190168076 509982409 /nfs/dbraw/zinc/98/24/09/509982409.db2.gz MVARUVADTVZCBT-ZDUSSCGKSA-N 1 1 350.419 2.700 20 5 FFBDMO CC(C)CCNC(=O)[C@H](C)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174243826 510021927 /nfs/dbraw/zinc/02/19/27/510021927.db2.gz UDDLXGUJRNHEEE-HNNXBMFYSA-N 1 1 363.458 2.989 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1 ZINC000193817743 510084903 /nfs/dbraw/zinc/08/49/03/510084903.db2.gz CKMARCZJYPOCGG-MRXNPFEDSA-N 1 1 365.386 2.663 20 5 FFBDMO CC[N@H+]1CCCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000265550996 510112049 /nfs/dbraw/zinc/11/20/49/510112049.db2.gz YLZPGSXBRQMGRP-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000174523597 510158320 /nfs/dbraw/zinc/15/83/20/510158320.db2.gz XSIVNGODARBHHZ-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000262054107 510161724 /nfs/dbraw/zinc/16/17/24/510161724.db2.gz VGYAYGMEZYFEDQ-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccccc1Cl ZINC000180887789 510166530 /nfs/dbraw/zinc/16/65/30/510166530.db2.gz ATLGBZXPMGEPKZ-HNNXBMFYSA-N 1 1 362.817 2.863 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccccc1Cl ZINC000180887806 510166556 /nfs/dbraw/zinc/16/65/56/510166556.db2.gz ATLGBZXPMGEPKZ-OAHLLOKOSA-N 1 1 362.817 2.863 20 5 FFBDMO COc1cc(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000184223498 510201807 /nfs/dbraw/zinc/20/18/07/510201807.db2.gz LWNURKTZYGPNDX-UHFFFAOYSA-N 1 1 365.405 2.577 20 5 FFBDMO COc1cc(CN2CC[N@H+]3CCCC[C@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000246250236 510387960 /nfs/dbraw/zinc/38/79/60/510387960.db2.gz WQOIQSNQUGJUEW-ZDUSSCGKSA-N 1 1 371.384 2.875 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1C1CC1 ZINC000174932778 510393002 /nfs/dbraw/zinc/39/30/02/510393002.db2.gz XKDRZIQVHVMBSB-LBPRGKRZSA-N 1 1 358.423 2.571 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246270932 510399662 /nfs/dbraw/zinc/39/96/62/510399662.db2.gz AEJMGEZJPBMYLI-HNAYVOBHSA-N 1 1 372.469 2.790 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000246333682 510432122 /nfs/dbraw/zinc/43/21/22/510432122.db2.gz HBFABCLKBNOQIX-PKOBYXMFSA-N 1 1 356.422 2.824 20 5 FFBDMO CNC(=O)CC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000175021834 510441192 /nfs/dbraw/zinc/44/11/92/510441192.db2.gz NTZVSUAASBXTND-GFCCVEGCSA-N 1 1 373.413 2.554 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000190995706 510456772 /nfs/dbraw/zinc/45/67/72/510456772.db2.gz BQGOSSBTUVTUCG-AWEZNQCLSA-N 1 1 363.458 2.635 20 5 FFBDMO C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181540908 510463882 /nfs/dbraw/zinc/46/38/82/510463882.db2.gz OYXSVIOISWLUPG-CABCVRRESA-N 1 1 361.442 2.743 20 5 FFBDMO C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181547874 510466053 /nfs/dbraw/zinc/46/60/53/510466053.db2.gz IWEGGORCUWLMNP-HOTGVXAUSA-N 1 1 374.485 2.800 20 5 FFBDMO Nc1c(C(=O)Nc2ccccc2C[NH+]2CCSCC2)cccc1[N+](=O)[O-] ZINC000178182593 510476088 /nfs/dbraw/zinc/47/60/88/510476088.db2.gz KYXBAAGGGZHMQG-UHFFFAOYSA-N 1 1 372.450 2.978 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cc(F)ccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000178190750 510479305 /nfs/dbraw/zinc/47/93/05/510479305.db2.gz KKYCXNDZRDQDHM-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000181637585 510515410 /nfs/dbraw/zinc/51/54/10/510515410.db2.gz KMYNKVWDHHODII-KGLIPLIRSA-N 1 1 361.442 2.986 20 5 FFBDMO Cc1cc(NCc2c[nH+]c(N(C)C)n2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000270198268 510713248 /nfs/dbraw/zinc/71/32/48/510713248.db2.gz JDHLSXNYWQFZPV-UHFFFAOYSA-N 1 1 367.413 2.772 20 5 FFBDMO COc1cc(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000182095472 510755489 /nfs/dbraw/zinc/75/54/89/510755489.db2.gz MAHHAUSFRWTRMR-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CCC1(CC)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000185243403 510768355 /nfs/dbraw/zinc/76/83/55/510768355.db2.gz KJXAUVIRJPHKEF-XMMPIXPASA-N 1 1 354.472 2.987 20 5 FFBDMO CCC1(CC)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000185243403 510768357 /nfs/dbraw/zinc/76/83/57/510768357.db2.gz KJXAUVIRJPHKEF-XMMPIXPASA-N 1 1 354.472 2.987 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(OC)cc2)CC1 ZINC000195342101 510794178 /nfs/dbraw/zinc/79/41/78/510794178.db2.gz LWMAZEPZQKCICE-UHFFFAOYSA-N 1 1 373.457 2.841 20 5 FFBDMO CCc1cc(NCC[N@H+]2CCCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000188496055 510797089 /nfs/dbraw/zinc/79/70/89/510797089.db2.gz IIZBTCRPGYTPDY-UHFFFAOYSA-N 1 1 371.441 2.748 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)n1 ZINC000191717889 510799625 /nfs/dbraw/zinc/79/96/25/510799625.db2.gz UNUQODGUIFMRIX-LJQANCHMSA-N 1 1 371.441 2.596 20 5 FFBDMO O=C1[C@@H](N2CCC[N@H+](C3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000172584992 510805116 /nfs/dbraw/zinc/80/51/16/510805116.db2.gz ZJYVPODRMYJLIX-IBGZPJMESA-N 1 1 372.469 2.650 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000270488752 510886367 /nfs/dbraw/zinc/88/63/67/510886367.db2.gz QXUSAQGBYUMATR-UHFFFAOYSA-N 1 1 350.438 2.729 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000293966424 510913111 /nfs/dbraw/zinc/91/31/11/510913111.db2.gz UHHMQUNUXCZENM-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000364527093 510916793 /nfs/dbraw/zinc/91/67/93/510916793.db2.gz JTKUQFOLHOCPEZ-DKSSEZFCSA-N 1 1 357.410 2.813 20 5 FFBDMO COCCCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1 ZINC000270601613 510921159 /nfs/dbraw/zinc/92/11/59/510921159.db2.gz WNZRROGRUHIDEC-UHFFFAOYSA-N 1 1 359.426 2.685 20 5 FFBDMO CCOC1CC(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000285545440 510950047 /nfs/dbraw/zinc/95/00/47/510950047.db2.gz IBECIDPNQQACLY-UHFFFAOYSA-N 1 1 373.457 2.798 20 5 FFBDMO COc1cc(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294407977 511054525 /nfs/dbraw/zinc/05/45/25/511054525.db2.gz IVAGJEXVTRIIMH-ZDUSSCGKSA-N 1 1 367.421 2.984 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccncc1OC[C@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294457262 511070969 /nfs/dbraw/zinc/07/09/69/511070969.db2.gz VYVKJCRCVGZMRT-KGLIPLIRSA-N 1 1 372.425 2.838 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H]2CCCC[C@@H]21 ZINC000297802769 511072840 /nfs/dbraw/zinc/07/28/40/511072840.db2.gz HYUZMUFZFQQSIT-JKSUJKDBSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294501989 511085710 /nfs/dbraw/zinc/08/57/10/511085710.db2.gz PEHRDGOUXWOKQC-UHFFFAOYSA-N 1 1 356.304 2.939 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000294835776 511193900 /nfs/dbraw/zinc/19/39/00/511193900.db2.gz QKCSLWZIPRPGPB-LSDHHAIUSA-N 1 1 369.421 2.775 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481722 511219686 /nfs/dbraw/zinc/21/96/86/511219686.db2.gz NPSMRMKGRIXIGK-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481722 511219692 /nfs/dbraw/zinc/21/96/92/511219692.db2.gz NPSMRMKGRIXIGK-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000271481722 511219697 /nfs/dbraw/zinc/21/96/97/511219697.db2.gz NPSMRMKGRIXIGK-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC000298367233 511260188 /nfs/dbraw/zinc/26/01/88/511260188.db2.gz USQMUZNTOJEGRM-GOEBONIOSA-N 1 1 369.368 2.909 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(NC(=O)N(C)C)cc2)c([N+](=O)[O-])cc1O ZINC000279946455 511276790 /nfs/dbraw/zinc/27/67/90/511276790.db2.gz YGDJLKPMHOBZGC-UHFFFAOYSA-N 1 1 374.397 2.692 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000295140373 511296661 /nfs/dbraw/zinc/29/66/61/511296661.db2.gz OLZADTSOGNCDQA-MWLCHTKSSA-N 1 1 357.332 2.969 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000271788227 511324143 /nfs/dbraw/zinc/32/41/43/511324143.db2.gz MHWDMXJDYGIXDI-LLVKDONJSA-N 1 1 371.224 2.738 20 5 FFBDMO CO[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000280239858 511387878 /nfs/dbraw/zinc/38/78/78/511387878.db2.gz AXUQDACYCXYTRJ-KRWDZBQOSA-N 1 1 353.394 2.954 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292058704 511448944 /nfs/dbraw/zinc/44/89/44/511448944.db2.gz BMTHXDYRJZGVAW-GJZGRUSLSA-N 1 1 360.458 2.728 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272205178 511464785 /nfs/dbraw/zinc/46/47/85/511464785.db2.gz ZDHMXJJIGPLGPU-IUODEOHRSA-N 1 1 353.369 2.629 20 5 FFBDMO CC[N@@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])c(C)n2)[C@@H]1c1ccccc1 ZINC000295669454 511477192 /nfs/dbraw/zinc/47/71/92/511477192.db2.gz JTEXAUOGMATRMZ-IRXDYDNUSA-N 1 1 357.414 2.567 20 5 FFBDMO CC[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])c(C)n2)[C@@H]1c1ccccc1 ZINC000295669454 511477195 /nfs/dbraw/zinc/47/71/95/511477195.db2.gz JTEXAUOGMATRMZ-IRXDYDNUSA-N 1 1 357.414 2.567 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(Br)c([N+](=O)[O-])c3)C2)C1 ZINC000292470866 511608960 /nfs/dbraw/zinc/60/89/60/511608960.db2.gz ZSOHWRQJFCTFSM-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000296083591 511613037 /nfs/dbraw/zinc/61/30/37/511613037.db2.gz CQBBYSOINBIONP-INIZCTEOSA-N 1 1 360.414 2.842 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000299387236 511617890 /nfs/dbraw/zinc/61/78/90/511617890.db2.gz YZZYVBQYFFRHAG-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000365854103 511689317 /nfs/dbraw/zinc/68/93/17/511689317.db2.gz PWSIPULUJGREOR-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000284634920 511803640 /nfs/dbraw/zinc/80/36/40/511803640.db2.gz NNJKFACVQCNCDF-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc1OC ZINC000274460487 511842661 /nfs/dbraw/zinc/84/26/61/511842661.db2.gz JVDXWNQSEYREGW-ZDUSSCGKSA-N 1 1 365.430 2.605 20 5 FFBDMO Cc1cc(F)c(NC(=O)N(C)CC[N@@H+]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000296668988 511844527 /nfs/dbraw/zinc/84/45/27/511844527.db2.gz HHSPXQYSYTYGOM-UHFFFAOYSA-N 1 1 368.409 2.617 20 5 FFBDMO Cc1cc(F)c(NC(=O)N(C)CC[N@H+]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000296668988 511844530 /nfs/dbraw/zinc/84/45/30/511844530.db2.gz HHSPXQYSYTYGOM-UHFFFAOYSA-N 1 1 368.409 2.617 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+](C2CC2)C1 ZINC000296698133 511858991 /nfs/dbraw/zinc/85/89/91/511858991.db2.gz KRSLTRSWLIUJOI-CYBMUJFWSA-N 1 1 357.414 2.561 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cn2)cc1F ZINC000366141844 511864948 /nfs/dbraw/zinc/86/49/48/511864948.db2.gz CXOQFIVLQVMREJ-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296904777 511944637 /nfs/dbraw/zinc/94/46/37/511944637.db2.gz SGYYRQWJRKMPFV-CYBMUJFWSA-N 1 1 362.430 2.942 20 5 FFBDMO C[NH+]1CCN([C@@H](c2nc(-c3ccc([N+](=O)[O-])o3)no2)c2ccccc2)CC1 ZINC000351154486 511968480 /nfs/dbraw/zinc/96/84/80/511968480.db2.gz ZVFRHLWQDJDEEB-MRXNPFEDSA-N 1 1 369.381 2.575 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000360037882 512065810 /nfs/dbraw/zinc/06/58/10/512065810.db2.gz SEHBFYYRSKOHCV-HOCLYGCPSA-N 1 1 371.397 2.521 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC(=O)N2CCCC2)CC1 ZINC000373757735 512490128 /nfs/dbraw/zinc/49/01/28/512490128.db2.gz BCRIIZYFVHSMLM-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@@H](C)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000411283157 512561883 /nfs/dbraw/zinc/56/18/83/512561883.db2.gz YNWNCYDEWCXVSO-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000367585048 512570883 /nfs/dbraw/zinc/57/08/83/512570883.db2.gz CKWRYKGDADILJF-UHFFFAOYSA-N 1 1 369.425 2.658 20 5 FFBDMO CC[C@@H](NCC(=O)NC1CC[NH+](C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000411472011 512652086 /nfs/dbraw/zinc/65/20/86/512652086.db2.gz GTNJUAAXMZTSIE-GOSISDBHSA-N 1 1 362.474 2.625 20 5 FFBDMO CCOc1ccc(NC(=O)CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1 ZINC000411474903 512652912 /nfs/dbraw/zinc/65/29/12/512652912.db2.gz CXWDSXOBWACFQR-UHFFFAOYSA-N 1 1 370.409 2.775 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)Nc1cc(F)cc(F)c1 ZINC000411478465 512654723 /nfs/dbraw/zinc/65/47/23/512654723.db2.gz KHZPAAMTOTUQMF-UHFFFAOYSA-N 1 1 362.336 2.655 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)n1 ZINC000378245465 512657023 /nfs/dbraw/zinc/65/70/23/512657023.db2.gz NVSAFCGENVLUOF-GFCCVEGCSA-N 1 1 359.361 2.951 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000374301614 512754022 /nfs/dbraw/zinc/75/40/22/512754022.db2.gz KKVJQGDKDAHADR-RBUKOAKNSA-N 1 1 353.422 2.741 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000378501189 512793898 /nfs/dbraw/zinc/79/38/98/512793898.db2.gz YUDQABAYLNGUKL-WFASDCNBSA-N 1 1 353.369 2.629 20 5 FFBDMO COCCn1cc2c(n1)[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC000378563765 512825661 /nfs/dbraw/zinc/82/56/61/512825661.db2.gz TYVTTXFXCSRZFB-HNNXBMFYSA-N 1 1 360.414 2.614 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000390727045 512910609 /nfs/dbraw/zinc/91/06/09/512910609.db2.gz RZZYVGDPWNXXGR-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000374787871 513003511 /nfs/dbraw/zinc/00/35/11/513003511.db2.gz KJWOVQCLIBMXEN-HNNXBMFYSA-N 1 1 357.414 2.964 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370588033 513006565 /nfs/dbraw/zinc/00/65/65/513006565.db2.gz KCAXEJVISHCLRE-YJBOKZPZSA-N 1 1 352.394 2.746 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000368610447 513024302 /nfs/dbraw/zinc/02/43/02/513024302.db2.gz CHEVBCSSYJJOJF-ZBFHGGJFSA-N 1 1 354.410 2.881 20 5 FFBDMO COCC[N@@H+](C)CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)c1ccccc1 ZINC000450314767 513138857 /nfs/dbraw/zinc/13/88/57/513138857.db2.gz NJQRYMUGZFLYHL-INIZCTEOSA-N 1 1 359.430 2.815 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000433809035 513155758 /nfs/dbraw/zinc/15/57/58/513155758.db2.gz RTNIPQUIIUSBOH-NSHDSACASA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000433809035 513155749 /nfs/dbraw/zinc/15/57/49/513155749.db2.gz RTNIPQUIIUSBOH-NSHDSACASA-N 1 1 355.236 2.603 20 5 FFBDMO C[C@]12CC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C[C@H]1C2(F)F ZINC000428744731 513180536 /nfs/dbraw/zinc/18/05/36/513180536.db2.gz CCPRLNABVNMVOZ-FMKPAKJESA-N 1 1 351.353 2.677 20 5 FFBDMO C[C@]12CC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C[C@H]1C2(F)F ZINC000428744731 513180543 /nfs/dbraw/zinc/18/05/43/513180543.db2.gz CCPRLNABVNMVOZ-FMKPAKJESA-N 1 1 351.353 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412695148 513228497 /nfs/dbraw/zinc/22/84/97/513228497.db2.gz IOZFMMSANPIRFE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412695148 513228504 /nfs/dbraw/zinc/22/85/04/513228504.db2.gz IOZFMMSANPIRFE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000434422803 513319431 /nfs/dbraw/zinc/31/94/31/513319431.db2.gz BTXUNJJPXFDNRU-OAHLLOKOSA-N 1 1 351.834 2.924 20 5 FFBDMO C[C@@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000450807619 513350675 /nfs/dbraw/zinc/35/06/75/513350675.db2.gz GWTDJWWHHQHALL-HNNXBMFYSA-N 1 1 368.437 2.652 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425010088 513368259 /nfs/dbraw/zinc/36/82/59/513368259.db2.gz VEZUAOGTEFPIDP-QFBILLFUSA-N 1 1 366.421 2.645 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000447049760 513387793 /nfs/dbraw/zinc/38/77/93/513387793.db2.gz WTUOMJXROZUMMT-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000425060052 513395571 /nfs/dbraw/zinc/39/55/71/513395571.db2.gz UFBCDEQCQGOGPJ-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413173013 513499490 /nfs/dbraw/zinc/49/94/90/513499490.db2.gz BWXPAMHSBAALJU-UHFFFAOYSA-N 1 1 362.352 2.556 20 5 FFBDMO CCC(C)(C)CC[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000441255223 513522148 /nfs/dbraw/zinc/52/21/48/513522148.db2.gz DGJDSEWEIDHGDH-UHFFFAOYSA-N 1 1 369.487 2.727 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1C1CCN(C)CC1 ZINC000413219061 513527393 /nfs/dbraw/zinc/52/73/93/513527393.db2.gz KSAYUFNKJSEDKH-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CCN1C1CC[NH+](C)CC1 ZINC000413219061 513527396 /nfs/dbraw/zinc/52/73/96/513527396.db2.gz KSAYUFNKJSEDKH-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413263640 513555659 /nfs/dbraw/zinc/55/56/59/513555659.db2.gz MQYOXWALNDULIA-UHFFFAOYSA-N 1 1 370.335 2.823 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201042 513586424 /nfs/dbraw/zinc/58/64/24/513586424.db2.gz BWBCISSAYLLLNN-CRAIPNDOSA-N 1 1 365.474 2.830 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000430241015 513596937 /nfs/dbraw/zinc/59/69/37/513596937.db2.gz QBVOEUCDQYEKKC-AWEZNQCLSA-N 1 1 363.458 2.978 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000430558906 513687831 /nfs/dbraw/zinc/68/78/31/513687831.db2.gz ZHKVSFZDQMIJLV-UHFFFAOYSA-N 1 1 355.394 2.761 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000430558906 513687833 /nfs/dbraw/zinc/68/78/33/513687833.db2.gz ZHKVSFZDQMIJLV-UHFFFAOYSA-N 1 1 355.394 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451349114 513694112 /nfs/dbraw/zinc/69/41/12/513694112.db2.gz WOZOJSTWEUACDM-BNEJOLLZSA-N 1 1 361.442 2.937 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000430694716 513724840 /nfs/dbraw/zinc/72/48/40/513724840.db2.gz KZRNZKRRKKKPPV-HNNXBMFYSA-N 1 1 372.400 2.825 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@@H]3O)n2)cc1 ZINC000451426685 513744324 /nfs/dbraw/zinc/74/43/24/513744324.db2.gz VWTLGOUEYAYGRX-OAGGEKHMSA-N 1 1 358.398 2.770 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c(C)cc1[N+](=O)[O-] ZINC000416405058 513753582 /nfs/dbraw/zinc/75/35/82/513753582.db2.gz AZYRDPYYICJJCY-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000416406202 513754652 /nfs/dbraw/zinc/75/46/52/513754652.db2.gz FCGKTBUNWDOOMI-GJZGRUSLSA-N 1 1 369.487 2.562 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000436257102 513810461 /nfs/dbraw/zinc/81/04/61/513810461.db2.gz CMTQCTGYMIDAEG-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000436257102 513810469 /nfs/dbraw/zinc/81/04/69/513810469.db2.gz CMTQCTGYMIDAEG-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@@H](O)COCc3ccco3)C2)cc1 ZINC000451543138 513821580 /nfs/dbraw/zinc/82/15/80/513821580.db2.gz AZHMUNSRNNWGQS-SJLPKXTDSA-N 1 1 360.410 2.945 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000426151165 513858811 /nfs/dbraw/zinc/85/88/11/513858811.db2.gz UYURCVZPVZHSOF-JTQLQIEISA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000426151165 513858818 /nfs/dbraw/zinc/85/88/18/513858818.db2.gz UYURCVZPVZHSOF-JTQLQIEISA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448723772 513867523 /nfs/dbraw/zinc/86/75/23/513867523.db2.gz IVAJDXYFKRMOSJ-RYUDHWBXSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000448926555 513974594 /nfs/dbraw/zinc/97/45/94/513974594.db2.gz VASZAVZBULFIOV-AWEZNQCLSA-N 1 1 369.425 2.732 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448934252 513978430 /nfs/dbraw/zinc/97/84/30/513978430.db2.gz UPKHYVPYDRELBY-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[NH+](C)CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C1CCCC1 ZINC000448977345 514002847 /nfs/dbraw/zinc/00/28/47/514002847.db2.gz YFLURWQOZPQIAD-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000451866893 514031171 /nfs/dbraw/zinc/03/11/71/514031171.db2.gz BUIAQHVMRMDJPE-ZDUSSCGKSA-N 1 1 361.364 2.790 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000426876604 514063991 /nfs/dbraw/zinc/06/39/91/514063991.db2.gz SWMGEVOKJAPTOE-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1c1ccccc1 ZINC000452007832 514131236 /nfs/dbraw/zinc/13/12/36/514131236.db2.gz RMIQNYZRBPAJDX-IAGOWNOFSA-N 1 1 370.405 2.992 20 5 FFBDMO COc1ccc([C@H](CCO)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444671081 514289776 /nfs/dbraw/zinc/28/97/76/514289776.db2.gz HYYASQAVHKZINL-HNNXBMFYSA-N 1 1 356.382 2.693 20 5 FFBDMO C[N@H+](Cc1cc(F)cc(F)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000444692090 514295687 /nfs/dbraw/zinc/29/56/87/514295687.db2.gz KZKQWQYEVQCJPL-HNNXBMFYSA-N 1 1 352.337 2.745 20 5 FFBDMO CCC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000444770350 514324358 /nfs/dbraw/zinc/32/43/58/514324358.db2.gz BYJWVAQMKFJYQP-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000444770350 514324363 /nfs/dbraw/zinc/32/43/63/514324363.db2.gz BYJWVAQMKFJYQP-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000449784684 514351083 /nfs/dbraw/zinc/35/10/83/514351083.db2.gz YFMKXFYOAUHOOW-KRWDZBQOSA-N 1 1 357.458 2.882 20 5 FFBDMO O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000438557202 514403783 /nfs/dbraw/zinc/40/37/83/514403783.db2.gz JWWOVJYMBATNIT-QGZVFWFLSA-N 1 1 369.425 2.752 20 5 FFBDMO O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000438557202 514403790 /nfs/dbraw/zinc/40/37/90/514403790.db2.gz JWWOVJYMBATNIT-QGZVFWFLSA-N 1 1 369.425 2.752 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000449983031 514451963 /nfs/dbraw/zinc/45/19/63/514451963.db2.gz YIPYMBFYOOVSBS-QGZVFWFLSA-N 1 1 373.453 2.938 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000449982409 514452563 /nfs/dbraw/zinc/45/25/63/514452563.db2.gz SZQPWQXHAHIOHM-CYBMUJFWSA-N 1 1 365.405 2.737 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000479493773 514603998 /nfs/dbraw/zinc/60/39/98/514603998.db2.gz BJFAOKJUNQVWCE-QGZVFWFLSA-N 1 1 360.435 2.851 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000466557842 514689989 /nfs/dbraw/zinc/68/99/89/514689989.db2.gz YOPRYVOXVJZJPB-KSSFIOAISA-N 1 1 360.458 2.699 20 5 FFBDMO Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)N(C)C)c(F)cc1[N+](=O)[O-] ZINC000461876890 514764162 /nfs/dbraw/zinc/76/41/62/514764162.db2.gz PNKWSEPAMKJWCS-AGUYFDCRSA-N 1 1 364.421 2.538 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000489339296 514805738 /nfs/dbraw/zinc/80/57/38/514805738.db2.gz XRDDYWFDQOZATM-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000462160486 514917511 /nfs/dbraw/zinc/91/75/11/514917511.db2.gz UPJYDKACXWLFAS-LIRRHRJNSA-N 1 1 371.412 2.913 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000489946954 515043095 /nfs/dbraw/zinc/04/30/95/515043095.db2.gz RGJWHKVRAFUAGL-HDMKZQKVSA-N 1 1 360.458 2.509 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(c2ccc(Cl)cc2)CCOCC1 ZINC000476823845 515207495 /nfs/dbraw/zinc/20/74/95/515207495.db2.gz HPKZPHHYHDSKRL-UHFFFAOYSA-N 1 1 350.806 2.777 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000490627925 515266499 /nfs/dbraw/zinc/26/64/99/515266499.db2.gz PELXXGDBCMMYMQ-UHFFFAOYSA-N 1 1 352.387 2.625 20 5 FFBDMO CC[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000486037264 515307496 /nfs/dbraw/zinc/30/74/96/515307496.db2.gz SHFVOMXGSBWDCR-MRXNPFEDSA-N 1 1 356.426 2.601 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000486037264 515307504 /nfs/dbraw/zinc/30/75/04/515307504.db2.gz SHFVOMXGSBWDCR-MRXNPFEDSA-N 1 1 356.426 2.601 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000504703836 515359157 /nfs/dbraw/zinc/35/91/57/515359157.db2.gz QNXJXVLCWHUQIE-UHFFFAOYSA-N 1 1 368.437 2.740 20 5 FFBDMO CC[C@@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)OC ZINC000499786698 515453864 /nfs/dbraw/zinc/45/38/64/515453864.db2.gz PIEBRYYKOIKSMQ-GFCCVEGCSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(=O)OC ZINC000499787144 515455704 /nfs/dbraw/zinc/45/57/04/515455704.db2.gz SQNLWGHYWIYKCD-ZDUSSCGKSA-N 1 1 351.403 2.505 20 5 FFBDMO C[N@H+](CCc1cccc(Br)c1)CCn1cc([N+](=O)[O-])cn1 ZINC000463418705 515488089 /nfs/dbraw/zinc/48/80/89/515488089.db2.gz ZNZPQSPJNYSFKD-UHFFFAOYSA-N 1 1 353.220 2.728 20 5 FFBDMO COc1cc(C[N@@H+]2CCN(C(C)=O)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000492804128 515564730 /nfs/dbraw/zinc/56/47/30/515564730.db2.gz CMPVGWBZPXYMBJ-UHFFFAOYSA-N 1 1 361.442 2.970 20 5 FFBDMO COc1cc(C[N@H+]2CCN(C(C)=O)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000492804128 515564740 /nfs/dbraw/zinc/56/47/40/515564740.db2.gz CMPVGWBZPXYMBJ-UHFFFAOYSA-N 1 1 361.442 2.970 20 5 FFBDMO C[C@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000463843284 515637156 /nfs/dbraw/zinc/63/71/56/515637156.db2.gz CKMNNFOKMRMJFS-MRXNPFEDSA-N 1 1 370.453 2.668 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000457088287 515640257 /nfs/dbraw/zinc/64/02/57/515640257.db2.gz RCKCVRZOMANCTR-MRXNPFEDSA-N 1 1 360.458 2.750 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000457093690 515643526 /nfs/dbraw/zinc/64/35/26/515643526.db2.gz YVMIWAZFANXKFK-KRWDZBQOSA-N 1 1 374.485 2.752 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cncc(F)c2)c([N+](=O)[O-])c1 ZINC000459618327 515698230 /nfs/dbraw/zinc/69/82/30/515698230.db2.gz DJYOBUPJZQEIED-WDEREUQCSA-N 1 1 362.361 2.815 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000486962631 515701221 /nfs/dbraw/zinc/70/12/21/515701221.db2.gz GTHQIDKWQARGOS-CABCVRRESA-N 1 1 366.849 2.717 20 5 FFBDMO C[C@@H](C(=O)NC(=O)Nc1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511060993 515760373 /nfs/dbraw/zinc/76/03/73/515760373.db2.gz WHZIIFVLKSHTCP-AWEZNQCLSA-N 1 1 370.409 2.806 20 5 FFBDMO C[C@@H](C(=O)NC(=O)Nc1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511060993 515760382 /nfs/dbraw/zinc/76/03/82/515760382.db2.gz WHZIIFVLKSHTCP-AWEZNQCLSA-N 1 1 370.409 2.806 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071802 515767908 /nfs/dbraw/zinc/76/79/08/515767908.db2.gz IBCGKOYFQGIUHL-INIZCTEOSA-N 1 1 355.438 2.817 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071802 515767916 /nfs/dbraw/zinc/76/79/16/515767916.db2.gz IBCGKOYFQGIUHL-INIZCTEOSA-N 1 1 355.438 2.817 20 5 FFBDMO COc1cc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000511097173 515779194 /nfs/dbraw/zinc/77/91/94/515779194.db2.gz UCXCHKYMBOBRCK-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1cc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000511097173 515779202 /nfs/dbraw/zinc/77/92/02/515779202.db2.gz UCXCHKYMBOBRCK-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCCc1ccc(F)cc1 ZINC000511135861 515799989 /nfs/dbraw/zinc/79/99/89/515799989.db2.gz IDFMNTSSHAJIBE-UHFFFAOYSA-N 1 1 359.401 2.567 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCCc1ccc(F)cc1 ZINC000511135861 515799999 /nfs/dbraw/zinc/79/99/99/515799999.db2.gz IDFMNTSSHAJIBE-UHFFFAOYSA-N 1 1 359.401 2.567 20 5 FFBDMO CCc1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000478457097 515830204 /nfs/dbraw/zinc/83/02/04/515830204.db2.gz IQWXTQIZCYNAHW-ROUUACIJSA-N 1 1 353.422 2.985 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)ccc1Cl ZINC000500782619 515857744 /nfs/dbraw/zinc/85/77/44/515857744.db2.gz WJQLIGYEVPGWQW-UHFFFAOYSA-N 1 1 350.762 2.663 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1 ZINC000506477130 515893774 /nfs/dbraw/zinc/89/37/74/515893774.db2.gz LZQULIUIHBDKSY-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000494669778 515918845 /nfs/dbraw/zinc/91/88/45/515918845.db2.gz CSIPEUQGRYEFIX-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000464819721 515972435 /nfs/dbraw/zinc/97/24/35/515972435.db2.gz BXKBGIFLSRBZND-LPHOPBHVSA-N 1 1 361.442 2.619 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000460110689 516025092 /nfs/dbraw/zinc/02/50/92/516025092.db2.gz QUBHSAYVXBEVNT-ZDUSSCGKSA-N 1 1 352.435 2.523 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000464974585 516031289 /nfs/dbraw/zinc/03/12/89/516031289.db2.gz RXFYQLUCBSIBDR-MRXNPFEDSA-N 1 1 356.426 2.527 20 5 FFBDMO COc1cc(C[N@@H+]2CC(C)(C)O[C@@]3(CCCOC3)C2)ccc1[N+](=O)[O-] ZINC000483348495 516045655 /nfs/dbraw/zinc/04/56/55/516045655.db2.gz XGVSEVHZSVCNQG-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc(C[N@H+]2CC(C)(C)O[C@@]3(CCCOC3)C2)ccc1[N+](=O)[O-] ZINC000483348495 516045661 /nfs/dbraw/zinc/04/56/61/516045661.db2.gz XGVSEVHZSVCNQG-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])n3C)cc2)C1 ZINC000465198537 516091318 /nfs/dbraw/zinc/09/13/18/516091318.db2.gz VDMMGFXCFIRARX-AWEZNQCLSA-N 1 1 372.425 2.906 20 5 FFBDMO O=C(NCc1cccc(C[NH+]2CCCC2)c1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000479335450 516153755 /nfs/dbraw/zinc/15/37/55/516153755.db2.gz PIBSUQXTSFAJJY-UHFFFAOYSA-N 1 1 355.394 2.826 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2F)c2ccccc2)CC1 ZINC000483702426 516180365 /nfs/dbraw/zinc/18/03/65/516180365.db2.gz UNUALKRIXTWZMZ-SFHVURJKSA-N 1 1 372.400 2.661 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000507453793 516214521 /nfs/dbraw/zinc/21/45/21/516214521.db2.gz ZYXPZEFOPWSVAZ-GASCZTMLSA-N 1 1 369.487 2.550 20 5 FFBDMO CCc1cccc(F)c1C[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000474930586 516239917 /nfs/dbraw/zinc/23/99/17/516239917.db2.gz QRKCNYBDAWERLT-UHFFFAOYSA-N 1 1 366.414 2.860 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000465744992 516246188 /nfs/dbraw/zinc/24/61/88/516246188.db2.gz DJFOUJPOMQMDGX-OAHLLOKOSA-N 1 1 362.474 2.947 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1C ZINC000497558470 516326392 /nfs/dbraw/zinc/32/63/92/516326392.db2.gz QKUJXNSXZFCGQP-LSDHHAIUSA-N 1 1 369.487 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)c1 ZINC000557642353 516352757 /nfs/dbraw/zinc/35/27/57/516352757.db2.gz KEBWFLOPDSCGBN-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000513095473 516470421 /nfs/dbraw/zinc/47/04/21/516470421.db2.gz KJTHZUVIWVOETQ-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000513095473 516470430 /nfs/dbraw/zinc/47/04/30/516470430.db2.gz KJTHZUVIWVOETQ-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@@H]1COc2ccccc2C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000543875430 516474134 /nfs/dbraw/zinc/47/41/34/516474134.db2.gz BBBMCBVNSIKDQP-PBHICJAKSA-N 1 1 358.394 2.618 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000518052915 516534779 /nfs/dbraw/zinc/53/47/79/516534779.db2.gz OGBBNAZXXIVQLI-MRXNPFEDSA-N 1 1 359.430 2.711 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000554746482 516617983 /nfs/dbraw/zinc/61/79/83/516617983.db2.gz ZGVVQFKEKSBYHW-INIZCTEOSA-N 1 1 359.426 2.533 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(NCCc3[nH+]ccn3Cc3ccccc3)c21 ZINC000544394594 516739461 /nfs/dbraw/zinc/73/94/61/516739461.db2.gz LAWXNIBLJZIJOU-UHFFFAOYSA-N 1 1 374.404 2.859 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[NH+](C)C ZINC000524681134 516787984 /nfs/dbraw/zinc/78/79/84/516787984.db2.gz XJSGCPMFKOEJSN-INIZCTEOSA-N 1 1 361.373 2.775 20 5 FFBDMO Cc1ccc(-c2noc([C@@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)cc1F ZINC000544514811 516792707 /nfs/dbraw/zinc/79/27/07/516792707.db2.gz AOMVPUMPJPKPBB-LLVKDONJSA-N 1 1 360.349 2.640 20 5 FFBDMO CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000518899062 516812315 /nfs/dbraw/zinc/81/23/15/516812315.db2.gz PPCUVIQZESFXFZ-KRWDZBQOSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000561880199 516812396 /nfs/dbraw/zinc/81/23/96/516812396.db2.gz BLHNBNIXQVVOEZ-AWEZNQCLSA-N 1 1 366.437 2.714 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1SC ZINC000518899239 516813491 /nfs/dbraw/zinc/81/34/91/516813491.db2.gz RCCPVXAERCGWQQ-LBPRGKRZSA-N 1 1 365.455 2.634 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000558596184 516828455 /nfs/dbraw/zinc/82/84/55/516828455.db2.gz JEGNBSLDVVCTBW-IAGOWNOFSA-N 1 1 368.437 2.527 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000561982608 516862071 /nfs/dbraw/zinc/86/20/71/516862071.db2.gz PGNLEWYPDKFKHS-CYBMUJFWSA-N 1 1 371.384 2.934 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000561982608 516862079 /nfs/dbraw/zinc/86/20/79/516862079.db2.gz PGNLEWYPDKFKHS-CYBMUJFWSA-N 1 1 371.384 2.934 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000551821239 516890692 /nfs/dbraw/zinc/89/06/92/516890692.db2.gz JCEGMQHFOXBBRM-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC1 ZINC000514217797 516908498 /nfs/dbraw/zinc/90/84/98/516908498.db2.gz HOKGUIORJGSMPT-UHFFFAOYSA-N 1 1 357.357 2.753 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000562125384 516927650 /nfs/dbraw/zinc/92/76/50/516927650.db2.gz XOBUAKZUNUNUIT-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO C[C@@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000514683787 517003209 /nfs/dbraw/zinc/00/32/09/517003209.db2.gz IYNDFEXKKRMMAZ-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000514705276 517014634 /nfs/dbraw/zinc/01/46/34/517014634.db2.gz LIDRJDQECZYSSH-KRWDZBQOSA-N 1 1 364.446 2.853 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000541393669 517028743 /nfs/dbraw/zinc/02/87/43/517028743.db2.gz MBEDYKOVRURWSJ-LLVKDONJSA-N 1 1 355.847 2.693 20 5 FFBDMO CC(C)C[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000562394713 517076716 /nfs/dbraw/zinc/07/67/16/517076716.db2.gz DTELQAWOAURUPR-MAUKXSAKSA-N 1 1 363.458 2.561 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000519626057 517086942 /nfs/dbraw/zinc/08/69/42/517086942.db2.gz KWTDMFDAQMQQFJ-LLVKDONJSA-N 1 1 372.263 2.745 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000532699189 517102275 /nfs/dbraw/zinc/10/22/75/517102275.db2.gz GJQIJYJODBVSAT-OWCLPIDISA-N 1 1 360.458 2.871 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970505 517230304 /nfs/dbraw/zinc/23/03/04/517230304.db2.gz OBGQSELNUJHOEK-DLBZAZTESA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970505 517230314 /nfs/dbraw/zinc/23/03/14/517230314.db2.gz OBGQSELNUJHOEK-DLBZAZTESA-N 1 1 361.442 2.619 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000552457832 517269464 /nfs/dbraw/zinc/26/94/64/517269464.db2.gz GUOIXDFQJVWJBZ-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000552457832 517269473 /nfs/dbraw/zinc/26/94/73/517269473.db2.gz GUOIXDFQJVWJBZ-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000541924620 517295081 /nfs/dbraw/zinc/29/50/81/517295081.db2.gz HYRXRJHSJBMNJW-CABCVRRESA-N 1 1 369.425 2.538 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541956679 517310894 /nfs/dbraw/zinc/31/08/94/517310894.db2.gz VXUOZBCXCZFAPX-HNNXBMFYSA-N 1 1 367.764 2.649 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCc2ccccc2C1 ZINC000548935576 517314232 /nfs/dbraw/zinc/31/42/32/517314232.db2.gz OKBOURGXMKULGF-UHFFFAOYSA-N 1 1 353.422 2.654 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCc2ccccc2C1 ZINC000548935576 517314239 /nfs/dbraw/zinc/31/42/39/517314239.db2.gz OKBOURGXMKULGF-UHFFFAOYSA-N 1 1 353.422 2.654 20 5 FFBDMO CN1CC[N@H+](C)C[C@H]1c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000545789223 517365828 /nfs/dbraw/zinc/36/58/28/517365828.db2.gz VSOWPWLGQCUPPZ-LBPRGKRZSA-N 1 1 359.411 2.778 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000545789223 517365838 /nfs/dbraw/zinc/36/58/38/517365838.db2.gz VSOWPWLGQCUPPZ-LBPRGKRZSA-N 1 1 359.411 2.778 20 5 FFBDMO O=C(Nc1cc(F)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000526934453 517393864 /nfs/dbraw/zinc/39/38/64/517393864.db2.gz GCXULNMRBAOIHM-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO CCOc1cccc(N(C)CC(C)(C)C[NH+]2CCOCC2)c1[N+](=O)[O-] ZINC000545875524 517408630 /nfs/dbraw/zinc/40/86/30/517408630.db2.gz PXDADFYPAUORES-UHFFFAOYSA-N 1 1 351.447 2.788 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000542167420 517416871 /nfs/dbraw/zinc/41/68/71/517416871.db2.gz OFTVHDLWJCPOKE-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000542167420 517416880 /nfs/dbraw/zinc/41/68/80/517416880.db2.gz OFTVHDLWJCPOKE-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO C[C@H](C(=O)NCCc1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549171756 517435822 /nfs/dbraw/zinc/43/58/22/517435822.db2.gz PDRGFCOALZUIEC-OAHLLOKOSA-N 1 1 373.428 2.956 20 5 FFBDMO CC(=O)NC1CCC([N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000542246601 517460046 /nfs/dbraw/zinc/46/00/46/517460046.db2.gz BUHSWMFMJYNMBN-UHFFFAOYSA-N 1 1 373.413 2.524 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000553059410 517502959 /nfs/dbraw/zinc/50/29/59/517502959.db2.gz JSMINWVOZANALW-LSDHHAIUSA-N 1 1 360.458 2.785 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000538379161 517595343 /nfs/dbraw/zinc/59/53/43/517595343.db2.gz RPMASYUNMQXXOA-SFHVURJKSA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000538379161 517595354 /nfs/dbraw/zinc/59/53/54/517595354.db2.gz RPMASYUNMQXXOA-SFHVURJKSA-N 1 1 368.437 2.830 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000534020779 517709919 /nfs/dbraw/zinc/70/99/19/517709919.db2.gz SSKZULORQKJTJW-SJLPKXTDSA-N 1 1 354.410 2.812 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000556858918 517713768 /nfs/dbraw/zinc/71/37/68/517713768.db2.gz BVFLCDQIXAYBLT-AWEZNQCLSA-N 1 1 372.347 2.976 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCCc1c[nH]c3ccc([N+](=O)[O-])cc13)CC2 ZINC000563265222 517779012 /nfs/dbraw/zinc/77/90/12/517779012.db2.gz VRXLFMHRDVIZIG-AWEZNQCLSA-N 1 1 367.409 2.502 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000539329445 517996952 /nfs/dbraw/zinc/99/69/52/517996952.db2.gz HXINJGYQNNCQNU-UHFFFAOYSA-N 1 1 369.377 2.849 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534694963 518003556 /nfs/dbraw/zinc/00/35/56/518003556.db2.gz GPUJKPKGLKETIO-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534694963 518003561 /nfs/dbraw/zinc/00/35/61/518003561.db2.gz GPUJKPKGLKETIO-GOSISDBHSA-N 1 1 354.410 2.623 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2CCc2ccccc2)c1 ZINC000534863439 518062875 /nfs/dbraw/zinc/06/28/75/518062875.db2.gz GBJGMYMBMSWLBS-IEBWSBKVSA-N 1 1 358.442 2.640 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000543476705 518111494 /nfs/dbraw/zinc/11/14/94/518111494.db2.gz TZXHBOVOQKCFPL-HOCLYGCPSA-N 1 1 352.431 2.711 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000543574254 518142516 /nfs/dbraw/zinc/14/25/16/518142516.db2.gz PVZSAQIEHWSKRA-APWZRJJASA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000543574254 518142521 /nfs/dbraw/zinc/14/25/21/518142521.db2.gz PVZSAQIEHWSKRA-APWZRJJASA-N 1 1 364.442 2.616 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000531151900 518156175 /nfs/dbraw/zinc/15/61/75/518156175.db2.gz OUHORCQSORYGAX-OAHLLOKOSA-N 1 1 361.442 2.744 20 5 FFBDMO COc1cc(C[N@H+](C)CCC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000539851217 518172001 /nfs/dbraw/zinc/17/20/01/518172001.db2.gz SAUFZLPCODLKOB-UHFFFAOYSA-N 1 1 354.403 2.776 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000539851217 518172002 /nfs/dbraw/zinc/17/20/02/518172002.db2.gz SAUFZLPCODLKOB-UHFFFAOYSA-N 1 1 354.403 2.776 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000566863614 518237620 /nfs/dbraw/zinc/23/76/20/518237620.db2.gz DLMVDXJSMCCYEA-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000578761890 518362133 /nfs/dbraw/zinc/36/21/33/518362133.db2.gz SQKVVZWBNNHTFR-MRXNPFEDSA-N 1 1 366.421 2.677 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)c1 ZINC000578761890 518362140 /nfs/dbraw/zinc/36/21/40/518362140.db2.gz SQKVVZWBNNHTFR-MRXNPFEDSA-N 1 1 366.421 2.677 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000567177098 518391137 /nfs/dbraw/zinc/39/11/37/518391137.db2.gz ZIJZLIIYOUUNEK-UHFFFAOYSA-N 1 1 373.400 2.773 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584676412 518424370 /nfs/dbraw/zinc/42/43/70/518424370.db2.gz GHDCHYIUKQXCEA-UHFFFAOYSA-N 1 1 361.446 2.650 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000581850865 518467221 /nfs/dbraw/zinc/46/72/21/518467221.db2.gz LNDZOAFXAZPBFU-INIZCTEOSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000581850865 518467229 /nfs/dbraw/zinc/46/72/29/518467229.db2.gz LNDZOAFXAZPBFU-INIZCTEOSA-N 1 1 354.410 2.832 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000573284327 518592046 /nfs/dbraw/zinc/59/20/46/518592046.db2.gz VAEKBBMKLSLNFD-HNNXBMFYSA-N 1 1 355.385 2.652 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)[C@@H]2C1 ZINC000585783611 518595681 /nfs/dbraw/zinc/59/56/81/518595681.db2.gz KQEBSEGZCLRTHT-SJORKVTESA-N 1 1 372.400 2.705 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2cc(Br)cn2)ccc1[N+](=O)[O-] ZINC000573402358 518646249 /nfs/dbraw/zinc/64/62/49/518646249.db2.gz FNOOKDDIOWXSPA-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)C(C)(C)C1 ZINC000567750841 518691660 /nfs/dbraw/zinc/69/16/60/518691660.db2.gz JQJLKOBPENKXQB-NSHDSACASA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)C(C)(C)C1 ZINC000567750841 518691668 /nfs/dbraw/zinc/69/16/68/518691668.db2.gz JQJLKOBPENKXQB-NSHDSACASA-N 1 1 355.822 2.568 20 5 FFBDMO COC(=O)c1ccccc1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000589305595 518976898 /nfs/dbraw/zinc/97/68/98/518976898.db2.gz NFLWWLCQKFZBDH-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccccc1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000589305595 518976903 /nfs/dbraw/zinc/97/69/03/518976903.db2.gz NFLWWLCQKFZBDH-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c1 ZINC000589505954 519019778 /nfs/dbraw/zinc/01/97/78/519019778.db2.gz RXBUTUCJHSEMOL-SUMWQHHRSA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c1 ZINC000589505954 519019783 /nfs/dbraw/zinc/01/97/83/519019783.db2.gz RXBUTUCJHSEMOL-SUMWQHHRSA-N 1 1 358.398 2.661 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000580204335 519059848 /nfs/dbraw/zinc/05/98/48/519059848.db2.gz CLPCCPIMZIWPGH-QGZVFWFLSA-N 1 1 364.446 2.636 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@](C)(O)C2)cc1OC ZINC000571792806 519277972 /nfs/dbraw/zinc/27/79/72/519277972.db2.gz PIBGUAVLKWOFLM-ACJLOTCBSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@](C)(O)C2)cc1OC ZINC000571792806 519277981 /nfs/dbraw/zinc/27/79/81/519277981.db2.gz PIBGUAVLKWOFLM-ACJLOTCBSA-N 1 1 352.431 2.985 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601506 519283114 /nfs/dbraw/zinc/28/31/14/519283114.db2.gz CZDBIMNIDVTUHO-GUYCJALGSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601506 519283120 /nfs/dbraw/zinc/28/31/20/519283120.db2.gz CZDBIMNIDVTUHO-GUYCJALGSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601508 519284052 /nfs/dbraw/zinc/28/40/52/519284052.db2.gz CZDBIMNIDVTUHO-SUMWQHHRSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601508 519284059 /nfs/dbraw/zinc/28/40/59/519284059.db2.gz CZDBIMNIDVTUHO-SUMWQHHRSA-N 1 1 371.441 2.781 20 5 FFBDMO COC(=O)Cc1ccc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000590695612 519321217 /nfs/dbraw/zinc/32/12/17/519321217.db2.gz ZIVRZATWJWBWNN-KRWDZBQOSA-N 1 1 355.394 2.909 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000574946930 519416421 /nfs/dbraw/zinc/41/64/21/519416421.db2.gz GHACBOHOZRWEFN-CQSZACIVSA-N 1 1 364.446 2.780 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238688 519450486 /nfs/dbraw/zinc/45/04/86/519450486.db2.gz PIIWAZPZXFFRSC-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238688 519450494 /nfs/dbraw/zinc/45/04/94/519450494.db2.gz PIIWAZPZXFFRSC-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)c1 ZINC000566429319 519487764 /nfs/dbraw/zinc/48/77/64/519487764.db2.gz SNYLECDLDHUMCB-HZPDHXFCSA-N 1 1 357.410 2.527 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H](c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602857358 519929025 /nfs/dbraw/zinc/92/90/25/519929025.db2.gz VDZAVFXGAKNYMI-INIZCTEOSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000602857358 519929038 /nfs/dbraw/zinc/92/90/38/519929038.db2.gz VDZAVFXGAKNYMI-INIZCTEOSA-N 1 1 354.410 2.832 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)CC1 ZINC000602878454 519944690 /nfs/dbraw/zinc/94/46/90/519944690.db2.gz WNQDERRDWSTLRY-UHFFFAOYSA-N 1 1 357.414 2.563 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC=C(c2cnn(C)c2)C1 ZINC000602886880 519951233 /nfs/dbraw/zinc/95/12/33/519951233.db2.gz JWIGCMAHYDSMGC-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997441 520012848 /nfs/dbraw/zinc/01/28/48/520012848.db2.gz JXRUGUZBSPVZQT-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(F)c1N1CCOCC1 ZINC000594546561 520020060 /nfs/dbraw/zinc/02/00/60/520020060.db2.gz QXCBIEZVVQGJOM-ZIAGYGMSSA-N 1 1 364.421 2.609 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608784752 520127652 /nfs/dbraw/zinc/12/76/52/520127652.db2.gz QVPAZKXCVSYDOE-CQSZACIVSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608784752 520127660 /nfs/dbraw/zinc/12/76/60/520127660.db2.gz QVPAZKXCVSYDOE-CQSZACIVSA-N 1 1 360.370 2.562 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866656 520149218 /nfs/dbraw/zinc/14/92/18/520149218.db2.gz MWJJQWGJYGGQIP-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866656 520149228 /nfs/dbraw/zinc/14/92/28/520149228.db2.gz MWJJQWGJYGGQIP-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)C2 ZINC000597715573 520194489 /nfs/dbraw/zinc/19/44/89/520194489.db2.gz MUYOMLQNLVCPIS-IBGZPJMESA-N 1 1 358.442 2.727 20 5 FFBDMO O=C([C@H]1CCc2[nH]cnc2C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597723649 520197910 /nfs/dbraw/zinc/19/79/10/520197910.db2.gz MDJIZNAOWZUZBK-GJZGRUSLSA-N 1 1 354.410 2.829 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+]C2(c3ccccc3OC)CC2)c([N+](=O)[O-])c1 ZINC000592142748 520219573 /nfs/dbraw/zinc/21/95/73/520219573.db2.gz CLKFMKBFNRDWAV-UHFFFAOYSA-N 1 1 371.393 2.829 20 5 FFBDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1SC ZINC000592174367 520245558 /nfs/dbraw/zinc/24/55/58/520245558.db2.gz RFICALQHVRKQPX-NFAWXSAZSA-N 1 1 364.427 2.643 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNCc2csc([N+](=O)[O-])c2)C1 ZINC000594994296 520248200 /nfs/dbraw/zinc/24/82/00/520248200.db2.gz JOWJMWOGSANMIJ-QGZVFWFLSA-N 1 1 360.483 2.562 20 5 FFBDMO CN1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000594994296 520248206 /nfs/dbraw/zinc/24/82/06/520248206.db2.gz JOWJMWOGSANMIJ-QGZVFWFLSA-N 1 1 360.483 2.562 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@H]3C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000603399448 520248520 /nfs/dbraw/zinc/24/85/20/520248520.db2.gz ATQPTGNZQFKEDM-GFCCVEGCSA-N 1 1 369.849 2.946 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCS(=O)(=O)c1ccccc1 ZINC000595007149 520253396 /nfs/dbraw/zinc/25/33/96/520253396.db2.gz KCRZADZBWYQYBU-ZDUSSCGKSA-N 1 1 364.423 2.728 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1C1CCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000592197203 520256631 /nfs/dbraw/zinc/25/66/31/520256631.db2.gz CXISOZBJHVZZKZ-CQSZACIVSA-N 1 1 361.398 2.917 20 5 FFBDMO COc1ccnc(C[NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1F ZINC000595082272 520285888 /nfs/dbraw/zinc/28/58/88/520285888.db2.gz XLRSFAGWBWPAMV-NSHDSACASA-N 1 1 362.361 2.644 20 5 FFBDMO CCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597945624 520344551 /nfs/dbraw/zinc/34/45/51/520344551.db2.gz KDNGEUIOBCSDBU-LBPRGKRZSA-N 1 1 357.863 2.893 20 5 FFBDMO CCOc1cc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000617194780 520376961 /nfs/dbraw/zinc/37/69/61/520376961.db2.gz OLQDVQUCSJMFBJ-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000617263864 520402604 /nfs/dbraw/zinc/40/26/04/520402604.db2.gz HIVSCRIIWJRPJU-GFCCVEGCSA-N 1 1 351.428 2.720 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492820 520415835 /nfs/dbraw/zinc/41/58/35/520415835.db2.gz DJZLNBOLVZQACJ-BZUAXINKSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609758133 520422957 /nfs/dbraw/zinc/42/29/57/520422957.db2.gz LBPIPTADTRSQFF-CZUORRHYSA-N 1 1 358.442 2.868 20 5 FFBDMO CCOC(=O)c1ccnc(NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000609961226 520489574 /nfs/dbraw/zinc/48/95/74/520489574.db2.gz BXPOZECCTKVMAC-UHFFFAOYSA-N 1 1 364.446 2.655 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@H+]2CCCC[C@@H]2CC)c1[N+](=O)[O-] ZINC000609963711 520491584 /nfs/dbraw/zinc/49/15/84/520491584.db2.gz HVQZWASCAOEMCD-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218502 520501925 /nfs/dbraw/zinc/50/19/25/520501925.db2.gz GOHNYZQYOOFCLE-LBPRGKRZSA-N 1 1 367.396 2.939 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000604482585 520573844 /nfs/dbraw/zinc/57/38/44/520573844.db2.gz QXTDWKPCEZSMSX-UHFFFAOYSA-N 1 1 354.410 2.586 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](CO)Cc1ccccc1 ZINC000595594560 520579371 /nfs/dbraw/zinc/57/93/71/520579371.db2.gz GBTBLZUNIOCJEB-SFHVURJKSA-N 1 1 371.437 2.767 20 5 FFBDMO CCCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000592828295 520604797 /nfs/dbraw/zinc/60/47/97/520604797.db2.gz FTKGOMYYCHYDCN-CQSZACIVSA-N 1 1 369.849 2.960 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCn4c(nnc4C(F)(F)F)C3)c2c1 ZINC000601120399 520645668 /nfs/dbraw/zinc/64/56/68/520645668.db2.gz HNHHQDMRKMKHEV-UHFFFAOYSA-N 1 1 364.287 2.774 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598512468 520672237 /nfs/dbraw/zinc/67/22/37/520672237.db2.gz TVJOVJSCBZEOLL-KRWDZBQOSA-N 1 1 369.421 2.673 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000601184411 520677245 /nfs/dbraw/zinc/67/72/45/520677245.db2.gz LAFNQUAYGLJXNJ-GFCCVEGCSA-N 1 1 350.806 2.715 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000598562035 520708271 /nfs/dbraw/zinc/70/82/71/520708271.db2.gz RZOCLYSISHAXNM-ZDUSSCGKSA-N 1 1 365.405 2.594 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 ZINC000610484866 520710828 /nfs/dbraw/zinc/71/08/28/520710828.db2.gz VOWKQEAMZUZECZ-DTORHVGOSA-N 1 1 360.258 2.854 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 ZINC000610484866 520710834 /nfs/dbraw/zinc/71/08/34/520710834.db2.gz VOWKQEAMZUZECZ-DTORHVGOSA-N 1 1 360.258 2.854 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](OC(C)C)C1 ZINC000593055572 520713079 /nfs/dbraw/zinc/71/30/79/520713079.db2.gz LYLMZCJLVFLWBY-OAHLLOKOSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093474 520740902 /nfs/dbraw/zinc/74/09/02/520740902.db2.gz UECGDFSAGFLOAY-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c(C)c1[N+](=O)[O-] ZINC000598614135 520743618 /nfs/dbraw/zinc/74/36/18/520743618.db2.gz JJHPMTKDTRHMQR-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000598613888 520743998 /nfs/dbraw/zinc/74/39/98/520743998.db2.gz ZIAWBVKWQWLJSW-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)CC[C@H]21 ZINC000601334222 520745127 /nfs/dbraw/zinc/74/51/27/520745127.db2.gz ZGEFKMFZJJSQQB-CRAIPNDOSA-N 1 1 357.454 2.959 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645371 520758759 /nfs/dbraw/zinc/75/87/59/520758759.db2.gz INKMWNICLQAOIZ-PWSUYJOCSA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645371 520758764 /nfs/dbraw/zinc/75/87/64/520758764.db2.gz INKMWNICLQAOIZ-PWSUYJOCSA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595875156 520782311 /nfs/dbraw/zinc/78/23/11/520782311.db2.gz PUUKXAOPVDVDSO-QLJPJBMISA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595875154 520782330 /nfs/dbraw/zinc/78/23/30/520782330.db2.gz PUUKXAOPVDVDSO-MGPLVRAMSA-N 1 1 360.357 2.655 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595900729 520804573 /nfs/dbraw/zinc/80/45/73/520804573.db2.gz JIJDNWLLSDOAFS-NVXWUHKLSA-N 1 1 374.485 2.942 20 5 FFBDMO C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@](C)(C(F)F)O1 ZINC000595918103 520824034 /nfs/dbraw/zinc/82/40/34/520824034.db2.gz ONQJNPLCEVQMHZ-BZNIZROVSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@](C)(C(F)F)O1 ZINC000595918103 520824043 /nfs/dbraw/zinc/82/40/43/520824043.db2.gz ONQJNPLCEVQMHZ-BZNIZROVSA-N 1 1 357.357 2.668 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC000595920975 520825457 /nfs/dbraw/zinc/82/54/57/520825457.db2.gz VYQNTPONUOBEER-YVEFUNNKSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@@](C)(C(F)F)C1 ZINC000595920975 520825462 /nfs/dbraw/zinc/82/54/62/520825462.db2.gz VYQNTPONUOBEER-YVEFUNNKSA-N 1 1 371.384 2.976 20 5 FFBDMO COc1cc(CNC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000596058389 520885438 /nfs/dbraw/zinc/88/54/38/520885438.db2.gz GPVVDZBDDLLWGF-HNNXBMFYSA-N 1 1 363.458 2.824 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@H]1CCN1C1CCCCC1)OCCO2 ZINC000598991748 520963535 /nfs/dbraw/zinc/96/35/35/520963535.db2.gz FMCMZUJPLLAUMA-MRXNPFEDSA-N 1 1 361.442 2.863 20 5 FFBDMO COc1cc(C[NH2+]C[C@H](n2cccn2)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000598989932 520963577 /nfs/dbraw/zinc/96/35/77/520963577.db2.gz WKTQWRPYJKGFDY-AWEZNQCLSA-N 1 1 374.319 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c2ncccc12 ZINC000596269026 521003019 /nfs/dbraw/zinc/00/30/19/521003019.db2.gz RBRKURRJGGPHEO-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2c2ncnc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000614517847 521005828 /nfs/dbraw/zinc/00/58/28/521005828.db2.gz BWTBAAPNIBTWLK-IJEWVQPXSA-N 1 1 371.441 2.616 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000596306591 521020141 /nfs/dbraw/zinc/02/01/41/521020141.db2.gz GZAOWZINLUMKFM-AWEZNQCLSA-N 1 1 371.441 2.844 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000611198206 521033775 /nfs/dbraw/zinc/03/37/75/521033775.db2.gz ZDDMLCAYTMUCNR-HXUWFJFHSA-N 1 1 366.421 2.951 20 5 FFBDMO O=[N+]([O-])c1ccsc1N1CC[NH+](CCCOCC(F)(F)F)CC1 ZINC000611411814 521141959 /nfs/dbraw/zinc/14/19/59/521141959.db2.gz RXKSZSKVIHJASW-UHFFFAOYSA-N 1 1 353.366 2.747 20 5 FFBDMO COC(=O)c1cc(-c2ccc(CC[NH+]3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000596635117 521179364 /nfs/dbraw/zinc/17/93/64/521179364.db2.gz FHWMXYZZGIGEHY-UHFFFAOYSA-N 1 1 370.405 2.923 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(Cc2cccc(Cl)c2)CC1 ZINC000611524726 521201181 /nfs/dbraw/zinc/20/11/81/521201181.db2.gz MSWZNOCRFMOJOG-UHFFFAOYSA-N 1 1 363.849 2.571 20 5 FFBDMO COCC1([N@H+](C)Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000611550191 521214387 /nfs/dbraw/zinc/21/43/87/521214387.db2.gz MBVUXJLGGAJZMA-UHFFFAOYSA-N 1 1 360.357 2.858 20 5 FFBDMO COCC1([N@@H+](C)Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000611550191 521214390 /nfs/dbraw/zinc/21/43/90/521214390.db2.gz MBVUXJLGGAJZMA-UHFFFAOYSA-N 1 1 360.357 2.858 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000596694808 521227527 /nfs/dbraw/zinc/22/75/27/521227527.db2.gz OBSYEIGKXRYJMT-JTQLQIEISA-N 1 1 358.345 2.802 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599463901 521240020 /nfs/dbraw/zinc/24/00/20/521240020.db2.gz GTSLYAJAGMVURO-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599463901 521240026 /nfs/dbraw/zinc/24/00/26/521240026.db2.gz GTSLYAJAGMVURO-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000611711662 521293567 /nfs/dbraw/zinc/29/35/67/521293567.db2.gz NMSYUIMKLUPZEA-SCLBCKFNSA-N 1 1 353.426 2.991 20 5 FFBDMO COc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000599600244 521322539 /nfs/dbraw/zinc/32/25/39/521322539.db2.gz IMXKMPCSCIFCFF-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO CN(C)C(=O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000594014454 521349260 /nfs/dbraw/zinc/34/92/60/521349260.db2.gz QVYVUCAYABJBGH-QAQDUYKDSA-N 1 1 363.458 2.569 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027144 521359723 /nfs/dbraw/zinc/35/97/23/521359723.db2.gz RGWSCGGGNJNGMA-ZWKOTPCHSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027144 521359727 /nfs/dbraw/zinc/35/97/27/521359727.db2.gz RGWSCGGGNJNGMA-ZWKOTPCHSA-N 1 1 359.426 2.734 20 5 FFBDMO COC(=O)[C@@](C)(NC[C@@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000599651139 521361913 /nfs/dbraw/zinc/36/19/13/521361913.db2.gz HGTMWXDGPBRPEN-HKUYNNGSSA-N 1 1 363.458 2.836 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594073190 521389899 /nfs/dbraw/zinc/38/98/99/521389899.db2.gz CKRPEIMVNZSKRM-MCIONIFRSA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594073190 521389910 /nfs/dbraw/zinc/38/99/10/521389910.db2.gz CKRPEIMVNZSKRM-MCIONIFRSA-N 1 1 364.446 2.831 20 5 FFBDMO CC(C)N1C[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1=O ZINC000602555568 521410531 /nfs/dbraw/zinc/41/05/31/521410531.db2.gz RIINWLYSGNDEKD-QMMMGPOBSA-N 1 1 362.249 2.518 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731743 521434617 /nfs/dbraw/zinc/43/46/17/521434617.db2.gz RAHWKOXGYKGHMJ-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731743 521434624 /nfs/dbraw/zinc/43/46/24/521434624.db2.gz RAHWKOXGYKGHMJ-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1cc([N+](=O)[O-])c[nH]1 ZINC000612037585 521449278 /nfs/dbraw/zinc/44/92/78/521449278.db2.gz HMOZFFKUWDQFSD-KBAYOESNSA-N 1 1 368.437 2.953 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000599779969 521467576 /nfs/dbraw/zinc/46/75/76/521467576.db2.gz QMXAUWBKYYPVSL-QGZVFWFLSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000599779969 521467580 /nfs/dbraw/zinc/46/75/80/521467580.db2.gz QMXAUWBKYYPVSL-QGZVFWFLSA-N 1 1 370.409 2.999 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000612094698 521478111 /nfs/dbraw/zinc/47/81/11/521478111.db2.gz RDOLKPSJLCNFGU-IRXDYDNUSA-N 1 1 358.394 2.877 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000612094700 521478249 /nfs/dbraw/zinc/47/82/49/521478249.db2.gz RDOLKPSJLCNFGU-SJORKVTESA-N 1 1 358.394 2.877 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597093941 521499142 /nfs/dbraw/zinc/49/91/42/521499142.db2.gz CYBVNAUCLLCZOB-PWSUYJOCSA-N 1 1 353.810 2.579 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)C2)C1 ZINC000597093868 521499247 /nfs/dbraw/zinc/49/92/47/521499247.db2.gz ZAGNQXADIPYIRD-MRXNPFEDSA-N 1 1 367.837 2.780 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597105136 521508946 /nfs/dbraw/zinc/50/89/46/521508946.db2.gz WTDGIMUMZWRAOK-LLVKDONJSA-N 1 1 369.853 2.930 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CC[C@@H]4CCCO4)CC3)nc2c1 ZINC000615796090 521534295 /nfs/dbraw/zinc/53/42/95/521534295.db2.gz PDAUBJJCZJYSBG-HNNXBMFYSA-N 1 1 359.430 2.552 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000615835651 521551393 /nfs/dbraw/zinc/55/13/93/521551393.db2.gz XVAUGACNKLJICN-NXNYUAIASA-N 1 1 358.486 2.710 20 5 FFBDMO Cc1ncc(CNC(=O)CC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000602822432 521553431 /nfs/dbraw/zinc/55/34/31/521553431.db2.gz FGPRTTRNRLRLRM-UHFFFAOYSA-N 1 1 362.455 2.541 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000602825123 521555108 /nfs/dbraw/zinc/55/51/08/521555108.db2.gz JPMFTPOWCIFNDX-XLNGHYISSA-N 1 1 350.463 2.751 20 5 FFBDMO CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000615942194 521583950 /nfs/dbraw/zinc/58/39/50/521583950.db2.gz FOPLJHPTFOYUKH-HNNXBMFYSA-N 1 1 352.866 2.853 20 5 FFBDMO CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000615942194 521583958 /nfs/dbraw/zinc/58/39/58/521583958.db2.gz FOPLJHPTFOYUKH-HNNXBMFYSA-N 1 1 352.866 2.853 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+]Cc2ccc(Cl)o2)cc1[N+](=O)[O-] ZINC000616088127 521619122 /nfs/dbraw/zinc/61/91/22/521619122.db2.gz KPJMEQDHVVUUAX-UHFFFAOYSA-N 1 1 354.746 2.683 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000616089307 521619720 /nfs/dbraw/zinc/61/97/20/521619720.db2.gz IWWFXIXBIFEOQM-SNVBAGLBSA-N 1 1 363.370 2.602 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785213 521872145 /nfs/dbraw/zinc/87/21/45/521872145.db2.gz KFMTWRTUTSDVOD-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785213 521872156 /nfs/dbraw/zinc/87/21/56/521872156.db2.gz KFMTWRTUTSDVOD-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO CC(C)[N@@H+]1CCCC[C@H]1Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000619864458 521909736 /nfs/dbraw/zinc/90/97/36/521909736.db2.gz SJQRAPAWSMZFIY-NSHDSACASA-N 1 1 358.236 2.782 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000619864458 521909743 /nfs/dbraw/zinc/90/97/43/521909743.db2.gz SJQRAPAWSMZFIY-NSHDSACASA-N 1 1 358.236 2.782 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccnc(NC)c2[N+](=O)[O-])C1 ZINC000517048164 562073361 /nfs/dbraw/zinc/07/33/61/562073361.db2.gz MAYIULCAXDVXHL-ZDUSSCGKSA-N 1 1 363.462 2.662 20 5 FFBDMO CC(C)Oc1nc(NC2CCN(c3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-] ZINC000521646150 562181252 /nfs/dbraw/zinc/18/12/52/562181252.db2.gz PKCYZCPGRWQYIP-UHFFFAOYSA-N 1 1 360.418 2.591 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(-c4nn[nH]n4)c3)CC2)c(F)c1 ZINC000826498001 608534454 /nfs/dbraw/zinc/53/44/54/608534454.db2.gz CPMCAIUFCDXVGA-UHFFFAOYSA-N 1 1 354.345 2.693 20 5 FFBDMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C)cc(C)c1[N+](=O)[O-])C2 ZINC001164807459 720126366 /nfs/dbraw/zinc/12/63/66/720126366.db2.gz CLLNUJRNILCXSS-YLJYHZDGSA-N 1 1 374.485 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727972 720334293 /nfs/dbraw/zinc/33/42/93/720334293.db2.gz VBYBQTGYGFJGHJ-HUUCEWRRSA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1ccnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)c1[N+](=O)[O-] ZINC001164857018 720938284 /nfs/dbraw/zinc/93/82/84/720938284.db2.gz FIIALJJMAFYYRG-AWEZNQCLSA-N 1 1 358.446 2.916 20 5 FFBDMO Cc1ccnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)c1[N+](=O)[O-] ZINC001164857019 720939419 /nfs/dbraw/zinc/93/94/19/720939419.db2.gz FIIALJJMAFYYRG-CQSZACIVSA-N 1 1 358.446 2.916 20 5 FFBDMO COc1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC001164862607 720954825 /nfs/dbraw/zinc/95/48/25/720954825.db2.gz WQYINMMQNQDMNK-ZDUSSCGKSA-N 1 1 374.445 2.616 20 5 FFBDMO CSc1nc(Cl)nc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)c1[N+](=O)[O-] ZINC001164773717 721290304 /nfs/dbraw/zinc/29/03/04/721290304.db2.gz TWYHQEDGHZUURL-UHFFFAOYSA-N 1 1 369.878 2.682 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164783488 721391065 /nfs/dbraw/zinc/39/10/65/721391065.db2.gz IMPAPVYOHWXUID-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164783492 721391172 /nfs/dbraw/zinc/39/11/72/721391172.db2.gz IMPAPVYOHWXUID-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO Nc1nc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC001164996750 722202691 /nfs/dbraw/zinc/20/26/91/722202691.db2.gz WIYKKBDUHNENMZ-LJQANCHMSA-N 1 1 371.416 2.956 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000153941848 728791924 /nfs/dbraw/zinc/79/19/24/728791924.db2.gz LFHPQTPBEBOXKM-CYBMUJFWSA-N 1 1 356.806 2.792 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H]2COc2ccc(Cl)cc2)c1 ZINC000746656306 735501803 /nfs/dbraw/zinc/50/18/03/735501803.db2.gz XHKWGWIDMDDQKH-CQSZACIVSA-N 1 1 350.806 2.988 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1F ZINC000093002859 728473023 /nfs/dbraw/zinc/47/30/23/728473023.db2.gz RATZDHMMJFDJSX-CYBMUJFWSA-N 1 1 373.450 2.537 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000119107457 728588038 /nfs/dbraw/zinc/58/80/38/728588038.db2.gz PTEGVJQRUDWOHB-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000132272317 728724088 /nfs/dbraw/zinc/72/40/88/728724088.db2.gz MIGFUFWFQFKQJW-ZDUSSCGKSA-N 1 1 373.450 2.585 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000857637120 730403559 /nfs/dbraw/zinc/40/35/59/730403559.db2.gz UZWQEASEJHBGFH-HNNXBMFYSA-N 1 1 355.322 2.621 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000857637120 730403560 /nfs/dbraw/zinc/40/35/60/730403560.db2.gz UZWQEASEJHBGFH-HNNXBMFYSA-N 1 1 355.322 2.621 20 5 FFBDMO C[C@@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1[C@H](C)CC[C@H]1C ZINC000859567886 730459205 /nfs/dbraw/zinc/45/92/05/730459205.db2.gz WCEXGPNAKKHBCK-UTUOFQBUSA-N 1 1 352.362 2.721 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000859689107 730463055 /nfs/dbraw/zinc/46/30/55/730463055.db2.gz NAPSEDPDIQJLEA-GFCCVEGCSA-N 1 1 352.362 2.724 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000863031090 730744570 /nfs/dbraw/zinc/74/45/70/730744570.db2.gz CRCZRSJRMHTKRE-OAHLLOKOSA-N 1 1 353.369 2.820 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNc2cc(F)c([N+](=O)[O-])cc2CO)C[C@@H](C)O1 ZINC000865426049 730953180 /nfs/dbraw/zinc/95/31/80/730953180.db2.gz ZNGDRJPVDBMGPP-VXGBXAGGSA-N 1 1 355.410 2.526 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1cc(F)c([N+](=O)[O-])cc1CO ZINC000865726835 730990949 /nfs/dbraw/zinc/99/09/49/730990949.db2.gz KNSCGQBSVVRUPQ-UHFFFAOYSA-N 1 1 350.394 2.902 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000866209446 731040804 /nfs/dbraw/zinc/04/08/04/731040804.db2.gz SAILVMWUBUIYIN-MNOVXSKESA-N 1 1 355.236 2.591 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)CN1CCN(C)CC1 ZINC000872030848 731722492 /nfs/dbraw/zinc/72/24/92/731722492.db2.gz CQXDEILGHXSOIL-GJZGRUSLSA-N 1 1 366.531 2.851 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)CN1CCN(C)CC1 ZINC000872030850 731722510 /nfs/dbraw/zinc/72/25/10/731722510.db2.gz CQXDEILGHXSOIL-LSDHHAIUSA-N 1 1 366.531 2.851 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000872033932 731722862 /nfs/dbraw/zinc/72/28/62/731722862.db2.gz KKZZUQLTOWVPST-NWANDNLSSA-N 1 1 351.472 2.831 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CN2CCC[C@@H]2CO1 ZINC000872033932 731722865 /nfs/dbraw/zinc/72/28/65/731722865.db2.gz KKZZUQLTOWVPST-NWANDNLSSA-N 1 1 351.472 2.831 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000874832575 732104960 /nfs/dbraw/zinc/10/49/60/732104960.db2.gz FXRPAPWJXNNTGN-QWHCGFSZSA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000874837253 732106029 /nfs/dbraw/zinc/10/60/29/732106029.db2.gz KDHRYTIVDCPRMV-QWHCGFSZSA-N 1 1 357.332 2.922 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]2CO1 ZINC000877497664 732373283 /nfs/dbraw/zinc/37/32/83/732373283.db2.gz WQEKQGIHXLNIRM-PWSUYJOCSA-N 1 1 359.304 2.544 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@](O)(c2ccc(Cl)cc2)C1 ZINC000878802348 732596321 /nfs/dbraw/zinc/59/63/21/732596321.db2.gz FKSFHYGJWBIKOA-QGZVFWFLSA-N 1 1 364.833 2.737 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879574817 732727428 /nfs/dbraw/zinc/72/74/28/732727428.db2.gz GUKFXXPCEYUUOS-WQGACYEGSA-N 1 1 366.849 2.601 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000886069227 733745269 /nfs/dbraw/zinc/74/52/69/733745269.db2.gz DGGWTARDVAOJHE-GXTWGEPZSA-N 1 1 350.419 2.725 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000886069227 733745272 /nfs/dbraw/zinc/74/52/72/733745272.db2.gz DGGWTARDVAOJHE-GXTWGEPZSA-N 1 1 350.419 2.725 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000886829647 733845947 /nfs/dbraw/zinc/84/59/47/733845947.db2.gz DTAHCHCJZBRYFN-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO CCOc1cc(NC(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000888834917 734103792 /nfs/dbraw/zinc/10/37/92/734103792.db2.gz WVKHUKQVPDHCDI-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928081581 738817595 /nfs/dbraw/zinc/81/75/95/738817595.db2.gz PJZUASSJQXAGGM-HIFRSBDPSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928081581 738817602 /nfs/dbraw/zinc/81/76/02/738817602.db2.gz PJZUASSJQXAGGM-HIFRSBDPSA-N 1 1 369.874 2.866 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091430 738820367 /nfs/dbraw/zinc/82/03/67/738820367.db2.gz FAQDQJMOYAUUFX-ZIAGYGMSSA-N 1 1 361.423 2.651 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091430 738820371 /nfs/dbraw/zinc/82/03/71/738820371.db2.gz FAQDQJMOYAUUFX-ZIAGYGMSSA-N 1 1 361.423 2.651 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000928094118 738821843 /nfs/dbraw/zinc/82/18/43/738821843.db2.gz ZTAKZFPYWZZLPF-TZMCWYRMSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928094118 738821849 /nfs/dbraw/zinc/82/18/49/738821849.db2.gz ZTAKZFPYWZZLPF-TZMCWYRMSA-N 1 1 369.874 2.866 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCS(=O)(=O)Cc1ccccc1 ZINC000892730266 734597185 /nfs/dbraw/zinc/59/71/85/734597185.db2.gz GKYBDYMHUNLDDY-UHFFFAOYSA-N 1 1 368.842 2.953 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCC[N@H+]3CCSC[C@H]23)s1 ZINC000895570235 735025690 /nfs/dbraw/zinc/02/56/90/735025690.db2.gz RPMCMYZRWRQWEZ-GHMZBOCLSA-N 1 1 351.457 2.591 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)COC(=O)N1 ZINC000896394746 735152329 /nfs/dbraw/zinc/15/23/29/735152329.db2.gz FSJLNRIASNBVPG-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](C2CCOCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000755057592 736229570 /nfs/dbraw/zinc/22/95/70/736229570.db2.gz SAONZESWXGPWIZ-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC[NH+]1CCSCC1 ZINC000757945092 736438037 /nfs/dbraw/zinc/43/80/37/736438037.db2.gz HIIURSJAWOBUSX-GFCCVEGCSA-N 1 1 356.469 2.667 20 5 FFBDMO CN1CCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccc[nH+]c21 ZINC000762328083 736815010 /nfs/dbraw/zinc/81/50/10/736815010.db2.gz MFIZMMPRYJXDHI-UHFFFAOYSA-N 1 1 361.789 2.538 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000763275355 736921925 /nfs/dbraw/zinc/92/19/25/736921925.db2.gz GLRFIKIPYDRJCM-CYBMUJFWSA-N 1 1 357.863 2.644 20 5 FFBDMO O=C(N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000764300358 737009801 /nfs/dbraw/zinc/00/98/01/737009801.db2.gz ZHWHFZHKNCGCRR-GJZGRUSLSA-N 1 1 367.833 2.621 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000765734530 737150695 /nfs/dbraw/zinc/15/06/95/737150695.db2.gz JVVRDBGIUWZCIP-NWDGAFQWSA-N 1 1 354.838 2.872 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1)CC2 ZINC000913384790 737396490 /nfs/dbraw/zinc/39/64/90/737396490.db2.gz GCPQZTIASCTPID-LLVKDONJSA-N 1 1 366.780 2.771 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000768100853 737397833 /nfs/dbraw/zinc/39/78/33/737397833.db2.gz DFSOZXIAKWMJTG-BZUAXINKSA-N 1 1 365.499 2.918 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000768100853 737397836 /nfs/dbraw/zinc/39/78/36/737397836.db2.gz DFSOZXIAKWMJTG-BZUAXINKSA-N 1 1 365.499 2.918 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000771965170 737771394 /nfs/dbraw/zinc/77/13/94/737771394.db2.gz OBXCGFRLGMTOCO-UHFFFAOYSA-N 1 1 353.762 2.765 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CC[C@@H]([C@H]4CCOC4)C3)c2c(Cl)c1 ZINC000774637570 738008131 /nfs/dbraw/zinc/00/81/31/738008131.db2.gz BZFOMPMQEGUACJ-NEPJUHHUSA-N 1 1 350.806 2.914 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000923298433 738267375 /nfs/dbraw/zinc/26/73/75/738267375.db2.gz CKLLBHJYVLUOEE-BNOWGMLFSA-N 1 1 367.833 2.711 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000930368685 739095437 /nfs/dbraw/zinc/09/54/37/739095437.db2.gz NMZLXUULBWWSMI-LBPRGKRZSA-N 1 1 351.834 2.781 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)Nc1cccc([N+](=O)[O-])c1Cl ZINC000931296888 739240071 /nfs/dbraw/zinc/24/00/71/739240071.db2.gz CNUAPDRCVYHAMQ-GFCCVEGCSA-N 1 1 368.821 2.623 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477197 739248458 /nfs/dbraw/zinc/24/84/58/739248458.db2.gz VCPCLEALYNAYQH-LZWOXQAQSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477197 739248462 /nfs/dbraw/zinc/24/84/62/739248462.db2.gz VCPCLEALYNAYQH-LZWOXQAQSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477197 739248465 /nfs/dbraw/zinc/24/84/65/739248465.db2.gz VCPCLEALYNAYQH-LZWOXQAQSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932024292 739375161 /nfs/dbraw/zinc/37/51/61/739375161.db2.gz IEMTYIBALDGTQC-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000933778381 739688890 /nfs/dbraw/zinc/68/88/90/739688890.db2.gz GVFSWKCCZMRBRN-AWEZNQCLSA-N 1 1 351.422 2.857 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000934392854 739780490 /nfs/dbraw/zinc/78/04/90/739780490.db2.gz CYLOKQWSEZAZSV-RYUDHWBXSA-N 1 1 351.834 2.922 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000799199096 740399225 /nfs/dbraw/zinc/39/92/25/740399225.db2.gz PORLZKZZPAMOSL-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000799199096 740399227 /nfs/dbraw/zinc/39/92/27/740399227.db2.gz PORLZKZZPAMOSL-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)c1 ZINC000802136266 740676421 /nfs/dbraw/zinc/67/64/21/740676421.db2.gz WFDJBZDCRODZCU-LBPRGKRZSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@H+](C(C)C)CCO2)c1 ZINC000802136266 740676423 /nfs/dbraw/zinc/67/64/23/740676423.db2.gz WFDJBZDCRODZCU-LBPRGKRZSA-N 1 1 354.428 2.583 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000804539981 740882106 /nfs/dbraw/zinc/88/21/06/740882106.db2.gz RGBXTUUJPKFCJM-BETUJISGSA-N 1 1 352.391 2.804 20 5 FFBDMO O=C1NC2(CO1)CC[NH+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC2 ZINC000815089163 741899209 /nfs/dbraw/zinc/89/92/09/741899209.db2.gz ALJCBETYWRLYJQ-UHFFFAOYSA-N 1 1 359.304 2.688 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(OC(=O)N(C)C)CC2)ccc1[N+](=O)[O-] ZINC000815188122 741909896 /nfs/dbraw/zinc/90/98/96/741909896.db2.gz GDEJQYLAFWPSSE-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827311620 743553944 /nfs/dbraw/zinc/55/39/44/743553944.db2.gz QJMKOMBBXAGOKU-GXFFZTMASA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCN(CC(F)(F)F)CC1 ZINC000832621639 745728184 /nfs/dbraw/zinc/72/81/84/745728184.db2.gz YXGCROWQGZNIHI-HNNXBMFYSA-N 1 1 361.364 2.587 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000837175504 746385478 /nfs/dbraw/zinc/38/54/78/746385478.db2.gz SXKOXHGFAGNOQG-UHFFFAOYSA-N 1 1 357.813 2.920 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000837478193 746455563 /nfs/dbraw/zinc/45/55/63/746455563.db2.gz XFOZIULXLLIZGQ-ZDUSSCGKSA-N 1 1 354.378 2.919 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)OCCn1cc[nH+]c1C ZINC000838059212 746568242 /nfs/dbraw/zinc/56/82/42/746568242.db2.gz UMABGZDVOJUCEN-UHFFFAOYSA-N 1 1 366.761 2.569 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839537862 746850265 /nfs/dbraw/zinc/85/02/65/746850265.db2.gz WVFOODHYNZGTEZ-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839537862 746850271 /nfs/dbraw/zinc/85/02/71/746850271.db2.gz WVFOODHYNZGTEZ-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC([C@H](O)c2ncc[nH]2)CC1 ZINC000839580163 746861233 /nfs/dbraw/zinc/86/12/33/746861233.db2.gz XTLMFCALZMNVFY-HNNXBMFYSA-N 1 1 350.806 2.917 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H](C2CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)C1 ZINC000841104795 747270867 /nfs/dbraw/zinc/27/08/67/747270867.db2.gz SQBLGKCSZNKNSC-PBHICJAKSA-N 1 1 353.850 2.967 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000842836756 747703158 /nfs/dbraw/zinc/70/31/58/747703158.db2.gz RFHPYRJWBCHQQN-LBPRGKRZSA-N 1 1 350.371 2.601 20 5 FFBDMO CC(C)O[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000844381917 748018151 /nfs/dbraw/zinc/01/81/51/748018151.db2.gz ONMAOOBEZVDQRH-AWEZNQCLSA-N 1 1 353.394 2.952 20 5 FFBDMO COc1ccc(CSCC(=O)OC[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000845815560 748330172 /nfs/dbraw/zinc/33/01/72/748330172.db2.gz UGGBFTRWJJCTIJ-OCCSQVGLSA-N 1 1 368.455 2.720 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCN(c2[nH]cc[nH+]2)CC1 ZINC000846874710 748563417 /nfs/dbraw/zinc/56/34/17/748563417.db2.gz ABPKPWSUQYCYFT-UHFFFAOYSA-N 1 1 356.213 2.947 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000848482171 748937929 /nfs/dbraw/zinc/93/79/29/748937929.db2.gz LDPIZVYBQNXNCJ-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000848482171 748937933 /nfs/dbraw/zinc/93/79/33/748937933.db2.gz LDPIZVYBQNXNCJ-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO C[C@H]1C[NH+](Cc2ccc(C(=O)OCC(C)(C)[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000851130493 749514753 /nfs/dbraw/zinc/51/47/53/749514753.db2.gz XRKTZBABBVAVAJ-KBPBESRZSA-N 1 1 350.415 2.508 20 5 FFBDMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000852696582 749927818 /nfs/dbraw/zinc/92/78/18/749927818.db2.gz OFNXFQIULOVBKE-PHIMTYICSA-N 1 1 357.204 2.741 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c(C(F)(F)F)c1 ZINC000853966354 750211573 /nfs/dbraw/zinc/21/15/73/750211573.db2.gz SVDBJPXAAWPQKI-ZDUSSCGKSA-N 1 1 359.348 2.649 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759904790 971932017 /nfs/dbraw/zinc/93/20/17/971932017.db2.gz FCKJLYOKHQKZAR-ZDUSSCGKSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759904790 971932024 /nfs/dbraw/zinc/93/20/24/971932024.db2.gz FCKJLYOKHQKZAR-ZDUSSCGKSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116004150 1032061291 /nfs/dbraw/zinc/06/12/91/1032061291.db2.gz HPPFOOXOVRZLSG-SFHVURJKSA-N 1 1 354.410 2.661 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116004150 1032061309 /nfs/dbraw/zinc/06/13/09/1032061309.db2.gz HPPFOOXOVRZLSG-SFHVURJKSA-N 1 1 354.410 2.661 20 5 FFBDMO O=C1N=NCN1C1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000894610505 965509128 /nfs/dbraw/zinc/50/91/28/965509128.db2.gz FLMKEPIASCTNIU-UHFFFAOYSA-N 1 1 371.319 2.748 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C2CCCC2)[C@@H](C)C1 ZINC001176154999 1013647749 /nfs/dbraw/zinc/64/77/49/1013647749.db2.gz TVZBNJJDKFURJY-GJZGRUSLSA-N 1 1 360.458 2.871 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[nH+]c1 ZINC000177521665 969252159 /nfs/dbraw/zinc/25/21/59/969252159.db2.gz ZFZVWDREGYEJOI-UHFFFAOYSA-N 1 1 357.414 2.596 20 5 FFBDMO COc1c(O)ccc(CN[C@@H](Cc2ccccc2)C[NH+](C)C)c1[N+](=O)[O-] ZINC000892649482 969698968 /nfs/dbraw/zinc/69/89/68/969698968.db2.gz PODWDVZWOJXRIO-INIZCTEOSA-N 1 1 359.426 2.572 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000825822201 1014086649 /nfs/dbraw/zinc/08/66/49/1014086649.db2.gz DRYAOFDRCMOPJK-LJQANCHMSA-N 1 1 371.437 2.785 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000825822199 1014086712 /nfs/dbraw/zinc/08/67/12/1014086712.db2.gz DRYAOFDRCMOPJK-IBGZPJMESA-N 1 1 371.437 2.785 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001481350615 974282340 /nfs/dbraw/zinc/28/23/40/974282340.db2.gz MYZZRBBPCZWSLI-HZPDHXFCSA-N 1 1 353.850 2.722 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001481350615 974282343 /nfs/dbraw/zinc/28/23/43/974282343.db2.gz MYZZRBBPCZWSLI-HZPDHXFCSA-N 1 1 353.850 2.722 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001481350615 974282351 /nfs/dbraw/zinc/28/23/51/974282351.db2.gz MYZZRBBPCZWSLI-HZPDHXFCSA-N 1 1 353.850 2.722 20 5 FFBDMO C[C@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876466367 1014278384 /nfs/dbraw/zinc/27/83/84/1014278384.db2.gz BCITYVLUSRUNCJ-XKQJLSEDSA-N 1 1 372.425 2.668 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)cc2)CC1 ZINC000054012421 976179485 /nfs/dbraw/zinc/17/94/85/976179485.db2.gz LGFYMRUJEMIUND-UHFFFAOYSA-N 1 1 369.425 2.571 20 5 FFBDMO CN(CC[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000107669143 976947535 /nfs/dbraw/zinc/94/75/35/976947535.db2.gz KYXOGUJDVWSEJJ-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CN(CC[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 ZINC000107669143 976947548 /nfs/dbraw/zinc/94/75/48/976947548.db2.gz KYXOGUJDVWSEJJ-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CCOc1ccc([C@H](O)C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)cc1 ZINC000877541895 1014619795 /nfs/dbraw/zinc/61/97/95/1014619795.db2.gz MKVUFHQYYQWWDP-SFHVURJKSA-N 1 1 374.441 2.673 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC2(CCCC2)O1 ZINC000190952003 980344396 /nfs/dbraw/zinc/34/43/96/980344396.db2.gz XKWYFVTYXCTOJY-INIZCTEOSA-N 1 1 364.442 2.758 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000905678734 980487455 /nfs/dbraw/zinc/48/74/55/980487455.db2.gz QDULSDYNOOHLIO-CYBMUJFWSA-N 1 1 373.310 2.972 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000905678734 980487457 /nfs/dbraw/zinc/48/74/57/980487457.db2.gz QDULSDYNOOHLIO-CYBMUJFWSA-N 1 1 373.310 2.972 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877742595 1014703886 /nfs/dbraw/zinc/70/38/86/1014703886.db2.gz FMBCPXUUWJFOHF-MAUKXSAKSA-N 1 1 355.442 2.521 20 5 FFBDMO CSCC[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(C)(C)O ZINC001168216924 981109772 /nfs/dbraw/zinc/10/97/72/981109772.db2.gz KLIDPDCRFRDRIS-MRXNPFEDSA-N 1 1 353.488 2.887 20 5 FFBDMO CSCC[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(C)(C)O ZINC001168216924 981109777 /nfs/dbraw/zinc/10/97/77/981109777.db2.gz KLIDPDCRFRDRIS-MRXNPFEDSA-N 1 1 353.488 2.887 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](C(C)(C)O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877797068 1014729977 /nfs/dbraw/zinc/72/99/77/1014729977.db2.gz PRKHQVYBEMCRCG-INIZCTEOSA-N 1 1 358.442 2.978 20 5 FFBDMO C[C@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000912814266 984126275 /nfs/dbraw/zinc/12/62/75/984126275.db2.gz UURMYGPZWQICSI-MLGOLLRUSA-N 1 1 359.430 2.664 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccc(C3CCC3)cc2)CC1 ZINC000996429719 984353617 /nfs/dbraw/zinc/35/36/17/984353617.db2.gz UOPMETJHGWJKFW-RTBURBONSA-N 1 1 357.454 2.700 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])CCc1ccccn1 ZINC000764313459 984417178 /nfs/dbraw/zinc/41/71/78/984417178.db2.gz ZIIITLMVJMTJMI-UHFFFAOYSA-N 1 1 372.425 2.892 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000764941123 984815610 /nfs/dbraw/zinc/81/56/10/984815610.db2.gz MUPWFZSLUGLSFT-CQSZACIVSA-N 1 1 364.402 2.733 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764988768 984903193 /nfs/dbraw/zinc/90/31/93/984903193.db2.gz DIQSVDXAYDZTCW-HNNXBMFYSA-N 1 1 371.441 2.545 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)nc1-c1ccccc1 ZINC000761210201 984905150 /nfs/dbraw/zinc/90/51/50/984905150.db2.gz ILOGBWQOGRVBOV-HOTGVXAUSA-N 1 1 354.410 2.932 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)NC(=O)OC(C)(C)C ZINC000785439481 985490424 /nfs/dbraw/zinc/49/04/24/985490424.db2.gz OOMXHFDTZUWIMT-AWEZNQCLSA-N 1 1 364.446 2.630 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccc(C3CC3)cc2)CC1 ZINC000997771404 985733242 /nfs/dbraw/zinc/73/32/42/985733242.db2.gz HFFCIAKKTGDHGU-RTBURBONSA-N 1 1 357.454 2.557 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000173545932 985874889 /nfs/dbraw/zinc/87/48/89/985874889.db2.gz QZTQURRKUFMOHV-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000173545916 985875004 /nfs/dbraw/zinc/87/50/04/985875004.db2.gz QZTQURRKUFMOHV-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C(C)(C)C ZINC000878840597 1015246331 /nfs/dbraw/zinc/24/63/31/1015246331.db2.gz ORHPJRSNVOOAHL-INIZCTEOSA-N 1 1 366.437 2.725 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C(C)(C)C ZINC000878840597 1015246339 /nfs/dbraw/zinc/24/63/39/1015246339.db2.gz ORHPJRSNVOOAHL-INIZCTEOSA-N 1 1 366.437 2.725 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1C(C)(C)C ZINC000878840597 1015246347 /nfs/dbraw/zinc/24/63/47/1015246347.db2.gz ORHPJRSNVOOAHL-INIZCTEOSA-N 1 1 366.437 2.725 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000765943198 987206279 /nfs/dbraw/zinc/20/62/79/987206279.db2.gz HBOFQJAEICZXOR-AWEZNQCLSA-N 1 1 362.386 2.558 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCN1C1CCOCC1 ZINC000451552143 987441223 /nfs/dbraw/zinc/44/12/23/987441223.db2.gz VSWOYOLTRWQJAF-QFBILLFUSA-N 1 1 373.453 2.554 20 5 FFBDMO CCCn1ccnc1CCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000762078274 988106375 /nfs/dbraw/zinc/10/63/75/988106375.db2.gz XGOXSNMYIDMYMP-UHFFFAOYSA-N 1 1 371.445 2.777 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C12CCC2 ZINC000763236635 989248869 /nfs/dbraw/zinc/24/88/69/989248869.db2.gz RMGLPYVMHMUEKB-CVEARBPZSA-N 1 1 359.430 2.885 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](Cc3ccc(C4CC4)cc3)C2)CC1 ZINC001035704617 990528410 /nfs/dbraw/zinc/52/84/10/990528410.db2.gz URDSGRNTEBJNQE-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000920474230 990861831 /nfs/dbraw/zinc/86/18/31/990861831.db2.gz YRAJXGFZEXUFKJ-MJGOQNOKSA-N 1 1 372.469 2.942 20 5 FFBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](CO)c1ccccc1 ZINC000880463029 1015841989 /nfs/dbraw/zinc/84/19/89/1015841989.db2.gz YWTNXPRTPGXGMV-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](CO)c1ccccc1 ZINC000880463029 1015841997 /nfs/dbraw/zinc/84/19/97/1015841997.db2.gz YWTNXPRTPGXGMV-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810616022 994839207 /nfs/dbraw/zinc/83/92/07/994839207.db2.gz SLXMIBVPEKDMDI-GFCCVEGCSA-N 1 1 355.354 2.531 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCCC1CCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264835 1015996737 /nfs/dbraw/zinc/99/67/37/1015996737.db2.gz SHRBPUXQEHMMQK-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CCCC1CCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264835 1015996744 /nfs/dbraw/zinc/99/67/44/1015996744.db2.gz SHRBPUXQEHMMQK-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCCC1CCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264835 1015996752 /nfs/dbraw/zinc/99/67/52/1015996752.db2.gz SHRBPUXQEHMMQK-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000731455635 997950379 /nfs/dbraw/zinc/95/03/79/997950379.db2.gz NDHASVDDIZSEGT-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000844718455 998091365 /nfs/dbraw/zinc/09/13/65/998091365.db2.gz VKZCVTIXHNOWQQ-OAHLLOKOSA-N 1 1 362.430 2.684 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000844718455 998091378 /nfs/dbraw/zinc/09/13/78/998091378.db2.gz VKZCVTIXHNOWQQ-OAHLLOKOSA-N 1 1 362.430 2.684 20 5 FFBDMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)[C@H]1CCCO1 ZINC001119856256 998361421 /nfs/dbraw/zinc/36/14/21/998361421.db2.gz PGVSTCNUTUTPOY-UONOGXRCSA-N 1 1 359.220 2.641 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000845727350 998639205 /nfs/dbraw/zinc/63/92/05/998639205.db2.gz BJMWGHRZLSVBPG-AWEZNQCLSA-N 1 1 358.398 2.810 20 5 FFBDMO CCc1cccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c1 ZINC001000152233 1016246450 /nfs/dbraw/zinc/24/64/50/1016246450.db2.gz BCVDDTFHZYDRRW-RTBURBONSA-N 1 1 371.481 2.775 20 5 FFBDMO C[C@@H](OC(=O)[C@@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741027670 999704648 /nfs/dbraw/zinc/70/46/48/999704648.db2.gz AXOJJNJOSTXYPI-ZIAGYGMSSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000741724495 999739015 /nfs/dbraw/zinc/73/90/15/999739015.db2.gz MRHRSZXEYXGMSZ-HUUCEWRRSA-N 1 1 360.458 2.798 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]2(CC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169013962 1000015614 /nfs/dbraw/zinc/01/56/14/1000015614.db2.gz WYQQLNSUPPUZPK-DAYGRLMNSA-N 1 1 353.463 2.907 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](OCC3CC3)[C@@H]2Cc2cccnc2)C1 ZINC001169019040 1000017526 /nfs/dbraw/zinc/01/75/26/1000017526.db2.gz GKQHJOXLLLWKBB-ZRNYENFQSA-N 1 1 359.470 2.939 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169026221 1000018114 /nfs/dbraw/zinc/01/81/14/1000018114.db2.gz VYDZSLOGBDCAFH-ZAWLATJESA-N 1 1 361.442 2.529 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCO[C@H]3[C@H](OCC4CCCC4)CC[C@@H]32)C1 ZINC001169025133 1000018299 /nfs/dbraw/zinc/01/82/99/1000018299.db2.gz XUGAKPVNMMPPLI-LTFXXXRZSA-N 1 1 352.475 2.870 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ccc(N)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000804345046 1000093629 /nfs/dbraw/zinc/09/36/29/1000093629.db2.gz SVWXXVDMRSUWIS-FQEVSTJZSA-N 1 1 369.469 2.968 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2ccc(N)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000804345046 1000093631 /nfs/dbraw/zinc/09/36/31/1000093631.db2.gz SVWXXVDMRSUWIS-FQEVSTJZSA-N 1 1 369.469 2.968 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ccc(N)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000804345046 1000093634 /nfs/dbraw/zinc/09/36/34/1000093634.db2.gz SVWXXVDMRSUWIS-FQEVSTJZSA-N 1 1 369.469 2.968 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767566626 1000126344 /nfs/dbraw/zinc/12/63/44/1000126344.db2.gz IMAAXFRNTUZSPN-UHFFFAOYSA-N 1 1 355.354 2.533 20 5 FFBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c(c1)CC(=O)N2C ZINC000769787609 1000601853 /nfs/dbraw/zinc/60/18/53/1000601853.db2.gz RIJVGTUNBCEKFF-LLVKDONJSA-N 1 1 365.393 2.841 20 5 FFBDMO C[N@H+](CCN1CCN(c2ccccc2)CC1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788479766 1001811642 /nfs/dbraw/zinc/81/16/42/1001811642.db2.gz BQQGWPNZCLJYQH-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccccc2)CC1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788479766 1001811651 /nfs/dbraw/zinc/81/16/51/1001811651.db2.gz 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CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000804841081 1003874916 /nfs/dbraw/zinc/87/49/16/1003874916.db2.gz PPTVPUBGLNOINA-UHFFFAOYSA-N 1 1 360.414 2.506 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805777057 1004129161 /nfs/dbraw/zinc/12/91/61/1004129161.db2.gz YQGLURAAPUWPQQ-IRXDYDNUSA-N 1 1 365.430 2.619 20 5 FFBDMO CC1(C)CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000104650251 1004728391 /nfs/dbraw/zinc/72/83/91/1004728391.db2.gz ZVCAGHNYAADCAD-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC1(C)CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000104650251 1004728395 /nfs/dbraw/zinc/72/83/95/1004728395.db2.gz ZVCAGHNYAADCAD-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001198862810 1004758251 /nfs/dbraw/zinc/75/82/51/1004758251.db2.gz LSNHTYNCAZNFSS-CQSZACIVSA-N 1 1 367.450 2.550 20 5 FFBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001198862810 1004758255 /nfs/dbraw/zinc/75/82/55/1004758255.db2.gz LSNHTYNCAZNFSS-CQSZACIVSA-N 1 1 367.450 2.550 20 5 FFBDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194731785 1004795751 /nfs/dbraw/zinc/79/57/51/1004795751.db2.gz GBLJOGATABMJPT-GWCFXTLKSA-N 1 1 366.805 2.891 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000776279554 1005345738 /nfs/dbraw/zinc/34/57/38/1005345738.db2.gz YHKLSEAYOMQICE-FQEVSTJZSA-N 1 1 364.405 2.872 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000776279554 1005345741 /nfs/dbraw/zinc/34/57/41/1005345741.db2.gz YHKLSEAYOMQICE-FQEVSTJZSA-N 1 1 364.405 2.872 20 5 FFBDMO COc1cc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c([N+](=O)[O-])cc1OC ZINC001187593674 1006148627 /nfs/dbraw/zinc/14/86/27/1006148627.db2.gz NNNVXHCWWTWFTK-BXUZGUMPSA-N 1 1 353.444 2.604 20 5 FFBDMO CC1(C)CCC(C[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)CC1 ZINC001050517398 1017035329 /nfs/dbraw/zinc/03/53/29/1017035329.db2.gz RSGZIBVCEWGJMX-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO CC(=O)c1c(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000882171850 1006311061 /nfs/dbraw/zinc/31/10/61/1006311061.db2.gz MBMQHHCYZVNCJE-QGZVFWFLSA-N 1 1 369.421 2.976 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1Cn1cc([N+](=O)[O-])c(-c3ccccn3)n1)CCOCC2 ZINC000853518566 1006425469 /nfs/dbraw/zinc/42/54/69/1006425469.db2.gz KBGWKHRSXUCRTH-CQSZACIVSA-N 1 1 357.414 2.702 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000814909252 1006463416 /nfs/dbraw/zinc/46/34/16/1006463416.db2.gz JIYFWEKAHGCOFO-SFHVURJKSA-N 1 1 365.405 2.833 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1cc([N+](=O)[O-])ccc1F ZINC000854572771 1006898777 /nfs/dbraw/zinc/89/87/77/1006898777.db2.gz GPDLQGHYHYCRCO-HNNXBMFYSA-N 1 1 359.357 2.553 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000855735356 1007532053 /nfs/dbraw/zinc/53/20/53/1007532053.db2.gz SACJVNILNLWOGC-QGZVFWFLSA-N 1 1 368.437 2.566 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)c1 ZINC000136897695 1008554279 /nfs/dbraw/zinc/55/42/79/1008554279.db2.gz IDYSAGGAMNNLCZ-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[N@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000136897695 1008554285 /nfs/dbraw/zinc/55/42/85/1008554285.db2.gz IDYSAGGAMNNLCZ-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000136897695 1008554300 /nfs/dbraw/zinc/55/43/00/1008554300.db2.gz IDYSAGGAMNNLCZ-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859590135 1008581820 /nfs/dbraw/zinc/58/18/20/1008581820.db2.gz XUGLCTGSKTTZRG-GOSISDBHSA-N 1 1 357.366 2.987 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@](O)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000859590135 1008581826 /nfs/dbraw/zinc/58/18/26/1008581826.db2.gz XUGLCTGSKTTZRG-GOSISDBHSA-N 1 1 357.366 2.987 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000822516631 1008665472 /nfs/dbraw/zinc/66/54/72/1008665472.db2.gz OMEBLDOKHKZPJE-IBGZPJMESA-N 1 1 360.410 2.952 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](CO)c1ccccc1C ZINC000886433306 1008680525 /nfs/dbraw/zinc/68/05/25/1008680525.db2.gz GCOQXNDBWKXCLH-GOSISDBHSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](CO)c1ccccc1C ZINC000886433306 1008680528 /nfs/dbraw/zinc/68/05/28/1008680528.db2.gz GCOQXNDBWKXCLH-GOSISDBHSA-N 1 1 357.410 2.816 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000823967622 1009284221 /nfs/dbraw/zinc/28/42/21/1009284221.db2.gz FZWBNGGCQGGMGU-STQMWFEESA-N 1 1 361.446 2.952 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000824008727 1009291530 /nfs/dbraw/zinc/29/15/30/1009291530.db2.gz UNCBRFBYEQIUCQ-KRWDZBQOSA-N 1 1 355.398 2.698 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000824008727 1009291540 /nfs/dbraw/zinc/29/15/40/1009291540.db2.gz UNCBRFBYEQIUCQ-KRWDZBQOSA-N 1 1 355.398 2.698 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)c1[N+](=O)[O-] ZINC001180112362 1009568726 /nfs/dbraw/zinc/56/87/26/1009568726.db2.gz IQWGUVRYGWVMNJ-DZGCQCFKSA-N 1 1 362.382 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866636 1009788915 /nfs/dbraw/zinc/78/89/15/1009788915.db2.gz MBNHMAVEZHPEGF-AWEZNQCLSA-N 1 1 357.370 2.627 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000794633979 1010448089 /nfs/dbraw/zinc/44/80/89/1010448089.db2.gz QBJQOWSTWBRBOP-CQSZACIVSA-N 1 1 361.398 2.884 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000794633979 1010448098 /nfs/dbraw/zinc/44/80/98/1010448098.db2.gz QBJQOWSTWBRBOP-CQSZACIVSA-N 1 1 361.398 2.884 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000773260685 1010966485 /nfs/dbraw/zinc/96/64/85/1010966485.db2.gz ZTMUSLCBBPXPJD-UONOGXRCSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000773260685 1010966490 /nfs/dbraw/zinc/96/64/90/1010966490.db2.gz ZTMUSLCBBPXPJD-UONOGXRCSA-N 1 1 361.398 2.599 20 5 FFBDMO COc1ccccc1[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867944163 1011126804 /nfs/dbraw/zinc/12/68/04/1011126804.db2.gz QJFDSJCKYKPKDA-XOBRGWDASA-N 1 1 369.421 2.793 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000867031702 1011926035 /nfs/dbraw/zinc/92/60/35/1011926035.db2.gz VRPFWCVPEUYINF-LPHOPBHVSA-N 1 1 357.385 2.838 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000870129096 1012176434 /nfs/dbraw/zinc/17/64/34/1012176434.db2.gz ZHGWKDBZQWNEDS-HNNXBMFYSA-N 1 1 354.410 2.817 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@]4(CCOC4)C3)CC2)c(F)c1 ZINC001173009902 1012179800 /nfs/dbraw/zinc/17/98/00/1012179800.db2.gz JHIPLPXFIUDFBF-GOSISDBHSA-N 1 1 367.396 2.954 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@H](CO)C2)c1F ZINC001173179409 1012321504 /nfs/dbraw/zinc/32/15/04/1012321504.db2.gz FMULNUFNLJJYQY-MNOVXSKESA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC(F)(F)[C@H](CO)C2)c1F ZINC001173179409 1012321516 /nfs/dbraw/zinc/32/15/16/1012321516.db2.gz FMULNUFNLJJYQY-MNOVXSKESA-N 1 1 362.348 2.623 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173191998 1012336192 /nfs/dbraw/zinc/33/61/92/1012336192.db2.gz HELPPXYIOMMGFX-CHWSQXEVSA-N 1 1 368.405 2.949 20 5 FFBDMO CCOC1CC2(C[C@H]2C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000870376616 1012341149 /nfs/dbraw/zinc/34/11/49/1012341149.db2.gz CBCJWZGQEKYAEU-FFEBTUMSSA-N 1 1 374.437 2.918 20 5 FFBDMO CCOC1CC2(C[C@H]2C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000870376616 1012341164 /nfs/dbraw/zinc/34/11/64/1012341164.db2.gz CBCJWZGQEKYAEU-FFEBTUMSSA-N 1 1 374.437 2.918 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196556 1012341488 /nfs/dbraw/zinc/34/14/88/1012341488.db2.gz NOQGTXRDUVVQTC-RYUDHWBXSA-N 1 1 354.378 2.701 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173227426 1012359873 /nfs/dbraw/zinc/35/98/73/1012359873.db2.gz OGWJQOHYLNGZKW-RDJZCZTQSA-N 1 1 358.442 2.891 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227722 1012360329 /nfs/dbraw/zinc/36/03/29/1012360329.db2.gz VIRLWRKLZXORJF-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227722 1012360349 /nfs/dbraw/zinc/36/03/49/1012360349.db2.gz VIRLWRKLZXORJF-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccccn2)CC1 ZINC001173228349 1012364484 /nfs/dbraw/zinc/36/44/84/1012364484.db2.gz VBZUNBVJCRLYIR-KRWDZBQOSA-N 1 1 354.454 2.781 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(NC(=O)C(F)(F)F)CC1 ZINC001173231402 1012364774 /nfs/dbraw/zinc/36/47/74/1012364774.db2.gz CFBYJMDPBKKYLT-NSHDSACASA-N 1 1 359.348 2.669 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@H](c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880037 1012617766 /nfs/dbraw/zinc/61/77/66/1012617766.db2.gz UAXPCIURHHILEK-PKOBYXMFSA-N 1 1 373.384 2.508 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173697731 1012902836 /nfs/dbraw/zinc/90/28/36/1012902836.db2.gz WHOSVEOZSWQMDW-CQSZACIVSA-N 1 1 367.471 2.622 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CNCC2(CCOCC2)C1)C1CC1 ZINC000925798140 1017851560 /nfs/dbraw/zinc/85/15/60/1017851560.db2.gz QRILWMIIILJEPR-MSOLQXFVSA-N 1 1 359.470 2.664 20 5 FFBDMO CC(C)N1CC[NH+](CCC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC1 ZINC000901133094 1018762000 /nfs/dbraw/zinc/76/20/00/1018762000.db2.gz BVLUMUHYAUIRBU-UHFFFAOYSA-N 1 1 374.485 2.502 20 5 FFBDMO COCC[N@@H+](C)Cc1cc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)no1 ZINC000901398378 1019043232 /nfs/dbraw/zinc/04/32/32/1019043232.db2.gz RAAQMWQTZQQSCP-UHFFFAOYSA-N 1 1 360.414 2.928 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777733332 1019202165 /nfs/dbraw/zinc/20/21/65/1019202165.db2.gz FVBJTMCWBXEECT-DJJJIMSYSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777733332 1019202172 /nfs/dbraw/zinc/20/21/72/1019202172.db2.gz FVBJTMCWBXEECT-DJJJIMSYSA-N 1 1 373.384 2.654 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC001045437633 1019966955 /nfs/dbraw/zinc/96/69/55/1019966955.db2.gz WGTQPBBQDYAUTA-QZTJIDSGSA-N 1 1 357.454 2.700 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)CC[C@H](O)c1ccccc1 ZINC000930353086 1019992329 /nfs/dbraw/zinc/99/23/29/1019992329.db2.gz GUUZMJKYGOZIGJ-PMACEKPBSA-N 1 1 358.438 2.944 20 5 FFBDMO Cc1csc(C[C@@H]2CC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])cnc43)C2)n1 ZINC000902540262 1020268939 /nfs/dbraw/zinc/26/89/39/1020268939.db2.gz LJWHLCQCDIZJIH-ZDUSSCGKSA-N 1 1 372.454 2.935 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C(=O)OC(C)(C)C ZINC000828917139 1032904503 /nfs/dbraw/zinc/90/45/03/1032904503.db2.gz DOOLIINGPWUFHC-XYPHTWIQSA-N 1 1 364.442 2.928 20 5 FFBDMO O=C([C@H]1CC[C@H]2CCCC[N@H+]21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000900880324 1020696822 /nfs/dbraw/zinc/69/68/22/1020696822.db2.gz HMIUTHGGCCPKSK-DNVCBOLYSA-N 1 1 373.453 2.982 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)c([N+](=O)[O-])c1 ZINC000932135481 1020716674 /nfs/dbraw/zinc/71/66/74/1020716674.db2.gz LAQAUVDIQQNVLN-CQSZACIVSA-N 1 1 360.414 2.595 20 5 FFBDMO COc1ccccc1N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000934178432 1021159486 /nfs/dbraw/zinc/15/94/86/1021159486.db2.gz ZQJHCBNLSBMEHH-IBGZPJMESA-N 1 1 371.437 2.849 20 5 FFBDMO COc1ccc(C[N@H+]2Cc3ncccc3N3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000934492049 1021259253 /nfs/dbraw/zinc/25/92/53/1021259253.db2.gz POTDZIKZQYILPQ-HNNXBMFYSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1ccc(C[N@@H+]2Cc3ncccc3N3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000934492049 1021259262 /nfs/dbraw/zinc/25/92/62/1021259262.db2.gz POTDZIKZQYILPQ-HNNXBMFYSA-N 1 1 354.410 2.983 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583764 1022135673 /nfs/dbraw/zinc/13/56/73/1022135673.db2.gz PILOHPWVRJAGJD-FZMZJTMJSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583764 1022135675 /nfs/dbraw/zinc/13/56/75/1022135675.db2.gz PILOHPWVRJAGJD-FZMZJTMJSA-N 1 1 367.450 2.601 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000750601895 1022223411 /nfs/dbraw/zinc/22/34/11/1022223411.db2.gz GXMYFGNMYGOGKZ-UHFFFAOYSA-N 1 1 368.393 2.967 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000750601895 1022223422 /nfs/dbraw/zinc/22/34/22/1022223422.db2.gz GXMYFGNMYGOGKZ-UHFFFAOYSA-N 1 1 368.393 2.967 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803947 1023208478 /nfs/dbraw/zinc/20/84/78/1023208478.db2.gz PFBZYUVUBIGGKA-BXUZGUMPSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803947 1023208484 /nfs/dbraw/zinc/20/84/84/1023208484.db2.gz PFBZYUVUBIGGKA-BXUZGUMPSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001122803270 1023483920 /nfs/dbraw/zinc/48/39/20/1023483920.db2.gz WWWUHVQWZOUNSC-RHSMWYFYSA-N 1 1 372.425 2.554 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)O[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000755835390 1023642401 /nfs/dbraw/zinc/64/24/01/1023642401.db2.gz YQWGSEWGNRSYRX-GDBMZVCRSA-N 1 1 372.425 2.879 20 5 FFBDMO C[C@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CCCC[N@H+]1Cc1ccccc1 ZINC000755914572 1023650597 /nfs/dbraw/zinc/65/05/97/1023650597.db2.gz FJOLOWABOBJESR-LJQANCHMSA-N 1 1 372.425 2.779 20 5 FFBDMO Cc1nn(C[N@H+](C)CCOCc2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000756874135 1023762396 /nfs/dbraw/zinc/76/23/96/1023762396.db2.gz OCIZLJSLMSOMKF-UHFFFAOYSA-N 1 1 355.398 2.754 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCOCc2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000756874135 1023762400 /nfs/dbraw/zinc/76/24/00/1023762400.db2.gz OCIZLJSLMSOMKF-UHFFFAOYSA-N 1 1 355.398 2.754 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001121700262 1023934495 /nfs/dbraw/zinc/93/44/95/1023934495.db2.gz UNTHOXWKJXLOKU-OWCLPIDISA-N 1 1 364.494 2.727 20 5 FFBDMO Cc1c(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000838142763 1026225386 /nfs/dbraw/zinc/22/53/86/1026225386.db2.gz PRVNGNUYKXVRAA-ZDUSSCGKSA-N 1 1 364.402 2.582 20 5 FFBDMO O=C1C[C@@]2(CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644085 1026771634 /nfs/dbraw/zinc/77/16/34/1026771634.db2.gz NTSPQZITMYPWFF-UYAOXDASSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@@]2(CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644085 1026771644 /nfs/dbraw/zinc/77/16/44/1026771644.db2.gz NTSPQZITMYPWFF-UYAOXDASSA-N 1 1 368.389 2.738 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@@H]3O)n2)cc1 ZINC000840117671 1026965864 /nfs/dbraw/zinc/96/58/64/1026965864.db2.gz WCVCOESDWYUQCK-KSZLIROESA-N 1 1 371.441 2.826 20 5 FFBDMO CO[C@H]1C[C@H]([N@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138877 1026978217 /nfs/dbraw/zinc/97/82/17/1026978217.db2.gz GNYRPFKENNJWFM-IRXDYDNUSA-N 1 1 374.441 2.684 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138877 1026978223 /nfs/dbraw/zinc/97/82/23/1026978223.db2.gz GNYRPFKENNJWFM-IRXDYDNUSA-N 1 1 374.441 2.684 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC/C=C\c2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160107657 1027595587 /nfs/dbraw/zinc/59/55/87/1027595587.db2.gz QRNKEZXZFMOKMM-IYKQLEIESA-N 1 1 369.465 2.894 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CC/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107657 1027595597 /nfs/dbraw/zinc/59/55/97/1027595597.db2.gz QRNKEZXZFMOKMM-IYKQLEIESA-N 1 1 369.465 2.894 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107657 1027595606 /nfs/dbraw/zinc/59/56/06/1027595606.db2.gz QRNKEZXZFMOKMM-IYKQLEIESA-N 1 1 369.465 2.894 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2ccc(-n3cccn3)nc2)ncc1[N+](=O)[O-] ZINC001160238432 1027646290 /nfs/dbraw/zinc/64/62/90/1027646290.db2.gz HBRBXBINNDMKPB-RMKNXTFCSA-N 1 1 365.397 2.715 20 5 FFBDMO COc1cc(C(=O)N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC001155609812 1028815248 /nfs/dbraw/zinc/81/52/48/1028815248.db2.gz IQKQTGIXKJGSEZ-UHFFFAOYSA-N 1 1 358.398 2.963 20 5 FFBDMO COC(=O)[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1ccc(O)cc1 ZINC001155732710 1028878371 /nfs/dbraw/zinc/87/83/71/1028878371.db2.gz ZCBVLEWWPUWOMR-KBOKABMXSA-N 1 1 372.381 2.554 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C ZINC001163929116 1029118447 /nfs/dbraw/zinc/11/84/47/1029118447.db2.gz GTUAINFAVYLUHU-CQSZACIVSA-N 1 1 371.384 2.999 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC001156315425 1029141031 /nfs/dbraw/zinc/14/10/31/1029141031.db2.gz NXTNGQSYPIWZKE-RYQLBKOJSA-N 1 1 354.410 2.551 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001165155043 1029425095 /nfs/dbraw/zinc/42/50/95/1029425095.db2.gz RRWRBNOGPLAYDQ-UHFFFAOYSA-N 1 1 353.426 2.599 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[C@H]([N@@H+](C)C(C)C)C1 ZINC001157001945 1029439008 /nfs/dbraw/zinc/43/90/08/1029439008.db2.gz QTRQBVBOSHGCRM-NSHDSACASA-N 1 1 370.837 2.739 20 5 FFBDMO Cc1cc(N2C[C@H]3[C@H](C2)CCC[N@@H+]3C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001157270519 1029530148 /nfs/dbraw/zinc/53/01/48/1029530148.db2.gz FQNLTHLAWWVORS-RDJZCZTQSA-N 1 1 353.426 2.891 20 5 FFBDMO Cc1nc(Cl)nc(-n2ccc(C[NH2+]Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC001157607517 1029629675 /nfs/dbraw/zinc/62/96/75/1029629675.db2.gz NWEHVPZXHHAZSF-UHFFFAOYSA-N 1 1 358.789 2.822 20 5 FFBDMO C[NH+]1CCC(CN2CCN(c3nc4ccccc4cc3[N+](=O)[O-])CC2)CC1 ZINC001157842834 1029674377 /nfs/dbraw/zinc/67/43/77/1029674377.db2.gz ZQOUCXQUJPNCRX-UHFFFAOYSA-N 1 1 369.469 2.607 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782526167 1029732491 /nfs/dbraw/zinc/73/24/91/1029732491.db2.gz HQSNWAAABQPTGK-KGLIPLIRSA-N 1 1 365.405 2.811 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@@H]2[NH2+]C[C@H]21 ZINC001158421753 1029825441 /nfs/dbraw/zinc/82/54/41/1029825441.db2.gz FSUOAGVAJXLZKI-FDFHNCONSA-N 1 1 359.473 2.826 20 5 FFBDMO O=[N+]([O-])c1c2[nH]cnc2ccc1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC001165398834 1029966234 /nfs/dbraw/zinc/96/62/34/1029966234.db2.gz SGMLKAUBSFMLMK-UHFFFAOYSA-N 1 1 367.409 2.915 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])c(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)n1 ZINC001166032968 1030213248 /nfs/dbraw/zinc/21/32/48/1030213248.db2.gz NIWMFYVTWUTTHT-UHFFFAOYSA-N 1 1 353.810 2.586 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ccc3c(cccc3[N+](=O)[O-])n1)CC2 ZINC001166032950 1030214757 /nfs/dbraw/zinc/21/47/57/1030214757.db2.gz MLKLIBFRUYRJHN-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCN(c3ncccc3F)CC2)cc1 ZINC000784401468 1030604503 /nfs/dbraw/zinc/60/45/03/1030604503.db2.gz ZRQZPXZDFSCFDB-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C(=O)Nc2ccccn2)C1 ZINC000797518479 1031143444 /nfs/dbraw/zinc/14/34/44/1031143444.db2.gz GICQPQZNHRYRCV-OAHLLOKOSA-N 1 1 370.409 2.849 20 5 FFBDMO O=C(CCN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000843363260 1031355634 /nfs/dbraw/zinc/35/56/34/1031355634.db2.gz UVFASRNUZDALMQ-CJNGLKHVSA-N 1 1 364.421 2.527 20 5 FFBDMO C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000798527096 1031444295 /nfs/dbraw/zinc/44/42/95/1031444295.db2.gz NIIJXOSUPOVRSP-IBGZPJMESA-N 1 1 354.410 2.632 20 5 FFBDMO O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001149930622 1031621544 /nfs/dbraw/zinc/62/15/44/1031621544.db2.gz DOTBPUAIZDHWKY-INIZCTEOSA-N 1 1 366.377 2.568 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](c4ccccn4)C3)n2)c1 ZINC000799159310 1031673448 /nfs/dbraw/zinc/67/34/48/1031673448.db2.gz YESKYXISGXTQAY-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO O=C(NCC1([NH2+]Cc2c(F)cccc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530614 1031786340 /nfs/dbraw/zinc/78/63/40/1031786340.db2.gz HMTOALSHRMABQT-MLGOLLRUSA-N 1 1 367.396 2.539 20 5 FFBDMO COC(=O)c1cccc2nc([C@](F)(Cl)O[C@@H](C)C[N+](C)(C)C)[nH]c21 ZINC001223402745 1033429064 /nfs/dbraw/zinc/42/90/64/1033429064.db2.gz HDPKBOWWQBHCAB-MGPLVRAMSA-O 1 1 358.821 2.779 20 5 FFBDMO O=C1OCCN1C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000830130289 1033477630 /nfs/dbraw/zinc/47/76/30/1033477630.db2.gz PIOXICFJYWTKAY-NSHDSACASA-N 1 1 373.331 2.888 20 5 FFBDMO O=C1OCCN1C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000830130289 1033477638 /nfs/dbraw/zinc/47/76/38/1033477638.db2.gz PIOXICFJYWTKAY-NSHDSACASA-N 1 1 373.331 2.888 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000830456882 1033621842 /nfs/dbraw/zinc/62/18/42/1033621842.db2.gz MWQPOFULZMFYPN-ZFWWWQNUSA-N 1 1 367.446 2.782 20 5 FFBDMO C[C@@H]1C[C@@H](CNC(=O)[C@@H](N)Cc2c3ccccc3cc3ccccc32)C[NH2+]1 ZINC001219683879 1033746446 /nfs/dbraw/zinc/74/64/46/1033746446.db2.gz GSKHMJSWQZDXPU-MCFFVMPBSA-N 1 1 361.489 2.977 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC001225061469 1034109456 /nfs/dbraw/zinc/10/94/56/1034109456.db2.gz HPIYKZHQQBWLPM-UHFFFAOYSA-N 1 1 354.838 2.526 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000831698868 1034221225 /nfs/dbraw/zinc/22/12/25/1034221225.db2.gz BTGIAKXNIANHSB-ZWKOTPCHSA-N 1 1 361.442 2.542 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])cc1O[C@@H]1CC[N@H+]([C@@H](C)c2ccccn2)C1 ZINC001225450446 1034258088 /nfs/dbraw/zinc/25/80/88/1034258088.db2.gz ICLIMGWLYDCTEU-DZGCQCFKSA-N 1 1 371.393 2.991 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]4CC5(CC[C@@H]43)OCCO5)nc2c1 ZINC000832054849 1034523496 /nfs/dbraw/zinc/52/34/96/1034523496.db2.gz WGMSZXVPOLFDEB-DYVFJYSZSA-N 1 1 372.425 2.979 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]4CC5(CC[C@@H]43)OCCO5)nc2c1 ZINC000832054849 1034523501 /nfs/dbraw/zinc/52/35/01/1034523501.db2.gz WGMSZXVPOLFDEB-DYVFJYSZSA-N 1 1 372.425 2.979 20 5 FFBDMO COc1cc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)ncc1[N+](=O)[O-] ZINC001226582043 1034747428 /nfs/dbraw/zinc/74/74/28/1034747428.db2.gz VBYJWQJWLFLZCK-MRXNPFEDSA-N 1 1 373.409 2.668 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](F)C1)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001139785526 1035232756 /nfs/dbraw/zinc/23/27/56/1035232756.db2.gz VOJOWWLFHKJLAS-LBPRGKRZSA-N 1 1 363.311 2.664 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC001536197709 1069933901 /nfs/dbraw/zinc/93/39/01/1069933901.db2.gz WANAGTZQLUZKKQ-CYBMUJFWSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC001536197709 1069933907 /nfs/dbraw/zinc/93/39/07/1069933907.db2.gz WANAGTZQLUZKKQ-CYBMUJFWSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c4cccnc34)C[C@H]1[N@H+]2C ZINC001228139638 1035956484 /nfs/dbraw/zinc/95/64/84/1035956484.db2.gz VMNULGNOWHDGGO-UALQAHIBSA-N 1 1 371.393 2.689 20 5 FFBDMO O=[N+]([O-])c1c[nH]cc2nc(O[C@H]3CCC[N@@H+](Cc4ccccc4)C3)nc1-2 ZINC001230230185 1037163523 /nfs/dbraw/zinc/16/35/23/1037163523.db2.gz MCJMFANLDJRMSU-AWEZNQCLSA-N 1 1 353.382 2.910 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cnc4c(cccc4[N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001231156961 1037485903 /nfs/dbraw/zinc/48/59/03/1037485903.db2.gz VWYCCRZYETVHIY-LBTBCDHLSA-N 1 1 371.393 2.689 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@]4(CCOC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093890 1038379718 /nfs/dbraw/zinc/37/97/18/1038379718.db2.gz RRJXMHYZCRQLGQ-LJQANCHMSA-N 1 1 361.442 2.685 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3[C@@H]4CC[C@H]3CC(=O)C4)CC2)ccc1[N+](=O)[O-] ZINC001256095250 1038381264 /nfs/dbraw/zinc/38/12/64/1038381264.db2.gz CGTGTMTXGKRCOX-IYBDPMFKSA-N 1 1 359.426 2.768 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@@H]3C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256100605 1038383434 /nfs/dbraw/zinc/38/34/34/1038383434.db2.gz LPQXBMMXJQQQQH-GOSISDBHSA-N 1 1 363.458 2.929 20 5 FFBDMO COc1ccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)cc1OC ZINC001248210190 1040174416 /nfs/dbraw/zinc/17/44/16/1040174416.db2.gz LWSAOKGELVNIOL-AWEZNQCLSA-N 1 1 370.365 2.905 20 5 FFBDMO [NH3+][C@@H](Cc1cc(F)cc(F)c1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001248397693 1040257290 /nfs/dbraw/zinc/25/72/90/1040257290.db2.gz FJVPOSNUELXOCD-NSHDSACASA-N 1 1 365.271 2.700 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCC[C@](O)(CF)C3)CC2)cc1 ZINC001254474090 1040740924 /nfs/dbraw/zinc/74/09/24/1040740924.db2.gz LOBOCGUKIFLBOZ-SFHVURJKSA-N 1 1 351.422 2.750 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC[N@@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001254550988 1040792059 /nfs/dbraw/zinc/79/20/59/1040792059.db2.gz UXMUGNRTCIOWSM-YLJYHZDGSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001254550988 1040792084 /nfs/dbraw/zinc/79/20/84/1040792084.db2.gz UXMUGNRTCIOWSM-YLJYHZDGSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001254550988 1040792097 /nfs/dbraw/zinc/79/20/97/1040792097.db2.gz UXMUGNRTCIOWSM-YLJYHZDGSA-N 1 1 369.465 2.705 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559762 1040796330 /nfs/dbraw/zinc/79/63/30/1040796330.db2.gz ZULJBBJRRIWHEG-HOTGVXAUSA-N 1 1 358.442 2.891 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559762 1040796340 /nfs/dbraw/zinc/79/63/40/1040796340.db2.gz ZULJBBJRRIWHEG-HOTGVXAUSA-N 1 1 358.442 2.891 20 5 FFBDMO Cc1cc(N2CC[NH+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)nc(C)n1 ZINC001254562133 1040798706 /nfs/dbraw/zinc/79/87/06/1040798706.db2.gz JUNFOFRCOHXTJF-HNNXBMFYSA-N 1 1 355.442 2.755 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1C[C@H]3CN(Cc4nccs4)C[C@H]3C1)C2 ZINC001254594306 1040822797 /nfs/dbraw/zinc/82/27/97/1040822797.db2.gz DGCVBYUSYZJILB-JZXOWHBKSA-N 1 1 370.478 2.582 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001265557692 1042865948 /nfs/dbraw/zinc/86/59/48/1042865948.db2.gz XVXVSJPCYYFBNB-RDTXWAMCSA-N 1 1 368.437 2.939 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Nc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])c1 ZINC001310422199 1043685184 /nfs/dbraw/zinc/68/51/84/1043685184.db2.gz QAXSGFRIHXDXOQ-UHFFFAOYSA-N 1 1 357.414 2.961 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001318659358 1044793936 /nfs/dbraw/zinc/79/39/36/1044793936.db2.gz JMSHPRSDFSQCHG-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001318659358 1044793953 /nfs/dbraw/zinc/79/39/53/1044793953.db2.gz JMSHPRSDFSQCHG-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256847 1045376539 /nfs/dbraw/zinc/37/65/39/1045376539.db2.gz DBPUTWAEOATGSO-YJBOKZPZSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256847 1045376545 /nfs/dbraw/zinc/37/65/45/1045376545.db2.gz DBPUTWAEOATGSO-YJBOKZPZSA-N 1 1 372.400 2.951 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC001322035850 1045926560 /nfs/dbraw/zinc/92/65/60/1045926560.db2.gz XUPIXPQZDRZYPK-INIZCTEOSA-N 1 1 364.398 2.769 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC001322035850 1045926574 /nfs/dbraw/zinc/92/65/74/1045926574.db2.gz XUPIXPQZDRZYPK-INIZCTEOSA-N 1 1 364.398 2.769 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219764 1046422589 /nfs/dbraw/zinc/42/25/89/1046422589.db2.gz BNMPVRMWWBQKLC-UONOGXRCSA-N 1 1 358.485 2.584 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219764 1046422595 /nfs/dbraw/zinc/42/25/95/1046422595.db2.gz BNMPVRMWWBQKLC-UONOGXRCSA-N 1 1 358.485 2.584 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)n1 ZINC001294189191 1049704978 /nfs/dbraw/zinc/70/49/78/1049704978.db2.gz KBJVBPRIJYXWCB-INIZCTEOSA-N 1 1 354.410 2.645 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2F)[C@H](c2ccccc2)C1 ZINC001299849210 1050622756 /nfs/dbraw/zinc/62/27/56/1050622756.db2.gz CEXQYTMYBNMTFS-PBHICJAKSA-N 1 1 357.385 2.809 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001542262187 1071199442 /nfs/dbraw/zinc/19/94/42/1071199442.db2.gz DBZXEBCSJJZMBW-HZSPNIEDSA-N 1 1 351.422 2.759 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001340876871 1051209192 /nfs/dbraw/zinc/20/91/92/1051209192.db2.gz AXMBHAZAMUBKAE-DOTOQJQBSA-N 1 1 372.473 2.737 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC001342656721 1051265152 /nfs/dbraw/zinc/26/51/52/1051265152.db2.gz BIJVJZGWJIXKTK-HNNXBMFYSA-N 1 1 372.473 2.737 20 5 FFBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC001542350616 1071216296 /nfs/dbraw/zinc/21/62/96/1071216296.db2.gz MMPAAKDWXJCRHK-ZDUSSCGKSA-N 1 1 367.833 2.575 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001303802580 1051452197 /nfs/dbraw/zinc/45/21/97/1051452197.db2.gz ZLAZBNOHIFUZHB-PWSUYJOCSA-N 1 1 374.363 2.624 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC001306869929 1052207682 /nfs/dbraw/zinc/20/76/82/1052207682.db2.gz MVVQGANNFXEHEX-PHIMTYICSA-N 1 1 370.247 2.912 20 5 FFBDMO CCC(=O)c1ccc(N[C@H]2CCc3c([nH+]c(C)n3CCO)C2)c([N+](=O)[O-])c1 ZINC001307157062 1052259896 /nfs/dbraw/zinc/25/98/96/1052259896.db2.gz QLWFHIWUIXNFCL-AWEZNQCLSA-N 1 1 372.425 2.654 20 5 FFBDMO C[N@@H+](CCCC1CCCC1)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001307871352 1052359048 /nfs/dbraw/zinc/35/90/48/1052359048.db2.gz AXVLFAYOEZVQNK-UHFFFAOYSA-N 1 1 369.487 2.775 20 5 FFBDMO COC(=O)[C@@H]1[C@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1(F)F ZINC001308774213 1052497544 /nfs/dbraw/zinc/49/75/44/1052497544.db2.gz QTDPQVVMCINCAI-SNPRPXQTSA-N 1 1 354.353 2.829 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC001336745965 1054188276 /nfs/dbraw/zinc/18/82/76/1054188276.db2.gz ULGJQDKBRGPKSW-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@H+](C)CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470098 1054719388 /nfs/dbraw/zinc/71/93/88/1054719388.db2.gz JIDMMAXCIMVRBC-YSVLISHTSA-N 1 1 365.455 2.705 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@@H+](C)CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470098 1054719405 /nfs/dbraw/zinc/71/94/05/1054719405.db2.gz JIDMMAXCIMVRBC-YSVLISHTSA-N 1 1 365.455 2.705 20 5 FFBDMO C/C(=C\C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178623 1055187190 /nfs/dbraw/zinc/18/71/90/1055187190.db2.gz RCUCLXAVXKHRCA-MCZUYUKXSA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C\C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178623 1055187194 /nfs/dbraw/zinc/18/71/94/1055187194.db2.gz RCUCLXAVXKHRCA-MCZUYUKXSA-N 1 1 361.442 2.612 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001350573103 1055840648 /nfs/dbraw/zinc/84/06/48/1055840648.db2.gz HRZITOGRTSERLI-CQSZACIVSA-N 1 1 354.410 2.641 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](CCO)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001473291410 1055955011 /nfs/dbraw/zinc/95/50/11/1055955011.db2.gz LCVHYZFPOOTFNP-OAHLLOKOSA-N 1 1 357.410 2.979 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001473292190 1055964615 /nfs/dbraw/zinc/96/46/15/1055964615.db2.gz UYGWIMGBGBSPQW-OAHLLOKOSA-N 1 1 357.410 2.613 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001473292190 1055964624 /nfs/dbraw/zinc/96/46/24/1055964624.db2.gz UYGWIMGBGBSPQW-OAHLLOKOSA-N 1 1 357.410 2.613 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC001545105635 1071733351 /nfs/dbraw/zinc/73/33/51/1071733351.db2.gz MSGPALLXPWJZKR-DZGCQCFKSA-N 1 1 354.410 2.869 20 5 FFBDMO Cc1cc(F)ccc1C[NH+]1CCC(C)(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001500424878 1058487100 /nfs/dbraw/zinc/48/71/00/1058487100.db2.gz VMZBNDAHYQNHPD-IAGOWNOFSA-N 1 1 363.433 2.518 20 5 FFBDMO CC1([NH2+]CCCCc2ccccc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001502779357 1058897508 /nfs/dbraw/zinc/89/75/08/1058897508.db2.gz WCAFAMUMZKOVBX-QZTJIDSGSA-N 1 1 359.470 2.645 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001515868554 1059852720 /nfs/dbraw/zinc/85/27/20/1059852720.db2.gz MZSXFERPPYVVHY-MRXNPFEDSA-N 1 1 374.445 2.725 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2c(Br)cncc2[N+](=O)[O-])CC1 ZINC001516514689 1060122521 /nfs/dbraw/zinc/12/25/21/1060122521.db2.gz ULOVIWUBXKUEQM-UHFFFAOYSA-N 1 1 366.219 2.870 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000848488182 1060136211 /nfs/dbraw/zinc/13/62/11/1060136211.db2.gz CCYFLEWDXXQJRW-PKOBYXMFSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000848488182 1060136225 /nfs/dbraw/zinc/13/62/25/1060136225.db2.gz CCYFLEWDXXQJRW-PKOBYXMFSA-N 1 1 373.453 2.617 20 5 FFBDMO Cn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001355538938 1060340252 /nfs/dbraw/zinc/34/02/52/1060340252.db2.gz URVVMTQQMNMTCO-OAHLLOKOSA-N 1 1 370.457 2.702 20 5 FFBDMO Cc1cc([C@H]2CCCC[N@@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837706 1061123446 /nfs/dbraw/zinc/12/34/46/1061123446.db2.gz YIRKRWGEUSLJEE-GDBMZVCRSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1cc([C@H]2CCCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])[nH]n1 ZINC001460837706 1061123451 /nfs/dbraw/zinc/12/34/51/1061123451.db2.gz YIRKRWGEUSLJEE-GDBMZVCRSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001460953784 1061163175 /nfs/dbraw/zinc/16/31/75/1061163175.db2.gz BFZUUDPONOMHIH-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001460953784 1061163183 /nfs/dbraw/zinc/16/31/83/1061163183.db2.gz BFZUUDPONOMHIH-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC001462928588 1061849127 /nfs/dbraw/zinc/84/91/27/1061849127.db2.gz WBKACIRLCNPVSY-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO C[N@H+]1CC[C@H]1CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC001462928588 1061849137 /nfs/dbraw/zinc/84/91/37/1061849137.db2.gz WBKACIRLCNPVSY-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO O=C(Oc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001528364759 1061880851 /nfs/dbraw/zinc/88/08/51/1061880851.db2.gz ODYLSMDVPIEMTC-AWEZNQCLSA-N 1 1 371.349 2.931 20 5 FFBDMO C[C@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000774596802 1062075928 /nfs/dbraw/zinc/07/59/28/1062075928.db2.gz LNUYQQDDYIUSCK-BLLLJJGKSA-N 1 1 370.365 2.959 20 5 FFBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000775575961 1062134329 /nfs/dbraw/zinc/13/43/29/1062134329.db2.gz GETOXRXSRLYMNN-QWRGUYRKSA-N 1 1 369.381 2.855 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000775578157 1062135151 /nfs/dbraw/zinc/13/51/51/1062135151.db2.gz SOKCQYPQDYHZMY-NSHDSACASA-N 1 1 374.353 2.801 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC001523692371 1062580957 /nfs/dbraw/zinc/58/09/57/1062580957.db2.gz DNMXLFMOEAEYSC-SFHVURJKSA-N 1 1 354.410 2.899 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[N@@H+](Cc3ccccc3C)CC2)n1 ZINC001441192412 1063408529 /nfs/dbraw/zinc/40/85/29/1063408529.db2.gz XSFIXNYXTKYLOY-UHFFFAOYSA-N 1 1 368.437 2.955 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001525865159 1063442924 /nfs/dbraw/zinc/44/29/24/1063442924.db2.gz IVIUTTCGQXUSLK-JSGCOSHPSA-N 1 1 369.849 2.958 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001471234201 1064607491 /nfs/dbraw/zinc/60/74/91/1064607491.db2.gz CZBMXIDGRRTLMB-AWEZNQCLSA-N 1 1 363.462 2.968 20 5 FFBDMO COCCC[N@@H+](C)CCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001472713315 1065132856 /nfs/dbraw/zinc/13/28/56/1065132856.db2.gz SYUMJVLJUKNCNR-UHFFFAOYSA-N 1 1 352.822 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO ZINC001472895674 1065170360 /nfs/dbraw/zinc/17/03/60/1065170360.db2.gz BUYBLRPOUXIUHI-VXGBXAGGSA-N 1 1 360.241 2.937 20 5 FFBDMO C[C@@H]1CN(c2cc[nH+]cc2)CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001473810091 1065373638 /nfs/dbraw/zinc/37/36/38/1065373638.db2.gz UIENKVUBWPQYIP-MRXNPFEDSA-N 1 1 356.426 2.969 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)CCc2ccc3c(c2)OCO3)c1[N+](=O)[O-] ZINC001474710925 1065587535 /nfs/dbraw/zinc/58/75/35/1065587535.db2.gz XXLBVWQUDNFDFQ-UHFFFAOYSA-N 1 1 360.366 2.712 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c(F)cc1[N+](=O)[O-] ZINC001475024046 1065676713 /nfs/dbraw/zinc/67/67/13/1065676713.db2.gz ZVBGSJMGWKZQTN-CYBMUJFWSA-N 1 1 373.450 2.537 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1cccc(Br)c1[N+](=O)[O-] ZINC001559180625 1076132815 /nfs/dbraw/zinc/13/28/15/1076132815.db2.gz NJAWUUTVNMPAHK-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1cccc(Br)c1[N+](=O)[O-] ZINC001559180625 1076132817 /nfs/dbraw/zinc/13/28/17/1076132817.db2.gz NJAWUUTVNMPAHK-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC001559573187 1076174395 /nfs/dbraw/zinc/17/43/95/1076174395.db2.gz YWAKTLLSQMPSFH-GOSISDBHSA-N 1 1 358.442 2.862 20 5 FFBDMO Cc1ccc(C[N@H+](C)C[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001560071540 1076222006 /nfs/dbraw/zinc/22/20/06/1076222006.db2.gz JHILORPENZPPOI-HNNXBMFYSA-N 1 1 367.446 2.563 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2Cc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001560217032 1076248306 /nfs/dbraw/zinc/24/83/06/1076248306.db2.gz PIALFCBDRYYIPL-QGZVFWFLSA-N 1 1 369.421 2.997 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3cn(CC)nc3C)CC2)ccc1[N+](=O)[O-] ZINC001560800929 1076301029 /nfs/dbraw/zinc/30/10/29/1076301029.db2.gz ADWALAXNCBMVRH-UHFFFAOYSA-N 1 1 373.457 2.841 20 5 FFBDMO COc1c(O)ccc(C[N@H+](C)CCCNC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001560926616 1076310378 /nfs/dbraw/zinc/31/03/78/1076310378.db2.gz SQLQIQRCSZUQSL-UHFFFAOYSA-N 1 1 369.418 2.656 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)CCCNC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001560926616 1076310380 /nfs/dbraw/zinc/31/03/80/1076310380.db2.gz SQLQIQRCSZUQSL-UHFFFAOYSA-N 1 1 369.418 2.656 20 5 FFBDMO C[N@@H+](CC/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001567746938 1077050614 /nfs/dbraw/zinc/05/06/14/1077050614.db2.gz RKBMDRCBMOQZHQ-GCDVTEQJSA-N 1 1 371.481 2.926 20 5 FFBDMO C[N@H+](CC/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001567746938 1077050621 /nfs/dbraw/zinc/05/06/21/1077050621.db2.gz RKBMDRCBMOQZHQ-GCDVTEQJSA-N 1 1 371.481 2.926 20 5 FFBDMO C[N@@H+](CC/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001567746938 1077050625 /nfs/dbraw/zinc/05/06/25/1077050625.db2.gz RKBMDRCBMOQZHQ-GCDVTEQJSA-N 1 1 371.481 2.926 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1ccc(C(F)F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570673380 1077220973 /nfs/dbraw/zinc/22/09/73/1077220973.db2.gz AIHNQVHLJKSIMZ-HUUCEWRRSA-N 1 1 369.412 2.864 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC001570899663 1077240527 /nfs/dbraw/zinc/24/05/27/1077240527.db2.gz AMEBTJIDHNJPOY-PHIMTYICSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@H]2CCCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001587149031 1079746250 /nfs/dbraw/zinc/74/62/50/1079746250.db2.gz HBMUHJWYHVGBCA-INIZCTEOSA-N 1 1 371.441 2.801 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590050730 1080978997 /nfs/dbraw/zinc/97/89/97/1080978997.db2.gz OMVDNBFKSNMSAH-PXAZEXFGSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@]1([NH2+]Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC001590148820 1081050881 /nfs/dbraw/zinc/05/08/81/1081050881.db2.gz UPROEDKVEGSGRK-SFHVURJKSA-N 1 1 366.381 2.562 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC=C(c2ccc(Cl)nc2)CC1 ZINC000375004585 512114796 /nfs/dbraw/zinc/11/47/96/512114796.db2.gz NOKIHGLOTGDHQF-UHFFFAOYSA-N 1 1 360.801 2.594 20 5 FFBDMO Cc1nn(C)c(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)c1[N+](=O)[O-] ZINC000052473622 249498622 /nfs/dbraw/zinc/49/86/22/249498622.db2.gz WMUGYRSQUZNIPL-UHFFFAOYSA-N 1 1 365.384 2.991 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101911968 250092946 /nfs/dbraw/zinc/09/29/46/250092946.db2.gz UMOPWLZBHRXYIO-INIZCTEOSA-N 1 1 363.458 2.992 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC000106891456 250297111 /nfs/dbraw/zinc/29/71/11/250297111.db2.gz KMNCGBLZVOKQAA-NSHDSACASA-N 1 1 373.862 2.543 20 5 FFBDMO O=C1[C@@H]([N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1CC(F)(F)F ZINC000153257646 251119100 /nfs/dbraw/zinc/11/91/00/251119100.db2.gz VBFHWJDDKKRVFP-AWEZNQCLSA-N 1 1 357.332 2.722 20 5 FFBDMO O=C1[C@@H]([N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1CC(F)(F)F ZINC000153257646 251119103 /nfs/dbraw/zinc/11/91/03/251119103.db2.gz VBFHWJDDKKRVFP-AWEZNQCLSA-N 1 1 357.332 2.722 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NCc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000181144224 251247918 /nfs/dbraw/zinc/24/79/18/251247918.db2.gz YUVIOUJOIVICFJ-LJQANCHMSA-N 1 1 371.437 2.920 20 5 FFBDMO C[C@@H]1C[N@H+](CCC2CCN(c3ncc([N+](=O)[O-])s3)CC2)C[C@H](C)O1 ZINC000192479749 251276955 /nfs/dbraw/zinc/27/69/55/251276955.db2.gz QYTQWASVUHOEIH-BETUJISGSA-N 1 1 354.476 2.767 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272572398 252071428 /nfs/dbraw/zinc/07/14/28/252071428.db2.gz QXPBVECKZHRTHY-LLVKDONJSA-N 1 1 352.341 2.644 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272576462 252072031 /nfs/dbraw/zinc/07/20/31/252072031.db2.gz XGPLEQZJHZAMMJ-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO C[N@@H+]1CCCN(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CC1 ZINC000272519126 252057882 /nfs/dbraw/zinc/05/78/82/252057882.db2.gz HDPHLSBJKUGJMT-UHFFFAOYSA-N 1 1 370.409 2.695 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CC1 ZINC000272519126 252057888 /nfs/dbraw/zinc/05/78/88/252057888.db2.gz HDPHLSBJKUGJMT-UHFFFAOYSA-N 1 1 370.409 2.695 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272551356 252066340 /nfs/dbraw/zinc/06/63/40/252066340.db2.gz RIVYAZDWBLASMF-ROUUACIJSA-N 1 1 358.442 2.949 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCNc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000272573405 252070696 /nfs/dbraw/zinc/07/06/96/252070696.db2.gz WJHXRMVXFWLKAY-GOSISDBHSA-N 1 1 366.425 2.905 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272569945 252070868 /nfs/dbraw/zinc/07/08/68/252070868.db2.gz TULDXKIZZVSERX-WFASDCNBSA-N 1 1 368.865 2.772 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000276360936 256092770 /nfs/dbraw/zinc/09/27/70/256092770.db2.gz AIVYBNGNTLRALK-OAHLLOKOSA-N 1 1 364.446 2.570 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000277650085 256222204 /nfs/dbraw/zinc/22/22/04/256222204.db2.gz YVTOUJOIAKQFFO-CYBMUJFWSA-N 1 1 362.386 2.558 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CCCO1 ZINC000277741397 256233967 /nfs/dbraw/zinc/23/39/67/256233967.db2.gz YCYWFUPCNGAWDP-ZDUSSCGKSA-N 1 1 361.398 2.572 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2 ZINC000286001901 257015233 /nfs/dbraw/zinc/01/52/33/257015233.db2.gz ISTALMKZCJGXMX-LLVKDONJSA-N 1 1 357.366 2.785 20 5 FFBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000286581709 257044098 /nfs/dbraw/zinc/04/40/98/257044098.db2.gz VFVPEUMNTSMHBX-CQSZACIVSA-N 1 1 373.413 2.526 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000286914224 257061698 /nfs/dbraw/zinc/06/16/98/257061698.db2.gz AYDBEYUYEYABLQ-MRXNPFEDSA-N 1 1 360.414 2.675 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]([C@H](C)CO)C1CCCC1 ZINC000287786493 257112608 /nfs/dbraw/zinc/11/26/08/257112608.db2.gz NRAWJEAYGQTUCI-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000287826521 257117977 /nfs/dbraw/zinc/11/79/77/257117977.db2.gz PYPNKAZRDVMLCO-KRWDZBQOSA-N 1 1 373.409 2.668 20 5 FFBDMO COc1cc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000290416326 257330958 /nfs/dbraw/zinc/33/09/58/257330958.db2.gz RGYRQTNVHBNUCB-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO NC(=O)c1ccnc(NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000290542341 257340340 /nfs/dbraw/zinc/34/03/40/257340340.db2.gz INRMIIRZZOFURD-HNNXBMFYSA-N 1 1 369.425 2.555 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000291726418 257419275 /nfs/dbraw/zinc/41/92/75/257419275.db2.gz HXIJLSLYPDYSSF-RDTXWAMCSA-N 1 1 369.421 2.996 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000302195417 258094040 /nfs/dbraw/zinc/09/40/40/258094040.db2.gz SIKKGOJPXNILNB-ZBFHGGJFSA-N 1 1 359.426 2.835 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+](CC2CCCC2)C1 ZINC000302635982 258107074 /nfs/dbraw/zinc/10/70/74/258107074.db2.gz KGPZOQWAAACSOA-AWEZNQCLSA-N 1 1 367.471 2.675 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000302635982 258107075 /nfs/dbraw/zinc/10/70/75/258107075.db2.gz KGPZOQWAAACSOA-AWEZNQCLSA-N 1 1 367.471 2.675 20 5 FFBDMO C[N@@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302836582 258112220 /nfs/dbraw/zinc/11/22/20/258112220.db2.gz WQIPTEMABNWIEN-DYVFJYSZSA-N 1 1 374.351 2.773 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302836582 258112221 /nfs/dbraw/zinc/11/22/21/258112221.db2.gz WQIPTEMABNWIEN-DYVFJYSZSA-N 1 1 374.351 2.773 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301856296 258071236 /nfs/dbraw/zinc/07/12/36/258071236.db2.gz CEGWMLRQGDFASF-CQSZACIVSA-N 1 1 369.487 2.778 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c(F)c1 ZINC000301888841 258072862 /nfs/dbraw/zinc/07/28/62/258072862.db2.gz RWGWIVXSUUFPOM-LSDHHAIUSA-N 1 1 363.364 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H]2C[C@@H](O)C[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000301888841 258072863 /nfs/dbraw/zinc/07/28/63/258072863.db2.gz RWGWIVXSUUFPOM-LSDHHAIUSA-N 1 1 363.364 2.920 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O ZINC000330700642 258168612 /nfs/dbraw/zinc/16/86/12/258168612.db2.gz GXULSFWCTQVKQU-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O ZINC000330700642 258168613 /nfs/dbraw/zinc/16/86/13/258168613.db2.gz GXULSFWCTQVKQU-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)c1[N+](=O)[O-] ZINC000331436384 258186034 /nfs/dbraw/zinc/18/60/34/258186034.db2.gz CVSRZNVVGZQHNV-UHFFFAOYSA-N 1 1 351.451 2.607 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000331570115 258191315 /nfs/dbraw/zinc/19/13/15/258191315.db2.gz PTRRBQQOVBXQKE-LLVKDONJSA-N 1 1 353.369 2.549 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000332369276 258227459 /nfs/dbraw/zinc/22/74/59/258227459.db2.gz AAZSXRXAXMOFGW-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2ccc([N+](=O)[O-])cc2Br)n1C ZINC000070143465 507608331 /nfs/dbraw/zinc/60/83/31/507608331.db2.gz RGQLLEWPZWIRBP-UHFFFAOYSA-N 1 1 354.208 2.769 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000375175478 512197596 /nfs/dbraw/zinc/19/75/96/512197596.db2.gz RZJCEVJMHNJGEA-UHFFFAOYSA-N 1 1 357.414 2.512 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000054626398 506590623 /nfs/dbraw/zinc/59/06/23/506590623.db2.gz VJKQFFUNSHPMGN-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000066921862 506696023 /nfs/dbraw/zinc/69/60/23/506696023.db2.gz WGKXSGNKZJCFOW-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000043121917 506703350 /nfs/dbraw/zinc/70/33/50/506703350.db2.gz JUZHBYRYQGDFFC-UHFFFAOYSA-N 1 1 370.409 2.783 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000055758182 506843771 /nfs/dbraw/zinc/84/37/71/506843771.db2.gz WRTQEDKRWLTJSM-FRRDWIJNSA-N 1 1 359.430 2.567 20 5 FFBDMO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000055758182 506843779 /nfs/dbraw/zinc/84/37/79/506843779.db2.gz WRTQEDKRWLTJSM-FRRDWIJNSA-N 1 1 359.430 2.567 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000055758182 506843786 /nfs/dbraw/zinc/84/37/86/506843786.db2.gz WRTQEDKRWLTJSM-FRRDWIJNSA-N 1 1 359.430 2.567 20 5 FFBDMO CC(C)COC1CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000067377760 506850422 /nfs/dbraw/zinc/85/04/22/506850422.db2.gz JDANLIXVLNDBBL-SFHVURJKSA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000067383029 506854102 /nfs/dbraw/zinc/85/41/02/506854102.db2.gz SAEJBSZWRSGASK-CQSZACIVSA-N 1 1 371.441 2.846 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCc3ccccc3C2)c1 ZINC000067547773 506922561 /nfs/dbraw/zinc/92/25/61/506922561.db2.gz BOTUMENLHODHRW-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC1)OCCO2 ZINC000045749533 507013201 /nfs/dbraw/zinc/01/32/01/507013201.db2.gz MWVKMYFIHSYBBT-LBPRGKRZSA-N 1 1 360.370 2.545 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000067831612 507020392 /nfs/dbraw/zinc/02/03/92/507020392.db2.gz ZUXNVKBDEJVSDL-AWEZNQCLSA-N 1 1 371.441 2.970 20 5 FFBDMO COc1ccc(CC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000067907113 507048698 /nfs/dbraw/zinc/04/86/98/507048698.db2.gz UEFMTKSYHDXCSH-HNNXBMFYSA-N 1 1 363.458 2.774 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000016222737 507079298 /nfs/dbraw/zinc/07/92/98/507079298.db2.gz XHTQIBCDDYQOCV-INIZCTEOSA-N 1 1 369.421 2.879 20 5 FFBDMO O=C(NC1CC1)c1ccc(NCC[NH+]2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000068321537 507187633 /nfs/dbraw/zinc/18/76/33/507187633.db2.gz IYYJMVNRMJHLHV-UHFFFAOYSA-N 1 1 366.421 2.915 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000068351915 507197767 /nfs/dbraw/zinc/19/77/67/507197767.db2.gz NWPKSTUSICEZTB-LBPRGKRZSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000068519825 507253667 /nfs/dbraw/zinc/25/36/67/507253667.db2.gz DRYKDIKYMPXBGW-SFHVURJKSA-N 1 1 357.410 2.783 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000068519827 507254192 /nfs/dbraw/zinc/25/41/92/507254192.db2.gz DRYKDIKYMPXBGW-GOSISDBHSA-N 1 1 357.410 2.783 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428568 513560535 /nfs/dbraw/zinc/56/05/35/513560535.db2.gz XBQDXJGIOXQYMX-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000023245065 507341103 /nfs/dbraw/zinc/34/11/03/507341103.db2.gz KJCXUFGJTSPVQF-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000023245065 507341108 /nfs/dbraw/zinc/34/11/08/507341108.db2.gz KJCXUFGJTSPVQF-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)[NH+](C)C ZINC000023694118 507365804 /nfs/dbraw/zinc/36/58/04/507365804.db2.gz WFHQJIQPFZUEGS-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428568 513560530 /nfs/dbraw/zinc/56/05/30/513560530.db2.gz XBQDXJGIOXQYMX-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO C[C@@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000025631839 507517759 /nfs/dbraw/zinc/51/77/59/507517759.db2.gz YRMBRTZAXOMTOG-HNNXBMFYSA-N 1 1 369.421 2.537 20 5 FFBDMO O=C(CC[NH+]1CCN(Cc2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000026158294 507563914 /nfs/dbraw/zinc/56/39/14/507563914.db2.gz JSEYRJKNIGIFFD-UHFFFAOYSA-N 1 1 368.437 2.741 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000050561445 507692747 /nfs/dbraw/zinc/69/27/47/507692747.db2.gz HDYJJJVBWVNSAW-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000063852421 507775696 /nfs/dbraw/zinc/77/56/96/507775696.db2.gz NSZHHTLZMQUUIP-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO COc1ccccc1OCC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000051855762 507788220 /nfs/dbraw/zinc/78/82/20/507788220.db2.gz GOJOCVNLJCHYOJ-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000052253820 507804509 /nfs/dbraw/zinc/80/45/09/507804509.db2.gz XGIBLVRDQBSJQF-UHFFFAOYSA-N 1 1 355.301 2.523 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064736217 507807604 /nfs/dbraw/zinc/80/76/04/507807604.db2.gz VESMTBOYPICUGR-LLVKDONJSA-N 1 1 366.805 2.727 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(C(=O)NC2CC2)cc1 ZINC000052561524 507813944 /nfs/dbraw/zinc/81/39/44/507813944.db2.gz RGFNOBDLSJPOGG-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1cccc2nc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn21 ZINC000072665207 507840104 /nfs/dbraw/zinc/84/01/04/507840104.db2.gz HNGIKMDQBQSNLK-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1cccc2nc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn21 ZINC000072665207 507840106 /nfs/dbraw/zinc/84/01/06/507840106.db2.gz HNGIKMDQBQSNLK-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO CC(C)N(C(=O)[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000072665252 507840276 /nfs/dbraw/zinc/84/02/76/507840276.db2.gz GPDZTUYYFUHXDI-CABCVRRESA-N 1 1 363.462 2.510 20 5 FFBDMO CC[C@](C)([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000072683492 507841399 /nfs/dbraw/zinc/84/13/99/507841399.db2.gz QJMOKXBVKJBSAQ-KRWDZBQOSA-N 1 1 360.439 2.855 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000072771426 507851810 /nfs/dbraw/zinc/85/18/10/507851810.db2.gz FKHIWZMUFBATFQ-TXEJJXNPSA-N 1 1 353.444 2.758 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644386 507853366 /nfs/dbraw/zinc/85/33/66/507853366.db2.gz IQSAFIQKFWUUFE-MOPGFXCFSA-N 1 1 371.437 2.789 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000078351872 507863708 /nfs/dbraw/zinc/86/37/08/507863708.db2.gz NZKPRJOQKYCDSZ-UHFFFAOYSA-N 1 1 369.487 2.669 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000108333326 507887752 /nfs/dbraw/zinc/88/77/52/507887752.db2.gz JLSSEZRXECCMGJ-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO O=C(C[N@H+](C[C@@H]1CCCO1)[C@@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000089952756 507890163 /nfs/dbraw/zinc/89/01/63/507890163.db2.gz OFIRMPVLTWCFDQ-KGLIPLIRSA-N 1 1 365.455 2.520 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCCO1)[C@@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000089952756 507890165 /nfs/dbraw/zinc/89/01/65/507890165.db2.gz OFIRMPVLTWCFDQ-KGLIPLIRSA-N 1 1 365.455 2.520 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000108392163 507892191 /nfs/dbraw/zinc/89/21/91/507892191.db2.gz XBPBLFLKKLIHLE-QGZVFWFLSA-N 1 1 361.442 2.765 20 5 FFBDMO CCCO[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000108398568 507892314 /nfs/dbraw/zinc/89/23/14/507892314.db2.gz HKHJLUZDCLDBRN-CQSZACIVSA-N 1 1 365.430 2.823 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000108398568 507892316 /nfs/dbraw/zinc/89/23/16/507892316.db2.gz HKHJLUZDCLDBRN-CQSZACIVSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000079577090 507977782 /nfs/dbraw/zinc/97/77/82/507977782.db2.gz UTSJBZNBAGUWKP-MRXNPFEDSA-N 1 1 362.474 2.659 20 5 FFBDMO COc1cc(C[NH+]2CCC(c3nc(C)no3)CC2)c([N+](=O)[O-])cc1OC ZINC000091835397 508016990 /nfs/dbraw/zinc/01/69/90/508016990.db2.gz NHUNRHXDTYGVOD-UHFFFAOYSA-N 1 1 362.386 2.683 20 5 FFBDMO CC[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O ZINC000110559913 508033365 /nfs/dbraw/zinc/03/33/65/508033365.db2.gz IKYJOVDTVOXMDE-DGCLKSJQSA-N 1 1 372.263 2.639 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092010478 508032691 /nfs/dbraw/zinc/03/26/91/508032691.db2.gz VJLOMMCOTSJHGU-BOYDOFOJSA-N 1 1 356.426 2.787 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cc2Cl)CC1 ZINC000080569656 508085021 /nfs/dbraw/zinc/08/50/21/508085021.db2.gz AKVUVJKEVMGVII-UHFFFAOYSA-N 1 1 368.865 2.959 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc(-n3ccnc3)c([N+](=O)[O-])c1)C2 ZINC000080714544 508097047 /nfs/dbraw/zinc/09/70/47/508097047.db2.gz DXXYOXIUXSTPLN-MQVJKMGUSA-N 1 1 369.425 2.526 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000111458599 508100683 /nfs/dbraw/zinc/10/06/83/508100683.db2.gz IMAVSGMOAQZDIF-HNNXBMFYSA-N 1 1 356.426 2.915 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc(-n4cccn4)c3)C2)nc1 ZINC000093534244 508147370 /nfs/dbraw/zinc/14/73/70/508147370.db2.gz IAYYGOAXTWWLPC-MRXNPFEDSA-N 1 1 364.409 2.862 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000112309845 508173274 /nfs/dbraw/zinc/17/32/74/508173274.db2.gz UNEOLNFFJRSEIH-UHFFFAOYSA-N 1 1 355.460 2.787 20 5 FFBDMO CCC[N@H+](C)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000081568920 508190842 /nfs/dbraw/zinc/19/08/42/508190842.db2.gz XBIDZCGFFFSKCX-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000081568920 508190843 /nfs/dbraw/zinc/19/08/43/508190843.db2.gz XBIDZCGFFFSKCX-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000081632066 508199060 /nfs/dbraw/zinc/19/90/60/508199060.db2.gz BZWGIUILZCKVGB-OAHLLOKOSA-N 1 1 371.441 2.809 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000076486204 508212848 /nfs/dbraw/zinc/21/28/48/508212848.db2.gz ZGTMBFDYOXXZMA-KDOFPFPSSA-N 1 1 371.441 2.583 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H](C)C1 ZINC000076491684 508213351 /nfs/dbraw/zinc/21/33/51/508213351.db2.gz DGOMFXLTEIGFAL-RDTXWAMCSA-N 1 1 371.441 2.583 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000076490161 508213584 /nfs/dbraw/zinc/21/35/84/508213584.db2.gz DYWIUZWJTYFHGC-KDOFPFPSSA-N 1 1 371.441 2.583 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169851 508238445 /nfs/dbraw/zinc/23/84/45/508238445.db2.gz IMACFAWJDMOWQX-CYBMUJFWSA-N 1 1 360.414 2.864 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083169851 508238449 /nfs/dbraw/zinc/23/84/49/508238449.db2.gz IMACFAWJDMOWQX-CYBMUJFWSA-N 1 1 360.414 2.864 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])C1 ZINC000113939727 508287430 /nfs/dbraw/zinc/28/74/30/508287430.db2.gz NSFIJHVXFYMJFW-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])C1 ZINC000113939727 508287431 /nfs/dbraw/zinc/28/74/31/508287431.db2.gz NSFIJHVXFYMJFW-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000113950762 508287777 /nfs/dbraw/zinc/28/77/77/508287777.db2.gz UZYSJEVWRNWIPI-KOLCDFICSA-N 1 1 362.386 2.886 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000106104898 508393816 /nfs/dbraw/zinc/39/38/16/508393816.db2.gz YXGPOVYWXGNUME-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000134247194 508513258 /nfs/dbraw/zinc/51/32/58/508513258.db2.gz IRJXCKHXGSZTJB-XIKOKIGWSA-N 1 1 355.394 2.518 20 5 FFBDMO CC[N@@H+](CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000116749403 508554633 /nfs/dbraw/zinc/55/46/33/508554633.db2.gz WESRGCCVWCIYJG-UHFFFAOYSA-N 1 1 355.822 2.618 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134710207 508561138 /nfs/dbraw/zinc/56/11/38/508561138.db2.gz FWJIVHNCHAKLTL-OAHLLOKOSA-N 1 1 358.442 2.999 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000122715231 508576734 /nfs/dbraw/zinc/57/67/34/508576734.db2.gz SZJCLUHDKKWKJO-UHFFFAOYSA-N 1 1 374.397 2.810 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(c3cnccn3)CC2)o1 ZINC000157909303 508630462 /nfs/dbraw/zinc/63/04/62/508630462.db2.gz XIAZQVVGVBRETF-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO Cc1c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000123241890 508657156 /nfs/dbraw/zinc/65/71/56/508657156.db2.gz CHVSMVMLXTVHKX-ZWNOBZJWSA-N 1 1 364.402 2.675 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000123238393 508657394 /nfs/dbraw/zinc/65/73/94/508657394.db2.gz SUEZHBREQWWZIU-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153938015 508681110 /nfs/dbraw/zinc/68/11/10/508681110.db2.gz FCQCBNLWFDTSHT-QAPCUYQASA-N 1 1 372.469 2.872 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000123493494 508695054 /nfs/dbraw/zinc/69/50/54/508695054.db2.gz UWPVULNMSRNPJZ-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nnc4ccccn43)C2)c1 ZINC000154341242 508764071 /nfs/dbraw/zinc/76/40/71/508764071.db2.gz JVBWWCKRJGBNPS-WBVHZDCISA-N 1 1 367.409 2.551 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000154402535 508777084 /nfs/dbraw/zinc/77/70/84/508777084.db2.gz LPSKLTTXDCEAQS-UHFFFAOYSA-N 1 1 372.263 2.748 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCc3ccccc3[C@H]2CO)c([N+](=O)[O-])c1 ZINC000130702446 508833526 /nfs/dbraw/zinc/83/35/26/508833526.db2.gz HKQPLLWKJWNEDT-GOSISDBHSA-N 1 1 358.394 2.574 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000148595939 508864576 /nfs/dbraw/zinc/86/45/76/508864576.db2.gz RDYRDTDQBLKMNI-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@H](C(N)=O)CC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000159604271 508864537 /nfs/dbraw/zinc/86/45/37/508864537.db2.gz KTFZZGLSCLWPBM-CHWSQXEVSA-N 1 1 373.409 2.949 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000154857399 508870545 /nfs/dbraw/zinc/87/05/45/508870545.db2.gz HMMONBSMBJIFBS-INIZCTEOSA-N 1 1 350.419 2.559 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000160230098 508957694 /nfs/dbraw/zinc/95/76/94/508957694.db2.gz IKQPPQZZDLMUAT-KDOFPFPSSA-N 1 1 368.437 2.887 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000120827835 509071783 /nfs/dbraw/zinc/07/17/83/509071783.db2.gz ZDGBXKCOGHHJMF-SNVBAGLBSA-N 1 1 358.236 2.817 20 5 FFBDMO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000120992173 509104861 /nfs/dbraw/zinc/10/48/61/509104861.db2.gz ZWGOUKXEPLBBLX-OCCSQVGLSA-N 1 1 367.475 2.734 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000121397141 509171869 /nfs/dbraw/zinc/17/18/69/509171869.db2.gz AYFIWKKHHFHISS-SFHVURJKSA-N 1 1 372.469 2.927 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)n1 ZINC000191815150 509196261 /nfs/dbraw/zinc/19/62/61/509196261.db2.gz DWSGROIMUOAKEV-LSDHHAIUSA-N 1 1 363.462 2.538 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248147464 509247806 /nfs/dbraw/zinc/24/78/06/509247806.db2.gz ZWZPPBVFCLROJZ-QFBILLFUSA-N 1 1 354.410 2.568 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248546819 509358138 /nfs/dbraw/zinc/35/81/38/509358138.db2.gz DZMNDKSUUPEUIR-KGLIPLIRSA-N 1 1 351.422 2.932 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccc(Cl)cc1 ZINC000176242411 509399192 /nfs/dbraw/zinc/39/91/92/509399192.db2.gz ZKAIPHGCQZKORC-UHFFFAOYSA-N 1 1 365.821 2.795 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000264282627 509432480 /nfs/dbraw/zinc/43/24/80/509432480.db2.gz IOLULUWQVABXRN-LJQANCHMSA-N 1 1 367.449 2.818 20 5 FFBDMO CC(C)N1CCC([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236601373 509461530 /nfs/dbraw/zinc/46/15/30/509461530.db2.gz ONVXOUPYCGXLNG-UHFFFAOYSA-N 1 1 357.458 2.958 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000264357378 509479054 /nfs/dbraw/zinc/47/90/54/509479054.db2.gz YCACXMYSSGXKIK-OAHLLOKOSA-N 1 1 359.451 2.951 20 5 FFBDMO O=[N+]([O-])c1ccc(CNC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358125 509481577 /nfs/dbraw/zinc/48/15/77/509481577.db2.gz UXUDPMMGENUZMD-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000192358125 509481582 /nfs/dbraw/zinc/48/15/82/509481582.db2.gz UXUDPMMGENUZMD-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179511797 509487551 /nfs/dbraw/zinc/48/75/51/509487551.db2.gz QUAHFHGGTSDDRO-ZDUSSCGKSA-N 1 1 357.414 2.979 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000248816803 509495528 /nfs/dbraw/zinc/49/55/28/509495528.db2.gz LAKNBZFUOFWMNE-DNVCBOLYSA-N 1 1 353.422 2.774 20 5 FFBDMO Cc1[nH+]ccn1CCCCNS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000173312567 509524650 /nfs/dbraw/zinc/52/46/50/509524650.db2.gz WWONYDZERDENQB-UHFFFAOYSA-N 1 1 372.834 2.512 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])s1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183018842 509550856 /nfs/dbraw/zinc/55/08/56/509550856.db2.gz OKONZCAESCBHFO-NEPJUHHUSA-N 1 1 373.500 2.588 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268040718 509730846 /nfs/dbraw/zinc/73/08/46/509730846.db2.gz XYWBBGDLFRDMIF-MWLCHTKSSA-N 1 1 357.332 2.969 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)CCN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000186582765 509784237 /nfs/dbraw/zinc/78/42/37/509784237.db2.gz GTDPFUTXZYAOTC-CVEARBPZSA-N 1 1 364.490 2.670 20 5 FFBDMO C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000189952199 509849801 /nfs/dbraw/zinc/84/98/01/509849801.db2.gz LREYSRGJQDMBAE-HOTGVXAUSA-N 1 1 357.458 2.538 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000252735597 509860400 /nfs/dbraw/zinc/86/04/00/509860400.db2.gz NGTIWDHIHAYULL-KGLIPLIRSA-N 1 1 356.426 2.993 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180560184 509984126 /nfs/dbraw/zinc/98/41/26/509984126.db2.gz BSNSNUGLWIZFEU-JTQLQIEISA-N 1 1 358.236 2.817 20 5 FFBDMO C[C@]([NH2+]CCOc1cccc([N+](=O)[O-])c1)(C(N)=O)c1cccc(Cl)c1 ZINC000177406419 510041256 /nfs/dbraw/zinc/04/12/56/510041256.db2.gz MCWLSFKHWHCIHN-QGZVFWFLSA-N 1 1 363.801 2.617 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)ccc1[N+](=O)[O-] ZINC000193772873 510061331 /nfs/dbraw/zinc/06/13/31/510061331.db2.gz PWXGWGOHBONKCU-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO COc1cc(NC(=O)C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000177455109 510068569 /nfs/dbraw/zinc/06/85/69/510068569.db2.gz YJXRZWFHTKGEBL-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1cc(NC(=O)C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000177455109 510068575 /nfs/dbraw/zinc/06/85/75/510068575.db2.gz YJXRZWFHTKGEBL-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC1 ZINC000193898224 510118734 /nfs/dbraw/zinc/11/87/34/510118734.db2.gz PVEOAASZRWNEHE-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000262031318 510154430 /nfs/dbraw/zinc/15/44/30/510154430.db2.gz SIDCAUJDKQGLPG-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](c4cc[nH]n4)C3)n2)c1 ZINC000193995628 510166988 /nfs/dbraw/zinc/16/69/88/510166988.db2.gz LVSOOSHXAPPIRH-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)n2)c1 ZINC000193995628 510166994 /nfs/dbraw/zinc/16/69/94/510166994.db2.gz LVSOOSHXAPPIRH-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194070961 510201252 /nfs/dbraw/zinc/20/12/52/510201252.db2.gz CQCSMUONIYWUCZ-SFHVURJKSA-N 1 1 368.437 2.916 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)cs1 ZINC000265760808 510215688 /nfs/dbraw/zinc/21/56/88/510215688.db2.gz JUECEDWMOBRPBH-SJORKVTESA-N 1 1 361.467 2.629 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@H]2CCCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000246072138 510277803 /nfs/dbraw/zinc/27/78/03/510277803.db2.gz CQXTYVFYLUJIET-WBVHZDCISA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@H]2CCCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000246072138 510277808 /nfs/dbraw/zinc/27/78/08/510277808.db2.gz CQXTYVFYLUJIET-WBVHZDCISA-N 1 1 361.467 2.844 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000175037471 510451525 /nfs/dbraw/zinc/45/15/25/510451525.db2.gz RFDAARZQRIDTCS-IAGOWNOFSA-N 1 1 372.469 2.894 20 5 FFBDMO Cc1cc(N2CC[NH+](C[C@@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181523799 510453666 /nfs/dbraw/zinc/45/36/66/510453666.db2.gz ZSEDIUXDGXCYTM-HNNXBMFYSA-N 1 1 356.426 2.610 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1nccs1 ZINC000175051404 510459902 /nfs/dbraw/zinc/45/99/02/510459902.db2.gz WESZJBQGGFEGLT-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1nccs1 ZINC000175051404 510459911 /nfs/dbraw/zinc/45/99/11/510459911.db2.gz WESZJBQGGFEGLT-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000194736019 510501714 /nfs/dbraw/zinc/50/17/14/510501714.db2.gz VNUKBCPTSYDOIY-INMHGKMJSA-N 1 1 374.485 2.901 20 5 FFBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000187946532 510515270 /nfs/dbraw/zinc/51/52/70/510515270.db2.gz RYDXEYOZGMSSGM-MEDUHNTESA-N 1 1 355.822 2.670 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CC[NH+](CCOC(C)C)CC1 ZINC000175291487 510572626 /nfs/dbraw/zinc/57/26/26/510572626.db2.gz LPFSRYWAKHHTHL-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000246660961 510606581 /nfs/dbraw/zinc/60/65/81/510606581.db2.gz JAWPXYWBNHCTRJ-PKOBYXMFSA-N 1 1 356.422 2.899 20 5 FFBDMO Cc1cccc(C[N@H+](Cc2ccco2)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000266611132 510686567 /nfs/dbraw/zinc/68/65/67/510686567.db2.gz CGBUSIOGZNJSBZ-SFHVURJKSA-N 1 1 370.409 2.756 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246812570 510688429 /nfs/dbraw/zinc/68/84/29/510688429.db2.gz NJYNWJUTOZPPFZ-VCBZYWHSSA-N 1 1 372.469 2.871 20 5 FFBDMO CCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000191709134 510795852 /nfs/dbraw/zinc/79/58/52/510795852.db2.gz XHQXGVVZCDFBLE-INIZCTEOSA-N 1 1 371.441 2.548 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247557975 510865558 /nfs/dbraw/zinc/86/55/58/510865558.db2.gz ZINRTXZBPSFAJB-YJBOKZPZSA-N 1 1 362.474 2.976 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285443995 510908552 /nfs/dbraw/zinc/90/85/52/510908552.db2.gz XTYUXTCAYRYLRQ-GOSISDBHSA-N 1 1 374.437 2.655 20 5 FFBDMO COc1ccc([C@H](CCO)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000270682958 510950335 /nfs/dbraw/zinc/95/03/35/510950335.db2.gz TVHWHLAFJMQXEG-SFHVURJKSA-N 1 1 374.393 2.683 20 5 FFBDMO Cc1noc([C@@H]2CCCC[N@@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000285595058 510970892 /nfs/dbraw/zinc/97/08/92/510970892.db2.gz JIXWTOGIVPPAMY-HNNXBMFYSA-N 1 1 359.386 2.842 20 5 FFBDMO Cc1noc([C@@H]2CCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000285595058 510970894 /nfs/dbraw/zinc/97/08/94/510970894.db2.gz JIXWTOGIVPPAMY-HNNXBMFYSA-N 1 1 359.386 2.842 20 5 FFBDMO Cn1c[nH+]cc1CCN1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000297787688 511069529 /nfs/dbraw/zinc/06/95/29/511069529.db2.gz WPXFYTCRDLTLDQ-UHFFFAOYSA-N 1 1 365.231 2.692 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294596784 511114666 /nfs/dbraw/zinc/11/46/66/511114666.db2.gz USMIWNPTJFFRPA-NEPJUHHUSA-N 1 1 353.394 2.593 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000271206604 511120626 /nfs/dbraw/zinc/12/06/26/511120626.db2.gz SFGWJYOTFTULBZ-UHFFFAOYSA-N 1 1 357.357 2.674 20 5 FFBDMO COc1cc(C[NH2+]Cc2cncn2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000289938323 511121351 /nfs/dbraw/zinc/12/13/51/511121351.db2.gz UEZHONBGDOJFRM-UHFFFAOYSA-N 1 1 374.319 2.568 20 5 FFBDMO C[C@@H]1CN(c2ncc(Br)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000294855654 511199376 /nfs/dbraw/zinc/19/93/76/511199376.db2.gz CRBGPMOKZNNOCB-JTQLQIEISA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000271471820 511216039 /nfs/dbraw/zinc/21/60/39/511216039.db2.gz YYHXMIBYMRTMHW-ZDUSSCGKSA-N 1 1 357.414 2.955 20 5 FFBDMO COc1cccc(CNC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271577757 511250717 /nfs/dbraw/zinc/25/07/17/511250717.db2.gz BGYSZSSVMZSJQA-UONOGXRCSA-N 1 1 357.410 2.959 20 5 FFBDMO CNC(=O)c1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271639822 511271566 /nfs/dbraw/zinc/27/15/66/511271566.db2.gz RDUPMKHPCCFSGD-OLZOCXBDSA-N 1 1 370.409 2.632 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000295078326 511273718 /nfs/dbraw/zinc/27/37/18/511273718.db2.gz WOUBJMBMGKXXRT-WBVHZDCISA-N 1 1 359.426 2.500 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000271779043 511321613 /nfs/dbraw/zinc/32/16/13/511321613.db2.gz RWRNFJKZFJPPIG-CYBMUJFWSA-N 1 1 370.409 2.586 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3ccncn3)CC2)cccc1[N+](=O)[O-] ZINC000298541359 511321656 /nfs/dbraw/zinc/32/16/56/511321656.db2.gz XMMBNMUKFZVUQP-AWEZNQCLSA-N 1 1 369.425 2.900 20 5 FFBDMO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295278620 511346417 /nfs/dbraw/zinc/34/64/17/511346417.db2.gz IIMVVQJILXNPBF-XJKSGUPXSA-N 1 1 369.425 2.684 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@]1(C)CCCO ZINC000271987981 511392372 /nfs/dbraw/zinc/39/23/72/511392372.db2.gz DFDCHDDXRWEIQP-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+](C2CC2)C1 ZINC000295532754 511437040 /nfs/dbraw/zinc/43/70/40/511437040.db2.gz JTDXJORELXNKSC-CYBMUJFWSA-N 1 1 369.425 2.541 20 5 FFBDMO C[C@@H]1CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)CC[N@H+](C2CCC2)C1 ZINC000295839681 511532159 /nfs/dbraw/zinc/53/21/59/511532159.db2.gz DHKZHGAUOXUPLQ-AWEZNQCLSA-N 1 1 370.457 2.701 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000299203365 511551659 /nfs/dbraw/zinc/55/16/59/511551659.db2.gz XQHFDSRRHJPQME-JKIFEVAISA-N 1 1 362.430 2.700 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000299203365 511551663 /nfs/dbraw/zinc/55/16/63/511551663.db2.gz XQHFDSRRHJPQME-JKIFEVAISA-N 1 1 362.430 2.700 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000292556920 511641916 /nfs/dbraw/zinc/64/19/16/511641916.db2.gz XRLQPALCEKWILU-WMZOPIPTSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccncc1 ZINC000292556920 511641924 /nfs/dbraw/zinc/64/19/24/511641924.db2.gz XRLQPALCEKWILU-WMZOPIPTSA-N 1 1 357.410 2.813 20 5 FFBDMO Cc1nc(NCc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)ncc1[N+](=O)[O-] ZINC000296189231 511648897 /nfs/dbraw/zinc/64/88/97/511648897.db2.gz BJQUPGQQHZCPCF-OKILXGFUSA-N 1 1 371.441 2.915 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc(Cn3c[nH+]c4c3CCCC4)n2)c1 ZINC000350249124 511756616 /nfs/dbraw/zinc/75/66/16/511756616.db2.gz BCRCMKCOGHDWCZ-UHFFFAOYSA-N 1 1 369.381 2.701 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@H]2C1 ZINC000284521969 511757506 /nfs/dbraw/zinc/75/75/06/511757506.db2.gz FPXOQCPTWFDTIP-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000363778443 511763186 /nfs/dbraw/zinc/76/31/86/511763186.db2.gz MYXAMROOEGVPDG-GOEBONIOSA-N 1 1 354.410 2.881 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342993 511783977 /nfs/dbraw/zinc/78/39/77/511783977.db2.gz UVKGUDRFWJICFR-WMLDXEAASA-N 1 1 359.386 2.516 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342993 511783983 /nfs/dbraw/zinc/78/39/83/511783983.db2.gz UVKGUDRFWJICFR-WMLDXEAASA-N 1 1 359.386 2.516 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000296549016 511792142 /nfs/dbraw/zinc/79/21/42/511792142.db2.gz BSYJSRBGEBBHKR-KRWDZBQOSA-N 1 1 359.426 2.691 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CCn4c[nH+]cc4C3)n2)c1 ZINC000350903322 511903531 /nfs/dbraw/zinc/90/35/31/511903531.db2.gz IVYXVYTYDIHJDP-NSHDSACASA-N 1 1 355.354 2.504 20 5 FFBDMO COCCn1cc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000282038708 512055806 /nfs/dbraw/zinc/05/58/06/512055806.db2.gz OPEWWUXEXPKAML-UHFFFAOYSA-N 1 1 356.382 2.988 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cnc([C@@H]4CCCO4)s3)CC2)n1 ZINC000369692788 512557521 /nfs/dbraw/zinc/55/75/21/512557521.db2.gz KRFCWCIZMJFBPF-AWEZNQCLSA-N 1 1 363.443 2.936 20 5 FFBDMO Cc1cc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000367805606 512670303 /nfs/dbraw/zinc/67/03/03/512670303.db2.gz XOTPDWPHZYLQKW-QGZVFWFLSA-N 1 1 369.469 2.668 20 5 FFBDMO Cc1cc(N2CCN([C@@H]3CCC[N@@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000367805606 512670307 /nfs/dbraw/zinc/67/03/07/512670307.db2.gz XOTPDWPHZYLQKW-QGZVFWFLSA-N 1 1 369.469 2.668 20 5 FFBDMO Cc1cc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000367805606 512670309 /nfs/dbraw/zinc/67/03/09/512670309.db2.gz XOTPDWPHZYLQKW-QGZVFWFLSA-N 1 1 369.469 2.668 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCN(c2cnccn2)CC1 ZINC000370042685 512738887 /nfs/dbraw/zinc/73/88/87/512738887.db2.gz LCSKPPKVMOLQKW-UHFFFAOYSA-N 1 1 371.441 2.884 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000378513831 512799307 /nfs/dbraw/zinc/79/93/07/512799307.db2.gz DUMXWQVYHGAKQI-UHFFFAOYSA-N 1 1 351.834 2.878 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000382009665 512876536 /nfs/dbraw/zinc/87/65/36/512876536.db2.gz MTXQVNILKBBGJS-BBRMVZONSA-N 1 1 354.410 2.570 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949953 512886023 /nfs/dbraw/zinc/88/60/23/512886023.db2.gz QSXAMSSDQKCRDS-QZTJIDSGSA-N 1 1 356.378 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949953 512886027 /nfs/dbraw/zinc/88/60/27/512886027.db2.gz QSXAMSSDQKCRDS-QZTJIDSGSA-N 1 1 356.378 2.769 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@@H+](C)Cc2ccccc2)n1 ZINC000394024485 512935373 /nfs/dbraw/zinc/93/53/73/512935373.db2.gz ZJPPBSQMKWLEQL-UHFFFAOYSA-N 1 1 358.398 2.710 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000398001239 512952317 /nfs/dbraw/zinc/95/23/17/512952317.db2.gz NNIBHMPPZRTSJT-WMLDXEAASA-N 1 1 368.437 2.817 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](Cc3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368486963 512970312 /nfs/dbraw/zinc/97/03/12/512970312.db2.gz QQBVPLKRRPHBGG-QFBILLFUSA-N 1 1 366.421 2.660 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](Cc2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000368487032 512971024 /nfs/dbraw/zinc/97/10/24/512971024.db2.gz RCFLFPRQKZPUNB-MRXNPFEDSA-N 1 1 354.410 2.883 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086827 512995712 /nfs/dbraw/zinc/99/57/12/512995712.db2.gz LVYSHOUMLWQLML-OWCLPIDISA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086827 512995718 /nfs/dbraw/zinc/99/57/18/512995718.db2.gz LVYSHOUMLWQLML-OWCLPIDISA-N 1 1 374.485 2.996 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000412369430 513055721 /nfs/dbraw/zinc/05/57/21/513055721.db2.gz PGZMPCQAVWWHCX-CQSZACIVSA-N 1 1 361.442 2.938 20 5 FFBDMO CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000450391792 513174146 /nfs/dbraw/zinc/17/41/46/513174146.db2.gz RLARFJCHGLYIOZ-WMZOPIPTSA-N 1 1 371.441 2.785 20 5 FFBDMO CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000450391792 513174154 /nfs/dbraw/zinc/17/41/54/513174154.db2.gz RLARFJCHGLYIOZ-WMZOPIPTSA-N 1 1 371.441 2.785 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000428992596 513242714 /nfs/dbraw/zinc/24/27/14/513242714.db2.gz BHJFLFUFPOWLAJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000428992596 513242719 /nfs/dbraw/zinc/24/27/19/513242719.db2.gz BHJFLFUFPOWLAJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000428992596 513242727 /nfs/dbraw/zinc/24/27/27/513242727.db2.gz BHJFLFUFPOWLAJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+]2CCCO)c(Br)c1 ZINC000450589178 513264515 /nfs/dbraw/zinc/26/45/15/513264515.db2.gz CEXOBVOPOAKBKQ-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+](CCCO)C2)c(Br)c1 ZINC000450609680 513272260 /nfs/dbraw/zinc/27/22/60/513272260.db2.gz FRWBXAABZHDSMI-NSHDSACASA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+](CCCO)C2)c(Br)c1 ZINC000450609680 513272265 /nfs/dbraw/zinc/27/22/65/513272265.db2.gz FRWBXAABZHDSMI-NSHDSACASA-N 1 1 358.236 2.616 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@@H]2CCCN(c3c(C)cccc3[N+](=O)[O-])C2)CC1 ZINC000450777967 513336024 /nfs/dbraw/zinc/33/60/24/513336024.db2.gz SZYQVHOBVVWYLD-SFHVURJKSA-N 1 1 374.485 2.674 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425004012 513363543 /nfs/dbraw/zinc/36/35/43/513363543.db2.gz MXZIUHSMMOCNIB-PKOBYXMFSA-N 1 1 351.406 2.941 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1C ZINC000434765119 513423263 /nfs/dbraw/zinc/42/32/63/513423263.db2.gz PTLGMSZREJLTMN-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000451087481 513509338 /nfs/dbraw/zinc/50/93/38/513509338.db2.gz OBQFDZFSBYAIKJ-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C2CC2)C[C@H](C)C1 ZINC000451087481 513509343 /nfs/dbraw/zinc/50/93/43/513509343.db2.gz OBQFDZFSBYAIKJ-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C2CC2)C[C@H](C)C1 ZINC000451087481 513509349 /nfs/dbraw/zinc/50/93/49/513509349.db2.gz OBQFDZFSBYAIKJ-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000430201044 513587190 /nfs/dbraw/zinc/58/71/90/513587190.db2.gz BWBCISSAYLLLNN-QAPCUYQASA-N 1 1 365.474 2.830 20 5 FFBDMO Cc1c(Br)c(NCC[C@H]2CCC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000413451369 513662517 /nfs/dbraw/zinc/66/25/17/513662517.db2.gz ZQNLDEBFBFYKFG-LLVKDONJSA-N 1 1 357.252 2.626 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000413491319 513681697 /nfs/dbraw/zinc/68/16/97/513681697.db2.gz BBIUMJXWYNIRIW-QWHCGFSZSA-N 1 1 367.421 2.616 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC(OC3CCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000419293446 513765666 /nfs/dbraw/zinc/76/56/66/513765666.db2.gz AHHXIHZONRMDRW-SFHVURJKSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C(C[N@@H+]1CCSC[C@@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000419373814 513791609 /nfs/dbraw/zinc/79/16/09/513791609.db2.gz NPBNSCKTLXJIEO-QGZVFWFLSA-N 1 1 361.467 2.701 20 5 FFBDMO O=C(C[N@H+]1CCSC[C@@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000419373814 513791616 /nfs/dbraw/zinc/79/16/16/513791616.db2.gz NPBNSCKTLXJIEO-QGZVFWFLSA-N 1 1 361.467 2.701 20 5 FFBDMO CS(=O)(=O)CC1(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451545420 513824380 /nfs/dbraw/zinc/82/43/80/513824380.db2.gz HFPWQPXSUWEQJM-OAHLLOKOSA-N 1 1 352.456 2.599 20 5 FFBDMO CS(=O)(=O)CC1(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451545420 513824388 /nfs/dbraw/zinc/82/43/88/513824388.db2.gz HFPWQPXSUWEQJM-OAHLLOKOSA-N 1 1 352.456 2.599 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000426127790 513854621 /nfs/dbraw/zinc/85/46/21/513854621.db2.gz NQBYMQRFNDVLDQ-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000426127790 513854625 /nfs/dbraw/zinc/85/46/25/513854625.db2.gz NQBYMQRFNDVLDQ-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000413959659 513901740 /nfs/dbraw/zinc/90/17/40/513901740.db2.gz SYJAEPZKSDAJFH-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000413959659 513901745 /nfs/dbraw/zinc/90/17/45/513901745.db2.gz SYJAEPZKSDAJFH-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCc2ccccc2CC1 ZINC000451709752 513928536 /nfs/dbraw/zinc/92/85/36/513928536.db2.gz LLVSUCOLKHHRIP-SFHVURJKSA-N 1 1 356.422 2.825 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451732268 513945454 /nfs/dbraw/zinc/94/54/54/513945454.db2.gz SKEVCRYGAPJENY-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451808470 513994115 /nfs/dbraw/zinc/99/41/15/513994115.db2.gz FXUVFJBKVYFGHC-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@@H](C[NH+]4CCOCC4)C3)n2)cc1 ZINC000448969476 513998494 /nfs/dbraw/zinc/99/84/94/513998494.db2.gz VEWAHZHYXCVRDL-AWEZNQCLSA-N 1 1 374.466 2.877 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000420602229 514196699 /nfs/dbraw/zinc/19/66/99/514196699.db2.gz OLQWAHCQYMZJKM-UKRRQHHQSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000452172808 514229755 /nfs/dbraw/zinc/22/97/55/514229755.db2.gz ZELRZILKVWILHX-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000452181766 514237427 /nfs/dbraw/zinc/23/74/27/514237427.db2.gz JPGIVEWQERUMPZ-ZXFNITATSA-N 1 1 363.458 2.906 20 5 FFBDMO COc1ccc(-c2ccc(CN3C[C@@H]4CC[N@@H+](C)[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000449521276 514238764 /nfs/dbraw/zinc/23/87/64/514238764.db2.gz UKVZONLVBYSMLC-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4CCN(C)[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000449521276 514238765 /nfs/dbraw/zinc/23/87/65/514238765.db2.gz UKVZONLVBYSMLC-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H]4CCN(C)[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000449521276 514238767 /nfs/dbraw/zinc/23/87/67/514238767.db2.gz UKVZONLVBYSMLC-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO C[C@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn21 ZINC000449575623 514260324 /nfs/dbraw/zinc/26/03/24/514260324.db2.gz YKFRZCHVHMFVQJ-LRDDRELGSA-N 1 1 352.398 2.987 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000423959581 514309008 /nfs/dbraw/zinc/30/90/08/514309008.db2.gz CLSKKZRLGXDLDJ-CXAGYDPISA-N 1 1 372.450 2.644 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC000444802891 514338573 /nfs/dbraw/zinc/33/85/73/514338573.db2.gz FGAWSLMCSQZBTA-UHFFFAOYSA-N 1 1 350.419 2.847 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000438700865 514428023 /nfs/dbraw/zinc/42/80/23/514428023.db2.gz VHPKCNGBIDRHFX-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000449963539 514443428 /nfs/dbraw/zinc/44/34/28/514443428.db2.gz AOULBHQHLBLTQM-INIZCTEOSA-N 1 1 371.441 2.727 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000449973934 514448893 /nfs/dbraw/zinc/44/88/93/514448893.db2.gz SYSMDXLAEWFQEE-HOCLYGCPSA-N 1 1 361.442 2.889 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000450018038 514466517 /nfs/dbraw/zinc/46/65/17/514466517.db2.gz QMVBILGPAQNNEZ-ZDUSSCGKSA-N 1 1 365.405 2.546 20 5 FFBDMO CCOc1ccc2c(c1)CC[N@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2 ZINC000433449684 514495283 /nfs/dbraw/zinc/49/52/83/514495283.db2.gz IALNQCJJBAJRGO-GOSISDBHSA-N 1 1 372.421 2.792 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000461110000 514517390 /nfs/dbraw/zinc/51/73/90/514517390.db2.gz VFIWZRHLMGOBQN-KRWDZBQOSA-N 1 1 356.382 2.805 20 5 FFBDMO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461412225 514604513 /nfs/dbraw/zinc/60/45/13/514604513.db2.gz ZQTVCCNURSXDHN-OAHLLOKOSA-N 1 1 373.453 2.970 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C(C)C ZINC000453023695 514606085 /nfs/dbraw/zinc/60/60/85/514606085.db2.gz CJHJBNRLDLFVPK-DLBZAZTESA-N 1 1 354.472 2.981 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C(C)C ZINC000453023695 514606092 /nfs/dbraw/zinc/60/60/92/514606092.db2.gz CJHJBNRLDLFVPK-DLBZAZTESA-N 1 1 354.472 2.981 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C(C)C ZINC000453023703 514607364 /nfs/dbraw/zinc/60/73/64/514607364.db2.gz CJHJBNRLDLFVPK-SJORKVTESA-N 1 1 354.472 2.981 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C(C)C ZINC000453023703 514607376 /nfs/dbraw/zinc/60/73/76/514607376.db2.gz CJHJBNRLDLFVPK-SJORKVTESA-N 1 1 354.472 2.981 20 5 FFBDMO COc1cccc(N[C@@H](C)C[NH+]2CCN(c3ccccn3)CC2)c1[N+](=O)[O-] ZINC000475385525 514642949 /nfs/dbraw/zinc/64/29/49/514642949.db2.gz FRNPZVYREPTBKJ-HNNXBMFYSA-N 1 1 371.441 2.621 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000470972876 514700817 /nfs/dbraw/zinc/70/08/17/514700817.db2.gz BBLAXIRDIYIFJR-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000470972876 514700826 /nfs/dbraw/zinc/70/08/26/514700826.db2.gz BBLAXIRDIYIFJR-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000475528929 514704437 /nfs/dbraw/zinc/70/44/37/514704437.db2.gz GWOCZTGBUFTVPT-UHFFFAOYSA-N 1 1 357.458 2.672 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000475572268 514718034 /nfs/dbraw/zinc/71/80/34/514718034.db2.gz PCNKYLWPDFQFEE-UHFFFAOYSA-N 1 1 350.293 2.531 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000475572268 514718040 /nfs/dbraw/zinc/71/80/40/514718040.db2.gz PCNKYLWPDFQFEE-UHFFFAOYSA-N 1 1 350.293 2.531 20 5 FFBDMO Cc1nc(N2CCN(CC[N@H+](C)Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000471044347 514730759 /nfs/dbraw/zinc/73/07/59/514730759.db2.gz LNWPTWNBIHTCDR-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCCC[C@H](SC)C2)cc1[N+](=O)[O-] ZINC000475706539 514770302 /nfs/dbraw/zinc/77/03/02/514770302.db2.gz XOMYWZSVFOGZOD-AWEZNQCLSA-N 1 1 368.455 2.864 20 5 FFBDMO NC(=O)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466998273 514856325 /nfs/dbraw/zinc/85/63/25/514856325.db2.gz MSVFPMUFSXYGIK-HNNXBMFYSA-N 1 1 351.765 2.574 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000498471482 514918122 /nfs/dbraw/zinc/91/81/22/514918122.db2.gz PLBFKZTZBYTUJA-ZDUSSCGKSA-N 1 1 368.865 2.774 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000476474783 515063633 /nfs/dbraw/zinc/06/36/33/515063633.db2.gz ZWGNJUUNZLUDNM-DOTOQJQBSA-N 1 1 355.394 2.779 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000490005919 515066829 /nfs/dbraw/zinc/06/68/29/515066829.db2.gz DCMXNVKRHGLMBW-SFHVURJKSA-N 1 1 357.410 2.913 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000456344626 515112800 /nfs/dbraw/zinc/11/28/00/515112800.db2.gz RRQSDDIRUROHFG-HNNXBMFYSA-N 1 1 369.421 2.895 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000456344626 515112810 /nfs/dbraw/zinc/11/28/10/515112810.db2.gz RRQSDDIRUROHFG-HNNXBMFYSA-N 1 1 369.421 2.895 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000456391590 515150272 /nfs/dbraw/zinc/15/02/72/515150272.db2.gz WQQSJZKGLNCTEK-CYBMUJFWSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000456391590 515150278 /nfs/dbraw/zinc/15/02/78/515150278.db2.gz WQQSJZKGLNCTEK-CYBMUJFWSA-N 1 1 370.247 2.914 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000462907325 515294219 /nfs/dbraw/zinc/29/42/19/515294219.db2.gz FMXNUHPYERFUCM-CQSZACIVSA-N 1 1 368.437 2.813 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519325 515358949 /nfs/dbraw/zinc/35/89/49/515358949.db2.gz LEYZRIFDSVTILG-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519325 515358960 /nfs/dbraw/zinc/35/89/60/515358960.db2.gz LEYZRIFDSVTILG-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000468480487 515379126 /nfs/dbraw/zinc/37/91/26/515379126.db2.gz UPAMTZUADXTMFZ-HNNXBMFYSA-N 1 1 351.472 2.924 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000477459199 515465098 /nfs/dbraw/zinc/46/50/98/515465098.db2.gz YHOSLLIJBBAAMO-MJBXVCDLSA-N 1 1 351.422 2.759 20 5 FFBDMO COc1cccc([C@H]2[C@@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)CC[N@H+]2C2CC2)c1 ZINC000481941352 515521878 /nfs/dbraw/zinc/52/18/78/515521878.db2.gz HPVRDGKCELLSKB-WMZOPIPTSA-N 1 1 370.409 2.639 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000510443605 515543839 /nfs/dbraw/zinc/54/38/39/515543839.db2.gz OQVWYEKAOYPNME-JOYOIKCWSA-N 1 1 370.247 2.878 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC000505498746 515558409 /nfs/dbraw/zinc/55/84/09/515558409.db2.gz NJJICHGJZZOHBC-INIZCTEOSA-N 1 1 354.410 2.526 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000473309635 515573291 /nfs/dbraw/zinc/57/32/91/515573291.db2.gz KPAPRJAERDDSDV-OAHLLOKOSA-N 1 1 371.441 2.693 20 5 FFBDMO CCOc1ccc(OCC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000459499726 515598201 /nfs/dbraw/zinc/59/82/01/515598201.db2.gz XHZOMLWSWDIAPP-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO C[N@H+](Cc1ccccc1)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1 ZINC000482252923 515626886 /nfs/dbraw/zinc/62/68/86/515626886.db2.gz DDROTCYPBHAXBM-IBGZPJMESA-N 1 1 369.421 2.941 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1 ZINC000482252923 515626896 /nfs/dbraw/zinc/62/68/96/515626896.db2.gz DDROTCYPBHAXBM-IBGZPJMESA-N 1 1 369.421 2.941 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC2(C)C)cc1SC ZINC000457074802 515628923 /nfs/dbraw/zinc/62/89/23/515628923.db2.gz LWQZSGDSKRWBBE-UHFFFAOYSA-N 1 1 367.471 2.930 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457081582 515632815 /nfs/dbraw/zinc/63/28/15/515632815.db2.gz DGAPUWDNYQDLQR-CQSZACIVSA-N 1 1 351.422 2.953 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454644270 515635897 /nfs/dbraw/zinc/63/58/97/515635897.db2.gz OHVKKPSVJDNAMI-JKSUJKDBSA-N 1 1 358.442 2.721 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@@H]21 ZINC000493507334 515638782 /nfs/dbraw/zinc/63/87/82/515638782.db2.gz UQEMXWJKXGWXAU-HUBLWGQQSA-N 1 1 367.833 2.568 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000457093691 515642614 /nfs/dbraw/zinc/64/26/14/515642614.db2.gz YVMIWAZFANXKFK-QGZVFWFLSA-N 1 1 374.485 2.752 20 5 FFBDMO COc1cc(C[NH2+]C(C)(C)CN(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000459553772 515642971 /nfs/dbraw/zinc/64/29/71/515642971.db2.gz ZOJXMHWYGWSBFW-UHFFFAOYSA-N 1 1 361.389 2.677 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000457108678 515656289 /nfs/dbraw/zinc/65/62/89/515656289.db2.gz GDQUANXZHDCIDM-GFCCVEGCSA-N 1 1 370.247 2.912 20 5 FFBDMO C[N@@H+](CCCCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1 ZINC000457163736 515698300 /nfs/dbraw/zinc/69/83/00/515698300.db2.gz HVDJRIBEVPOSET-UHFFFAOYSA-N 1 1 372.425 2.512 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](COc3ccccc3)C2)c1 ZINC000505861689 515699827 /nfs/dbraw/zinc/69/98/27/515699827.db2.gz FIXCDQCAKZAZGB-FUHWJXTLSA-N 1 1 372.421 2.735 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 ZINC000482626376 515741317 /nfs/dbraw/zinc/74/13/17/515741317.db2.gz AJQCHKDRIKBRIS-OAHLLOKOSA-N 1 1 374.393 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(OC3CCOCC3)c2)c(F)c1 ZINC000478277515 515763331 /nfs/dbraw/zinc/76/33/31/515763331.db2.gz SEMCPXUCRULLBW-UHFFFAOYSA-N 1 1 361.373 2.977 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COCc1ccccc1F ZINC000511068313 515765169 /nfs/dbraw/zinc/76/51/69/515765169.db2.gz ZKYQESKOXKFHPY-QGZVFWFLSA-N 1 1 362.401 2.786 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000464358969 515795401 /nfs/dbraw/zinc/79/54/01/515795401.db2.gz WSBUGLRVWZSTFW-KRWDZBQOSA-N 1 1 370.453 2.930 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cn[nH]c1 ZINC000494686738 515924037 /nfs/dbraw/zinc/92/40/37/515924037.db2.gz CPEOUJGAGNAMCJ-JTQLQIEISA-N 1 1 372.410 2.731 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](OCC3CC3)C2)c([N+](=O)[O-])c1 ZINC000494707812 515935405 /nfs/dbraw/zinc/93/54/05/515935405.db2.gz KYMHTPVUYCNCEN-MRXNPFEDSA-N 1 1 350.415 2.873 20 5 FFBDMO Cc1ccc(CCC[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000474279161 515968728 /nfs/dbraw/zinc/96/87/28/515968728.db2.gz WCHUQFKKFCIUQO-UHFFFAOYSA-N 1 1 368.437 2.689 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000494810918 515970068 /nfs/dbraw/zinc/97/00/68/515970068.db2.gz UKJDOLNVAGAXSI-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO Cn1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)ccc1[N+](=O)[O-] ZINC000511699884 516005973 /nfs/dbraw/zinc/00/59/73/516005973.db2.gz AWDSQTUOKDOGSL-KRWDZBQOSA-N 1 1 370.453 2.964 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H](C)c2nc(C)cs2)cc1[N+](=O)[O-] ZINC000474355451 516008741 /nfs/dbraw/zinc/00/87/41/516008741.db2.gz XOCNCRYBRHAOTM-LLVKDONJSA-N 1 1 365.411 2.762 20 5 FFBDMO CC(C)[C@@H]1CN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000487960522 516052668 /nfs/dbraw/zinc/05/26/68/516052668.db2.gz FJIHAGQBYKWISX-BBRMVZONSA-N 1 1 359.430 2.978 20 5 FFBDMO CC(C)[C@@H]1CN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000487960523 516053774 /nfs/dbraw/zinc/05/37/74/516053774.db2.gz FJIHAGQBYKWISX-CJNGLKHVSA-N 1 1 359.430 2.978 20 5 FFBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000469996610 516067867 /nfs/dbraw/zinc/06/78/67/516067867.db2.gz PBASSNOBLMKARE-GXTWGEPZSA-N 1 1 362.348 2.997 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCC[C@@H]1C ZINC000488075550 516106994 /nfs/dbraw/zinc/10/69/94/516106994.db2.gz ORWNDZLMNVGGEE-YOEHRIQHSA-N 1 1 361.442 2.621 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)CC2)c1 ZINC000470131411 516134106 /nfs/dbraw/zinc/13/41/06/516134106.db2.gz HTZNJOIIFYZDEX-UHFFFAOYSA-N 1 1 359.361 2.791 20 5 FFBDMO COC(=O)C(C)(C)N1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000470202794 516170959 /nfs/dbraw/zinc/17/09/59/516170959.db2.gz LJBKCAVXYVDUIJ-QINSGFPZSA-N 1 1 361.442 2.567 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000488716164 516292759 /nfs/dbraw/zinc/29/27/59/516292759.db2.gz QYQXYXXDHYYAHS-IIDMSEBBSA-N 1 1 374.485 2.900 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000488748219 516300376 /nfs/dbraw/zinc/30/03/76/516300376.db2.gz KAQGBVBDNNWCTE-HEHGZKQESA-N 1 1 361.442 2.856 20 5 FFBDMO C[NH+]1CCN(CCC(C)(C)Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000547439299 516337839 /nfs/dbraw/zinc/33/78/39/516337839.db2.gz FOKUFSYZZARECB-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)[C@H]2CCNC2=O)cc1[N+](=O)[O-] ZINC000539896409 516341933 /nfs/dbraw/zinc/34/19/33/516341933.db2.gz ZULAYFUEVJMUPU-KRWDZBQOSA-N 1 1 354.410 2.683 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@H]2CCNC2=O)cc1[N+](=O)[O-] ZINC000539896409 516341941 /nfs/dbraw/zinc/34/19/41/516341941.db2.gz ZULAYFUEVJMUPU-KRWDZBQOSA-N 1 1 354.410 2.683 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3ncnc4sc([N+](=O)[O-])cc43)CC2)c1 ZINC000557624268 516342785 /nfs/dbraw/zinc/34/27/85/516342785.db2.gz AIZUCPCVBKCOEX-UHFFFAOYSA-N 1 1 356.411 2.630 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000523202406 516407578 /nfs/dbraw/zinc/40/75/78/516407578.db2.gz NXARONCXWLIVET-OAHLLOKOSA-N 1 1 362.474 2.947 20 5 FFBDMO C[N@H+]1CCN(c2nc3sccn3c2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000557741858 516413289 /nfs/dbraw/zinc/41/32/89/516413289.db2.gz VXDYDXIJIDHLPU-AWEZNQCLSA-N 1 1 357.439 2.667 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)C[C@@H]1Cc1ccccc1 ZINC000557742407 516414308 /nfs/dbraw/zinc/41/43/08/516414308.db2.gz RUWAUWDZLUCYIW-INIZCTEOSA-N 1 1 363.421 2.901 20 5 FFBDMO C[C@H]1COc2ccccc2C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000543875433 516473799 /nfs/dbraw/zinc/47/37/99/516473799.db2.gz BBBMCBVNSIKDQP-YOEHRIQHSA-N 1 1 358.394 2.618 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cn1 ZINC000531627419 516562654 /nfs/dbraw/zinc/56/26/54/516562654.db2.gz IIJMAXDTBALTIW-MRXNPFEDSA-N 1 1 354.410 2.774 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000536034828 516600518 /nfs/dbraw/zinc/60/05/18/516600518.db2.gz HTPQBPMMWSWUKB-GOSISDBHSA-N 1 1 364.405 2.852 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000536034828 516600528 /nfs/dbraw/zinc/60/05/28/516600528.db2.gz HTPQBPMMWSWUKB-GOSISDBHSA-N 1 1 364.405 2.852 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000558145441 516615754 /nfs/dbraw/zinc/61/57/54/516615754.db2.gz AJWKZVBSXMSQCM-QZTJIDSGSA-N 1 1 371.437 2.934 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1 ZINC000540689994 516670081 /nfs/dbraw/zinc/67/00/81/516670081.db2.gz IWTHSLXCPQOMBM-INIZCTEOSA-N 1 1 361.442 2.805 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000544298836 516687671 /nfs/dbraw/zinc/68/76/71/516687671.db2.gz GSDGHAAOEQYZJH-UONOGXRCSA-N 1 1 364.446 2.666 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000513678579 516717908 /nfs/dbraw/zinc/71/79/08/516717908.db2.gz PHXOQKJEOVUQDD-SFHVURJKSA-N 1 1 352.394 2.956 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000513702521 516724979 /nfs/dbraw/zinc/72/49/79/516724979.db2.gz JUSPSWKHEJRVNB-GOSISDBHSA-N 1 1 352.394 2.956 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000548094768 516759145 /nfs/dbraw/zinc/75/91/45/516759145.db2.gz OJWUUYCITFPYDK-PKOBYXMFSA-N 1 1 368.437 2.882 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000518808662 516783148 /nfs/dbraw/zinc/78/31/48/516783148.db2.gz TWQKUYLTRUXYKG-OAHLLOKOSA-N 1 1 363.458 2.990 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1cccc(F)c1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000541019116 516830795 /nfs/dbraw/zinc/83/07/95/516830795.db2.gz GFGWWBVXIFZQNL-AWEZNQCLSA-N 1 1 367.764 2.649 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000544612081 516836496 /nfs/dbraw/zinc/83/64/96/516836496.db2.gz OXYOUQUFKAYBGS-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000551781664 516867321 /nfs/dbraw/zinc/86/73/21/516867321.db2.gz IIKPTUFBXVINIY-LJQANCHMSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000551781664 516867324 /nfs/dbraw/zinc/86/73/24/516867324.db2.gz IIKPTUFBXVINIY-LJQANCHMSA-N 1 1 353.422 2.902 20 5 FFBDMO CCOc1ccc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000519550536 517040496 /nfs/dbraw/zinc/04/04/96/517040496.db2.gz KOJDVCVEBSQITB-UHFFFAOYSA-N 1 1 361.442 2.942 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H](c1ccco1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000552038052 517044977 /nfs/dbraw/zinc/04/49/77/517044977.db2.gz JKLJJGDKAVDASW-WMZOPIPTSA-N 1 1 369.425 2.903 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000545174169 517085036 /nfs/dbraw/zinc/08/50/36/517085036.db2.gz OTDJRGYLQYQNPV-ZDUSSCGKSA-N 1 1 367.833 2.784 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000541820584 517233045 /nfs/dbraw/zinc/23/30/45/517233045.db2.gz FWCXNYQXPYIPLK-AWEZNQCLSA-N 1 1 369.487 2.754 20 5 FFBDMO CCNc1ccc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000520316440 517343587 /nfs/dbraw/zinc/34/35/87/517343587.db2.gz NHNPGVKYCNQCMS-UHFFFAOYSA-N 1 1 352.354 2.860 20 5 FFBDMO COc1ccc(CN2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556507486 517467052 /nfs/dbraw/zinc/46/70/52/517467052.db2.gz CBPCVXVVDWDYKI-GOSISDBHSA-N 1 1 355.438 2.962 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000521036525 517587940 /nfs/dbraw/zinc/58/79/40/517587940.db2.gz MENACUXILHPFNY-ZDUSSCGKSA-N 1 1 351.451 2.655 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000556763386 517640596 /nfs/dbraw/zinc/64/05/96/517640596.db2.gz HXPBRZYNTOOMHP-CYBMUJFWSA-N 1 1 374.363 2.849 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000521408255 517718358 /nfs/dbraw/zinc/71/83/58/517718358.db2.gz AZUNICVBHTWANF-GJZGRUSLSA-N 1 1 374.485 2.901 20 5 FFBDMO CCCCO[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C ZINC000534178485 517773449 /nfs/dbraw/zinc/77/34/49/517773449.db2.gz VBGXZRHKKNXPOD-HZPDHXFCSA-N 1 1 351.447 2.672 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000542889143 517801207 /nfs/dbraw/zinc/80/12/07/517801207.db2.gz OPHFZPWGFABZEV-WDEREUQCSA-N 1 1 357.357 2.751 20 5 FFBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553600854 517803591 /nfs/dbraw/zinc/80/35/91/517803591.db2.gz BOUNBMUVNLASBH-YPMHNXCESA-N 1 1 359.348 2.913 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1 ZINC000521881383 517885575 /nfs/dbraw/zinc/88/55/75/517885575.db2.gz CDUHCJWJTUSYIB-UHFFFAOYSA-N 1 1 363.414 2.516 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000534530799 517931098 /nfs/dbraw/zinc/93/10/98/517931098.db2.gz OAJFHFVDGZJHII-OAHLLOKOSA-N 1 1 356.382 2.765 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000534530799 517931110 /nfs/dbraw/zinc/93/11/10/517931110.db2.gz OAJFHFVDGZJHII-OAHLLOKOSA-N 1 1 356.382 2.765 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000516956454 517940807 /nfs/dbraw/zinc/94/08/07/517940807.db2.gz IBLDRXYKNNPJFR-OAHLLOKOSA-N 1 1 357.410 2.806 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000522064516 517974615 /nfs/dbraw/zinc/97/46/15/517974615.db2.gz KTWAFNJHRBYGEX-CYBMUJFWSA-N 1 1 365.478 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCN([C@@H]3CC[N@@H+](Cc4ccccc4)C3)C2)nc1 ZINC000560729800 517991660 /nfs/dbraw/zinc/99/16/60/517991660.db2.gz OTBMXCOGLQDGPD-PKOBYXMFSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]([C@@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729800 517991673 /nfs/dbraw/zinc/99/16/73/517991673.db2.gz OTBMXCOGLQDGPD-PKOBYXMFSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729800 517991678 /nfs/dbraw/zinc/99/16/78/517991678.db2.gz OTBMXCOGLQDGPD-PKOBYXMFSA-N 1 1 367.453 2.751 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000517411317 518142908 /nfs/dbraw/zinc/14/29/08/518142908.db2.gz ZXCLYMFWDQWRAX-GASCZTMLSA-N 1 1 363.462 2.569 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000566884676 518246734 /nfs/dbraw/zinc/24/67/34/518246734.db2.gz QNOLNTSZRCZQRF-IRXDYDNUSA-N 1 1 350.415 2.872 20 5 FFBDMO CC(C)[C@H](CNc1nc2c(cc1[N+](=O)[O-])CCCC2)N1CC[NH+](C)CC1 ZINC000569922221 518357022 /nfs/dbraw/zinc/35/70/22/518357022.db2.gz CEWXOFDMGOQJRY-SFHVURJKSA-N 1 1 361.490 2.553 20 5 FFBDMO CC(C)(C)[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000584850577 518508397 /nfs/dbraw/zinc/50/83/97/518508397.db2.gz HOXRPZIKJVGBEN-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000564607404 518523823 /nfs/dbraw/zinc/52/38/23/518523823.db2.gz LLXDGBDWBDVREU-WBVHZDCISA-N 1 1 360.385 2.963 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000567541548 518575192 /nfs/dbraw/zinc/57/51/92/518575192.db2.gz FDDPGRFOINMXNQ-RDJZCZTQSA-N 1 1 360.385 2.963 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000573478606 518685779 /nfs/dbraw/zinc/68/57/79/518685779.db2.gz QLRIWIUUCXZEPR-QZTJIDSGSA-N 1 1 371.441 2.545 20 5 FFBDMO O=[N+]([O-])c1ccccc1CN(CCC[NH+]1CCOCC1)Cc1ccncc1 ZINC000570653728 518713667 /nfs/dbraw/zinc/71/36/67/518713667.db2.gz YKCKDBXWFVZAKF-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000570706290 518740640 /nfs/dbraw/zinc/74/06/40/518740640.db2.gz FUWQBTZIUCGWGE-GASCZTMLSA-N 1 1 350.438 2.729 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000573633610 518760017 /nfs/dbraw/zinc/76/00/17/518760017.db2.gz MFEREMLEOWIZLC-NSHDSACASA-N 1 1 374.363 2.755 20 5 FFBDMO Cc1cc(OCC(=O)N2CCC[N@H+](C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000570859808 518813560 /nfs/dbraw/zinc/81/35/60/518813560.db2.gz WLOSVJYSJRNESY-UHFFFAOYSA-N 1 1 361.442 2.759 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC000570981934 518870079 /nfs/dbraw/zinc/87/00/79/518870079.db2.gz CJYVQEKMYOWWOR-QMMMGPOBSA-N 1 1 350.762 2.727 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC000570981934 518870081 /nfs/dbraw/zinc/87/00/81/518870081.db2.gz CJYVQEKMYOWWOR-QMMMGPOBSA-N 1 1 350.762 2.727 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c1 ZINC000589505942 519020207 /nfs/dbraw/zinc/02/02/07/519020207.db2.gz RXBUTUCJHSEMOL-CXAGYDPISA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c1 ZINC000589505942 519020213 /nfs/dbraw/zinc/02/02/13/519020213.db2.gz RXBUTUCJHSEMOL-CXAGYDPISA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000589509550 519021176 /nfs/dbraw/zinc/02/11/76/519021176.db2.gz YGVNQMXWQBBIGB-HOCLYGCPSA-N 1 1 350.415 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)c1 ZINC000589509550 519021180 /nfs/dbraw/zinc/02/11/80/519021180.db2.gz YGVNQMXWQBBIGB-HOCLYGCPSA-N 1 1 350.415 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCn1cc(Br)cn1 ZINC000565625402 519047993 /nfs/dbraw/zinc/04/79/93/519047993.db2.gz HTEIOCMLEBBZON-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000577393787 519059372 /nfs/dbraw/zinc/05/93/72/519059372.db2.gz YXRDAJFAJPKORF-MJGOQNOKSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000577393787 519059377 /nfs/dbraw/zinc/05/93/77/519059377.db2.gz YXRDAJFAJPKORF-MJGOQNOKSA-N 1 1 360.385 2.905 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@@H+]1CCO)c1cc2ccccc2c2cccnc12 ZINC000583066163 519059617 /nfs/dbraw/zinc/05/96/17/519059617.db2.gz QJIPMBOYDOYRFK-QGZVFWFLSA-N 1 1 363.461 2.965 20 5 FFBDMO CC1(C)CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC[N@H+]1CCO ZINC000590175408 519169393 /nfs/dbraw/zinc/16/93/93/519169393.db2.gz OISWMUNUHWPECQ-UHFFFAOYSA-N 1 1 361.364 2.502 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862262 519255331 /nfs/dbraw/zinc/25/53/31/519255331.db2.gz JASLCQHYTUTCAX-MAUKXSAKSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862262 519255332 /nfs/dbraw/zinc/25/53/32/519255332.db2.gz JASLCQHYTUTCAX-MAUKXSAKSA-N 1 1 352.394 2.585 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000590582899 519274618 /nfs/dbraw/zinc/27/46/18/519274618.db2.gz WDWXPXBNLYVCQQ-MFKMUULPSA-N 1 1 353.806 2.565 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1 ZINC000580634850 519275689 /nfs/dbraw/zinc/27/56/89/519275689.db2.gz MQZUJGYGWGHPMJ-QGZVFWFLSA-N 1 1 369.421 2.745 20 5 FFBDMO O=C(CCNC1CC[NH+](C2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000566112738 519308757 /nfs/dbraw/zinc/30/87/57/519308757.db2.gz RQPTZVZLRZTDJU-UHFFFAOYSA-N 1 1 360.458 2.920 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H]1CN(c3ccccc3)CCO1)CC2 ZINC000574819727 519350106 /nfs/dbraw/zinc/35/01/06/519350106.db2.gz JDTCCJYBPWNYCK-FQEVSTJZSA-N 1 1 353.422 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1CN(c3ccccc3)CCO1)CC2 ZINC000574819727 519350112 /nfs/dbraw/zinc/35/01/12/519350112.db2.gz JDTCCJYBPWNYCK-FQEVSTJZSA-N 1 1 353.422 2.858 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000569129805 519393028 /nfs/dbraw/zinc/39/30/28/519393028.db2.gz UONSPPOJOKMIPA-ZDUSSCGKSA-N 1 1 362.817 2.674 20 5 FFBDMO CC(C)(C)OC(=O)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1 ZINC000569129320 519393741 /nfs/dbraw/zinc/39/37/41/519393741.db2.gz NXXZPIXVNQZAMZ-UHFFFAOYSA-N 1 1 364.442 2.960 20 5 FFBDMO CC(C)(C)OC(=O)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1 ZINC000569129320 519393749 /nfs/dbraw/zinc/39/37/49/519393749.db2.gz NXXZPIXVNQZAMZ-UHFFFAOYSA-N 1 1 364.442 2.960 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1 ZINC000583722171 519398039 /nfs/dbraw/zinc/39/80/39/519398039.db2.gz KUVKKBOEOORSRA-WMZOPIPTSA-N 1 1 359.426 2.957 20 5 FFBDMO O=C(CCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccc(F)cc1 ZINC000580993063 519464601 /nfs/dbraw/zinc/46/46/01/519464601.db2.gz WLGZFYXMVGPCAX-UHFFFAOYSA-N 1 1 372.400 2.914 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000583929657 519504006 /nfs/dbraw/zinc/50/40/06/519504006.db2.gz VJQYFQIQPFGRBT-GFCCVEGCSA-N 1 1 354.765 2.917 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000578378713 519561671 /nfs/dbraw/zinc/56/16/71/519561671.db2.gz NATDIKHUYVSEBY-CQSZACIVSA-N 1 1 366.437 2.857 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C(=O)OC(C)(C)C)CC[C@H]1C ZINC000602848467 519924334 /nfs/dbraw/zinc/92/43/34/519924334.db2.gz VNCCRDVNUCOIGI-TZMCWYRMSA-N 1 1 352.435 2.542 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000602916185 519970520 /nfs/dbraw/zinc/97/05/20/519970520.db2.gz KUMCBIHYKKQERD-IBGZPJMESA-N 1 1 370.409 2.600 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000602916185 519970526 /nfs/dbraw/zinc/97/05/26/519970526.db2.gz KUMCBIHYKKQERD-IBGZPJMESA-N 1 1 370.409 2.600 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c(C)cc1[N+](=O)[O-] ZINC000594483698 519993404 /nfs/dbraw/zinc/99/34/04/519993404.db2.gz NZNCHLLGFQMLII-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(COc1cc[nH+]c2c1CCCC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000594493747 520002470 /nfs/dbraw/zinc/00/24/70/520002470.db2.gz RFLZKRIVFBJOJB-UHFFFAOYSA-N 1 1 353.378 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCN4CCOC[C@@H]4C3)s2)cc1 ZINC000612589959 520037520 /nfs/dbraw/zinc/03/75/20/520037520.db2.gz DZWLSZKZLMZXFD-INIZCTEOSA-N 1 1 359.451 2.840 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1[N+](=O)[O-] ZINC000600190178 520109956 /nfs/dbraw/zinc/10/99/56/520109956.db2.gz MNYWWKPKPHJFFA-KGLIPLIRSA-N 1 1 366.439 2.617 20 5 FFBDMO COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000600194021 520115138 /nfs/dbraw/zinc/11/51/38/520115138.db2.gz ZWCHVHWDFNPVEP-SFHVURJKSA-N 1 1 360.366 2.619 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)nc1 ZINC000612778458 520140335 /nfs/dbraw/zinc/14/03/35/520140335.db2.gz WOTDHCMELMULGP-UHFFFAOYSA-N 1 1 367.331 2.726 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccnc(N2CC[NH+](C)CC2)c1 ZINC000597666420 520166339 /nfs/dbraw/zinc/16/63/39/520166339.db2.gz HVBFPVIHUYZQRE-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO COc1ccc(CC(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000609016451 520179032 /nfs/dbraw/zinc/17/90/32/520179032.db2.gz BXNNIDQAWJQFGV-UHFFFAOYSA-N 1 1 363.458 2.725 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000600300121 520188944 /nfs/dbraw/zinc/18/89/44/520188944.db2.gz XZIFCIIVTXPTGX-KRWDZBQOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000600300121 520188951 /nfs/dbraw/zinc/18/89/51/520188951.db2.gz XZIFCIIVTXPTGX-KRWDZBQOSA-N 1 1 355.394 2.608 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)n[nH]1)C2 ZINC000597710868 520190609 /nfs/dbraw/zinc/19/06/09/520190609.db2.gz PPFGAEXPYMVJFH-IBGZPJMESA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)C2 ZINC000597710868 520190622 /nfs/dbraw/zinc/19/06/22/520190622.db2.gz PPFGAEXPYMVJFH-IBGZPJMESA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)C2 ZINC000597710868 520190630 /nfs/dbraw/zinc/19/06/30/520190630.db2.gz PPFGAEXPYMVJFH-IBGZPJMESA-N 1 1 369.425 2.543 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000592153439 520228581 /nfs/dbraw/zinc/22/85/81/520228581.db2.gz ARNIILOSPHYCJQ-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO COc1cc(OCc2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)ccc1[N+](=O)[O-] ZINC000612955306 520237228 /nfs/dbraw/zinc/23/72/28/520237228.db2.gz XHRKDDBEQDEPGW-YHWZYXNKSA-N 1 1 374.397 2.906 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000609233546 520240722 /nfs/dbraw/zinc/24/07/22/520240722.db2.gz GJBNUVJJLIMQHN-AZUAARDMSA-N 1 1 372.421 2.798 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000592183632 520249155 /nfs/dbraw/zinc/24/91/55/520249155.db2.gz FHVFLXWGEWTYJU-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000592183632 520249164 /nfs/dbraw/zinc/24/91/64/520249164.db2.gz FHVFLXWGEWTYJU-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1[C@@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CCOCC2 ZINC000592183922 520250122 /nfs/dbraw/zinc/25/01/22/520250122.db2.gz LFJILTUSDNKZTN-WMLDXEAASA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000603403876 520250335 /nfs/dbraw/zinc/25/03/35/520250335.db2.gz WIXMIBBWCAJVCI-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C(C)C)N1CCN(C)CC1 ZINC000595007480 520254765 /nfs/dbraw/zinc/25/47/65/520254765.db2.gz OEVJQLGTRDBTIL-MAUKXSAKSA-N 1 1 364.490 2.526 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(=O)NCCc1ccccc1 ZINC000595022365 520259853 /nfs/dbraw/zinc/25/98/53/520259853.db2.gz ISEYYYUODAQZQL-CQSZACIVSA-N 1 1 357.410 2.613 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595049796 520270663 /nfs/dbraw/zinc/27/06/63/520270663.db2.gz OTESUQYCRXTNJU-DLBZAZTESA-N 1 1 357.458 2.880 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595056500 520271509 /nfs/dbraw/zinc/27/15/09/520271509.db2.gz KAFKUOFDGUBJCL-DOTOQJQBSA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000597859709 520285474 /nfs/dbraw/zinc/28/54/74/520285474.db2.gz GBXSDZXXEPADTL-LLVKDONJSA-N 1 1 355.385 2.652 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000597859710 520287466 /nfs/dbraw/zinc/28/74/66/520287466.db2.gz GBXSDZXXEPADTL-NSHDSACASA-N 1 1 355.385 2.652 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000609476678 520323823 /nfs/dbraw/zinc/32/38/23/520323823.db2.gz YIALTOAPMGUINC-OKILXGFUSA-N 1 1 365.478 2.758 20 5 FFBDMO CCc1nc(C[NH+]2CCC(CNc3ccncc3[N+](=O)[O-])CC2)cs1 ZINC000609517035 520340087 /nfs/dbraw/zinc/34/00/87/520340087.db2.gz GQJQGUZWYPWZNW-UHFFFAOYSA-N 1 1 361.471 2.755 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H]1CC[N@@H+](C)C1 ZINC000597945000 520343945 /nfs/dbraw/zinc/34/39/45/520343945.db2.gz GETLWDZNSRNFKO-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)CC1 ZINC000603857018 520380525 /nfs/dbraw/zinc/38/05/25/520380525.db2.gz LUXIAVDEYDFLAN-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604105760 520451515 /nfs/dbraw/zinc/45/15/15/520451515.db2.gz XQARYGNLMCUFGU-KGLIPLIRSA-N 1 1 364.446 2.523 20 5 FFBDMO COc1cccc([C@@H]2[C@@H]([NH2+]Cc3onc(C)c3[N+](=O)[O-])CCN2C2CC2)c1 ZINC000595475922 520494400 /nfs/dbraw/zinc/49/44/00/520494400.db2.gz KHWVSAUAHBYGFZ-QFBILLFUSA-N 1 1 372.425 2.967 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218501 520501051 /nfs/dbraw/zinc/50/10/51/520501051.db2.gz GOHNYZQYOOFCLE-GFCCVEGCSA-N 1 1 367.396 2.939 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000604437762 520563235 /nfs/dbraw/zinc/56/32/35/520563235.db2.gz RDYRDTDQBLKMNI-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000610239004 520594768 /nfs/dbraw/zinc/59/47/68/520594768.db2.gz MJEFTIGSYLDBLP-UHFFFAOYSA-N 1 1 350.378 2.948 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000598466398 520629438 /nfs/dbraw/zinc/62/94/38/520629438.db2.gz SLWMZSYWYPDSIN-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000592879705 520629847 /nfs/dbraw/zinc/62/98/47/520629847.db2.gz BUMVQZRQSRNAHO-MJGOQNOKSA-N 1 1 353.422 2.599 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCCc1cn2c([nH+]1)CCCC2 ZINC000601102657 520635881 /nfs/dbraw/zinc/63/58/81/520635881.db2.gz CEFDKIZJAJZVMN-UHFFFAOYSA-N 1 1 358.324 2.535 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CCO ZINC000595694710 520656399 /nfs/dbraw/zinc/65/63/99/520656399.db2.gz FHZLSRMHFJOYHQ-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CCO ZINC000595694710 520656404 /nfs/dbraw/zinc/65/64/04/520656404.db2.gz FHZLSRMHFJOYHQ-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507406 520665348 /nfs/dbraw/zinc/66/53/48/520665348.db2.gz ANQKLZMYKWDNSH-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507406 520665354 /nfs/dbraw/zinc/66/53/54/520665354.db2.gz ANQKLZMYKWDNSH-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)c1 ZINC000598507946 520667486 /nfs/dbraw/zinc/66/74/86/520667486.db2.gz FBXFOZWYVMATNF-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)c1 ZINC000598507946 520667491 /nfs/dbraw/zinc/66/74/91/520667491.db2.gz FBXFOZWYVMATNF-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO Cn1ccnc1[C@H]1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601172932 520672016 /nfs/dbraw/zinc/67/20/16/520672016.db2.gz LRKWYSDGWYVSST-SJKOYZFVSA-N 1 1 353.382 2.631 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]2N1 ZINC000595729204 520675732 /nfs/dbraw/zinc/67/57/32/520675732.db2.gz RCSNZQODRRLEAR-YGRLFVJLSA-N 1 1 357.332 2.714 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]2N1 ZINC000595729204 520675734 /nfs/dbraw/zinc/67/57/34/520675734.db2.gz RCSNZQODRRLEAR-YGRLFVJLSA-N 1 1 357.332 2.714 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598560436 520705826 /nfs/dbraw/zinc/70/58/26/520705826.db2.gz LXOWJZIJAKBZOT-HNNXBMFYSA-N 1 1 363.483 2.925 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000598560487 520705873 /nfs/dbraw/zinc/70/58/73/520705873.db2.gz MVOZLOQPKDDKIZ-CQSZACIVSA-N 1 1 356.426 2.928 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC([C@@H]3CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595785202 520722267 /nfs/dbraw/zinc/72/22/67/520722267.db2.gz WWRXAKFVMXVSEU-OALUTQOASA-N 1 1 373.453 2.981 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595786255 520723919 /nfs/dbraw/zinc/72/39/19/520723919.db2.gz HDASYRNGCNDLSF-KFKAGJAMSA-N 1 1 373.453 2.981 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000610523061 520727492 /nfs/dbraw/zinc/72/74/92/520727492.db2.gz DQGVXZYSYMSKJP-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO CCOc1cc(CN2CC[N@@H+](CCOC)CC2(C)C)ccc1[N+](=O)[O-] ZINC000593100827 520745898 /nfs/dbraw/zinc/74/58/98/520745898.db2.gz JXQLEXDOEUGSER-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000595825260 520748838 /nfs/dbraw/zinc/74/88/38/520748838.db2.gz DQABTBKBHFWYEO-INIZCTEOSA-N 1 1 354.410 2.744 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000595825260 520748843 /nfs/dbraw/zinc/74/88/43/520748843.db2.gz DQABTBKBHFWYEO-INIZCTEOSA-N 1 1 354.410 2.744 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595830351 520754169 /nfs/dbraw/zinc/75/41/69/520754169.db2.gz KRIVLCZAEMKGJG-CMPLNLGQSA-N 1 1 358.341 2.673 20 5 FFBDMO O=C(C[N@@H+](CCC1CC1)CC1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000595872292 520781212 /nfs/dbraw/zinc/78/12/12/520781212.db2.gz UQMULEVUSGHZLY-UHFFFAOYSA-N 1 1 361.398 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595910632 520814566 /nfs/dbraw/zinc/81/45/66/520814566.db2.gz WKANZBPEORTUCG-RYZJOYRSSA-N 1 1 354.406 2.956 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000601540286 520833153 /nfs/dbraw/zinc/83/31/53/520833153.db2.gz GYBKZUZGQYBSKD-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO CN(C(=O)C[NH2+]C(C)(C)C(=O)Nc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610844419 520866698 /nfs/dbraw/zinc/86/66/98/520866698.db2.gz QFTCVVSBAFPSQM-UHFFFAOYSA-N 1 1 370.409 2.565 20 5 FFBDMO CC[NH+](CC)CCN(CC(C)C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000610920299 520905833 /nfs/dbraw/zinc/90/58/33/520905833.db2.gz QIVWPLVKQLPDHC-UHFFFAOYSA-N 1 1 353.467 2.881 20 5 FFBDMO CC1CCC(O)(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000596094006 520907813 /nfs/dbraw/zinc/90/78/13/520907813.db2.gz GDQJKZBUEULSHS-LTCLLZNKSA-N 1 1 358.442 2.949 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000593340034 520921129 /nfs/dbraw/zinc/92/11/29/520921129.db2.gz SBZSPBHCQDOQET-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000593340034 520921135 /nfs/dbraw/zinc/92/11/35/520921135.db2.gz SBZSPBHCQDOQET-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO CC1([NH+]2CCCC2)CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000601739039 520927490 /nfs/dbraw/zinc/92/74/90/520927490.db2.gz KPUAXHPSTOOBMN-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO NC(=O)c1cc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000596129516 520930424 /nfs/dbraw/zinc/93/04/24/520930424.db2.gz QRWALBJLUAMQPK-INIZCTEOSA-N 1 1 354.410 2.770 20 5 FFBDMO Cc1cc(N[C@H](C)C[NH+]2CCN(c3ccccn3)CC2)c([N+](=O)[O-])s1 ZINC000596131213 520930532 /nfs/dbraw/zinc/93/05/32/520930532.db2.gz KDXYPHBOVHZIGT-CYBMUJFWSA-N 1 1 361.471 2.982 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)NCCC[N@H+](C)C(C)C)c1 ZINC000593401927 520966538 /nfs/dbraw/zinc/96/65/38/520966538.db2.gz CUVWVZWLPULJMW-UHFFFAOYSA-N 1 1 373.457 2.608 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000611073031 520971135 /nfs/dbraw/zinc/97/11/35/520971135.db2.gz QPHPRSPAYSVQSS-JTQLQIEISA-N 1 1 370.247 2.737 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593418500 520982433 /nfs/dbraw/zinc/98/24/33/520982433.db2.gz ICGUZENGXWPFEC-CYBMUJFWSA-N 1 1 351.422 2.903 20 5 FFBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596231491 520984923 /nfs/dbraw/zinc/98/49/23/520984923.db2.gz JVQKNRLEXYFJHQ-AAEUAGOBSA-N 1 1 359.348 2.913 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599056024 521002937 /nfs/dbraw/zinc/00/29/37/521002937.db2.gz HSFFPAZANCWAKE-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000614533759 521015238 /nfs/dbraw/zinc/01/52/38/521015238.db2.gz YBVUCQORRODMRE-FQEVSTJZSA-N 1 1 371.437 2.677 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599083380 521023486 /nfs/dbraw/zinc/02/34/86/521023486.db2.gz KPQNIPAFZOFGPK-WDEREUQCSA-N 1 1 368.231 2.714 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000614585172 521035361 /nfs/dbraw/zinc/03/53/61/521035361.db2.gz RHUSZTSJVXQFRW-FQEVSTJZSA-N 1 1 367.405 2.960 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599194025 521080395 /nfs/dbraw/zinc/08/03/95/521080395.db2.gz NTIOBGGRYNXKGK-LLVKDONJSA-N 1 1 370.247 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N[C@@H]3C[C@@H]([NH+]4CCOCC4)C34CCC4)c2c1 ZINC000596514719 521108763 /nfs/dbraw/zinc/10/87/63/521108763.db2.gz AHTTZVAWQPKDON-IAGOWNOFSA-N 1 1 369.425 2.593 20 5 FFBDMO O=[N+]([O-])c1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1C(F)(F)F ZINC000596540889 521123829 /nfs/dbraw/zinc/12/38/29/521123829.db2.gz VRKPXECZEZCTFL-ZDUSSCGKSA-N 1 1 359.348 2.649 20 5 FFBDMO CCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000596543135 521124095 /nfs/dbraw/zinc/12/40/95/521124095.db2.gz KOSAVRMSLLWQNT-OAHLLOKOSA-N 1 1 368.865 2.916 20 5 FFBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])c1 ZINC000611560284 521218901 /nfs/dbraw/zinc/21/89/01/521218901.db2.gz MSRSJFVBNGMFAH-INIZCTEOSA-N 1 1 360.414 2.954 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1CCn1ccc([N+](=O)[O-])n1 ZINC000599536763 521282562 /nfs/dbraw/zinc/28/25/62/521282562.db2.gz RGNBAXGTUIFHGF-GOSISDBHSA-N 1 1 357.458 2.634 20 5 FFBDMO CC(C)[C@H]1CN(Cc2ccccc2)CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000599536763 521282567 /nfs/dbraw/zinc/28/25/67/521282567.db2.gz RGNBAXGTUIFHGF-GOSISDBHSA-N 1 1 357.458 2.634 20 5 FFBDMO CC(C)[C@H]1CN(Cc2ccccc2)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000599536763 521282570 /nfs/dbraw/zinc/28/25/70/521282570.db2.gz RGNBAXGTUIFHGF-GOSISDBHSA-N 1 1 357.458 2.634 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000596843286 521326301 /nfs/dbraw/zinc/32/63/01/521326301.db2.gz JDWUKJVGLOCXHY-MRXNPFEDSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987347 521331871 /nfs/dbraw/zinc/33/18/71/521331871.db2.gz NOTFAJDNIONUEG-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987347 521331879 /nfs/dbraw/zinc/33/18/79/521331879.db2.gz NOTFAJDNIONUEG-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027143 521359389 /nfs/dbraw/zinc/35/93/89/521359389.db2.gz RGWSCGGGNJNGMA-ROUUACIJSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](OC3CCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000594027143 521359398 /nfs/dbraw/zinc/35/93/98/521359398.db2.gz RGWSCGGGNJNGMA-ROUUACIJSA-N 1 1 359.426 2.734 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CCN[C@@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000611938548 521401669 /nfs/dbraw/zinc/40/16/69/521401669.db2.gz NYWNEHWIUYAYRN-IBGZPJMESA-N 1 1 370.453 2.573 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@H+]1C ZINC000607688855 521428404 /nfs/dbraw/zinc/42/84/04/521428404.db2.gz YRGSADQOVQSAEQ-CVEARBPZSA-N 1 1 363.461 2.754 20 5 FFBDMO C[C@@H]1OCC[C@@]12C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000619175819 521433988 /nfs/dbraw/zinc/43/39/88/521433988.db2.gz QAJGADKAROAKEV-RVKKMQEKSA-N 1 1 350.415 2.632 20 5 FFBDMO CNC(=O)NC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602693523 521481485 /nfs/dbraw/zinc/48/14/85/521481485.db2.gz MVSSZWJYUIWSPC-UHFFFAOYSA-N 1 1 360.336 2.507 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](Cn4ccnn4)C3)o2)c1 ZINC000597173759 521556830 /nfs/dbraw/zinc/55/68/30/521556830.db2.gz IPGBFOTUEVUHNF-CQSZACIVSA-N 1 1 353.382 2.968 20 5 FFBDMO Cc1cc(N[C@H](C)[C@H]2C[N@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062103 521613616 /nfs/dbraw/zinc/61/36/16/521613616.db2.gz CIILWMXJJHPWRE-QMTHXVAHSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062103 521613621 /nfs/dbraw/zinc/61/36/21/521613621.db2.gz CIILWMXJJHPWRE-QMTHXVAHSA-N 1 1 358.236 2.797 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(-n2cncn2)c(F)c1 ZINC000619846248 521901902 /nfs/dbraw/zinc/90/19/02/521901902.db2.gz ZBYRZYFVQIACBV-UHFFFAOYSA-N 1 1 355.373 2.989 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(-c2nn[nH]n2)c(F)c1 ZINC000826212309 609142000 /nfs/dbraw/zinc/14/20/00/609142000.db2.gz MNZVUSMJNBONIA-JTQLQIEISA-N 1 1 372.360 2.773 20 5 FFBDMO Nc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ccc1[N+](=O)[O-] ZINC001164629209 719084591 /nfs/dbraw/zinc/08/45/91/719084591.db2.gz WLEJDJJQVINJGR-WBVHZDCISA-N 1 1 353.426 2.673 20 5 FFBDMO Nc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ccc1[N+](=O)[O-] ZINC001164629206 719084800 /nfs/dbraw/zinc/08/48/00/719084800.db2.gz WLEJDJJQVINJGR-NVXWUHKLSA-N 1 1 353.426 2.673 20 5 FFBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc([N+](=O)[O-])c(C)c1C)C2 ZINC001164811786 720126430 /nfs/dbraw/zinc/12/64/30/720126430.db2.gz NJYZLIAPHYSQRG-PXNSSMCTSA-N 1 1 374.485 2.791 20 5 FFBDMO Cc1nc(Cl)nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164725141 720332921 /nfs/dbraw/zinc/33/29/21/720332921.db2.gz LVLHYICCHOSDSM-ZIAGYGMSSA-N 1 1 374.832 2.595 20 5 FFBDMO COc1nc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)ccc1[N+](=O)[O-] ZINC001164858629 720937726 /nfs/dbraw/zinc/93/77/26/720937726.db2.gz JPQGCMIFOJNGNL-CYBMUJFWSA-N 1 1 374.445 2.616 20 5 FFBDMO CCS[C@H]1CC[C@@H]([N@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398304 735295697 /nfs/dbraw/zinc/29/56/97/735295697.db2.gz GJKNFXYTMSVZQY-YPMHNXCESA-N 1 1 363.439 2.754 20 5 FFBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398304 735295698 /nfs/dbraw/zinc/29/56/98/735295698.db2.gz GJKNFXYTMSVZQY-YPMHNXCESA-N 1 1 363.439 2.754 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000897987244 735300469 /nfs/dbraw/zinc/30/04/69/735300469.db2.gz OXYYIQCUCJZPSN-GFCCVEGCSA-N 1 1 364.789 2.856 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000130583371 728719799 /nfs/dbraw/zinc/71/97/99/728719799.db2.gz OTIJUJANFIETTB-CYBMUJFWSA-N 1 1 350.419 2.556 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000177345807 729134316 /nfs/dbraw/zinc/13/43/16/729134316.db2.gz HOJSSMOLVGDGOX-KGLIPLIRSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000194570888 729513759 /nfs/dbraw/zinc/51/37/59/729513759.db2.gz TWZNDYJOLZGYOG-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000194570888 729513765 /nfs/dbraw/zinc/51/37/65/729513765.db2.gz TWZNDYJOLZGYOG-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000194570888 729513770 /nfs/dbraw/zinc/51/37/70/729513770.db2.gz TWZNDYJOLZGYOG-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ncc([N+](=O)[O-])s3)C2)ccn1 ZINC000856533194 730345303 /nfs/dbraw/zinc/34/53/03/730345303.db2.gz APZAORRAZKCUSO-AWEZNQCLSA-N 1 1 363.443 2.556 20 5 FFBDMO CCOCC[NH+]1CCN(c2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856729436 730351029 /nfs/dbraw/zinc/35/10/29/730351029.db2.gz VCXSGZILZSUHGE-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000861343845 730601445 /nfs/dbraw/zinc/60/14/45/730601445.db2.gz LODGZZVCIABZGK-BZNIZROVSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)CCN1CCN(C)CC1 ZINC000872063840 731725522 /nfs/dbraw/zinc/72/55/22/731725522.db2.gz UEEQQZBHFAFHBF-GJZGRUSLSA-N 1 1 366.531 2.993 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@@H]2CCC[N@H+]3C)ncc1[N+](=O)[O-] ZINC000872778395 731830301 /nfs/dbraw/zinc/83/03/01/731830301.db2.gz AEDHIYARZUMZJR-QWRGUYRKSA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)ncc1[N+](=O)[O-] ZINC000872778395 731830306 /nfs/dbraw/zinc/83/03/06/731830306.db2.gz AEDHIYARZUMZJR-QWRGUYRKSA-N 1 1 355.236 2.734 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cc1SC ZINC000874835766 732105404 /nfs/dbraw/zinc/10/54/04/732105404.db2.gz ADXAQSOGIOANTC-CHWSQXEVSA-N 1 1 365.455 2.634 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000874838225 732106260 /nfs/dbraw/zinc/10/62/60/732106260.db2.gz OJLIFQPRFAEFHP-UONOGXRCSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C ZINC000874844037 732107027 /nfs/dbraw/zinc/10/70/27/732107027.db2.gz QEYQNNZFQBFQID-UBHSHLNASA-N 1 1 367.833 2.711 20 5 FFBDMO CC[N@@H+](CCNS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C)C(C)C ZINC000780855990 738582253 /nfs/dbraw/zinc/58/22/53/738582253.db2.gz LSYXQDKJYDUVRK-UHFFFAOYSA-N 1 1 363.867 2.565 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@]3(CCOC3)C2)o1 ZINC000878185143 732495261 /nfs/dbraw/zinc/49/52/61/732495261.db2.gz FGSKWXNNIATWFI-INIZCTEOSA-N 1 1 364.789 2.911 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878655804 732573109 /nfs/dbraw/zinc/57/31/09/732573109.db2.gz ADCRMPFSZQJRJJ-GFCCVEGCSA-N 1 1 365.821 2.824 20 5 FFBDMO COc1cc(C[N@H+]2CCCCCCNC(=O)CC2)c([N+](=O)[O-])cc1F ZINC000879256023 732673412 /nfs/dbraw/zinc/67/34/12/732673412.db2.gz UXELMYIUQMMIMP-UHFFFAOYSA-N 1 1 353.394 2.625 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2CSC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560078 732723209 /nfs/dbraw/zinc/72/32/09/732723209.db2.gz FBLCDMGVUDYBIW-WDEREUQCSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2CSC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560078 732723213 /nfs/dbraw/zinc/72/32/13/732723213.db2.gz FBLCDMGVUDYBIW-WDEREUQCSA-N 1 1 355.847 2.872 20 5 FFBDMO CSc1cccc(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928089014 738819463 /nfs/dbraw/zinc/81/94/63/738819463.db2.gz IPOJDDUCFQSPTL-QWHCGFSZSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1cccc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928089014 738819465 /nfs/dbraw/zinc/81/94/65/738819465.db2.gz IPOJDDUCFQSPTL-QWHCGFSZSA-N 1 1 367.496 2.626 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc2c(c1)CCS2(=O)=O ZINC000893139430 734657504 /nfs/dbraw/zinc/65/75/04/734657504.db2.gz MQVDWVGWEFBGQA-UHFFFAOYSA-N 1 1 366.826 2.868 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1[N+](=O)[O-] ZINC000894699873 734902715 /nfs/dbraw/zinc/90/27/15/734902715.db2.gz LQEGBWJLNCSPAL-KFWWJZLASA-N 1 1 350.415 2.825 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)ccc1C(F)(F)F ZINC000897221081 735207913 /nfs/dbraw/zinc/20/79/13/735207913.db2.gz GZOLSJIETOVTFN-KBPBESRZSA-N 1 1 359.348 2.649 20 5 FFBDMO COCCCN1CCC([NH2+][C@H](C)c2cc(OC)cc([N+](=O)[O-])c2)CC1 ZINC000903086861 736028461 /nfs/dbraw/zinc/02/84/61/736028461.db2.gz BBOYPAYDFDFNRK-CQSZACIVSA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc([N+](=O)[O-])cc1F ZINC000754506924 736166232 /nfs/dbraw/zinc/16/62/32/736166232.db2.gz AJNXUAOFJPACQK-MRXNPFEDSA-N 1 1 354.378 2.570 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756937482 736374730 /nfs/dbraw/zinc/37/47/30/736374730.db2.gz WVQYSEQPAKFRBN-CQSZACIVSA-N 1 1 354.838 2.922 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[N@H+]1C1CC1 ZINC000756952434 736376346 /nfs/dbraw/zinc/37/63/46/736376346.db2.gz SUAXAALEMUZGQS-CMPLNLGQSA-N 1 1 352.822 2.673 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761049276 736690798 /nfs/dbraw/zinc/69/07/98/736690798.db2.gz PCTWUFMMWNPGJI-SNVBAGLBSA-N 1 1 361.320 2.816 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C2)C1 ZINC000908422515 736773906 /nfs/dbraw/zinc/77/39/06/736773906.db2.gz OOEDUVBFFHUTKE-INIZCTEOSA-N 1 1 355.797 2.945 20 5 FFBDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766910786 737274617 /nfs/dbraw/zinc/27/46/17/737274617.db2.gz RQFTZLKLWFMXRN-PBHICJAKSA-N 1 1 350.415 2.682 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000767113309 737293020 /nfs/dbraw/zinc/29/30/20/737293020.db2.gz VAUSELCQXQVKCP-OAHLLOKOSA-N 1 1 368.455 2.863 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000767113309 737293024 /nfs/dbraw/zinc/29/30/24/737293024.db2.gz VAUSELCQXQVKCP-OAHLLOKOSA-N 1 1 368.455 2.863 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)ccc1Cl ZINC000768555903 737432576 /nfs/dbraw/zinc/43/25/76/737432576.db2.gz UAFIVAPHJNFRNO-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000769469220 737532749 /nfs/dbraw/zinc/53/27/49/737532749.db2.gz VQCBMCQACOHZKW-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999710 737588880 /nfs/dbraw/zinc/58/88/80/737588880.db2.gz FRNRHPJTZLIGFO-SJLPKXTDSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999710 737588882 /nfs/dbraw/zinc/58/88/82/737588882.db2.gz FRNRHPJTZLIGFO-SJLPKXTDSA-N 1 1 350.415 2.826 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1F ZINC000771730120 737750160 /nfs/dbraw/zinc/75/01/60/737750160.db2.gz BEBIBRNAXXHZTD-QWHCGFSZSA-N 1 1 373.450 2.584 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000771851864 737761197 /nfs/dbraw/zinc/76/11/97/737761197.db2.gz SQAIBGXWGIXKJK-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO COCC1(C)CC[NH+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000773720475 737931077 /nfs/dbraw/zinc/93/10/77/737931077.db2.gz IVTNPCGYVZUVRZ-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879938 738134998 /nfs/dbraw/zinc/13/49/98/738134998.db2.gz MGIHIWQYJBXFGN-OLZOCXBDSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879938 738134999 /nfs/dbraw/zinc/13/49/99/738134999.db2.gz MGIHIWQYJBXFGN-OLZOCXBDSA-N 1 1 356.806 2.791 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785727798 738991630 /nfs/dbraw/zinc/99/16/30/738991630.db2.gz JJSBUHAGSFYVKN-GHMZBOCLSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)COC(=O)N1 ZINC000932027453 739376857 /nfs/dbraw/zinc/37/68/57/739376857.db2.gz YYNMYTAULGCCFM-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO COCC[N@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@H]1CC[C@H](C)C1 ZINC000790475952 739459691 /nfs/dbraw/zinc/45/96/91/739459691.db2.gz CLGOLXZNKPNJBP-QWRGUYRKSA-N 1 1 361.240 2.648 20 5 FFBDMO COCC[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@H]1CC[C@H](C)C1 ZINC000790475952 739459695 /nfs/dbraw/zinc/45/96/95/739459695.db2.gz CLGOLXZNKPNJBP-QWRGUYRKSA-N 1 1 361.240 2.648 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCCSC[C@H]2C2CC2)c([N+](=O)[O-])c1 ZINC000933915579 739704701 /nfs/dbraw/zinc/70/47/01/739704701.db2.gz YECNSCBBXXVSAI-INIZCTEOSA-N 1 1 365.455 2.759 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCSC[C@H]2C2CC2)c([N+](=O)[O-])c1 ZINC000933915579 739704705 /nfs/dbraw/zinc/70/47/05/739704705.db2.gz YECNSCBBXXVSAI-INIZCTEOSA-N 1 1 365.455 2.759 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cn1 ZINC000933983575 739715941 /nfs/dbraw/zinc/71/59/41/739715941.db2.gz WKIAVOZSVDCZRD-MRXNPFEDSA-N 1 1 362.455 2.887 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000934319837 739764708 /nfs/dbraw/zinc/76/47/08/739764708.db2.gz OJVMXOSPRJZNPE-ZJUUUORDSA-N 1 1 370.812 2.668 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810844738 741455197 /nfs/dbraw/zinc/45/51/97/741455197.db2.gz QOVDCCJGOABDMI-RYUDHWBXSA-N 1 1 356.325 2.980 20 5 FFBDMO C[C@H](C[N+](=O)[O-])OC(=O)c1ccccc1OCC[N@H+]1CCCC[C@H]1C ZINC000814045109 741787756 /nfs/dbraw/zinc/78/77/56/741787756.db2.gz MTIWIMDSXLCWFA-HUUCEWRRSA-N 1 1 350.415 2.762 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000814481974 741835082 /nfs/dbraw/zinc/83/50/82/741835082.db2.gz GGIKSPNBZZNJLM-UHFFFAOYSA-N 1 1 350.350 2.552 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000823276836 742872086 /nfs/dbraw/zinc/87/20/86/742872086.db2.gz YCGXIOSVKSPZFG-BLLLJJGKSA-N 1 1 351.834 2.733 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCc2ccc(Cl)cc2)CC1 ZINC001045437186 743274057 /nfs/dbraw/zinc/27/40/57/743274057.db2.gz HSYVVGIHNWCWLN-HZPDHXFCSA-N 1 1 365.861 2.518 20 5 FFBDMO Cc1cc(C[NH2+]C[C@H]2CC[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001048608569 743414362 /nfs/dbraw/zinc/41/43/62/743414362.db2.gz YIIOVPZLNRPNNX-MUIFIZLQSA-N 1 1 365.499 2.734 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325606 743511268 /nfs/dbraw/zinc/51/12/68/743511268.db2.gz JPDYRBUOTVBPPH-MWQQHZPXSA-N 1 1 365.861 2.770 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F ZINC000828614378 745092419 /nfs/dbraw/zinc/09/24/19/745092419.db2.gz IUZDXBBBDXZESB-UHFFFAOYSA-N 1 1 352.341 2.897 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)O1 ZINC000829801477 745262069 /nfs/dbraw/zinc/26/20/69/745262069.db2.gz QGOMKRHTMJNHLW-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO C[C@@H]1CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000830082582 745303150 /nfs/dbraw/zinc/30/31/50/745303150.db2.gz JUYFXLRBHVPPAA-GFCCVEGCSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccc(Cl)cc1 ZINC000830896420 745447625 /nfs/dbraw/zinc/44/76/25/745447625.db2.gz DVMOFXQZDNWAPO-IAGOWNOFSA-N 1 1 350.802 2.947 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H](CO)CC(C)(C)C ZINC000832093814 745635382 /nfs/dbraw/zinc/63/53/82/745635382.db2.gz JKFGLKUKSQSASV-ZDUSSCGKSA-N 1 1 355.410 2.791 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000832779074 745754212 /nfs/dbraw/zinc/75/42/12/745754212.db2.gz TZWOPANGEOQLGY-ZDUSSCGKSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H](CCCO)C1 ZINC000832784319 745754859 /nfs/dbraw/zinc/75/48/59/745754859.db2.gz YSZYNHSUOFWDHF-RYUDHWBXSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H](CCCO)C1 ZINC000832784319 745754864 /nfs/dbraw/zinc/75/48/64/745754864.db2.gz YSZYNHSUOFWDHF-RYUDHWBXSA-N 1 1 355.822 2.670 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839525274 746847021 /nfs/dbraw/zinc/84/70/21/746847021.db2.gz QFVYJWHFOIBRHX-NSHDSACASA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839525274 746847032 /nfs/dbraw/zinc/84/70/32/746847032.db2.gz QFVYJWHFOIBRHX-NSHDSACASA-N 1 1 357.204 2.885 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)O1 ZINC000843981748 747944711 /nfs/dbraw/zinc/94/47/11/747944711.db2.gz SNTQARSWTLMQND-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)O1 ZINC000843981748 747944714 /nfs/dbraw/zinc/94/47/14/747944714.db2.gz SNTQARSWTLMQND-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000843981675 747944951 /nfs/dbraw/zinc/94/49/51/747944951.db2.gz ORFXIKSHJVJTRS-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000843981675 747944957 /nfs/dbraw/zinc/94/49/57/747944957.db2.gz ORFXIKSHJVJTRS-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000846989822 748592775 /nfs/dbraw/zinc/59/27/75/748592775.db2.gz VYTWIKHTDCSHPF-GFCCVEGCSA-N 1 1 357.813 2.873 20 5 FFBDMO CCOC(=O)CC[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000847087579 748617976 /nfs/dbraw/zinc/61/79/76/748617976.db2.gz XDJPMAJLZOWMGA-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000847087579 748617978 /nfs/dbraw/zinc/61/79/78/748617978.db2.gz XDJPMAJLZOWMGA-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO COc1cc(CO[NH+]=C(N)[C@@H]2C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000848523087 748949069 /nfs/dbraw/zinc/94/90/69/748949069.db2.gz ZOPQIFZNHDPSLD-WCBMZHEXSA-N 1 1 359.329 2.902 20 5 FFBDMO Cc1noc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC000852189795 749797951 /nfs/dbraw/zinc/79/79/51/749797951.db2.gz BUFAMXYJMXWKRN-VXGBXAGGSA-N 1 1 354.407 2.817 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCOCCO)C2CCC2)c1Br ZINC000852289188 749824448 /nfs/dbraw/zinc/82/44/48/749824448.db2.gz KTGLBSQIZZWXKU-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+](CCOCCO)C2CCC2)c1Br ZINC000852289188 749824450 /nfs/dbraw/zinc/82/44/50/749824450.db2.gz KTGLBSQIZZWXKU-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO C[N@@H+]1CCO[C@H](CSCc2cccc([N+](=O)[O-])c2Br)C1 ZINC000400798027 845875211 /nfs/dbraw/zinc/87/52/11/845875211.db2.gz OREPDLJBEJNYOL-NSHDSACASA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@H](CSCc2cccc([N+](=O)[O-])c2Br)C1 ZINC000400798027 845875216 /nfs/dbraw/zinc/87/52/16/845875216.db2.gz OREPDLJBEJNYOL-NSHDSACASA-N 1 1 361.261 2.921 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c1C ZINC000895667568 970835557 /nfs/dbraw/zinc/83/55/57/970835557.db2.gz BKXPNDNKJCDTDR-INIZCTEOSA-N 1 1 361.442 2.539 20 5 FFBDMO CN(C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)[C@H]1CC[N@H+](C2CC2)C1 ZINC000888922590 971401590 /nfs/dbraw/zinc/40/15/90/971401590.db2.gz CVJZIZOBXCZSFM-AWEZNQCLSA-N 1 1 354.410 2.639 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c2ccccc2N1 ZINC000759893601 971911092 /nfs/dbraw/zinc/91/10/92/971911092.db2.gz DWKMUFWGZAHEHY-INIZCTEOSA-N 1 1 352.394 2.628 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134885692 960091952 /nfs/dbraw/zinc/09/19/52/960091952.db2.gz WMJVYVJVXGRZTG-DOTOQJQBSA-N 1 1 369.421 2.753 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)c2ncccc2C1 ZINC000872318349 1013209806 /nfs/dbraw/zinc/20/98/06/1013209806.db2.gz RWAOBOIFAOQYPT-UHFFFAOYSA-N 1 1 369.425 2.579 20 5 FFBDMO O=C(NCc1cccc(C[NH+]2CCCCCC2)c1)c1n[nH]cc1[N+](=O)[O-] ZINC000126324454 963558189 /nfs/dbraw/zinc/55/81/89/963558189.db2.gz IPCXGKVIAXLJMU-UHFFFAOYSA-N 1 1 357.414 2.624 20 5 FFBDMO COc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(F)c1OC ZINC000894579106 965497257 /nfs/dbraw/zinc/49/72/57/965497257.db2.gz DUPAKUXMVFYARL-UHFFFAOYSA-N 1 1 364.377 2.785 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2CCN(CC(C)(F)F)CC2)cccc1[N+](=O)[O-] ZINC001176495461 1013715793 /nfs/dbraw/zinc/71/57/93/1013715793.db2.gz JCKSNPHOCNXCDD-UHFFFAOYSA-N 1 1 370.400 2.505 20 5 FFBDMO CN1CC[N@H+](C)C[C@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001211587346 967576490 /nfs/dbraw/zinc/57/64/90/967576490.db2.gz FLXUWVQYUAXPQJ-INIZCTEOSA-N 1 1 360.421 2.751 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001211587346 967576500 /nfs/dbraw/zinc/57/65/00/967576500.db2.gz FLXUWVQYUAXPQJ-INIZCTEOSA-N 1 1 360.421 2.751 20 5 FFBDMO COC(=O)c1cccc2c1OCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001176659288 1013758207 /nfs/dbraw/zinc/75/82/07/1013758207.db2.gz ZVGQIFZLDODJTF-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc2c1OCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001176659288 1013758214 /nfs/dbraw/zinc/75/82/14/1013758214.db2.gz ZVGQIFZLDODJTF-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO Cn1c2ccccc2c(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1=O ZINC000892764413 970278451 /nfs/dbraw/zinc/27/84/51/970278451.db2.gz XINGRCYZMUMQJD-HNNXBMFYSA-N 1 1 370.453 2.615 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000892776702 970284470 /nfs/dbraw/zinc/28/44/70/970284470.db2.gz JUMHMYYHUWBTTN-LJQANCHMSA-N 1 1 355.442 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)nc1-c1ccccc1 ZINC000897220653 973458626 /nfs/dbraw/zinc/45/86/26/973458626.db2.gz CWTIHFYUWAOSCH-IAGOWNOFSA-N 1 1 368.437 2.692 20 5 FFBDMO CN(C)C(=O)OC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000796548642 1014261316 /nfs/dbraw/zinc/26/13/16/1014261316.db2.gz BTQYBPXPQICZAG-MRXNPFEDSA-N 1 1 365.430 2.916 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(O)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000893638568 976716219 /nfs/dbraw/zinc/71/62/19/976716219.db2.gz OFLVCRGZTOKQOS-UHFFFAOYSA-N 1 1 358.394 2.793 20 5 FFBDMO CCOc1ccccc1N1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178563252 977277141 /nfs/dbraw/zinc/27/71/41/977277141.db2.gz MOLCBRXQBSDBQJ-LJQANCHMSA-N 1 1 371.437 2.849 20 5 FFBDMO O=C(NC1(C[NH2+]CCc2ccc(Cl)cc2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001481897107 977742389 /nfs/dbraw/zinc/74/23/89/977742389.db2.gz OEBCGJZJJHXCRK-HZPDHXFCSA-N 1 1 365.861 2.566 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877686907 1014678200 /nfs/dbraw/zinc/67/82/00/1014678200.db2.gz ATCVMPLETVOBRQ-MOPGFXCFSA-N 1 1 368.437 2.642 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691822 1014686750 /nfs/dbraw/zinc/68/67/50/1014686750.db2.gz PHGYJBMSLOFYRU-MSOLQXFVSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691822 1014686758 /nfs/dbraw/zinc/68/67/58/1014686758.db2.gz PHGYJBMSLOFYRU-MSOLQXFVSA-N 1 1 368.437 2.908 20 5 FFBDMO O=c1c2ccccc2ncn1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130144301 981100366 /nfs/dbraw/zinc/10/03/66/981100366.db2.gz MFFFSUZYHLIKIB-UHFFFAOYSA-N 1 1 364.405 2.969 20 5 FFBDMO CCOC(=O)[C@H](C)C1C[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000877828158 1014745640 /nfs/dbraw/zinc/74/56/40/1014745640.db2.gz AYFJPZYZCLXZRA-CYBMUJFWSA-N 1 1 372.425 2.626 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@H](C)C1 ZINC000910293606 981901646 /nfs/dbraw/zinc/90/16/46/981901646.db2.gz PJBDAGWMYFLULO-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3c([N+](=O)[O-])c1N)C2 ZINC000897877069 982542137 /nfs/dbraw/zinc/54/21/37/982542137.db2.gz SXUBKCCIKZVNHR-HXUWFJFHSA-N 1 1 368.437 2.888 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000045428016 984448418 /nfs/dbraw/zinc/44/84/18/984448418.db2.gz QRPCJDBEVYUWJB-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC1CC1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761291840 985126246 /nfs/dbraw/zinc/12/62/46/985126246.db2.gz WREZUCKIHUELHT-UHFFFAOYSA-N 1 1 360.414 2.876 20 5 FFBDMO COc1cccc([C@H](C)[NH+]2CCN(Cn3nc(C)c([N+](=O)[O-])c3C)CC2)c1 ZINC000171607619 985334933 /nfs/dbraw/zinc/33/49/33/985334933.db2.gz RMSSJMIXSSVZIV-HNNXBMFYSA-N 1 1 373.457 2.753 20 5 FFBDMO Cc1cccc(CCC[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001005381437 989740451 /nfs/dbraw/zinc/74/04/51/989740451.db2.gz KNIZSUIBBXGLNT-RTBURBONSA-N 1 1 359.470 2.516 20 5 FFBDMO Cc1ccc(CCC[NH+]2CCC(N(C)C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001005381399 989740477 /nfs/dbraw/zinc/74/04/77/989740477.db2.gz KDVZYQBOLFHDIC-RTBURBONSA-N 1 1 359.470 2.516 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2 ZINC001035186440 990402508 /nfs/dbraw/zinc/40/25/08/990402508.db2.gz FMAZHHHIKXGUMK-IEBWSBKVSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035186440 990402511 /nfs/dbraw/zinc/40/25/11/990402511.db2.gz FMAZHHHIKXGUMK-IEBWSBKVSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035186440 990402514 /nfs/dbraw/zinc/40/25/14/990402514.db2.gz FMAZHHHIKXGUMK-IEBWSBKVSA-N 1 1 371.481 2.783 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCc3ccccc3)C2)CC1 ZINC001035187576 990409294 /nfs/dbraw/zinc/40/92/94/990409294.db2.gz XLEAORGHGIYRGD-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCCc3ccccc3)C2)CC1 ZINC001035187576 990409302 /nfs/dbraw/zinc/40/93/02/990409302.db2.gz XLEAORGHGIYRGD-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCc3ccccc3)C2)CC1 ZINC001035187576 990409309 /nfs/dbraw/zinc/40/93/09/990409309.db2.gz XLEAORGHGIYRGD-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO Cc1cncc([C@@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000879750344 1015665242 /nfs/dbraw/zinc/66/52/42/1015665242.db2.gz TUJGKQFAKNHLFA-IRXDYDNUSA-N 1 1 357.410 2.875 20 5 FFBDMO Cc1cncc([C@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000879749197 1015664845 /nfs/dbraw/zinc/66/48/45/1015664845.db2.gz UIVJIZHADFMKGF-IEBWSBKVSA-N 1 1 357.410 2.875 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)c1cnn(-c2cc[nH+]cc2)c1 ZINC001131250910 994098356 /nfs/dbraw/zinc/09/83/56/994098356.db2.gz MRTPNOTYAGWRSE-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810845660 994951832 /nfs/dbraw/zinc/95/18/32/994951832.db2.gz FQLOMWSYEHRTMH-UONOGXRCSA-N 1 1 356.382 2.564 20 5 FFBDMO CCOc1cc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000810846309 994953943 /nfs/dbraw/zinc/95/39/43/994953943.db2.gz IROBERZTOZKVKJ-QWHCGFSZSA-N 1 1 364.398 2.786 20 5 FFBDMO COc1ccc(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000813171872 995633638 /nfs/dbraw/zinc/63/36/38/995633638.db2.gz WFFWMTWOQSGADM-IBGZPJMESA-N 1 1 370.405 2.964 20 5 FFBDMO COc1ccc(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000813171872 995633640 /nfs/dbraw/zinc/63/36/40/995633640.db2.gz WFFWMTWOQSGADM-IBGZPJMESA-N 1 1 370.405 2.964 20 5 FFBDMO CC(C)c1nn(C)cc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174085 995633760 /nfs/dbraw/zinc/63/37/60/995633760.db2.gz PFHYQFIOPIUHGI-INIZCTEOSA-N 1 1 372.425 2.883 20 5 FFBDMO CC(C)c1nn(C)cc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174085 995633762 /nfs/dbraw/zinc/63/37/62/995633762.db2.gz PFHYQFIOPIUHGI-INIZCTEOSA-N 1 1 372.425 2.883 20 5 FFBDMO NC(=O)COc1ccc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000824820455 997101751 /nfs/dbraw/zinc/10/17/51/997101751.db2.gz FYYMNRVSOJZKQG-QGZVFWFLSA-N 1 1 369.421 2.839 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825124336 997222887 /nfs/dbraw/zinc/22/28/87/997222887.db2.gz NQWZFYFMVFLMPV-RVKKMQEKSA-N 1 1 363.458 2.503 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000732166295 998497950 /nfs/dbraw/zinc/49/79/50/998497950.db2.gz NRMHEVQSESECQZ-INIZCTEOSA-N 1 1 358.442 2.504 20 5 FFBDMO Cc1c(C(=O)OC[C@@H]2CC[N@H+]2C(C)(C)C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000845740026 998631157 /nfs/dbraw/zinc/63/11/57/998631157.db2.gz XAKWAPALKRGTDR-HNNXBMFYSA-N 1 1 373.413 2.514 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000803860687 1016248923 /nfs/dbraw/zinc/24/89/23/1016248923.db2.gz PLCBQBLNZWRUPG-OAHLLOKOSA-N 1 1 364.398 2.769 20 5 FFBDMO C[C@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000803859746 1016248332 /nfs/dbraw/zinc/24/83/32/1016248332.db2.gz VQSNJIRZDMNBQP-KBPBESRZSA-N 1 1 363.414 2.730 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H](C4OCCO4)C3)c2)cc1 ZINC000738147634 999621245 /nfs/dbraw/zinc/62/12/45/999621245.db2.gz FEIQXOWAGKWIOO-HNNXBMFYSA-N 1 1 358.398 2.501 20 5 FFBDMO CC[C@]1(C)CCC[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386226 999815925 /nfs/dbraw/zinc/81/59/25/999815925.db2.gz FMGYBYHMELNBPQ-MOPGFXCFSA-N 1 1 374.441 2.831 20 5 FFBDMO CC[C@]1(C)CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386226 999815927 /nfs/dbraw/zinc/81/59/27/999815927.db2.gz FMGYBYHMELNBPQ-MOPGFXCFSA-N 1 1 374.441 2.831 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000745090076 999891973 /nfs/dbraw/zinc/89/19/73/999891973.db2.gz UNPRZFOHWOZOBV-CZUORRHYSA-N 1 1 363.414 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)cn1 ZINC001212581665 1000003168 /nfs/dbraw/zinc/00/31/68/1000003168.db2.gz UEFUWRBVRMSPTD-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CC(C)(C)OC(=O)N1CC([C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169014443 1000015668 /nfs/dbraw/zinc/01/56/68/1000015668.db2.gz ZVDFNZMKEUNOPR-IIAWOOMASA-N 1 1 353.463 2.621 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCC3(CCN(c4ncccn4)CC3)C2)C1 ZINC001169022269 1000017961 /nfs/dbraw/zinc/01/79/61/1000017961.db2.gz RLRKVYGVOWXDKG-SJORKVTESA-N 1 1 359.474 2.604 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2C[C@@H]3COC[C@]3(COCC3CCCC3)C2)C1 ZINC001169025799 1000018081 /nfs/dbraw/zinc/01/80/81/1000018081.db2.gz VJGAENBQOIRTFY-WJFTUGDTSA-N 1 1 352.475 2.587 20 5 FFBDMO O=C(c1ccc(Cl)cc1)N1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169049645 1000018638 /nfs/dbraw/zinc/01/86/38/1000018638.db2.gz XENIIFWDLLEVAN-YOEHRIQHSA-N 1 1 365.861 2.933 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000791814091 1002813669 /nfs/dbraw/zinc/81/36/69/1002813669.db2.gz YPBOSUVPEYKPQR-UHFFFAOYSA-N 1 1 374.441 2.649 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@@H]1N2C(=O)c1cc([N+](=O)[O-])cn1C ZINC000791980013 1002862351 /nfs/dbraw/zinc/86/23/51/1002862351.db2.gz KUCZCSNEEFIHMB-RDJZCZTQSA-N 1 1 354.410 2.690 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(c3nccs3)CC2)c([N+](=O)[O-])c1 ZINC001170326607 1003113766 /nfs/dbraw/zinc/11/37/66/1003113766.db2.gz AHGKVXMHGYRGOY-ZDUSSCGKSA-N 1 1 362.455 2.813 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCCC[C@@]23CC(=O)N(C)C3)c([N+](=O)[O-])c1 ZINC001170340484 1003130339 /nfs/dbraw/zinc/13/03/39/1003130339.db2.gz MBPQAXMAKZZVGF-LIRRHRJNSA-N 1 1 361.442 2.621 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000794116932 1003568182 /nfs/dbraw/zinc/56/81/82/1003568182.db2.gz ZUEGZEZQJWLUCL-UHFFFAOYSA-N 1 1 358.442 2.577 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001196773857 1003966271 /nfs/dbraw/zinc/96/62/71/1003966271.db2.gz UVECIKVIHAXGBK-UONOGXRCSA-N 1 1 365.430 2.961 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(c2c[nH+]cn2C)CC1 ZINC001198768400 1004734347 /nfs/dbraw/zinc/73/43/47/1004734347.db2.gz HESPHTAYEXMYHT-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001195595668 1004995208 /nfs/dbraw/zinc/99/52/08/1004995208.db2.gz GFIJWSIQWBJRIE-GIPNMCIBSA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@@H+](Cc1cn(C[C@H](O)c2ccc([N+](=O)[O-])cc2)nn1)C1CCCCC1 ZINC000881399065 1006080974 /nfs/dbraw/zinc/08/09/74/1006080974.db2.gz VUPOLTIYCPVTIF-SFHVURJKSA-N 1 1 359.430 2.684 20 5 FFBDMO CCCc1ccc(C[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1 ZINC001050516412 1017035953 /nfs/dbraw/zinc/03/59/53/1017035953.db2.gz AJQWMTFPOQZJED-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO Cc1nn(CN2CC[C@H]([N@@H+](C)CCc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000853560551 1006444052 /nfs/dbraw/zinc/44/40/52/1006444052.db2.gz OZIYABPFUFTTME-SFHVURJKSA-N 1 1 357.458 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H]3CCC4(CCOCC4)CO3)c2c1 ZINC000882785429 1006505915 /nfs/dbraw/zinc/50/59/15/1006505915.db2.gz JFWMPRDUUXHROA-OAHLLOKOSA-N 1 1 357.410 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)c3cc4ccccc4o3)C2)nc1 ZINC000815070005 1006506505 /nfs/dbraw/zinc/50/65/05/1006506505.db2.gz NWOHOCPZWOIKME-GDBMZVCRSA-N 1 1 368.393 2.956 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979959 1006585651 /nfs/dbraw/zinc/58/56/51/1006585651.db2.gz UNPWHQAFWPLAQZ-JXFKEZNVSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979959 1006585656 /nfs/dbraw/zinc/58/56/56/1006585656.db2.gz UNPWHQAFWPLAQZ-JXFKEZNVSA-N 1 1 368.437 2.860 20 5 FFBDMO COc1cc(Cn2cc(C[NH+]3CCC(C)CC3)nn2)c([N+](=O)[O-])cc1F ZINC000883994528 1007130285 /nfs/dbraw/zinc/13/02/85/1007130285.db2.gz CQYMZKXYSFIAGG-UHFFFAOYSA-N 1 1 363.393 2.614 20 5 FFBDMO CCOc1cc(Cn2cc(C[NH+]3CCC(C)CC3)nn2)ccc1[N+](=O)[O-] ZINC000883995617 1007131071 /nfs/dbraw/zinc/13/10/71/1007131071.db2.gz UOCPZIDVFDLISR-UHFFFAOYSA-N 1 1 359.430 2.865 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000885932974 1007841562 /nfs/dbraw/zinc/84/15/62/1007841562.db2.gz FWTBAKHQLMOBLV-UHFFFAOYSA-N 1 1 356.426 2.706 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856542498 1007878450 /nfs/dbraw/zinc/87/84/50/1007878450.db2.gz ARALNNTXHALCLY-CWRNSKLLSA-N 1 1 354.410 2.506 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856542498 1007878456 /nfs/dbraw/zinc/87/84/56/1007878456.db2.gz ARALNNTXHALCLY-CWRNSKLLSA-N 1 1 354.410 2.506 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001136409077 1008407143 /nfs/dbraw/zinc/40/71/43/1008407143.db2.gz IOZTWRRHNUFPHM-ZFWWWQNUSA-N 1 1 354.410 2.742 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC000858821342 1008429921 /nfs/dbraw/zinc/42/99/21/1008429921.db2.gz FKGNKQJDPYZBLE-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000859251625 1008493396 /nfs/dbraw/zinc/49/33/96/1008493396.db2.gz HIJBKCHBBNPRSB-OAHLLOKOSA-N 1 1 357.410 2.589 20 5 FFBDMO O=C(CCN1CCCC[C@]2(CC[NH2+]C2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886874716 1008910743 /nfs/dbraw/zinc/91/07/43/1008910743.db2.gz UYOIQJYQXIWEQR-GOSISDBHSA-N 1 1 364.421 2.528 20 5 FFBDMO Cc1[nH]c(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001178441488 1008975273 /nfs/dbraw/zinc/97/52/73/1008975273.db2.gz HLZIXUDWHYXKQT-SECBINFHSA-N 1 1 352.778 2.672 20 5 FFBDMO Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000126435031 1009229464 /nfs/dbraw/zinc/22/94/64/1009229464.db2.gz XQYUQPDFDBSYET-XJKSGUPXSA-N 1 1 358.442 2.574 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000823967618 1009284326 /nfs/dbraw/zinc/28/43/26/1009284326.db2.gz FZWBNGGCQGGMGU-CHWSQXEVSA-N 1 1 361.446 2.952 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000823927013 1009284697 /nfs/dbraw/zinc/28/46/97/1009284697.db2.gz KNZUZBVDEZUYOX-CQSZACIVSA-N 1 1 369.425 2.915 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823927013 1009284709 /nfs/dbraw/zinc/28/47/09/1009284709.db2.gz KNZUZBVDEZUYOX-CQSZACIVSA-N 1 1 369.425 2.915 20 5 FFBDMO COCCC1CC[NH+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000863269313 1010150478 /nfs/dbraw/zinc/15/04/78/1010150478.db2.gz BEQRGGQNPVRVLX-GOSISDBHSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc([N+](=O)[O-])cc1C(F)F)C2 ZINC000865904637 1010886533 /nfs/dbraw/zinc/88/65/33/1010886533.db2.gz TXZQCIGRRFSNGO-NSHDSACASA-N 1 1 366.368 2.999 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000773262169 1010946292 /nfs/dbraw/zinc/94/62/92/1010946292.db2.gz OCKFNFXBKXTPDA-GJZGRUSLSA-N 1 1 359.430 2.744 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000866307115 1010974215 /nfs/dbraw/zinc/97/42/15/1010974215.db2.gz QYWXHECUQMJJTC-XVSDVWIESA-N 1 1 365.449 2.632 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905494 1012077583 /nfs/dbraw/zinc/07/75/83/1012077583.db2.gz CQFSINVMJNCVOT-CRAIPNDOSA-N 1 1 370.453 2.817 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905494 1012077602 /nfs/dbraw/zinc/07/76/02/1012077602.db2.gz CQFSINVMJNCVOT-CRAIPNDOSA-N 1 1 370.453 2.817 20 5 FFBDMO COCC[N@@H+](C1CCN(C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912305 1012125844 /nfs/dbraw/zinc/12/58/44/1012125844.db2.gz ZAEBFWGDDLWPED-SFHVURJKSA-N 1 1 361.486 2.885 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000870138478 1012184405 /nfs/dbraw/zinc/18/44/05/1012184405.db2.gz FTECHQNPFSGWGO-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO CC[N@@H+](CCN(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014307 1012185069 /nfs/dbraw/zinc/18/50/69/1012185069.db2.gz NBGXJOFRARFGEO-UHFFFAOYSA-N 1 1 356.417 2.725 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[NH2+]2)cc1 ZINC000870140037 1012186948 /nfs/dbraw/zinc/18/69/48/1012186948.db2.gz ULZZLGRVORXYQZ-QGZVFWFLSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)CCc2noc(C)n2)c1F ZINC001173182843 1012325932 /nfs/dbraw/zinc/32/59/32/1012325932.db2.gz UVAZKFURORKQCR-JTQLQIEISA-N 1 1 352.366 2.539 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c1F ZINC001173192829 1012335428 /nfs/dbraw/zinc/33/54/28/1012335428.db2.gz NAZMMBDPILMNID-ZENOOKHLSA-N 1 1 351.422 2.700 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@H]3C[N@@H+](C)C[C@@H]32)c1F ZINC001173195432 1012339297 /nfs/dbraw/zinc/33/92/97/1012339297.db2.gz FXVJPGYCSGUWHB-XEZPLFJOSA-N 1 1 351.422 2.700 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H](c3nc(C)no3)C2)c1F ZINC001173197575 1012341612 /nfs/dbraw/zinc/34/16/12/1012341612.db2.gz UPZIWBKKIMTOLF-JQWIXIFHSA-N 1 1 364.377 2.854 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001173224445 1012357832 /nfs/dbraw/zinc/35/78/32/1012357832.db2.gz FWOVRMCFNQYBJR-UWJYYQICSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001173224445 1012357843 /nfs/dbraw/zinc/35/78/43/1012357843.db2.gz FWOVRMCFNQYBJR-UWJYYQICSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001173224445 1012357856 /nfs/dbraw/zinc/35/78/56/1012357856.db2.gz FWOVRMCFNQYBJR-UWJYYQICSA-N 1 1 369.465 2.705 20 5 FFBDMO C[N@@H+](CCc1nc(-c2ccccc2)no1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796387511 1012586546 /nfs/dbraw/zinc/58/65/46/1012586546.db2.gz CXOMTJBLBIZAGP-QGZVFWFLSA-N 1 1 368.393 2.853 20 5 FFBDMO Cn1cc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000871152621 1012753293 /nfs/dbraw/zinc/75/32/93/1012753293.db2.gz LJZXLAZQSNGRHX-UHFFFAOYSA-N 1 1 371.441 2.552 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000097667649 1012931487 /nfs/dbraw/zinc/93/14/87/1012931487.db2.gz IVKNXPIPFKTGFL-NWDGAFQWSA-N 1 1 364.402 2.662 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000827675726 1018609101 /nfs/dbraw/zinc/60/91/01/1018609101.db2.gz XPBZHAPIJNMWKV-SFHVURJKSA-N 1 1 371.437 2.655 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(Cc2ccccc2)nn1 ZINC000801601825 1019163022 /nfs/dbraw/zinc/16/30/22/1019163022.db2.gz PAIVXOIHOPUUOY-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(Cc2ccccc2)nn1 ZINC000801601825 1019163025 /nfs/dbraw/zinc/16/30/25/1019163025.db2.gz PAIVXOIHOPUUOY-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000801950971 1019536084 /nfs/dbraw/zinc/53/60/84/1019536084.db2.gz OFDHLCJKWRBHIS-RYUDHWBXSA-N 1 1 364.421 2.699 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@H]1C[N@H+](C(C)C)CCO1 ZINC000802138833 1019788785 /nfs/dbraw/zinc/78/87/85/1019788785.db2.gz PVFWYZVRTZHDOO-AEFFLSMTSA-N 1 1 364.442 2.816 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001045436559 1019964820 /nfs/dbraw/zinc/96/48/20/1019964820.db2.gz RYFYNPLEHRWPBW-QZTJIDSGSA-N 1 1 359.470 2.946 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525086 1020275807 /nfs/dbraw/zinc/27/58/07/1020275807.db2.gz KLIYTAKKQYFTQE-USYVTKNRSA-N 1 1 371.481 2.644 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525086 1020275814 /nfs/dbraw/zinc/27/58/14/1020275814.db2.gz KLIYTAKKQYFTQE-USYVTKNRSA-N 1 1 371.481 2.644 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525086 1020275819 /nfs/dbraw/zinc/27/58/19/1020275819.db2.gz KLIYTAKKQYFTQE-USYVTKNRSA-N 1 1 371.481 2.644 20 5 FFBDMO CCc1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 ZINC001048525407 1020276213 /nfs/dbraw/zinc/27/62/13/1020276213.db2.gz TXFYDVZBGXWJPS-PBOLBBRVSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1ccccc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525407 1020276221 /nfs/dbraw/zinc/27/62/21/1020276221.db2.gz TXFYDVZBGXWJPS-PBOLBBRVSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525407 1020276227 /nfs/dbraw/zinc/27/62/27/1020276227.db2.gz TXFYDVZBGXWJPS-PBOLBBRVSA-N 1 1 371.481 2.773 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C(=O)OC(C)(C)C ZINC000828917409 1032904127 /nfs/dbraw/zinc/90/41/27/1032904127.db2.gz GNKMNPSRINAPKF-COXVUDFISA-N 1 1 364.442 2.928 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]C[C@@H](C(C)C)N2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC000903064938 1020659822 /nfs/dbraw/zinc/65/98/22/1020659822.db2.gz CBIGZESDGKLCQW-BEFAXECRSA-N 1 1 364.490 2.526 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136305 1020716077 /nfs/dbraw/zinc/71/60/77/1020716077.db2.gz ZNHYRLMITFNVTJ-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136305 1020716086 /nfs/dbraw/zinc/71/60/86/1020716086.db2.gz ZNHYRLMITFNVTJ-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136303 1020716757 /nfs/dbraw/zinc/71/67/57/1020716757.db2.gz ZNHYRLMITFNVTJ-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932136303 1020716764 /nfs/dbraw/zinc/71/67/64/1020716764.db2.gz ZNHYRLMITFNVTJ-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO O=C(CC[N@@H+]1CCn2nc(C3CC3)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000932604077 1020845740 /nfs/dbraw/zinc/84/57/40/1020845740.db2.gz JHTWCYVWEDCIGK-UHFFFAOYSA-N 1 1 355.398 2.513 20 5 FFBDMO O=C(CC[N@H+]1CCn2nc(C3CC3)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000932604077 1020845745 /nfs/dbraw/zinc/84/57/45/1020845745.db2.gz JHTWCYVWEDCIGK-UHFFFAOYSA-N 1 1 355.398 2.513 20 5 FFBDMO O=C(CC[N@@H+]1CCn2nc(C3CC3)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000932606407 1020846799 /nfs/dbraw/zinc/84/67/99/1020846799.db2.gz VUKXTZXWUOCEKP-UHFFFAOYSA-N 1 1 355.398 2.513 20 5 FFBDMO O=C(CC[N@H+]1CCn2nc(C3CC3)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000932606407 1020846805 /nfs/dbraw/zinc/84/68/05/1020846805.db2.gz VUKXTZXWUOCEKP-UHFFFAOYSA-N 1 1 355.398 2.513 20 5 FFBDMO CCn1cnc2c1CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C2 ZINC000933257298 1020984018 /nfs/dbraw/zinc/98/40/18/1020984018.db2.gz DXXPPHLHZSBLFM-UHFFFAOYSA-N 1 1 357.414 2.507 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000749667120 1021018995 /nfs/dbraw/zinc/01/89/95/1021018995.db2.gz VIOHJILCKSGOCM-ZWKOTPCHSA-N 1 1 352.394 2.741 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000749810668 1021041918 /nfs/dbraw/zinc/04/19/18/1021041918.db2.gz MJHFEKUIQCZRGC-CQSZACIVSA-N 1 1 365.430 2.915 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271087 1022647346 /nfs/dbraw/zinc/64/73/46/1022647346.db2.gz SXOMQJCKKUTJES-KGLIPLIRSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271087 1022647356 /nfs/dbraw/zinc/64/73/56/1022647356.db2.gz SXOMQJCKKUTJES-KGLIPLIRSA-N 1 1 359.220 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[NH+]3CCC4(CC3)COCCO4)c2c1 ZINC001119334327 1022696883 /nfs/dbraw/zinc/69/68/83/1022696883.db2.gz QIKZHKXHOHCOJF-UHFFFAOYSA-N 1 1 365.411 2.711 20 5 FFBDMO O=C1O[C@@H](C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1c1ccccc1 ZINC000757168084 1023807875 /nfs/dbraw/zinc/80/78/75/1023807875.db2.gz SNNOUTPDEVKTTD-INIZCTEOSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C1O[C@@H](C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1c1ccccc1 ZINC000757168084 1023807879 /nfs/dbraw/zinc/80/78/79/1023807879.db2.gz SNNOUTPDEVKTTD-INIZCTEOSA-N 1 1 353.378 2.978 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000757925698 1023885676 /nfs/dbraw/zinc/88/56/76/1023885676.db2.gz RDAZLAOVRGZOSU-OAHLLOKOSA-N 1 1 370.365 2.728 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000757925698 1023885686 /nfs/dbraw/zinc/88/56/86/1023885686.db2.gz RDAZLAOVRGZOSU-OAHLLOKOSA-N 1 1 370.365 2.728 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@@H]2C1 ZINC001124025337 1024233169 /nfs/dbraw/zinc/23/31/69/1024233169.db2.gz LHIPJEDIMDSCFM-NQYLQCIDSA-N 1 1 361.445 2.751 20 5 FFBDMO C[N@H+]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)[C@@H](c2ccccc2)C1 ZINC000245197966 1025389029 /nfs/dbraw/zinc/38/90/29/1025389029.db2.gz JYXJAOHGHXNPPB-LJQANCHMSA-N 1 1 366.421 2.973 20 5 FFBDMO CO[C@@H]1CC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1(C)C ZINC000840122962 1026968642 /nfs/dbraw/zinc/96/86/42/1026968642.db2.gz FXYSELOZIBPUQT-MRXNPFEDSA-N 1 1 362.430 2.541 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1(C)C ZINC000840122962 1026968650 /nfs/dbraw/zinc/96/86/50/1026968650.db2.gz FXYSELOZIBPUQT-MRXNPFEDSA-N 1 1 362.430 2.541 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000840141752 1026981965 /nfs/dbraw/zinc/98/19/65/1026981965.db2.gz RXESDQZACNVNBU-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1cc(C)c(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC001160090595 1027586430 /nfs/dbraw/zinc/58/64/30/1027586430.db2.gz JWJZSPAHJROLRG-UYAOXDASSA-N 1 1 371.481 2.915 20 5 FFBDMO Cc1cc(C)c(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001160090595 1027586443 /nfs/dbraw/zinc/58/64/43/1027586443.db2.gz JWJZSPAHJROLRG-UYAOXDASSA-N 1 1 371.481 2.915 20 5 FFBDMO Cc1cc(C)c(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001160090595 1027586455 /nfs/dbraw/zinc/58/64/55/1027586455.db2.gz JWJZSPAHJROLRG-UYAOXDASSA-N 1 1 371.481 2.915 20 5 FFBDMO CCc1ccc(CC[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001160107291 1027592922 /nfs/dbraw/zinc/59/29/22/1027592922.db2.gz LZZSGYKPOBENCZ-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO CCc1ccc(CC[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160107291 1027592933 /nfs/dbraw/zinc/59/29/33/1027592933.db2.gz LZZSGYKPOBENCZ-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO CCc1ccc(CC[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160107291 1027592944 /nfs/dbraw/zinc/59/29/44/1027592944.db2.gz LZZSGYKPOBENCZ-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO C[N@@H+]1CCc2c(NCCc3ccc4c(c3)OCO4)ccc([N+](=O)[O-])c2C1 ZINC001162087905 1028427589 /nfs/dbraw/zinc/42/75/89/1028427589.db2.gz VLDNLFZNZNGDHY-UHFFFAOYSA-N 1 1 355.394 2.966 20 5 FFBDMO C[N@H+]1CCc2c(NCCc3ccc4c(c3)OCO4)ccc([N+](=O)[O-])c2C1 ZINC001162087905 1028427593 /nfs/dbraw/zinc/42/75/93/1028427593.db2.gz VLDNLFZNZNGDHY-UHFFFAOYSA-N 1 1 355.394 2.966 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nc(Cl)nc1NCC[C@@H]1CC[NH2+]CC1(F)F ZINC001162811072 1028664893 /nfs/dbraw/zinc/66/48/93/1028664893.db2.gz QIKYVAKTXNLNAE-LURJTMIESA-N 1 1 356.160 2.738 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC001164124146 1029179855 /nfs/dbraw/zinc/17/98/55/1029179855.db2.gz BNEGHRNHAWOFPK-ZYHUDNBSSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001164124146 1029179860 /nfs/dbraw/zinc/17/98/60/1029179860.db2.gz BNEGHRNHAWOFPK-ZYHUDNBSSA-N 1 1 373.276 2.744 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])cc1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC001164492476 1029298294 /nfs/dbraw/zinc/29/82/94/1029298294.db2.gz LOXPPCYMPOCDBD-BRWVUGGUSA-N 1 1 354.410 2.551 20 5 FFBDMO COc1nc(N(C)[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)ncc1[N+](=O)[O-] ZINC001165184600 1029440249 /nfs/dbraw/zinc/44/02/49/1029440249.db2.gz XQFHDLZIBPQBPZ-RHSMWYFYSA-N 1 1 371.441 2.740 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](n2ccnc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782488632 1029717067 /nfs/dbraw/zinc/71/70/67/1029717067.db2.gz GHHIDWRZMDQSAJ-AWEZNQCLSA-N 1 1 361.377 2.596 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1O ZINC000782531056 1029734921 /nfs/dbraw/zinc/73/49/21/1029734921.db2.gz LGLXVEGCKHWEER-CJNGLKHVSA-N 1 1 367.421 2.791 20 5 FFBDMO C[N@@H+](C1CN(c2nc3ccccc3c(Cl)c2[N+](=O)[O-])C1)[C@@H]1CCOC1 ZINC001165205668 1029892004 /nfs/dbraw/zinc/89/20/04/1029892004.db2.gz OWIZGRJVBPHOET-LLVKDONJSA-N 1 1 362.817 2.706 20 5 FFBDMO C[C@@H]1C[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007725 1030411860 /nfs/dbraw/zinc/41/18/60/1030411860.db2.gz LCJVZDCRVVHQRX-DJJJIMSYSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007725 1030411870 /nfs/dbraw/zinc/41/18/70/1030411870.db2.gz LCJVZDCRVVHQRX-DJJJIMSYSA-N 1 1 374.441 2.687 20 5 FFBDMO O=C(NCC1([NH2+]CCCCC(F)(F)F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530794 1031789051 /nfs/dbraw/zinc/78/90/51/1031789051.db2.gz RQRXERCVCPUXKD-CHWSQXEVSA-N 1 1 365.396 2.793 20 5 FFBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)C1CC[NH2+]CC1 ZINC001219005690 1033456484 /nfs/dbraw/zinc/45/64/84/1033456484.db2.gz TYBGNWAHEMVNME-UHFFFAOYSA-N 1 1 364.449 2.895 20 5 FFBDMO CN1CCN(CCO[C@@H](c2ccccc2)c2ccccc2[N+](=O)[O-])CC1 ZINC001224548562 1033925741 /nfs/dbraw/zinc/92/57/41/1033925741.db2.gz CQTHFNZIFYVKOW-FQEVSTJZSA-N 1 1 355.438 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](OC[C@@H]1C[N@H+](Cc3ccccc3)CCO1)C2 ZINC001224955245 1034069294 /nfs/dbraw/zinc/06/92/94/1034069294.db2.gz FCNBIQMFSKQQMG-RTWAWAEBSA-N 1 1 368.433 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](OC[C@@H]1C[N@@H+](Cc3ccccc3)CCO1)C2 ZINC001224955245 1034069306 /nfs/dbraw/zinc/06/93/06/1034069306.db2.gz FCNBIQMFSKQQMG-RTWAWAEBSA-N 1 1 368.433 2.980 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ncc([N+](=O)[O-])cc1Br ZINC001226344563 1034639744 /nfs/dbraw/zinc/63/97/44/1034639744.db2.gz QOAXPUOHHUSXFQ-DDFAGTSDSA-N 1 1 356.220 2.861 20 5 FFBDMO Cc1c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000832297055 1034709463 /nfs/dbraw/zinc/70/94/63/1034709463.db2.gz POFJLMHQVZDQRR-ZDUSSCGKSA-N 1 1 364.402 2.722 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1OC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226764013 1034825173 /nfs/dbraw/zinc/82/51/73/1034825173.db2.gz DLDFHQVQNRHBNJ-GOSISDBHSA-N 1 1 357.410 2.968 20 5 FFBDMO Cc1nc(Cl)nc(O[C@@H]2CC[N@@H+]([C@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227337917 1035510724 /nfs/dbraw/zinc/51/07/24/1035510724.db2.gz ICCFHJZUVCCBPX-VXGBXAGGSA-N 1 1 363.805 2.956 20 5 FFBDMO Cc1nc(Cl)nc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227337917 1035510730 /nfs/dbraw/zinc/51/07/30/1035510730.db2.gz ICCFHJZUVCCBPX-VXGBXAGGSA-N 1 1 363.805 2.956 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])c3nc[nH]c32)C1 ZINC001227692267 1035674631 /nfs/dbraw/zinc/67/46/31/1035674631.db2.gz VQNJGUXVZNIZBF-QWHCGFSZSA-N 1 1 368.397 2.866 20 5 FFBDMO COC(=O)c1cccc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227896017 1035791679 /nfs/dbraw/zinc/79/16/79/1035791679.db2.gz DVALRZJQGJAYER-ZIAGYGMSSA-N 1 1 371.393 2.991 20 5 FFBDMO COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1OC1CC[NH+](CCF)CC1 ZINC001228963852 1036437622 /nfs/dbraw/zinc/43/76/22/1036437622.db2.gz SHRAAJGMGVMFOS-UHFFFAOYSA-N 1 1 360.769 2.848 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377413 1036640247 /nfs/dbraw/zinc/64/02/47/1036640247.db2.gz CWKRXDGMDPPCOQ-HRCADAONSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377413 1036640261 /nfs/dbraw/zinc/64/02/61/1036640261.db2.gz CWKRXDGMDPPCOQ-HRCADAONSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377413 1036640274 /nfs/dbraw/zinc/64/02/74/1036640274.db2.gz CWKRXDGMDPPCOQ-HRCADAONSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1ccc(N2CCC[C@@H](Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)C2)[nH+]c1 ZINC001230231538 1037163758 /nfs/dbraw/zinc/16/37/58/1037163758.db2.gz MQPAREMTGPGGNY-GFCCVEGCSA-N 1 1 354.370 2.617 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](CO)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256094253 1038378793 /nfs/dbraw/zinc/37/87/93/1038378793.db2.gz WKTZUANCYQFWIM-HNNXBMFYSA-N 1 1 363.458 2.667 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H]3CN(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256099673 1038383723 /nfs/dbraw/zinc/38/37/23/1038383723.db2.gz VDOLAHGRSWZEKU-KRWDZBQOSA-N 1 1 362.474 2.598 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](C(C)=O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101141 1038384662 /nfs/dbraw/zinc/38/46/62/1038384662.db2.gz ZGMIEJVEMNBOBP-HNNXBMFYSA-N 1 1 361.442 2.873 20 5 FFBDMO CCC[C@@H]1CNCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246932571 1039538707 /nfs/dbraw/zinc/53/87/07/1039538707.db2.gz RKAIDOBFSPMSEC-CQSZACIVSA-N 1 1 368.428 2.916 20 5 FFBDMO CCC[C@@H]1CNCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246932571 1039538716 /nfs/dbraw/zinc/53/87/16/1039538716.db2.gz RKAIDOBFSPMSEC-CQSZACIVSA-N 1 1 368.428 2.916 20 5 FFBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2ccc3nccnc3c2)no1 ZINC001247665621 1039873308 /nfs/dbraw/zinc/87/33/08/1039873308.db2.gz HADLENLMYQVZCK-ZDUSSCGKSA-N 1 1 362.349 2.831 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001254563211 1040798884 /nfs/dbraw/zinc/79/88/84/1040798884.db2.gz XXFQMYIQXKAHJO-PBHICJAKSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561515 1040800423 /nfs/dbraw/zinc/80/04/23/1040800423.db2.gz LVDIJLGIFAJAQV-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561515 1040800430 /nfs/dbraw/zinc/80/04/30/1040800430.db2.gz LVDIJLGIFAJAQV-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO CC(C)[N@H+]1CCOC[C@]2(CCCN([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821370 /nfs/dbraw/zinc/82/13/70/1040821370.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@]2(CCC[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821375 /nfs/dbraw/zinc/82/13/75/1040821375.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592715 1040821389 /nfs/dbraw/zinc/82/13/89/1040821389.db2.gz GAANOPWFXBAFGJ-NHCUHLMSSA-N 1 1 373.497 2.885 20 5 FFBDMO O=C1N(CC2CC2)CC[C@@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599399 1040829499 /nfs/dbraw/zinc/82/94/99/1040829499.db2.gz YURVOZWMEHPHSZ-PZJWPPBQSA-N 1 1 369.465 2.787 20 5 FFBDMO CC(C)N(C)Cc1nn([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)c2c1CC[NH2+]C2 ZINC001254598773 1040830189 /nfs/dbraw/zinc/83/01/89/1040830189.db2.gz XIYMGJHEUDEDQK-QGZVFWFLSA-N 1 1 369.469 2.617 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)N1CCCCC1 ZINC001254601385 1040832451 /nfs/dbraw/zinc/83/24/51/1040832451.db2.gz ZATBEAMGWYOION-VQIMIIECSA-N 1 1 357.454 2.787 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603068 1040832565 /nfs/dbraw/zinc/83/25/65/1040832565.db2.gz LGPRKSNSKSWTQX-WOJBJXKFSA-N 1 1 359.470 2.637 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254603012 1040832921 /nfs/dbraw/zinc/83/29/21/1040832921.db2.gz KEWJFWCNLPTEEC-LJQANCHMSA-N 1 1 352.390 2.907 20 5 FFBDMO Cc1cnc(O[C@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605321 1040835064 /nfs/dbraw/zinc/83/50/64/1040835064.db2.gz BERONEIKSAGBBT-MSOLQXFVSA-N 1 1 354.410 2.704 20 5 FFBDMO C[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1NC(=O)OC(C)(C)C ZINC001254608281 1040837253 /nfs/dbraw/zinc/83/72/53/1040837253.db2.gz QDSOAFDLRODBEM-DQYPLSBCSA-N 1 1 361.442 2.907 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)[C@H]2C1 ZINC001262826961 1041880706 /nfs/dbraw/zinc/88/07/06/1041880706.db2.gz UFBXPGHMMCGYMV-NHCYSSNCSA-N 1 1 357.332 2.684 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3csc([N+](=O)[O-])c3)n2C)C1 ZINC001262850200 1041900384 /nfs/dbraw/zinc/90/03/84/1041900384.db2.gz NCEKWBIGCMPRRF-GFCCVEGCSA-N 1 1 364.475 2.620 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001538310439 1070402750 /nfs/dbraw/zinc/40/27/50/1070402750.db2.gz XCXBWSIAZTXTPC-AWEZNQCLSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001538310439 1070402753 /nfs/dbraw/zinc/40/27/53/1070402753.db2.gz XCXBWSIAZTXTPC-AWEZNQCLSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001265557685 1042866131 /nfs/dbraw/zinc/86/61/31/1042866131.db2.gz XVXVSJPCYYFBNB-KBXCAEBGSA-N 1 1 368.437 2.939 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001310506383 1043698789 /nfs/dbraw/zinc/69/87/89/1043698789.db2.gz CGRJJUPEKNIAFP-JTQLQIEISA-N 1 1 357.208 2.573 20 5 FFBDMO CC[N@H+]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC001312381006 1044104240 /nfs/dbraw/zinc/10/42/40/1044104240.db2.gz NZOZKYOLHGELKF-GFCCVEGCSA-N 1 1 354.838 2.526 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2C(=O)OCCn2ccc([N+](=O)[O-])n2)c1 ZINC001319056476 1045006195 /nfs/dbraw/zinc/00/61/95/1045006195.db2.gz ORNJZFGMQDURTK-KRWDZBQOSA-N 1 1 372.425 2.698 20 5 FFBDMO Cc1cccc(C[N@H+]2CCCC[C@H]2C(=O)OCCn2ccc([N+](=O)[O-])n2)c1 ZINC001319056476 1045006207 /nfs/dbraw/zinc/00/62/07/1045006207.db2.gz ORNJZFGMQDURTK-KRWDZBQOSA-N 1 1 372.425 2.698 20 5 FFBDMO Cc1cc(N[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001319503948 1045176384 /nfs/dbraw/zinc/17/63/84/1045176384.db2.gz BAMCOCMZSBXSQV-YVEFUNNKSA-N 1 1 353.426 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001321114602 1045551517 /nfs/dbraw/zinc/55/15/17/1045551517.db2.gz YFGYKTMTBQFIQY-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001321114602 1045551532 /nfs/dbraw/zinc/55/15/32/1045551532.db2.gz YFGYKTMTBQFIQY-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC001322221605 1046001062 /nfs/dbraw/zinc/00/10/62/1046001062.db2.gz HJAFDULSYLSOLF-CRAIPNDOSA-N 1 1 374.437 2.906 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCCC4(CC[NH2+]CC4)C3)n2)cc1 ZINC001326584331 1046989142 /nfs/dbraw/zinc/98/91/42/1046989142.db2.gz WRWVYMGFFLHPDS-UHFFFAOYSA-N 1 1 357.414 2.610 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001328186922 1048216435 /nfs/dbraw/zinc/21/64/35/1048216435.db2.gz VQDPJYAFXWPNNW-NVXWUHKLSA-N 1 1 373.388 2.883 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC001290803575 1048399444 /nfs/dbraw/zinc/39/94/44/1048399444.db2.gz NGGMYPZUXPSCSG-INIZCTEOSA-N 1 1 354.410 2.693 20 5 FFBDMO C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001332718777 1048525853 /nfs/dbraw/zinc/52/58/53/1048525853.db2.gz USSKWYINLXSSGM-SJCJKPOMSA-N 1 1 366.801 2.826 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001334076710 1049233852 /nfs/dbraw/zinc/23/38/52/1049233852.db2.gz XHZABKGTKIMUAS-UHFFFAOYSA-N 1 1 368.409 2.556 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001296059326 1050017494 /nfs/dbraw/zinc/01/74/94/1050017494.db2.gz CHFNVKAPGGSXCX-QGZVFWFLSA-N 1 1 370.457 2.936 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@H](C)[N+](=O)[O-])n2Cc2ccccc2)C[C@@H]1C ZINC001342144904 1050739337 /nfs/dbraw/zinc/73/93/37/1050739337.db2.gz OVQZCUWABBTDJB-JYJNAYRXSA-N 1 1 372.473 2.583 20 5 FFBDMO C[C@@H](NC(=O)[C@]1([NH+](C)C)COc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC001303302273 1051325721 /nfs/dbraw/zinc/32/57/21/1051325721.db2.gz ANVMYOAZSNUJQG-JLTOFOAXSA-N 1 1 369.421 2.708 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCC2)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001303551493 1051383190 /nfs/dbraw/zinc/38/31/90/1051383190.db2.gz VOCOTYAKVQZWSB-UHFFFAOYSA-N 1 1 363.377 2.730 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1Cc2cccnc2C1 ZINC001345006774 1052194307 /nfs/dbraw/zinc/19/43/07/1052194307.db2.gz MKBZZWAWDKPJJP-AEFFLSMTSA-N 1 1 367.405 2.522 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1Cc2cccnc2C1 ZINC001345006774 1052194313 /nfs/dbraw/zinc/19/43/13/1052194313.db2.gz MKBZZWAWDKPJJP-AEFFLSMTSA-N 1 1 367.405 2.522 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])cc1C(F)(F)F ZINC001307227609 1052272076 /nfs/dbraw/zinc/27/20/76/1052272076.db2.gz IVTJVYWUTSJWBV-KGLIPLIRSA-N 1 1 373.375 2.957 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCCC[C@H]2CO)o1 ZINC001307413841 1052304866 /nfs/dbraw/zinc/30/48/66/1052304866.db2.gz AZISCTPZTWCYON-NSHDSACASA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCCC[C@H]2CO)o1 ZINC001307413841 1052304873 /nfs/dbraw/zinc/30/48/73/1052304873.db2.gz AZISCTPZTWCYON-NSHDSACASA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)o1 ZINC001307421878 1052305051 /nfs/dbraw/zinc/30/50/51/1052305051.db2.gz CXNUGGBIEXADOL-CYBMUJFWSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)o1 ZINC001307421878 1052305056 /nfs/dbraw/zinc/30/50/56/1052305056.db2.gz CXNUGGBIEXADOL-CYBMUJFWSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@H]3COC4(CCCCC4)O3)C2)nc1 ZINC001307544204 1052319819 /nfs/dbraw/zinc/31/98/19/1052319819.db2.gz DPRQZOCNYYDXKJ-HOCLYGCPSA-N 1 1 362.430 2.552 20 5 FFBDMO C[N@H+](CCOCCNC(=O)OC(C)(C)C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC001307993307 1052378808 /nfs/dbraw/zinc/37/88/08/1052378808.db2.gz UWVRBBHNGGEFRD-UHFFFAOYSA-N 1 1 371.409 2.707 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC001307993307 1052378810 /nfs/dbraw/zinc/37/88/10/1052378810.db2.gz UWVRBBHNGGEFRD-UHFFFAOYSA-N 1 1 371.409 2.707 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ncccn2)CC1 ZINC001308090924 1052404375 /nfs/dbraw/zinc/40/43/75/1052404375.db2.gz NQZDQBPDTVPFBQ-ZDUSSCGKSA-N 1 1 355.398 2.591 20 5 FFBDMO COC(=O)[C@@H]1[C@@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1(F)F ZINC001308774211 1052497959 /nfs/dbraw/zinc/49/79/59/1052497959.db2.gz QTDPQVVMCINCAI-CFVMTHIKSA-N 1 1 354.353 2.829 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CN(C)CCN1C ZINC001308949275 1052525067 /nfs/dbraw/zinc/52/50/67/1052525067.db2.gz XPOVVTKPVNKLNI-HZMBPMFUSA-N 1 1 361.273 2.626 20 5 FFBDMO CCc1ccc(S(=O)(=O)NCC[N@@H+]2CCCC[C@H]2CC)cc1[N+](=O)[O-] ZINC001309175602 1052567394 /nfs/dbraw/zinc/56/73/94/1052567394.db2.gz VFWFFWNMAKUADF-OAHLLOKOSA-N 1 1 369.487 2.700 20 5 FFBDMO C[N@@H+]1C[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830719 1054265750 /nfs/dbraw/zinc/26/57/50/1054265750.db2.gz UTQGAWRZPRUCNC-HOJAQTOUSA-N 1 1 355.438 2.563 20 5 FFBDMO C[N@H+]1C[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830719 1054265765 /nfs/dbraw/zinc/26/57/65/1054265765.db2.gz UTQGAWRZPRUCNC-HOJAQTOUSA-N 1 1 355.438 2.563 20 5 FFBDMO CN1C[C@@H](C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830719 1054265781 /nfs/dbraw/zinc/26/57/81/1054265781.db2.gz UTQGAWRZPRUCNC-HOJAQTOUSA-N 1 1 355.438 2.563 20 5 FFBDMO C[C@H](CO)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC001348442329 1054697097 /nfs/dbraw/zinc/69/70/97/1054697097.db2.gz MTLOFFSDRJTKNJ-OAHLLOKOSA-N 1 1 357.410 2.806 20 5 FFBDMO Cc1cc(CCC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)no1 ZINC001348542948 1054777216 /nfs/dbraw/zinc/77/72/16/1054777216.db2.gz LCLGBXVAQHJBNE-KRWDZBQOSA-N 1 1 359.382 2.642 20 5 FFBDMO Cc1cc(CCC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)no1 ZINC001348542948 1054777231 /nfs/dbraw/zinc/77/72/31/1054777231.db2.gz LCLGBXVAQHJBNE-KRWDZBQOSA-N 1 1 359.382 2.642 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)c4cc(F)c([N+](=O)[O-])cc4F)C[C@]2(C1)CCCC3 ZINC001337663516 1054929083 /nfs/dbraw/zinc/92/90/83/1054929083.db2.gz ZIZPRFISBOFULI-HDICACEKSA-N 1 1 365.380 2.821 20 5 FFBDMO Cc1c(C(=O)OCc2ncc(C)c([N+](=O)[O-])c2C)cnn1-c1cc[nH+]cc1 ZINC001338880325 1055899038 /nfs/dbraw/zinc/89/90/38/1055899038.db2.gz KEVQVWMZLDAOLL-UHFFFAOYSA-N 1 1 367.365 2.853 20 5 FFBDMO CN(C)c1nc(NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc[nH+]1 ZINC000610128300 1056427518 /nfs/dbraw/zinc/42/75/18/1056427518.db2.gz QDPMBMZXHBSGLX-UHFFFAOYSA-N 1 1 370.335 2.994 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC001339467746 1056483425 /nfs/dbraw/zinc/48/34/25/1056483425.db2.gz QRPSXYHQRRMMCU-UHFFFAOYSA-N 1 1 374.445 2.921 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@H+](C)CCO1 ZINC000619527317 1056556611 /nfs/dbraw/zinc/55/66/11/1056556611.db2.gz HHABEHLAVPCCIL-WBMJQRKESA-N 1 1 360.389 2.927 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@@H+](C)CCO1 ZINC000619527317 1056556622 /nfs/dbraw/zinc/55/66/22/1056556622.db2.gz HHABEHLAVPCCIL-WBMJQRKESA-N 1 1 360.389 2.927 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)OCC[C@@H]2CC[N@H+](C)C2)c1 ZINC000847819789 1056678165 /nfs/dbraw/zinc/67/81/65/1056678165.db2.gz SOEYBOJEGOZCAR-HNNXBMFYSA-N 1 1 372.425 2.647 20 5 FFBDMO O=C(/C=C/c1nccs1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001514774429 1059089336 /nfs/dbraw/zinc/08/93/36/1059089336.db2.gz JIPBQFPTQBKDON-RGDDUWESSA-N 1 1 359.407 2.882 20 5 FFBDMO O=C(/C=C/c1nccs1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001514774429 1059089355 /nfs/dbraw/zinc/08/93/55/1059089355.db2.gz JIPBQFPTQBKDON-RGDDUWESSA-N 1 1 359.407 2.882 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1cc(Cl)ccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001505811603 1059405678 /nfs/dbraw/zinc/40/56/78/1059405678.db2.gz NGUOZUBVZZQYOB-UKRRQHHQSA-N 1 1 371.840 2.719 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC(n3ccnc3)CC2)c1 ZINC000848478057 1060100657 /nfs/dbraw/zinc/10/06/57/1060100657.db2.gz BAAXDSPMFAJRAU-UHFFFAOYSA-N 1 1 352.398 2.949 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482646 1060121262 /nfs/dbraw/zinc/12/12/62/1060121262.db2.gz SHTJDKNVAGDHPO-QZTJIDSGSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482646 1060121267 /nfs/dbraw/zinc/12/12/67/1060121267.db2.gz SHTJDKNVAGDHPO-QZTJIDSGSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1C1CCOCC1 ZINC000848484341 1060123434 /nfs/dbraw/zinc/12/34/34/1060123434.db2.gz ZAQKVUIIKRBZNG-OALUTQOASA-N 1 1 373.453 2.759 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1CN1CC[C@@H](c3ccc([N+](=O)[O-])cc3)C1=O)CCOCC2 ZINC000848489101 1060143373 /nfs/dbraw/zinc/14/33/73/1060143373.db2.gz JCZROMWSYNDSHK-QAPCUYQASA-N 1 1 373.453 2.759 20 5 FFBDMO CC(C)(C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC001517124900 1060356042 /nfs/dbraw/zinc/35/60/42/1060356042.db2.gz PVLALCZWYAFWRV-QGZVFWFLSA-N 1 1 362.426 2.669 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC001460715083 1061072686 /nfs/dbraw/zinc/07/26/86/1061072686.db2.gz BOYRGCCYSPYHCI-AWEZNQCLSA-N 1 1 363.414 2.507 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC001460715083 1061072702 /nfs/dbraw/zinc/07/27/02/1061072702.db2.gz BOYRGCCYSPYHCI-AWEZNQCLSA-N 1 1 363.414 2.507 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2Cc2ccnn2C)cccc1[N+](=O)[O-] ZINC001460970288 1061171246 /nfs/dbraw/zinc/17/12/46/1061171246.db2.gz FNAKVWCKUVDXQH-INIZCTEOSA-N 1 1 371.441 2.672 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc4scnc4c3)CC2)cn1 ZINC001461926979 1061454058 /nfs/dbraw/zinc/45/40/58/1061454058.db2.gz LTCJCKSWKPKKIC-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2cc[nH+]cc2)c1 ZINC001361146873 1062104702 /nfs/dbraw/zinc/10/47/02/1062104702.db2.gz SHXKHXYHXOCWJB-UHFFFAOYSA-N 1 1 365.393 2.928 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC001493859293 1063239048 /nfs/dbraw/zinc/23/90/48/1063239048.db2.gz QHEZDGOJTJARQE-HUUCEWRRSA-N 1 1 361.433 2.694 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC001493859293 1063239069 /nfs/dbraw/zinc/23/90/69/1063239069.db2.gz QHEZDGOJTJARQE-HUUCEWRRSA-N 1 1 361.433 2.694 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC001493859293 1063239092 /nfs/dbraw/zinc/23/90/92/1063239092.db2.gz QHEZDGOJTJARQE-HUUCEWRRSA-N 1 1 361.433 2.694 20 5 FFBDMO O=C(c1ccn(-c2cc[nH+]cc2)n1)N1CCc2c1ccc([N+](=O)[O-])c2F ZINC001533799202 1063410940 /nfs/dbraw/zinc/41/09/40/1063410940.db2.gz NIMYXGCOSLMABP-UHFFFAOYSA-N 1 1 353.313 2.518 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[NH2+]2)cc1 ZINC001467501683 1063761757 /nfs/dbraw/zinc/76/17/57/1063761757.db2.gz FKNKSVBWVMOGPA-GOSISDBHSA-N 1 1 354.410 2.526 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@@H+](Cc2ccccc2)CCOCC1 ZINC001472131881 1064945304 /nfs/dbraw/zinc/94/53/04/1064945304.db2.gz NRUBURSAVYBJMS-UHFFFAOYSA-N 1 1 373.409 2.553 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC001472878164 1065165971 /nfs/dbraw/zinc/16/59/71/1065165971.db2.gz JQUXPCIPLHOEPH-ZDUSSCGKSA-N 1 1 362.430 2.538 20 5 FFBDMO CCc1cc(NCc2[nH]c(C)[nH+]c2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001472880895 1065166609 /nfs/dbraw/zinc/16/66/09/1065166609.db2.gz DRRIABWRLPVMDN-UHFFFAOYSA-N 1 1 352.398 2.988 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCO[C@@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC001473769552 1065352545 /nfs/dbraw/zinc/35/25/45/1065352545.db2.gz VJDJLAIFTWCTRS-HDMKZQKVSA-N 1 1 363.458 2.957 20 5 FFBDMO Cc1ccc2nc(NC(=O)[C@@](C)([NH3+])c3cccc([N+](=O)[O-])c3)sc2n1 ZINC001579742169 1078672962 /nfs/dbraw/zinc/67/29/62/1078672962.db2.gz IQYZIELPUDXJRG-INIZCTEOSA-N 1 1 357.395 2.721 20 5 FFBDMO C[N@H+](CCc1cnccn1)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559703058 1076184331 /nfs/dbraw/zinc/18/43/31/1076184331.db2.gz LGUHBAHWIKAZAL-UHFFFAOYSA-N 1 1 374.788 2.763 20 5 FFBDMO C[N@@H+](CCc1cnccn1)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559703058 1076184335 /nfs/dbraw/zinc/18/43/35/1076184335.db2.gz LGUHBAHWIKAZAL-UHFFFAOYSA-N 1 1 374.788 2.763 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc2cc[nH]c2c1 ZINC001559831625 1076195086 /nfs/dbraw/zinc/19/50/86/1076195086.db2.gz YVNWWWCICYKTHF-KRWDZBQOSA-N 1 1 369.421 2.990 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC001560034811 1076214950 /nfs/dbraw/zinc/21/49/50/1076214950.db2.gz DUDWVKYZRYCSQJ-CQSZACIVSA-N 1 1 358.398 2.793 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3cc(O)ccc3C2)cccc1[N+](=O)[O-] ZINC001560240808 1076254814 /nfs/dbraw/zinc/25/48/14/1076254814.db2.gz VZEMXSOBLPETTQ-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO C[C@H](O)C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@@H](C)C1 ZINC001563396347 1076550665 /nfs/dbraw/zinc/55/06/65/1076550665.db2.gz UMXGCKZEIZTPPA-KBPBESRZSA-N 1 1 372.425 2.667 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@@H](C)C1 ZINC001563396347 1076550669 /nfs/dbraw/zinc/55/06/69/1076550669.db2.gz UMXGCKZEIZTPPA-KBPBESRZSA-N 1 1 372.425 2.667 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001585856662 1079506062 /nfs/dbraw/zinc/50/60/62/1079506062.db2.gz XMIUTHPLCHFMDG-GFCCVEGCSA-N 1 1 357.863 2.941 20 5 FFBDMO Cc1ccccc1[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[NH2+]1 ZINC001586591168 1079653783 /nfs/dbraw/zinc/65/37/83/1079653783.db2.gz ZKIDRGGLMLIYFS-KRWDZBQOSA-N 1 1 373.384 2.594 20 5 FFBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001590045881 1080972520 /nfs/dbraw/zinc/97/25/20/1080972520.db2.gz FNFGUTXEYIVOOM-CYBMUJFWSA-N 1 1 368.397 2.847 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590152954 1081053842 /nfs/dbraw/zinc/05/38/42/1081053842.db2.gz IFLDRTUVQVSYTG-IBGZPJMESA-N 1 1 364.409 2.939 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000368867765 512110006 /nfs/dbraw/zinc/11/00/06/512110006.db2.gz JWXPNZHHGRZFPS-KRWDZBQOSA-N 1 1 361.398 2.870 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093769974 250044585 /nfs/dbraw/zinc/04/45/85/250044585.db2.gz YVAVLNHUOHCSAY-OAHLLOKOSA-N 1 1 357.458 2.769 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103186625 250138814 /nfs/dbraw/zinc/13/88/14/250138814.db2.gz FUSOFNMPZNRAJP-LLVKDONJSA-N 1 1 353.444 2.539 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000106786911 250289648 /nfs/dbraw/zinc/28/96/48/250289648.db2.gz VKUZMTKSZQSXQU-CQSZACIVSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000181150247 251248413 /nfs/dbraw/zinc/24/84/13/251248413.db2.gz WZVRVQGGFGACBF-CQSZACIVSA-N 1 1 356.426 2.817 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000272417426 252032446 /nfs/dbraw/zinc/03/24/46/252032446.db2.gz GSTKPRZBGBSCDU-DZGCQCFKSA-N 1 1 371.441 2.521 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000272417431 252033584 /nfs/dbraw/zinc/03/35/84/252033584.db2.gz GSTKPRZBGBSCDU-HIFRSBDPSA-N 1 1 371.441 2.521 20 5 FFBDMO C[C@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272752246 252121589 /nfs/dbraw/zinc/12/15/89/252121589.db2.gz FBSYNZPCNGNNRZ-JTQLQIEISA-N 1 1 368.231 2.738 20 5 FFBDMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273467567 252312859 /nfs/dbraw/zinc/31/28/59/252312859.db2.gz IOGKGTBLISJIFO-WBMJQRKESA-N 1 1 364.423 2.875 20 5 FFBDMO Cc1nnc([C@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)s1 ZINC000275635007 256033544 /nfs/dbraw/zinc/03/35/44/256033544.db2.gz RDOOCQDKMRODNL-QMMMGPOBSA-N 1 1 353.379 2.573 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000278234249 256290288 /nfs/dbraw/zinc/29/02/88/256290288.db2.gz VLJAJURKCCWOGA-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983714 256263468 /nfs/dbraw/zinc/26/34/68/256263468.db2.gz UBQFEEOIVGIAGN-CYBMUJFWSA-N 1 1 373.400 2.787 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278356952 256303538 /nfs/dbraw/zinc/30/35/38/256303538.db2.gz ARULQZLWYIDGCN-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CCOc1cc(CN2CC[N@H+](C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000278608624 256330478 /nfs/dbraw/zinc/33/04/78/256330478.db2.gz JAYITBBRXIRQJE-OAHLLOKOSA-N 1 1 363.458 2.679 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000286116968 257021206 /nfs/dbraw/zinc/02/12/06/257021206.db2.gz UPBZIHOCPDBYHV-CZUORRHYSA-N 1 1 350.415 2.977 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC000286857156 257058616 /nfs/dbraw/zinc/05/86/16/257058616.db2.gz MREJXVMGTLGMSI-QWHCGFSZSA-N 1 1 362.430 2.841 20 5 FFBDMO COCC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccn1 ZINC000287219502 257078133 /nfs/dbraw/zinc/07/81/33/257078133.db2.gz FKTUFIOBAOVENC-UHFFFAOYSA-N 1 1 361.398 2.526 20 5 FFBDMO COCC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccn1 ZINC000287219502 257078134 /nfs/dbraw/zinc/07/81/34/257078134.db2.gz FKTUFIOBAOVENC-UHFFFAOYSA-N 1 1 361.398 2.526 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC(F)(F)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000289368238 257277225 /nfs/dbraw/zinc/27/72/25/257277225.db2.gz AZEOLWDTGFUMKQ-NSHDSACASA-N 1 1 357.357 2.909 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000290053573 257313195 /nfs/dbraw/zinc/31/31/95/257313195.db2.gz XFUVCXKIRAKPLC-HNNXBMFYSA-N 1 1 357.414 2.684 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F ZINC000289557537 257287183 /nfs/dbraw/zinc/28/71/83/257287183.db2.gz UVJYOSIECOUMMU-CYBMUJFWSA-N 1 1 359.348 2.528 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000290585766 257343953 /nfs/dbraw/zinc/34/39/53/257343953.db2.gz WPYNMRUFSUHAOP-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293094477 257531538 /nfs/dbraw/zinc/53/15/38/257531538.db2.gz PSPCZOZMTFWXMN-IBGZPJMESA-N 1 1 363.458 2.962 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NCCCC[N@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-] ZINC000295408324 257631197 /nfs/dbraw/zinc/63/11/97/257631197.db2.gz CZNJHDBNQLXRHX-ZDUSSCGKSA-N 1 1 369.849 2.523 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC000298744301 257937659 /nfs/dbraw/zinc/93/76/59/257937659.db2.gz SIQLNNHXYGRFKA-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301109713 258026401 /nfs/dbraw/zinc/02/64/01/258026401.db2.gz SCVHEPWTLFHNJR-MJBXVCDLSA-N 1 1 369.487 2.777 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301186431 258032734 /nfs/dbraw/zinc/03/27/34/258032734.db2.gz KGFSBBWGEWGJNR-SFHVURJKSA-N 1 1 369.469 2.749 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Br)C[NH+]1CCOCC1 ZINC000301393170 258046879 /nfs/dbraw/zinc/04/68/79/258046879.db2.gz IYOZZWTZSDNDNQ-LLVKDONJSA-N 1 1 358.236 2.738 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1cccnc1)C1CC1 ZINC000299694244 258017223 /nfs/dbraw/zinc/01/72/23/258017223.db2.gz ODPNYFXTJWRBBU-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000302177207 258093126 /nfs/dbraw/zinc/09/31/26/258093126.db2.gz OVEAETJKHVPBBF-AUUYWEPGSA-N 1 1 368.437 2.887 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000302494060 258104224 /nfs/dbraw/zinc/10/42/24/258104224.db2.gz ATKVBVCDEFMLGP-OAHLLOKOSA-N 1 1 370.453 2.938 20 5 FFBDMO Cc1cc(N2CCC(Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000301520317 258053862 /nfs/dbraw/zinc/05/38/62/258053862.db2.gz DBNWRDCMNQBHAZ-UHFFFAOYSA-N 1 1 372.385 2.991 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000301826374 258069639 /nfs/dbraw/zinc/06/96/39/258069639.db2.gz JEEOUYIKFUQJAT-SJLPKXTDSA-N 1 1 372.400 2.951 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301878827 258072791 /nfs/dbraw/zinc/07/27/91/258072791.db2.gz JKUUSJZCPJZXSP-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NC[C@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000331902195 258205213 /nfs/dbraw/zinc/20/52/13/258205213.db2.gz WFDDCNBKCWLWLC-HUUCEWRRSA-N 1 1 360.458 2.513 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NC[C@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000331902198 258205255 /nfs/dbraw/zinc/20/52/55/258205255.db2.gz WFDDCNBKCWLWLC-LSDHHAIUSA-N 1 1 360.458 2.513 20 5 FFBDMO Cc1c(NC(=O)CCN2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000332008721 258209992 /nfs/dbraw/zinc/20/99/92/258209992.db2.gz JSUQEZANNSMVID-HOCLYGCPSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332263454 258222219 /nfs/dbraw/zinc/22/22/19/258222219.db2.gz DWEFOFFVOWHERZ-RYUDHWBXSA-N 1 1 355.341 2.553 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC[C@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000373058576 512152174 /nfs/dbraw/zinc/15/21/74/512152174.db2.gz NZNWMSKUJOOSFB-HNNXBMFYSA-N 1 1 371.441 2.851 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000052862430 506268629 /nfs/dbraw/zinc/26/86/29/506268629.db2.gz KXIHUJZNKMGKKU-CQSZACIVSA-N 1 1 373.413 2.803 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)cn1 ZINC000065728235 506352250 /nfs/dbraw/zinc/35/22/50/506352250.db2.gz MHOVQYXKKLTKKG-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000375153278 512185876 /nfs/dbraw/zinc/18/58/76/512185876.db2.gz OVDUGUNBEKCTON-OAHLLOKOSA-N 1 1 370.409 2.502 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000375153278 512185881 /nfs/dbraw/zinc/18/58/81/512185881.db2.gz OVDUGUNBEKCTON-OAHLLOKOSA-N 1 1 370.409 2.502 20 5 FFBDMO CCc1ccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000373236402 512234334 /nfs/dbraw/zinc/23/43/34/512234334.db2.gz IGOYZLYAVKMMNL-UHFFFAOYSA-N 1 1 357.414 2.629 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000375303298 512258088 /nfs/dbraw/zinc/25/80/88/512258088.db2.gz NTUZFFYZUPKKMK-LJQANCHMSA-N 1 1 356.426 2.998 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000054677495 506601206 /nfs/dbraw/zinc/60/12/06/506601206.db2.gz LKCMXDVRTVYUNV-LBPRGKRZSA-N 1 1 360.370 2.532 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000054677495 506601209 /nfs/dbraw/zinc/60/12/09/506601209.db2.gz LKCMXDVRTVYUNV-LBPRGKRZSA-N 1 1 360.370 2.532 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NCc1c[nH+]c2n1CCCC2 ZINC000375378575 512293622 /nfs/dbraw/zinc/29/36/22/512293622.db2.gz MRPMOBDAKLTBJF-UHFFFAOYSA-N 1 1 366.780 2.779 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043238267 506719352 /nfs/dbraw/zinc/71/93/52/506719352.db2.gz DOQOCNSGEDLCEV-KRWDZBQOSA-N 1 1 354.410 2.669 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000067702718 506981437 /nfs/dbraw/zinc/98/14/37/506981437.db2.gz ZUUAVECJBOJYSN-IJEWVQPXSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000067702718 506981447 /nfs/dbraw/zinc/98/14/47/506981447.db2.gz ZUUAVECJBOJYSN-IJEWVQPXSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[NH+](Cc2ccccc2)CC1 ZINC000016445814 507091279 /nfs/dbraw/zinc/09/12/79/507091279.db2.gz WOJPSVVJFMLZFO-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000017281876 507118965 /nfs/dbraw/zinc/11/89/65/507118965.db2.gz NVTANQCKHXPNMZ-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000047174252 507275593 /nfs/dbraw/zinc/27/55/93/507275593.db2.gz ZISYAJRRFQSUCH-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000047866280 507403158 /nfs/dbraw/zinc/40/31/58/507403158.db2.gz RRIABKARQUPZHH-UHFFFAOYSA-N 1 1 369.328 2.913 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CCc2ccccc21 ZINC000026915679 507620756 /nfs/dbraw/zinc/62/07/56/507620756.db2.gz IYYVDXBOSQZJIJ-OAHLLOKOSA-N 1 1 369.377 2.881 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CCc2ccccc21 ZINC000026915679 507620765 /nfs/dbraw/zinc/62/07/65/507620765.db2.gz IYYVDXBOSQZJIJ-OAHLLOKOSA-N 1 1 369.377 2.881 20 5 FFBDMO COC(=O)CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000050962344 507722747 /nfs/dbraw/zinc/72/27/47/507722747.db2.gz GKEFXIGQQDODCG-UHFFFAOYSA-N 1 1 371.393 2.599 20 5 FFBDMO COC(=O)CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000050962344 507722749 /nfs/dbraw/zinc/72/27/49/507722749.db2.gz GKEFXIGQQDODCG-UHFFFAOYSA-N 1 1 371.393 2.599 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000063645636 507754572 /nfs/dbraw/zinc/75/45/72/507754572.db2.gz CPJFMVVEMDSRLV-AWEZNQCLSA-N 1 1 367.421 2.884 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000029207973 507768478 /nfs/dbraw/zinc/76/84/78/507768478.db2.gz FCVCLQDSZZKDLM-QGZVFWFLSA-N 1 1 363.458 2.770 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000029208020 507768695 /nfs/dbraw/zinc/76/86/95/507768695.db2.gz SSTVYBSVJQNOCD-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000029622289 507784517 /nfs/dbraw/zinc/78/45/17/507784517.db2.gz OGEZRCNGRUEPFN-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000031542251 507820077 /nfs/dbraw/zinc/82/00/77/507820077.db2.gz URTDOHVDQCEZLG-KRWDZBQOSA-N 1 1 369.421 2.754 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCN(C)c1ccccc1 ZINC000107682994 507862889 /nfs/dbraw/zinc/86/28/89/507862889.db2.gz BIWPRZSSEZRFSB-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCN(C)c1ccccc1 ZINC000107682994 507862891 /nfs/dbraw/zinc/86/28/91/507862891.db2.gz BIWPRZSSEZRFSB-UHFFFAOYSA-N 1 1 356.426 2.910 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089891304 507879478 /nfs/dbraw/zinc/87/94/78/507879478.db2.gz VRXFGACAGNEZGV-OAHLLOKOSA-N 1 1 372.425 2.988 20 5 FFBDMO Cc1cnc(N[C@@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667438 507895249 /nfs/dbraw/zinc/89/52/49/507895249.db2.gz FRKPJFSYZDQZLS-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cnc(N[C@@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667438 507895252 /nfs/dbraw/zinc/89/52/52/507895252.db2.gz FRKPJFSYZDQZLS-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000090004486 507900261 /nfs/dbraw/zinc/90/02/61/507900261.db2.gz RQFILFRXCUVBEG-AWEZNQCLSA-N 1 1 372.425 2.650 20 5 FFBDMO C[C@H](c1ccncc1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000091990419 508031482 /nfs/dbraw/zinc/03/14/82/508031482.db2.gz QYAXJHLXWCWFBF-CYBMUJFWSA-N 1 1 356.382 2.981 20 5 FFBDMO COCCOc1cccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000092047828 508037774 /nfs/dbraw/zinc/03/77/74/508037774.db2.gz HIVCTTLBUHNPFK-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cc1nn(C)c(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)c1[N+](=O)[O-] ZINC000092406533 508068793 /nfs/dbraw/zinc/06/87/93/508068793.db2.gz CAWALWNKAVCVIB-UHFFFAOYSA-N 1 1 357.414 2.861 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000080959063 508117226 /nfs/dbraw/zinc/11/72/26/508117226.db2.gz MEHFGGDUIYGDQQ-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000112926997 508234828 /nfs/dbraw/zinc/23/48/28/508234828.db2.gz WIAPAIVBUJATCC-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO Cn1c(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000083219618 508241912 /nfs/dbraw/zinc/24/19/12/508241912.db2.gz ZZSWFRKCVDKCFJ-UHFFFAOYSA-N 1 1 367.409 2.942 20 5 FFBDMO Cn1c(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)nc2ccccc21 ZINC000083219618 508241915 /nfs/dbraw/zinc/24/19/15/508241915.db2.gz ZZSWFRKCVDKCFJ-UHFFFAOYSA-N 1 1 367.409 2.942 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2)C[C@@H](O)c2ccco2)c1 ZINC000084135373 508266863 /nfs/dbraw/zinc/26/68/63/508266863.db2.gz OMXZSIPASAAJBS-QGZVFWFLSA-N 1 1 356.382 2.620 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000114459512 508316743 /nfs/dbraw/zinc/31/67/43/508316743.db2.gz RCNQARJNFKIDOW-JKSUJKDBSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000114644111 508333617 /nfs/dbraw/zinc/33/36/17/508333617.db2.gz POJZPQKPMRASQY-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1cccc2[nH+]c(Cn3cc([N+](=O)[O-])cc(Br)c3=O)cn21 ZINC000127606363 508475822 /nfs/dbraw/zinc/47/58/22/508475822.db2.gz ZHSPUGBXKNMUTQ-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000116277632 508493515 /nfs/dbraw/zinc/49/35/15/508493515.db2.gz LORXTFDEKJUGMV-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO O=C(COc1ccccc1C[NH2+]Cc1ccccc1[N+](=O)[O-])NCC1CC1 ZINC000116335055 508501153 /nfs/dbraw/zinc/50/11/53/508501153.db2.gz WDNACMGWNXZTIW-UHFFFAOYSA-N 1 1 369.421 2.790 20 5 FFBDMO Cc1ccc(S(=O)(=O)C[C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000152732614 508504611 /nfs/dbraw/zinc/50/46/11/508504611.db2.gz UWQFAWAXWXDFOY-LBPRGKRZSA-N 1 1 354.453 2.917 20 5 FFBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000134247214 508513100 /nfs/dbraw/zinc/51/31/00/508513100.db2.gz IRJXCKHXGSZTJB-KPZWWZAWSA-N 1 1 355.394 2.518 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])c1 ZINC000122342604 508520194 /nfs/dbraw/zinc/52/01/94/508520194.db2.gz FLCKJRJFCIFRML-YOEHRIQHSA-N 1 1 360.414 2.762 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000117341906 508593786 /nfs/dbraw/zinc/59/37/86/508593786.db2.gz DKNYGRIUVMRTDD-CQSZACIVSA-N 1 1 363.414 2.641 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@H]2CCCC[C@@H]21 ZINC000117336569 508593863 /nfs/dbraw/zinc/59/38/63/508593863.db2.gz XIWMMXWTHROFSC-HOCLYGCPSA-N 1 1 361.398 2.536 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000157687613 508598253 /nfs/dbraw/zinc/59/82/53/508598253.db2.gz WORNPQPKRAEYJI-KRWDZBQOSA-N 1 1 358.394 2.749 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1CSC ZINC000135425355 508602103 /nfs/dbraw/zinc/60/21/03/508602103.db2.gz QCSSURBOOQYKSN-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000135437192 508604150 /nfs/dbraw/zinc/60/41/50/508604150.db2.gz HGCCPZYUAMVXMG-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000135437192 508604153 /nfs/dbraw/zinc/60/41/53/508604153.db2.gz HGCCPZYUAMVXMG-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+](CCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000158116469 508659293 /nfs/dbraw/zinc/65/92/93/508659293.db2.gz NEONUFSBZUANPN-UHFFFAOYSA-N 1 1 359.213 2.593 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1ccnc1 ZINC000136090477 508669240 /nfs/dbraw/zinc/66/92/40/508669240.db2.gz JXYLTASMCOKQSE-DYVFJYSZSA-N 1 1 358.398 2.741 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1ccnc1 ZINC000136090477 508669242 /nfs/dbraw/zinc/66/92/42/508669242.db2.gz JXYLTASMCOKQSE-DYVFJYSZSA-N 1 1 358.398 2.741 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000119097344 508724968 /nfs/dbraw/zinc/72/49/68/508724968.db2.gz OHXLOYAHYZXAAC-LLVKDONJSA-N 1 1 370.247 2.737 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000119104815 508726751 /nfs/dbraw/zinc/72/67/51/508726751.db2.gz APHOHUOUVISWHA-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C[N@H+]1C1CC1 ZINC000154241727 508744294 /nfs/dbraw/zinc/74/42/94/508744294.db2.gz IUVIJSUCHKKNRE-ZFWWWQNUSA-N 1 1 358.442 2.894 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000139626345 508792434 /nfs/dbraw/zinc/79/24/34/508792434.db2.gz ULRSCNBBVSLMLE-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000119423783 508793403 /nfs/dbraw/zinc/79/34/03/508793403.db2.gz ZUCIKJMHKHVHMX-LLVKDONJSA-N 1 1 368.397 2.622 20 5 FFBDMO CC(C)CO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000119503515 508808633 /nfs/dbraw/zinc/80/86/33/508808633.db2.gz RIKFIVOAFVTZQL-HNNXBMFYSA-N 1 1 363.414 2.640 20 5 FFBDMO CSc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000159215317 508808957 /nfs/dbraw/zinc/80/89/57/508808957.db2.gz BWSXAVWIXFMBHT-UHFFFAOYSA-N 1 1 372.450 2.983 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000119503362 508809328 /nfs/dbraw/zinc/80/93/28/508809328.db2.gz RIKFIVOAFVTZQL-OAHLLOKOSA-N 1 1 363.414 2.640 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000119701405 508846596 /nfs/dbraw/zinc/84/65/96/508846596.db2.gz OBVFGPVNMNDHLX-ACJLOTCBSA-N 1 1 357.385 2.984 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130898106 508862590 /nfs/dbraw/zinc/86/25/90/508862590.db2.gz VROQIODEBQJTCC-UHFFFAOYSA-N 1 1 365.389 2.855 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000159945633 508915168 /nfs/dbraw/zinc/91/51/68/508915168.db2.gz DLAAFODPUQCJBH-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000131378317 508923318 /nfs/dbraw/zinc/92/33/18/508923318.db2.gz IQLNCBIONWLVBB-HNNXBMFYSA-N 1 1 359.382 2.770 20 5 FFBDMO COCc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])o1 ZINC000131378317 508923323 /nfs/dbraw/zinc/92/33/23/508923323.db2.gz IQLNCBIONWLVBB-HNNXBMFYSA-N 1 1 359.382 2.770 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000131649093 508957108 /nfs/dbraw/zinc/95/71/08/508957108.db2.gz SQQBNEXGGBDPAG-CQSZACIVSA-N 1 1 351.422 2.905 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000120257223 508959586 /nfs/dbraw/zinc/95/95/86/508959586.db2.gz AIOASBYMSMLWDM-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155343642 508981430 /nfs/dbraw/zinc/98/14/30/508981430.db2.gz WPNPIWPFMAVVIH-PBHICJAKSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000160550024 509000991 /nfs/dbraw/zinc/00/09/91/509000991.db2.gz AKYPIWALGWKBLY-LBPRGKRZSA-N 1 1 352.387 2.858 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000132458811 509034675 /nfs/dbraw/zinc/03/46/75/509034675.db2.gz IKRCXYWSEHQKOK-KRWDZBQOSA-N 1 1 367.421 2.601 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000151530970 509037673 /nfs/dbraw/zinc/03/76/73/509037673.db2.gz FBMQAXGEJGOLIY-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO COc1ccc(CCC[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000125879147 509040220 /nfs/dbraw/zinc/04/02/20/509040220.db2.gz MAOKHCMWHOYRCJ-UHFFFAOYSA-N 1 1 357.410 2.767 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704387 509048581 /nfs/dbraw/zinc/04/85/81/509048581.db2.gz TXLLIBZEKBYGHF-HZPDHXFCSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704387 509048583 /nfs/dbraw/zinc/04/85/83/509048583.db2.gz TXLLIBZEKBYGHF-HZPDHXFCSA-N 1 1 365.430 2.677 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1ccco1 ZINC000161141849 509077007 /nfs/dbraw/zinc/07/70/07/509077007.db2.gz UIAYXXSZKAQRPE-INIZCTEOSA-N 1 1 358.398 2.558 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000120871582 509080135 /nfs/dbraw/zinc/08/01/35/509080135.db2.gz AGYJGDZJJFFLBK-QGZVFWFLSA-N 1 1 362.474 2.901 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121060117 509119929 /nfs/dbraw/zinc/11/99/29/509119929.db2.gz TVRFTIUBEAJWFY-ZDUSSCGKSA-N 1 1 368.231 2.571 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000161962978 509166653 /nfs/dbraw/zinc/16/66/53/509166653.db2.gz RPGCZWWTELYEOC-CQSZACIVSA-N 1 1 363.414 2.589 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000161962978 509166654 /nfs/dbraw/zinc/16/66/54/509166654.db2.gz RPGCZWWTELYEOC-CQSZACIVSA-N 1 1 363.414 2.589 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2c([N+](=O)[O-])cnn2C)cc1 ZINC000162104818 509172593 /nfs/dbraw/zinc/17/25/93/509172593.db2.gz BKCIHMLZNQYHOR-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1c([N+](=O)[O-])cnn1C ZINC000162185546 509175325 /nfs/dbraw/zinc/17/53/25/509175325.db2.gz VYLCORVOHGPTOH-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000162299233 509192865 /nfs/dbraw/zinc/19/28/65/509192865.db2.gz HYJYWBUASLZLIC-UHFFFAOYSA-N 1 1 372.450 2.739 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000195694044 509216988 /nfs/dbraw/zinc/21/69/88/509216988.db2.gz PQCDNSFZZYFNDH-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000162833165 509309131 /nfs/dbraw/zinc/30/91/31/509309131.db2.gz BCCPCCVWRDQJQK-UHFFFAOYSA-N 1 1 374.828 2.843 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182651316 509351105 /nfs/dbraw/zinc/35/11/05/509351105.db2.gz ULVRHVQOBIMIAC-OAHLLOKOSA-N 1 1 374.384 2.983 20 5 FFBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000182672693 509362097 /nfs/dbraw/zinc/36/20/97/509362097.db2.gz ZHGKZLSGISNYOV-CYBMUJFWSA-N 1 1 351.403 2.505 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000163320578 509362103 /nfs/dbraw/zinc/36/21/03/509362103.db2.gz UAQJYEJWDHPSGZ-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000163320578 509362111 /nfs/dbraw/zinc/36/21/11/509362111.db2.gz UAQJYEJWDHPSGZ-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cccc([N+](=O)[O-])c2N)cc1F ZINC000176182358 509364333 /nfs/dbraw/zinc/36/43/33/509364333.db2.gz PPEPHPCWXWLOSI-UHFFFAOYSA-N 1 1 369.356 2.740 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@@H+](CC(C)C)C1 ZINC000176253373 509404080 /nfs/dbraw/zinc/40/40/80/509404080.db2.gz WPPLPWDRFYPHSZ-CYBMUJFWSA-N 1 1 350.419 2.703 20 5 FFBDMO Cc1[nH+]ccn1C[C@H]1CCCN1c1ncc([N+](=O)[O-])cc1Br ZINC000267234128 509405092 /nfs/dbraw/zinc/40/50/92/509405092.db2.gz QPQHOEVSOBHXAW-LLVKDONJSA-N 1 1 366.219 2.926 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000176303347 509432249 /nfs/dbraw/zinc/43/22/49/509432249.db2.gz POLMIQQDEXREFH-AEFFLSMTSA-N 1 1 360.458 2.872 20 5 FFBDMO C[C@@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831130 509447182 /nfs/dbraw/zinc/44/71/82/509447182.db2.gz GUIWDXQROKXZCK-OLZOCXBDSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182831130 509447190 /nfs/dbraw/zinc/44/71/90/509447190.db2.gz GUIWDXQROKXZCK-OLZOCXBDSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831130 509447196 /nfs/dbraw/zinc/44/71/96/509447196.db2.gz GUIWDXQROKXZCK-OLZOCXBDSA-N 1 1 371.441 2.854 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@H](C)C1 ZINC000183022716 509552676 /nfs/dbraw/zinc/55/26/76/509552676.db2.gz HZJOUWBORSDOGD-RISCZKNCSA-N 1 1 371.384 2.999 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183089698 509590201 /nfs/dbraw/zinc/59/02/01/509590201.db2.gz UIVUYQOCRQDGGQ-YPMHNXCESA-N 1 1 369.368 2.895 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179917771 509672787 /nfs/dbraw/zinc/67/27/87/509672787.db2.gz CRDQBHBLLWWQQG-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179917771 509672794 /nfs/dbraw/zinc/67/27/94/509672794.db2.gz CRDQBHBLLWWQQG-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473471 509689050 /nfs/dbraw/zinc/68/90/50/509689050.db2.gz UWWDTJVYHQMCFH-YOEHRIQHSA-N 1 1 353.438 2.961 20 5 FFBDMO COc1ccc(OCC[N@@H+](C[C@@H](C)O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000173667885 509709174 /nfs/dbraw/zinc/70/91/74/509709174.db2.gz DUKXOQFWXZVUCJ-CQSZACIVSA-N 1 1 352.431 2.998 20 5 FFBDMO Cc1nc(C[NH+]2CCC(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000170685785 509721137 /nfs/dbraw/zinc/72/11/37/509721137.db2.gz HFFNPKYFWNREEL-UHFFFAOYSA-N 1 1 374.466 2.888 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1 ZINC000180098594 509751209 /nfs/dbraw/zinc/75/12/09/509751209.db2.gz QALPSCAZVBXVPE-WMZOPIPTSA-N 1 1 355.394 2.779 20 5 FFBDMO Cc1c([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cnn1C ZINC000183434371 509788271 /nfs/dbraw/zinc/78/82/71/509788271.db2.gz VXPQVPAOTQKRRU-VIFPVBQESA-N 1 1 351.794 2.579 20 5 FFBDMO CC1(C2CC[NH+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC2)OCCO1 ZINC000268174466 509796375 /nfs/dbraw/zinc/79/63/75/509796375.db2.gz VQMWCNAAMKVEOO-UHFFFAOYSA-N 1 1 374.397 2.620 20 5 FFBDMO COCC[N@@H+](C)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264992809 509812586 /nfs/dbraw/zinc/81/25/86/509812586.db2.gz XKWLXFQTTARCDW-UHFFFAOYSA-N 1 1 364.471 2.776 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H](C4OCCO4)C3)o2)c1 ZINC000170914849 509844777 /nfs/dbraw/zinc/84/47/77/509844777.db2.gz DIVLBMZWJNSUTQ-OAHLLOKOSA-N 1 1 373.409 2.877 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC000173928952 509860168 /nfs/dbraw/zinc/86/01/68/509860168.db2.gz FURMZUAJEFQFMG-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc(CN2CCC(OCC[NH+]3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000173946792 509870433 /nfs/dbraw/zinc/87/04/33/509870433.db2.gz NECSQXYLOYAZMW-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000268336891 509876221 /nfs/dbraw/zinc/87/62/21/509876221.db2.gz GEQYWZQDEIRWSE-GWCFXTLKSA-N 1 1 370.247 2.816 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)O1 ZINC000193401108 509899034 /nfs/dbraw/zinc/89/90/34/509899034.db2.gz DBIKXHMOXSGJRI-BETUJISGSA-N 1 1 373.400 2.737 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)O1 ZINC000193401108 509899040 /nfs/dbraw/zinc/89/90/40/509899040.db2.gz DBIKXHMOXSGJRI-BETUJISGSA-N 1 1 373.400 2.737 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000265205017 509920443 /nfs/dbraw/zinc/92/04/43/509920443.db2.gz KOKVVPWDSJSKIM-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000245437272 509933817 /nfs/dbraw/zinc/93/38/17/509933817.db2.gz DSEGCQSEGMBDPR-CHWSQXEVSA-N 1 1 368.865 2.849 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)c1 ZINC000193497241 509940895 /nfs/dbraw/zinc/94/08/95/509940895.db2.gz ZSSNEKFWCSQDHE-KRWDZBQOSA-N 1 1 356.426 2.746 20 5 FFBDMO COC(=O)c1cnc(NCCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000190166903 509982005 /nfs/dbraw/zinc/98/20/05/509982005.db2.gz ZROKELKVBYMYTQ-UHFFFAOYSA-N 1 1 370.409 2.637 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000261634999 510009961 /nfs/dbraw/zinc/00/99/61/510009961.db2.gz BEWUUIIKFSRBQL-SFHVURJKSA-N 1 1 369.421 2.709 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC(c4[nH]cc[nH+]4)CC3)n2)c1 ZINC000265460334 510067051 /nfs/dbraw/zinc/06/70/51/510067051.db2.gz FGSYNBQPVBLGLO-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174658038 510234903 /nfs/dbraw/zinc/23/49/03/510234903.db2.gz UPKCYKPQEWXJLJ-LBPRGKRZSA-N 1 1 359.213 2.591 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000174740435 510285276 /nfs/dbraw/zinc/28/52/76/510285276.db2.gz JPGQVJPDOLUNSU-XJKSGUPXSA-N 1 1 350.806 2.643 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([N+](=O)[O-])cc1F ZINC000184404231 510307295 /nfs/dbraw/zinc/30/72/95/510307295.db2.gz HDWHRHNQMYRHTH-CYBMUJFWSA-N 1 1 354.378 2.718 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000194398737 510345398 /nfs/dbraw/zinc/34/53/98/510345398.db2.gz YLLUBVBTXOOKIA-QGZVFWFLSA-N 1 1 363.458 2.770 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174949320 510401825 /nfs/dbraw/zinc/40/18/25/510401825.db2.gz OBFRAJSZWFTQRO-AWEZNQCLSA-N 1 1 359.430 2.809 20 5 FFBDMO CCc1nc([C@H](C)[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000184672115 510453296 /nfs/dbraw/zinc/45/32/96/510453296.db2.gz CITMZBWIAAJVEE-WCQYABFASA-N 1 1 351.428 2.704 20 5 FFBDMO CCc1nc([C@H](C)[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000184672074 510453438 /nfs/dbraw/zinc/45/34/38/510453438.db2.gz CITMZBWIAAJVEE-AAEUAGOBSA-N 1 1 351.428 2.704 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374403 510454715 /nfs/dbraw/zinc/45/47/15/510454715.db2.gz MCOLVTOKXHLXRB-KGLIPLIRSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374403 510454722 /nfs/dbraw/zinc/45/47/22/510454722.db2.gz MCOLVTOKXHLXRB-KGLIPLIRSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374403 510454728 /nfs/dbraw/zinc/45/47/28/510454728.db2.gz MCOLVTOKXHLXRB-KGLIPLIRSA-N 1 1 363.462 2.607 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246424217 510481701 /nfs/dbraw/zinc/48/17/01/510481701.db2.gz JXKKXJSJZSHVDP-DIFFPNOSSA-N 1 1 360.370 2.591 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](CO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000269614239 510484761 /nfs/dbraw/zinc/48/47/61/510484761.db2.gz SDQYSDIPMGLKSV-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](CO)c1ccccc1 ZINC000269628913 510489787 /nfs/dbraw/zinc/48/97/87/510489787.db2.gz VUFUXKIEGJUEAN-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO COc1cc(C[NH+]2[C@H](C)CC(O)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000191138398 510520517 /nfs/dbraw/zinc/52/05/17/510520517.db2.gz FRNYQYVOZAYHED-NXEZZACHSA-N 1 1 360.357 2.939 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCC[C@H]1O ZINC000246535365 510541690 /nfs/dbraw/zinc/54/16/90/510541690.db2.gz LBXJJXJFPFEYRV-UEKVPHQBSA-N 1 1 355.822 2.668 20 5 FFBDMO CC[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000184921414 510585997 /nfs/dbraw/zinc/58/59/97/510585997.db2.gz GPIXAQQGWDDNOM-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000184921414 510586004 /nfs/dbraw/zinc/58/60/04/510586004.db2.gz GPIXAQQGWDDNOM-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000194919852 510592223 /nfs/dbraw/zinc/59/22/23/510592223.db2.gz XBIOPFQUXWMNOW-IBGZPJMESA-N 1 1 361.442 2.765 20 5 FFBDMO CCc1n[nH]c(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000175384489 510619855 /nfs/dbraw/zinc/61/98/55/510619855.db2.gz GBQXMASUQZCCLL-ZDUSSCGKSA-N 1 1 359.430 2.521 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000246700390 510623563 /nfs/dbraw/zinc/62/35/63/510623563.db2.gz QWEJTTXHBFTWSO-XJKSGUPXSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000246700390 510623568 /nfs/dbraw/zinc/62/35/68/510623568.db2.gz QWEJTTXHBFTWSO-XJKSGUPXSA-N 1 1 351.472 2.874 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@H]1C[C@H](C)O ZINC000246707181 510626540 /nfs/dbraw/zinc/62/65/40/510626540.db2.gz NGVQRVTYZJITOK-TUAOUCFPSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCC[C@H]1C[C@H](C)O ZINC000246707181 510626549 /nfs/dbraw/zinc/62/65/49/510626549.db2.gz NGVQRVTYZJITOK-TUAOUCFPSA-N 1 1 355.822 2.811 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H](C)C1 ZINC000246722462 510637287 /nfs/dbraw/zinc/63/72/87/510637287.db2.gz GQPBEQCVSDLOQQ-STQMWFEESA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1cc(OC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC000185102571 510685569 /nfs/dbraw/zinc/68/55/69/510685569.db2.gz YMKAQARPWDBLDZ-INIZCTEOSA-N 1 1 360.385 2.840 20 5 FFBDMO CN(Cc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188302651 510698184 /nfs/dbraw/zinc/69/81/84/510698184.db2.gz IDESMPKPADQVRQ-HXUWFJFHSA-N 1 1 355.438 2.664 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182033579 510722331 /nfs/dbraw/zinc/72/23/31/510722331.db2.gz YBCGXCRPLKEUMI-PBHICJAKSA-N 1 1 360.410 2.603 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182157202 510787405 /nfs/dbraw/zinc/78/74/05/510787405.db2.gz ZDWXUBKTMSNEAW-QGZVFWFLSA-N 1 1 366.893 2.850 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182190522 510805975 /nfs/dbraw/zinc/80/59/75/510805975.db2.gz PIUPUZYXHHBYPI-INIZCTEOSA-N 1 1 360.410 2.654 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC000364579554 510951921 /nfs/dbraw/zinc/95/19/21/510951921.db2.gz LSHAJJXEIMIBGH-AWEZNQCLSA-N 1 1 367.833 2.714 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc(N)ccc1F)CCc1cccc([N+](=O)[O-])c1 ZINC000282417589 510968806 /nfs/dbraw/zinc/96/88/06/510968806.db2.gz JBODMSDJLOJKEF-UHFFFAOYSA-N 1 1 360.389 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000277737118 510970706 /nfs/dbraw/zinc/97/07/06/510970706.db2.gz KLKWETBLMHHZSK-WFASDCNBSA-N 1 1 362.348 2.999 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](N2CCCC2)C[C@H]1C ZINC000285599111 510971839 /nfs/dbraw/zinc/97/18/39/510971839.db2.gz PLYPOAPZQIIPDX-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](N2CCCC2)C[C@H]1C ZINC000285599111 510971844 /nfs/dbraw/zinc/97/18/44/510971844.db2.gz PLYPOAPZQIIPDX-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO CCOC(=O)C1CCC(O)(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000282545800 511020863 /nfs/dbraw/zinc/02/08/63/511020863.db2.gz WLEGLPSJADPQGY-UHFFFAOYSA-N 1 1 364.442 2.554 20 5 FFBDMO CN(c1ncc(Br)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286501904 511026813 /nfs/dbraw/zinc/02/68/13/511026813.db2.gz WNFTVBOJPFYZBY-FOSCPWQOSA-N 1 1 355.236 2.814 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)Cc1ccncc1 ZINC000270972319 511043568 /nfs/dbraw/zinc/04/35/68/511043568.db2.gz CZOGOLUZHCCJDG-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCn3c(Br)cnc3C2)cc1 ZINC000279377149 511062044 /nfs/dbraw/zinc/06/20/44/511062044.db2.gz XNPRVFMZJDJZKB-UHFFFAOYSA-N 1 1 351.204 2.612 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCn3c(Br)cnc3C2)cc1 ZINC000279377149 511062048 /nfs/dbraw/zinc/06/20/48/511062048.db2.gz XNPRVFMZJDJZKB-UHFFFAOYSA-N 1 1 351.204 2.612 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000279381561 511063155 /nfs/dbraw/zinc/06/31/55/511063155.db2.gz VAFJGJCBGCYDKB-ONGXEEELSA-N 1 1 355.797 2.671 20 5 FFBDMO CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@@H]1C[NH+]2CCC1CC2 ZINC000333017008 511177858 /nfs/dbraw/zinc/17/78/58/511177858.db2.gz CKENVBHGXZILLK-HXUWFJFHSA-N 1 1 361.445 2.848 20 5 FFBDMO CCC1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC[NH+](Cc2ccccc2)CC1 ZINC000362413984 511190344 /nfs/dbraw/zinc/19/03/44/511190344.db2.gz QHACGEZZHQJRQE-UHFFFAOYSA-N 1 1 371.441 2.740 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCC[C@@H](N3CCCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000365049678 511227335 /nfs/dbraw/zinc/22/73/35/511227335.db2.gz XGKHYRFUJUDMLR-MRXNPFEDSA-N 1 1 361.442 2.970 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](N3CCCCC3=O)C2)ccc1[N+](=O)[O-] ZINC000365049678 511227338 /nfs/dbraw/zinc/22/73/38/511227338.db2.gz XGKHYRFUJUDMLR-MRXNPFEDSA-N 1 1 361.442 2.970 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccccc1[N+](=O)[O-] ZINC000271684682 511286310 /nfs/dbraw/zinc/28/63/10/511286310.db2.gz DEEUTQKBESUVMB-GFCCVEGCSA-N 1 1 370.365 2.743 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])cc1F ZINC000295163293 511305723 /nfs/dbraw/zinc/30/57/23/511305723.db2.gz DJHGTIXOMRRASZ-CYBMUJFWSA-N 1 1 367.421 2.840 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccncn2)CC1 ZINC000298521083 511313509 /nfs/dbraw/zinc/31/35/09/511313509.db2.gz VTRVQMWRHQVMRB-CYBMUJFWSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@H]1OCC[C@]12C[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)CCO2 ZINC000280334820 511425608 /nfs/dbraw/zinc/42/56/08/511425608.db2.gz HMOSARWONYKYLZ-KUHUBIRLSA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283723531 511474970 /nfs/dbraw/zinc/47/49/70/511474970.db2.gz VYVCKTZXFKDDES-AWEZNQCLSA-N 1 1 359.430 2.620 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000272260129 511483941 /nfs/dbraw/zinc/48/39/41/511483941.db2.gz UYIVZEXPWSBZCG-SWLSCSKDSA-N 1 1 355.385 2.875 20 5 FFBDMO COC(=O)CC1([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCCC1 ZINC000280528565 511499170 /nfs/dbraw/zinc/49/91/70/511499170.db2.gz SGHHKABQFLZSDB-UHFFFAOYSA-N 1 1 360.370 2.610 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000363355220 511499566 /nfs/dbraw/zinc/49/95/66/511499566.db2.gz IFPYLARFENUJIE-WBVHZDCISA-N 1 1 357.458 2.813 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000292297416 511542101 /nfs/dbraw/zinc/54/21/01/511542101.db2.gz CXWZDJSWPPDXQV-JQWIXIFHSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000292297416 511542107 /nfs/dbraw/zinc/54/21/07/511542107.db2.gz CXWZDJSWPPDXQV-JQWIXIFHSA-N 1 1 360.357 2.593 20 5 FFBDMO CC(C)[N@H+]1CCCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000292324510 511554185 /nfs/dbraw/zinc/55/41/85/511554185.db2.gz BPWNPPDWTTXLNY-CYBMUJFWSA-N 1 1 368.865 2.991 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000365673099 511593441 /nfs/dbraw/zinc/59/34/41/511593441.db2.gz PTGJPDXSFUNKBJ-MNZLEMJZSA-N 1 1 351.406 2.763 20 5 FFBDMO CO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1(C)C ZINC000296103491 511620138 /nfs/dbraw/zinc/62/01/38/511620138.db2.gz RCVJTVIYBOLWPZ-HNNXBMFYSA-N 1 1 353.394 2.809 20 5 FFBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)COCC(F)(F)F ZINC000292509795 511623349 /nfs/dbraw/zinc/62/33/49/511623349.db2.gz TZYQHIQRXFNFEB-AWEZNQCLSA-N 1 1 350.337 2.745 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000365730404 511625229 /nfs/dbraw/zinc/62/52/29/511625229.db2.gz AEABEKRLELMIKL-UHFFFAOYSA-N 1 1 356.382 2.564 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000365738132 511629660 /nfs/dbraw/zinc/62/96/60/511629660.db2.gz GSIQZPFMMMFERD-SJORKVTESA-N 1 1 366.421 2.584 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000296215961 511659344 /nfs/dbraw/zinc/65/93/44/511659344.db2.gz CXJXRUGELZTOEC-RDJZCZTQSA-N 1 1 359.426 2.500 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CNC3CC[NH+](Cc4ccncc4)CC3)nc2c1 ZINC000365819502 511667572 /nfs/dbraw/zinc/66/75/72/511667572.db2.gz VKKRRGLXDDUTKQ-UHFFFAOYSA-N 1 1 366.425 2.620 20 5 FFBDMO C[N@H+](CCOc1ccc(F)cc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000303348960 511734669 /nfs/dbraw/zinc/73/46/69/511734669.db2.gz FKXYKWSDCZZAAR-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccc(F)cc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000303348960 511734674 /nfs/dbraw/zinc/73/46/74/511734674.db2.gz FKXYKWSDCZZAAR-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@H+](CCOc1ccc(F)cc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000303348959 511735352 /nfs/dbraw/zinc/73/53/52/511735352.db2.gz FKXYKWSDCZZAAR-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccc(F)cc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000303348959 511735353 /nfs/dbraw/zinc/73/53/53/511735353.db2.gz FKXYKWSDCZZAAR-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342994 511783546 /nfs/dbraw/zinc/78/35/46/511783546.db2.gz UVKGUDRFWJICFR-YOEHRIQHSA-N 1 1 359.386 2.516 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342994 511783550 /nfs/dbraw/zinc/78/35/50/511783550.db2.gz UVKGUDRFWJICFR-YOEHRIQHSA-N 1 1 359.386 2.516 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC000281280336 511787791 /nfs/dbraw/zinc/78/77/91/511787791.db2.gz QDEWIQRPCRJJOV-INIZCTEOSA-N 1 1 363.458 2.909 20 5 FFBDMO COC(=O)[C@H]1CC12CC[NH+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC2 ZINC000274336353 511799787 /nfs/dbraw/zinc/79/97/87/511799787.db2.gz SMTREPSXEZNIGK-GFCCVEGCSA-N 1 1 352.362 2.518 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@H]4CCn5c[nH+]cc5C4)n3)c2c1 ZINC000363994430 511894003 /nfs/dbraw/zinc/89/40/03/511894003.db2.gz NIOVMOHHTXZKPN-NSHDSACASA-N 1 1 364.365 2.976 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366199334 511896148 /nfs/dbraw/zinc/89/61/48/511896148.db2.gz GKZBWHACVKFNKU-HOCLYGCPSA-N 1 1 354.410 2.773 20 5 FFBDMO CCc1[nH]nc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)c1[N+](=O)[O-] ZINC000281584139 511898704 /nfs/dbraw/zinc/89/87/04/511898704.db2.gz MFGUJFVXSKBEMO-UHFFFAOYSA-N 1 1 351.794 2.848 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCc4[nH+]ccn4C3)n2)c1 ZINC000350898520 511903145 /nfs/dbraw/zinc/90/31/45/511903145.db2.gz ILCLIKGYFJWCCZ-LLVKDONJSA-N 1 1 355.354 2.504 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839755 511959487 /nfs/dbraw/zinc/95/94/87/511959487.db2.gz LTVBUGPOCDQLMQ-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839755 511959489 /nfs/dbraw/zinc/95/94/89/511959489.db2.gz LTVBUGPOCDQLMQ-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000274839755 511959497 /nfs/dbraw/zinc/95/94/97/511959497.db2.gz LTVBUGPOCDQLMQ-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000366511994 512062634 /nfs/dbraw/zinc/06/26/34/512062634.db2.gz SXSSOBYKRLPXPE-CYBMUJFWSA-N 1 1 368.231 2.668 20 5 FFBDMO COCc1ccc(CNC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000285312251 512074525 /nfs/dbraw/zinc/07/45/25/512074525.db2.gz MDLRNILCGJHLGO-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1ccc(CNC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000285312251 512074531 /nfs/dbraw/zinc/07/45/31/512074531.db2.gz MDLRNILCGJHLGO-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)C1 ZINC000366533837 512076497 /nfs/dbraw/zinc/07/64/97/512076497.db2.gz UNWNSBJODNRAGI-GOSISDBHSA-N 1 1 372.450 2.886 20 5 FFBDMO CC(=O)c1cc(N2CCC(C)(CN3CC[NH+](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000367348398 512456180 /nfs/dbraw/zinc/45/61/80/512456180.db2.gz OBXUHKMXHSABLT-UHFFFAOYSA-N 1 1 374.485 2.651 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771677 512498752 /nfs/dbraw/zinc/49/87/52/512498752.db2.gz ILLYWIRJUYZEMR-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771677 512498758 /nfs/dbraw/zinc/49/87/58/512498758.db2.gz ILLYWIRJUYZEMR-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000373776416 512500031 /nfs/dbraw/zinc/50/00/31/512500031.db2.gz HBNKLKGCHOGGSE-DYVFJYSZSA-N 1 1 359.426 2.579 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000373776418 512500300 /nfs/dbraw/zinc/50/03/00/512500300.db2.gz HBNKLKGCHOGGSE-GUYCJALGSA-N 1 1 359.426 2.579 20 5 FFBDMO C[N@H+]1CCCC12CCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000375819320 512524055 /nfs/dbraw/zinc/52/40/55/512524055.db2.gz YHWKNMIZTCESLH-UHFFFAOYSA-N 1 1 366.849 2.747 20 5 FFBDMO Cc1cc(C)cc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000369693241 512557507 /nfs/dbraw/zinc/55/75/07/512557507.db2.gz REHDRGXNNSXVBE-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1F ZINC000411414772 512624336 /nfs/dbraw/zinc/62/43/36/512624336.db2.gz BZAGILSBMDUUDV-QWHCGFSZSA-N 1 1 367.421 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000374028777 512630553 /nfs/dbraw/zinc/63/05/53/512630553.db2.gz STDQRVLSKWVZOQ-IIDMSEBBSA-N 1 1 350.415 2.632 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000378500974 512792690 /nfs/dbraw/zinc/79/26/90/512792690.db2.gz YUDQABAYLNGUKL-DOMZBBRYSA-N 1 1 353.369 2.629 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000411763896 512799435 /nfs/dbraw/zinc/79/94/35/512799435.db2.gz ZJYKPGMPDSHRQZ-AWEZNQCLSA-N 1 1 367.471 2.767 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000383835698 512881556 /nfs/dbraw/zinc/88/15/56/512881556.db2.gz SXBJJCHULPGTKW-LRDDRELGSA-N 1 1 372.400 2.709 20 5 FFBDMO NC(=O)[C@@H]1C[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1c1ccccc1 ZINC000411971325 512895580 /nfs/dbraw/zinc/89/55/80/512895580.db2.gz IUBFKVHIBGESLE-UONOGXRCSA-N 1 1 361.348 2.574 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1c1ccccc1 ZINC000411971325 512895585 /nfs/dbraw/zinc/89/55/85/512895585.db2.gz IUBFKVHIBGESLE-UONOGXRCSA-N 1 1 361.348 2.574 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCCC2=O)CC1 ZINC000412056104 512934227 /nfs/dbraw/zinc/93/42/27/512934227.db2.gz NMVNJYBXPXWSNU-MRXNPFEDSA-N 1 1 361.442 2.970 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000398001240 512952281 /nfs/dbraw/zinc/95/22/81/512952281.db2.gz NNIBHMPPZRTSJT-YOEHRIQHSA-N 1 1 368.437 2.817 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000370739688 513078454 /nfs/dbraw/zinc/07/84/54/513078454.db2.gz OJBTYIZMKQZFMD-MAUKXSAKSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000370739688 513078456 /nfs/dbraw/zinc/07/84/56/513078456.db2.gz OJBTYIZMKQZFMD-MAUKXSAKSA-N 1 1 357.410 2.813 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000433713866 513134525 /nfs/dbraw/zinc/13/45/25/513134525.db2.gz NWONFPGLRFSFCE-UHFFFAOYSA-N 1 1 351.451 2.826 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000428816447 513200925 /nfs/dbraw/zinc/20/09/25/513200925.db2.gz ILTBPZBCWDTLNU-FQEVSTJZSA-N 1 1 370.405 2.920 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000433985723 513207226 /nfs/dbraw/zinc/20/72/26/513207226.db2.gz OOTKXUXXSOLICJ-UHFFFAOYSA-N 1 1 351.451 2.778 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000433985723 513207233 /nfs/dbraw/zinc/20/72/33/513207233.db2.gz OOTKXUXXSOLICJ-UHFFFAOYSA-N 1 1 351.451 2.778 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000433985723 513207240 /nfs/dbraw/zinc/20/72/40/513207240.db2.gz OOTKXUXXSOLICJ-UHFFFAOYSA-N 1 1 351.451 2.778 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000428992595 513241806 /nfs/dbraw/zinc/24/18/06/513241806.db2.gz BHJFLFUFPOWLAJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000428992595 513241815 /nfs/dbraw/zinc/24/18/15/513241815.db2.gz BHJFLFUFPOWLAJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000428992595 513241824 /nfs/dbraw/zinc/24/18/24/513241824.db2.gz BHJFLFUFPOWLAJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429022030 513257992 /nfs/dbraw/zinc/25/79/92/513257992.db2.gz RBXIZWHAVKIKAC-DDUZABMNSA-N 1 1 360.458 2.504 20 5 FFBDMO CC(C)([NH2+]CC(=O)NC(=O)Nc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429250831 513316515 /nfs/dbraw/zinc/31/65/15/513316515.db2.gz HAQJDSOBEOSCEF-UHFFFAOYSA-N 1 1 356.382 2.768 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000421706636 513379310 /nfs/dbraw/zinc/37/93/10/513379310.db2.gz VINZUDIPRDGDCW-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425056996 513394175 /nfs/dbraw/zinc/39/41/75/513394175.db2.gz AQLJXMGJVLDFQO-SMDDNHRTSA-N 1 1 369.874 2.893 20 5 FFBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1F)[NH+]1CCN(c2ccccc2)CC1 ZINC000413053646 513410859 /nfs/dbraw/zinc/41/08/59/513410859.db2.gz KIOVNSGJWKAKAQ-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCO[C@@H](C)C2)CC1 ZINC000421772798 513418706 /nfs/dbraw/zinc/41/87/06/513418706.db2.gz ZXXDAWROXNTIRY-HNNXBMFYSA-N 1 1 361.442 2.537 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000421787627 513427364 /nfs/dbraw/zinc/42/73/64/513427364.db2.gz QCPFEFNLGKJRHQ-IYBDPMFKSA-N 1 1 363.458 2.831 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC[N@@H+]1CCOC ZINC000421795952 513432551 /nfs/dbraw/zinc/43/25/51/513432551.db2.gz LEXUTAIPVRDUEH-MRXNPFEDSA-N 1 1 363.458 2.785 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1CCOC ZINC000421795952 513432555 /nfs/dbraw/zinc/43/25/55/513432555.db2.gz LEXUTAIPVRDUEH-MRXNPFEDSA-N 1 1 363.458 2.785 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000441017014 513461549 /nfs/dbraw/zinc/46/15/49/513461549.db2.gz WKDOCOGDMNNWAB-WIBUTAKZSA-N 1 1 372.421 2.659 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(-c4cc[nH]n4)o3)C2)nc1 ZINC000435123565 513517915 /nfs/dbraw/zinc/51/79/15/513517915.db2.gz HPVGMSJFGYZLLE-GFCCVEGCSA-N 1 1 354.370 2.659 20 5 FFBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441276559 513525813 /nfs/dbraw/zinc/52/58/13/513525813.db2.gz KLSHLTGQLWKRBZ-ABAIWWIYSA-N 1 1 372.347 2.864 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441278839 513528466 /nfs/dbraw/zinc/52/84/66/513528466.db2.gz QNMHCIQVVVQVII-HRCADAONSA-N 1 1 361.442 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441278836 513528490 /nfs/dbraw/zinc/52/84/90/513528490.db2.gz QNMHCIQVVVQVII-ARFHVFGLSA-N 1 1 361.442 2.979 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(Cc3ccc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000425447591 513572214 /nfs/dbraw/zinc/57/22/14/513572214.db2.gz PXZZGARWOWSRGB-OAHLLOKOSA-N 1 1 354.248 2.885 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812627 513578749 /nfs/dbraw/zinc/57/87/49/513578749.db2.gz NBGOKBQQBZPWAQ-INIZCTEOSA-N 1 1 362.474 2.713 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCO[C@H]1C ZINC000425467616 513581927 /nfs/dbraw/zinc/58/19/27/513581927.db2.gz BTVHMGLPICWUMY-SMDDNHRTSA-N 1 1 373.247 2.983 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCO[C@H]1C ZINC000425467616 513581926 /nfs/dbraw/zinc/58/19/26/513581926.db2.gz BTVHMGLPICWUMY-SMDDNHRTSA-N 1 1 373.247 2.983 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000451404621 513725290 /nfs/dbraw/zinc/72/52/90/513725290.db2.gz BDGJZQNYUWFTTK-INIZCTEOSA-N 1 1 374.416 2.864 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1F)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000425967160 513809715 /nfs/dbraw/zinc/80/97/15/513809715.db2.gz NLHSTTCPVSKRDM-FQEVSTJZSA-N 1 1 373.428 2.803 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562215 513833855 /nfs/dbraw/zinc/83/38/55/513833855.db2.gz IXEDDWXVNDLWNG-LRDDRELGSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562215 513833861 /nfs/dbraw/zinc/83/38/61/513833861.db2.gz IXEDDWXVNDLWNG-LRDDRELGSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000426224233 513877052 /nfs/dbraw/zinc/87/70/52/513877052.db2.gz AFCYQEFHVYELTI-TZMCWYRMSA-N 1 1 374.384 2.983 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000451690948 513912759 /nfs/dbraw/zinc/91/27/59/513912759.db2.gz ARPFUZJBYWCGBP-JJXSEGSLSA-N 1 1 361.442 2.713 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)C1CCCC1 ZINC000448919298 513969856 /nfs/dbraw/zinc/96/98/56/513969856.db2.gz ZOXRMTOYBOQQKO-UHFFFAOYSA-N 1 1 357.414 2.589 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448925123 513973100 /nfs/dbraw/zinc/97/31/00/513973100.db2.gz MCMSKMNNXXINOF-OAHLLOKOSA-N 1 1 369.425 2.527 20 5 FFBDMO CCOc1cc(N(C)CC(C)(C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000443893454 514064294 /nfs/dbraw/zinc/06/42/94/514064294.db2.gz DRMMGZVDJLWXMD-UHFFFAOYSA-N 1 1 351.447 2.788 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000426933881 514077062 /nfs/dbraw/zinc/07/70/62/514077062.db2.gz NWMOIRRBFSZISU-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-] ZINC000443950999 514079779 /nfs/dbraw/zinc/07/97/79/514079779.db2.gz VZVOVEGSLLLIPR-UHFFFAOYSA-N 1 1 350.419 2.700 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@]3(CCSC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451963920 514098218 /nfs/dbraw/zinc/09/82/18/514098218.db2.gz IFCUVJNFIAGETF-SJLPKXTDSA-N 1 1 361.467 2.919 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]1[NH2+]CCc2ccccc21 ZINC000423431314 514140725 /nfs/dbraw/zinc/14/07/25/514140725.db2.gz QJRMJGWVOOYDCS-IFXJQAMLSA-N 1 1 368.437 2.789 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432334265 514163574 /nfs/dbraw/zinc/16/35/74/514163574.db2.gz FYJXJTWVKMDJQG-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1c1ccc(O)cc1 ZINC000449346596 514176344 /nfs/dbraw/zinc/17/63/44/514176344.db2.gz BLJXORJNBGTNOM-DLBZAZTESA-N 1 1 374.368 2.828 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)[N@@H+]1CCO ZINC000449534662 514245089 /nfs/dbraw/zinc/24/50/89/514245089.db2.gz MUVFWNPYBQLRET-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)N1CCO ZINC000449534662 514245093 /nfs/dbraw/zinc/24/50/93/514245093.db2.gz MUVFWNPYBQLRET-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)N1CCO ZINC000449534662 514245094 /nfs/dbraw/zinc/24/50/94/514245094.db2.gz MUVFWNPYBQLRET-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000437856103 514252173 /nfs/dbraw/zinc/25/21/73/514252173.db2.gz TVVSFUFBGONGAU-INIZCTEOSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000437856671 514252911 /nfs/dbraw/zinc/25/29/11/514252911.db2.gz YGFRQINPSNYTGC-HNNXBMFYSA-N 1 1 371.441 2.998 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000437856671 514252920 /nfs/dbraw/zinc/25/29/20/514252920.db2.gz YGFRQINPSNYTGC-HNNXBMFYSA-N 1 1 371.441 2.998 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000437856671 514252928 /nfs/dbraw/zinc/25/29/28/514252928.db2.gz YGFRQINPSNYTGC-HNNXBMFYSA-N 1 1 371.441 2.998 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444608525 514272868 /nfs/dbraw/zinc/27/28/68/514272868.db2.gz LHWPWIRVOSFCFR-CYBMUJFWSA-N 1 1 359.430 2.599 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444608525 514272876 /nfs/dbraw/zinc/27/28/76/514272876.db2.gz LHWPWIRVOSFCFR-CYBMUJFWSA-N 1 1 359.430 2.599 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCN1CCOCC1)Cc1ccco1 ZINC000449763798 514345406 /nfs/dbraw/zinc/34/54/06/514345406.db2.gz VPDYXMHJHZRQAH-UHFFFAOYSA-N 1 1 359.426 2.831 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCN1CCOCC1)Cc1ccco1 ZINC000449763798 514345412 /nfs/dbraw/zinc/34/54/12/514345412.db2.gz VPDYXMHJHZRQAH-UHFFFAOYSA-N 1 1 359.426 2.831 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]1[NH2+]CCc2ccccc21 ZINC000414942081 514366988 /nfs/dbraw/zinc/36/69/88/514366988.db2.gz BGYNRQHGHMRWPQ-LIRRHRJNSA-N 1 1 368.437 2.789 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420948800 514396667 /nfs/dbraw/zinc/39/66/67/514396667.db2.gz OFFBVIJLQQBHDI-OLZOCXBDSA-N 1 1 362.348 2.999 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@H]1C ZINC000449968953 514447136 /nfs/dbraw/zinc/44/71/36/514447136.db2.gz CKIGKHBGWRNEDT-CJNGLKHVSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@H]1C ZINC000449968953 514447139 /nfs/dbraw/zinc/44/71/39/514447139.db2.gz CKIGKHBGWRNEDT-CJNGLKHVSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@H]1C ZINC000449968953 514447148 /nfs/dbraw/zinc/44/71/48/514447148.db2.gz CKIGKHBGWRNEDT-CJNGLKHVSA-N 1 1 371.441 2.930 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000421101375 514483834 /nfs/dbraw/zinc/48/38/34/514483834.db2.gz VUWRVKUQEUSOKA-LLVKDONJSA-N 1 1 358.345 2.754 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1ccc(F)cc1[N+](=O)[O-] ZINC000428542447 514494601 /nfs/dbraw/zinc/49/46/01/514494601.db2.gz RERUVNOKXGTDJB-OAHLLOKOSA-N 1 1 359.357 2.553 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000439484473 514561922 /nfs/dbraw/zinc/56/19/22/514561922.db2.gz DXQDFFCXOQUGRM-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000439484473 514561924 /nfs/dbraw/zinc/56/19/24/514561924.db2.gz DXQDFFCXOQUGRM-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458192863 514616129 /nfs/dbraw/zinc/61/61/29/514616129.db2.gz PGKUOJKALXYNMH-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C1 ZINC000507960011 514625014 /nfs/dbraw/zinc/62/50/14/514625014.db2.gz BGROCGXWJUYORY-CQSZACIVSA-N 1 1 358.446 2.558 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)(C)C ZINC000475345418 514628100 /nfs/dbraw/zinc/62/81/00/514628100.db2.gz AOYWNDAKVKWYON-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C[C@@H](C)C1 ZINC000453427492 514631095 /nfs/dbraw/zinc/63/10/95/514631095.db2.gz PEOCDDLVCHOUNX-ZQIUZPCESA-N 1 1 370.457 2.557 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C[C@@H](C)C1 ZINC000453427491 514632723 /nfs/dbraw/zinc/63/27/23/514632723.db2.gz PEOCDDLVCHOUNX-VBQJREDUSA-N 1 1 370.457 2.557 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(S(C)(=O)=O)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000502549973 514688287 /nfs/dbraw/zinc/68/82/87/514688287.db2.gz FKQRMUSGJAHLQW-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)ccc1[N+](=O)[O-] ZINC000471058816 514736454 /nfs/dbraw/zinc/73/64/54/514736454.db2.gz GPHDLCKQNQTDLW-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231147 514761039 /nfs/dbraw/zinc/76/10/39/514761039.db2.gz IPQZPDOHUQGPPA-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231147 514761047 /nfs/dbraw/zinc/76/10/47/514761047.db2.gz IPQZPDOHUQGPPA-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231147 514761055 /nfs/dbraw/zinc/76/10/55/514761055.db2.gz IPQZPDOHUQGPPA-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)C[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000471205029 514795495 /nfs/dbraw/zinc/79/54/95/514795495.db2.gz RENYPZYGFDGGJN-CQSZACIVSA-N 1 1 373.400 2.977 20 5 FFBDMO Cc1cc(N2CCC[N@H+]([C@H](C)CO)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461943065 514798231 /nfs/dbraw/zinc/79/82/31/514798231.db2.gz WCSJEBFMSCOKSV-GFCCVEGCSA-N 1 1 361.364 2.815 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[C@H](C)C1 ZINC000484893144 514832648 /nfs/dbraw/zinc/83/26/48/514832648.db2.gz HBGKDZTTYAIKRQ-GOEBONIOSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[C@H](C)C1 ZINC000484893144 514832658 /nfs/dbraw/zinc/83/26/58/514832658.db2.gz HBGKDZTTYAIKRQ-GOEBONIOSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[C@@H](C)C1 ZINC000484893143 514833098 /nfs/dbraw/zinc/83/30/98/514833098.db2.gz HBGKDZTTYAIKRQ-GDBMZVCRSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[C@@H](C)C1 ZINC000484893143 514833104 /nfs/dbraw/zinc/83/31/04/514833104.db2.gz HBGKDZTTYAIKRQ-GDBMZVCRSA-N 1 1 370.471 2.506 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000508594182 514834230 /nfs/dbraw/zinc/83/42/30/514834230.db2.gz IIIYBNQETKTCCU-LBPRGKRZSA-N 1 1 360.366 2.858 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc([N+](=O)[O-])nn3C)cc2)C1 ZINC000476076467 514909621 /nfs/dbraw/zinc/90/96/21/514909621.db2.gz VTXBQERAQOMATM-ZDUSSCGKSA-N 1 1 357.414 2.813 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000467710927 515087634 /nfs/dbraw/zinc/08/76/34/515087634.db2.gz OUFNTROXSZXOKS-YMTOWFKASA-N 1 1 368.231 2.570 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CCN(c2cc[nH+]c(N3CCCCC3)n2)CC1 ZINC000498901734 515107481 /nfs/dbraw/zinc/10/74/81/515107481.db2.gz PDBCUDSMHRQBDF-UHFFFAOYSA-N 1 1 368.441 2.702 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1C ZINC000480946218 515148238 /nfs/dbraw/zinc/14/82/38/515148238.db2.gz ANGOXYKWHRQZRB-GXTWGEPZSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@H]1[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCC[N@H+]1C ZINC000462701953 515199215 /nfs/dbraw/zinc/19/92/15/515199215.db2.gz PEYSKMCVWKYGFH-GOEBONIOSA-N 1 1 356.426 2.885 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000490626569 515266293 /nfs/dbraw/zinc/26/62/93/515266293.db2.gz KOIHGGMOTRDGEH-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000490675278 515279610 /nfs/dbraw/zinc/27/96/10/515279610.db2.gz QSLWPXVTLXMTAX-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCCC1 ZINC000504896539 515404678 /nfs/dbraw/zinc/40/46/78/515404678.db2.gz YMRWMTRLLPOJOR-CABCVRRESA-N 1 1 353.488 2.512 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCC1 ZINC000504896539 515404688 /nfs/dbraw/zinc/40/46/88/515404688.db2.gz YMRWMTRLLPOJOR-CABCVRRESA-N 1 1 353.488 2.512 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000491351794 515418095 /nfs/dbraw/zinc/41/80/95/515418095.db2.gz ZULCXJUNBPDJMT-FQEVSTJZSA-N 1 1 370.453 2.680 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000481757047 515453760 /nfs/dbraw/zinc/45/37/60/515453760.db2.gz WQJCCCYRSJYVQQ-DLBZAZTESA-N 1 1 369.421 2.578 20 5 FFBDMO CCCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000481768322 515458518 /nfs/dbraw/zinc/45/85/18/515458518.db2.gz MIXNGGHSLOOSAO-UHFFFAOYSA-N 1 1 351.447 2.932 20 5 FFBDMO CC[N@H+]1CCCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000491876420 515478034 /nfs/dbraw/zinc/47/80/34/515478034.db2.gz QAPGKIVRDHXKFC-UHFFFAOYSA-N 1 1 373.400 2.775 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000481837513 515481895 /nfs/dbraw/zinc/48/18/95/515481895.db2.gz IQEVJTJJEPXSHR-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1O ZINC000459347180 515490326 /nfs/dbraw/zinc/49/03/26/515490326.db2.gz POSWQIJHKJUSTK-CQSZACIVSA-N 1 1 358.398 2.781 20 5 FFBDMO CSc1ccc(OCC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000459518149 515614519 /nfs/dbraw/zinc/61/45/19/515614519.db2.gz WZOVOQZRZHFAQM-UHFFFAOYSA-N 1 1 374.466 2.913 20 5 FFBDMO CC(C)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cnn(C)c1 ZINC000459575918 515662313 /nfs/dbraw/zinc/66/23/13/515662313.db2.gz CWCPEFITUDWFLC-UHFFFAOYSA-N 1 1 359.430 2.815 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C[C@@H]1C ZINC000493891585 515678344 /nfs/dbraw/zinc/67/83/44/515678344.db2.gz OEJLICDPQHHOSB-LSDHHAIUSA-N 1 1 369.487 2.705 20 5 FFBDMO COc1cc(C[NH+]2CC3(C2)CCOCC3)c([N+](=O)[O-])cc1OCC(F)F ZINC000459614841 515697219 /nfs/dbraw/zinc/69/72/19/515697219.db2.gz HFFLMLGZHUYMQT-UHFFFAOYSA-N 1 1 372.368 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000459620469 515700422 /nfs/dbraw/zinc/70/04/22/515700422.db2.gz LMFDSCVQBMYGNO-WDEREUQCSA-N 1 1 362.361 2.815 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000510904686 515708958 /nfs/dbraw/zinc/70/89/58/515708958.db2.gz ZMWZMSNUMVDKLQ-LBPRGKRZSA-N 1 1 359.348 2.875 20 5 FFBDMO CCOc1cc(C(=O)Nc2cc[nH+]c(N(C)C)c2)c([N+](=O)[O-])cc1OC ZINC000500436644 515710203 /nfs/dbraw/zinc/71/02/03/515710203.db2.gz NXDDUARSKNFUDP-UHFFFAOYSA-N 1 1 360.370 2.715 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000459640000 515714713 /nfs/dbraw/zinc/71/47/13/515714713.db2.gz WONKOLGAKVMKHY-LLVKDONJSA-N 1 1 372.450 2.780 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000511063001 515763833 /nfs/dbraw/zinc/76/38/33/515763833.db2.gz GDCILBYSYXRAOL-CQSZACIVSA-N 1 1 373.375 2.918 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCCN(C(C)=O)CC3)o2)c([N+](=O)[O-])c1 ZINC000506247582 515826622 /nfs/dbraw/zinc/82/66/22/515826622.db2.gz TVHXNSOVFJWNMY-UHFFFAOYSA-N 1 1 373.409 2.918 20 5 FFBDMO CNc1nc(C(=O)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000454958050 515857772 /nfs/dbraw/zinc/85/77/72/515857772.db2.gz VHHNTFBPTUDSBS-DZGCQCFKSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000506479477 515893109 /nfs/dbraw/zinc/89/31/09/515893109.db2.gz XSKAZJISIMLFML-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c([N+](=O)[O-])c1 ZINC000474148867 515905462 /nfs/dbraw/zinc/90/54/62/515905462.db2.gz YCOSAJJHSDUPBV-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO CC[N@@H+](CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000494908183 516004616 /nfs/dbraw/zinc/00/46/16/516004616.db2.gz HSSMBGARVFYBSZ-UHFFFAOYSA-N 1 1 374.363 2.897 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474423752 516039767 /nfs/dbraw/zinc/03/97/67/516039767.db2.gz AAYGHGSGNPQDOL-OAHLLOKOSA-N 1 1 370.409 2.999 20 5 FFBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCCOC2)O1 ZINC000483368863 516051861 /nfs/dbraw/zinc/05/18/61/516051861.db2.gz CLGLUPQRQLKDRO-MAUKXSAKSA-N 1 1 350.415 2.634 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000470007118 516078119 /nfs/dbraw/zinc/07/81/19/516078119.db2.gz ARRMNEODRJVJJM-GXSJLCMTSA-N 1 1 374.340 2.588 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000470007118 516078126 /nfs/dbraw/zinc/07/81/26/516078126.db2.gz ARRMNEODRJVJJM-GXSJLCMTSA-N 1 1 374.340 2.588 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000460234725 516078747 /nfs/dbraw/zinc/07/87/47/516078747.db2.gz TVZXUEZUAYUMMF-UHFFFAOYSA-N 1 1 358.442 2.921 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000495151934 516083549 /nfs/dbraw/zinc/08/35/49/516083549.db2.gz AABKDQWKIWEOMV-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CNC(=O)C[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000483424166 516083875 /nfs/dbraw/zinc/08/38/75/516083875.db2.gz CGYDYRXDVZGYJJ-OAHLLOKOSA-N 1 1 361.373 2.710 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CC)C[C@@H]1CC ZINC000455357510 516144701 /nfs/dbraw/zinc/14/47/01/516144701.db2.gz KPUYWMKKGCDZDN-ZDUSSCGKSA-N 1 1 350.419 2.942 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512147844 516173827 /nfs/dbraw/zinc/17/38/27/516173827.db2.gz VJSLXMYJUPBDTD-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000474774894 516190748 /nfs/dbraw/zinc/19/07/48/516190748.db2.gz KVPZQUGLGYJDER-GFCCVEGCSA-N 1 1 369.263 2.920 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC000460817584 516255987 /nfs/dbraw/zinc/25/59/87/516255987.db2.gz VBISWZPNKIHUHE-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000507603736 516260756 /nfs/dbraw/zinc/26/07/56/516260756.db2.gz KFQDIVDRBRRBRL-NVXWUHKLSA-N 1 1 369.421 2.925 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC000497603995 516327703 /nfs/dbraw/zinc/32/77/03/516327703.db2.gz JXXKKPXTMHERES-WDEREUQCSA-N 1 1 357.357 2.751 20 5 FFBDMO COc1ccc2c(c1)CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000535553385 516397586 /nfs/dbraw/zinc/39/75/86/516397586.db2.gz GVZNUIPBRSISNB-UHFFFAOYSA-N 1 1 369.421 2.667 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000535553385 516397599 /nfs/dbraw/zinc/39/75/99/516397599.db2.gz GVZNUIPBRSISNB-UHFFFAOYSA-N 1 1 369.421 2.667 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[C@@H](C)C1 ZINC000561146060 516406244 /nfs/dbraw/zinc/40/62/44/516406244.db2.gz OYOWIJVKSRXZPO-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[C@@H](C)C1 ZINC000561146060 516406250 /nfs/dbraw/zinc/40/62/50/516406250.db2.gz OYOWIJVKSRXZPO-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000561157829 516415217 /nfs/dbraw/zinc/41/52/17/516415217.db2.gz XGLZCCUOJWLWBM-YPMHNXCESA-N 1 1 350.419 2.617 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000543790709 516430593 /nfs/dbraw/zinc/43/05/93/516430593.db2.gz ZJLUYLLPIWDZCI-LJQANCHMSA-N 1 1 356.426 2.656 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000517766103 516443859 /nfs/dbraw/zinc/44/38/59/516443859.db2.gz AAHBPFGVELIFET-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000517766103 516443864 /nfs/dbraw/zinc/44/38/64/516443864.db2.gz AAHBPFGVELIFET-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COCC1(C)CC[NH+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000540199596 516469799 /nfs/dbraw/zinc/46/97/99/516469799.db2.gz ZSALANCHLBIFGJ-CYBMUJFWSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1cc(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000513467191 516635941 /nfs/dbraw/zinc/63/59/41/516635941.db2.gz RNYKMUUEESWBHY-CYBMUJFWSA-N 1 1 371.384 2.873 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000536193839 516672401 /nfs/dbraw/zinc/67/24/01/516672401.db2.gz ULNOVEBZFLGNOY-RBUKOAKNSA-N 1 1 368.437 2.882 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc(Cn2c[nH+]c3c2CCCC3)n1 ZINC000558325645 516692818 /nfs/dbraw/zinc/69/28/18/516692818.db2.gz GKVCGKVPFISJOJ-UHFFFAOYSA-N 1 1 368.397 2.756 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCCC[C@@H]3[NH+]3CCOCC3)cc2N1 ZINC000531911013 516708257 /nfs/dbraw/zinc/70/82/57/516708257.db2.gz GBIGDYKKLVKKBA-YOEHRIQHSA-N 1 1 374.441 2.535 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000561746951 516745486 /nfs/dbraw/zinc/74/54/86/516745486.db2.gz PKYREHZJSOSVTR-IIAWOOMASA-N 1 1 361.442 2.796 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000524881122 516859233 /nfs/dbraw/zinc/85/92/33/516859233.db2.gz UTVCOVPJZIOBRY-WMLDXEAASA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000525105569 516918203 /nfs/dbraw/zinc/91/82/03/516918203.db2.gz IYQRQKQRTFHKTD-NTZNESFSSA-N 1 1 355.822 2.614 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCc1nc2ccccc2c(=O)[nH]1 ZINC000558739222 516923198 /nfs/dbraw/zinc/92/31/98/516923198.db2.gz GUOJFTABJGRZQD-UHFFFAOYSA-N 1 1 352.394 2.961 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000514635236 516973469 /nfs/dbraw/zinc/97/34/69/516973469.db2.gz NICQECAXWYXYAV-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[C@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000555579140 516988820 /nfs/dbraw/zinc/98/88/20/516988820.db2.gz WLHJTNMJZCNKDG-QGZVFWFLSA-N 1 1 367.409 2.742 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000532461471 516988888 /nfs/dbraw/zinc/98/88/88/516988888.db2.gz NWCNZNZMRWRUMI-UHFFFAOYSA-N 1 1 351.451 2.634 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000532461471 516988896 /nfs/dbraw/zinc/98/88/96/516988896.db2.gz NWCNZNZMRWRUMI-UHFFFAOYSA-N 1 1 351.451 2.634 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000532461471 516988904 /nfs/dbraw/zinc/98/89/04/516988904.db2.gz NWCNZNZMRWRUMI-UHFFFAOYSA-N 1 1 351.451 2.634 20 5 FFBDMO CCO[C@@H]1C[C@@H]1[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000514707981 517013871 /nfs/dbraw/zinc/01/38/71/517013871.db2.gz HSKTULGYGPXBEU-CMPLNLGQSA-N 1 1 364.320 2.812 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000525355354 517017392 /nfs/dbraw/zinc/01/73/92/517017392.db2.gz RBAYAUZYTJRZAN-INIZCTEOSA-N 1 1 362.474 2.949 20 5 FFBDMO C[C@@H](C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719602 517085677 /nfs/dbraw/zinc/08/56/77/517085677.db2.gz IYHHNRSVZXGMTK-RBSFLKMASA-N 1 1 363.458 2.702 20 5 FFBDMO Cc1sc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000552201022 517137993 /nfs/dbraw/zinc/13/79/93/517137993.db2.gz YFEUUZNZXHUTFY-CQSZACIVSA-N 1 1 361.423 2.784 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000532990273 517241778 /nfs/dbraw/zinc/24/17/78/517241778.db2.gz CEQNTYLEALJEGC-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000532990273 517241784 /nfs/dbraw/zinc/24/17/84/517241784.db2.gz CEQNTYLEALJEGC-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000541880186 517270261 /nfs/dbraw/zinc/27/02/61/517270261.db2.gz LVWARZPLZCPYKD-NSHDSACASA-N 1 1 361.423 2.539 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000559638650 517355520 /nfs/dbraw/zinc/35/55/20/517355520.db2.gz HAFKHROVCNLYJP-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CC[C@@H](CO)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000559869948 517465630 /nfs/dbraw/zinc/46/56/30/517465630.db2.gz DUKKYWVKFCOHHN-ZIFCJYIRSA-N 1 1 360.410 2.969 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000556521442 517477310 /nfs/dbraw/zinc/47/73/10/517477310.db2.gz WVKAUKSAYNDZNK-GOEBONIOSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1cc(C(C)(C)C)nn1C)c1ccccc1[N+](=O)[O-] ZINC000538275897 517536224 /nfs/dbraw/zinc/53/62/24/517536224.db2.gz KSEGXNBLQJZADO-LBPRGKRZSA-N 1 1 359.430 2.915 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000553170900 517557071 /nfs/dbraw/zinc/55/70/71/517557071.db2.gz FNIZTSWMQUHKQK-AWEZNQCLSA-N 1 1 359.430 2.588 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCc3ccccc3C2)n1 ZINC000553311785 517637611 /nfs/dbraw/zinc/63/76/11/517637611.db2.gz LPEHOWFBBAGSSZ-ZDUSSCGKSA-N 1 1 370.409 2.635 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000553330558 517649184 /nfs/dbraw/zinc/64/91/84/517649184.db2.gz FUUSGYKIPGMLOQ-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000553330558 517649191 /nfs/dbraw/zinc/64/91/91/517649191.db2.gz FUUSGYKIPGMLOQ-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000546578802 517738007 /nfs/dbraw/zinc/73/80/07/517738007.db2.gz VIQPFVYITUXWNJ-ZDUSSCGKSA-N 1 1 351.422 2.860 20 5 FFBDMO CCN(C(=O)c1[nH]nc(C)c1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000521477125 517749218 /nfs/dbraw/zinc/74/92/18/517749218.db2.gz SDHYWDXZIUJTIZ-GDBMZVCRSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000521477125 517749226 /nfs/dbraw/zinc/74/92/26/517749226.db2.gz SDHYWDXZIUJTIZ-GDBMZVCRSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000521477125 517749234 /nfs/dbraw/zinc/74/92/34/517749234.db2.gz SDHYWDXZIUJTIZ-GDBMZVCRSA-N 1 1 371.441 2.924 20 5 FFBDMO Cc1cccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)c1[N+](=O)[O-] ZINC000556934687 517756403 /nfs/dbraw/zinc/75/64/03/517756403.db2.gz SYBHGQCUXLXQRL-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@]2(C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000546811344 517870190 /nfs/dbraw/zinc/87/01/90/517870190.db2.gz LKCVSVMYSVXXAN-INIZCTEOSA-N 1 1 360.357 2.594 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000543093921 517903601 /nfs/dbraw/zinc/90/36/01/517903601.db2.gz ULSQTYZQACDFPA-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000543093921 517903613 /nfs/dbraw/zinc/90/36/13/517903613.db2.gz ULSQTYZQACDFPA-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000543255785 517991829 /nfs/dbraw/zinc/99/18/29/517991829.db2.gz BKXBYBAICULNIZ-UHFFFAOYSA-N 1 1 369.874 2.895 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000517070705 518011206 /nfs/dbraw/zinc/01/12/06/518011206.db2.gz NPPGCILZKPPDPP-ZDUSSCGKSA-N 1 1 352.398 2.998 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OCC ZINC000517115010 518031751 /nfs/dbraw/zinc/03/17/51/518031751.db2.gz ILDUOZCSBURRSB-GFCCVEGCSA-N 1 1 366.418 2.608 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557525117 518053423 /nfs/dbraw/zinc/05/34/23/518053423.db2.gz CZTRGRHMZVGDCT-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000557525117 518053433 /nfs/dbraw/zinc/05/34/33/518053433.db2.gz CZTRGRHMZVGDCT-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000547282789 518056351 /nfs/dbraw/zinc/05/63/51/518056351.db2.gz DWHCYYUFTFHASZ-UHFFFAOYSA-N 1 1 370.356 2.970 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000517268950 518099128 /nfs/dbraw/zinc/09/91/28/518099128.db2.gz RMCPFEAZJAFLOX-OAHLLOKOSA-N 1 1 374.441 2.516 20 5 FFBDMO CCC[N@@H+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 ZINC000560968028 518102133 /nfs/dbraw/zinc/10/21/33/518102133.db2.gz ADBTUKDNICDSRF-AWEZNQCLSA-N 1 1 365.821 2.784 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000522436686 518106965 /nfs/dbraw/zinc/10/69/65/518106965.db2.gz VVJGWIFFOQCSBU-CYBMUJFWSA-N 1 1 373.450 2.667 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000522436686 518106970 /nfs/dbraw/zinc/10/69/70/518106970.db2.gz VVJGWIFFOQCSBU-CYBMUJFWSA-N 1 1 373.450 2.667 20 5 FFBDMO COc1ccc(CNC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000535266752 518171741 /nfs/dbraw/zinc/17/17/41/518171741.db2.gz XWIPRRIGOKNPDK-INIZCTEOSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc(CNC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000535266752 518171742 /nfs/dbraw/zinc/17/17/42/518171742.db2.gz XWIPRRIGOKNPDK-INIZCTEOSA-N 1 1 370.409 2.589 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856254 518204899 /nfs/dbraw/zinc/20/48/99/518204899.db2.gz MCVVFPCEXMXSTL-CRAIPNDOSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856254 518204901 /nfs/dbraw/zinc/20/49/01/518204901.db2.gz MCVVFPCEXMXSTL-CRAIPNDOSA-N 1 1 352.394 2.585 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000584546735 518392094 /nfs/dbraw/zinc/39/20/94/518392094.db2.gz OHUNVSZCASWJQF-LBPRGKRZSA-N 1 1 355.822 2.570 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023201 518550266 /nfs/dbraw/zinc/55/02/66/518550266.db2.gz WQYDAQXKEKSYCX-AAEUAGOBSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023201 518550268 /nfs/dbraw/zinc/55/02/68/518550268.db2.gz WQYDAQXKEKSYCX-AAEUAGOBSA-N 1 1 355.822 2.568 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000586773224 518636439 /nfs/dbraw/zinc/63/64/39/518636439.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@H](O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773224 518636446 /nfs/dbraw/zinc/63/64/46/518636446.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773224 518636450 /nfs/dbraw/zinc/63/64/50/518636450.db2.gz JKPVVXOZEJHRPQ-LJQANCHMSA-N 1 1 357.454 2.562 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376486 518651868 /nfs/dbraw/zinc/65/18/68/518651868.db2.gz SPDCCAOKOPDTNM-TZIWHRDSSA-N 1 1 367.449 2.809 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000579376486 518651873 /nfs/dbraw/zinc/65/18/73/518651873.db2.gz SPDCCAOKOPDTNM-TZIWHRDSSA-N 1 1 367.449 2.809 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1 ZINC000588311631 518774427 /nfs/dbraw/zinc/77/44/27/518774427.db2.gz JVWPXUMLOPTJJI-UHFFFAOYSA-N 1 1 354.410 2.621 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000588640392 518793244 /nfs/dbraw/zinc/79/32/44/518793244.db2.gz UQJSQYWJJXVWII-GOSISDBHSA-N 1 1 368.437 2.965 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000588640392 518793249 /nfs/dbraw/zinc/79/32/49/518793249.db2.gz UQJSQYWJJXVWII-GOSISDBHSA-N 1 1 368.437 2.965 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@@H+](C)C2CCCCC2)n1 ZINC000568077011 518862681 /nfs/dbraw/zinc/86/26/81/518862681.db2.gz OMNBVNBAQJHTTI-UHFFFAOYSA-N 1 1 350.419 2.843 20 5 FFBDMO COCCC[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000565389958 518930089 /nfs/dbraw/zinc/93/00/89/518930089.db2.gz HUUVOEDERSXHCG-UHFFFAOYSA-N 1 1 364.183 2.668 20 5 FFBDMO CCc1nn(C)c(Nc2ccc(CC[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000565443726 518959001 /nfs/dbraw/zinc/95/90/01/518959001.db2.gz MGROUTYLWREWTP-UHFFFAOYSA-N 1 1 359.430 2.509 20 5 FFBDMO Cc1cc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc(N2CCCC2)[nH+]1 ZINC000577253078 518988375 /nfs/dbraw/zinc/98/83/75/518988375.db2.gz PJNAQCZXXNRIMO-UHFFFAOYSA-N 1 1 352.398 2.809 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c1 ZINC000589518595 519024203 /nfs/dbraw/zinc/02/42/03/519024203.db2.gz ZVZJQDJXLLWYLH-XJKSGUPXSA-N 1 1 350.415 2.897 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1noc2c1CCCC2 ZINC000568801516 519221284 /nfs/dbraw/zinc/22/12/84/519221284.db2.gz XULDWUSATYNEEG-LBPRGKRZSA-N 1 1 358.398 2.969 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000583442118 519250962 /nfs/dbraw/zinc/25/09/62/519250962.db2.gz RVUWJFKGOLZYHJ-KRWDZBQOSA-N 1 1 358.373 2.562 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2cc(OC)c(C)cc2[N+](=O)[O-])CC1 ZINC000590574662 519271983 /nfs/dbraw/zinc/27/19/83/519271983.db2.gz PVXBGQKSCONEPW-AWEZNQCLSA-N 1 1 350.463 2.597 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000580656753 519288978 /nfs/dbraw/zinc/28/89/78/519288978.db2.gz FFVOGGAYXMPJKW-NVXWUHKLSA-N 1 1 357.410 2.527 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2ccc(C)cn2)c([N+](=O)[O-])c1 ZINC000590754378 519351531 /nfs/dbraw/zinc/35/15/31/519351531.db2.gz CJWYLPFCLLRJBX-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CC1(C)CC[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000591028427 519484356 /nfs/dbraw/zinc/48/43/56/519484356.db2.gz RBCHEZJDMPKLGS-OAHLLOKOSA-N 1 1 373.457 2.941 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000566552992 519547382 /nfs/dbraw/zinc/54/73/82/519547382.db2.gz CSQNHMYKLNCIPQ-CQSZACIVSA-N 1 1 365.430 2.558 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000566632834 519587753 /nfs/dbraw/zinc/58/77/53/519587753.db2.gz RBUCQLIVSOAPPJ-APWZRJJASA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000566632834 519587760 /nfs/dbraw/zinc/58/77/60/519587760.db2.gz RBUCQLIVSOAPPJ-APWZRJJASA-N 1 1 360.385 2.905 20 5 FFBDMO Cc1nccnc1C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000602853603 519927252 /nfs/dbraw/zinc/92/72/52/519927252.db2.gz JBPGLXSTHFNTNC-QAQDUYKDSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1nccnc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000602853603 519927255 /nfs/dbraw/zinc/92/72/55/519927255.db2.gz JBPGLXSTHFNTNC-QAQDUYKDSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000591510763 519934117 /nfs/dbraw/zinc/93/41/17/519934117.db2.gz JISDUFZCNFUMHH-DLBZAZTESA-N 1 1 361.442 2.585 20 5 FFBDMO C[C@H](c1ccccc1)N(C)C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602965524 519996479 /nfs/dbraw/zinc/99/64/79/519996479.db2.gz HXDAQJOCYBPHDA-FOIQADDNSA-N 1 1 371.437 2.612 20 5 FFBDMO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000591723137 520011145 /nfs/dbraw/zinc/01/11/45/520011145.db2.gz ILVCPQDELQTHHJ-CYBMUJFWSA-N 1 1 372.429 2.592 20 5 FFBDMO Cc1[nH]c2nc[nH+]c(N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c2c1C ZINC000591897971 520074540 /nfs/dbraw/zinc/07/45/40/520074540.db2.gz YWOQIRBXBIERHI-UHFFFAOYSA-N 1 1 352.398 2.810 20 5 FFBDMO COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000600192542 520113215 /nfs/dbraw/zinc/11/32/15/520113215.db2.gz QNNDQVUOVRURLM-SFHVURJKSA-N 1 1 360.366 2.619 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000600224134 520136179 /nfs/dbraw/zinc/13/61/79/520136179.db2.gz GCTFTGSCGQXSOJ-GOSISDBHSA-N 1 1 370.453 2.916 20 5 FFBDMO CCn1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000616786233 520139524 /nfs/dbraw/zinc/13/95/24/520139524.db2.gz PQPJQQHBAFVDAB-UHFFFAOYSA-N 1 1 360.414 2.885 20 5 FFBDMO CCCN(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@@H+](C)C1 ZINC000592024735 520140850 /nfs/dbraw/zinc/14/08/50/520140850.db2.gz YBHTZBVMPLNQMB-INIZCTEOSA-N 1 1 373.457 2.744 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000600227976 520140992 /nfs/dbraw/zinc/14/09/92/520140992.db2.gz SAKRLXJQHFWAJP-QGZVFWFLSA-N 1 1 356.426 2.906 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866649 520149031 /nfs/dbraw/zinc/14/90/31/520149031.db2.gz LAKMHVRYNNAKCS-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866649 520149039 /nfs/dbraw/zinc/14/90/39/520149039.db2.gz LAKMHVRYNNAKCS-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000597711585 520191715 /nfs/dbraw/zinc/19/17/15/520191715.db2.gz VHFCUAKZHPNQIC-LJQANCHMSA-N 1 1 356.426 2.563 20 5 FFBDMO Cc1nccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)n1 ZINC000592132577 520208251 /nfs/dbraw/zinc/20/82/51/520208251.db2.gz KKEUGDBRSVIUIZ-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1nccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)n1 ZINC000592132577 520208257 /nfs/dbraw/zinc/20/82/57/520208257.db2.gz KKEUGDBRSVIUIZ-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccsc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000609150158 520210107 /nfs/dbraw/zinc/21/01/07/520210107.db2.gz RTZBZDXAPLCZSZ-UHFFFAOYSA-N 1 1 360.483 2.910 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000609194742 520225690 /nfs/dbraw/zinc/22/56/90/520225690.db2.gz HQKTVUSXASZKOL-KRWDZBQOSA-N 1 1 360.410 2.518 20 5 FFBDMO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CS1(=O)=O ZINC000594974464 520236754 /nfs/dbraw/zinc/23/67/54/520236754.db2.gz LUCANFQBCTYFKQ-OLZOCXBDSA-N 1 1 364.423 2.910 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000603403877 520249960 /nfs/dbraw/zinc/24/99/60/520249960.db2.gz WIXMIBBWCAJVCI-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C\c1nc([C@@H]2C[N@@H+]3CCC[C@H]3CO2)no1 ZINC000612981975 520256595 /nfs/dbraw/zinc/25/65/95/520256595.db2.gz GXXHGJCBVZQWNY-VLLIJTNSSA-N 1 1 360.345 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C\c1nc([C@@H]2C[N@H+]3CCC[C@H]3CO2)no1 ZINC000612981975 520256602 /nfs/dbraw/zinc/25/66/02/520256602.db2.gz GXXHGJCBVZQWNY-VLLIJTNSSA-N 1 1 360.345 2.823 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000600470719 520279323 /nfs/dbraw/zinc/27/93/23/520279323.db2.gz ICDZZVCYILPDBF-KRWDZBQOSA-N 1 1 372.469 2.942 20 5 FFBDMO CCc1cccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000603581942 520313859 /nfs/dbraw/zinc/31/38/59/520313859.db2.gz YSTZQNCNJXWRSY-UHFFFAOYSA-N 1 1 356.426 2.753 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595298057 520392220 /nfs/dbraw/zinc/39/22/20/520392220.db2.gz NZNARZINWSZKAL-IYBDPMFKSA-N 1 1 364.465 2.724 20 5 FFBDMO Cc1noc(C[NH+]2CCC(C(=O)NCc3ccc(C)cc3)CC2)c1[N+](=O)[O-] ZINC000595332602 520412654 /nfs/dbraw/zinc/41/26/54/520412654.db2.gz KTOBFJKMJBDLTO-UHFFFAOYSA-N 1 1 372.425 2.728 20 5 FFBDMO CN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000609724564 520414497 /nfs/dbraw/zinc/41/44/97/520414497.db2.gz ARGNINDFBWCDGA-AWEZNQCLSA-N 1 1 367.833 2.712 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492826 520416182 /nfs/dbraw/zinc/41/61/82/520416182.db2.gz DJZLNBOLVZQACJ-OWCLPIDISA-N 1 1 360.458 2.633 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC[NH+]1Cc2ccccc2C1 ZINC000609792625 520433620 /nfs/dbraw/zinc/43/36/20/520433620.db2.gz IKOJKGFFKYFYJR-UHFFFAOYSA-N 1 1 359.813 2.923 20 5 FFBDMO O=C1Nc2ccccc2S[C@@H]1CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000595421728 520460385 /nfs/dbraw/zinc/46/03/85/520460385.db2.gz BXYYOAGCJFMPIV-QGZVFWFLSA-N 1 1 370.434 2.851 20 5 FFBDMO O=C1Nc2ccccc2S[C@@H]1CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000595421728 520460392 /nfs/dbraw/zinc/46/03/92/520460392.db2.gz BXYYOAGCJFMPIV-QGZVFWFLSA-N 1 1 370.434 2.851 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000598194744 520485020 /nfs/dbraw/zinc/48/50/20/520485020.db2.gz HKQNWLCVDRMTOC-LJQANCHMSA-N 1 1 353.422 2.984 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609984188 520496578 /nfs/dbraw/zinc/49/65/78/520496578.db2.gz QSZCKIZXORNEOA-IUODEOHRSA-N 1 1 369.849 2.814 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000604446403 520565553 /nfs/dbraw/zinc/56/55/53/520565553.db2.gz LUXNZRHNOVOPBV-STQMWFEESA-N 1 1 369.849 2.864 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC000604509292 520582884 /nfs/dbraw/zinc/58/28/84/520582884.db2.gz XQRTZPXNDGKDTR-UHFFFAOYSA-N 1 1 360.439 2.734 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc21 ZINC000595618809 520597000 /nfs/dbraw/zinc/59/70/00/520597000.db2.gz RXKTWPNQMHRTRX-KRWDZBQOSA-N 1 1 372.425 2.732 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc21 ZINC000595618809 520597004 /nfs/dbraw/zinc/59/70/04/520597004.db2.gz RXKTWPNQMHRTRX-KRWDZBQOSA-N 1 1 372.425 2.732 20 5 FFBDMO C[C@H](CCN1CC[NH+](C)CC1)Nc1ccc([N+](=O)[O-])cc1Br ZINC000613704715 520627610 /nfs/dbraw/zinc/62/76/10/520627610.db2.gz MONWOAUGUNFUPG-GFCCVEGCSA-N 1 1 371.279 2.795 20 5 FFBDMO COc1c(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000592881119 520632031 /nfs/dbraw/zinc/63/20/31/520632031.db2.gz KQVSXBLMSKPBBV-WBVHZDCISA-N 1 1 369.421 2.679 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000601148824 520660326 /nfs/dbraw/zinc/66/03/26/520660326.db2.gz GTFHMPWIKOTABC-HXUWFJFHSA-N 1 1 366.421 2.837 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601150002 520662190 /nfs/dbraw/zinc/66/21/90/520662190.db2.gz RRNLUZOBESUSNN-WBVHZDCISA-N 1 1 363.439 2.900 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(N3CCSCC3)c2)c(F)c1 ZINC000601151435 520662292 /nfs/dbraw/zinc/66/22/92/520662292.db2.gz AFJPUUCIQPLLFU-UHFFFAOYSA-N 1 1 362.430 2.972 20 5 FFBDMO COc1ccc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598511619 520672398 /nfs/dbraw/zinc/67/23/98/520672398.db2.gz TWVVAHYZTAMCQV-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598511619 520672405 /nfs/dbraw/zinc/67/24/05/520672405.db2.gz TWVVAHYZTAMCQV-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO CC[C@@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000593056274 520713457 /nfs/dbraw/zinc/71/34/57/520713457.db2.gz DQHFURNIMLMQNV-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC([C@H]3CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595785203 520722558 /nfs/dbraw/zinc/72/25/58/520722558.db2.gz WWRXAKFVMXVSEU-RBUKOAKNSA-N 1 1 373.453 2.981 20 5 FFBDMO COC(=O)c1ccnc(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000598591715 520732358 /nfs/dbraw/zinc/73/23/58/520732358.db2.gz AJHQYLBQJIMHGE-LBPRGKRZSA-N 1 1 350.419 2.699 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC000595831605 520756132 /nfs/dbraw/zinc/75/61/32/520756132.db2.gz GIZQAQNSOJYHFH-OAHLLOKOSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC000595831605 520756138 /nfs/dbraw/zinc/75/61/38/520756138.db2.gz GIZQAQNSOJYHFH-OAHLLOKOSA-N 1 1 352.456 2.881 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595869493 520778974 /nfs/dbraw/zinc/77/89/74/520778974.db2.gz DLKDUKGQIDYTCR-PIGZYNQJSA-N 1 1 374.384 2.698 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900788 520807381 /nfs/dbraw/zinc/80/73/81/520807381.db2.gz LFQWOIBPDUZOLK-ZBFHGGJFSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@](C)(C(F)F)O1 ZINC000595918105 520824146 /nfs/dbraw/zinc/82/41/46/520824146.db2.gz ONQJNPLCEVQMHZ-ZBEGNZNMSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@](C)(C(F)F)O1 ZINC000595918105 520824151 /nfs/dbraw/zinc/82/41/51/520824151.db2.gz ONQJNPLCEVQMHZ-ZBEGNZNMSA-N 1 1 357.357 2.668 20 5 FFBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000610782878 520841353 /nfs/dbraw/zinc/84/13/53/520841353.db2.gz LENAXISBHUOYJS-HNNXBMFYSA-N 1 1 360.414 2.652 20 5 FFBDMO COc1cc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596078618 520899646 /nfs/dbraw/zinc/89/96/46/520899646.db2.gz XWPQVJZPSFSFSP-ZDUSSCGKSA-N 1 1 369.849 2.948 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593323657 520909863 /nfs/dbraw/zinc/90/98/63/520909863.db2.gz SKNVZTFGVXKQIT-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593323657 520909870 /nfs/dbraw/zinc/90/98/70/520909870.db2.gz SKNVZTFGVXKQIT-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@H]1Cc1ccccc1 ZINC000593322405 520909960 /nfs/dbraw/zinc/90/99/60/520909960.db2.gz MMIRYDZXTDHMFG-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@H]1Cc1ccccc1 ZINC000593322405 520909963 /nfs/dbraw/zinc/90/99/63/520909963.db2.gz MMIRYDZXTDHMFG-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596150992 520940826 /nfs/dbraw/zinc/94/08/26/520940826.db2.gz GWDIBOVKSOTSEH-WDEREUQCSA-N 1 1 355.822 2.811 20 5 FFBDMO COc1cccc(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)c1[N+](=O)[O-] ZINC000618241110 520958745 /nfs/dbraw/zinc/95/87/45/520958745.db2.gz VZYJOJGWFHFWMI-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2oc(=O)n(C)c2c1 ZINC000599008852 520976051 /nfs/dbraw/zinc/97/60/51/520976051.db2.gz UXCIUNHYFLPVNI-UHFFFAOYSA-N 1 1 357.366 2.728 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCOCC3)C2)cc1C(F)(F)F ZINC000596247429 520992649 /nfs/dbraw/zinc/99/26/49/520992649.db2.gz ONPWRQDISOKOIY-CYBMUJFWSA-N 1 1 359.348 2.915 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599081905 521021503 /nfs/dbraw/zinc/02/15/03/521021503.db2.gz VVMCTANLNNQBSJ-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000593496322 521031607 /nfs/dbraw/zinc/03/16/07/521031607.db2.gz NZMWOXOSKOPVTL-CABCVRRESA-N 1 1 360.439 2.531 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000593496325 521032306 /nfs/dbraw/zinc/03/23/06/521032306.db2.gz NZMWOXOSKOPVTL-LSDHHAIUSA-N 1 1 360.439 2.531 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596336666 521034080 /nfs/dbraw/zinc/03/40/80/521034080.db2.gz RLARMFKACDGFEP-AWEZNQCLSA-N 1 1 371.441 2.844 20 5 FFBDMO O=C(C[NH+]1CCC(c2cccnc2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000611258891 521062135 /nfs/dbraw/zinc/06/21/35/521062135.db2.gz ZHICEHHBADGBLH-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599164081 521066653 /nfs/dbraw/zinc/06/66/53/521066653.db2.gz JJINESOOVLGVFW-GOSISDBHSA-N 1 1 374.485 2.856 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)s1 ZINC000596478112 521092174 /nfs/dbraw/zinc/09/21/74/521092174.db2.gz GSDWUNPNNWZICP-LLVKDONJSA-N 1 1 373.500 2.879 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C3CCCCC3)C2)s1 ZINC000596478112 521092180 /nfs/dbraw/zinc/09/21/80/521092180.db2.gz GSDWUNPNNWZICP-LLVKDONJSA-N 1 1 373.500 2.879 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000611350878 521115205 /nfs/dbraw/zinc/11/52/05/521115205.db2.gz VQTGZPUSWHXJPI-JKSUJKDBSA-N 1 1 373.453 2.623 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000611350875 521116020 /nfs/dbraw/zinc/11/60/20/521116020.db2.gz VQTGZPUSWHXJPI-HOTGVXAUSA-N 1 1 373.453 2.623 20 5 FFBDMO COC(=O)Cc1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571725 521138778 /nfs/dbraw/zinc/13/87/78/521138778.db2.gz YVKUMXZMZBNDTB-MRXNPFEDSA-N 1 1 361.442 2.844 20 5 FFBDMO COC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000593674566 521146111 /nfs/dbraw/zinc/14/61/11/521146111.db2.gz YLAPGLRXXDBHAC-QZTJIDSGSA-N 1 1 371.437 2.944 20 5 FFBDMO CCN(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@@H+](CC)C1 ZINC000596600812 521158583 /nfs/dbraw/zinc/15/85/83/521158583.db2.gz LGKLWIJRFNJEJU-INIZCTEOSA-N 1 1 373.457 2.744 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccncc3Br)CC2)n1 ZINC000599396581 521198226 /nfs/dbraw/zinc/19/82/26/521198226.db2.gz QKPNNHUPLRDHEE-UHFFFAOYSA-N 1 1 366.219 2.786 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000611518460 521198544 /nfs/dbraw/zinc/19/85/44/521198544.db2.gz AWWDKOQOWXWAOW-GFCCVEGCSA-N 1 1 373.400 2.773 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611579337 521231625 /nfs/dbraw/zinc/23/16/25/521231625.db2.gz VLTRMUIDJJTFAF-LBPRGKRZSA-N 1 1 373.356 2.636 20 5 FFBDMO COC(=O)[C@](C)(NCC[N@@H+](C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000599650239 521362164 /nfs/dbraw/zinc/36/21/64/521362164.db2.gz GRAUBBYBPLIBJN-HXUWFJFHSA-N 1 1 371.437 2.705 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602496029 521378786 /nfs/dbraw/zinc/37/87/86/521378786.db2.gz ZLHUQLSQBLKOOB-LBPRGKRZSA-N 1 1 359.348 2.914 20 5 FFBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCN(c2cnccn2)CC1 ZINC000619077478 521385766 /nfs/dbraw/zinc/38/57/66/521385766.db2.gz IQOLDJJONAGJQR-XQRVVYSFSA-N 1 1 353.426 2.999 20 5 FFBDMO O=[N+]([O-])c1sc(CNC[C@@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000602508696 521386609 /nfs/dbraw/zinc/38/66/09/521386609.db2.gz DNGNTHITBGZJCE-VIFPVBQESA-N 1 1 360.277 2.993 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000599693757 521406754 /nfs/dbraw/zinc/40/67/54/521406754.db2.gz GCYLYDYJJBJKOZ-DABQJJPHSA-N 1 1 374.397 2.807 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000599693757 521406763 /nfs/dbraw/zinc/40/67/63/521406763.db2.gz GCYLYDYJJBJKOZ-DABQJJPHSA-N 1 1 374.397 2.807 20 5 FFBDMO Cn1c[nH+]c2cc(NC3CCN(c4ccc([N+](=O)[O-])nc4)CC3)ccc21 ZINC000602590457 521426679 /nfs/dbraw/zinc/42/66/79/521426679.db2.gz UTOUDXUVSPTNCH-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO Cc1c(C[NH2+]Cc2cc(C(=O)OC(C)(C)C)nn2C)cccc1[N+](=O)[O-] ZINC000602634929 521449446 /nfs/dbraw/zinc/44/94/46/521449446.db2.gz QHWCPXUKXZUZPD-UHFFFAOYSA-N 1 1 360.414 2.882 20 5 FFBDMO COCCn1cc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602655092 521461442 /nfs/dbraw/zinc/46/14/42/521461442.db2.gz YAMGECUAWWCUEE-UHFFFAOYSA-N 1 1 358.320 2.746 20 5 FFBDMO Cn1cc(C[NH+]2CCC(c3noc4cc(F)ccc43)CC2)c([N+](=O)[O-])n1 ZINC000602671711 521471945 /nfs/dbraw/zinc/47/19/45/521471945.db2.gz UMIFHGUVNLIVNG-UHFFFAOYSA-N 1 1 359.361 2.988 20 5 FFBDMO CCN(C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](CC)C1 ZINC000597092073 521497675 /nfs/dbraw/zinc/49/76/75/521497675.db2.gz JMLBJKNAVDKJDU-NSHDSACASA-N 1 1 355.826 2.778 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599830056 521497831 /nfs/dbraw/zinc/49/78/31/521497831.db2.gz PSJYDOXQCZAVNY-CYBMUJFWSA-N 1 1 357.414 2.996 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000599831168 521499291 /nfs/dbraw/zinc/49/92/91/521499291.db2.gz OXRQKZZJQGANMF-DOTOQJQBSA-N 1 1 355.398 2.891 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1CC(=O)c1ccc(F)cc1 ZINC000602797071 521538473 /nfs/dbraw/zinc/53/84/73/521538473.db2.gz LNFLDKNCFRWEDB-INIZCTEOSA-N 1 1 360.389 2.976 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000602825119 521555312 /nfs/dbraw/zinc/55/53/12/521555312.db2.gz JPMFTPOWCIFNDX-XBVQOTNRSA-N 1 1 350.463 2.751 20 5 FFBDMO COc1c(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000619442453 521569592 /nfs/dbraw/zinc/56/95/92/521569592.db2.gz VNIXBDCAZMXSLA-KBPBESRZSA-N 1 1 361.442 2.986 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@]34COC[C@@]3(C1)CCCC4)OCCO2 ZINC000597248302 521595674 /nfs/dbraw/zinc/59/56/74/521595674.db2.gz PONGZBZVOGQETQ-KDURUIRLSA-N 1 1 360.410 2.759 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000616136118 521628639 /nfs/dbraw/zinc/62/86/39/521628639.db2.gz XJZBLUFZEHBVHY-AWEZNQCLSA-N 1 1 360.366 2.729 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164722049 720394850 /nfs/dbraw/zinc/39/48/50/720394850.db2.gz BTWYRVZYWUBDOB-IAGOWNOFSA-N 1 1 353.426 2.855 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](CCc2ccccn2)CC1 ZINC001165056226 722015179 /nfs/dbraw/zinc/01/51/79/722015179.db2.gz PRSOQFHSCSZHSB-UHFFFAOYSA-N 1 1 363.421 2.903 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000897984946 735300213 /nfs/dbraw/zinc/30/02/13/735300213.db2.gz HWNQRYSUEHQKTD-LBPRGKRZSA-N 1 1 364.789 2.856 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000066080337 728166457 /nfs/dbraw/zinc/16/64/57/728166457.db2.gz VJQAWXKXVDWKEH-NSHDSACASA-N 1 1 364.427 2.807 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000066080337 728166461 /nfs/dbraw/zinc/16/64/61/728166461.db2.gz VJQAWXKXVDWKEH-NSHDSACASA-N 1 1 364.427 2.807 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000081571218 728401777 /nfs/dbraw/zinc/40/17/77/728401777.db2.gz WYIIAJIBVJENED-CYBMUJFWSA-N 1 1 368.865 2.850 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@H]1CCCC[C@@H]1O ZINC000130073375 728714930 /nfs/dbraw/zinc/71/49/30/728714930.db2.gz PSEZAVOMYMOSFM-WBMJQRKESA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCSCC1 ZINC000179145497 729179009 /nfs/dbraw/zinc/17/90/09/729179009.db2.gz RUJIIPMBUYCMDX-NSHDSACASA-N 1 1 357.863 2.644 20 5 FFBDMO CC1(C)CC[C@@H](CO)[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000856803395 730358787 /nfs/dbraw/zinc/35/87/87/730358787.db2.gz DUXZOUFEEKFPCU-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)CC[C@@H](CO)[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000856803395 730358789 /nfs/dbraw/zinc/35/87/89/730358789.db2.gz DUXZOUFEEKFPCU-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1ccc(NC2CC([NH+]3CCOCC3)C2)c([N+](=O)[O-])c1Br ZINC000858601152 730429596 /nfs/dbraw/zinc/42/95/96/730429596.db2.gz WPHFUEQIMBQULY-UHFFFAOYSA-N 1 1 370.247 2.941 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860054503 730474604 /nfs/dbraw/zinc/47/46/04/730474604.db2.gz LWJIQMWPINJMLD-JTQLQIEISA-N 1 1 350.400 2.739 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000861032215 730569009 /nfs/dbraw/zinc/56/90/09/730569009.db2.gz KRYGYJZFZBMBQR-HIFRSBDPSA-N 1 1 368.455 2.729 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1cc(F)c([N+](=O)[O-])cc1CO ZINC000865804416 730999331 /nfs/dbraw/zinc/99/93/31/730999331.db2.gz XWEWVNTWTZMPPL-UHFFFAOYSA-N 1 1 351.378 2.778 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(C)s3)CC[NH2+]2)cc1 ZINC000870137219 731473737 /nfs/dbraw/zinc/47/37/37/731473737.db2.gz RWRJRNLHVOMMKX-AWEZNQCLSA-N 1 1 361.423 2.760 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)CN1CCN(C)CC1 ZINC000872034650 731722974 /nfs/dbraw/zinc/72/29/74/731722974.db2.gz QCLZUCJJCVLHTR-KGLIPLIRSA-N 1 1 352.504 2.603 20 5 FFBDMO C[C@@H]1[C@H](C)N(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000878341252 732516867 /nfs/dbraw/zinc/51/68/67/732516867.db2.gz ZTTRZKVXQWPQBK-MNOVXSKESA-N 1 1 365.821 2.823 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000879563079 732724244 /nfs/dbraw/zinc/72/42/44/732724244.db2.gz QGCXSGGKWFGBFE-CHWSQXEVSA-N 1 1 363.439 2.578 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3Br)CC[C@@H]21 ZINC000881439508 733055273 /nfs/dbraw/zinc/05/52/73/733055273.db2.gz NZSXYYKHPOCFGC-JQWIXIFHSA-N 1 1 368.231 2.524 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827877 733845194 /nfs/dbraw/zinc/84/51/94/733845194.db2.gz SXXJBGPEVSLQMP-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000886827877 733845197 /nfs/dbraw/zinc/84/51/97/733845197.db2.gz SXXJBGPEVSLQMP-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@H](C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928092560 738820904 /nfs/dbraw/zinc/82/09/04/738820904.db2.gz SZWPUUGGPHAJCN-UVBJJODRSA-N 1 1 367.446 2.533 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c1 ZINC000928093962 738821085 /nfs/dbraw/zinc/82/10/85/738821085.db2.gz FJOYNNLWZKETII-DZGCQCFKSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1 ZINC000928093962 738821090 /nfs/dbraw/zinc/82/10/90/738821090.db2.gz FJOYNNLWZKETII-DZGCQCFKSA-N 1 1 367.496 2.626 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095116 738821992 /nfs/dbraw/zinc/82/19/92/738821992.db2.gz MXWARXGLFCHIQZ-CHWSQXEVSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095116 738821997 /nfs/dbraw/zinc/82/19/97/738821997.db2.gz MXWARXGLFCHIQZ-CHWSQXEVSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000729545242 734583446 /nfs/dbraw/zinc/58/34/46/734583446.db2.gz CMNVIBSTZLAIRV-CYBMUJFWSA-N 1 1 368.821 2.577 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000783920097 738849246 /nfs/dbraw/zinc/84/92/46/738849246.db2.gz ZBRLDRPWGNUMKK-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC000928431765 738868652 /nfs/dbraw/zinc/86/86/52/738868652.db2.gz OJTVZHCEBCXKIQ-HZGVNTEJSA-N 1 1 350.177 2.863 20 5 FFBDMO COc1cc(C[NH2+]C[C@@H]2CC(C)=NO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000895307376 734989340 /nfs/dbraw/zinc/98/93/40/734989340.db2.gz QHQPSVIUBVQWBX-NSHDSACASA-N 1 1 359.329 2.502 20 5 FFBDMO CCO/C=C\[C@@](O)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000895710501 735044546 /nfs/dbraw/zinc/04/45/46/735044546.db2.gz MDKMZRYUWWTSOK-CFHLNLSMSA-N 1 1 352.284 2.667 20 5 FFBDMO O=C(C[NH+]1CCC([C@@H]2CCOC2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000784342140 738880604 /nfs/dbraw/zinc/88/06/04/738880604.db2.gz ORHSGVUMSRJXPX-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO COc1cc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c(Cl)cc1[N+](=O)[O-] ZINC000896525773 735173030 /nfs/dbraw/zinc/17/30/30/735173030.db2.gz OPADDPHGEDTZQT-LBPRGKRZSA-N 1 1 355.822 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cc1C(F)(F)F ZINC000897221197 735208109 /nfs/dbraw/zinc/20/81/09/735208109.db2.gz JFFGCOWIDLFFBF-HUUCEWRRSA-N 1 1 359.348 2.649 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932767 735937173 /nfs/dbraw/zinc/93/71/73/735937173.db2.gz FQHSWAFJBJFSSY-GXFFZTMASA-N 1 1 361.240 2.647 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932767 735937181 /nfs/dbraw/zinc/93/71/81/735937181.db2.gz FQHSWAFJBJFSSY-GXFFZTMASA-N 1 1 361.240 2.647 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[N@@H+]2CCOC[C@@H]2C1 ZINC000754080856 736123163 /nfs/dbraw/zinc/12/31/63/736123163.db2.gz CSOQXVJXZMADNG-VIFPVBQESA-N 1 1 365.739 2.788 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[N@H+]2CCOC[C@@H]2C1 ZINC000754080856 736123166 /nfs/dbraw/zinc/12/31/66/736123166.db2.gz CSOQXVJXZMADNG-VIFPVBQESA-N 1 1 365.739 2.788 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000756902167 736371614 /nfs/dbraw/zinc/37/16/14/736371614.db2.gz QMQHQNMSBBBVJB-FZMZJTMJSA-N 1 1 353.806 2.688 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757262491 736399346 /nfs/dbraw/zinc/39/93/46/736399346.db2.gz NALIJTLLSUDXRX-OAHLLOKOSA-N 1 1 354.838 2.730 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccnc(Cl)c1 ZINC000757677117 736418812 /nfs/dbraw/zinc/41/88/12/736418812.db2.gz YBOKXJJRUVISEM-NSHDSACASA-N 1 1 369.830 2.768 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000906240753 736475451 /nfs/dbraw/zinc/47/54/51/736475451.db2.gz OZROIAPYEXCWGC-UONOGXRCSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000907795540 736668459 /nfs/dbraw/zinc/66/84/59/736668459.db2.gz YNAKFWSRQCSOGV-VXGBXAGGSA-N 1 1 359.760 2.646 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2Br)C[C@@H]1C ZINC000766557950 737241976 /nfs/dbraw/zinc/24/19/76/737241976.db2.gz WYPLRSMUTRQNOJ-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000913759905 737443818 /nfs/dbraw/zinc/44/38/18/737443818.db2.gz BXRJIGPGHPFKGE-XJKSGUPXSA-N 1 1 351.834 2.733 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769148723 737501629 /nfs/dbraw/zinc/50/16/29/737501629.db2.gz QIAMEYJKHZPJRR-SNVBAGLBSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769148723 737501625 /nfs/dbraw/zinc/50/16/25/737501625.db2.gz QIAMEYJKHZPJRR-SNVBAGLBSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769148722 737501686 /nfs/dbraw/zinc/50/16/86/737501686.db2.gz QIAMEYJKHZPJRR-JTQLQIEISA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769148722 737501690 /nfs/dbraw/zinc/50/16/90/737501690.db2.gz QIAMEYJKHZPJRR-JTQLQIEISA-N 1 1 356.220 2.587 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395084 737722076 /nfs/dbraw/zinc/72/20/76/737722076.db2.gz KITDAZRAZFCVMZ-IUCAKERBSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395084 737722077 /nfs/dbraw/zinc/72/20/77/737722077.db2.gz KITDAZRAZFCVMZ-IUCAKERBSA-N 1 1 374.210 2.661 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000771944308 737768668 /nfs/dbraw/zinc/76/86/68/737768668.db2.gz VFZKMKZNCIMNNZ-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)C[C@H]1C ZINC000778009118 738342015 /nfs/dbraw/zinc/34/20/15/738342015.db2.gz KTLWDFOOYKDJJA-OLZOCXBDSA-N 1 1 373.450 2.536 20 5 FFBDMO COCCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000929663240 739009336 /nfs/dbraw/zinc/00/93/36/739009336.db2.gz BPWHYNNNERTZEA-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018159 739374171 /nfs/dbraw/zinc/37/41/71/739374171.db2.gz AXWNSWKTTRVRIC-QLJPJBMISA-N 1 1 355.341 2.584 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018159 739374172 /nfs/dbraw/zinc/37/41/72/739374172.db2.gz AXWNSWKTTRVRIC-QLJPJBMISA-N 1 1 355.341 2.584 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)COC(=O)N1 ZINC000932020675 739374704 /nfs/dbraw/zinc/37/47/04/739374704.db2.gz KJFLLGVDUBFLBL-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436152 739453785 /nfs/dbraw/zinc/45/37/85/739453785.db2.gz HIGQREOSWFXADM-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436152 739453788 /nfs/dbraw/zinc/45/37/88/739453788.db2.gz HIGQREOSWFXADM-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933340784 739607014 /nfs/dbraw/zinc/60/70/14/739607014.db2.gz VSPSCCHACCYGLO-JTQLQIEISA-N 1 1 360.336 2.995 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333398 739766930 /nfs/dbraw/zinc/76/69/30/739766930.db2.gz OTPZXAZKCSARKW-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333398 739766938 /nfs/dbraw/zinc/76/69/38/739766938.db2.gz OTPZXAZKCSARKW-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H]3CSC[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000934776346 739838681 /nfs/dbraw/zinc/83/86/81/739838681.db2.gz JSOFVXAEWHMDKJ-PXAZEXFGSA-N 1 1 365.455 2.617 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccccc1Cl)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963791250 740656240 /nfs/dbraw/zinc/65/62/40/740656240.db2.gz QAPOLQFONLHWIN-KLQVMUDPSA-N 1 1 363.845 2.522 20 5 FFBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804809216 740906619 /nfs/dbraw/zinc/90/66/19/740906619.db2.gz SCVQLIBBOYLZSN-YPMHNXCESA-N 1 1 359.348 2.913 20 5 FFBDMO COC(=O)C[C@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOC1 ZINC000809978440 741369282 /nfs/dbraw/zinc/36/92/82/741369282.db2.gz WXTDSTFPAWERMC-CQSZACIVSA-N 1 1 363.197 2.713 20 5 FFBDMO C[N@@H+](Cc1cc(F)ccc1Cl)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985431648 741395472 /nfs/dbraw/zinc/39/54/72/741395472.db2.gz RPOJXTVSILXEDN-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1cc(F)ccc1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985431648 741395476 /nfs/dbraw/zinc/39/54/76/741395476.db2.gz RPOJXTVSILXEDN-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1cc(F)ccc1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985431648 741395480 /nfs/dbraw/zinc/39/54/80/741395480.db2.gz RPOJXTVSILXEDN-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO CC[C@@H](C)[C@@H](OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173254 741684716 /nfs/dbraw/zinc/68/47/16/741684716.db2.gz ZKTPIUCQTKNSTO-XOKHGSTOSA-N 1 1 350.415 2.773 20 5 FFBDMO CC[C@@H](C)[C@@H](OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173254 741684717 /nfs/dbraw/zinc/68/47/17/741684717.db2.gz ZKTPIUCQTKNSTO-XOKHGSTOSA-N 1 1 350.415 2.773 20 5 FFBDMO COCCC(C)(C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174140 741684989 /nfs/dbraw/zinc/68/49/89/741684989.db2.gz QNILCOVIKCCREE-INIZCTEOSA-N 1 1 350.415 2.775 20 5 FFBDMO COCCC(C)(C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174140 741684991 /nfs/dbraw/zinc/68/49/91/741684991.db2.gz QNILCOVIKCCREE-INIZCTEOSA-N 1 1 350.415 2.775 20 5 FFBDMO O=C(CCc1cscn1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174520 741685010 /nfs/dbraw/zinc/68/50/10/741685010.db2.gz WGUKKZNTEDHFFB-INIZCTEOSA-N 1 1 361.423 2.802 20 5 FFBDMO O=C(CCc1cscn1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174520 741685013 /nfs/dbraw/zinc/68/50/13/741685013.db2.gz WGUKKZNTEDHFFB-INIZCTEOSA-N 1 1 361.423 2.802 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)C2 ZINC000821026027 742578872 /nfs/dbraw/zinc/57/88/72/742578872.db2.gz OUQNOOQKPJGNTC-MRXNPFEDSA-N 1 1 370.812 2.527 20 5 FFBDMO C[N@H+](Cc1ccccc1Cl)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964223 742823211 /nfs/dbraw/zinc/82/32/11/742823211.db2.gz ACYHJRSGYKEHMK-NVXWUHKLSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@@H+](Cc1ccccc1Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964223 742823219 /nfs/dbraw/zinc/82/32/19/742823219.db2.gz ACYHJRSGYKEHMK-NVXWUHKLSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@H+](Cc1ccccc1Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964223 742823227 /nfs/dbraw/zinc/82/32/27/742823227.db2.gz ACYHJRSGYKEHMK-NVXWUHKLSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@H+](Cc1sccc1Cl)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964676 742823454 /nfs/dbraw/zinc/82/34/54/742823454.db2.gz VEUFYAWVIOJPKK-TZMCWYRMSA-N 1 1 371.890 2.737 20 5 FFBDMO C[N@@H+](Cc1sccc1Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964676 742823458 /nfs/dbraw/zinc/82/34/58/742823458.db2.gz VEUFYAWVIOJPKK-TZMCWYRMSA-N 1 1 371.890 2.737 20 5 FFBDMO C[N@H+](Cc1sccc1Cl)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964676 742823467 /nfs/dbraw/zinc/82/34/67/742823467.db2.gz VEUFYAWVIOJPKK-TZMCWYRMSA-N 1 1 371.890 2.737 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503873 742928630 /nfs/dbraw/zinc/92/86/30/742928630.db2.gz ZXLRLIPQCVBAEH-FUHWJXTLSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503873 742928634 /nfs/dbraw/zinc/92/86/34/742928634.db2.gz ZXLRLIPQCVBAEH-FUHWJXTLSA-N 1 1 350.415 2.682 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C1 ZINC000829176129 745176321 /nfs/dbraw/zinc/17/63/21/745176321.db2.gz QRRATERHMWUDBV-GFCCVEGCSA-N 1 1 355.385 2.985 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839393073 746821329 /nfs/dbraw/zinc/82/13/29/746821329.db2.gz VJSRDISFTAJRFN-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839393073 746821336 /nfs/dbraw/zinc/82/13/36/746821336.db2.gz VJSRDISFTAJRFN-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000839532336 746848491 /nfs/dbraw/zinc/84/84/91/746848491.db2.gz WQEYIRSHFRGJFY-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000839532334 746848657 /nfs/dbraw/zinc/84/86/57/746848657.db2.gz WQEYIRSHFRGJFY-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000842163624 747536940 /nfs/dbraw/zinc/53/69/40/747536940.db2.gz QNUDVEZYRRAZIE-QWRGUYRKSA-N 1 1 362.257 2.789 20 5 FFBDMO C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO ZINC000842163623 747537054 /nfs/dbraw/zinc/53/70/54/747537054.db2.gz QNUDVEZYRRAZIE-MNOVXSKESA-N 1 1 362.257 2.789 20 5 FFBDMO C[C@@H]1[C@H](COC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000845818101 748331378 /nfs/dbraw/zinc/33/13/78/748331378.db2.gz OUBQENZEQHNGFC-ZJUUUORDSA-N 1 1 357.204 2.854 20 5 FFBDMO CCOc1cc(C(=O)OCC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC ZINC000847828101 748791717 /nfs/dbraw/zinc/79/17/17/748791717.db2.gz LQONYAFTGMKACM-LBPRGKRZSA-N 1 1 352.387 2.501 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCCCNC3=O)o2)c([N+](=O)[O-])c1 ZINC000123917568 971808077 /nfs/dbraw/zinc/80/80/77/971808077.db2.gz WYKMVFPRTLGREV-MRXNPFEDSA-N 1 1 373.409 2.964 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCCCNC3=O)o2)c([N+](=O)[O-])c1 ZINC000123917568 971808082 /nfs/dbraw/zinc/80/80/82/971808082.db2.gz WYKMVFPRTLGREV-MRXNPFEDSA-N 1 1 373.409 2.964 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(N2CCN(C)CC2)nc1 ZINC000873010594 1013346657 /nfs/dbraw/zinc/34/66/57/1013346657.db2.gz MENQBEJUQLXJPH-UHFFFAOYSA-N 1 1 369.469 2.648 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC001175300896 1013432275 /nfs/dbraw/zinc/43/22/75/1013432275.db2.gz IVEGPSZFKWUCFZ-IUUKEHGRSA-N 1 1 374.397 2.837 20 5 FFBDMO CCc1cc(NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC001266777587 964071024 /nfs/dbraw/zinc/07/10/24/964071024.db2.gz WDGAAPGDONSFJU-STQMWFEESA-N 1 1 356.426 2.796 20 5 FFBDMO O=C(NCC1([NH2+]CCc2ccc(Cl)cc2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001482219111 964150783 /nfs/dbraw/zinc/15/07/83/964150783.db2.gz ZAMAYCPGETUKAL-HZPDHXFCSA-N 1 1 365.861 2.566 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCN1C(=O)OC(C)(C)C ZINC000933467408 964427395 /nfs/dbraw/zinc/42/73/95/964427395.db2.gz KVUWJYYEPFEWFX-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO CC(C)CC(=O)N1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175570045 1013513030 /nfs/dbraw/zinc/51/30/30/1013513030.db2.gz UKZQTYMJRNODCX-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO CCCn1ccnc1CCC[N@@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC000894478464 965404870 /nfs/dbraw/zinc/40/48/70/965404870.db2.gz BCXIQEQAEUQJMW-UHFFFAOYSA-N 1 1 362.430 2.980 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c2ccccc21 ZINC000892301008 966961443 /nfs/dbraw/zinc/96/14/43/966961443.db2.gz VVHLTZRNPQOPGR-LBPRGKRZSA-N 1 1 353.382 2.554 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001270925153 967823063 /nfs/dbraw/zinc/82/30/63/967823063.db2.gz HZRQEABZRUUDLR-FQEVSTJZSA-N 1 1 368.437 2.940 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000874846339 1013917249 /nfs/dbraw/zinc/91/72/49/1013917249.db2.gz IRBPBBSGYZUSKX-ROUUACIJSA-N 1 1 358.442 2.504 20 5 FFBDMO Cn1c2ccccc2c(N2CCC3(CCC[N@H+]3C)CC2)c([N+](=O)[O-])c1=O ZINC000893091729 970582742 /nfs/dbraw/zinc/58/27/42/970582742.db2.gz FUAYDEOEVVDMBD-UHFFFAOYSA-N 1 1 356.426 2.511 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]2C1 ZINC000895575728 970749900 /nfs/dbraw/zinc/74/99/00/970749900.db2.gz GXGQCZMSCZIVQR-GASCZTMLSA-N 1 1 355.394 2.765 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000825842156 1014110573 /nfs/dbraw/zinc/11/05/73/1014110573.db2.gz ZJDYMPHCSFILGF-CVEARBPZSA-N 1 1 361.442 2.621 20 5 FFBDMO CCCc1ccc(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC000981765132 976764253 /nfs/dbraw/zinc/76/42/53/976764253.db2.gz QTXYYCPSIZHWNB-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCCc1ccc(C[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765132 976764273 /nfs/dbraw/zinc/76/42/73/976764273.db2.gz QTXYYCPSIZHWNB-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCCc1ccc(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765132 976764283 /nfs/dbraw/zinc/76/42/83/976764283.db2.gz QTXYYCPSIZHWNB-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO Cc1noc(C2CC[NH+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)CC2)n1 ZINC000728899225 976916338 /nfs/dbraw/zinc/91/63/38/976916338.db2.gz DMHLJUOYZYAIFF-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO O=C(CC[NH2+][C@@H]1c2ccccc2OC[C@@H]1F)Nc1ccccc1[N+](=O)[O-] ZINC000905535554 980458832 /nfs/dbraw/zinc/45/88/32/980458832.db2.gz BIRKGLPPQHVPHZ-SCLBCKFNSA-N 1 1 359.357 2.985 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C[C@H]1C ZINC000905711483 980493663 /nfs/dbraw/zinc/49/36/63/980493663.db2.gz FIWRWNQDTIVDCX-UKRRQHHQSA-N 1 1 358.398 2.547 20 5 FFBDMO C[C@H]1CN(Cc2ccccc2)C[C@H]1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877665873 1014667926 /nfs/dbraw/zinc/66/79/26/1014667926.db2.gz MLCJIHVSHAORBM-XMZVIZOASA-N 1 1 369.469 2.853 20 5 FFBDMO COc1ccc(C[N@H+]2Cc3cccnc3N3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000877713710 1014695285 /nfs/dbraw/zinc/69/52/85/1014695285.db2.gz MHEIVRCXLCGNQZ-MRXNPFEDSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1ccc(C[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000877713710 1014695293 /nfs/dbraw/zinc/69/52/93/1014695293.db2.gz MHEIVRCXLCGNQZ-MRXNPFEDSA-N 1 1 354.410 2.983 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](C(C)(C)O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877797069 1014730637 /nfs/dbraw/zinc/73/06/37/1014730637.db2.gz PRKHQVYBEMCRCG-MRXNPFEDSA-N 1 1 358.442 2.978 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000877835396 1014749161 /nfs/dbraw/zinc/74/91/61/1014749161.db2.gz ADWQXIOPCAKARK-GFCCVEGCSA-N 1 1 374.384 2.840 20 5 FFBDMO CN(c1ccc2ncccc2c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000764144206 984314776 /nfs/dbraw/zinc/31/47/76/984314776.db2.gz WGSDXLCGQUABLB-INIZCTEOSA-N 1 1 369.469 2.748 20 5 FFBDMO O=[N+]([O-])c1c(NCc2ccccc2C[NH+]2CCOCC2)nc2ccccn21 ZINC000058304115 984577212 /nfs/dbraw/zinc/57/72/12/984577212.db2.gz FBCOXZJZVHEBBG-UHFFFAOYSA-N 1 1 367.409 2.687 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000170647470 985103701 /nfs/dbraw/zinc/10/37/01/985103701.db2.gz UNNQNMXZGLZCKG-CQSZACIVSA-N 1 1 365.430 2.820 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547129 985877042 /nfs/dbraw/zinc/87/70/42/985877042.db2.gz VDODDESSZBNWOG-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547129 985877049 /nfs/dbraw/zinc/87/70/49/985877049.db2.gz VDODDESSZBNWOG-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000370061883 987985584 /nfs/dbraw/zinc/98/55/84/987985584.db2.gz IACAHHQJSKOHJR-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3COc4ccccc4O3)CC2)cc1 ZINC000916146356 989749871 /nfs/dbraw/zinc/74/98/71/989749871.db2.gz CHNGPEXFJUIWNV-QGZVFWFLSA-N 1 1 355.394 2.557 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])c3nonc32)cn1 ZINC000917093882 990132380 /nfs/dbraw/zinc/13/23/80/990132380.db2.gz VHUIAIYFMILYGH-UHFFFAOYSA-N 1 1 351.326 2.632 20 5 FFBDMO CC1CCC([N@@H+](C)CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000917456318 990223582 /nfs/dbraw/zinc/22/35/82/990223582.db2.gz OMQIIRXEMOGQTB-TYJKZOGGSA-N 1 1 374.441 2.830 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](C/C=C/c3ccccc3)C2)CC1 ZINC001035186685 990409471 /nfs/dbraw/zinc/40/94/71/990409471.db2.gz JKKWZPIOAVYNCR-LVLPYEQSSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](C/C=C/c3ccccc3)C2)CC1 ZINC001035186685 990409476 /nfs/dbraw/zinc/40/94/76/990409476.db2.gz JKKWZPIOAVYNCR-LVLPYEQSSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](C/C=C/c3ccccc3)C2)CC1 ZINC001035186685 990409485 /nfs/dbraw/zinc/40/94/85/990409485.db2.gz JKKWZPIOAVYNCR-LVLPYEQSSA-N 1 1 369.465 2.680 20 5 FFBDMO C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1c1cc[nH+]cc1 ZINC000880258793 1015791362 /nfs/dbraw/zinc/79/13/62/1015791362.db2.gz CJZBVHCDOICJKG-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO COc1cccc2c1CC[C@]2(CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000880380708 1015821977 /nfs/dbraw/zinc/82/19/77/1015821977.db2.gz WLHQRFWIOFKJLN-LJQANCHMSA-N 1 1 358.394 2.536 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000747648454 994966801 /nfs/dbraw/zinc/96/68/01/994966801.db2.gz IGYDXBZNYWYWMY-IBGZPJMESA-N 1 1 372.469 2.650 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000811445851 995148865 /nfs/dbraw/zinc/14/88/65/995148865.db2.gz WRMUGSNPRODSPS-MRXNPFEDSA-N 1 1 369.349 2.759 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)c1 ZINC000811800396 995257619 /nfs/dbraw/zinc/25/76/19/995257619.db2.gz QNAOTFAHYZMVFM-GOSISDBHSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)c1 ZINC000811800396 995257628 /nfs/dbraw/zinc/25/76/28/995257628.db2.gz QNAOTFAHYZMVFM-GOSISDBHSA-N 1 1 352.398 2.868 20 5 FFBDMO C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@H]1C[N@H+](C)CCO1 ZINC000880709482 1015951370 /nfs/dbraw/zinc/95/13/70/1015951370.db2.gz NVOBHUWRGXKXNA-BLLLJJGKSA-N 1 1 364.446 2.733 20 5 FFBDMO C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@H]1C[N@@H+](C)CCO1 ZINC000880709482 1015951377 /nfs/dbraw/zinc/95/13/77/1015951377.db2.gz NVOBHUWRGXKXNA-BLLLJJGKSA-N 1 1 364.446 2.733 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000747828600 995573624 /nfs/dbraw/zinc/57/36/24/995573624.db2.gz GVNYXLPGNJUNNK-JKSUJKDBSA-N 1 1 357.414 2.559 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC001229941258 997281077 /nfs/dbraw/zinc/28/10/77/997281077.db2.gz PXCOVOXPNYBGLW-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO COc1ccc(OCCOC(=O)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC000803855703 1016244457 /nfs/dbraw/zinc/24/44/57/1016244457.db2.gz JNAJPVNJHGBIGR-CQSZACIVSA-N 1 1 366.414 2.790 20 5 FFBDMO Cc1c(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000741579292 999732400 /nfs/dbraw/zinc/73/24/00/999732400.db2.gz LBKYRFSFRUIMJM-QMTHXVAHSA-N 1 1 364.402 2.532 20 5 FFBDMO CC(C)C1CC[NH+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000742170159 999760883 /nfs/dbraw/zinc/76/08/83/999760883.db2.gz XPUQBVCTQSDASB-LJQANCHMSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000742155139 999762243 /nfs/dbraw/zinc/76/22/43/999762243.db2.gz PNTNHTMIXHSZSG-LPMFXHHGSA-N 1 1 374.441 2.830 20 5 FFBDMO CC(C)C[C@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000744437104 999856434 /nfs/dbraw/zinc/85/64/34/999856434.db2.gz GUBSHIPGRUNEQI-AUUYWEPGSA-N 1 1 374.441 2.687 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn([C@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168978591 1000012187 /nfs/dbraw/zinc/01/21/87/1000012187.db2.gz SPRUKNASMVVVSC-ZUEVXXBESA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@@H]1CNC(=O)OC(C)(C)C ZINC001169006446 1000014948 /nfs/dbraw/zinc/01/49/48/1000014948.db2.gz IHVGHETWZLSZTQ-LVQVYYBASA-N 1 1 355.479 2.915 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024550 1000017867 /nfs/dbraw/zinc/01/78/67/1000017867.db2.gz XAQVAYBZNGNWSS-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024550 1000017869 /nfs/dbraw/zinc/01/78/69/1000017869.db2.gz XAQVAYBZNGNWSS-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000846368737 1000290487 /nfs/dbraw/zinc/29/04/87/1000290487.db2.gz HSTLZOZKGRXLPR-SFHVURJKSA-N 1 1 363.458 2.789 20 5 FFBDMO C[C@@]1(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000846593790 1000382436 /nfs/dbraw/zinc/38/24/36/1000382436.db2.gz SOBXUOHAEKWUDW-LJQANCHMSA-N 1 1 372.400 2.711 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147147 1000434701 /nfs/dbraw/zinc/43/47/01/1000434701.db2.gz VHBXBWSJZMVTOP-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147147 1000434706 /nfs/dbraw/zinc/43/47/06/1000434706.db2.gz VHBXBWSJZMVTOP-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001147493646 1000905088 /nfs/dbraw/zinc/90/50/88/1000905088.db2.gz FHABEAJJXGEPBL-SWLSCSKDSA-N 1 1 353.850 2.979 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001148387427 1001131130 /nfs/dbraw/zinc/13/11/30/1001131130.db2.gz CRGSMKCQTNVKAB-AUUYWEPGSA-N 1 1 368.437 2.817 20 5 FFBDMO C[NH+](C)CCN(CCc1ccccc1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000772239685 1001342024 /nfs/dbraw/zinc/34/20/24/1001342024.db2.gz DXRWHALEXJHEIX-UHFFFAOYSA-N 1 1 357.410 2.547 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000746665835 1001680636 /nfs/dbraw/zinc/68/06/36/1001680636.db2.gz GTXKJMCWYHXOAB-UKRRQHHQSA-N 1 1 367.450 2.559 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCC[C@H](C)C1 ZINC000791207737 1002617885 /nfs/dbraw/zinc/61/78/85/1002617885.db2.gz CQZJGEUIYDIDHM-QWHCGFSZSA-N 1 1 366.437 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1F ZINC001185413707 1002948994 /nfs/dbraw/zinc/94/89/94/1002948994.db2.gz WXTVBQKSQXCUBX-STQMWFEESA-N 1 1 373.450 2.584 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@](CO)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334074 1003117999 /nfs/dbraw/zinc/11/79/99/1003117999.db2.gz AQDHMWNORGSYOC-XHDPSFHLSA-N 1 1 362.348 2.781 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170354372 1003120935 /nfs/dbraw/zinc/12/09/35/1003120935.db2.gz JVJNEBXINALODY-DZGCQCFKSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170354652 1003121681 /nfs/dbraw/zinc/12/16/81/1003121681.db2.gz NMDSRKDFAOHRGN-YOEHRIQHSA-N 1 1 363.458 2.866 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@]3(CCCC(=O)N3)C2)c([N+](=O)[O-])c1 ZINC001170341085 1003129360 /nfs/dbraw/zinc/12/93/60/1003129360.db2.gz NEEDQVBKEIKCFU-LIRRHRJNSA-N 1 1 361.442 2.669 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000792869770 1003204670 /nfs/dbraw/zinc/20/46/70/1003204670.db2.gz DIDDYRCIBXVFIL-QGZVFWFLSA-N 1 1 357.366 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000792869770 1003204679 /nfs/dbraw/zinc/20/46/79/1003204679.db2.gz DIDDYRCIBXVFIL-QGZVFWFLSA-N 1 1 357.366 2.985 20 5 FFBDMO Cc1c(Br)c(N(C)CC[NH+]2CCCCC2)ncc1[N+](=O)[O-] ZINC001186789993 1003425618 /nfs/dbraw/zinc/42/56/18/1003425618.db2.gz FHVYFVQTUHVOOX-UHFFFAOYSA-N 1 1 357.252 2.983 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](n2ccnn2)CC1 ZINC001196525227 1003805040 /nfs/dbraw/zinc/80/50/40/1003805040.db2.gz FENXPDGIZGFHBO-HNNXBMFYSA-N 1 1 372.429 2.551 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776275097 1005342472 /nfs/dbraw/zinc/34/24/72/1005342472.db2.gz JGYXEPTUYHKUGR-ROUUACIJSA-N 1 1 352.394 2.741 20 5 FFBDMO CO[C@H]1CC[C@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000851935807 1005924566 /nfs/dbraw/zinc/92/45/66/1005924566.db2.gz SNPUZCUKLCVTRN-ZFWWWQNUSA-N 1 1 359.430 2.551 20 5 FFBDMO Cn1c(C(=O)O[C@H]2CC[N@@H+](Cc3ccc4c(c3)CCC4)C2)ccc1[N+](=O)[O-] ZINC000776557938 1005928844 /nfs/dbraw/zinc/92/88/44/1005928844.db2.gz LDLFNPCFXQENBE-KRWDZBQOSA-N 1 1 369.421 2.853 20 5 FFBDMO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000776582878 1005954390 /nfs/dbraw/zinc/95/43/90/1005954390.db2.gz CZPABNTVACQBQA-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000776582878 1005954392 /nfs/dbraw/zinc/95/43/92/1005954392.db2.gz CZPABNTVACQBQA-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580512 1005961235 /nfs/dbraw/zinc/96/12/35/1005961235.db2.gz VYLMDUQXSLRZSW-QILLFSRXSA-N 1 1 363.458 2.645 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@H]3CCOC3)CC2)nc1-c1ccccn1 ZINC000853507573 1006418987 /nfs/dbraw/zinc/41/89/87/1006418987.db2.gz ZWGFRIMHWVKBFI-HNNXBMFYSA-N 1 1 357.414 2.559 20 5 FFBDMO CC(=O)c1c(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)cccc1[N+](=O)[O-] ZINC000882598682 1006451800 /nfs/dbraw/zinc/45/18/00/1006451800.db2.gz JMGNLKDXXHYUSY-QGZVFWFLSA-N 1 1 369.421 2.976 20 5 FFBDMO CC(=O)c1c(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)cccc1[N+](=O)[O-] ZINC000882598681 1006452219 /nfs/dbraw/zinc/45/22/19/1006452219.db2.gz JMGNLKDXXHYUSY-KRWDZBQOSA-N 1 1 369.421 2.976 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000853812277 1006543029 /nfs/dbraw/zinc/54/30/29/1006543029.db2.gz XXMMIHZVYNLCRG-LBPRGKRZSA-N 1 1 371.384 2.803 20 5 FFBDMO Cc1nn(C)c(Nc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c1[N+](=O)[O-] ZINC000882944280 1006570395 /nfs/dbraw/zinc/57/03/95/1006570395.db2.gz AUFATLHOEOTUHU-INIZCTEOSA-N 1 1 356.430 2.665 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979962 1006585750 /nfs/dbraw/zinc/58/57/50/1006585750.db2.gz UNPWHQAFWPLAQZ-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979962 1006585759 /nfs/dbraw/zinc/58/57/59/1006585759.db2.gz UNPWHQAFWPLAQZ-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1F ZINC000026713353 1006635175 /nfs/dbraw/zinc/63/51/75/1006635175.db2.gz YGUBGBKRMTTYDO-OAHLLOKOSA-N 1 1 364.373 2.614 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)C[C@@H]1Cc1ccccc1 ZINC000854395968 1006812082 /nfs/dbraw/zinc/81/20/82/1006812082.db2.gz YGMRASSQWZOXFM-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)C[C@@H]1Cc1ccccc1 ZINC000854395968 1006812098 /nfs/dbraw/zinc/81/20/98/1006812098.db2.gz YGMRASSQWZOXFM-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000855162456 1007141919 /nfs/dbraw/zinc/14/19/19/1007141919.db2.gz JZVAYZKYUXPPAA-LBPRGKRZSA-N 1 1 364.402 2.662 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000855165251 1007148492 /nfs/dbraw/zinc/14/84/92/1007148492.db2.gz SLRGBDJENJIFSB-NSHDSACASA-N 1 1 357.813 2.919 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1C ZINC001189997594 1007417688 /nfs/dbraw/zinc/41/76/88/1007417688.db2.gz QNGQVVGOHIHWHE-INIZCTEOSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000817180635 1007460536 /nfs/dbraw/zinc/46/05/36/1007460536.db2.gz ABTANASPMXOIIP-UHFFFAOYSA-N 1 1 356.378 2.784 20 5 FFBDMO CC1CC[NH+](c2ccc(NC[C@H](O)Cn3cc([N+](=O)[O-])cn3)cc2)CC1 ZINC000819395293 1008113939 /nfs/dbraw/zinc/11/39/39/1008113939.db2.gz MJOGCLDDOPJBSH-SFHVURJKSA-N 1 1 359.430 2.501 20 5 FFBDMO CN1CC[N@@H+](C)Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc21 ZINC000819466063 1008160796 /nfs/dbraw/zinc/16/07/96/1008160796.db2.gz GZEHDRVGKZQBRG-LJQANCHMSA-N 1 1 356.426 2.622 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)C1CCCCC1 ZINC001136421695 1008426426 /nfs/dbraw/zinc/42/64/26/1008426426.db2.gz ABQAAQVXVYVPPI-UHFFFAOYSA-N 1 1 371.441 2.979 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001136452014 1008468761 /nfs/dbraw/zinc/46/87/61/1008468761.db2.gz MEOWAPRSGCOETE-MRXNPFEDSA-N 1 1 368.437 2.819 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137441247 1008610115 /nfs/dbraw/zinc/61/01/15/1008610115.db2.gz ACLZBQHOAQMMQK-BBRMVZONSA-N 1 1 354.410 2.570 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823599449 1009134292 /nfs/dbraw/zinc/13/42/92/1009134292.db2.gz UKHQXQZBOFVSLE-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823599449 1009134301 /nfs/dbraw/zinc/13/43/01/1009134301.db2.gz UKHQXQZBOFVSLE-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@](C)(O)c1ccccc1 ZINC000823598038 1009135462 /nfs/dbraw/zinc/13/54/62/1009135462.db2.gz DYIWRENPYOIKBB-IBGZPJMESA-N 1 1 357.410 2.763 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000823926805 1009284597 /nfs/dbraw/zinc/28/45/97/1009284597.db2.gz IDPOVAFIBPUVLL-UHFFFAOYSA-N 1 1 355.398 2.527 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC[N@H+]1CC(C)(C)O ZINC000861183408 1009295378 /nfs/dbraw/zinc/29/53/78/1009295378.db2.gz GZBHCZIRUONALY-CQSZACIVSA-N 1 1 371.437 2.665 20 5 FFBDMO O=C1O[C@H](c2ccccc2)CN1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000863264643 1010145828 /nfs/dbraw/zinc/14/58/28/1010145828.db2.gz JLEKLKYPELJOOT-INIZCTEOSA-N 1 1 371.397 2.579 20 5 FFBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000863294251 1010163286 /nfs/dbraw/zinc/16/32/86/1010163286.db2.gz VDUQCDJAFKNYNN-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000863294251 1010163291 /nfs/dbraw/zinc/16/32/91/1010163291.db2.gz VDUQCDJAFKNYNN-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC001181841688 1010278114 /nfs/dbraw/zinc/27/81/14/1010278114.db2.gz WQVUHQVRMPZCDE-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794645417 1010439032 /nfs/dbraw/zinc/43/90/32/1010439032.db2.gz MWSSQFMWEYJXEI-UHFFFAOYSA-N 1 1 373.413 2.631 20 5 FFBDMO COc1ccc([C@H]2CC[N@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)cc1 ZINC000794625858 1010445981 /nfs/dbraw/zinc/44/59/81/1010445981.db2.gz CJJKLRASIMSCRT-AWEZNQCLSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C2)cc1 ZINC000794625858 1010445989 /nfs/dbraw/zinc/44/59/89/1010445989.db2.gz CJJKLRASIMSCRT-AWEZNQCLSA-N 1 1 369.377 2.958 20 5 FFBDMO C[N@H+]1CCn2nc(NCc3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2C1 ZINC000865844209 1010872526 /nfs/dbraw/zinc/87/25/26/1010872526.db2.gz DRUJKMMOKACNPI-UHFFFAOYSA-N 1 1 370.438 2.972 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H](C[C@@H]4CCOC4)C3)n2)cc1 ZINC000773267715 1011005597 /nfs/dbraw/zinc/00/55/97/1011005597.db2.gz VFCMKUPLRCLRQM-HOTGVXAUSA-N 1 1 371.441 2.949 20 5 FFBDMO O=C(c1ccco1)N1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172909641 1012123375 /nfs/dbraw/zinc/12/33/75/1012123375.db2.gz ULKZNDMEHBSTDY-KRWDZBQOSA-N 1 1 369.421 2.893 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCS1 ZINC001172911622 1012125522 /nfs/dbraw/zinc/12/55/22/1012125522.db2.gz DBFRKMKXRPOFFE-WBVHZDCISA-N 1 1 364.467 2.823 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870093632 1012128337 /nfs/dbraw/zinc/12/83/37/1012128337.db2.gz WPXIJUCFQSQFCF-OAHLLOKOSA-N 1 1 359.357 2.535 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000870129097 1012175812 /nfs/dbraw/zinc/17/58/12/1012175812.db2.gz ZHGWKDBZQWNEDS-OAHLLOKOSA-N 1 1 354.410 2.817 20 5 FFBDMO C[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1O ZINC001173010583 1012179144 /nfs/dbraw/zinc/17/91/44/1012179144.db2.gz VLHVJDAPEPGJQD-YVEFUNNKSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H]1CO ZINC001173009674 1012179693 /nfs/dbraw/zinc/17/96/93/1012179693.db2.gz HAAJSOCHXHKDPK-SJCJKPOMSA-N 1 1 369.412 2.935 20 5 FFBDMO COC[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010039 1012179738 /nfs/dbraw/zinc/17/97/38/1012179738.db2.gz LJPQDPJMLKFMRY-LBPRGKRZSA-N 1 1 355.385 2.810 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870138401 1012184756 /nfs/dbraw/zinc/18/47/56/1012184756.db2.gz FALFTKLXCHUZOY-GOSISDBHSA-N 1 1 355.394 2.699 20 5 FFBDMO C[N@H+](Cc1ccon1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014783 1012186362 /nfs/dbraw/zinc/18/63/62/1012186362.db2.gz BOKRTFRISORQBU-UHFFFAOYSA-N 1 1 352.341 2.962 20 5 FFBDMO C[N@@H+](Cc1ccon1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014783 1012186373 /nfs/dbraw/zinc/18/63/73/1012186373.db2.gz BOKRTFRISORQBU-UHFFFAOYSA-N 1 1 352.341 2.962 20 5 FFBDMO CC(C)[N@@H+](CCCO)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017888 1012188571 /nfs/dbraw/zinc/18/85/71/1012188571.db2.gz MFMNGULPXIEUIO-UHFFFAOYSA-N 1 1 357.401 2.935 20 5 FFBDMO C[C@@H]1C[C@H](O)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018628 1012190044 /nfs/dbraw/zinc/19/00/44/1012190044.db2.gz XRZREGGGRIXDPZ-BXUZGUMPSA-N 1 1 355.385 2.687 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870146453 1012200068 /nfs/dbraw/zinc/20/00/68/1012200068.db2.gz YWTQGONZQDESPB-KUHUBIRLSA-N 1 1 369.421 2.880 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870146451 1012201675 /nfs/dbraw/zinc/20/16/75/1012201675.db2.gz YWTQGONZQDESPB-IFXJQAMLSA-N 1 1 369.421 2.880 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880308 1012616542 /nfs/dbraw/zinc/61/65/42/1012616542.db2.gz YYQNKHAJSAMZAH-MJGOQNOKSA-N 1 1 373.384 2.508 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@H](c2cccc(F)c2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870880034 1012617083 /nfs/dbraw/zinc/61/70/83/1012617083.db2.gz UAXPCIURHHILEK-HKUYNNGSSA-N 1 1 373.384 2.508 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]21 ZINC000827331026 1017640373 /nfs/dbraw/zinc/64/03/73/1017640373.db2.gz VDEQQFDTMWLZEJ-CJNGLKHVSA-N 1 1 372.450 2.885 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccc3ccccc3c1)C2 ZINC001072725589 1020294818 /nfs/dbraw/zinc/29/48/18/1020294818.db2.gz PTRYFFBYJKHVFU-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1ccc3ccccc3c1)C2 ZINC001072725589 1020294828 /nfs/dbraw/zinc/29/48/28/1020294828.db2.gz PTRYFFBYJKHVFU-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccc3ccccc3c1)C2 ZINC001072725589 1020294833 /nfs/dbraw/zinc/29/48/33/1020294833.db2.gz PTRYFFBYJKHVFU-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1[C@H]1CCCOC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000828904069 1032898202 /nfs/dbraw/zinc/89/82/02/1032898202.db2.gz BFBSPVSJLMVKIF-SUMWQHHRSA-N 1 1 365.405 2.954 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C(=O)OC(C)(C)C ZINC000828917138 1032904542 /nfs/dbraw/zinc/90/45/42/1032904542.db2.gz DOOLIINGPWUFHC-XOKHGSTOSA-N 1 1 364.442 2.928 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c1 ZINC000931905094 1020626461 /nfs/dbraw/zinc/62/64/61/1020626461.db2.gz BLSJBMJVDICDIJ-RLLQIKCJSA-N 1 1 354.406 2.528 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)C[C@]2(C)C1 ZINC000931996685 1020660207 /nfs/dbraw/zinc/66/02/07/1020660207.db2.gz RLYCEMCJIKNMOK-XIKOKIGWSA-N 1 1 355.398 2.558 20 5 FFBDMO Cn1ccc(C2CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)n1 ZINC000932150001 1020725543 /nfs/dbraw/zinc/72/55/43/1020725543.db2.gz UHOPCXBZMNULDW-UHFFFAOYSA-N 1 1 358.398 2.574 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000934836650 1021421838 /nfs/dbraw/zinc/42/18/38/1021421838.db2.gz DVHAJHVNDJPWSD-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807070 1021428566 /nfs/dbraw/zinc/42/85/66/1021428566.db2.gz QIZRGKQCFBKYCE-DOTOQJQBSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807070 1021428570 /nfs/dbraw/zinc/42/85/70/1021428570.db2.gz QIZRGKQCFBKYCE-DOTOQJQBSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2 ZINC000778795188 1022378230 /nfs/dbraw/zinc/37/82/30/1022378230.db2.gz PJKYOEXXCONBQD-UHFFFAOYSA-N 1 1 361.354 2.508 20 5 FFBDMO COc1cc(CNCC[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000779121725 1022838356 /nfs/dbraw/zinc/83/83/56/1022838356.db2.gz XNNUBSMJNZBRPK-LBPRGKRZSA-N 1 1 373.400 2.821 20 5 FFBDMO COc1cc(C[NH2+]CCN2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000779121725 1022838365 /nfs/dbraw/zinc/83/83/65/1022838365.db2.gz XNNUBSMJNZBRPK-LBPRGKRZSA-N 1 1 373.400 2.821 20 5 FFBDMO CC(C)CNC(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000751468741 1022839857 /nfs/dbraw/zinc/83/98/57/1022839857.db2.gz OHFUBKORIYEFCE-UHFFFAOYSA-N 1 1 360.414 2.720 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000755676487 1023622401 /nfs/dbraw/zinc/62/24/01/1023622401.db2.gz AIBWXOLTQIDJCN-BXBOZWQASA-N 1 1 362.426 2.898 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000756611832 1023734841 /nfs/dbraw/zinc/73/48/41/1023734841.db2.gz SXSBHCVENZAGLZ-MRXNPFEDSA-N 1 1 365.430 2.569 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000756611832 1023734849 /nfs/dbraw/zinc/73/48/49/1023734849.db2.gz SXSBHCVENZAGLZ-MRXNPFEDSA-N 1 1 365.430 2.569 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@H]32)n1 ZINC000756624641 1023736842 /nfs/dbraw/zinc/73/68/42/1023736842.db2.gz BMSIWOMFRRLRQT-GOEBONIOSA-N 1 1 369.425 2.568 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000757925695 1023885731 /nfs/dbraw/zinc/88/57/31/1023885731.db2.gz RDAZLAOVRGZOSU-HNNXBMFYSA-N 1 1 370.365 2.728 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000757925695 1023885738 /nfs/dbraw/zinc/88/57/38/1023885738.db2.gz RDAZLAOVRGZOSU-HNNXBMFYSA-N 1 1 370.365 2.728 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+]2C)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001121801700 1024040294 /nfs/dbraw/zinc/04/02/94/1024040294.db2.gz UZGUYUUENGHKTD-MRXNPFEDSA-N 1 1 358.446 2.652 20 5 FFBDMO CCn1c([C@H]2CCC[N@H+]2C)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001121801700 1024040311 /nfs/dbraw/zinc/04/03/11/1024040311.db2.gz UZGUYUUENGHKTD-MRXNPFEDSA-N 1 1 358.446 2.652 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@@H]2C1 ZINC001124004203 1024217680 /nfs/dbraw/zinc/21/76/80/1024217680.db2.gz UWAMOBIPLHOQMG-UAGQMJEPSA-N 1 1 366.421 2.727 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000195148781 1024949416 /nfs/dbraw/zinc/94/94/16/1024949416.db2.gz WILJONQAXFZODF-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1[N+](=O)[O-] ZINC000795222706 1025360092 /nfs/dbraw/zinc/36/00/92/1025360092.db2.gz WUFHCXVJVBLUAS-UHFFFAOYSA-N 1 1 369.381 2.640 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000840141762 1026981926 /nfs/dbraw/zinc/98/19/26/1026981926.db2.gz RXESDQZACNVNBU-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO CCCCOC(=O)[C@H]1CCN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1 ZINC001158537627 1027054970 /nfs/dbraw/zinc/05/49/70/1027054970.db2.gz AWITYYBMSSRORD-VFADXPBXSA-N 1 1 362.430 2.692 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@H](Nc2cccc([N+](=O)[O-])n2)C1 ZINC001158581234 1027066174 /nfs/dbraw/zinc/06/61/74/1027066174.db2.gz DGYQPUYMOIQSLT-NVXWUHKLSA-N 1 1 370.409 2.861 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000247912579 1027278591 /nfs/dbraw/zinc/27/85/91/1027278591.db2.gz ALUAMKVJKPPKEB-IEBWSBKVSA-N 1 1 368.437 2.836 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000093099505 1027605882 /nfs/dbraw/zinc/60/58/82/1027605882.db2.gz XXHGVODNUXATPA-GASCZTMLSA-N 1 1 363.458 2.701 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000093099505 1027605890 /nfs/dbraw/zinc/60/58/90/1027605890.db2.gz XXHGVODNUXATPA-GASCZTMLSA-N 1 1 363.458 2.701 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001153484383 1027903492 /nfs/dbraw/zinc/90/34/92/1027903492.db2.gz ZITZDZQPBGBCOL-PHIMTYICSA-N 1 1 370.247 2.846 20 5 FFBDMO Cc1cc(NCCC[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1Br ZINC001161711247 1028290490 /nfs/dbraw/zinc/29/04/90/1028290490.db2.gz YRHFIJHFEYMMRC-UHFFFAOYSA-N 1 1 371.279 2.715 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC001161885272 1028350369 /nfs/dbraw/zinc/35/03/69/1028350369.db2.gz LVLIAFLITJUOSW-AWEZNQCLSA-N 1 1 362.817 2.958 20 5 FFBDMO COC(=O)c1ccccc1CCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001162707884 1028627925 /nfs/dbraw/zinc/62/79/25/1028627925.db2.gz FPLPGOIOVIDCJJ-PKNBQFBNSA-N 1 1 370.409 2.963 20 5 FFBDMO CC(C)[C@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000780497741 1028715381 /nfs/dbraw/zinc/71/53/81/1028715381.db2.gz MMSDLJTWPBEKNA-LIRRHRJNSA-N 1 1 374.441 2.687 20 5 FFBDMO COc1cc(N2CC[NH+](C[C@@H](OC)c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC001155715704 1028866620 /nfs/dbraw/zinc/86/66/20/1028866620.db2.gz MRLVFSDFVRLNHV-GOSISDBHSA-N 1 1 372.425 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CCC[N@@H+](Cc4ccncc4)CC3)c2c1 ZINC001163827383 1029081596 /nfs/dbraw/zinc/08/15/96/1029081596.db2.gz RJBFGUVKGBYRSL-UHFFFAOYSA-N 1 1 364.409 2.645 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cc(Cl)ncc2[N+](=O)[O-])CC1 ZINC001165107013 1029391964 /nfs/dbraw/zinc/39/19/64/1029391964.db2.gz CXWQEYGZRICOHQ-ZDUSSCGKSA-N 1 1 354.838 2.723 20 5 FFBDMO Cc1cc(C(C)(C)C)cc(C)c1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001157775025 1029661379 /nfs/dbraw/zinc/66/13/79/1029661379.db2.gz IHBIZFGELVJOQO-SJLPKXTDSA-N 1 1 361.486 2.862 20 5 FFBDMO CN(CC(=O)OCc1ccccc1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001158197821 1029753843 /nfs/dbraw/zinc/75/38/43/1029753843.db2.gz CUTFVSAODUXGOR-MDZDMXLPSA-N 1 1 370.409 2.702 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000798523432 1031445255 /nfs/dbraw/zinc/44/52/55/1031445255.db2.gz JPSVODBMTOLQGB-LJQANCHMSA-N 1 1 356.426 2.575 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC001149656461 1031561805 /nfs/dbraw/zinc/56/18/05/1031561805.db2.gz WCOJVGJCEXQGHH-ZFWWWQNUSA-N 1 1 351.834 2.733 20 5 FFBDMO COc1ncnc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1[N+](=O)[O-] ZINC000312976081 1033705425 /nfs/dbraw/zinc/70/54/25/1033705425.db2.gz KWCKSZVYKIQZBA-OWCLPIDISA-N 1 1 369.425 2.716 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1cc([N+](=O)[O-])ccc1F ZINC000831164320 1033974691 /nfs/dbraw/zinc/97/46/91/1033974691.db2.gz BTQJKKYMSBJTQX-KBRIMQKVSA-N 1 1 365.405 2.688 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC(NC(=O)OC(C)(C)C)C1 ZINC000831237300 1034004874 /nfs/dbraw/zinc/00/48/74/1034004874.db2.gz PRZXQNXLJDPFID-AVVWSFFYSA-N 1 1 365.430 2.616 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226165518 1034554478 /nfs/dbraw/zinc/55/44/78/1034554478.db2.gz LLWMESBQOZWIPA-KUHUBIRLSA-N 1 1 369.421 2.983 20 5 FFBDMO COC(=O)c1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1CCC[N@@H+](C)C1 ZINC001226358796 1034649214 /nfs/dbraw/zinc/64/92/14/1034649214.db2.gz VMOGCJZFTXSCQD-SNVBAGLBSA-N 1 1 373.203 2.617 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001227062131 1034923045 /nfs/dbraw/zinc/92/30/45/1034923045.db2.gz GIRIOEIYYLFXQH-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO Cc1ccc(N2CCC[C@@H](Oc3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C2)[nH+]c1 ZINC001227111948 1034938574 /nfs/dbraw/zinc/93/85/74/1034938574.db2.gz UMDWHEUKSATYCU-CYBMUJFWSA-N 1 1 359.342 2.649 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ccc(Br)nc1[N+](=O)[O-] ZINC001227260265 1035490717 /nfs/dbraw/zinc/49/07/17/1035490717.db2.gz PVKOFFSGWBTMTE-DDFAGTSDSA-N 1 1 356.220 2.861 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000835396347 1035747010 /nfs/dbraw/zinc/74/70/10/1035747010.db2.gz MFGJSKNLEAEVKH-LSDHHAIUSA-N 1 1 356.382 2.564 20 5 FFBDMO C[C@H](Oc1cc([N+](=O)[O-])ccc1[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC001229396695 1036649698 /nfs/dbraw/zinc/64/96/98/1036649698.db2.gz WPKKCSCERXZHIX-LIRRHRJNSA-N 1 1 358.394 2.969 20 5 FFBDMO COc1cc(O[C@H]2CC[N@@H+](C)C2)c2c(c1)oc1ccc(OC)c(O)c1c2=O ZINC001230526118 1037302687 /nfs/dbraw/zinc/30/26/87/1037302687.db2.gz QLUZHLQTQNOBHA-NSHDSACASA-N 1 1 371.389 2.752 20 5 FFBDMO Cc1nc(O[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])cc1Br ZINC001231120850 1037479434 /nfs/dbraw/zinc/47/94/34/1037479434.db2.gz XTPDKMRMJKZVSS-VIFPVBQESA-N 1 1 353.176 2.651 20 5 FFBDMO CC(C)N(CC[N@@H+](C)CCc1ccc(Cl)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001278908230 1038353937 /nfs/dbraw/zinc/35/39/37/1038353937.db2.gz OBPYSLFILKAWJV-IAGOWNOFSA-N 1 1 367.877 2.717 20 5 FFBDMO CC(C)N(CC[N@H+](C)CCc1ccc(Cl)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001278908230 1038353946 /nfs/dbraw/zinc/35/39/46/1038353946.db2.gz OBPYSLFILKAWJV-IAGOWNOFSA-N 1 1 367.877 2.717 20 5 FFBDMO CC(C)N(CC[N@@H+](C)CCc1ccc(Cl)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001278908230 1038353958 /nfs/dbraw/zinc/35/39/58/1038353958.db2.gz OBPYSLFILKAWJV-IAGOWNOFSA-N 1 1 367.877 2.717 20 5 FFBDMO Cc1cc(C[N@H+](C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)c(C)s1 ZINC001278908665 1038359704 /nfs/dbraw/zinc/35/97/04/1038359704.db2.gz VIBCVOVNNGQUAB-HZPDHXFCSA-N 1 1 353.488 2.699 20 5 FFBDMO Cc1cc(C[N@@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c(C)s1 ZINC001278908665 1038359714 /nfs/dbraw/zinc/35/97/14/1038359714.db2.gz VIBCVOVNNGQUAB-HZPDHXFCSA-N 1 1 353.488 2.699 20 5 FFBDMO Cc1cc(C[N@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c(C)s1 ZINC001278908665 1038359725 /nfs/dbraw/zinc/35/97/25/1038359725.db2.gz VIBCVOVNNGQUAB-HZPDHXFCSA-N 1 1 353.488 2.699 20 5 FFBDMO CC[C@@]12C[C@@H](CO1)[N@H+](C1CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC1)C2 ZINC001256100300 1038384250 /nfs/dbraw/zinc/38/42/50/1038384250.db2.gz DOIVLTOBPZQUML-LPHOPBHVSA-N 1 1 361.442 2.826 20 5 FFBDMO CC[N@@H+](CCC[NH+](C)C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101364 1038386776 /nfs/dbraw/zinc/38/67/76/1038386776.db2.gz GKBOMPROKMSGQU-UHFFFAOYSA-N 1 1 364.490 2.846 20 5 FFBDMO CC[N@H+](CCCN(C)C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101364 1038386788 /nfs/dbraw/zinc/38/67/88/1038386788.db2.gz GKBOMPROKMSGQU-UHFFFAOYSA-N 1 1 364.490 2.846 20 5 FFBDMO CC[N@@H+](CCCN(C)C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101364 1038386805 /nfs/dbraw/zinc/38/68/05/1038386805.db2.gz GKBOMPROKMSGQU-UHFFFAOYSA-N 1 1 364.490 2.846 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC001258098418 1039172442 /nfs/dbraw/zinc/17/24/42/1039172442.db2.gz RZHHZMLJUHJMQH-UHFFFAOYSA-N 1 1 354.410 2.593 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1-c1nc2ccc(N3CC[NH+](C)CC3)cc2[nH]1 ZINC001251580216 1039188212 /nfs/dbraw/zinc/18/82/12/1039188212.db2.gz XQCYLFFFOCNDGV-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@]34CCC[NH2+]C4)CC2)ccc1[N+](=O)[O-] ZINC001246607643 1039412377 /nfs/dbraw/zinc/41/23/77/1039412377.db2.gz HCILMXCHDBYXQX-HXUWFJFHSA-N 1 1 374.485 2.790 20 5 FFBDMO COCOc1ccccc1-c1noc([C@@H]([NH3+])Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001248210965 1040173905 /nfs/dbraw/zinc/17/39/05/1040173905.db2.gz XWMJYRRIGZDZHB-HNNXBMFYSA-N 1 1 370.365 2.870 20 5 FFBDMO COc1cccc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1OC ZINC001248209793 1040174194 /nfs/dbraw/zinc/17/41/94/1040174194.db2.gz XBZCTEQSXWQIEZ-CQSZACIVSA-N 1 1 370.365 2.905 20 5 FFBDMO [NH3+][C@@H](CCOCc1ccccc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001248229314 1040183772 /nfs/dbraw/zinc/18/37/72/1040183772.db2.gz KMVNNQPZSYXLKV-ZDUSSCGKSA-N 1 1 373.344 2.786 20 5 FFBDMO CN1C(=O)CC[C@H]2C[N@@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC[C@H]21 ZINC001254481308 1040747797 /nfs/dbraw/zinc/74/77/97/1040747797.db2.gz AQQZMDUUFJKLLF-HNAYVOBHSA-N 1 1 372.469 2.506 20 5 FFBDMO CC(C)C(=O)N1CC[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC[C@H]21 ZINC001254596123 1040824823 /nfs/dbraw/zinc/82/48/23/1040824823.db2.gz OWCVHDZHTZBVLR-AYOQOUSVSA-N 1 1 357.454 2.641 20 5 FFBDMO C[N@@H+](C1CCOCC1)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603811 1040832212 /nfs/dbraw/zinc/83/22/12/1040832212.db2.gz QXPRMFBWBFWLLB-FQEVSTJZSA-N 1 1 359.470 2.637 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1Cc3cnn(C4CCOCC4)c3C1)C2 ZINC001254609831 1040837658 /nfs/dbraw/zinc/83/76/58/1040837658.db2.gz ZALLGVNMBJZORK-SFHVURJKSA-N 1 1 354.410 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1Cc3cnn(C4CCOCC4)c3C1)C2 ZINC001254609831 1040837668 /nfs/dbraw/zinc/83/76/68/1040837668.db2.gz ZALLGVNMBJZORK-SFHVURJKSA-N 1 1 354.410 2.626 20 5 FFBDMO CC(C)(C)n1c[nH+]cc1[C@@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC001262723014 1041816663 /nfs/dbraw/zinc/81/66/63/1041816663.db2.gz BSCSSCRRRADZRU-CYBMUJFWSA-N 1 1 369.429 2.973 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)n1 ZINC001264872600 1042827974 /nfs/dbraw/zinc/82/79/74/1042827974.db2.gz PLSWRFLGPIKFLU-GFCCVEGCSA-N 1 1 360.439 2.536 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)n1 ZINC001264872600 1042827979 /nfs/dbraw/zinc/82/79/79/1042827979.db2.gz PLSWRFLGPIKFLU-GFCCVEGCSA-N 1 1 360.439 2.536 20 5 FFBDMO C[C@@H](CNC(=O)NC[C@H](c1ccco1)[NH+](C)C)c1ccccc1[N+](=O)[O-] ZINC001311346234 1043898183 /nfs/dbraw/zinc/89/81/83/1043898183.db2.gz ZBZRHDBHOBDOFC-XJKSGUPXSA-N 1 1 360.414 2.893 20 5 FFBDMO CC(C)(C)c1ccc2c(c1)CC[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2 ZINC001318777961 1044870453 /nfs/dbraw/zinc/87/04/53/1044870453.db2.gz CMSAZJKOEIWVEZ-SFHVURJKSA-N 1 1 358.442 2.508 20 5 FFBDMO CN(CC[NH2+]Cc1csc2c1cccc2Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001317585682 1045113320 /nfs/dbraw/zinc/11/33/20/1045113320.db2.gz SSFVACROWNIJSS-TZMCWYRMSA-N 1 1 367.858 2.768 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703777 1045246417 /nfs/dbraw/zinc/24/64/17/1045246417.db2.gz DCYIXODJUVTEPJ-CRAIPNDOSA-N 1 1 372.400 2.800 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703777 1045246426 /nfs/dbraw/zinc/24/64/26/1045246426.db2.gz DCYIXODJUVTEPJ-CRAIPNDOSA-N 1 1 372.400 2.800 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C(=O)NC2CC2)C1 ZINC001318293170 1045264392 /nfs/dbraw/zinc/26/43/92/1045264392.db2.gz DZXZZLVIXWYXJG-AWEZNQCLSA-N 1 1 361.442 2.873 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256842 1045376728 /nfs/dbraw/zinc/37/67/28/1045376728.db2.gz DBPUTWAEOATGSO-CRAIPNDOSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256842 1045376734 /nfs/dbraw/zinc/37/67/34/1045376734.db2.gz DBPUTWAEOATGSO-CRAIPNDOSA-N 1 1 372.400 2.951 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001289306018 1047624184 /nfs/dbraw/zinc/62/41/84/1047624184.db2.gz CAFHKVWSFFWPML-UHFFFAOYSA-N 1 1 356.382 2.998 20 5 FFBDMO CCC1([NH2+]Cc2ccc3c(c2)CCC3)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001327448484 1047899895 /nfs/dbraw/zinc/89/98/95/1047899895.db2.gz BTARQWYXDPKKMQ-RTBURBONSA-N 1 1 371.481 2.701 20 5 FFBDMO CC[N@H+]1CCC[C@H](CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001327891848 1048085664 /nfs/dbraw/zinc/08/56/64/1048085664.db2.gz PFMQLQZQQWDLQM-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO CCO[C@@H]1COCC[C@@H]1[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001334095337 1049246446 /nfs/dbraw/zinc/24/64/46/1049246446.db2.gz XLEOZOZBSQQJKE-GXTWGEPZSA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC001334272301 1049344070 /nfs/dbraw/zinc/34/40/70/1049344070.db2.gz WFGHKEDCPJHASN-ZDUSSCGKSA-N 1 1 374.416 2.972 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001297065400 1050117264 /nfs/dbraw/zinc/11/72/64/1050117264.db2.gz KCNMIZZFRKRTDP-UHFFFAOYSA-N 1 1 351.422 2.905 20 5 FFBDMO CC(C)Cn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC001342989088 1051604959 /nfs/dbraw/zinc/60/49/59/1051604959.db2.gz VPVVEIQODFYXKR-KBPBESRZSA-N 1 1 374.445 2.633 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2CCCC[N@@H+]2Cc2ccncc2)cccc1[N+](=O)[O-] ZINC001343559711 1052307146 /nfs/dbraw/zinc/30/71/46/1052307146.db2.gz KSVBWAXNNXSNLP-LJQANCHMSA-N 1 1 368.437 2.969 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2CCCC[N@H+]2Cc2ccncc2)cccc1[N+](=O)[O-] ZINC001343559711 1052307150 /nfs/dbraw/zinc/30/71/50/1052307150.db2.gz KSVBWAXNNXSNLP-LJQANCHMSA-N 1 1 368.437 2.969 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC001308051493 1052394505 /nfs/dbraw/zinc/39/45/05/1052394505.db2.gz WANQLLMREKYYDJ-SECBINFHSA-N 1 1 368.315 2.958 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC001308081091 1052402295 /nfs/dbraw/zinc/40/22/95/1052402295.db2.gz DOQJADSMZJLYKT-ZYHUDNBSSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC001308081091 1052402298 /nfs/dbraw/zinc/40/22/98/1052402298.db2.gz DOQJADSMZJLYKT-ZYHUDNBSSA-N 1 1 371.231 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3cc(Cl)ccn3)CC2)cc1 ZINC001308090610 1052404385 /nfs/dbraw/zinc/40/43/85/1052404385.db2.gz NHKSZWLPTMFDRT-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC[NH+]([C@H]2CCOC2)CC1 ZINC001335520439 1053412890 /nfs/dbraw/zinc/41/28/90/1053412890.db2.gz PUPOOGFLGPUKST-LBPRGKRZSA-N 1 1 362.817 2.707 20 5 FFBDMO C[C@H](Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001336570433 1054068142 /nfs/dbraw/zinc/06/81/42/1054068142.db2.gz TZBLCDHSJFGOKG-QWHCGFSZSA-N 1 1 374.441 2.991 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(C[C@@]1(O)CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001336769832 1054211249 /nfs/dbraw/zinc/21/12/49/1054211249.db2.gz DWQRLDUAHFDQJP-HXUWFJFHSA-N 1 1 353.422 2.547 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CC[NH+]([C@@H]2CCOC2)CC1 ZINC001336797216 1054234043 /nfs/dbraw/zinc/23/40/43/1054234043.db2.gz KGQGSWONGZWGFH-CYBMUJFWSA-N 1 1 362.817 2.707 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)ccn1 ZINC001336860006 1054294129 /nfs/dbraw/zinc/29/41/29/1054294129.db2.gz YPXICSKZODLXJW-UHFFFAOYSA-N 1 1 355.398 2.642 20 5 FFBDMO CCOC(=O)c1cc(N2CCC(c3c[nH+]cn3C)CC2)ccc1[N+](=O)[O-] ZINC001348605264 1054814525 /nfs/dbraw/zinc/81/45/25/1054814525.db2.gz RKLRSGMKYJVNAG-UHFFFAOYSA-N 1 1 358.398 2.889 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 ZINC001351742800 1054978256 /nfs/dbraw/zinc/97/82/56/1054978256.db2.gz IOHLIZLJPLWMBO-UHFFFAOYSA-N 1 1 364.361 2.969 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)[C@H]2C1 ZINC001338298999 1055399234 /nfs/dbraw/zinc/39/92/34/1055399234.db2.gz XVCCKHMVKCFHQA-RRQGHBQHSA-N 1 1 358.442 2.583 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC2(CCCCO2)CC1 ZINC001353206633 1056187008 /nfs/dbraw/zinc/18/70/08/1056187008.db2.gz GWEDFHPGDYBSNS-SFHVURJKSA-N 1 1 373.453 2.903 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C(C)(C)C1 ZINC001544678594 1071677938 /nfs/dbraw/zinc/67/79/38/1071677938.db2.gz DRWTYYUKWFYGSO-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C(C)(C)C1 ZINC001544678594 1071677943 /nfs/dbraw/zinc/67/79/43/1071677943.db2.gz DRWTYYUKWFYGSO-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)c1C ZINC001514977818 1059182629 /nfs/dbraw/zinc/18/26/29/1059182629.db2.gz JHYDEYHPNYJECJ-UHFFFAOYSA-N 1 1 370.409 2.964 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001455619398 1059838047 /nfs/dbraw/zinc/83/80/47/1059838047.db2.gz FCCXIGTYUDORGJ-UHFFFAOYSA-N 1 1 366.805 2.592 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@]2(CCCOC2)C1 ZINC000848480974 1060114603 /nfs/dbraw/zinc/11/46/03/1060114603.db2.gz UALIWOPKIRWZHV-ICSRJNTNSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000848485529 1060131426 /nfs/dbraw/zinc/13/14/26/1060131426.db2.gz PHVVTIJODGEMOD-MOPGFXCFSA-N 1 1 373.453 2.759 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)C1 ZINC000848488155 1060136412 /nfs/dbraw/zinc/13/64/12/1060136412.db2.gz BRJPWRVMYDQSBV-LJQANCHMSA-N 1 1 355.442 2.834 20 5 FFBDMO COc1cc(N(C)CCC[N@@H+](C)CCN(C)C)c(Cl)cc1[N+](=O)[O-] ZINC001458417003 1060585880 /nfs/dbraw/zinc/58/58/80/1060585880.db2.gz UGQACNXPRNCVRM-UHFFFAOYSA-N 1 1 358.870 2.577 20 5 FFBDMO COc1cc(N(C)CCCN(C)CC[NH+](C)C)c(Cl)cc1[N+](=O)[O-] ZINC001458417003 1060585895 /nfs/dbraw/zinc/58/58/95/1060585895.db2.gz UGQACNXPRNCVRM-UHFFFAOYSA-N 1 1 358.870 2.577 20 5 FFBDMO CN(C)c1cc[nH+]c(CNc2ncc([N+](=O)[O-])cc2Br)c1 ZINC001458604068 1060632437 /nfs/dbraw/zinc/63/24/37/1060632437.db2.gz OPPOATBOTPERGQ-UHFFFAOYSA-N 1 1 352.192 2.825 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+](CCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001459793671 1060820978 /nfs/dbraw/zinc/82/09/78/1060820978.db2.gz TWZPZIFQEGXUID-HNNXBMFYSA-N 1 1 369.421 2.539 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+](CCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001459793671 1060820986 /nfs/dbraw/zinc/82/09/86/1060820986.db2.gz TWZPZIFQEGXUID-HNNXBMFYSA-N 1 1 369.421 2.539 20 5 FFBDMO O=C(CC[NH2+][C@H](CO)c1c(F)cccc1F)Nc1ccccc1[N+](=O)[O-] ZINC001459805505 1060822045 /nfs/dbraw/zinc/82/20/45/1060822045.db2.gz MKJIFQDAKKXWBR-CQSZACIVSA-N 1 1 365.336 2.525 20 5 FFBDMO O=[N+]([O-])c1cc(OCc2ccc(C[NH+]3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000849958716 1060925986 /nfs/dbraw/zinc/92/59/86/1060925986.db2.gz YUCAAGRFPHNXED-UHFFFAOYSA-N 1 1 373.365 2.914 20 5 FFBDMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N1CCc2c1ccc([N+](=O)[O-])c2F ZINC001460262626 1060935499 /nfs/dbraw/zinc/93/54/99/1060935499.db2.gz FEZZKDVOZMYXCK-UHFFFAOYSA-N 1 1 353.313 2.518 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2c2ncccn2)cccc1[N+](=O)[O-] ZINC001460462148 1060997840 /nfs/dbraw/zinc/99/78/40/1060997840.db2.gz CIONIMKDGPHMOG-INIZCTEOSA-N 1 1 355.398 2.859 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2ncccn2)cccc1[N+](=O)[O-] ZINC001460462148 1060997864 /nfs/dbraw/zinc/99/78/64/1060997864.db2.gz CIONIMKDGPHMOG-INIZCTEOSA-N 1 1 355.398 2.859 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C ZINC001475348309 1061058630 /nfs/dbraw/zinc/05/86/30/1061058630.db2.gz AUOVALFVSMKCRY-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](CO)c2ccccc2C)c1 ZINC001460780503 1061098832 /nfs/dbraw/zinc/09/88/32/1061098832.db2.gz XJONZGWQQVKPID-SFHVURJKSA-N 1 1 358.394 2.855 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](CO)c2ccccc2C)c1 ZINC001460780503 1061098844 /nfs/dbraw/zinc/09/88/44/1061098844.db2.gz XJONZGWQQVKPID-SFHVURJKSA-N 1 1 358.394 2.855 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001460817052 1061112553 /nfs/dbraw/zinc/11/25/53/1061112553.db2.gz KTRZWVDWIUKMBO-GOSISDBHSA-N 1 1 356.382 2.678 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001460828192 1061119417 /nfs/dbraw/zinc/11/94/17/1061119417.db2.gz GSKSYIYOKOBFNY-AWEZNQCLSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(CCCCNc2cc[nH+]c(N3CCOCC3)n2)cc1 ZINC000544676714 1061149132 /nfs/dbraw/zinc/14/91/32/1061149132.db2.gz CCSWUZLDQDTPGT-UHFFFAOYSA-N 1 1 357.414 2.656 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC001461267018 1061272853 /nfs/dbraw/zinc/27/28/53/1061272853.db2.gz FKZWNYNJEPOVJD-XQQFMLRXSA-N 1 1 369.849 2.957 20 5 FFBDMO Cc1nc2ccccc2nc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC001462501454 1061648770 /nfs/dbraw/zinc/64/87/70/1061648770.db2.gz FSSZSGDGWJXTPD-IBGZPJMESA-N 1 1 352.394 2.844 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c(C)c1[N+](=O)[O-] ZINC001463659364 1062201351 /nfs/dbraw/zinc/20/13/51/1062201351.db2.gz QCNZSKMZYJFTEP-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c(C)c1[N+](=O)[O-] ZINC001463659364 1062201356 /nfs/dbraw/zinc/20/13/56/1062201356.db2.gz QCNZSKMZYJFTEP-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[N@H+]1CCCC[C@H]1C ZINC001441491697 1063446491 /nfs/dbraw/zinc/44/64/91/1063446491.db2.gz HACSXYXWKJUTBJ-NXEZZACHSA-N 1 1 372.828 2.962 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001496114238 1063585568 /nfs/dbraw/zinc/58/55/68/1063585568.db2.gz AICOUIAREKEDSP-OAHLLOKOSA-N 1 1 374.489 2.904 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[nH+]1 ZINC001472012095 1064890021 /nfs/dbraw/zinc/89/00/21/1064890021.db2.gz AJGADTIMFLWNGS-UHFFFAOYSA-N 1 1 367.768 2.515 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[nH+]c1 ZINC001472012560 1064891201 /nfs/dbraw/zinc/89/12/01/1064891201.db2.gz HHPSXMFISRKAPM-UHFFFAOYSA-N 1 1 365.393 2.876 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001472036069 1064901435 /nfs/dbraw/zinc/90/14/35/1064901435.db2.gz RBLAQVHVJUBQIK-JTQLQIEISA-N 1 1 372.828 2.772 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001472036069 1064901446 /nfs/dbraw/zinc/90/14/46/1064901446.db2.gz RBLAQVHVJUBQIK-JTQLQIEISA-N 1 1 372.828 2.772 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001472646936 1065120426 /nfs/dbraw/zinc/12/04/26/1065120426.db2.gz YGMZNXOLDGYHGO-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001472674883 1065125487 /nfs/dbraw/zinc/12/54/87/1065125487.db2.gz IOFMCJXPYYLAOA-GFCCVEGCSA-N 1 1 359.386 2.615 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001472677869 1065125712 /nfs/dbraw/zinc/12/57/12/1065125712.db2.gz JNLRZWJFTTVYGL-NSHDSACASA-N 1 1 374.363 2.613 20 5 FFBDMO C[C@H]1C[NH+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H](C)C1O ZINC001473631397 1065302219 /nfs/dbraw/zinc/30/22/19/1065302219.db2.gz RTAHSEYSQGDHHU-UWVGGRQHSA-N 1 1 366.805 2.747 20 5 FFBDMO COCCOc1ccc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])cc1 ZINC001473929895 1065421550 /nfs/dbraw/zinc/42/15/50/1065421550.db2.gz KVBLYOYFUAYMTG-UHFFFAOYSA-N 1 1 362.382 2.624 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NCc3c(Br)cccc3[N+](=O)[O-])[C@H]2C1 ZINC001474303326 1065490054 /nfs/dbraw/zinc/49/00/54/1065490054.db2.gz XNAXUKMPBYDCHP-VHRBIJSZSA-N 1 1 354.248 2.787 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001475069532 1065693026 /nfs/dbraw/zinc/69/30/26/1065693026.db2.gz UZSCTYDXKLLIME-GUTXKFCHSA-N 1 1 369.487 2.548 20 5 FFBDMO Cc1cc(F)cc2c1CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001579612706 1078650298 /nfs/dbraw/zinc/65/02/98/1078650298.db2.gz RQZOUFFOFAUAKF-LJQANCHMSA-N 1 1 357.385 2.801 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)cccc1[N+](=O)[O-] ZINC001558020633 1075930028 /nfs/dbraw/zinc/93/00/28/1075930028.db2.gz QOYRUQZJIMQHIX-MRXNPFEDSA-N 1 1 368.437 2.949 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(F)c([N+](=O)[O-])cc2CO)cn1 ZINC001559075919 1076123011 /nfs/dbraw/zinc/12/30/11/1076123011.db2.gz BBWLWYHGYQCQII-UHFFFAOYSA-N 1 1 357.345 2.727 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC001560641542 1076287181 /nfs/dbraw/zinc/28/71/81/1076287181.db2.gz HMGBIKPDKDEHEI-OAHLLOKOSA-N 1 1 370.409 2.771 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(Cc3cc(Br)c([N+](=O)[O-])s3)[C@@H]2C1 ZINC001560898039 1076307521 /nfs/dbraw/zinc/30/75/21/1076307521.db2.gz WONDOZVUVLYXJM-JOYOIKCWSA-N 1 1 360.277 2.945 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001566156247 1076926280 /nfs/dbraw/zinc/92/62/80/1076926280.db2.gz PBIWKWBJJOVVTJ-CYBMUJFWSA-N 1 1 366.849 2.825 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C[N@H+]1Cc1ccccc1 ZINC001566338703 1076948099 /nfs/dbraw/zinc/94/80/99/1076948099.db2.gz QCLCYRVGQOFNFO-ZFWWWQNUSA-N 1 1 354.410 2.570 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H]1C(C)(C)C ZINC001570914706 1077242718 /nfs/dbraw/zinc/24/27/18/1077242718.db2.gz JWABNSWNUJGRIJ-QGZVFWFLSA-N 1 1 358.442 2.738 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001586784933 1079685887 /nfs/dbraw/zinc/68/58/87/1079685887.db2.gz ZZXQFXVQPFJBNC-INIZCTEOSA-N 1 1 351.422 2.903 20 5 FFBDMO C[C@@H](Nc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978705 1080918052 /nfs/dbraw/zinc/91/80/52/1080918052.db2.gz YMVNGWYYCRFTNL-CHWSQXEVSA-N 1 1 371.445 2.840 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590050742 1080979291 /nfs/dbraw/zinc/97/92/91/1080979291.db2.gz OMVDNBFKSNMSAH-YVEFUNNKSA-N 1 1 368.397 2.501 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000195719850 210209053 /nfs/dbraw/zinc/20/90/53/210209053.db2.gz MLCZVEMQGLYNPM-YQQAZPJKSA-N 1 1 361.442 2.617 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCn2cccc2[C@@H]1C ZINC000026264498 249340965 /nfs/dbraw/zinc/34/09/65/249340965.db2.gz AFIXYEBPUQYILP-ZDUSSCGKSA-N 1 1 358.398 2.810 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000021055032 249326596 /nfs/dbraw/zinc/32/65/96/249326596.db2.gz KLCRWFQXNAQDQF-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000021055032 249326599 /nfs/dbraw/zinc/32/65/99/249326599.db2.gz KLCRWFQXNAQDQF-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[C@@H]1[NH+]1CCOCC1 ZINC000120009352 250535935 /nfs/dbraw/zinc/53/59/35/250535935.db2.gz YNMILGVVSDEXPU-YJBOKZPZSA-N 1 1 368.437 2.814 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000153326295 251125248 /nfs/dbraw/zinc/12/52/48/251125248.db2.gz UGCUCPJIVDHMLR-GDBMZVCRSA-N 1 1 359.426 2.692 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@H]21 ZINC000270936395 251665424 /nfs/dbraw/zinc/66/54/24/251665424.db2.gz IVNNYMPJXLZVTE-ZYHUDNBSSA-N 1 1 355.236 2.673 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O ZINC000272283275 252000277 /nfs/dbraw/zinc/00/02/77/252000277.db2.gz DFVQPWLHNPQSPO-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O ZINC000272283275 252000280 /nfs/dbraw/zinc/00/02/80/252000280.db2.gz DFVQPWLHNPQSPO-CABCVRRESA-N 1 1 360.414 2.874 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H](c1ccco1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272554368 252066789 /nfs/dbraw/zinc/06/67/89/252066789.db2.gz RURCKZDZIPMARV-FUHWJXTLSA-N 1 1 369.425 2.903 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272671401 252098142 /nfs/dbraw/zinc/09/81/42/252098142.db2.gz TXMRMUWAYZAQBB-SWLSCSKDSA-N 1 1 367.833 2.570 20 5 FFBDMO Cc1cc(N2CCC([N@H+](C)CCCO)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272889074 252157994 /nfs/dbraw/zinc/15/79/94/252157994.db2.gz XKIKNVSJJCKAFJ-UHFFFAOYSA-N 1 1 358.442 2.734 20 5 FFBDMO Cc1cc(N2CCC([N@@H+](C)CCCO)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000272889074 252157998 /nfs/dbraw/zinc/15/79/98/252157998.db2.gz XKIKNVSJJCKAFJ-UHFFFAOYSA-N 1 1 358.442 2.734 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCSC3(CCOCC3)C2)c2c(c1)COCO2 ZINC000274518498 255889340 /nfs/dbraw/zinc/88/93/40/255889340.db2.gz XKYNYOVSZNZEIM-UHFFFAOYSA-N 1 1 366.439 2.559 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000275555264 256023116 /nfs/dbraw/zinc/02/31/16/256023116.db2.gz CVEFBSSAPSIADT-KRWDZBQOSA-N 1 1 353.394 2.690 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCC[C@@H](C)C1 ZINC000276125744 256074439 /nfs/dbraw/zinc/07/44/39/256074439.db2.gz ZQFDCJFJUMTMNU-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCC[C@@H](C)C1 ZINC000276125744 256074440 /nfs/dbraw/zinc/07/44/40/256074440.db2.gz ZQFDCJFJUMTMNU-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000276321317 256089997 /nfs/dbraw/zinc/08/99/97/256089997.db2.gz YWDCUSAQWDWDJM-BXUZGUMPSA-N 1 1 362.348 2.997 20 5 FFBDMO COC(=O)c1cnc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000276690037 256121889 /nfs/dbraw/zinc/12/18/89/256121889.db2.gz HBGCPSHNAVSIPV-CHWSQXEVSA-N 1 1 362.430 2.841 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)[C@@H]2C1 ZINC000277262025 256177510 /nfs/dbraw/zinc/17/75/10/256177510.db2.gz LMAHMWCHWYPUNE-ZWNOBZJWSA-N 1 1 368.231 2.524 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000278265808 256293196 /nfs/dbraw/zinc/29/31/96/256293196.db2.gz YPVVZHVIFLRMHU-GOSISDBHSA-N 1 1 367.409 2.780 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000281021867 256595505 /nfs/dbraw/zinc/59/55/05/256595505.db2.gz OLUZARIJFNLIGP-KYJSFNMBSA-N 1 1 361.442 2.939 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000283628531 256892527 /nfs/dbraw/zinc/89/25/27/256892527.db2.gz BIOLIBLHERHIFN-JTDSTZFVSA-N 1 1 354.410 2.682 20 5 FFBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936527 257012205 /nfs/dbraw/zinc/01/22/05/257012205.db2.gz LZFVDNGBBGPDGH-KSSFIOAISA-N 1 1 372.425 2.545 20 5 FFBDMO C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000285936527 257012206 /nfs/dbraw/zinc/01/22/06/257012206.db2.gz LZFVDNGBBGPDGH-KSSFIOAISA-N 1 1 372.425 2.545 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000287280122 257081035 /nfs/dbraw/zinc/08/10/35/257081035.db2.gz LRVHGJOERYBABD-UHFFFAOYSA-N 1 1 362.430 2.540 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000288480029 257193689 /nfs/dbraw/zinc/19/36/89/257193689.db2.gz RRCWLDWRCPZDTR-CALCHBBNSA-N 1 1 355.442 2.688 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c([N+](=O)[O-])c1 ZINC000289999157 257310706 /nfs/dbraw/zinc/31/07/06/257310706.db2.gz SXUDQJDGNKXGOZ-CYBMUJFWSA-N 1 1 366.805 2.779 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c([N+](=O)[O-])c1 ZINC000289999157 257310707 /nfs/dbraw/zinc/31/07/07/257310707.db2.gz SXUDQJDGNKXGOZ-CYBMUJFWSA-N 1 1 366.805 2.779 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCOC(C)(C)C1 ZINC000290014169 257311434 /nfs/dbraw/zinc/31/14/34/257311434.db2.gz ZXOKCXJAAHXRQY-MRXNPFEDSA-N 1 1 361.442 2.763 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(-n3cc[nH+]c3C)nc2)c1 ZINC000302102991 258087574 /nfs/dbraw/zinc/08/75/74/258087574.db2.gz QSHKMAOCCUPYHS-UHFFFAOYSA-N 1 1 367.365 2.883 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302772841 258110355 /nfs/dbraw/zinc/11/03/55/258110355.db2.gz NOBVUFNJDONXBR-CJNGLKHVSA-N 1 1 370.409 2.851 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330703740 258168818 /nfs/dbraw/zinc/16/88/18/258168818.db2.gz JIRFKMQMQMCWJK-NVXWUHKLSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1c(NC(=O)CCN2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000332008724 258210101 /nfs/dbraw/zinc/21/01/01/258210101.db2.gz JSUQEZANNSMVID-ZBFHGGJFSA-N 1 1 360.458 2.790 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332371414 258227462 /nfs/dbraw/zinc/22/74/62/258227462.db2.gz BDMNEAVBILOFPC-HNNXBMFYSA-N 1 1 360.458 2.607 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332371414 258227463 /nfs/dbraw/zinc/22/74/63/258227463.db2.gz BDMNEAVBILOFPC-HNNXBMFYSA-N 1 1 360.458 2.607 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000332485925 258232074 /nfs/dbraw/zinc/23/20/74/258232074.db2.gz AWAGWPRYPZUFAR-QWHCGFSZSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000331825449 258201794 /nfs/dbraw/zinc/20/17/94/258201794.db2.gz MXYBKXOLVQJHQR-OIISXLGYSA-N 1 1 360.458 2.967 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000097617975 132229984 /nfs/dbraw/zinc/22/99/84/132229984.db2.gz TZCQSZPQMPCKGK-IYBDPMFKSA-N 1 1 374.485 2.855 20 5 FFBDMO C[C@@](O)(C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(F)(F)F ZINC000602577405 521418364 /nfs/dbraw/zinc/41/83/64/521418364.db2.gz NSDREYOVEFNQIS-MRVPVSSYSA-N 1 1 363.155 2.822 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000054223607 506516006 /nfs/dbraw/zinc/51/60/06/506516006.db2.gz KFQDIVDRBRRBRL-RDJZCZTQSA-N 1 1 369.421 2.925 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000054645702 506595069 /nfs/dbraw/zinc/59/50/69/506595069.db2.gz GJLMYMOKBIUQEG-SFHVURJKSA-N 1 1 368.437 2.711 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000067024257 506728732 /nfs/dbraw/zinc/72/87/32/506728732.db2.gz DBGWCQFDUZNBAL-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000067702721 506981202 /nfs/dbraw/zinc/98/12/02/506981202.db2.gz ZUUAVECJBOJYSN-LZWOXQAQSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000067702721 506981208 /nfs/dbraw/zinc/98/12/08/506981208.db2.gz ZUUAVECJBOJYSN-LZWOXQAQSA-N 1 1 361.442 2.617 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000067724893 506990922 /nfs/dbraw/zinc/99/09/22/506990922.db2.gz JJUMZTHXQRLZRU-GOSISDBHSA-N 1 1 354.410 2.793 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000067724893 506990927 /nfs/dbraw/zinc/99/09/27/506990927.db2.gz JJUMZTHXQRLZRU-GOSISDBHSA-N 1 1 354.410 2.793 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)NCc1ccccc1[N+](=O)[O-] ZINC000045623269 506993202 /nfs/dbraw/zinc/99/32/02/506993202.db2.gz RTOHPLZGRWOQSM-UHFFFAOYSA-N 1 1 368.437 2.842 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000018110358 507138656 /nfs/dbraw/zinc/13/86/56/507138656.db2.gz SNJXDJUDNJVUNO-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000046479122 507141899 /nfs/dbraw/zinc/14/18/99/507141899.db2.gz VPEGLZXAFJOIGV-NSHDSACASA-N 1 1 360.439 2.614 20 5 FFBDMO O=C(NCC1([NH+]2CCOCC2)CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000018177056 507142821 /nfs/dbraw/zinc/14/28/21/507142821.db2.gz AKKASXXXCWRILX-UHFFFAOYSA-N 1 1 362.430 2.751 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047405726 507324027 /nfs/dbraw/zinc/32/40/27/507324027.db2.gz HMHSDOPRKSPVJR-NSHDSACASA-N 1 1 353.806 2.688 20 5 FFBDMO CSc1ccc(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000023509028 507356775 /nfs/dbraw/zinc/35/67/75/507356775.db2.gz ZCMICJPTAXBGGI-BETUJISGSA-N 1 1 367.471 2.546 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)c2ccccc2C1 ZINC000069090901 507405923 /nfs/dbraw/zinc/40/59/23/507405923.db2.gz QZZCVVQUJGCAFE-AWEZNQCLSA-N 1 1 354.410 2.874 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000069090901 507405930 /nfs/dbraw/zinc/40/59/30/507405930.db2.gz QZZCVVQUJGCAFE-AWEZNQCLSA-N 1 1 354.410 2.874 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000027334992 507647515 /nfs/dbraw/zinc/64/75/15/507647515.db2.gz ICDGTCZCCHJBEG-OAHLLOKOSA-N 1 1 359.382 2.763 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C ZINC000071959598 507730624 /nfs/dbraw/zinc/73/06/24/507730624.db2.gz WYRVPTZTTRAKTR-QGZVFWFLSA-N 1 1 360.410 2.784 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCCOc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000029854636 507792819 /nfs/dbraw/zinc/79/28/19/507792819.db2.gz YGLUOEAICOPYSI-UHFFFAOYSA-N 1 1 357.410 2.959 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCCOc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000029854636 507792823 /nfs/dbraw/zinc/79/28/23/507792823.db2.gz YGLUOEAICOPYSI-UHFFFAOYSA-N 1 1 357.410 2.959 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000078146619 507839459 /nfs/dbraw/zinc/83/94/59/507839459.db2.gz FKXCPKKHNPNBKS-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000078146619 507839460 /nfs/dbraw/zinc/83/94/60/507839460.db2.gz FKXCPKKHNPNBKS-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO CCSCC[C@@H](C)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000072900773 507871398 /nfs/dbraw/zinc/87/13/98/507871398.db2.gz BHCQSCLGMFUMOF-CYBMUJFWSA-N 1 1 351.472 2.947 20 5 FFBDMO Cc1cnc(N2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000078659692 507895032 /nfs/dbraw/zinc/89/50/32/507895032.db2.gz MHQAHWDGKRODNB-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H](C[NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000090095863 507908211 /nfs/dbraw/zinc/90/82/11/507908211.db2.gz ZMTQVYBYFKCWFJ-INIZCTEOSA-N 1 1 368.437 2.815 20 5 FFBDMO COc1ccc(C[C@H](C)C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000090619701 507930739 /nfs/dbraw/zinc/93/07/39/507930739.db2.gz MAUBLNHVWNLZRJ-HNNXBMFYSA-N 1 1 359.426 2.576 20 5 FFBDMO CC[C@H](CSC)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000091099785 507955047 /nfs/dbraw/zinc/95/50/47/507955047.db2.gz JANZASZYYDTDGH-GFCCVEGCSA-N 1 1 353.444 2.966 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccnc2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109793976 507987476 /nfs/dbraw/zinc/98/74/76/507987476.db2.gz WGBJGTHAQHXZQQ-UHFFFAOYSA-N 1 1 363.805 2.720 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CC[N@@H+](C)C2)CC1 ZINC000109849251 507991631 /nfs/dbraw/zinc/99/16/31/507991631.db2.gz QXTXHBBPVWDJIG-HNNXBMFYSA-N 1 1 360.458 2.513 20 5 FFBDMO CC(C)C(=O)NCC[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000092103914 508043663 /nfs/dbraw/zinc/04/36/63/508043663.db2.gz WCENSWTVGUYPJZ-UHFFFAOYSA-N 1 1 358.236 2.561 20 5 FFBDMO CC(C)C(=O)NCC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000092103914 508043665 /nfs/dbraw/zinc/04/36/65/508043665.db2.gz WCENSWTVGUYPJZ-UHFFFAOYSA-N 1 1 358.236 2.561 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000075109128 508083529 /nfs/dbraw/zinc/08/35/29/508083529.db2.gz BHFOLNSCBNSCAF-SFHVURJKSA-N 1 1 368.437 2.711 20 5 FFBDMO O=C(CN1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960603 508117613 /nfs/dbraw/zinc/11/76/13/508117613.db2.gz FKIXFGCXKWKVPR-NSHDSACASA-N 1 1 363.805 2.789 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1O ZINC000080964186 508118009 /nfs/dbraw/zinc/11/80/09/508118009.db2.gz HKXWYYCVPZVRHB-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccccc2)C2CCCCC2)c1 ZINC000075645528 508125023 /nfs/dbraw/zinc/12/50/23/508125023.db2.gz BHLQOKVPRBHVKP-IBGZPJMESA-N 1 1 358.442 2.987 20 5 FFBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075885788 508139920 /nfs/dbraw/zinc/13/99/20/508139920.db2.gz BJEGOCFXEXRLHY-HKUYNNGSSA-N 1 1 360.458 2.804 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000081128577 508141093 /nfs/dbraw/zinc/14/10/93/508141093.db2.gz CKNHOJHKJUAVBG-IBGZPJMESA-N 1 1 353.422 2.870 20 5 FFBDMO COc1cc(CN(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000093660037 508151929 /nfs/dbraw/zinc/15/19/29/508151929.db2.gz PZHMXOKANRCAEN-HNNXBMFYSA-N 1 1 351.447 2.918 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000081364567 508167733 /nfs/dbraw/zinc/16/77/33/508167733.db2.gz IQQQRXIJBZWLAF-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO CCc1nn(C)c(NC[C@@H](C)[NH+]2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000094135707 508170617 /nfs/dbraw/zinc/17/06/17/508170617.db2.gz FOOXBZIRWJTQOT-OAHLLOKOSA-N 1 1 372.473 2.513 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081631507 508198963 /nfs/dbraw/zinc/19/89/63/508198963.db2.gz HRUBWGCKETZPAX-GOEBONIOSA-N 1 1 360.458 2.586 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000112700710 508211351 /nfs/dbraw/zinc/21/13/51/508211351.db2.gz BJQWRFRSGCLUMC-OAHLLOKOSA-N 1 1 363.458 2.978 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000076494861 508213907 /nfs/dbraw/zinc/21/39/07/508213907.db2.gz DNFYYRYKUKYJPW-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000076494861 508213909 /nfs/dbraw/zinc/21/39/09/508213909.db2.gz DNFYYRYKUKYJPW-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000114799331 508348538 /nfs/dbraw/zinc/34/85/38/508348538.db2.gz DOMCHPBJTGCIPV-OAHLLOKOSA-N 1 1 371.441 2.665 20 5 FFBDMO C[N@@H+](CCNC(=O)CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC000087365826 508349553 /nfs/dbraw/zinc/34/95/53/508349553.db2.gz OZXDKMVWHMYHKF-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000133779712 508448309 /nfs/dbraw/zinc/44/83/09/508448309.db2.gz MZMQTUPOBVSRRH-CABZTGNLSA-N 1 1 357.332 2.969 20 5 FFBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134206099 508507176 /nfs/dbraw/zinc/50/71/76/508507176.db2.gz DYKZRTWQGLQAKX-SCLBCKFNSA-N 1 1 355.394 2.857 20 5 FFBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134206099 508507182 /nfs/dbraw/zinc/50/71/82/508507182.db2.gz DYKZRTWQGLQAKX-SCLBCKFNSA-N 1 1 355.394 2.857 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000134247238 508513361 /nfs/dbraw/zinc/51/33/61/508513361.db2.gz IRJXCKHXGSZTJB-KZULUSFZSA-N 1 1 355.394 2.518 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122382338 508526476 /nfs/dbraw/zinc/52/64/76/508526476.db2.gz CUHVJKYPDHMZGU-MRXNPFEDSA-N 1 1 358.442 2.753 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)[NH+](C)C ZINC000122397732 508528556 /nfs/dbraw/zinc/52/85/56/508528556.db2.gz GPAYDJNGZNWVLZ-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000116738803 508552746 /nfs/dbraw/zinc/55/27/46/508552746.db2.gz KZJBGUVZQCRHAM-CYBMUJFWSA-N 1 1 369.849 2.865 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000116738806 508552758 /nfs/dbraw/zinc/55/27/58/508552758.db2.gz KZJBGUVZQCRHAM-ZDUSSCGKSA-N 1 1 369.849 2.865 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)NC(=O)Nc1ccccc1 ZINC000153149161 508553121 /nfs/dbraw/zinc/55/31/21/508553121.db2.gz SRIFOSBILGDREO-UHFFFAOYSA-N 1 1 368.393 2.691 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Nc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000116780519 508560721 /nfs/dbraw/zinc/56/07/21/508560721.db2.gz ZSTPALXHRNSGDY-QGZVFWFLSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Nc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000116780519 508560724 /nfs/dbraw/zinc/56/07/24/508560724.db2.gz ZSTPALXHRNSGDY-QGZVFWFLSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(CCN1CCC[C@@H]([NH+]2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000157400834 508562463 /nfs/dbraw/zinc/56/24/63/508562463.db2.gz GPWNKSIBRCIGQU-MRXNPFEDSA-N 1 1 360.458 2.874 20 5 FFBDMO CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H]1CCC[N@@H+](C)C1 ZINC000153509854 508590697 /nfs/dbraw/zinc/59/06/97/508590697.db2.gz DDFVZOFMSMWDJI-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000157818520 508617446 /nfs/dbraw/zinc/61/74/46/508617446.db2.gz RPCDHUUKVDNYMJ-LLVKDONJSA-N 1 1 359.430 2.804 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N[C@@H](C)C(C)C)CC1 ZINC000153883100 508668649 /nfs/dbraw/zinc/66/86/49/508668649.db2.gz RSCXQXFRPFTWBF-AWEZNQCLSA-N 1 1 363.458 2.976 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CN3CCOCC3)C2)ccc1Cl ZINC000153908449 508674946 /nfs/dbraw/zinc/67/49/46/508674946.db2.gz ICRICMLZWUMDDX-OAHLLOKOSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](CN3CCOCC3)C2)ccc1Cl ZINC000153908449 508674947 /nfs/dbraw/zinc/67/49/47/508674947.db2.gz ICRICMLZWUMDDX-OAHLLOKOSA-N 1 1 353.850 2.792 20 5 FFBDMO Cc1[nH+]ccn1CCCCn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000158276777 508682176 /nfs/dbraw/zinc/68/21/76/508682176.db2.gz IHWWNKGHAAIAHJ-UHFFFAOYSA-N 1 1 355.192 2.504 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@@H](C)O1 ZINC000153999463 508695185 /nfs/dbraw/zinc/69/51/85/508695185.db2.gz CABLXUZKSXBJMT-KFWWJZLASA-N 1 1 360.410 2.597 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(CC)Cc2ccc(C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000158473484 508709373 /nfs/dbraw/zinc/70/93/73/508709373.db2.gz WJGFMOSRQWDQGJ-UHFFFAOYSA-N 1 1 373.457 2.994 20 5 FFBDMO CC[N@H+](CCO)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000158679893 508738446 /nfs/dbraw/zinc/73/84/46/508738446.db2.gz QJKSJVOXDCXOHI-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CC[N@@H+](CCO)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000158679893 508738448 /nfs/dbraw/zinc/73/84/48/508738448.db2.gz QJKSJVOXDCXOHI-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CCOc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000158758611 508748888 /nfs/dbraw/zinc/74/88/88/508748888.db2.gz HJFOXCVDBMTGSG-UHFFFAOYSA-N 1 1 370.409 2.659 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)COc2ccccc2[N+](=O)[O-])c1 ZINC000123890958 508753707 /nfs/dbraw/zinc/75/37/07/508753707.db2.gz WKXNEIUBUMQJIG-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137459990 508757198 /nfs/dbraw/zinc/75/71/98/508757198.db2.gz MYFGUFBVIRJSJQ-WBVHZDCISA-N 1 1 369.421 2.753 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000137476473 508757470 /nfs/dbraw/zinc/75/74/70/508757470.db2.gz WLSZNRQAIHCRDW-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)c1[N+](=O)[O-] ZINC000154314359 508758257 /nfs/dbraw/zinc/75/82/57/508758257.db2.gz NTLZNCNLOBYAEV-ZDUSSCGKSA-N 1 1 351.451 2.511 20 5 FFBDMO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1nc(-c2cccnc2)no1 ZINC000154355365 508766933 /nfs/dbraw/zinc/76/69/33/508766933.db2.gz IYCSWLQHCZHNKZ-UHFFFAOYSA-N 1 1 369.381 2.941 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1nc(-c2cccnc2)no1 ZINC000154355365 508766936 /nfs/dbraw/zinc/76/69/36/508766936.db2.gz IYCSWLQHCZHNKZ-UHFFFAOYSA-N 1 1 369.381 2.941 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC000139802578 508794894 /nfs/dbraw/zinc/79/48/94/508794894.db2.gz ZPKCTHIPEOEEAJ-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000140049814 508798858 /nfs/dbraw/zinc/79/88/58/508798858.db2.gz DXPAQWSPXZTRNV-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000140049814 508798861 /nfs/dbraw/zinc/79/88/61/508798861.db2.gz DXPAQWSPXZTRNV-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140053099 508799022 /nfs/dbraw/zinc/79/90/22/508799022.db2.gz AQULGWWXIFFQHG-ZBFHGGJFSA-N 1 1 357.414 2.561 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000154639800 508824435 /nfs/dbraw/zinc/82/44/35/508824435.db2.gz KYLZXQWWOHVLSL-UHFFFAOYSA-N 1 1 372.263 2.746 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000159348930 508828965 /nfs/dbraw/zinc/82/89/65/508828965.db2.gz ZNRBKVRCTMELJG-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000369460207 512420502 /nfs/dbraw/zinc/42/05/02/512420502.db2.gz BDFNDXAITGBZPO-CQSZACIVSA-N 1 1 373.413 2.535 20 5 FFBDMO CC(C)[N@@H+](CCN1C(=O)NC2(CCCC2)C1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000159577106 508861361 /nfs/dbraw/zinc/86/13/61/508861361.db2.gz MRFVFVJMZZXLAL-UHFFFAOYSA-N 1 1 374.441 2.670 20 5 FFBDMO CCc1cc(N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832123 508865463 /nfs/dbraw/zinc/86/54/63/508865463.db2.gz FUCDGWAQJCDDJF-GUYCJALGSA-N 1 1 371.441 2.745 20 5 FFBDMO CCc1cc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832123 508865465 /nfs/dbraw/zinc/86/54/65/508865465.db2.gz FUCDGWAQJCDDJF-GUYCJALGSA-N 1 1 371.441 2.745 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000119860124 508877876 /nfs/dbraw/zinc/87/78/76/508877876.db2.gz UEKGQFYWMCULRP-GUYCJALGSA-N 1 1 357.385 2.984 20 5 FFBDMO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000150930613 508924601 /nfs/dbraw/zinc/92/46/01/508924601.db2.gz CGPSSKQAKKCORW-CQSZACIVSA-N 1 1 353.382 2.905 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000125258508 508956440 /nfs/dbraw/zinc/95/64/40/508956440.db2.gz SFTJWVZINUOMFS-KRWDZBQOSA-N 1 1 362.474 2.805 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121123932 509133124 /nfs/dbraw/zinc/13/31/24/509133124.db2.gz CMUHXOSNRLJQAL-PXNSSMCTSA-N 1 1 374.529 2.779 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H](C)O1 ZINC000161630352 509137413 /nfs/dbraw/zinc/13/74/13/509137413.db2.gz HKQKXHDVEJEIRD-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H](C)O1 ZINC000161630352 509137416 /nfs/dbraw/zinc/13/74/16/509137416.db2.gz HKQKXHDVEJEIRD-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO CC(C)C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCCc2cccnc21 ZINC000126853860 509138859 /nfs/dbraw/zinc/13/88/59/509138859.db2.gz WAMBOEGQVRLGSA-ZWKOTPCHSA-N 1 1 373.457 2.583 20 5 FFBDMO CN(CC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000248088090 509234046 /nfs/dbraw/zinc/23/40/46/509234046.db2.gz SZZHGDNOFSXMND-OXQOHEQNSA-N 1 1 368.437 2.593 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1c(C)noc1C ZINC000182443992 509240163 /nfs/dbraw/zinc/24/01/63/509240163.db2.gz GSKWCKVJQCQZQN-HNNXBMFYSA-N 1 1 358.398 2.830 20 5 FFBDMO CC(C)(O)C[N@H+](Cc1ccccc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182472056 509254774 /nfs/dbraw/zinc/25/47/74/509254774.db2.gz XNPHGFBUTCIZJK-QGZVFWFLSA-N 1 1 374.437 2.608 20 5 FFBDMO C[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000182509840 509277348 /nfs/dbraw/zinc/27/73/48/509277348.db2.gz RPKBFNANRJOYEG-XYPHTWIQSA-N 1 1 352.456 2.879 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000266959813 509278815 /nfs/dbraw/zinc/27/88/15/509278815.db2.gz WOOLULUMSVHYMB-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000172957537 509323458 /nfs/dbraw/zinc/32/34/58/509323458.db2.gz WNWCTZOQMMPWFW-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO CCS[C@H]1CCCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248450147 509326110 /nfs/dbraw/zinc/32/61/10/509326110.db2.gz ILYHZCRRLAXEQV-CABCVRRESA-N 1 1 354.472 2.942 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000248473136 509336003 /nfs/dbraw/zinc/33/60/03/509336003.db2.gz WRDMEHURAVYZBO-FRFSOERESA-N 1 1 352.456 2.695 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248476038 509338789 /nfs/dbraw/zinc/33/87/89/509338789.db2.gz YBCGXCRPLKEUMI-WMLDXEAASA-N 1 1 360.410 2.603 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650014 509351686 /nfs/dbraw/zinc/35/16/86/509351686.db2.gz XXNOLVSIKLBXSV-DGCLKSJQSA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650014 509351696 /nfs/dbraw/zinc/35/16/96/509351696.db2.gz XXNOLVSIKLBXSV-DGCLKSJQSA-N 1 1 374.384 2.983 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Br)N1CC[NH+](CC2CC2)CC1 ZINC000182659922 509354810 /nfs/dbraw/zinc/35/48/10/509354810.db2.gz GHIGXAFAKGPCNB-UHFFFAOYSA-N 1 1 368.231 2.525 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1Br ZINC000182658299 509355174 /nfs/dbraw/zinc/35/51/74/509355174.db2.gz AWTMCSFUBKLCAU-SNVBAGLBSA-N 1 1 368.231 2.571 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173078887 509381463 /nfs/dbraw/zinc/38/14/63/509381463.db2.gz BPVBECBWZPVTNU-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173078887 509381466 /nfs/dbraw/zinc/38/14/66/509381466.db2.gz BPVBECBWZPVTNU-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000248701142 509442022 /nfs/dbraw/zinc/44/20/22/509442022.db2.gz AFZKVOPMXUGHAO-HNAYVOBHSA-N 1 1 369.421 2.610 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000248719146 509451970 /nfs/dbraw/zinc/45/19/70/509451970.db2.gz CELXJNXCAQZVCB-MLGOLLRUSA-N 1 1 372.400 2.566 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000186075059 509511742 /nfs/dbraw/zinc/51/17/42/509511742.db2.gz GDURXNYYXWUVHB-KGLIPLIRSA-N 1 1 367.471 2.526 20 5 FFBDMO CCCC[C@@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000236898874 509529947 /nfs/dbraw/zinc/52/99/47/509529947.db2.gz HANFQSKENKFEFK-VIFPVBQESA-N 1 1 370.258 2.697 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1 ZINC000189463085 509587555 /nfs/dbraw/zinc/58/75/55/509587555.db2.gz SFTXOTNRKFGRNC-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1 ZINC000189463085 509587559 /nfs/dbraw/zinc/58/75/59/509587559.db2.gz SFTXOTNRKFGRNC-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1 ZINC000179817194 509635582 /nfs/dbraw/zinc/63/55/82/509635582.db2.gz ZHBOQUSPCJBIJW-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO C[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[NH+]1CCCC1 ZINC000237388557 509637227 /nfs/dbraw/zinc/63/72/27/509637227.db2.gz ZQZITQXIWIDAEI-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000249803545 509766550 /nfs/dbraw/zinc/76/65/50/509766550.db2.gz ARWDPEUQOYFBJY-UKRRQHHQSA-N 1 1 363.439 2.671 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000189966417 509858062 /nfs/dbraw/zinc/85/80/62/509858062.db2.gz DPODFJPLTDDYAR-UHFFFAOYSA-N 1 1 357.410 2.774 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000245408745 509911549 /nfs/dbraw/zinc/91/15/49/509911549.db2.gz ISMQWZOOEWKVPE-HUUCEWRRSA-N 1 1 371.224 2.688 20 5 FFBDMO C[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000180465070 509938387 /nfs/dbraw/zinc/93/83/87/509938387.db2.gz HCRZXFQSOQIXQZ-UWJYYQICSA-N 1 1 368.481 2.910 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000245445771 509939299 /nfs/dbraw/zinc/93/92/99/509939299.db2.gz KQDCVRBBWVQABV-KGLIPLIRSA-N 1 1 359.430 2.979 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000174184760 509989737 /nfs/dbraw/zinc/98/97/37/509989737.db2.gz QEFSZUAFWIXEKZ-HNNXBMFYSA-N 1 1 364.446 2.619 20 5 FFBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000245548147 509997028 /nfs/dbraw/zinc/99/70/28/509997028.db2.gz YFJXPMXVGQSYPC-DOTOQJQBSA-N 1 1 359.430 2.680 20 5 FFBDMO C[C@H](C[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000183926818 510042306 /nfs/dbraw/zinc/04/23/06/510042306.db2.gz PYJGLKXKTLCEJO-GFCCVEGCSA-N 1 1 360.439 2.676 20 5 FFBDMO C[C@H](C[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nccs1 ZINC000183926818 510042311 /nfs/dbraw/zinc/04/23/11/510042311.db2.gz PYJGLKXKTLCEJO-GFCCVEGCSA-N 1 1 360.439 2.676 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000190292532 510048508 /nfs/dbraw/zinc/04/85/08/510048508.db2.gz XWXVDVPVTONUHQ-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000190292532 510048513 /nfs/dbraw/zinc/04/85/13/510048513.db2.gz XWXVDVPVTONUHQ-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000245631618 510049614 /nfs/dbraw/zinc/04/96/14/510049614.db2.gz IBMBRSMXNJWZTA-ZWKOTPCHSA-N 1 1 354.410 2.839 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000245658884 510067144 /nfs/dbraw/zinc/06/71/44/510067144.db2.gz PBPFDDWLBMIDCI-QZTJIDSGSA-N 1 1 354.410 2.839 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000171354652 510102603 /nfs/dbraw/zinc/10/26/03/510102603.db2.gz SPUJGZZYMZFJIN-QGZVFWFLSA-N 1 1 368.437 2.593 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCC[C@@H](C)C1 ZINC000245721178 510107579 /nfs/dbraw/zinc/10/75/79/510107579.db2.gz WCTKIDTYRPHQQP-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000174526452 510160472 /nfs/dbraw/zinc/16/04/72/510160472.db2.gz ZDAKECIMNFYJNO-INIZCTEOSA-N 1 1 374.485 2.999 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC000174621643 510211718 /nfs/dbraw/zinc/21/17/18/510211718.db2.gz XKDITWBIJMBMCD-NWDGAFQWSA-N 1 1 357.332 2.922 20 5 FFBDMO COc1cc(C[NH2+]C(C)(C)C(=O)NCC2CCCC2)c([N+](=O)[O-])cc1F ZINC000184292177 510244344 /nfs/dbraw/zinc/24/43/44/510244344.db2.gz XIMVCHVXISEUMS-UHFFFAOYSA-N 1 1 367.421 2.917 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000265936166 510311810 /nfs/dbraw/zinc/31/18/10/510311810.db2.gz FCPNCCQEBLHMIW-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269293367 510328060 /nfs/dbraw/zinc/32/80/60/510328060.db2.gz QRAUKRRLKODKRW-MRXNPFEDSA-N 1 1 369.421 2.595 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269293367 510328067 /nfs/dbraw/zinc/32/80/67/510328067.db2.gz QRAUKRRLKODKRW-MRXNPFEDSA-N 1 1 369.421 2.595 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)CCn1cc([N+](=O)[O-])cn1 ZINC000174839505 510336690 /nfs/dbraw/zinc/33/66/90/510336690.db2.gz YNIUQWXJVYJRMG-UHFFFAOYSA-N 1 1 354.414 2.746 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269453547 510415080 /nfs/dbraw/zinc/41/50/80/510415080.db2.gz GPTPDBXYTJCBLT-HIFRSBDPSA-N 1 1 371.441 2.834 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1)[NH+]1CCOCC1 ZINC000178194057 510483027 /nfs/dbraw/zinc/48/30/27/510483027.db2.gz QLKULJCMGKFYRD-CYBMUJFWSA-N 1 1 370.409 2.823 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000181637525 510514913 /nfs/dbraw/zinc/51/49/13/510514913.db2.gz KMYNKVWDHHODII-UONOGXRCSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[N@H+]1C1CC1 ZINC000184856928 510549881 /nfs/dbraw/zinc/54/98/81/510549881.db2.gz HUZIPDDPOCZUAB-NXEZZACHSA-N 1 1 368.231 2.712 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000181862855 510630977 /nfs/dbraw/zinc/63/09/77/510630977.db2.gz KMJBRXNBKHOJHO-JKSUJKDBSA-N 1 1 352.431 2.616 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2cccc(Cl)c2)c1 ZINC000246773977 510666047 /nfs/dbraw/zinc/66/60/47/510666047.db2.gz RYFKKCFKKGWBLO-CVEARBPZSA-N 1 1 350.806 2.643 20 5 FFBDMO Cc1cc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC000185102550 510686290 /nfs/dbraw/zinc/68/62/90/510686290.db2.gz YMKAQARPWDBLDZ-MRXNPFEDSA-N 1 1 360.385 2.840 20 5 FFBDMO Cn1c(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000172358934 510688425 /nfs/dbraw/zinc/68/84/25/510688425.db2.gz ROFVXFCRCRYENA-ZDUSSCGKSA-N 1 1 352.398 2.563 20 5 FFBDMO Cn1c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000172358934 510688432 /nfs/dbraw/zinc/68/84/32/510688432.db2.gz ROFVXFCRCRYENA-ZDUSSCGKSA-N 1 1 352.398 2.563 20 5 FFBDMO C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C[NH+]1CCOCC1 ZINC000172461167 510736838 /nfs/dbraw/zinc/73/68/38/510736838.db2.gz SGCKIVKMQBYAPW-GFCCVEGCSA-N 1 1 363.439 2.508 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000270389084 510788009 /nfs/dbraw/zinc/78/80/09/510788009.db2.gz AHYSWJDDRBRUDA-XJKSGUPXSA-N 1 1 357.414 2.617 20 5 FFBDMO COc1cc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)ccc1[N+](=O)[O-] ZINC000195456896 510831391 /nfs/dbraw/zinc/83/13/91/510831391.db2.gz UQUXBJCGTSNLQB-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248079 510832494 /nfs/dbraw/zinc/83/24/94/510832494.db2.gz XRIQBWMFKKWUMI-XJKSGUPXSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248079 510832498 /nfs/dbraw/zinc/83/24/98/510832498.db2.gz XRIQBWMFKKWUMI-XJKSGUPXSA-N 1 1 364.833 2.927 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247302650 510856254 /nfs/dbraw/zinc/85/62/54/510856254.db2.gz UVHXXHFGUIQRJF-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247302650 510856255 /nfs/dbraw/zinc/85/62/55/510856255.db2.gz UVHXXHFGUIQRJF-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247302650 510856256 /nfs/dbraw/zinc/85/62/56/510856256.db2.gz UVHXXHFGUIQRJF-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247302650 510856257 /nfs/dbraw/zinc/85/62/57/510856257.db2.gz UVHXXHFGUIQRJF-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)cc1SC ZINC000247420708 510860384 /nfs/dbraw/zinc/86/03/84/510860384.db2.gz NZLISILUGQDXEJ-DGCLKSJQSA-N 1 1 367.471 2.738 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000247554927 510865498 /nfs/dbraw/zinc/86/54/98/510865498.db2.gz ZCGNFKRNIRLLIY-QWHCGFSZSA-N 1 1 365.430 2.557 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)CC1 ZINC000270688008 510951168 /nfs/dbraw/zinc/95/11/68/510951168.db2.gz VAVFQCHYXNOTBX-UHFFFAOYSA-N 1 1 367.471 2.501 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000364600915 510963662 /nfs/dbraw/zinc/96/36/62/510963662.db2.gz DYQCIPLJMQTAEX-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1 ZINC000282478876 510993449 /nfs/dbraw/zinc/99/34/49/510993449.db2.gz LMFNXSRCCSLQGD-WMLDXEAASA-N 1 1 353.438 2.961 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1CC[NH+](Cc2nccn2C)CC1 ZINC000361345414 511036171 /nfs/dbraw/zinc/03/61/71/511036171.db2.gz CCWNBQYESWJOMU-UHFFFAOYSA-N 1 1 371.441 2.796 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)(C)C1 ZINC000270968642 511040399 /nfs/dbraw/zinc/04/03/99/511040399.db2.gz ZOALHGNCBLRLII-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)(C)C1 ZINC000270968642 511040405 /nfs/dbraw/zinc/04/04/05/511040405.db2.gz ZOALHGNCBLRLII-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C2 ZINC000291446837 511200679 /nfs/dbraw/zinc/20/06/79/511200679.db2.gz MVHHYWSVEZLEPA-OAHLLOKOSA-N 1 1 354.410 2.853 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3c(C)n[nH]c3C)CC2)ccc1[N+](=O)[O-] ZINC000279812692 511224645 /nfs/dbraw/zinc/22/46/45/511224645.db2.gz ORQUHGQGRJCLMY-UHFFFAOYSA-N 1 1 359.430 2.656 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+]1C ZINC000294934731 511226124 /nfs/dbraw/zinc/22/61/24/511226124.db2.gz LEVDQBITTNXWDI-IUODEOHRSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@@H+]1C ZINC000294934731 511226127 /nfs/dbraw/zinc/22/61/27/511226127.db2.gz LEVDQBITTNXWDI-IUODEOHRSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@H+]1C ZINC000294934731 511226130 /nfs/dbraw/zinc/22/61/30/511226130.db2.gz LEVDQBITTNXWDI-IUODEOHRSA-N 1 1 357.414 2.540 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@@H](C)C1 ZINC000294946459 511230366 /nfs/dbraw/zinc/23/03/66/511230366.db2.gz LUVFCFLGNLFLRY-SCLBCKFNSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000294946459 511230371 /nfs/dbraw/zinc/23/03/71/511230371.db2.gz LUVFCFLGNLFLRY-SCLBCKFNSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000294946459 511230375 /nfs/dbraw/zinc/23/03/75/511230375.db2.gz LUVFCFLGNLFLRY-SCLBCKFNSA-N 1 1 371.441 2.787 20 5 FFBDMO CCN(Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000362852290 511252024 /nfs/dbraw/zinc/25/20/24/511252024.db2.gz PTQMKMVZWUNDKC-DOTOQJQBSA-N 1 1 357.458 2.986 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000298356575 511256809 /nfs/dbraw/zinc/25/68/09/511256809.db2.gz CCRAWWXNKPEJGG-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC000298367250 511259735 /nfs/dbraw/zinc/25/97/35/511259735.db2.gz USQMUZNTOJEGRM-ZBFHGGJFSA-N 1 1 369.368 2.909 20 5 FFBDMO CCOc1cccc(CNC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271792802 511325775 /nfs/dbraw/zinc/32/57/75/511325775.db2.gz VAMAKCFKISRWMX-CQSZACIVSA-N 1 1 357.410 2.961 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000295315040 511359954 /nfs/dbraw/zinc/35/99/54/511359954.db2.gz CSVKTPQDIGVJHJ-GFCCVEGCSA-N 1 1 365.405 2.689 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000291978325 511414800 /nfs/dbraw/zinc/41/48/00/511414800.db2.gz YLRDUVIGOFGZQY-ZFWWWQNUSA-N 1 1 371.441 2.834 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000295471108 511417011 /nfs/dbraw/zinc/41/70/11/511417011.db2.gz GDRDFIGSLCCTPC-LBPRGKRZSA-N 1 1 367.421 2.856 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000295471108 511417015 /nfs/dbraw/zinc/41/70/15/511417015.db2.gz GDRDFIGSLCCTPC-LBPRGKRZSA-N 1 1 367.421 2.856 20 5 FFBDMO CN(CC1([NH+](C)C)CCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295508641 511428858 /nfs/dbraw/zinc/42/88/58/511428858.db2.gz HRYCNBULTIIZFK-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000334078884 511450203 /nfs/dbraw/zinc/45/02/03/511450203.db2.gz MMJKRWIVJOJQHL-GXSJLCMTSA-N 1 1 356.220 2.570 20 5 FFBDMO C[C@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+](C2CCC2)C1 ZINC000292076628 511455231 /nfs/dbraw/zinc/45/52/31/511455231.db2.gz DAOGSGHNJBSGFS-AWEZNQCLSA-N 1 1 371.441 2.951 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCOC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000292086658 511459827 /nfs/dbraw/zinc/45/98/27/511459827.db2.gz GIKQVNJZHRFDEC-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000298955851 511464271 /nfs/dbraw/zinc/46/42/71/511464271.db2.gz DJQYANWVLOXZCX-SJLPKXTDSA-N 1 1 358.442 2.552 20 5 FFBDMO C[N@@H+]1CC[C@@]2(CCN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133251 511478114 /nfs/dbraw/zinc/47/81/14/511478114.db2.gz LLBYWPTWHQNPIO-LJQANCHMSA-N 1 1 356.426 2.820 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133251 511478118 /nfs/dbraw/zinc/47/81/18/511478118.db2.gz LLBYWPTWHQNPIO-LJQANCHMSA-N 1 1 356.426 2.820 20 5 FFBDMO CN1CC[C@@]2(CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133251 511478125 /nfs/dbraw/zinc/47/81/25/511478125.db2.gz LLBYWPTWHQNPIO-LJQANCHMSA-N 1 1 356.426 2.820 20 5 FFBDMO CN1CC[C@@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133251 511478133 /nfs/dbraw/zinc/47/81/33/511478133.db2.gz LLBYWPTWHQNPIO-LJQANCHMSA-N 1 1 356.426 2.820 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O ZINC000272267477 511485114 /nfs/dbraw/zinc/48/51/14/511485114.db2.gz AOUOGGRNOMSNKD-CVEARBPZSA-N 1 1 350.415 2.690 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O ZINC000272267477 511485117 /nfs/dbraw/zinc/48/51/17/511485117.db2.gz AOUOGGRNOMSNKD-CVEARBPZSA-N 1 1 350.415 2.690 20 5 FFBDMO Nc1ccc(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)c([N+](=O)[O-])c1 ZINC000283757188 511489982 /nfs/dbraw/zinc/48/99/82/511489982.db2.gz MFLLCDXVKQEGBO-KRWDZBQOSA-N 1 1 356.426 2.746 20 5 FFBDMO Cc1cccn2c(=O)cc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])nc12 ZINC000292166281 511490793 /nfs/dbraw/zinc/49/07/93/511490793.db2.gz PCHGGJNTZAZWKS-UHFFFAOYSA-N 1 1 352.394 2.936 20 5 FFBDMO C[C@@H]1C[C@H](N(C)Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000363355218 511499134 /nfs/dbraw/zinc/49/91/34/511499134.db2.gz IFPYLARFENUJIE-NVXWUHKLSA-N 1 1 357.458 2.813 20 5 FFBDMO CC(C)([NH2+]CC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000292249585 511521228 /nfs/dbraw/zinc/52/12/28/511521228.db2.gz XNWBSFOGSXQPGT-SJORKVTESA-N 1 1 361.442 2.590 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4cscn4)CC3)nc2c1 ZINC000295873700 511541403 /nfs/dbraw/zinc/54/14/03/511541403.db2.gz ZFTIDPYTOZVYOM-UHFFFAOYSA-N 1 1 372.454 2.682 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnnn1Cc1ccccc1 ZINC000292788468 511720821 /nfs/dbraw/zinc/72/08/21/511720821.db2.gz MERMUNAUQGYUCI-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnnn1Cc1ccccc1 ZINC000292788468 511720823 /nfs/dbraw/zinc/72/08/23/511720823.db2.gz MERMUNAUQGYUCI-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC000365934631 511737013 /nfs/dbraw/zinc/73/70/13/511737013.db2.gz RBVVXWWKKJAMAZ-KRWDZBQOSA-N 1 1 362.817 2.595 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110220 511844454 /nfs/dbraw/zinc/84/44/54/511844454.db2.gz QVNHGZZAQBRWQN-BEFAXECRSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110220 511844461 /nfs/dbraw/zinc/84/44/61/511844461.db2.gz QVNHGZZAQBRWQN-BEFAXECRSA-N 1 1 363.458 2.961 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284857429 511901423 /nfs/dbraw/zinc/90/14/23/511901423.db2.gz RVQVVTREFMEGQZ-WBVHZDCISA-N 1 1 363.414 2.575 20 5 FFBDMO CCc1nocc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000293413398 511956230 /nfs/dbraw/zinc/95/62/30/511956230.db2.gz MQGLEJHKZBFUNU-UHFFFAOYSA-N 1 1 362.386 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4cccnc4)CC3)nc2c1 ZINC000274862955 511967545 /nfs/dbraw/zinc/96/75/45/511967545.db2.gz UWPDGCJFKDVWLN-UHFFFAOYSA-N 1 1 366.425 2.621 20 5 FFBDMO C[C@H](c1cnccn1)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274860781 511967701 /nfs/dbraw/zinc/96/77/01/511967701.db2.gz UEDQEISRMSTCQR-CYBMUJFWSA-N 1 1 367.413 2.534 20 5 FFBDMO CCC(=O)c1ccc(N2CC[C@H](N3CC[NH+](C)CC3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000366430490 512020282 /nfs/dbraw/zinc/02/02/82/512020282.db2.gz NMSOXBARGMXMJL-RDJZCZTQSA-N 1 1 374.485 2.650 20 5 FFBDMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000366441813 512026638 /nfs/dbraw/zinc/02/66/38/512026638.db2.gz OXIJPFPFARGWIW-HNNXBMFYSA-N 1 1 370.471 2.653 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000360037881 512065847 /nfs/dbraw/zinc/06/58/47/512065847.db2.gz SEHBFYYRSKOHCV-GOEBONIOSA-N 1 1 371.397 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000375729104 512475849 /nfs/dbraw/zinc/47/58/49/512475849.db2.gz FFUOURUXUADZFV-CYBMUJFWSA-N 1 1 365.386 2.521 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375758918 512490841 /nfs/dbraw/zinc/49/08/41/512490841.db2.gz BLZIZJVGBHGMDS-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375758918 512490846 /nfs/dbraw/zinc/49/08/46/512490846.db2.gz BLZIZJVGBHGMDS-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO CC(C)N1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])c4cnccc43)C2)CC1 ZINC000375867669 512545247 /nfs/dbraw/zinc/54/52/47/512545247.db2.gz DUKXHTOIBZQEEJ-MRXNPFEDSA-N 1 1 369.469 2.748 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000374164234 512687087 /nfs/dbraw/zinc/68/70/87/512687087.db2.gz RDZVXTPXTBMZGG-LJQANCHMSA-N 1 1 371.441 2.522 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1F ZINC000411606229 512715221 /nfs/dbraw/zinc/71/52/21/512715221.db2.gz QPIDEKGZICAASE-OLZOCXBDSA-N 1 1 367.421 2.522 20 5 FFBDMO CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000378406445 512743090 /nfs/dbraw/zinc/74/30/90/512743090.db2.gz UONIMWCDACWSTO-GOEBONIOSA-N 1 1 371.441 2.626 20 5 FFBDMO CC(=O)c1ccc2c(c1)CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000374352147 512784391 /nfs/dbraw/zinc/78/43/91/512784391.db2.gz OJZXWVIEFMFCNH-FQEVSTJZSA-N 1 1 354.406 2.932 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000374354016 512785947 /nfs/dbraw/zinc/78/59/47/512785947.db2.gz SZZPQFURWASALR-AWEZNQCLSA-N 1 1 369.425 2.558 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](C2CCOCC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374363246 512791852 /nfs/dbraw/zinc/79/18/52/512791852.db2.gz PQJUTSMRVKLGTK-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](C2CCOCC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000374363246 512791857 /nfs/dbraw/zinc/79/18/57/512791857.db2.gz PQJUTSMRVKLGTK-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000378500978 512792618 /nfs/dbraw/zinc/79/26/18/512792618.db2.gz YUDQABAYLNGUKL-SWLSCSKDSA-N 1 1 353.369 2.629 20 5 FFBDMO O=[N+]([O-])c1cn(C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)nc1C1CC1 ZINC000370278488 512856447 /nfs/dbraw/zinc/85/64/47/512856447.db2.gz GTPSTOXTCDDWOI-QGZVFWFLSA-N 1 1 356.426 2.960 20 5 FFBDMO CNc1ccc(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000388307935 512894133 /nfs/dbraw/zinc/89/41/33/512894133.db2.gz HPJZNZWTROOIEC-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000370493708 512962709 /nfs/dbraw/zinc/96/27/09/512962709.db2.gz XBCRGYQNCIXDBS-OAHLLOKOSA-N 1 1 355.394 2.910 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000370493708 512962711 /nfs/dbraw/zinc/96/27/11/512962711.db2.gz XBCRGYQNCIXDBS-OAHLLOKOSA-N 1 1 355.394 2.910 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[nH+]c1 ZINC000412119873 512969005 /nfs/dbraw/zinc/96/90/05/512969005.db2.gz KPGFYCNRBNOYHF-UHFFFAOYSA-N 1 1 372.425 2.739 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412357087 513052579 /nfs/dbraw/zinc/05/25/79/513052579.db2.gz DNNMXKFZVRMOKD-GFCCVEGCSA-N 1 1 355.410 2.522 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374882757 513054134 /nfs/dbraw/zinc/05/41/34/513054134.db2.gz WJNMBIZUULHQTH-CYBMUJFWSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374882757 513054137 /nfs/dbraw/zinc/05/41/37/513054137.db2.gz WJNMBIZUULHQTH-CYBMUJFWSA-N 1 1 361.377 2.795 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H]3CCCC[C@@]32c2ccccc2)c1 ZINC000370706823 513062780 /nfs/dbraw/zinc/06/27/80/513062780.db2.gz FVDFXYLXHBDWBE-QXAKKESOSA-N 1 1 356.426 2.554 20 5 FFBDMO CCOC1(C)CC[NH+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000428745170 513180311 /nfs/dbraw/zinc/18/03/11/513180311.db2.gz AEMTUTCVTCLBGB-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H](C)[N@@H+](CC)C[C@@H]1C ZINC000439888181 513205247 /nfs/dbraw/zinc/20/52/47/513205247.db2.gz NBDQLZCZLAPOSL-STQMWFEESA-N 1 1 350.419 2.940 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1C ZINC000440077455 513241143 /nfs/dbraw/zinc/24/11/43/513241143.db2.gz LFWFUPGXMAVFSJ-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000429012247 513252756 /nfs/dbraw/zinc/25/27/56/513252756.db2.gz SVAROROQNREWGK-CPUCHLNUSA-N 1 1 371.441 2.807 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000429039209 513264419 /nfs/dbraw/zinc/26/44/19/513264419.db2.gz HIZBCVVEPVTHON-XJKCOSOUSA-N 1 1 351.422 2.905 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000424991265 513355593 /nfs/dbraw/zinc/35/55/93/513355593.db2.gz NPJYZUJPVUXGRK-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])CC1 ZINC000421699282 513374206 /nfs/dbraw/zinc/37/42/06/513374206.db2.gz AWKCRSPEHXOKGQ-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N(C)C[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000421706635 513378837 /nfs/dbraw/zinc/37/88/37/513378837.db2.gz VINZUDIPRDGDCW-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2ccnc(N)n2)C1 ZINC000429723305 513452012 /nfs/dbraw/zinc/45/20/12/513452012.db2.gz JUPRJYHZNJAMIZ-AWEZNQCLSA-N 1 1 371.441 2.964 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425270887 513486214 /nfs/dbraw/zinc/48/62/14/513486214.db2.gz BFBXHAGNZQXNBU-DLBZAZTESA-N 1 1 355.442 2.830 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+]2CC=C(C(C)(C)C)CC2)n1 ZINC000413278388 513564816 /nfs/dbraw/zinc/56/48/16/513564816.db2.gz HPMSZSMGECUACM-UHFFFAOYSA-N 1 1 362.430 2.867 20 5 FFBDMO CCOCCOCC[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425442818 513569098 /nfs/dbraw/zinc/56/90/98/513569098.db2.gz KFUFBLUWIRWKAF-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO CCOCCOCC[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425442818 513569101 /nfs/dbraw/zinc/56/91/01/513569101.db2.gz KFUFBLUWIRWKAF-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000447982647 513647792 /nfs/dbraw/zinc/64/77/92/513647792.db2.gz MFBVENCTYWPXNS-INIZCTEOSA-N 1 1 364.446 2.523 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451339619 513685923 /nfs/dbraw/zinc/68/59/23/513685923.db2.gz ILTBNIWGSFOVTH-BNEJOLLZSA-N 1 1 361.442 2.937 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451340828 513686270 /nfs/dbraw/zinc/68/62/70/513686270.db2.gz KJIZTYLGQCPKFA-LESCRADOSA-N 1 1 361.442 2.939 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1 ZINC000451341706 513688700 /nfs/dbraw/zinc/68/87/00/513688700.db2.gz LLBIFZGBWJZHNF-RCCFBDPRSA-N 1 1 361.442 2.939 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000451347708 513693131 /nfs/dbraw/zinc/69/31/31/513693131.db2.gz UPPXXMMJHIFWJK-RCCFBDPRSA-N 1 1 361.442 2.573 20 5 FFBDMO C[C@@]12C[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368985 513705609 /nfs/dbraw/zinc/70/56/09/513705609.db2.gz MWBIIQUWVYFOMS-JJUQKUTHSA-N 1 1 353.422 2.628 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436072863 513751965 /nfs/dbraw/zinc/75/19/65/513751965.db2.gz CRKQESBMFHDJOB-CYBMUJFWSA-N 1 1 367.424 2.892 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1Cc1cc(F)ccc1F ZINC000419305572 513769272 /nfs/dbraw/zinc/76/92/72/513769272.db2.gz XEISSUQXQVLSBK-OAHLLOKOSA-N 1 1 363.364 2.742 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448590721 513797911 /nfs/dbraw/zinc/79/79/11/513797911.db2.gz DLYUMVATVORGGK-HNNXBMFYSA-N 1 1 361.442 2.938 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@H+](Cc3ccccc3)CCO1)CCN2 ZINC000436271582 513813055 /nfs/dbraw/zinc/81/30/55/513813055.db2.gz PZAPMDVAOOYFQJ-MRXNPFEDSA-N 1 1 368.437 2.876 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@@H+](Cc3ccccc3)CCO1)CCN2 ZINC000436271582 513813058 /nfs/dbraw/zinc/81/30/58/513813058.db2.gz PZAPMDVAOOYFQJ-MRXNPFEDSA-N 1 1 368.437 2.876 20 5 FFBDMO COc1cc(CN2CCC[C@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OC(F)F ZINC000442928601 513816642 /nfs/dbraw/zinc/81/66/42/513816642.db2.gz QCPRWDSVMUXROZ-LLVKDONJSA-N 1 1 359.373 2.766 20 5 FFBDMO CCCCOCCNC(=O)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550488 513827938 /nfs/dbraw/zinc/82/79/38/513827938.db2.gz RXUMVRIQEJVQPM-QGZVFWFLSA-N 1 1 363.458 2.707 20 5 FFBDMO CCCCOCCNC(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550488 513827944 /nfs/dbraw/zinc/82/79/44/513827944.db2.gz RXUMVRIQEJVQPM-QGZVFWFLSA-N 1 1 363.458 2.707 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437345547 514144924 /nfs/dbraw/zinc/14/49/24/514144924.db2.gz LEJYLWNQWNBMQR-OTYXRUKQSA-N 1 1 357.332 2.826 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1F)CCC(F)(F)F ZINC000427255474 514163343 /nfs/dbraw/zinc/16/33/43/514163343.db2.gz GCGNRLNCDOBSIE-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449362662 514181288 /nfs/dbraw/zinc/18/12/88/514181288.db2.gz LPAIQKKUXYOXHM-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1 ZINC000428530324 514490600 /nfs/dbraw/zinc/49/06/00/514490600.db2.gz CXBRPQVUBAMUOD-INIZCTEOSA-N 1 1 355.394 2.722 20 5 FFBDMO C[N@@H+](CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCSC1 ZINC000452863721 514523534 /nfs/dbraw/zinc/52/35/34/514523534.db2.gz VXOXRWBQHVYDDD-RDJZCZTQSA-N 1 1 363.483 2.738 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000502347706 514620746 /nfs/dbraw/zinc/62/07/46/514620746.db2.gz HIGHBORKFCGCLJ-CYBMUJFWSA-N 1 1 350.419 2.989 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000502347707 514621543 /nfs/dbraw/zinc/62/15/43/514621543.db2.gz HIGHBORKFCGCLJ-ZDUSSCGKSA-N 1 1 350.419 2.989 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H](O)COCc2ccccc2)ccc1[N+](=O)[O-] ZINC000489102137 514711112 /nfs/dbraw/zinc/71/11/12/514711112.db2.gz HLAFONPKVSZNIQ-QGZVFWFLSA-N 1 1 360.410 2.613 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000502711011 514748338 /nfs/dbraw/zinc/74/83/38/514748338.db2.gz GVMVDPQYRQVQNA-MRXNPFEDSA-N 1 1 369.487 2.836 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC000484884018 514828936 /nfs/dbraw/zinc/82/89/36/514828936.db2.gz MFKGSIKYFNHTIO-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1cc(F)cc2c1C[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000502904318 514838601 /nfs/dbraw/zinc/83/86/01/514838601.db2.gz QUZNGXJDQSGGKS-INIZCTEOSA-N 1 1 360.385 2.840 20 5 FFBDMO Cc1cc(F)cc2c1C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000502904318 514838609 /nfs/dbraw/zinc/83/86/09/514838609.db2.gz QUZNGXJDQSGGKS-INIZCTEOSA-N 1 1 360.385 2.840 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000475938350 514861509 /nfs/dbraw/zinc/86/15/09/514861509.db2.gz KHGXNNLWTRJLKO-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000475938350 514861518 /nfs/dbraw/zinc/86/15/18/514861518.db2.gz KHGXNNLWTRJLKO-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO CNc1nc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)ccc1[N+](=O)[O-] ZINC000456010172 514901519 /nfs/dbraw/zinc/90/15/19/514901519.db2.gz BXRVMGVKUQHKNA-UHFFFAOYSA-N 1 1 363.805 2.999 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000485148575 514935979 /nfs/dbraw/zinc/93/59/79/514935979.db2.gz FBIPPBIWZKPDRM-LBPRGKRZSA-N 1 1 369.263 2.920 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000485348544 515004898 /nfs/dbraw/zinc/00/48/98/515004898.db2.gz LPGCGDDFLAVHEF-QWHCGFSZSA-N 1 1 367.471 2.546 20 5 FFBDMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1CCSC1 ZINC000456192247 515013943 /nfs/dbraw/zinc/01/39/43/515013943.db2.gz ROFWONADMCQRNM-ZDUSSCGKSA-N 1 1 352.460 2.791 20 5 FFBDMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000456192247 515013956 /nfs/dbraw/zinc/01/39/56/515013956.db2.gz ROFWONADMCQRNM-ZDUSSCGKSA-N 1 1 352.460 2.791 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490063893 515086281 /nfs/dbraw/zinc/08/62/81/515086281.db2.gz OVYJHGJJQVLWER-OAHLLOKOSA-N 1 1 359.430 2.839 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000503702943 515125187 /nfs/dbraw/zinc/12/51/87/515125187.db2.gz RSFSGNRUTIFDBE-HOCLYGCPSA-N 1 1 360.385 2.963 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000456368918 515134724 /nfs/dbraw/zinc/13/47/24/515134724.db2.gz FPOOEKADFBPYNT-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1C ZINC000480926157 515137795 /nfs/dbraw/zinc/13/77/95/515137795.db2.gz KNHXXMMNIVDQFS-KBPBESRZSA-N 1 1 369.487 2.753 20 5 FFBDMO COc1c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000476696898 515162570 /nfs/dbraw/zinc/16/25/70/515162570.db2.gz VVZAFWUDJXDZOG-RHSMWYFYSA-N 1 1 369.421 2.854 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653480 515276917 /nfs/dbraw/zinc/27/69/17/515276917.db2.gz ANIWQEDARCDFSL-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653480 515276924 /nfs/dbraw/zinc/27/69/24/515276924.db2.gz ANIWQEDARCDFSL-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO CCc1cc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000462885087 515281209 /nfs/dbraw/zinc/28/12/09/515281209.db2.gz TWJLISKVLYLTLJ-CJNGLKHVSA-N 1 1 355.442 2.931 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000472491304 515290127 /nfs/dbraw/zinc/29/01/27/515290127.db2.gz AVLRDZJBODVPCI-QWHZDKJVSA-N 1 1 370.453 2.820 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)c1 ZINC000462932349 515304750 /nfs/dbraw/zinc/30/47/50/515304750.db2.gz RMIFZPIZOUCTGE-UHFFFAOYSA-N 1 1 374.416 2.977 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000499658234 515402512 /nfs/dbraw/zinc/40/25/12/515402512.db2.gz LNSWZOGIJCSXPH-INIZCTEOSA-N 1 1 358.442 2.930 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000468695376 515474802 /nfs/dbraw/zinc/47/48/02/515474802.db2.gz SFIGHURGNOPWPS-HIFRSBDPSA-N 1 1 354.410 2.742 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1C ZINC000486432423 515480494 /nfs/dbraw/zinc/48/04/94/515480494.db2.gz YMPWEQWAMFSYPK-VXGBXAGGSA-N 1 1 355.385 2.747 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000486432419 515480574 /nfs/dbraw/zinc/48/05/74/515480574.db2.gz YMPWEQWAMFSYPK-RYUDHWBXSA-N 1 1 355.385 2.747 20 5 FFBDMO CC[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)[N@H+]1CCc2ccccc2C1 ZINC000468729509 515489672 /nfs/dbraw/zinc/48/96/72/515489672.db2.gz PGLKMYOQGGDMEO-INIZCTEOSA-N 1 1 368.437 2.744 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3OC)CC[NH2+]2)cc1 ZINC000505492283 515554820 /nfs/dbraw/zinc/55/48/20/515554820.db2.gz YEOXDZQOLXGMBV-KRWDZBQOSA-N 1 1 369.421 2.953 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000505512242 515565595 /nfs/dbraw/zinc/56/55/95/515565595.db2.gz CBLABCKSSKQDKD-LJQANCHMSA-N 1 1 369.421 2.709 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000457064436 515620107 /nfs/dbraw/zinc/62/01/07/515620107.db2.gz WMZCTGMJKHBOTK-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000457074197 515629176 /nfs/dbraw/zinc/62/91/76/515629176.db2.gz LQBCUFAAMXCYSR-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493443511 515633724 /nfs/dbraw/zinc/63/37/24/515633724.db2.gz SONUSNUPBNTFTP-QWHCGFSZSA-N 1 1 369.849 2.611 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707242 515658679 /nfs/dbraw/zinc/65/86/79/515658679.db2.gz OACIBGFAHWKVOP-AAEUAGOBSA-N 1 1 373.400 2.820 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)n1 ZINC000478037376 515675730 /nfs/dbraw/zinc/67/57/30/515675730.db2.gz PQYZSWYADXDWNJ-HXUWFJFHSA-N 1 1 369.469 2.779 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cncc(F)c1 ZINC000459620468 515700908 /nfs/dbraw/zinc/70/09/08/515700908.db2.gz LMFDSCVQBMYGNO-QWRGUYRKSA-N 1 1 362.361 2.815 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc2c(s1)CCC2 ZINC000459636713 515710274 /nfs/dbraw/zinc/71/02/74/515710274.db2.gz QJMIKPSOONGADE-NSHDSACASA-N 1 1 372.450 2.780 20 5 FFBDMO CN1C(=O)C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482734459 515786851 /nfs/dbraw/zinc/78/68/51/515786851.db2.gz PVLITDIARYOVNY-BBRMVZONSA-N 1 1 367.377 2.996 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cnccc2C)c([N+](=O)[O-])c1 ZINC000483009879 515880907 /nfs/dbraw/zinc/88/09/07/515880907.db2.gz AQGZLFNPRJXEFD-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000511429018 515902918 /nfs/dbraw/zinc/90/29/18/515902918.db2.gz PUFPKWHMZPMRKB-INIZCTEOSA-N 1 1 360.458 2.796 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])c(OC)c2)[C@H](C)C1 ZINC000469789549 515968169 /nfs/dbraw/zinc/96/81/69/515968169.db2.gz YUHBGXAFAWJMQL-WBVHZDCISA-N 1 1 365.474 2.830 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1C ZINC000487986266 516065565 /nfs/dbraw/zinc/06/55/65/516065565.db2.gz GYTVZQYMEMIGRZ-WMLDXEAASA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1C ZINC000487986266 516065575 /nfs/dbraw/zinc/06/55/75/516065575.db2.gz GYTVZQYMEMIGRZ-WMLDXEAASA-N 1 1 370.471 2.506 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000469995790 516068014 /nfs/dbraw/zinc/06/80/14/516068014.db2.gz FUGALENZDMSWKT-COPLHBTASA-N 1 1 360.370 2.589 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000495181692 516092542 /nfs/dbraw/zinc/09/25/42/516092542.db2.gz DMOPVSYDEUZPBV-CYBMUJFWSA-N 1 1 374.363 2.897 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131026 516134785 /nfs/dbraw/zinc/13/47/85/516134785.db2.gz FNZUCTSQALXPNM-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131026 516134798 /nfs/dbraw/zinc/13/47/98/516134798.db2.gz FNZUCTSQALXPNM-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131026 516134807 /nfs/dbraw/zinc/13/48/07/516134807.db2.gz FNZUCTSQALXPNM-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470143382 516141744 /nfs/dbraw/zinc/14/17/44/516141744.db2.gz JQPIEIYSQRBYOL-UHFFFAOYSA-N 1 1 358.373 2.914 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000507270868 516148698 /nfs/dbraw/zinc/14/86/98/516148698.db2.gz DGBVHYYVFXXYEE-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000470165211 516156470 /nfs/dbraw/zinc/15/64/70/516156470.db2.gz GKJYXNMPDFUDKQ-CYBMUJFWSA-N 1 1 369.368 2.943 20 5 FFBDMO C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507374011 516190304 /nfs/dbraw/zinc/19/03/04/516190304.db2.gz YGGSFLSXWZIHRY-GDBMZVCRSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507374011 516190311 /nfs/dbraw/zinc/19/03/11/516190311.db2.gz YGGSFLSXWZIHRY-GDBMZVCRSA-N 1 1 369.421 2.941 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000507470135 516219824 /nfs/dbraw/zinc/21/98/24/516219824.db2.gz TXTKTYVFQAQGLF-DZGCQCFKSA-N 1 1 357.414 2.616 20 5 FFBDMO CCC[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2OC)CC[N@H+]1CCOC ZINC000501771409 516220621 /nfs/dbraw/zinc/22/06/21/516220621.db2.gz FVJKDZPDPOXZFV-QGZVFWFLSA-N 1 1 351.447 2.536 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCCC[N@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000507568135 516247634 /nfs/dbraw/zinc/24/76/34/516247634.db2.gz QGTKGPDCOBWHLF-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO Cc1c(CC(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000512417573 516270819 /nfs/dbraw/zinc/27/08/19/516270819.db2.gz ZVYQTJUZAGIPHA-UHFFFAOYSA-N 1 1 353.422 2.789 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cn2C)cc1 ZINC000531255472 516376607 /nfs/dbraw/zinc/37/66/07/516376607.db2.gz GUVJCXBVWPEVMK-GFCCVEGCSA-N 1 1 353.382 2.918 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N1CC[NH+](CCOc2ccccc2)CC1 ZINC000517622596 516387511 /nfs/dbraw/zinc/38/75/11/516387511.db2.gz GMVXMYDHEYKEQL-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000540021366 516404546 /nfs/dbraw/zinc/40/45/46/516404546.db2.gz POZUSESLYGQYFS-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@@H+]1C ZINC000540021366 516404549 /nfs/dbraw/zinc/40/45/49/516404549.db2.gz POZUSESLYGQYFS-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO COc1ccc(CNC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000517738099 516433086 /nfs/dbraw/zinc/43/30/86/516433086.db2.gz WGEZANITQNMRIB-ZIAGYGMSSA-N 1 1 364.446 2.523 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000523354778 516447314 /nfs/dbraw/zinc/44/73/14/516447314.db2.gz IXEYQYFSBJUTSA-CYBMUJFWSA-N 1 1 352.410 2.701 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000531427065 516459367 /nfs/dbraw/zinc/45/93/67/516459367.db2.gz IZSBLQISTHMBRC-NSHDSACASA-N 1 1 370.247 2.817 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523595144 516515261 /nfs/dbraw/zinc/51/52/61/516515261.db2.gz SUXLISMTCMHKBB-OWCLPIDISA-N 1 1 362.474 2.803 20 5 FFBDMO CN1CC[N@H+](C)C[C@@H]1c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000550998684 516516778 /nfs/dbraw/zinc/51/67/78/516516778.db2.gz MQANLTVQCCLNHQ-GFCCVEGCSA-N 1 1 371.319 2.582 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1c1noc(-c2cc([N+](=O)[O-])ccc2C(F)(F)F)n1 ZINC000550998684 516516787 /nfs/dbraw/zinc/51/67/87/516516787.db2.gz MQANLTVQCCLNHQ-GFCCVEGCSA-N 1 1 371.319 2.582 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544072353 516568235 /nfs/dbraw/zinc/56/82/35/516568235.db2.gz VCPAIHQGOYAHRG-BMGDILEWSA-N 1 1 366.458 2.860 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@@H](C)C1 ZINC000561762682 516756837 /nfs/dbraw/zinc/75/68/37/516756837.db2.gz PTYKIIXRYKWZSH-GDZNZVCISA-N 1 1 356.426 2.878 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000524637202 516775636 /nfs/dbraw/zinc/77/56/36/516775636.db2.gz QDOODUOOWSHPIF-MCIONIFRSA-N 1 1 363.462 2.748 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600037 516846704 /nfs/dbraw/zinc/84/67/04/516846704.db2.gz RNCCGJIGANFBLN-HOTGVXAUSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600037 516846711 /nfs/dbraw/zinc/84/67/11/516846711.db2.gz RNCCGJIGANFBLN-HOTGVXAUSA-N 1 1 363.461 2.706 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000525053985 516903938 /nfs/dbraw/zinc/90/39/38/516903938.db2.gz TUMQXMIUMCTRDE-GXTWGEPZSA-N 1 1 365.430 2.557 20 5 FFBDMO CN(C)CC[NH+]1CCC(N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000514608267 516960271 /nfs/dbraw/zinc/96/02/71/516960271.db2.gz MPQVORVYTRZOLB-MRXNPFEDSA-N 1 1 374.407 2.814 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000558859544 516973657 /nfs/dbraw/zinc/97/36/57/516973657.db2.gz DXAXLVDPFUBCAI-MRXNPFEDSA-N 1 1 358.446 2.650 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000525353685 517014146 /nfs/dbraw/zinc/01/41/46/517014146.db2.gz BNZSVFXHVCDXDQ-KRWDZBQOSA-N 1 1 362.474 2.947 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000525355355 517016430 /nfs/dbraw/zinc/01/64/30/517016430.db2.gz RBAYAUZYTJRZAN-MRXNPFEDSA-N 1 1 362.474 2.949 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCc1ccccc1O ZINC000541389556 517025896 /nfs/dbraw/zinc/02/58/96/517025896.db2.gz ARVXUSAAQBYRSK-UHFFFAOYSA-N 1 1 373.409 2.812 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H]1C ZINC000525396030 517028687 /nfs/dbraw/zinc/02/86/87/517028687.db2.gz KRAKLPRVNUDROD-KSSFIOAISA-N 1 1 371.441 2.725 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cccc(O)c2)c([N+](=O)[O-])c1 ZINC000532589457 517050364 /nfs/dbraw/zinc/05/03/64/517050364.db2.gz CBJOAEUKHTUJME-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@](CO)(C(C)C)C2)c([N+](=O)[O-])c1 ZINC000555711887 517078095 /nfs/dbraw/zinc/07/80/95/517078095.db2.gz CUYGLPWJYOEWKQ-GOSISDBHSA-N 1 1 352.431 2.713 20 5 FFBDMO C[C@@H]1C[C@@H]1N1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000525708445 517129523 /nfs/dbraw/zinc/12/95/23/517129523.db2.gz PKHPQBYBAKCWBY-KFNAQCHYSA-N 1 1 372.450 2.817 20 5 FFBDMO CC1=CC[N@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552280257 517174895 /nfs/dbraw/zinc/17/48/95/517174895.db2.gz ASTSNGBMNFPFKE-GOSISDBHSA-N 1 1 355.442 2.659 20 5 FFBDMO CC1=CC[N@@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552280257 517174904 /nfs/dbraw/zinc/17/49/04/517174904.db2.gz ASTSNGBMNFPFKE-GOSISDBHSA-N 1 1 355.442 2.659 20 5 FFBDMO Cc1cc(NC[C@H]2CC[N@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000548764972 517199211 /nfs/dbraw/zinc/19/92/11/517199211.db2.gz LRYIDFRUHPKQKN-OAHLLOKOSA-N 1 1 355.442 2.924 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000520073494 517269592 /nfs/dbraw/zinc/26/95/92/517269592.db2.gz OCPMFHINRRNKLB-UONOGXRCSA-N 1 1 369.487 2.556 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000520441905 517395050 /nfs/dbraw/zinc/39/50/50/517395050.db2.gz BYUVFUPLCGZVRE-DYVFJYSZSA-N 1 1 354.410 2.626 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000515666955 517443100 /nfs/dbraw/zinc/44/31/00/517443100.db2.gz CUWBHUACFXPTAS-HNNXBMFYSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000515666955 517443109 /nfs/dbraw/zinc/44/31/09/517443109.db2.gz CUWBHUACFXPTAS-HNNXBMFYSA-N 1 1 371.441 2.701 20 5 FFBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000542519237 517606995 /nfs/dbraw/zinc/60/69/95/517606995.db2.gz MTVDLUMBPODQME-AWEZNQCLSA-N 1 1 353.382 2.973 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)n1 ZINC000553272536 517616178 /nfs/dbraw/zinc/61/61/78/517616178.db2.gz BDSDENBFKRXQDO-OKILXGFUSA-N 1 1 364.446 2.946 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCCC[C@@H]2C)n1 ZINC000553275577 517620480 /nfs/dbraw/zinc/62/04/80/517620480.db2.gz LGRMFHFEKJDVJQ-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000533845470 517638320 /nfs/dbraw/zinc/63/83/20/517638320.db2.gz FBKDSPRBVZLREX-KRWDZBQOSA-N 1 1 354.410 2.923 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533845470 517638332 /nfs/dbraw/zinc/63/83/32/517638332.db2.gz FBKDSPRBVZLREX-KRWDZBQOSA-N 1 1 354.410 2.923 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000556763387 517639698 /nfs/dbraw/zinc/63/96/98/517639698.db2.gz HXPBRZYNTOOMHP-ZDUSSCGKSA-N 1 1 374.363 2.849 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000553332850 517651392 /nfs/dbraw/zinc/65/13/92/517651392.db2.gz UANRMYFRTUNRNY-LBPRGKRZSA-N 1 1 370.247 2.962 20 5 FFBDMO O=C1NCCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1Cc1ccccc1 ZINC000549832890 517733356 /nfs/dbraw/zinc/73/33/56/517733356.db2.gz PDFGCAKTHJELNU-IBGZPJMESA-N 1 1 353.422 2.571 20 5 FFBDMO COc1cc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000553508282 517752504 /nfs/dbraw/zinc/75/25/04/517752504.db2.gz YGOXZJCNRXAJHX-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@H]1C ZINC000542889141 517800970 /nfs/dbraw/zinc/80/09/70/517800970.db2.gz OPHFZPWGFABZEV-MNOVXSKESA-N 1 1 357.357 2.751 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000543063326 517889866 /nfs/dbraw/zinc/88/98/66/517889866.db2.gz LYKRLKGJOZSRPZ-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000557197894 517914113 /nfs/dbraw/zinc/91/41/13/517914113.db2.gz UWVMINJIBOSYNV-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000557197894 517914121 /nfs/dbraw/zinc/91/41/21/517914121.db2.gz UWVMINJIBOSYNV-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000543158474 517937159 /nfs/dbraw/zinc/93/71/59/517937159.db2.gz HFHSSFSVKGVUJM-HNNXBMFYSA-N 1 1 357.435 2.990 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000543158474 517937164 /nfs/dbraw/zinc/93/71/64/517937164.db2.gz HFHSSFSVKGVUJM-HNNXBMFYSA-N 1 1 357.435 2.990 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000522091399 517979849 /nfs/dbraw/zinc/97/98/49/517979849.db2.gz BJUZBDKASQMFOH-CYBMUJFWSA-N 1 1 362.455 2.637 20 5 FFBDMO NC(=O)c1cccc(N2CC[NH+](C/C=C/c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000517107643 518029789 /nfs/dbraw/zinc/02/97/89/518029789.db2.gz ZBPZMSWSVSMMKR-VMPITWQZSA-N 1 1 366.421 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000534797000 518036479 /nfs/dbraw/zinc/03/64/79/518036479.db2.gz IWCBICILMYULKM-CVEARBPZSA-N 1 1 357.410 2.651 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000539435389 518048692 /nfs/dbraw/zinc/04/86/92/518048692.db2.gz WXNPEWBEZBHRKL-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000539435389 518048700 /nfs/dbraw/zinc/04/87/00/518048700.db2.gz WXNPEWBEZBHRKL-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000539435389 518048708 /nfs/dbraw/zinc/04/87/08/518048708.db2.gz WXNPEWBEZBHRKL-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000539435389 518048715 /nfs/dbraw/zinc/04/87/15/518048715.db2.gz WXNPEWBEZBHRKL-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000560836009 518054693 /nfs/dbraw/zinc/05/46/93/518054693.db2.gz KULBMKRRFXSTNW-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000560836009 518054703 /nfs/dbraw/zinc/05/47/03/518054703.db2.gz KULBMKRRFXSTNW-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000522364767 518089290 /nfs/dbraw/zinc/08/92/90/518089290.db2.gz BJLIFOBMXLCTDQ-GUYCJALGSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000557603230 518101618 /nfs/dbraw/zinc/10/16/18/518101618.db2.gz JXEBVYCAEYMYPY-SOLBZPMBSA-N 1 1 363.458 2.547 20 5 FFBDMO Cc1cccc2ncc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)n21 ZINC000539836388 518170726 /nfs/dbraw/zinc/17/07/26/518170726.db2.gz ASRWQPKJPBSBEY-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000566836452 518223708 /nfs/dbraw/zinc/22/37/08/518223708.db2.gz KBDIYFSTHWUJIU-QGZVFWFLSA-N 1 1 360.458 2.783 20 5 FFBDMO COc1c(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000584414209 518330162 /nfs/dbraw/zinc/33/01/62/518330162.db2.gz LWHICYBXWDGCCB-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202508 518349092 /nfs/dbraw/zinc/34/90/92/518349092.db2.gz MLBMUEXAGLNOCP-OAGGEKHMSA-N 1 1 362.474 2.879 20 5 FFBDMO C[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000569954006 518374002 /nfs/dbraw/zinc/37/40/02/518374002.db2.gz IZONEHWXAZLAQY-OAHLLOKOSA-N 1 1 363.458 2.515 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000581675608 518402944 /nfs/dbraw/zinc/40/29/44/518402944.db2.gz YIGRGYFPKVHJPV-MRXNPFEDSA-N 1 1 369.421 2.742 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000567207134 518404651 /nfs/dbraw/zinc/40/46/51/518404651.db2.gz GWXOAQIESFZKPX-UONOGXRCSA-N 1 1 373.457 2.743 20 5 FFBDMO CC(C)(NC(=O)NCc1c[nH+]c2n1CCCC2)c1ccccc1[N+](=O)[O-] ZINC000584696080 518433367 /nfs/dbraw/zinc/43/33/67/518433367.db2.gz JDPCRXDSFXCTJB-UHFFFAOYSA-N 1 1 357.414 2.862 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)C[C@H]21 ZINC000584710851 518441586 /nfs/dbraw/zinc/44/15/86/518441586.db2.gz KKIRLDYOSJRPIG-IAGOWNOFSA-N 1 1 354.410 2.566 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)n1 ZINC000585789906 518598825 /nfs/dbraw/zinc/59/88/25/518598825.db2.gz DLZHMXFRWRZHID-MAUKXSAKSA-N 1 1 372.473 2.859 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC000586770034 518635675 /nfs/dbraw/zinc/63/56/75/518635675.db2.gz FOEZTUFCBYSUKX-GOSISDBHSA-N 1 1 359.332 2.969 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C2 ZINC000586770034 518635680 /nfs/dbraw/zinc/63/56/80/518635680.db2.gz FOEZTUFCBYSUKX-GOSISDBHSA-N 1 1 359.332 2.969 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000570653546 518713853 /nfs/dbraw/zinc/71/38/53/518713853.db2.gz ZALFDOCXMKLFSU-HZPDHXFCSA-N 1 1 357.410 2.651 20 5 FFBDMO C[C@@H]1CC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000576737979 518739079 /nfs/dbraw/zinc/73/90/79/518739079.db2.gz UMGOPVBCGCNCBU-CQSZACIVSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000576737979 518739084 /nfs/dbraw/zinc/73/90/84/518739084.db2.gz UMGOPVBCGCNCBU-CQSZACIVSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000567954090 518799065 /nfs/dbraw/zinc/79/90/65/518799065.db2.gz OZCVCGRSRYKHNE-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000573830306 518855091 /nfs/dbraw/zinc/85/50/91/518855091.db2.gz USEWGVGNXJDOPG-KRWDZBQOSA-N 1 1 358.442 2.882 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000568143655 518893902 /nfs/dbraw/zinc/89/39/02/518893902.db2.gz DEJUITDPKYNMSY-IBGZPJMESA-N 1 1 371.441 2.836 20 5 FFBDMO C[C@@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000573976415 518927801 /nfs/dbraw/zinc/92/78/01/518927801.db2.gz AOHZYNZDTWCOTE-LJQANCHMSA-N 1 1 355.394 2.695 20 5 FFBDMO C[C@@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000573976415 518927807 /nfs/dbraw/zinc/92/78/07/518927807.db2.gz AOHZYNZDTWCOTE-LJQANCHMSA-N 1 1 355.394 2.695 20 5 FFBDMO CN1CC[NH+](CC2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000589194379 518947171 /nfs/dbraw/zinc/94/71/71/518947171.db2.gz FBZYADGERUKQEV-XQRVVYSFSA-N 1 1 358.486 2.567 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000580056080 518984255 /nfs/dbraw/zinc/98/42/55/518984255.db2.gz QNOGEVNOEVRCHB-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000580056080 518984262 /nfs/dbraw/zinc/98/42/62/518984262.db2.gz QNOGEVNOEVRCHB-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000589484936 519014694 /nfs/dbraw/zinc/01/46/94/519014694.db2.gz GFDCQFXTQMGVQK-QGZVFWFLSA-N 1 1 370.453 2.965 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000565806734 519140747 /nfs/dbraw/zinc/14/07/47/519140747.db2.gz JJIVMJBOJKNIRH-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@H]4C[N@@H+](C)C[C@H]43)cc2[N+](=O)[O-])C1 ZINC000590447614 519236151 /nfs/dbraw/zinc/23/61/51/519236151.db2.gz ZLQTZWLYMKXIPQ-SIXWZSSISA-N 1 1 372.469 2.607 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2 ZINC000571740495 519248593 /nfs/dbraw/zinc/24/85/93/519248593.db2.gz WAJNJUPBMNIKGJ-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2 ZINC000571740495 519248598 /nfs/dbraw/zinc/24/85/98/519248598.db2.gz WAJNJUPBMNIKGJ-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1[N+](=O)[O-] ZINC000590583840 519275054 /nfs/dbraw/zinc/27/50/54/519275054.db2.gz GVNWHMDBNYRMRE-MNOVXSKESA-N 1 1 353.806 2.708 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000577898267 519313858 /nfs/dbraw/zinc/31/38/58/519313858.db2.gz DEPPOSCJRJMPBR-ROUUACIJSA-N 1 1 374.441 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CC[C@@H]3CCS(=O)(=O)C3)C2)cc1 ZINC000590757603 519353153 /nfs/dbraw/zinc/35/31/53/519353153.db2.gz CHVBIQPNVKTPNP-ZBFHGGJFSA-N 1 1 352.456 2.599 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@@H]2C)cc1OC ZINC000590759197 519354324 /nfs/dbraw/zinc/35/43/24/519354324.db2.gz WIQXFXLIXQKYTB-HEHGZKQESA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@@H]2C)cc1OC ZINC000590759197 519354332 /nfs/dbraw/zinc/35/43/32/519354332.db2.gz WIQXFXLIXQKYTB-HEHGZKQESA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@H]2C)cc1OC ZINC000590762378 519356546 /nfs/dbraw/zinc/35/65/46/519356546.db2.gz WIQXFXLIXQKYTB-XJKCOSOUSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@H]2C)cc1OC ZINC000590762378 519356552 /nfs/dbraw/zinc/35/65/52/519356552.db2.gz WIQXFXLIXQKYTB-XJKCOSOUSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000574967515 519427204 /nfs/dbraw/zinc/42/72/04/519427204.db2.gz MXGLFMKUKRYLNJ-CQSZACIVSA-N 1 1 354.838 2.526 20 5 FFBDMO Cc1c(CNC(=O)NCC[NH+]2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000616209934 519942792 /nfs/dbraw/zinc/94/27/92/519942792.db2.gz FMSOKFSKTXCDDO-UHFFFAOYSA-N 1 1 354.410 2.718 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CCc4nc[nH]c4C3)cc2[N+](=O)[O-])CC1 ZINC000599948466 519966813 /nfs/dbraw/zinc/96/68/13/519966813.db2.gz IFVGCXQUGVYCEG-UHFFFAOYSA-N 1 1 369.425 2.753 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](CO)[C@H](C(F)(F)F)C1 ZINC000602987939 520008963 /nfs/dbraw/zinc/00/89/63/520008963.db2.gz WRGCCDHTHPISSY-GXTWGEPZSA-N 1 1 362.348 2.985 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](CO)[C@H](C(F)(F)F)C1 ZINC000602987939 520008968 /nfs/dbraw/zinc/00/89/68/520008968.db2.gz WRGCCDHTHPISSY-GXTWGEPZSA-N 1 1 362.348 2.985 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000597603520 520130281 /nfs/dbraw/zinc/13/02/81/520130281.db2.gz CXWRCLCVGHTPNA-CQSZACIVSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000597603520 520130289 /nfs/dbraw/zinc/13/02/89/520130289.db2.gz CXWRCLCVGHTPNA-CQSZACIVSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000597603520 520130295 /nfs/dbraw/zinc/13/02/95/520130295.db2.gz CXWRCLCVGHTPNA-CQSZACIVSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597605160 520132426 /nfs/dbraw/zinc/13/24/26/520132426.db2.gz NJKWFHVXFNWQBD-CQSZACIVSA-N 1 1 369.849 2.960 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000600273449 520171301 /nfs/dbraw/zinc/17/13/01/520171301.db2.gz VNUKBCPTSYDOIY-YQQAZPJKSA-N 1 1 374.485 2.901 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000600297787 520188458 /nfs/dbraw/zinc/18/84/58/520188458.db2.gz FIOAEUHCZPIQBS-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1 ZINC000600297787 520188466 /nfs/dbraw/zinc/18/84/66/520188466.db2.gz FIOAEUHCZPIQBS-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000600300104 520189497 /nfs/dbraw/zinc/18/94/97/520189497.db2.gz XOCHXUGMBWECJU-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000600300104 520189502 /nfs/dbraw/zinc/18/95/02/520189502.db2.gz XOCHXUGMBWECJU-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000597710363 520189856 /nfs/dbraw/zinc/18/98/56/520189856.db2.gz LCZYVACZSIUOFI-LJQANCHMSA-N 1 1 361.442 2.940 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000597711898 520191990 /nfs/dbraw/zinc/19/19/90/520191990.db2.gz XAHRPXAMONRCED-LJQANCHMSA-N 1 1 363.433 2.956 20 5 FFBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594983762 520244469 /nfs/dbraw/zinc/24/44/69/520244469.db2.gz NKXZVMVEVSXOLJ-UHFFFAOYSA-N 1 1 358.398 2.657 20 5 FFBDMO CC1(C)[C@@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@@H]1[NH+]1CCOCC1 ZINC000603408392 520253296 /nfs/dbraw/zinc/25/32/96/520253296.db2.gz WZGXXCLGHILQDW-RYUDHWBXSA-N 1 1 363.443 2.511 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1Cc2ccccc2N(C)C1=O ZINC000595067899 520277276 /nfs/dbraw/zinc/27/72/76/520277276.db2.gz YYDDQYSTBPGWRL-WBMJQRKESA-N 1 1 355.394 2.842 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000597854661 520283985 /nfs/dbraw/zinc/28/39/85/520283985.db2.gz KYLOGXJOFKQLCH-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CCOc1cc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000597859019 520287339 /nfs/dbraw/zinc/28/73/39/520287339.db2.gz QAQXLZDICNFYBI-GFCCVEGCSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[NH+]1CCC(C)CC1 ZINC000603612361 520328404 /nfs/dbraw/zinc/32/84/04/520328404.db2.gz TYAVLMKCPHFDSY-KRWDZBQOSA-N 1 1 373.457 2.957 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCc1ccc(C)[nH+]c1N1CCCC1 ZINC000617353908 520449717 /nfs/dbraw/zinc/44/97/17/520449717.db2.gz KXYWBTRTUWTADG-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000598195841 520486087 /nfs/dbraw/zinc/48/60/87/520486087.db2.gz UJQLNCTVXARQPG-LJQANCHMSA-N 1 1 353.422 2.984 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595467031 520491321 /nfs/dbraw/zinc/49/13/21/520491321.db2.gz WZHCPFQSQPHATL-IBGZPJMESA-N 1 1 368.437 2.711 20 5 FFBDMO CC(C)(C)n1nnc(CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000595526507 520529703 /nfs/dbraw/zinc/52/97/03/520529703.db2.gz SRUVJHCDENZRAJ-OAHLLOKOSA-N 1 1 358.446 2.758 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341599 520564799 /nfs/dbraw/zinc/56/47/99/520564799.db2.gz DLQOANIIEYDNCN-AAEUAGOBSA-N 1 1 355.822 2.616 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](CO)Cc1ccccc1 ZINC000595593889 520578671 /nfs/dbraw/zinc/57/86/71/520578671.db2.gz BHYHGUUJHFSEDC-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](CO)Cc1ccccc1 ZINC000595593889 520578676 /nfs/dbraw/zinc/57/86/76/520578676.db2.gz BHYHGUUJHFSEDC-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO COCC[N@H+](Cc1ccc(C)cc1C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000604493421 520579110 /nfs/dbraw/zinc/57/91/10/520579110.db2.gz OWCYYCYWRCWCDK-UHFFFAOYSA-N 1 1 371.437 2.959 20 5 FFBDMO COCC[N@@H+](Cc1ccc(C)cc1C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000604493421 520579122 /nfs/dbraw/zinc/57/91/22/520579122.db2.gz OWCYYCYWRCWCDK-UHFFFAOYSA-N 1 1 371.437 2.959 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](CO)Cc1ccccc1 ZINC000595599574 520582935 /nfs/dbraw/zinc/58/29/35/520582935.db2.gz YTASPECUXZLEBE-SFHVURJKSA-N 1 1 371.437 2.767 20 5 FFBDMO Cc1cc(C)c(Cn2cc(Br)cc([N+](=O)[O-])c2=O)c(C)[nH+]1 ZINC000601080075 520628357 /nfs/dbraw/zinc/62/83/57/520628357.db2.gz HSTKDTAQUYDXJB-UHFFFAOYSA-N 1 1 352.188 2.888 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670797 520637448 /nfs/dbraw/zinc/63/74/48/520637448.db2.gz DLUZKWOKUDSBLL-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670797 520637456 /nfs/dbraw/zinc/63/74/56/520637456.db2.gz DLUZKWOKUDSBLL-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO CCO[C@@H]1C[C@@H](O)C12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601119432 520644964 /nfs/dbraw/zinc/64/49/64/520644964.db2.gz RRMYESFWHOPERH-QZTJIDSGSA-N 1 1 357.410 2.899 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601149295 520661792 /nfs/dbraw/zinc/66/17/92/520661792.db2.gz JSIYJXMYUIKZCC-JTQLQIEISA-N 1 1 368.315 2.648 20 5 FFBDMO Cn1nccc1[C@@H]1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601171172 520670130 /nfs/dbraw/zinc/67/01/30/520670130.db2.gz HGZGUWHGCYJHED-SGTLLEGYSA-N 1 1 353.382 2.631 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@]2(CO)CCCc3ccccc32)c1 ZINC000593028535 520692838 /nfs/dbraw/zinc/69/28/38/520692838.db2.gz JQDIDEJDDZPHSO-HXUWFJFHSA-N 1 1 370.405 2.695 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](n1cncn1)C(F)(F)F ZINC000601294699 520727719 /nfs/dbraw/zinc/72/77/19/520727719.db2.gz PUFREKSMDKGYDJ-NOZJJQNGSA-N 1 1 359.308 2.649 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581034 520749297 /nfs/dbraw/zinc/74/92/97/520749297.db2.gz ZHPOFMSOOYJRTK-IIAWOOMASA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581034 520749302 /nfs/dbraw/zinc/74/93/02/520749302.db2.gz ZHPOFMSOOYJRTK-IIAWOOMASA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581034 520749310 /nfs/dbraw/zinc/74/93/10/520749310.db2.gz ZHPOFMSOOYJRTK-IIAWOOMASA-N 1 1 374.441 2.810 20 5 FFBDMO CCOc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000593187405 520811131 /nfs/dbraw/zinc/81/11/31/520811131.db2.gz KCGOVPXLLHNWAQ-FRRDWIJNSA-N 1 1 365.430 2.555 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000593203361 520824264 /nfs/dbraw/zinc/82/42/64/520824264.db2.gz AJEGYZBJSDMINF-UHFFFAOYSA-N 1 1 373.457 2.703 20 5 FFBDMO COCC[N@@H+]1CCCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596077805 520899476 /nfs/dbraw/zinc/89/94/76/520899476.db2.gz QMRYRNZKIUWQHP-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO COCC[N@H+]1CCCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596077805 520899482 /nfs/dbraw/zinc/89/94/82/520899482.db2.gz QMRYRNZKIUWQHP-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593321312 520908600 /nfs/dbraw/zinc/90/86/00/520908600.db2.gz HZMOARVJLKMSDV-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593321312 520908603 /nfs/dbraw/zinc/90/86/03/520908603.db2.gz HZMOARVJLKMSDV-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599022569 520985613 /nfs/dbraw/zinc/98/56/13/520985613.db2.gz RKDWEOHRMZUMGB-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO COc1cc(C[N@@H+]2CCC23CCOCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000618318161 520995537 /nfs/dbraw/zinc/99/55/37/520995537.db2.gz GFFAADXNCZJUCM-UHFFFAOYSA-N 1 1 358.341 2.960 20 5 FFBDMO COc1cc(C[N@H+]2CCC23CCOCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000618318161 520995541 /nfs/dbraw/zinc/99/55/41/520995541.db2.gz GFFAADXNCZJUCM-UHFFFAOYSA-N 1 1 358.341 2.960 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(c2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596280723 521006388 /nfs/dbraw/zinc/00/63/88/521006388.db2.gz KIKCMEUSQHMXDT-UHFFFAOYSA-N 1 1 357.838 2.804 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000611181052 521026652 /nfs/dbraw/zinc/02/66/52/521026652.db2.gz CSIDOOWHSKQUKH-UHFFFAOYSA-N 1 1 364.465 2.724 20 5 FFBDMO CC[N@@H+](C[C@H]1CCOC1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000611205369 521036940 /nfs/dbraw/zinc/03/69/40/521036940.db2.gz YHHNUCXOBQGPBK-NWDGAFQWSA-N 1 1 355.822 2.934 20 5 FFBDMO O=C(NC1CC1)c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599165783 521065754 /nfs/dbraw/zinc/06/57/54/521065754.db2.gz SLAOALGYGAJYJY-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO O=[N+]([O-])c1cc2c(nc1N[C@@H]1C[C@@H]([NH+]3CCOCC3)C13CCC3)CCCC2 ZINC000596515715 521109036 /nfs/dbraw/zinc/10/90/36/521109036.db2.gz XBJNTXHOEMSMTO-QZTJIDSGSA-N 1 1 372.469 2.924 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350520 521115359 /nfs/dbraw/zinc/11/53/59/521115359.db2.gz PTCXACIVOZZPHX-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350520 521115363 /nfs/dbraw/zinc/11/53/63/521115363.db2.gz PTCXACIVOZZPHX-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cn1ncc2c1CC(C)(C)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000596597943 521156785 /nfs/dbraw/zinc/15/67/85/521156785.db2.gz GSMHZGLEGVFYCT-UHFFFAOYSA-N 1 1 371.441 2.741 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000593755226 521195327 /nfs/dbraw/zinc/19/53/27/521195327.db2.gz HYQDHIDHNZUHNK-UHFFFAOYSA-N 1 1 374.441 2.616 20 5 FFBDMO COc1ccc(C[N@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000599397186 521197738 /nfs/dbraw/zinc/19/77/38/521197738.db2.gz HLYRGFPJLJGJTH-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000599397186 521197743 /nfs/dbraw/zinc/19/77/43/521197743.db2.gz HLYRGFPJLJGJTH-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1ccc(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)cc1[N+](=O)[O-] ZINC000611582181 521236975 /nfs/dbraw/zinc/23/69/75/521236975.db2.gz FJFCZUXIUJZYCR-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO COCCC1CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000599506759 521265700 /nfs/dbraw/zinc/26/57/00/521265700.db2.gz HFBFIKOHGOMVTA-ZDUSSCGKSA-N 1 1 365.430 2.679 20 5 FFBDMO CC1(C)[C@H](c2ccc(F)cc2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599623940 521340138 /nfs/dbraw/zinc/34/01/38/521340138.db2.gz XEPDZYWLHDQZSA-SJORKVTESA-N 1 1 362.405 2.559 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599639699 521351074 /nfs/dbraw/zinc/35/10/74/521351074.db2.gz MZCJWPKRCFABJF-UVBSCNOISA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(=O)[nH]n1 ZINC000599640401 521352750 /nfs/dbraw/zinc/35/27/50/521352750.db2.gz DQKIIXBHYIJRDQ-MRXNPFEDSA-N 1 1 371.397 2.565 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000594049231 521372416 /nfs/dbraw/zinc/37/24/16/521372416.db2.gz PPKVABZOTCIYJV-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000594049231 521372427 /nfs/dbraw/zinc/37/24/27/521372427.db2.gz PPKVABZOTCIYJV-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCCC2)O1 ZINC000594057193 521377769 /nfs/dbraw/zinc/37/77/69/521377769.db2.gz ASZAZVITQIHWDQ-CVEARBPZSA-N 1 1 364.442 2.758 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CCC[N@@H+]1CCCO ZINC000602672044 521471999 /nfs/dbraw/zinc/47/19/99/521471999.db2.gz CPRYILCDMXJZOS-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCCN1CCCO ZINC000602672044 521472004 /nfs/dbraw/zinc/47/20/04/521472004.db2.gz CPRYILCDMXJZOS-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2C[N@H+](C)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000599820705 521491270 /nfs/dbraw/zinc/49/12/70/521491270.db2.gz MPDCCYRTRYFCDL-MSOLQXFVSA-N 1 1 353.422 2.865 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612121699 521494447 /nfs/dbraw/zinc/49/44/47/521494447.db2.gz LHDBLEULJFWQIL-UPJWGTAASA-N 1 1 362.348 2.997 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)n1 ZINC000602816381 521549876 /nfs/dbraw/zinc/54/98/76/521549876.db2.gz ILXQACFPIVQTST-HNNXBMFYSA-N 1 1 354.414 2.553 20 5 FFBDMO CCOC(=O)C1(COC)CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000619434360 521565684 /nfs/dbraw/zinc/56/56/84/521565684.db2.gz PDWNHTMVAIACFL-VURMDHGXSA-N 1 1 362.426 2.900 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000616055630 521612763 /nfs/dbraw/zinc/61/27/63/521612763.db2.gz FFDJJPHWHSHTTF-MRXNPFEDSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1Cl ZINC000619867058 521911264 /nfs/dbraw/zinc/91/12/64/521911264.db2.gz IEPNVXASXMWCGV-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1Cl ZINC000619867058 521911272 /nfs/dbraw/zinc/91/12/72/521911272.db2.gz IEPNVXASXMWCGV-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO Cc1nc(Cl)nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164725139 720333796 /nfs/dbraw/zinc/33/37/96/720333796.db2.gz LVLHYICCHOSDSM-KGLIPLIRSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726107 720334934 /nfs/dbraw/zinc/33/49/34/720334934.db2.gz PSUQZVGVXFCUDF-HZPDHXFCSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726107 720334936 /nfs/dbraw/zinc/33/49/36/720334936.db2.gz PSUQZVGVXFCUDF-HZPDHXFCSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc2[nH]ccc21 ZINC001164732951 720412593 /nfs/dbraw/zinc/41/25/93/720412593.db2.gz OWDBUASTGOEGRH-JKSUJKDBSA-N 1 1 364.409 2.719 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785875 721404952 /nfs/dbraw/zinc/40/49/52/721404952.db2.gz NLMOEDNZLMATAC-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164785875 721404955 /nfs/dbraw/zinc/40/49/55/721404955.db2.gz NLMOEDNZLMATAC-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153862095 728789978 /nfs/dbraw/zinc/78/99/78/728789978.db2.gz ZPYZQYGHFMFQEK-MRXNPFEDSA-N 1 1 366.893 2.850 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](Cc3nccs3)C1)OCCO2 ZINC000898071789 735309937 /nfs/dbraw/zinc/30/99/37/735309937.db2.gz SQAIOWXDKIQNKJ-LBPRGKRZSA-N 1 1 361.423 2.887 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2CN2CC[NH+](Cc3ccsc3)CC2)c1 ZINC000023856249 727848741 /nfs/dbraw/zinc/84/87/41/727848741.db2.gz WYUYXHISWGMPDF-UHFFFAOYSA-N 1 1 357.439 2.781 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H](SC)C1 ZINC000134583819 728731168 /nfs/dbraw/zinc/73/11/68/728731168.db2.gz QLXQHQJLIYJMGD-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H](SC)C1 ZINC000134583819 728731169 /nfs/dbraw/zinc/73/11/69/728731169.db2.gz QLXQHQJLIYJMGD-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCOCC1 ZINC000174440585 729072239 /nfs/dbraw/zinc/07/22/39/729072239.db2.gz YSLDKBNOJJJJQH-UHFFFAOYSA-N 1 1 356.806 2.792 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000856800069 730358508 /nfs/dbraw/zinc/35/85/08/730358508.db2.gz NVMKSNKNQVBFKK-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000858292937 730421918 /nfs/dbraw/zinc/42/19/18/730421918.db2.gz OHRYEJKXRUDVKH-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000859347823 730451180 /nfs/dbraw/zinc/45/11/80/730451180.db2.gz HIGAIMHUFNUUCQ-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000859347823 730451181 /nfs/dbraw/zinc/45/11/81/730451181.db2.gz HIGAIMHUFNUUCQ-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)ON=C(N)[C@H]1C[N@H+](C(C)C)CCO1 ZINC000779651037 738474794 /nfs/dbraw/zinc/47/47/94/738474794.db2.gz BTSWGFDUOHBACY-XJKSGUPXSA-N 1 1 350.419 2.572 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)ON=C(N)[C@H]1C[N@@H+](C(C)C)CCO1 ZINC000779651037 738474795 /nfs/dbraw/zinc/47/47/95/738474795.db2.gz BTSWGFDUOHBACY-XJKSGUPXSA-N 1 1 350.419 2.572 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000861374522 730606102 /nfs/dbraw/zinc/60/61/02/730606102.db2.gz VBVICJIYEDHHAE-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(C)s3)CC[NH2+]2)cc1 ZINC000870137220 731473716 /nfs/dbraw/zinc/47/37/16/731473716.db2.gz RWRJRNLHVOMMKX-CQSZACIVSA-N 1 1 361.423 2.760 20 5 FFBDMO Cc1nn(CCC(=O)O[C@@H](C)C[C@@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000870789667 731558210 /nfs/dbraw/zinc/55/82/10/731558210.db2.gz IVBKYGQYYIZNSY-WFASDCNBSA-N 1 1 352.435 2.604 20 5 FFBDMO CC(C)[C@H]1CN(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)CC[N@H+]1C ZINC000872737936 731823252 /nfs/dbraw/zinc/82/32/52/731823252.db2.gz XEOJTRWIYSUNBC-OAHLLOKOSA-N 1 1 351.838 2.827 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC2(CCSCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000877146845 732328447 /nfs/dbraw/zinc/32/84/47/732328447.db2.gz LEOAQFLPDJXGKR-KRWDZBQOSA-N 1 1 363.483 2.905 20 5 FFBDMO COC[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000879050577 732637100 /nfs/dbraw/zinc/63/71/00/732637100.db2.gz GQRCTQWZSRZAQZ-LLVKDONJSA-N 1 1 352.778 2.909 20 5 FFBDMO COC[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000879050577 732637103 /nfs/dbraw/zinc/63/71/03/732637103.db2.gz GQRCTQWZSRZAQZ-LLVKDONJSA-N 1 1 352.778 2.909 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(NS(C)(=O)=O)c1 ZINC000781915570 738672444 /nfs/dbraw/zinc/67/24/44/738672444.db2.gz DAROJCYGKJMFKL-LLVKDONJSA-N 1 1 367.402 2.956 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000885882495 733724842 /nfs/dbraw/zinc/72/48/42/733724842.db2.gz IMJRKOXSXRIFPK-AWEZNQCLSA-N 1 1 367.833 2.540 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C[C@]2(C)C1 ZINC000887920943 733993197 /nfs/dbraw/zinc/99/31/97/733993197.db2.gz LQXMZBKVAYDVQZ-DYVFJYSZSA-N 1 1 351.834 2.591 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000887931637 733994740 /nfs/dbraw/zinc/99/47/40/733994740.db2.gz BQJAZJJPRDBLNK-ABAIWWIYSA-N 1 1 357.332 2.637 20 5 FFBDMO CCOc1cc(NC(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000888834918 734103737 /nfs/dbraw/zinc/10/37/37/734103737.db2.gz WVKHUKQVPDHCDI-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](C3OCCO3)C2)c1Br ZINC000718980627 734377268 /nfs/dbraw/zinc/37/72/68/734377268.db2.gz QXRMJNVJUIDBSN-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095508 738822454 /nfs/dbraw/zinc/82/24/54/738822454.db2.gz KFHMFSBRIOOVSM-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095508 738822459 /nfs/dbraw/zinc/82/24/59/738822459.db2.gz KFHMFSBRIOOVSM-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000893601818 734725345 /nfs/dbraw/zinc/72/53/45/734725345.db2.gz JLIOJJYXIARYQW-LSDHHAIUSA-N 1 1 352.822 2.626 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000735471382 734947625 /nfs/dbraw/zinc/94/76/25/734947625.db2.gz MPALNIBIABVZPK-UHFFFAOYSA-N 1 1 350.806 2.927 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N[C@@H]1Cc2c[nH+]cn2C1 ZINC000894995989 734949698 /nfs/dbraw/zinc/94/96/98/734949698.db2.gz IEDLOVNEXUDGHX-SSDOTTSWSA-N 1 1 363.246 2.877 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000751913261 735933453 /nfs/dbraw/zinc/93/34/53/735933453.db2.gz FRMFMMQBRAICAP-UKRRQHHQSA-N 1 1 350.488 2.913 20 5 FFBDMO CO[C@]1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCSC1 ZINC000903315101 736074587 /nfs/dbraw/zinc/07/45/87/736074587.db2.gz SHMIEESRPDZKRN-RDJZCZTQSA-N 1 1 362.455 2.529 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[NH+](CC2CC2)CC1 ZINC000757702269 736420808 /nfs/dbraw/zinc/42/08/08/736420808.db2.gz KSCOLACFVXJNJF-UHFFFAOYSA-N 1 1 353.806 2.567 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000766557966 737241910 /nfs/dbraw/zinc/24/19/10/737241910.db2.gz XEXIGWVVAVIASH-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000913759902 737443876 /nfs/dbraw/zinc/44/38/76/737443876.db2.gz BXRJIGPGHPFKGE-BBRMVZONSA-N 1 1 351.834 2.733 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000769914408 737583891 /nfs/dbraw/zinc/58/38/91/737583891.db2.gz ZADDUJDXIURPOF-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000770690345 737653607 /nfs/dbraw/zinc/65/36/07/737653607.db2.gz VNBQGIVZXZAGFZ-GFCCVEGCSA-N 1 1 355.803 2.571 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000773917934 737945211 /nfs/dbraw/zinc/94/52/11/737945211.db2.gz AXWLQBFNNVEIHR-SJLPKXTDSA-N 1 1 350.415 2.539 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000773917936 737945277 /nfs/dbraw/zinc/94/52/77/737945277.db2.gz AXWLQBFNNVEIHR-WMZOPIPTSA-N 1 1 350.415 2.539 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@@H+]1CCc2sccc2C1 ZINC000921161562 737949437 /nfs/dbraw/zinc/94/94/37/737949437.db2.gz JIRMUAHCCXONBV-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@H+]1CCc2sccc2C1 ZINC000921161562 737949441 /nfs/dbraw/zinc/94/94/41/737949441.db2.gz JIRMUAHCCXONBV-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO CC(C)[C@@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385383 738134782 /nfs/dbraw/zinc/13/47/82/738134782.db2.gz ASZDZKJNAYTHMH-ZJPYXAASSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385383 738134785 /nfs/dbraw/zinc/13/47/85/738134785.db2.gz ASZDZKJNAYTHMH-ZJPYXAASSA-N 1 1 367.877 2.818 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776590750 738212257 /nfs/dbraw/zinc/21/22/57/738212257.db2.gz KGAMYCXIJCWFLW-WMLDXEAASA-N 1 1 350.415 2.684 20 5 FFBDMO C[C@@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)C1 ZINC000778231252 738365265 /nfs/dbraw/zinc/36/52/65/738365265.db2.gz FKQDNZCHWLLUPM-STQMWFEESA-N 1 1 355.385 2.923 20 5 FFBDMO C[C@@H](CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000778237136 738365638 /nfs/dbraw/zinc/36/56/38/738365638.db2.gz SWUMTKQWJZSJRH-QWRGUYRKSA-N 1 1 363.443 2.592 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000785468823 738966302 /nfs/dbraw/zinc/96/63/02/738966302.db2.gz NNOYIIAAWXAHNF-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000930318035 739086421 /nfs/dbraw/zinc/08/64/21/739086421.db2.gz ZPSUHYLPKYMRNA-UKRRQHHQSA-N 1 1 364.471 2.913 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)[C@H]2C1 ZINC000930767460 739159919 /nfs/dbraw/zinc/15/99/19/739159919.db2.gz GOKOQHWBMVSXDQ-RNCFNFMXSA-N 1 1 358.320 2.781 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477196 739248574 /nfs/dbraw/zinc/24/85/74/739248574.db2.gz VCPCLEALYNAYQH-IJEWVQPXSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477196 739248578 /nfs/dbraw/zinc/24/85/78/739248578.db2.gz VCPCLEALYNAYQH-IJEWVQPXSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)O1 ZINC000788477196 739248584 /nfs/dbraw/zinc/24/85/84/739248584.db2.gz VCPCLEALYNAYQH-IJEWVQPXSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931725544 739318962 /nfs/dbraw/zinc/31/89/62/739318962.db2.gz ZUNHPEZXHJRWBZ-BZPMIXESSA-N 1 1 366.849 2.744 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@@H](C(=O)OC(C)(C)C)[C@H](C3CC3)C2)c1[N+](=O)[O-] ZINC000931850226 739339633 /nfs/dbraw/zinc/33/96/33/739339633.db2.gz DOVUHYLPTNKIIW-QWHCGFSZSA-N 1 1 351.403 2.691 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@@H](C(=O)OC(C)(C)C)[C@H](C3CC3)C2)c1[N+](=O)[O-] ZINC000931850226 739339637 /nfs/dbraw/zinc/33/96/37/739339637.db2.gz DOVUHYLPTNKIIW-QWHCGFSZSA-N 1 1 351.403 2.691 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333008 739767204 /nfs/dbraw/zinc/76/72/04/739767204.db2.gz NJYQLGWHKORVNQ-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333008 739767208 /nfs/dbraw/zinc/76/72/08/739767208.db2.gz NJYQLGWHKORVNQ-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)N1CC(F)(F)F ZINC000934798233 739845912 /nfs/dbraw/zinc/84/59/12/739845912.db2.gz FOQAHCHYHIGSRS-BETUJISGSA-N 1 1 361.364 2.931 20 5 FFBDMO C[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)N1CC(F)(F)F ZINC000934798233 739845918 /nfs/dbraw/zinc/84/59/18/739845918.db2.gz FOQAHCHYHIGSRS-BETUJISGSA-N 1 1 361.364 2.931 20 5 FFBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804809215 740906634 /nfs/dbraw/zinc/90/66/34/740906634.db2.gz SCVQLIBBOYLZSN-WCQYABFASA-N 1 1 359.348 2.913 20 5 FFBDMO CC1(C)CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@H+]1CCO ZINC000809986035 741369855 /nfs/dbraw/zinc/36/98/55/741369855.db2.gz WPDFICVTEXYTJX-UHFFFAOYSA-N 1 1 362.257 2.790 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810617908 741432854 /nfs/dbraw/zinc/43/28/54/741432854.db2.gz JAVBLSZNAPDEPR-VIFPVBQESA-N 1 1 355.297 2.947 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCCOc2cccc([N+](=O)[O-])c2)C1 ZINC000811445908 741522718 /nfs/dbraw/zinc/52/27/18/741522718.db2.gz AVMGCCKQJGZOOQ-QGZVFWFLSA-N 1 1 354.378 2.729 20 5 FFBDMO CC(C)COCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174481 741685076 /nfs/dbraw/zinc/68/50/76/741685076.db2.gz UNRQDIVXCTVZKH-KRWDZBQOSA-N 1 1 350.415 2.775 20 5 FFBDMO CC(C)COCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174481 741685080 /nfs/dbraw/zinc/68/50/80/741685080.db2.gz UNRQDIVXCTVZKH-KRWDZBQOSA-N 1 1 350.415 2.775 20 5 FFBDMO C[C@H]1CC2(CN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC[NH2+]CC2 ZINC000818339930 742265020 /nfs/dbraw/zinc/26/50/20/742265020.db2.gz GFBBXEAJEPIENJ-LBPRGKRZSA-N 1 1 366.849 2.651 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)NCCC[N@H+](C)C(C)C ZINC000822487262 742741776 /nfs/dbraw/zinc/74/17/76/742741776.db2.gz NGSNHHLLGNAWIA-UHFFFAOYSA-N 1 1 370.837 2.667 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503876 742928525 /nfs/dbraw/zinc/92/85/25/742928525.db2.gz ZXLRLIPQCVBAEH-WMZOPIPTSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503876 742928529 /nfs/dbraw/zinc/92/85/29/742928529.db2.gz ZXLRLIPQCVBAEH-WMZOPIPTSA-N 1 1 350.415 2.682 20 5 FFBDMO CCCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@@H+](C)C1 ZINC000826677503 743421401 /nfs/dbraw/zinc/42/14/01/743421401.db2.gz MSDACGXUEPYNQS-AWEZNQCLSA-N 1 1 354.838 2.874 20 5 FFBDMO Cc1cc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001050325431 743510721 /nfs/dbraw/zinc/51/07/21/743510721.db2.gz CXALUYSFNYRFEV-MWQQHZPXSA-N 1 1 365.499 2.795 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000832142721 745644750 /nfs/dbraw/zinc/64/47/50/745644750.db2.gz YJWMCCCGOVVGEJ-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000832142721 745644753 /nfs/dbraw/zinc/64/47/53/745644753.db2.gz YJWMCCCGOVVGEJ-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO CCn1cc([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cn1 ZINC000832309175 745675194 /nfs/dbraw/zinc/67/51/94/745675194.db2.gz FRRZCBGFNZHCMS-SNVBAGLBSA-N 1 1 351.794 2.754 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@]2(CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000832347688 745681509 /nfs/dbraw/zinc/68/15/09/745681509.db2.gz AHMXFYZKECPNCY-QGZVFWFLSA-N 1 1 351.378 2.565 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H](CCCO)C1 ZINC000832784317 745754610 /nfs/dbraw/zinc/75/46/10/745754610.db2.gz YSZYNHSUOFWDHF-NWDGAFQWSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H](CCCO)C1 ZINC000832784317 745754611 /nfs/dbraw/zinc/75/46/11/745754611.db2.gz YSZYNHSUOFWDHF-NWDGAFQWSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)N[C@@H](C)C[N@H+](C)C(C)C ZINC000832870034 745765009 /nfs/dbraw/zinc/76/50/09/745765009.db2.gz CWRGWLMWCYZMGB-JTQLQIEISA-N 1 1 370.837 2.665 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000839106002 746775827 /nfs/dbraw/zinc/77/58/27/746775827.db2.gz ZGIAADXVXYTMFI-MAUKXSAKSA-N 1 1 350.415 2.682 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]2COCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502358 746841443 /nfs/dbraw/zinc/84/14/43/746841443.db2.gz HWBFEIVNZFLRTC-BXUZGUMPSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502358 746841448 /nfs/dbraw/zinc/84/14/48/746841448.db2.gz HWBFEIVNZFLRTC-BXUZGUMPSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]2COCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502361 746841472 /nfs/dbraw/zinc/84/14/72/746841472.db2.gz HWBFEIVNZFLRTC-SMDDNHRTSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502361 746841478 /nfs/dbraw/zinc/84/14/78/746841478.db2.gz HWBFEIVNZFLRTC-SMDDNHRTSA-N 1 1 353.806 2.688 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839530220 746848147 /nfs/dbraw/zinc/84/81/47/746848147.db2.gz OBODSHXUCJAUDL-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839530220 746848155 /nfs/dbraw/zinc/84/81/55/746848155.db2.gz OBODSHXUCJAUDL-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO Cc1ccccc1CC[N@@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000840101349 747002031 /nfs/dbraw/zinc/00/20/31/747002031.db2.gz IPMBWDSNQNTYFD-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO Cc1ccccc1CC[N@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000840101349 747002038 /nfs/dbraw/zinc/00/20/38/747002038.db2.gz IPMBWDSNQNTYFD-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO CCCCCCNC(=O)[C@@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000851741884 749658112 /nfs/dbraw/zinc/65/81/12/749658112.db2.gz OJBKDWPOHHXRQJ-CQSZACIVSA-N 1 1 352.435 2.800 20 5 FFBDMO CCCCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1 ZINC000851741884 749658114 /nfs/dbraw/zinc/65/81/14/749658114.db2.gz OJBKDWPOHHXRQJ-CQSZACIVSA-N 1 1 352.435 2.800 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)c2ccccc2N1 ZINC000759893493 971910764 /nfs/dbraw/zinc/91/07/64/971910764.db2.gz CSMDIYRRQPTEDZ-QGZVFWFLSA-N 1 1 366.421 2.670 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000134886706 960091061 /nfs/dbraw/zinc/09/10/61/960091061.db2.gz ZJZYVWCVHAPDSK-CZUORRHYSA-N 1 1 354.410 2.691 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(C3CCCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269411483 964131928 /nfs/dbraw/zinc/13/19/28/964131928.db2.gz JEXZEDFOYFWFNZ-QZTJIDSGSA-N 1 1 357.454 2.748 20 5 FFBDMO CC(C)(C)[C@@H]1CSCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001175699646 1013528226 /nfs/dbraw/zinc/52/82/26/1013528226.db2.gz VQGAOANGKGKOHR-INIZCTEOSA-N 1 1 363.483 2.947 20 5 FFBDMO CC(C)(C)[C@@H]1CSCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001175699646 1013528231 /nfs/dbraw/zinc/52/82/31/1013528231.db2.gz VQGAOANGKGKOHR-INIZCTEOSA-N 1 1 363.483 2.947 20 5 FFBDMO CN(C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCC[N@@H+](C)C1 ZINC000894477401 965405492 /nfs/dbraw/zinc/40/54/92/965405492.db2.gz PYFSUVKYHMQBHT-ZDUSSCGKSA-N 1 1 374.363 2.849 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)c2C(N)=O)C1 ZINC001175900100 1013586208 /nfs/dbraw/zinc/58/62/08/1013586208.db2.gz IJIQGARMZAFUSV-RMKNXTFCSA-N 1 1 358.423 2.826 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)c2C(N)=O)C1 ZINC001175900100 1013586216 /nfs/dbraw/zinc/58/62/16/1013586216.db2.gz IJIQGARMZAFUSV-RMKNXTFCSA-N 1 1 358.423 2.826 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134902440 965942651 /nfs/dbraw/zinc/94/26/51/965942651.db2.gz VMHXCINQZRTMNV-NVXWUHKLSA-N 1 1 372.469 2.790 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000065674489 968093792 /nfs/dbraw/zinc/09/37/92/968093792.db2.gz RMCCUNUMVXLOET-NWDGAFQWSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000708701188 968879055 /nfs/dbraw/zinc/87/90/55/968879055.db2.gz HHHJWDYSWRLAOF-GOEBONIOSA-N 1 1 368.437 2.675 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000874828467 1013910076 /nfs/dbraw/zinc/91/00/76/1013910076.db2.gz GZEHSYMZCCZGIV-IAGOWNOFSA-N 1 1 366.421 2.966 20 5 FFBDMO C[C@@H](CNC(=O)N1CC[C@@]2(C1)CCC[N@@H+](C)C2)c1ccccc1[N+](=O)[O-] ZINC000897059249 973205155 /nfs/dbraw/zinc/20/51/55/973205155.db2.gz BGQIRQMUGXXNFE-KXBFYZLASA-N 1 1 360.458 2.826 20 5 FFBDMO Cc1ncccc1OC[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000842173442 976715118 /nfs/dbraw/zinc/71/51/18/976715118.db2.gz PSEPUHRJAQKREQ-QZTJIDSGSA-N 1 1 357.410 2.875 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000899199348 977009631 /nfs/dbraw/zinc/00/96/31/977009631.db2.gz HDNQCHXQMVLBMW-JKSUJKDBSA-N 1 1 354.410 2.639 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)c(C)c1 ZINC000982279043 977376336 /nfs/dbraw/zinc/37/63/36/977376336.db2.gz ZVOPKEUZVDLWOF-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c(C)c1 ZINC000982279043 977376339 /nfs/dbraw/zinc/37/63/39/977376339.db2.gz ZVOPKEUZVDLWOF-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c(C)c1 ZINC000982279043 977376341 /nfs/dbraw/zinc/37/63/41/977376341.db2.gz ZVOPKEUZVDLWOF-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN(c3ccccc3F)CC2)c1 ZINC000796579780 1014403100 /nfs/dbraw/zinc/40/31/00/1014403100.db2.gz VTVCKJJHRIKUCU-IBGZPJMESA-N 1 1 359.401 2.980 20 5 FFBDMO C[C@@H](CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000174411332 977752678 /nfs/dbraw/zinc/75/26/78/977752678.db2.gz UPPFAQORXFNGKJ-AWEZNQCLSA-N 1 1 356.426 2.817 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1 ZINC001211759077 977830940 /nfs/dbraw/zinc/83/09/40/977830940.db2.gz UGKKRSYTIJPAOQ-MRXNPFEDSA-N 1 1 369.487 2.610 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000894178905 978116892 /nfs/dbraw/zinc/11/68/92/978116892.db2.gz QKWIEJTXOGTMFQ-UHFFFAOYSA-N 1 1 374.416 2.973 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@H]21 ZINC000878351590 1014997656 /nfs/dbraw/zinc/99/76/56/1014997656.db2.gz SIZLKAVLBYDZKN-GXFFZTMASA-N 1 1 370.356 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCOC[C@H]2C[C@H](O)c2ccccc2)cc1 ZINC000157922990 984704615 /nfs/dbraw/zinc/70/46/15/984704615.db2.gz FAAFPBCWOMPSSE-UXHICEINSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@H]2C[C@H](O)c2ccccc2)cc1 ZINC000157922990 984704624 /nfs/dbraw/zinc/70/46/24/984704624.db2.gz FAAFPBCWOMPSSE-UXHICEINSA-N 1 1 356.422 2.962 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000764941120 984815181 /nfs/dbraw/zinc/81/51/81/984815181.db2.gz MUPWFZSLUGLSFT-AWEZNQCLSA-N 1 1 364.402 2.733 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000173469371 985834909 /nfs/dbraw/zinc/83/49/09/985834909.db2.gz YANHQHYGMKZWPD-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000173469371 985834927 /nfs/dbraw/zinc/83/49/27/985834927.db2.gz YANHQHYGMKZWPD-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO C[C@@H]([N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C(C)(C)C ZINC000914568723 987792241 /nfs/dbraw/zinc/79/22/41/987792241.db2.gz OBAVCWCDIMWTDB-XIKOKIGWSA-N 1 1 362.430 2.686 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000762708529 988596398 /nfs/dbraw/zinc/59/63/98/988596398.db2.gz VQYQHNMSBAPMOY-UHFFFAOYSA-N 1 1 358.442 2.577 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3COc4ccccc4O3)CC2)cc1 ZINC000916146355 989749569 /nfs/dbraw/zinc/74/95/69/989749569.db2.gz CHNGPEXFJUIWNV-KRWDZBQOSA-N 1 1 355.394 2.557 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000126060027 990018951 /nfs/dbraw/zinc/01/89/51/990018951.db2.gz FLAAKCHYGSAAQC-QGZVFWFLSA-N 1 1 362.474 2.805 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[NH+](CCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000917081103 990125132 /nfs/dbraw/zinc/12/51/32/990125132.db2.gz YSLGRIBXCHNDBF-UHFFFAOYSA-N 1 1 364.446 2.950 20 5 FFBDMO Cc1cccc(CCC[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035704277 990528362 /nfs/dbraw/zinc/52/83/62/990528362.db2.gz JAEYYCODKFDOTQ-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373094094 990716161 /nfs/dbraw/zinc/71/61/61/990716161.db2.gz FFXQIIPFJBEYRY-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373094094 990716164 /nfs/dbraw/zinc/71/61/64/990716164.db2.gz FFXQIIPFJBEYRY-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000919763097 990725588 /nfs/dbraw/zinc/72/55/88/990725588.db2.gz QXXNIQWKMCUEAV-CZUORRHYSA-N 1 1 354.410 2.742 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1ccccc1C1CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001485250589 991877943 /nfs/dbraw/zinc/87/79/43/991877943.db2.gz KEWPLZKJLBUUDA-QZTJIDSGSA-N 1 1 359.470 2.803 20 5 FFBDMO Cc1cncc([C@@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000879749196 1015664544 /nfs/dbraw/zinc/66/45/44/1015664544.db2.gz UIVJIZHADFMKGF-HKUYNNGSSA-N 1 1 357.410 2.875 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008555 1015730802 /nfs/dbraw/zinc/73/08/02/1015730802.db2.gz FOYNLBVNAIGZKF-BBRMVZONSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008555 1015730807 /nfs/dbraw/zinc/73/08/07/1015730807.db2.gz FOYNLBVNAIGZKF-BBRMVZONSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1cc(C)cc([C@H](O)C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665351 993255892 /nfs/dbraw/zinc/25/58/92/993255892.db2.gz VCKYFGMYZQNWQK-FUHWJXTLSA-N 1 1 356.426 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1 ZINC000810052467 994678257 /nfs/dbraw/zinc/67/82/57/994678257.db2.gz ZJHXJMPPGANHTI-UYAOXDASSA-N 1 1 353.422 2.765 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810844090 994950597 /nfs/dbraw/zinc/95/05/97/994950597.db2.gz ZZGGYGNEJDKQIM-GJZGRUSLSA-N 1 1 356.382 2.564 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])O[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000810845907 994952047 /nfs/dbraw/zinc/95/20/47/994952047.db2.gz WBJPRYXIYDMPRV-HIFRSBDPSA-N 1 1 363.370 2.606 20 5 FFBDMO CC(C)(CCc1noc([C@@H]2CCC[N@@H+](Cc3cccnc3)C2)n1)[N+](=O)[O-] ZINC000812814021 995537861 /nfs/dbraw/zinc/53/78/61/995537861.db2.gz TWQCWRLZIDIBTM-OAHLLOKOSA-N 1 1 359.430 2.832 20 5 FFBDMO CC[C@H]1C[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173877 995633748 /nfs/dbraw/zinc/63/37/48/995633748.db2.gz LCKLJUSHWIALSG-NJAFHUGGSA-N 1 1 362.426 2.918 20 5 FFBDMO CC[C@H]1C[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173877 995633750 /nfs/dbraw/zinc/63/37/50/995633750.db2.gz LCKLJUSHWIALSG-NJAFHUGGSA-N 1 1 362.426 2.918 20 5 FFBDMO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171465 995633754 /nfs/dbraw/zinc/63/37/54/995633754.db2.gz LJLXEUPBNRLLBZ-ROUUACIJSA-N 1 1 361.442 2.587 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171465 995633756 /nfs/dbraw/zinc/63/37/56/995633756.db2.gz LJLXEUPBNRLLBZ-ROUUACIJSA-N 1 1 361.442 2.587 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccccc2C)C1 ZINC000825189205 997267725 /nfs/dbraw/zinc/26/77/25/997267725.db2.gz CFZWFRKRPFFYIH-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)c1 ZINC000845125122 998369049 /nfs/dbraw/zinc/36/90/49/998369049.db2.gz XZIJYZHSMTZMDQ-XQQFMLRXSA-N 1 1 364.398 2.686 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)[C@@H](C)[NH+]2CCCCCC2)c1 ZINC000845124371 998390030 /nfs/dbraw/zinc/39/00/30/998390030.db2.gz RXHJPLWVIWJSPJ-CYBMUJFWSA-N 1 1 364.398 2.689 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000845733624 998640353 /nfs/dbraw/zinc/64/03/53/998640353.db2.gz XOFGZQGIQSWABE-CQSZACIVSA-N 1 1 365.386 2.852 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000742155141 999762528 /nfs/dbraw/zinc/76/25/28/999762528.db2.gz PNTNHTMIXHSZSG-TYILLQQXSA-N 1 1 374.441 2.830 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000742412978 999772954 /nfs/dbraw/zinc/77/29/54/999772954.db2.gz RCYMQPMETBUGMJ-UHFFFAOYSA-N 1 1 363.374 2.701 20 5 FFBDMO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000743842069 999832953 /nfs/dbraw/zinc/83/29/53/999832953.db2.gz BDUHACPSAXDVKG-HNNXBMFYSA-N 1 1 372.347 2.693 20 5 FFBDMO CCC[N@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC(C)C ZINC000746145854 999951279 /nfs/dbraw/zinc/95/12/79/999951279.db2.gz SYDIUKBXOAPUMU-UHFFFAOYSA-N 1 1 362.474 2.611 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169010594 1000015226 /nfs/dbraw/zinc/01/52/26/1000015226.db2.gz DYFIVXHWNHDCMB-FPCVCCKLSA-N 1 1 353.463 2.906 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019812 1000017485 /nfs/dbraw/zinc/01/74/85/1000017485.db2.gz JSYGEFBUXICUAU-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019812 1000017486 /nfs/dbraw/zinc/01/74/86/1000017486.db2.gz JSYGEFBUXICUAU-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024548 1000017801 /nfs/dbraw/zinc/01/78/01/1000017801.db2.gz XAQVAYBZNGNWSS-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024548 1000017802 /nfs/dbraw/zinc/01/78/02/1000017802.db2.gz XAQVAYBZNGNWSS-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO O=C1Nc2ccccc2CN1[C@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169051374 1000019033 /nfs/dbraw/zinc/01/90/33/1000019033.db2.gz DNPVAYOLAKCQJJ-XIRDDKMYSA-N 1 1 358.442 2.944 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@@H](Nc2cccnc2[N+](=O)[O-])C1 ZINC001169519138 1000055936 /nfs/dbraw/zinc/05/59/36/1000055936.db2.gz MZRANCIAKAWZJJ-WBVHZDCISA-N 1 1 370.409 2.861 20 5 FFBDMO Cc1cc(N2CC[N@@H+](C)C[C@H]2CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000771238976 1001047811 /nfs/dbraw/zinc/04/78/11/1001047811.db2.gz PWGKSSQYTIAYLA-OAHLLOKOSA-N 1 1 364.446 2.548 20 5 FFBDMO Cc1cc(N2CC[N@H+](C)C[C@H]2CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000771238976 1001047819 /nfs/dbraw/zinc/04/78/19/1001047819.db2.gz PWGKSSQYTIAYLA-OAHLLOKOSA-N 1 1 364.446 2.548 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771880469 1001227773 /nfs/dbraw/zinc/22/77/73/1001227773.db2.gz ILHHYCAUDMUSTK-UHFFFAOYSA-N 1 1 358.398 2.947 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000787194068 1001674316 /nfs/dbraw/zinc/67/43/16/1001674316.db2.gz ZBLYWHSTDNQAPE-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000787194068 1001674318 /nfs/dbraw/zinc/67/43/18/1001674318.db2.gz ZBLYWHSTDNQAPE-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO Cc1c(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469141 1001807992 /nfs/dbraw/zinc/80/79/92/1001807992.db2.gz NTVGKWYEVUOQEJ-VQTJNVASSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1c(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469141 1001808005 /nfs/dbraw/zinc/80/80/05/1001808005.db2.gz NTVGKWYEVUOQEJ-VQTJNVASSA-N 1 1 369.465 2.876 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000774320262 1001861618 /nfs/dbraw/zinc/86/16/18/1001861618.db2.gz CMTIRBVZGAXJBR-CYBMUJFWSA-N 1 1 366.437 2.794 20 5 FFBDMO CC(C)[NH+]1CC(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000789924058 1002226136 /nfs/dbraw/zinc/22/61/36/1002226136.db2.gz QUIOFMCCBIMORN-UHFFFAOYSA-N 1 1 360.458 2.654 20 5 FFBDMO Cn1cc(C[C@H]2CC[N@H+](Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)cn1 ZINC000774637524 1002289041 /nfs/dbraw/zinc/28/90/41/1002289041.db2.gz NWLBGQALWXCOES-GFCCVEGCSA-N 1 1 374.832 2.854 20 5 FFBDMO Cn1cc(C[C@H]2CC[N@@H+](Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)cn1 ZINC000774637524 1002289047 /nfs/dbraw/zinc/28/90/47/1002289047.db2.gz NWLBGQALWXCOES-GFCCVEGCSA-N 1 1 374.832 2.854 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000791060780 1002566082 /nfs/dbraw/zinc/56/60/82/1002566082.db2.gz MTJXKMFKLVGGNM-OAHLLOKOSA-N 1 1 364.402 2.662 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC000791624117 1002748826 /nfs/dbraw/zinc/74/88/26/1002748826.db2.gz XVWJNIFWYZXCNS-SVFBPWRDSA-N 1 1 367.449 2.692 20 5 FFBDMO CC(C)(C)OC(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000774821031 1002809494 /nfs/dbraw/zinc/80/94/94/1002809494.db2.gz SYKAJQGFNACPTQ-UHFFFAOYSA-N 1 1 364.446 2.632 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1c(Cl)c(Cl)ccc1[N+](=O)[O-] ZINC001185403583 1002933295 /nfs/dbraw/zinc/93/32/95/1002933295.db2.gz JDMZLFJPMPRMLZ-UHFFFAOYSA-N 1 1 361.273 2.975 20 5 FFBDMO COC[C@H]1C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341358 1003129494 /nfs/dbraw/zinc/12/94/94/1003129494.db2.gz PLLFRUROHUVWSU-DZGCQCFKSA-N 1 1 374.441 2.514 20 5 FFBDMO COC[C@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341358 1003129507 /nfs/dbraw/zinc/12/95/07/1003129507.db2.gz PLLFRUROHUVWSU-DZGCQCFKSA-N 1 1 374.441 2.514 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](Oc3cnccn3)C2)c([N+](=O)[O-])c1 ZINC001170351241 1003137278 /nfs/dbraw/zinc/13/72/78/1003137278.db2.gz BQLDCTXCJDZQON-WMLDXEAASA-N 1 1 372.425 2.868 20 5 FFBDMO C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000792939749 1003227104 /nfs/dbraw/zinc/22/71/04/1003227104.db2.gz ICQBOUPVRCXVSL-SFHVURJKSA-N 1 1 370.409 2.862 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(c2[nH+]ccn2C)CC1 ZINC000793947268 1003541161 /nfs/dbraw/zinc/54/11/61/1003541161.db2.gz QACGWLLRHSMHIE-YPKPFQOOSA-N 1 1 369.425 2.517 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC001198157740 1004515053 /nfs/dbraw/zinc/51/50/53/1004515053.db2.gz TVHOXGWGDFOCSP-MRXNPFEDSA-N 1 1 373.413 2.503 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1Cc1ccnn1C ZINC001198821583 1004749401 /nfs/dbraw/zinc/74/94/01/1004749401.db2.gz UDDBKZSKBFJPBC-INIZCTEOSA-N 1 1 371.441 2.672 20 5 FFBDMO Cc1cn(C[N@@H+]2CCC[C@@H](C3CC3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000808229700 1004780177 /nfs/dbraw/zinc/78/01/77/1004780177.db2.gz BYHKMIGUXYRUDW-MRXNPFEDSA-N 1 1 356.426 2.935 20 5 FFBDMO Cc1cn(C[N@H+]2CCC[C@@H](C3CC3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000808229700 1004780181 /nfs/dbraw/zinc/78/01/81/1004780181.db2.gz BYHKMIGUXYRUDW-MRXNPFEDSA-N 1 1 356.426 2.935 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000808273056 1004794764 /nfs/dbraw/zinc/79/47/64/1004794764.db2.gz VWAHLBZLTBAVRK-TWGQIWQCSA-N 1 1 368.437 2.984 20 5 FFBDMO Cc1[nH+]c2cc3c(cc2n1C[C@@H](O)c1ccc([N+](=O)[O-])cc1)OCCO3 ZINC000776274048 1005339852 /nfs/dbraw/zinc/33/98/52/1005339852.db2.gz GEIHUTIRKHPQTE-MRXNPFEDSA-N 1 1 355.350 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)cc1 ZINC000776276454 1005343314 /nfs/dbraw/zinc/34/33/14/1005343314.db2.gz NDJBTNCZWHGJGC-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[N@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000776276454 1005343316 /nfs/dbraw/zinc/34/33/16/1005343316.db2.gz NDJBTNCZWHGJGC-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000776276454 1005343320 /nfs/dbraw/zinc/34/33/20/1005343320.db2.gz NDJBTNCZWHGJGC-FQEVSTJZSA-N 1 1 373.428 2.975 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000107894135 1005554365 /nfs/dbraw/zinc/55/43/65/1005554365.db2.gz MGKLOQDJGGBLPS-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(F)cc1Cl)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001490372165 1005700929 /nfs/dbraw/zinc/70/09/29/1005700929.db2.gz LWMSHTHFNUSMNA-GDBMZVCRSA-N 1 1 369.824 2.615 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCN(C[C@@H]2CCCO2)CC1 ZINC000850434492 1005815375 /nfs/dbraw/zinc/81/53/75/1005815375.db2.gz UKQYXDDELKCIGT-PBHICJAKSA-N 1 1 363.458 2.897 20 5 FFBDMO Cc1ccn([C@@H](C)CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000851035650 1005857904 /nfs/dbraw/zinc/85/79/04/1005857904.db2.gz UIRQAZRDEXKOIN-YJBOKZPZSA-N 1 1 372.425 2.869 20 5 FFBDMO Cc1ccn([C@@H](C)CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000851035650 1005857907 /nfs/dbraw/zinc/85/79/07/1005857907.db2.gz UIRQAZRDEXKOIN-YJBOKZPZSA-N 1 1 372.425 2.869 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000776582889 1005954573 /nfs/dbraw/zinc/95/45/73/1005954573.db2.gz CZPABNTVACQBQA-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000776582889 1005954575 /nfs/dbraw/zinc/95/45/75/1005954575.db2.gz CZPABNTVACQBQA-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000852514977 1006061759 /nfs/dbraw/zinc/06/17/59/1006061759.db2.gz NIYWCCYIXXLQLR-SFTDATJTSA-N 1 1 369.465 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1 ZINC000852520674 1006062537 /nfs/dbraw/zinc/06/25/37/1006062537.db2.gz MKZYNTKKABROQY-SXLOBPIMSA-N 1 1 356.422 2.726 20 5 FFBDMO COc1cc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c([N+](=O)[O-])cc1OC ZINC001187593675 1006148414 /nfs/dbraw/zinc/14/84/14/1006148414.db2.gz NNNVXHCWWTWFTK-FZMZJTMJSA-N 1 1 353.444 2.604 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CCC1CCCCCC1)CC2 ZINC001050517643 1017036625 /nfs/dbraw/zinc/03/66/25/1017036625.db2.gz YHTOGVOWHUDOOE-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=[N+]([O-])c1c(F)nccc1NCc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000882171578 1006311445 /nfs/dbraw/zinc/31/14/45/1006311445.db2.gz GISARMXKQCJVRD-HNNXBMFYSA-N 1 1 360.389 2.698 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC000111173683 1006337552 /nfs/dbraw/zinc/33/75/52/1006337552.db2.gz YLHHGMNGSSGZFU-UHFFFAOYSA-N 1 1 374.485 2.896 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccc([N+](=O)[O-])nc3)C2)O1 ZINC000882980383 1006584735 /nfs/dbraw/zinc/58/47/35/1006584735.db2.gz IGULZHSCFKCICZ-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815614490 1006710019 /nfs/dbraw/zinc/71/00/19/1006710019.db2.gz RSSYUCDWPLJLHQ-GFCCVEGCSA-N 1 1 357.414 2.890 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000776765912 1007035158 /nfs/dbraw/zinc/03/51/58/1007035158.db2.gz MNTPIRWTBALIBA-LJQANCHMSA-N 1 1 370.384 2.943 20 5 FFBDMO COCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000858767705 1008419650 /nfs/dbraw/zinc/41/96/50/1008419650.db2.gz DBPKAXXVBJUSPT-UHFFFAOYSA-N 1 1 357.410 2.542 20 5 FFBDMO COc1cccc([C@@H](O)C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)c1 ZINC000860134658 1008851879 /nfs/dbraw/zinc/85/18/79/1008851879.db2.gz YEXXZWZMMGSTBB-SFHVURJKSA-N 1 1 361.398 2.845 20 5 FFBDMO Cc1ccc(CCC[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001178463907 1008998258 /nfs/dbraw/zinc/99/82/58/1008998258.db2.gz MTJBUVMUFHXKJF-RTBURBONSA-N 1 1 361.486 2.859 20 5 FFBDMO C[C@@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402709 1009196314 /nfs/dbraw/zinc/19/63/14/1009196314.db2.gz HUIKLDGKUTWCDT-HNAYVOBHSA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@@H](CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402709 1009196322 /nfs/dbraw/zinc/19/63/22/1009196322.db2.gz HUIKLDGKUTWCDT-HNAYVOBHSA-N 1 1 368.437 2.874 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126475587 1009232355 /nfs/dbraw/zinc/23/23/55/1009232355.db2.gz ZVKWAYUNOHOWNL-SJKOYZFVSA-N 1 1 374.397 2.592 20 5 FFBDMO C[C@H]1[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823939081 1009287469 /nfs/dbraw/zinc/28/74/69/1009287469.db2.gz QUEZEVZAQKGBCF-SUMWQHHRSA-N 1 1 369.425 2.962 20 5 FFBDMO Cc1cc(CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000823938598 1009287603 /nfs/dbraw/zinc/28/76/03/1009287603.db2.gz JLOZFHCFTKGWBM-UHFFFAOYSA-N 1 1 370.413 2.802 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1ccc(Br)nc1)c1cccc([N+](=O)[O-])c1 ZINC001179352829 1009315946 /nfs/dbraw/zinc/31/59/46/1009315946.db2.gz IVXGHOYRAONTNT-HNNXBMFYSA-N 1 1 366.215 2.750 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000119385778 1010157679 /nfs/dbraw/zinc/15/76/79/1010157679.db2.gz KNOOFJRZXXHOIE-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@H+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C1 ZINC000794632682 1010448179 /nfs/dbraw/zinc/44/81/79/1010448179.db2.gz LAIIPAJATCPZIE-ZDUSSCGKSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C1 ZINC000794632682 1010448186 /nfs/dbraw/zinc/44/81/86/1010448186.db2.gz LAIIPAJATCPZIE-ZDUSSCGKSA-N 1 1 369.377 2.958 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN([C@H]2CCC[C@@H]2O)CC1 ZINC000866307112 1010973914 /nfs/dbraw/zinc/97/39/14/1010973914.db2.gz QYWXHECUQMJJTC-FMEYXAORSA-N 1 1 365.449 2.632 20 5 FFBDMO Cc1cn(C[N@H+](C)CCC2CCOCC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000121194669 1011040535 /nfs/dbraw/zinc/04/05/35/1011040535.db2.gz UWNQIFODFGTHIJ-UHFFFAOYSA-N 1 1 374.441 2.562 20 5 FFBDMO Cc1cn(C[N@@H+](C)CCC2CCOCC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000121194669 1011040540 /nfs/dbraw/zinc/04/05/40/1011040540.db2.gz UWNQIFODFGTHIJ-UHFFFAOYSA-N 1 1 374.441 2.562 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1c2ccccc2C[N@H+]1C ZINC000868079546 1011160885 /nfs/dbraw/zinc/16/08/85/1011160885.db2.gz FGNBURUBYDTEKN-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1c2ccccc2C[N@@H+]1C ZINC000868079546 1011160886 /nfs/dbraw/zinc/16/08/86/1011160886.db2.gz FGNBURUBYDTEKN-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000796170018 1011234807 /nfs/dbraw/zinc/23/48/07/1011234807.db2.gz DSINJSWFEJKYOH-MRXNPFEDSA-N 1 1 365.430 2.964 20 5 FFBDMO Cc1cc(CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000868440820 1011302627 /nfs/dbraw/zinc/30/26/27/1011302627.db2.gz LPKCJSRFWXQRGP-UHFFFAOYSA-N 1 1 372.400 2.896 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1)C1CC1 ZINC001172913967 1012096921 /nfs/dbraw/zinc/09/69/21/1012096921.db2.gz WNCDQNDWZDSJMW-QZTJIDSGSA-N 1 1 357.454 2.833 20 5 FFBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172911669 1012126041 /nfs/dbraw/zinc/12/60/41/1012126041.db2.gz UUKMKJCXNPSPBS-WMZOPIPTSA-N 1 1 374.437 2.686 20 5 FFBDMO CCN1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173010594 1012179203 /nfs/dbraw/zinc/17/92/03/1012179203.db2.gz VRVHIKKHAKJSDL-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO CC[N@@H+]1CCCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173010594 1012179211 /nfs/dbraw/zinc/17/92/11/1012179211.db2.gz VRVHIKKHAKJSDL-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO CC[N@H+]1CCCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173010594 1012179219 /nfs/dbraw/zinc/17/92/19/1012179219.db2.gz VRVHIKKHAKJSDL-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO CCOC(=O)CC[N@@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017654 1012188755 /nfs/dbraw/zinc/18/87/55/1012188755.db2.gz HZMVUMFLHNVZMN-UHFFFAOYSA-N 1 1 371.384 2.727 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@]34CCOC4)CC2)c(F)c1 ZINC001173017430 1012188868 /nfs/dbraw/zinc/18/88/68/1012188868.db2.gz DWFPVDDGIMWCGP-QGZVFWFLSA-N 1 1 353.369 2.707 20 5 FFBDMO CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018258 1012189620 /nfs/dbraw/zinc/18/96/20/1012189620.db2.gz QODBWLDIYVUDLI-OKILXGFUSA-N 1 1 366.412 2.620 20 5 FFBDMO CCOC(=O)[C@@]12CCO[C@@H]1CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173221866 1012352817 /nfs/dbraw/zinc/35/28/17/1012352817.db2.gz MYGPBFXLOAQLQF-LSBZLQRGSA-N 1 1 362.426 2.570 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2nccnc2Cl)CC1 ZINC001173221620 1012352865 /nfs/dbraw/zinc/35/28/65/1012352865.db2.gz KRQUNLXQTJZRRK-CYBMUJFWSA-N 1 1 361.833 2.791 20 5 FFBDMO Cc1noc(C[C@@H]2C[C@H]3C[N@H+]([C@@H](C)Cc4ccc([N+](=O)[O-])cc4)C[C@H]3O2)n1 ZINC001173222802 1012354040 /nfs/dbraw/zinc/35/40/40/1012354040.db2.gz CJBAHZNKCWEWPF-OYYDLILQSA-N 1 1 372.425 2.549 20 5 FFBDMO CCN(C)c1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173222382 1012355439 /nfs/dbraw/zinc/35/54/39/1012355439.db2.gz BDQOLHZKZKROFP-HNNXBMFYSA-N 1 1 369.469 2.873 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cnn(C)c21 ZINC001173224347 1012357647 /nfs/dbraw/zinc/35/76/47/1012357647.db2.gz JOYUKZMMMCRNJK-WMLDXEAASA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(C(=O)c3ccco3)C[C@H]2C1 ZINC001173226170 1012359931 /nfs/dbraw/zinc/35/99/31/1012359931.db2.gz LBQVVCULMUJDJX-BHYGNILZSA-N 1 1 369.421 2.823 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)c2ccccc2)CC1 ZINC001173229495 1012364749 /nfs/dbraw/zinc/36/47/49/1012364749.db2.gz VDYVBMXVTNXJRX-MRXNPFEDSA-N 1 1 353.422 2.984 20 5 FFBDMO CCC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCN1CCCC1 ZINC000796382179 1012530024 /nfs/dbraw/zinc/53/00/24/1012530024.db2.gz WXJYLFXMDNAJLR-UHFFFAOYSA-N 1 1 366.437 2.870 20 5 FFBDMO CCCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC[NH+]1CCCC1 ZINC000796382179 1012530036 /nfs/dbraw/zinc/53/00/36/1012530036.db2.gz WXJYLFXMDNAJLR-UHFFFAOYSA-N 1 1 366.437 2.870 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870905690 1012626077 /nfs/dbraw/zinc/62/60/77/1012626077.db2.gz BWARNVHEVVKUDY-VQTJNVASSA-N 1 1 369.421 2.543 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1 ZINC000748728674 1017579110 /nfs/dbraw/zinc/57/91/10/1017579110.db2.gz QVDRSMBQTWNHQK-CYBMUJFWSA-N 1 1 364.402 2.582 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)CC[C@H]21 ZINC000827364121 1017772210 /nfs/dbraw/zinc/77/22/10/1017772210.db2.gz FSVDXLMXTDJSLZ-CRAIPNDOSA-N 1 1 372.469 2.751 20 5 FFBDMO O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000827925801 1019003806 /nfs/dbraw/zinc/00/38/06/1019003806.db2.gz CQJPKRPYDXLBSR-QRVBRYPASA-N 1 1 367.405 2.577 20 5 FFBDMO O=[N+]([O-])c1cc(-c2cc(CC[NH+]3CCOCC3)on2)ccc1N1CCCC1 ZINC000901398762 1019045310 /nfs/dbraw/zinc/04/53/10/1019045310.db2.gz YWFPHSJPXDCUMG-UHFFFAOYSA-N 1 1 372.425 2.725 20 5 FFBDMO O=C1O[C@@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CC12CC2 ZINC000828817140 1032854104 /nfs/dbraw/zinc/85/41/04/1032854104.db2.gz LKJMKTGHMUKOHJ-BRWVUGGUSA-N 1 1 374.437 2.796 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000931057741 1020301323 /nfs/dbraw/zinc/30/13/23/1020301323.db2.gz QHZWMOFTVMAEDY-HNNXBMFYSA-N 1 1 362.430 2.586 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777952178 1020303924 /nfs/dbraw/zinc/30/39/24/1020303924.db2.gz YRMZERVJORJSEO-OAHLLOKOSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777952178 1020303927 /nfs/dbraw/zinc/30/39/27/1020303927.db2.gz YRMZERVJORJSEO-OAHLLOKOSA-N 1 1 358.398 2.691 20 5 FFBDMO CCN(CC)C(=O)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000726607109 1020492892 /nfs/dbraw/zinc/49/28/92/1020492892.db2.gz PKPZESSYPPNDQF-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO COc1cc([C@@H](C)NCc2ccnc(OCC[NH+](C)C)c2)cc([N+](=O)[O-])c1 ZINC000903131399 1020694031 /nfs/dbraw/zinc/69/40/31/1020694031.db2.gz RWIFCAQWQUUBBU-CQSZACIVSA-N 1 1 374.441 2.790 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H]2COC(=O)N2)CC1 ZINC000932780207 1020898931 /nfs/dbraw/zinc/89/89/31/1020898931.db2.gz SZQONVMKGQFQPD-INIZCTEOSA-N 1 1 363.414 2.702 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]([C@H]2CCCO2)C1 ZINC000933183227 1020974896 /nfs/dbraw/zinc/97/48/96/1020974896.db2.gz OCGPNSNNMJPLQT-KBRIMQKVSA-N 1 1 366.389 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]([C@H]2CCCO2)C1 ZINC000933183227 1020974900 /nfs/dbraw/zinc/97/49/00/1020974900.db2.gz OCGPNSNNMJPLQT-KBRIMQKVSA-N 1 1 366.389 2.667 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC000933738680 1021080640 /nfs/dbraw/zinc/08/06/40/1021080640.db2.gz LKNQLANIETUHMD-UVBSCNOISA-N 1 1 357.414 2.589 20 5 FFBDMO COc1ccccc1N1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000934178433 1021159066 /nfs/dbraw/zinc/15/90/66/1021159066.db2.gz ZQJHCBNLSBMEHH-LJQANCHMSA-N 1 1 371.437 2.849 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001116380605 1021187835 /nfs/dbraw/zinc/18/78/35/1021187835.db2.gz ONZBGCFZZDQQRZ-PKOBYXMFSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001116380605 1021187838 /nfs/dbraw/zinc/18/78/38/1021187838.db2.gz ONZBGCFZZDQQRZ-PKOBYXMFSA-N 1 1 373.384 2.674 20 5 FFBDMO C[NH+]1CCN(C(C)(C)CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC001116454698 1021226830 /nfs/dbraw/zinc/22/68/30/1021226830.db2.gz CQOPHPYYOPCUMC-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC001117726432 1021839090 /nfs/dbraw/zinc/83/90/90/1021839090.db2.gz DHUVMMAMPJVSRP-MQVJKMGUSA-N 1 1 369.425 2.633 20 5 FFBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1n[nH]cc1[N+](=O)[O-] ZINC001117726432 1021839105 /nfs/dbraw/zinc/83/91/05/1021839105.db2.gz DHUVMMAMPJVSRP-MQVJKMGUSA-N 1 1 369.425 2.633 20 5 FFBDMO O=C(NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1n[nH]cc1[N+](=O)[O-] ZINC001117726432 1021839122 /nfs/dbraw/zinc/83/91/22/1021839122.db2.gz DHUVMMAMPJVSRP-MQVJKMGUSA-N 1 1 369.425 2.633 20 5 FFBDMO CCC(C)(C)c1cc([N+](=O)[O-])c(O[C@@H]2CC[NH2+]CC(=O)C2)c([N+](=O)[O-])c1 ZINC001218193846 1033041339 /nfs/dbraw/zinc/04/13/39/1033041339.db2.gz ITTOWYJVQCJAJO-CYBMUJFWSA-N 1 1 365.386 2.891 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC(C(C)(C)C[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC001119572824 1022866980 /nfs/dbraw/zinc/86/69/80/1022866980.db2.gz PSUBDILRONOLNF-UHFFFAOYSA-N 1 1 365.478 2.881 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)[C@@H](C)C1 ZINC001121269081 1023681227 /nfs/dbraw/zinc/68/12/27/1023681227.db2.gz YPQFFFMNFYFPAS-NWDGAFQWSA-N 1 1 364.475 2.618 20 5 FFBDMO CCC[C@H]1CN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC001121296131 1023692882 /nfs/dbraw/zinc/69/28/82/1023692882.db2.gz GBJYUWLQWPIVII-WBVHZDCISA-N 1 1 372.473 2.644 20 5 FFBDMO Cc1cc(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cc([N+](=O)[O-])c1 ZINC001123360960 1023761749 /nfs/dbraw/zinc/76/17/49/1023761749.db2.gz STWADWSGAHOEBW-AWEZNQCLSA-N 1 1 362.430 2.620 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000757511885 1023825673 /nfs/dbraw/zinc/82/56/73/1023825673.db2.gz TVQXUWJHGBDUGR-IBWPDUFMSA-N 1 1 351.406 2.999 20 5 FFBDMO CCn1c(CCn2cc[nH+]c2C)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC001121770018 1023997532 /nfs/dbraw/zinc/99/75/32/1023997532.db2.gz YZEFAPLILCCAAB-UHFFFAOYSA-N 1 1 369.429 2.590 20 5 FFBDMO O=C(OCC[NH+]1CCSCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000838385097 1026339284 /nfs/dbraw/zinc/33/92/84/1026339284.db2.gz YTJOWCRDFQIHHZ-UHFFFAOYSA-N 1 1 373.434 2.862 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000840095689 1026955080 /nfs/dbraw/zinc/95/50/80/1026955080.db2.gz KJDRZOFHWJKYFD-KRWDZBQOSA-N 1 1 362.430 2.541 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000840095689 1026955088 /nfs/dbraw/zinc/95/50/88/1026955088.db2.gz KJDRZOFHWJKYFD-KRWDZBQOSA-N 1 1 362.430 2.541 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000795645622 1027392606 /nfs/dbraw/zinc/39/26/06/1027392606.db2.gz ULZRPPLEJLNVGY-UHFFFAOYSA-N 1 1 355.354 2.985 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccccc2C2CC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160106735 1027593880 /nfs/dbraw/zinc/59/38/80/1027593880.db2.gz AETRPLKYEFYBIB-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCCC1=CC[N@H+](Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106735 1027593889 /nfs/dbraw/zinc/59/38/89/1027593889.db2.gz AETRPLKYEFYBIB-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106735 1027593900 /nfs/dbraw/zinc/59/39/00/1027593900.db2.gz AETRPLKYEFYBIB-WOJBJXKFSA-N 1 1 369.465 2.868 20 5 FFBDMO Cc1nn(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1[N+](=O)[O-] ZINC000795710134 1027902281 /nfs/dbraw/zinc/90/22/81/1027902281.db2.gz KRMSYRJXDSGAMT-IBGZPJMESA-N 1 1 355.442 2.655 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](Cn1cnc(-c3ccc([N+](=O)[O-])cc3)n1)C2 ZINC000795719376 1027970705 /nfs/dbraw/zinc/97/07/05/1027970705.db2.gz CRJTXAICFALGPH-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@H]1CC[N@H+](Cc2cccc(Cl)c2)C1 ZINC001161182875 1028055388 /nfs/dbraw/zinc/05/53/88/1028055388.db2.gz XSHLMZIBAYFXJJ-HNNXBMFYSA-N 1 1 362.817 2.876 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@H]1CC[N@@H+](Cc2cccc(Cl)c2)C1 ZINC001161182875 1028055409 /nfs/dbraw/zinc/05/54/09/1028055409.db2.gz XSHLMZIBAYFXJJ-HNNXBMFYSA-N 1 1 362.817 2.876 20 5 FFBDMO C[NH+]1CCN(CCCNc2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC001161708758 1028290303 /nfs/dbraw/zinc/29/03/03/1028290303.db2.gz VGILDUCEXSJKEG-UHFFFAOYSA-N 1 1 362.352 2.543 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001161759282 1028306140 /nfs/dbraw/zinc/30/61/40/1028306140.db2.gz APVCXXBTNAHARE-CYBMUJFWSA-N 1 1 370.247 2.848 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)NCC[C@@H]2CC[NH2+]CC2(F)F)cnc1Cl ZINC001162808363 1028662937 /nfs/dbraw/zinc/66/29/37/1028662937.db2.gz QMQHJUOOPPSPEH-QMMMGPOBSA-N 1 1 370.734 2.917 20 5 FFBDMO CSc1nc(Cl)c([N+](=O)[O-])c(NCC[C@H]2CC[NH2+]CC2(F)F)n1 ZINC001162810849 1028664465 /nfs/dbraw/zinc/66/44/65/1028664465.db2.gz ODTRBDWUVKJLNN-SSDOTTSWSA-N 1 1 367.809 2.807 20 5 FFBDMO CC(C)Oc1nc(N[C@H](C[NH+]2CCOCC2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC001162879956 1028692753 /nfs/dbraw/zinc/69/27/53/1028692753.db2.gz HPJIVGLJVVNIOB-OAHLLOKOSA-N 1 1 366.462 2.936 20 5 FFBDMO COc1nc(N2CC[NH+](C[C@H](OC)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001155705253 1028860164 /nfs/dbraw/zinc/86/01/64/1028860164.db2.gz CIOKKERTZQBJOU-KRWDZBQOSA-N 1 1 372.425 2.508 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(N3CCC[N@@H+](Cc4ccncc4)CC3)nc21 ZINC001163826869 1029078041 /nfs/dbraw/zinc/07/80/41/1029078041.db2.gz MKUWXGBBPSIGGV-UHFFFAOYSA-N 1 1 352.398 2.578 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)ncnc2N1CCC[N@@H+](Cc2ccncc2)CC1 ZINC001163827830 1029080986 /nfs/dbraw/zinc/08/09/86/1029080986.db2.gz WCNBHBNWVHQOBU-UHFFFAOYSA-N 1 1 364.409 2.645 20 5 FFBDMO CC1(C)CCC(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001164494235 1029298231 /nfs/dbraw/zinc/29/82/31/1029298231.db2.gz ANCLEBMNTDXPSN-HZPDHXFCSA-N 1 1 351.491 2.744 20 5 FFBDMO C[N@@H+](C[C@@H]1CC=CCC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000784011337 1030414606 /nfs/dbraw/zinc/41/46/06/1030414606.db2.gz PNQAFAMAWFKVTE-KUHUBIRLSA-N 1 1 372.425 2.607 20 5 FFBDMO C/C(=C\C(=O)OC[C@@H]1C[N@@H+](CC(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000784870964 1030855430 /nfs/dbraw/zinc/85/54/30/1030855430.db2.gz JUGTWXMKMUZMFO-KAPURRDVSA-N 1 1 362.426 2.898 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000797518723 1031141589 /nfs/dbraw/zinc/14/15/89/1031141589.db2.gz JVESFNRJPXSNRX-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000797518723 1031141596 /nfs/dbraw/zinc/14/15/96/1031141596.db2.gz JVESFNRJPXSNRX-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000843475037 1031419756 /nfs/dbraw/zinc/41/97/56/1031419756.db2.gz WPAXNALIPHXOEH-MZEUMTGBSA-N 1 1 367.405 2.790 20 5 FFBDMO [NH3+][C@@H](CCc1ccc(O)cc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001205182301 1031579658 /nfs/dbraw/zinc/57/96/58/1031579658.db2.gz QGBOWBGQTGOLJB-LBPRGKRZSA-N 1 1 359.317 2.517 20 5 FFBDMO Cc1cc(C)cc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001115530932 1031789327 /nfs/dbraw/zinc/78/93/27/1031789327.db2.gz ZVSUVAQCXQGEFN-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)C2)cc1 ZINC001219452466 1033649537 /nfs/dbraw/zinc/64/95/37/1033649537.db2.gz OXIGGLIXGPEQTI-MRXNPFEDSA-N 1 1 369.425 2.881 20 5 FFBDMO N=C(NC(=O)[C@@H](N)Cc1c2ccccc2cc2ccccc21)SCC[NH3+] ZINC001220106194 1033985931 /nfs/dbraw/zinc/98/59/31/1033985931.db2.gz DYGYAVWOXHCPLC-SFHVURJKSA-N 1 1 366.490 2.606 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCO[C@H]2COCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001224779000 1034003606 /nfs/dbraw/zinc/00/36/06/1034003606.db2.gz PEYXCNWQFOIFEU-HXUWFJFHSA-N 1 1 372.421 2.891 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C12CCC2 ZINC000832208865 1034632101 /nfs/dbraw/zinc/63/21/01/1034632101.db2.gz DLDVAIHUFVGTLP-JKSUJKDBSA-N 1 1 365.405 2.952 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2c(C(=O)OC)cc(Br)cc2[N+](=O)[O-])C1 ZINC001226358057 1034649236 /nfs/dbraw/zinc/64/92/36/1034649236.db2.gz OJWDNCJUIXGAAJ-JTQLQIEISA-N 1 1 373.203 2.617 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)nc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001226364457 1034651534 /nfs/dbraw/zinc/65/15/34/1034651534.db2.gz MEZSZHCKYYSPTI-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)nc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001226364457 1034651542 /nfs/dbraw/zinc/65/15/42/1034651542.db2.gz MEZSZHCKYYSPTI-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO C[C@@H](Oc1ccc(C(=[NH2+])NO)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001229082429 1036489750 /nfs/dbraw/zinc/48/97/50/1036489750.db2.gz DZJVUKDGVOHMJY-MRVPVSSYSA-N 1 1 363.301 2.907 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001536567955 1070008743 /nfs/dbraw/zinc/00/87/43/1070008743.db2.gz MUMULDYDLUBSKX-ZDUSSCGKSA-N 1 1 370.247 2.846 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@@H+](Cc3ccc(Cl)cc3)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377877 1036640397 /nfs/dbraw/zinc/64/03/97/1036640397.db2.gz GGMIMGQTXBRYGL-ZDUSSCGKSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@H+](Cc3ccc(Cl)cc3)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377877 1036640405 /nfs/dbraw/zinc/64/04/05/1036640405.db2.gz GGMIMGQTXBRYGL-ZDUSSCGKSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1ccnc([N+](=O)[O-])c1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001233556889 1036680492 /nfs/dbraw/zinc/68/04/92/1036680492.db2.gz QKXFXPUFYPNJBO-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO Cc1ccc(N2CCC[C@H](Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)C2)[nH+]c1 ZINC001230231539 1037163281 /nfs/dbraw/zinc/16/32/81/1037163281.db2.gz MQPAREMTGPGGNY-LBPRGKRZSA-N 1 1 354.370 2.617 20 5 FFBDMO Cc1csc2nc(C)c(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)n12 ZINC001207128324 1037173625 /nfs/dbraw/zinc/17/36/25/1037173625.db2.gz CAJVOVGRMLGMIJ-KRWDZBQOSA-N 1 1 360.439 2.918 20 5 FFBDMO Cc1c(Br)c(O[C@@H]2CCc3[nH+]ccn3C2)ncc1[N+](=O)[O-] ZINC001231094888 1037467570 /nfs/dbraw/zinc/46/75/70/1037467570.db2.gz JNGLPEKYNDKEIM-SECBINFHSA-N 1 1 353.176 2.651 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001278907821 1038350915 /nfs/dbraw/zinc/35/09/15/1038350915.db2.gz JDDFFCXJOZFXOY-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)N(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001278907821 1038350927 /nfs/dbraw/zinc/35/09/27/1038350927.db2.gz JDDFFCXJOZFXOY-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001278907821 1038350939 /nfs/dbraw/zinc/35/09/39/1038350939.db2.gz JDDFFCXJOZFXOY-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H](CO)CC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256092907 1038377173 /nfs/dbraw/zinc/37/71/73/1038377173.db2.gz AYVRLHZUKFRARH-CABCVRRESA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCC(=O)[C@H](F)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093399 1038380071 /nfs/dbraw/zinc/38/00/71/1038380071.db2.gz KYNFJXNIECNRCI-OAHLLOKOSA-N 1 1 365.405 2.575 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)CCN3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001256100254 1038384081 /nfs/dbraw/zinc/38/40/81/1038384081.db2.gz CBXBKOBVNAGCLW-UHFFFAOYSA-N 1 1 362.474 2.600 20 5 FFBDMO COc1cc(N2CCC(N(C)CC[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001256100254 1038384096 /nfs/dbraw/zinc/38/40/96/1038384096.db2.gz CBXBKOBVNAGCLW-UHFFFAOYSA-N 1 1 362.474 2.600 20 5 FFBDMO CC1([NH+]2CCC2)CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC001537181714 1070138943 /nfs/dbraw/zinc/13/89/43/1070138943.db2.gz VLTHLFTWLNJCOP-UHFFFAOYSA-N 1 1 357.414 2.608 20 5 FFBDMO C[C@H](c1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013862 1039113014 /nfs/dbraw/zinc/11/30/14/1039113014.db2.gz ZCNRFNPRWDITMY-MJBXVCDLSA-N 1 1 360.414 2.781 20 5 FFBDMO C[C@H](c1nnc(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013862 1039113018 /nfs/dbraw/zinc/11/30/18/1039113018.db2.gz ZCNRFNPRWDITMY-MJBXVCDLSA-N 1 1 360.414 2.781 20 5 FFBDMO Cc1nc(N2C[C@H](C)O[C@@H](C)C2)cc(Nc2ccc(N)c([N+](=O)[O-])c2)[nH+]1 ZINC001209933758 1039294552 /nfs/dbraw/zinc/29/45/52/1039294552.db2.gz CBBCVLUCBHCDLW-QWRGUYRKSA-N 1 1 358.402 2.633 20 5 FFBDMO NC[C@]1(F)CCCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580951 1039403360 /nfs/dbraw/zinc/40/33/60/1039403360.db2.gz ONNHHEDISNWTOC-GOSISDBHSA-N 1 1 350.438 2.717 20 5 FFBDMO [NH3+]C[C@]1(F)CCCCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580951 1039403364 /nfs/dbraw/zinc/40/33/64/1039403364.db2.gz ONNHHEDISNWTOC-GOSISDBHSA-N 1 1 350.438 2.717 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001246898291 1039524625 /nfs/dbraw/zinc/52/46/25/1039524625.db2.gz YIVGWNOLHRKMLZ-BBWFWOEESA-N 1 1 357.571 2.798 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001246898291 1039524642 /nfs/dbraw/zinc/52/46/42/1039524642.db2.gz YIVGWNOLHRKMLZ-BBWFWOEESA-N 1 1 357.571 2.798 20 5 FFBDMO [NH3+][C@@H](Cc1c[nH]c2ccccc12)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247096231 1039605793 /nfs/dbraw/zinc/60/57/93/1039605793.db2.gz SSQMHBQDCVEFMD-LBPRGKRZSA-N 1 1 368.328 2.903 20 5 FFBDMO [NH3+][C@@H](Cc1c[nH]cn1)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247103541 1039609457 /nfs/dbraw/zinc/60/94/57/1039609457.db2.gz YCAUOGYCLMYADO-AWEZNQCLSA-N 1 1 357.377 2.799 20 5 FFBDMO COc1ccc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c(OC)c1 ZINC001248208871 1040172062 /nfs/dbraw/zinc/17/20/62/1040172062.db2.gz NCTRHRWMMKRXNE-OAHLLOKOSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH+]3CCN(CC(F)(F)F)CC3)CC2)cc1 ZINC001254479543 1040744455 /nfs/dbraw/zinc/74/44/55/1040744455.db2.gz DYEBZHGVCABEEE-UHFFFAOYSA-N 1 1 372.391 2.744 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC001254479691 1040744649 /nfs/dbraw/zinc/74/46/49/1040744649.db2.gz HWLIDPOPHJSTBW-KBXCAEBGSA-N 1 1 361.442 2.837 20 5 FFBDMO O=C1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCN1C1CCCC1 ZINC001254479236 1040745847 /nfs/dbraw/zinc/74/58/47/1040745847.db2.gz UHDCKKAIKOZBNE-UHFFFAOYSA-N 1 1 372.469 2.650 20 5 FFBDMO O=C1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCN1C1CCCC1 ZINC001254479236 1040745859 /nfs/dbraw/zinc/74/58/59/1040745859.db2.gz UHDCKKAIKOZBNE-UHFFFAOYSA-N 1 1 372.469 2.650 20 5 FFBDMO CC(=O)N1CC[C@@H]([N@H+](C(C)C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254481129 1040746868 /nfs/dbraw/zinc/74/68/68/1040746868.db2.gz TYHTZIZBAMVOPF-HXUWFJFHSA-N 1 1 374.485 2.895 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC[C@H]21 ZINC001254481306 1040748185 /nfs/dbraw/zinc/74/81/85/1040748185.db2.gz AQQZMDUUFJKLLF-DNVCBOLYSA-N 1 1 372.469 2.506 20 5 FFBDMO O=C(c1ccco1)N1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254604029 1040832430 /nfs/dbraw/zinc/83/24/30/1040832430.db2.gz STKCTPBBEDHEHR-KRWDZBQOSA-N 1 1 355.394 2.503 20 5 FFBDMO COC(=O)Cc1ccc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC001261261262 1041108883 /nfs/dbraw/zinc/10/88/83/1041108883.db2.gz OCVHACXNFNGMJI-HNNXBMFYSA-N 1 1 372.425 2.503 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001538310379 1070402672 /nfs/dbraw/zinc/40/26/72/1070402672.db2.gz WDSKPUXHGAXDSP-ZDUSSCGKSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001538310379 1070402676 /nfs/dbraw/zinc/40/26/76/1070402676.db2.gz WDSKPUXHGAXDSP-ZDUSSCGKSA-N 1 1 371.384 2.999 20 5 FFBDMO Cc1ccc(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC001310095969 1043634645 /nfs/dbraw/zinc/63/46/45/1043634645.db2.gz CVOXGVHXVHWZLH-UKRRQHHQSA-N 1 1 350.444 2.605 20 5 FFBDMO CC[N@H+]1CC[C@H](Cn2c(C)nnc2N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC001313883910 1044436916 /nfs/dbraw/zinc/43/69/16/1044436916.db2.gz LENHOZJULMPVPT-INIZCTEOSA-N 1 1 372.473 2.515 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001319335426 1045113899 /nfs/dbraw/zinc/11/38/99/1045113899.db2.gz CYJIAMOYOBEYEO-HNNXBMFYSA-N 1 1 360.458 2.988 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001319574567 1045200720 /nfs/dbraw/zinc/20/07/20/1045200720.db2.gz ZUYHLWHXKXHYIN-QZTJIDSGSA-N 1 1 372.400 2.979 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703778 1045245639 /nfs/dbraw/zinc/24/56/39/1045245639.db2.gz DCYIXODJUVTEPJ-MAUKXSAKSA-N 1 1 372.400 2.800 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703778 1045245649 /nfs/dbraw/zinc/24/56/49/1045245649.db2.gz DCYIXODJUVTEPJ-MAUKXSAKSA-N 1 1 372.400 2.800 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC2)cc1 ZINC001325759403 1046631444 /nfs/dbraw/zinc/63/14/44/1046631444.db2.gz RWLLIHOUJLKBSL-UHFFFAOYSA-N 1 1 368.437 2.714 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCCC3(CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC001327090259 1047185524 /nfs/dbraw/zinc/18/55/24/1047185524.db2.gz RWAANMYUPCXQRU-HNNXBMFYSA-N 1 1 360.458 2.696 20 5 FFBDMO O=[N+]([O-])c1cccc(CSCC[NH+]2CCOCC2)c1Br ZINC001328633472 1048387707 /nfs/dbraw/zinc/38/77/07/1048387707.db2.gz DZDJVQHZNYWSPN-UHFFFAOYSA-N 1 1 361.261 2.923 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC001307196501 1049945186 /nfs/dbraw/zinc/94/51/86/1049945186.db2.gz UQKOPEWRENLVEF-UHFFFAOYSA-N 1 1 356.854 2.970 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC001340122182 1050526782 /nfs/dbraw/zinc/52/67/82/1050526782.db2.gz BUULGHBMAQLQTJ-ZDUSSCGKSA-N 1 1 373.461 2.553 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C)C[C@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC001302849473 1051212982 /nfs/dbraw/zinc/21/29/82/1051212982.db2.gz NQMCJFMCWSAZLM-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)C[C@H]2CCCC[N@@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC001302849473 1051212993 /nfs/dbraw/zinc/21/29/93/1051212993.db2.gz NQMCJFMCWSAZLM-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)C[C@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC001302849473 1051213009 /nfs/dbraw/zinc/21/30/09/1051213009.db2.gz NQMCJFMCWSAZLM-MRXNPFEDSA-N 1 1 371.441 2.753 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3nccc4c3CCCC4)CC2)cn1 ZINC001342831450 1051440155 /nfs/dbraw/zinc/44/01/55/1051440155.db2.gz VGGKSRCXUSMDJT-UHFFFAOYSA-N 1 1 353.426 2.586 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001341133149 1051482070 /nfs/dbraw/zinc/48/20/70/1051482070.db2.gz LHSWBSNSARIFOE-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001341133149 1051482077 /nfs/dbraw/zinc/48/20/77/1051482077.db2.gz LHSWBSNSARIFOE-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1Cc2cccnc2C1 ZINC001345006775 1052194745 /nfs/dbraw/zinc/19/47/45/1052194745.db2.gz MKBZZWAWDKPJJP-WMZOPIPTSA-N 1 1 367.405 2.522 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1Cc2cccnc2C1 ZINC001345006775 1052194749 /nfs/dbraw/zinc/19/47/49/1052194749.db2.gz MKBZZWAWDKPJJP-WMZOPIPTSA-N 1 1 367.405 2.522 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC001306887638 1052212295 /nfs/dbraw/zinc/21/22/95/1052212295.db2.gz KYIHFOWNPKIJDJ-LJQANCHMSA-N 1 1 374.485 2.997 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@@H]1C ZINC001307151613 1052258915 /nfs/dbraw/zinc/25/89/15/1052258915.db2.gz UKFJLRQKKMREMU-BETUJISGSA-N 1 1 362.405 2.828 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC2CC2)CC1 ZINC001345163785 1052298425 /nfs/dbraw/zinc/29/84/25/1052298425.db2.gz ZXTUSXILKJOAKN-CQSZACIVSA-N 1 1 364.494 2.582 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@@H]3COC4(CCCCC4)O3)C2)nc1 ZINC001307544203 1052319508 /nfs/dbraw/zinc/31/95/08/1052319508.db2.gz DPRQZOCNYYDXKJ-GOEBONIOSA-N 1 1 362.430 2.552 20 5 FFBDMO C[C@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001308039587 1052389935 /nfs/dbraw/zinc/38/99/35/1052389935.db2.gz GYAIJBWHDJGRQC-INIZCTEOSA-N 1 1 356.426 2.969 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C2CCCC2)[C@@H](C)C1 ZINC001308080244 1052401323 /nfs/dbraw/zinc/40/13/23/1052401323.db2.gz VNXYWYLCQVJJQW-HNNXBMFYSA-N 1 1 360.458 2.790 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC001308578993 1052471717 /nfs/dbraw/zinc/47/17/17/1052471717.db2.gz WHFCELZBXKQCNS-OAHLLOKOSA-N 1 1 373.375 2.910 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])s1 ZINC001309015619 1052539382 /nfs/dbraw/zinc/53/93/82/1052539382.db2.gz CYGKFYPXRRDKIV-NSHDSACASA-N 1 1 361.489 2.508 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001335442048 1053366789 /nfs/dbraw/zinc/36/67/89/1053366789.db2.gz VTHHSUALZFKUSH-DLBZAZTESA-N 1 1 355.442 2.819 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc(C)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336024904 1053714718 /nfs/dbraw/zinc/71/47/18/1053714718.db2.gz MLJMCRWJQXNFPC-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC001336560211 1054062630 /nfs/dbraw/zinc/06/26/30/1054062630.db2.gz FBULVXIDCIYTAW-GUYCJALGSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348234062 1054563369 /nfs/dbraw/zinc/56/33/69/1054563369.db2.gz HXBKELQCFZILDD-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348234062 1054563378 /nfs/dbraw/zinc/56/33/78/1054563378.db2.gz HXBKELQCFZILDD-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@H]2C1 ZINC001337835850 1055047713 /nfs/dbraw/zinc/04/77/13/1055047713.db2.gz XZJJFULYVSVQCC-DUFXMDAXSA-N 1 1 357.332 2.684 20 5 FFBDMO O=C([C@H]1CC[N@@H+](Cc2ccccc2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001349788170 1055468393 /nfs/dbraw/zinc/46/83/93/1055468393.db2.gz WMLULGUHIBRDGI-KRWDZBQOSA-N 1 1 351.406 2.959 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC001350441697 1055776295 /nfs/dbraw/zinc/77/62/95/1055776295.db2.gz UIFQGJLYBURZJF-OAHLLOKOSA-N 1 1 360.458 2.975 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]2[C@@H](C1)C2(F)F ZINC001473295219 1055975224 /nfs/dbraw/zinc/97/52/24/1055975224.db2.gz YAPFNCVYZDGQNT-NWDGAFQWSA-N 1 1 355.341 2.519 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC001339317275 1056323659 /nfs/dbraw/zinc/32/36/59/1056323659.db2.gz MFLUBWLKUGMFDL-NJZAAPMLSA-N 1 1 351.834 2.637 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001473432310 1056384335 /nfs/dbraw/zinc/38/43/35/1056384335.db2.gz IZPKNQAPOHPLPU-CYBMUJFWSA-N 1 1 368.397 2.758 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2cnn(C)c2)C1 ZINC000849483057 1056869803 /nfs/dbraw/zinc/86/98/03/1056869803.db2.gz VJAQJTAPKCBPTD-ROUUACIJSA-N 1 1 371.441 2.781 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001453319505 1059357708 /nfs/dbraw/zinc/35/77/08/1059357708.db2.gz GZOZEGKECFDRLD-MRVPVSSYSA-N 1 1 358.801 2.572 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cc(C)n3)C2)c1 ZINC001454307807 1059494633 /nfs/dbraw/zinc/49/46/33/1059494633.db2.gz CZWVEAGFQDIWFI-INIZCTEOSA-N 1 1 354.410 2.611 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001455007860 1059669555 /nfs/dbraw/zinc/66/95/55/1059669555.db2.gz DQKRHNYIDWQFAP-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848478207 1060100756 /nfs/dbraw/zinc/10/07/56/1060100756.db2.gz HZLGMKPALQLLIW-MRXNPFEDSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848478207 1060100767 /nfs/dbraw/zinc/10/07/67/1060100767.db2.gz HZLGMKPALQLLIW-MRXNPFEDSA-N 1 1 369.425 2.503 20 5 FFBDMO Cn1cc(C[C@@H]2CC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)cn1 ZINC000848480691 1060114753 /nfs/dbraw/zinc/11/47/53/1060114753.db2.gz QNWLHJFTIQYUAE-HNNXBMFYSA-N 1 1 366.425 2.714 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000848481750 1060117142 /nfs/dbraw/zinc/11/71/42/1060117142.db2.gz CQRJQHWOQYASOZ-MJGOQNOKSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000848481636 1060118980 /nfs/dbraw/zinc/11/89/80/1060118980.db2.gz BBVNPTUNUFXBNZ-AOIWGVFYSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000848490365 1060146430 /nfs/dbraw/zinc/14/64/30/1060146430.db2.gz ZZLOHHNZLUQQRG-WDSOQIARSA-N 1 1 373.453 2.759 20 5 FFBDMO Cc1[nH+]ccn1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001511619439 1060365340 /nfs/dbraw/zinc/36/53/40/1060365340.db2.gz PIXSBSPPIOEYCW-UHFFFAOYSA-N 1 1 367.413 2.657 20 5 FFBDMO CCC[N@H+]1CC[C@@H](Nc2cc(CC)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001458503188 1060607510 /nfs/dbraw/zinc/60/75/10/1060607510.db2.gz DFMDAZAFZWIJNO-MRXNPFEDSA-N 1 1 355.442 2.932 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](CCO)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001459786858 1060818362 /nfs/dbraw/zinc/81/83/62/1060818362.db2.gz ZQTWBOUYGOKRKP-OAHLLOKOSA-N 1 1 357.410 2.979 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001464548259 1062677797 /nfs/dbraw/zinc/67/77/97/1062677797.db2.gz XGNJHEXSMJHPAH-LLVKDONJSA-N 1 1 354.838 2.681 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c(C)c(C)ccc3[N+](=O)[O-])CC2)c1 ZINC001532802478 1063177132 /nfs/dbraw/zinc/17/71/32/1063177132.db2.gz OCUUYHMSHZIEIP-UHFFFAOYSA-N 1 1 354.410 2.877 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001465900088 1063256708 /nfs/dbraw/zinc/25/67/08/1063256708.db2.gz NFOFCXZTVPPUMS-MEDUHNTESA-N 1 1 354.410 2.543 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC1(C)C ZINC001466376490 1063414997 /nfs/dbraw/zinc/41/49/97/1063414997.db2.gz NFDVBPAAMMAMLT-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCc2sccc2C1 ZINC001442252222 1063514125 /nfs/dbraw/zinc/51/41/25/1063514125.db2.gz OUEBFLLBGKXAMO-UHFFFAOYSA-N 1 1 363.414 2.892 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCc2sccc2C1 ZINC001442252222 1063514143 /nfs/dbraw/zinc/51/41/43/1063514143.db2.gz OUEBFLLBGKXAMO-UHFFFAOYSA-N 1 1 363.414 2.892 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCC[N@H+]1CCO ZINC001466686086 1063520996 /nfs/dbraw/zinc/52/09/96/1063520996.db2.gz CUHHAHJEKWZHLV-LBPRGKRZSA-N 1 1 370.837 2.525 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001467570743 1063786529 /nfs/dbraw/zinc/78/65/29/1063786529.db2.gz QOIJWKFXPVXJDU-UONOGXRCSA-N 1 1 359.430 2.839 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC001468486817 1063995144 /nfs/dbraw/zinc/99/51/44/1063995144.db2.gz NERMJIYLYLOVEA-UHFFFAOYSA-N 1 1 371.328 2.901 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC001470176732 1064269294 /nfs/dbraw/zinc/26/92/94/1064269294.db2.gz HTPWIOCTIVUMMM-CYBMUJFWSA-N 1 1 366.849 2.967 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001472648880 1065120748 /nfs/dbraw/zinc/12/07/48/1065120748.db2.gz OGOBGBXGQMATJX-CQSZACIVSA-N 1 1 360.389 2.583 20 5 FFBDMO COCC[N@@H+]1CCC[C@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001472811055 1065149324 /nfs/dbraw/zinc/14/93/24/1065149324.db2.gz HUOHBZUPRZIGIE-NSHDSACASA-N 1 1 358.236 2.880 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001472811055 1065149327 /nfs/dbraw/zinc/14/93/27/1065149327.db2.gz HUOHBZUPRZIGIE-NSHDSACASA-N 1 1 358.236 2.880 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCOc3ccc4c(c3)OCO4)CC2)c1 ZINC001473106479 1065200966 /nfs/dbraw/zinc/20/09/66/1065200966.db2.gz WDDUBMKGTQCNSM-UHFFFAOYSA-N 1 1 371.393 2.525 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCS(=O)CC1 ZINC001473227687 1065225737 /nfs/dbraw/zinc/22/57/37/1065225737.db2.gz LFLWKIWJBQTFSB-UHFFFAOYSA-N 1 1 350.362 2.957 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCS(=O)CC1 ZINC001473227687 1065225745 /nfs/dbraw/zinc/22/57/45/1065225745.db2.gz LFLWKIWJBQTFSB-UHFFFAOYSA-N 1 1 350.362 2.957 20 5 FFBDMO C[C@@]([NH3+])(C(=O)Nc1cccc(-c2cc[nH]n2)c1)c1cccc([N+](=O)[O-])c1 ZINC001576086568 1078194679 /nfs/dbraw/zinc/19/46/79/1078194679.db2.gz VPWBUANTQALWAS-SFHVURJKSA-N 1 1 351.366 2.798 20 5 FFBDMO COc1cc2c(cc1OC)C(C)(C)[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC001473759130 1065348450 /nfs/dbraw/zinc/34/84/50/1065348450.db2.gz YDFIQIMHXBOKAO-UHFFFAOYSA-N 1 1 374.441 2.910 20 5 FFBDMO CN(C)c1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 ZINC001473926649 1065421722 /nfs/dbraw/zinc/42/17/22/1065421722.db2.gz BOPBSHUSKDISPE-UHFFFAOYSA-N 1 1 352.341 2.947 20 5 FFBDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-] ZINC001474605494 1065560513 /nfs/dbraw/zinc/56/05/13/1065560513.db2.gz YNNLELGLXKRJRV-ZDUSSCGKSA-N 1 1 360.366 2.931 20 5 FFBDMO CC[C@@H](C)Oc1cccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001577001994 1078293119 /nfs/dbraw/zinc/29/31/19/1078293119.db2.gz ASISXALJNXJZTJ-XIKOKIGWSA-N 1 1 358.398 2.980 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001556098828 1075700375 /nfs/dbraw/zinc/70/03/75/1075700375.db2.gz ZLXFLOFEBDPKCL-KDOFPFPSSA-N 1 1 371.412 2.913 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@H]1C(C)(C)C ZINC001557275313 1075832089 /nfs/dbraw/zinc/83/20/89/1075832089.db2.gz DVWMMEMJEKLXIR-HNNXBMFYSA-N 1 1 351.472 2.876 20 5 FFBDMO C[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@H]1C(C)(C)C ZINC001557275313 1075832093 /nfs/dbraw/zinc/83/20/93/1075832093.db2.gz DVWMMEMJEKLXIR-HNNXBMFYSA-N 1 1 351.472 2.876 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 ZINC001559230808 1076137153 /nfs/dbraw/zinc/13/71/53/1076137153.db2.gz PLQQEZXFSQUYFK-KRWDZBQOSA-N 1 1 373.428 2.979 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090373 1076224486 /nfs/dbraw/zinc/22/44/86/1076224486.db2.gz RJRGRXNMCQNGHW-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090373 1076224488 /nfs/dbraw/zinc/22/44/88/1076224488.db2.gz RJRGRXNMCQNGHW-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H]1CCN1C(=O)OC(C)(C)C ZINC001560177267 1076241853 /nfs/dbraw/zinc/24/18/53/1076241853.db2.gz QUSBMDPJCYTMCH-OAHLLOKOSA-N 1 1 365.430 2.915 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(c2c[nH+]cn2C)CC1 ZINC001560232659 1076252581 /nfs/dbraw/zinc/25/25/81/1076252581.db2.gz CWPCQPKWLDCLNH-ZDUSSCGKSA-N 1 1 357.414 2.535 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC001587551364 1079812611 /nfs/dbraw/zinc/81/26/11/1079812611.db2.gz ISOIUZJDGFGZIG-MRXNPFEDSA-N 1 1 356.426 2.742 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001589277047 1080460185 /nfs/dbraw/zinc/46/01/85/1080460185.db2.gz PTWIIPGFABPDRF-ZDUSSCGKSA-N 1 1 370.247 2.848 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590259547 1081129130 /nfs/dbraw/zinc/12/91/30/1081129130.db2.gz KSIFCPGQJDHDES-JTQLQIEISA-N 1 1 351.436 2.513 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000052160010 210061056 /nfs/dbraw/zinc/06/10/56/210061056.db2.gz ARUVNSCZGBXEHI-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000052160010 210061059 /nfs/dbraw/zinc/06/10/59/210061059.db2.gz ARUVNSCZGBXEHI-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000007668239 249310018 /nfs/dbraw/zinc/31/00/18/249310018.db2.gz SYLDERXJCIEQPP-UHFFFAOYSA-N 1 1 359.382 2.683 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000007668239 249310021 /nfs/dbraw/zinc/31/00/21/249310021.db2.gz SYLDERXJCIEQPP-UHFFFAOYSA-N 1 1 359.382 2.683 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146926 250020266 /nfs/dbraw/zinc/02/02/66/250020266.db2.gz AMTNCQZPQKAXQW-ZLQZBKBYSA-N 1 1 358.486 2.710 20 5 FFBDMO CCN(CC)C(=O)C[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104663511 250182255 /nfs/dbraw/zinc/18/22/55/250182255.db2.gz YFXZNWLOTNXJFF-UHFFFAOYSA-N 1 1 360.414 2.593 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104663511 250182257 /nfs/dbraw/zinc/18/22/57/250182257.db2.gz YFXZNWLOTNXJFF-UHFFFAOYSA-N 1 1 360.414 2.593 20 5 FFBDMO Cc1nn(C)c(C)c1C[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000106142270 250243005 /nfs/dbraw/zinc/24/30/05/250243005.db2.gz MMZIBDRLERMFQR-UHFFFAOYSA-N 1 1 357.458 2.571 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864233 250295910 /nfs/dbraw/zinc/29/59/10/250295910.db2.gz JOIYYSNVQCIDBB-JQWIXIFHSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864233 250295912 /nfs/dbraw/zinc/29/59/12/250295912.db2.gz JOIYYSNVQCIDBB-JQWIXIFHSA-N 1 1 360.357 2.940 20 5 FFBDMO CCOc1ccc([C@@H](C)NC2CC[NH+](CCOC)CC2)cc1[N+](=O)[O-] ZINC000153218610 251113556 /nfs/dbraw/zinc/11/35/56/251113556.db2.gz GTFIOHWTJVXFRI-CQSZACIVSA-N 1 1 351.447 2.755 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000192508187 251281702 /nfs/dbraw/zinc/28/17/02/251281702.db2.gz GRIVOTVGRYOTAR-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1CO ZINC000268073647 251366533 /nfs/dbraw/zinc/36/65/33/251366533.db2.gz DHMYIJOAHGRUAX-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cnccc1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272510271 252056861 /nfs/dbraw/zinc/05/68/61/252056861.db2.gz ITRZCMHPXOVAAG-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CCCCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(N)=O ZINC000272570902 252070584 /nfs/dbraw/zinc/07/05/84/252070584.db2.gz NAAVSWMIHXPXIC-UHFFFAOYSA-N 1 1 360.414 2.770 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272671398 252098442 /nfs/dbraw/zinc/09/84/42/252098442.db2.gz TXMRMUWAYZAQBB-IUODEOHRSA-N 1 1 367.833 2.570 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272752248 252121258 /nfs/dbraw/zinc/12/12/58/252121258.db2.gz FBSYNZPCNGNNRZ-SNVBAGLBSA-N 1 1 368.231 2.738 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000273033239 252197331 /nfs/dbraw/zinc/19/73/31/252197331.db2.gz VFMSUUKAYJLZJI-GFCCVEGCSA-N 1 1 362.386 2.500 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000276294459 256087822 /nfs/dbraw/zinc/08/78/22/256087822.db2.gz MHJQGPSNJNRFSZ-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000285764422 257003552 /nfs/dbraw/zinc/00/35/52/257003552.db2.gz RRPVIRIFVVLSTD-SNVBAGLBSA-N 1 1 350.325 2.947 20 5 FFBDMO Cc1c(NC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000277517011 256206371 /nfs/dbraw/zinc/20/63/71/256206371.db2.gz OZGHORLHGTUGQZ-ZDUSSCGKSA-N 1 1 350.419 2.526 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278473676 256316664 /nfs/dbraw/zinc/31/66/64/256316664.db2.gz UUKUNGVRIIRCGI-AWEZNQCLSA-N 1 1 353.426 2.841 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000278513246 256321186 /nfs/dbraw/zinc/32/11/86/256321186.db2.gz RONKCAXLKHMNMC-CYBMUJFWSA-N 1 1 352.398 2.749 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCC[N@H+]1C1CC1 ZINC000279174344 256389860 /nfs/dbraw/zinc/38/98/60/256389860.db2.gz CZVDSAVEGZSMRS-CQSZACIVSA-N 1 1 357.332 2.857 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000278824614 256352253 /nfs/dbraw/zinc/35/22/53/256352253.db2.gz IYRNHUQHDGZBQZ-CQSZACIVSA-N 1 1 362.430 2.620 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000278845704 256354398 /nfs/dbraw/zinc/35/43/98/256354398.db2.gz LJLDIBOEZJQMAJ-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(Oc3cc[nH+]cc3C)CC2)n1 ZINC000287927794 257130412 /nfs/dbraw/zinc/13/04/12/257130412.db2.gz XBNXRJAROSZPPY-UHFFFAOYSA-N 1 1 372.381 2.528 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](c2ccncc2)C1 ZINC000289346541 257275707 /nfs/dbraw/zinc/27/57/07/257275707.db2.gz MNSBGCTWCYPPMI-IAGOWNOFSA-N 1 1 357.410 2.609 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705303 257294811 /nfs/dbraw/zinc/29/48/11/257294811.db2.gz CBNIGHRQBPPQOM-GJZGRUSLSA-N 1 1 357.414 2.682 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705303 257294812 /nfs/dbraw/zinc/29/48/12/257294812.db2.gz CBNIGHRQBPPQOM-GJZGRUSLSA-N 1 1 357.414 2.682 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000290048724 257312997 /nfs/dbraw/zinc/31/29/97/257312997.db2.gz MFJMHDYYHIRGMT-MRXNPFEDSA-N 1 1 356.426 2.801 20 5 FFBDMO Cc1cc(CNC(=O)COc2ccccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290352735 257327526 /nfs/dbraw/zinc/32/75/26/257327526.db2.gz LJCOGOWBULIFDU-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000299499389 258000085 /nfs/dbraw/zinc/00/00/85/258000085.db2.gz SHQRKRNTEXNFGE-UHFFFAOYSA-N 1 1 357.414 2.520 20 5 FFBDMO CCN1CC[NH+]([C@@H](C)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000302047123 258084342 /nfs/dbraw/zinc/08/43/42/258084342.db2.gz YRGVETCRLCELEX-HNNXBMFYSA-N 1 1 357.458 2.889 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC000302685296 258108163 /nfs/dbraw/zinc/10/81/63/258108163.db2.gz AACLLPRRBGJMNP-INIZCTEOSA-N 1 1 373.457 2.594 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2ncc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000301578373 258056605 /nfs/dbraw/zinc/05/66/05/258056605.db2.gz ZLROTUNCPGZIMM-MFKMUULPSA-N 1 1 357.252 2.919 20 5 FFBDMO Cc1nc(NCc2ccc(C[NH+]3CCN(C)CC3)cc2)ccc1[N+](=O)[O-] ZINC000301634225 258059867 /nfs/dbraw/zinc/05/98/67/258059867.db2.gz KDYQDMCBBQUYDI-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO Cc1cc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000301719976 258064850 /nfs/dbraw/zinc/06/48/50/258064850.db2.gz MDEMIHVKTZXYHK-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301813815 258069349 /nfs/dbraw/zinc/06/93/49/258069349.db2.gz ZFGXHTMMWZZMMT-AWEZNQCLSA-N 1 1 369.487 2.921 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000330554590 258165432 /nfs/dbraw/zinc/16/54/32/258165432.db2.gz GIDZHFJTJWHNGW-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@@H]1C[C@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCO1 ZINC000330785480 258170458 /nfs/dbraw/zinc/17/04/58/258170458.db2.gz UDSSDBAHKOGNFC-ZIAGYGMSSA-N 1 1 367.471 2.619 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000332382719 258228060 /nfs/dbraw/zinc/22/80/60/258228060.db2.gz HQJMIISKONWKPT-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000332382719 258228061 /nfs/dbraw/zinc/22/80/61/258228061.db2.gz HQJMIISKONWKPT-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000332394192 258228605 /nfs/dbraw/zinc/22/86/05/258228605.db2.gz NRSOPCFHQHFMMJ-LJQANCHMSA-N 1 1 374.485 2.610 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@@H](C)O1 ZINC000331727542 258198167 /nfs/dbraw/zinc/19/81/67/258198167.db2.gz YOGNZKXCYQVWNT-CHWSQXEVSA-N 1 1 374.441 2.694 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCc2ccccc2C1 ZINC000032447134 506254978 /nfs/dbraw/zinc/25/49/78/506254978.db2.gz XWYHYVSADLQNFU-MRXNPFEDSA-N 1 1 356.426 2.500 20 5 FFBDMO CC(C)(NC(=O)NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000377326027 512217382 /nfs/dbraw/zinc/21/73/82/512217382.db2.gz ZBQIGPFZQPQRON-UHFFFAOYSA-N 1 1 357.414 2.862 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cn4cc(Cl)ccc4n3)CC2)n1 ZINC000373241003 512236238 /nfs/dbraw/zinc/23/62/38/512236238.db2.gz JAAGKHGCLZGMRI-UHFFFAOYSA-N 1 1 360.805 2.930 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000053515220 506395927 /nfs/dbraw/zinc/39/59/27/506395927.db2.gz XOFSENCWEFDEOW-AWEZNQCLSA-N 1 1 371.441 2.600 20 5 FFBDMO Cc1c(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000053666717 506423668 /nfs/dbraw/zinc/42/36/68/506423668.db2.gz OHYUWERNOWIUAP-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000375350590 512280694 /nfs/dbraw/zinc/28/06/94/512280694.db2.gz XKLWBYHVWILYSX-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000066474331 506530523 /nfs/dbraw/zinc/53/05/23/506530523.db2.gz SKXQGIPMWDDVTL-HOTGVXAUSA-N 1 1 363.458 2.990 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC000054393056 506551658 /nfs/dbraw/zinc/55/16/58/506551658.db2.gz GZPBQHAHYPZMRP-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](c1ccsc1)[NH+](C)C ZINC000042158798 506603827 /nfs/dbraw/zinc/60/38/27/506603827.db2.gz FHGWLVBRHNAIPR-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000043127221 506702834 /nfs/dbraw/zinc/70/28/34/506702834.db2.gz PQQKQPIRNSFDLO-UHFFFAOYSA-N 1 1 370.409 2.953 20 5 FFBDMO C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000068201852 507147567 /nfs/dbraw/zinc/14/75/67/507147567.db2.gz QYYKLQPSOQHJDJ-OAHLLOKOSA-N 1 1 368.437 2.570 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@H](C)O1 ZINC000048317210 507500898 /nfs/dbraw/zinc/50/08/98/507500898.db2.gz SUDFZIOHDBNYTM-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@H](C)O1 ZINC000048317210 507500909 /nfs/dbraw/zinc/50/09/09/507500909.db2.gz SUDFZIOHDBNYTM-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000028836949 507744761 /nfs/dbraw/zinc/74/47/61/507744761.db2.gz GVBDBJPBNCYTTD-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000051377125 507765686 /nfs/dbraw/zinc/76/56/86/507765686.db2.gz WACJXTCMORAECF-ZDUSSCGKSA-N 1 1 360.439 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@]2([NH+]3CCOCC3)CCSC2)c2ncccc12 ZINC000029625753 507784682 /nfs/dbraw/zinc/78/46/82/507784682.db2.gz FMFRSJWWCFHNOI-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO Cc1csc(C(C)(C)[NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)n1 ZINC000072663270 507839613 /nfs/dbraw/zinc/83/96/13/507839613.db2.gz NJGHXRFHJYIWHK-UHFFFAOYSA-N 1 1 360.439 2.774 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCCO1)C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000072716166 507845493 /nfs/dbraw/zinc/84/54/93/507845493.db2.gz ICAVUGSGQBFACZ-GOSISDBHSA-N 1 1 373.453 2.908 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758953 507849694 /nfs/dbraw/zinc/84/96/94/507849694.db2.gz ROSABGVFFJKBRH-MAUKXSAKSA-N 1 1 360.458 2.506 20 5 FFBDMO COc1cc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089644759 507853150 /nfs/dbraw/zinc/85/31/50/507853150.db2.gz XBUAPUCIIBYBSQ-SJORKVTESA-N 1 1 357.410 2.651 20 5 FFBDMO COc1cc(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089644761 507853622 /nfs/dbraw/zinc/85/36/22/507853622.db2.gz XBUAPUCIIBYBSQ-DLBZAZTESA-N 1 1 357.410 2.651 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859192 507865916 /nfs/dbraw/zinc/86/59/16/507865916.db2.gz KQDCVRBBWVQABV-UONOGXRCSA-N 1 1 359.430 2.979 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1ccccc1 ZINC000073092609 507892657 /nfs/dbraw/zinc/89/26/57/507892657.db2.gz KNJNAAFJTGTNSJ-UHFFFAOYSA-N 1 1 369.421 2.633 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)Cc1ccccc1 ZINC000073092609 507892659 /nfs/dbraw/zinc/89/26/59/507892659.db2.gz KNJNAAFJTGTNSJ-UHFFFAOYSA-N 1 1 369.421 2.633 20 5 FFBDMO COCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000073142323 507897492 /nfs/dbraw/zinc/89/74/92/507897492.db2.gz GJNIDDSHAFOVLZ-UHFFFAOYSA-N 1 1 357.410 2.706 20 5 FFBDMO COCC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000073142323 507897495 /nfs/dbraw/zinc/89/74/95/507897495.db2.gz GJNIDDSHAFOVLZ-UHFFFAOYSA-N 1 1 357.410 2.706 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003544 507899622 /nfs/dbraw/zinc/89/96/22/507899622.db2.gz MCQFXCCAJKFLAQ-CYBMUJFWSA-N 1 1 355.398 2.924 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC000073306753 507912853 /nfs/dbraw/zinc/91/28/53/507912853.db2.gz JPWJIGKAXMQKQR-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(C(F)(F)F)c1 ZINC000090517914 507924707 /nfs/dbraw/zinc/92/47/07/507924707.db2.gz IVZDGFOXXJHWJI-UHFFFAOYSA-N 1 1 355.316 2.907 20 5 FFBDMO COCCCOCC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000091101851 507955972 /nfs/dbraw/zinc/95/59/72/507955972.db2.gz LWDOFIMEFRXTJP-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000091101851 507955973 /nfs/dbraw/zinc/95/59/73/507955973.db2.gz LWDOFIMEFRXTJP-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000079576811 507977698 /nfs/dbraw/zinc/97/76/98/507977698.db2.gz GDOBPJMYXDZAPA-MRXNPFEDSA-N 1 1 362.474 2.802 20 5 FFBDMO O=C(C[N@@H+](CCO)[C@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074312462 508010179 /nfs/dbraw/zinc/01/01/79/508010179.db2.gz CDUSRSVDWMXZRM-SFHVURJKSA-N 1 1 369.421 2.905 20 5 FFBDMO O=C(C[N@H+](CCO)[C@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074312462 508010182 /nfs/dbraw/zinc/01/01/82/508010182.db2.gz CDUSRSVDWMXZRM-SFHVURJKSA-N 1 1 369.421 2.905 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000074322179 508012568 /nfs/dbraw/zinc/01/25/68/508012568.db2.gz DDHDKFTYXOMHPS-HNNXBMFYSA-N 1 1 363.483 2.877 20 5 FFBDMO Cc1ccc(CC(=O)N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000110301356 508019260 /nfs/dbraw/zinc/01/92/60/508019260.db2.gz KARROTURHBOOSW-UHFFFAOYSA-N 1 1 367.449 2.833 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080106353 508039040 /nfs/dbraw/zinc/03/90/40/508039040.db2.gz FPONDXVLYSLOCW-ZDUSSCGKSA-N 1 1 359.430 2.970 20 5 FFBDMO O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000092188699 508049139 /nfs/dbraw/zinc/04/91/39/508049139.db2.gz OSGKDJDYUMMCKY-CQSZACIVSA-N 1 1 370.409 2.844 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000092588327 508085212 /nfs/dbraw/zinc/08/52/12/508085212.db2.gz ACAHRSCUYBNXSL-CQSZACIVSA-N 1 1 360.439 2.948 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000075324337 508098056 /nfs/dbraw/zinc/09/80/56/508098056.db2.gz VXYIITUCNZRHMX-MRXNPFEDSA-N 1 1 356.426 2.907 20 5 FFBDMO COCC[N@H+]1CCCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000080948442 508116540 /nfs/dbraw/zinc/11/65/40/508116540.db2.gz XVTPMWMCPUWEDZ-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO CCc1ccc([C@@H]2CCCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000075765727 508133032 /nfs/dbraw/zinc/13/30/32/508133032.db2.gz LPWLQSAWIQDKDK-RDJZCZTQSA-N 1 1 362.430 2.925 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000081121245 508139419 /nfs/dbraw/zinc/13/94/19/508139419.db2.gz GDSLUZUIXGYXHD-IBGZPJMESA-N 1 1 353.422 2.870 20 5 FFBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000075896383 508142148 /nfs/dbraw/zinc/14/21/48/508142148.db2.gz KQKPZJQNADDTID-YJBOKZPZSA-N 1 1 374.437 2.906 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000081362235 508167178 /nfs/dbraw/zinc/16/71/78/508167178.db2.gz ZJOOQWLRRVMXFM-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)CCc1ccccc1 ZINC000112698622 508210701 /nfs/dbraw/zinc/21/07/01/508210701.db2.gz VBMKNCSAORLTSD-UHFFFAOYSA-N 1 1 371.437 2.769 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000076494675 508213915 /nfs/dbraw/zinc/21/39/15/508213915.db2.gz KCRJZGKSXVGWCM-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000076494675 508213917 /nfs/dbraw/zinc/21/39/17/508213917.db2.gz KCRJZGKSXVGWCM-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000083248380 508242752 /nfs/dbraw/zinc/24/27/52/508242752.db2.gz JZGARCVDMWAURF-HNNXBMFYSA-N 1 1 368.437 2.898 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000083248380 508242755 /nfs/dbraw/zinc/24/27/55/508242755.db2.gz JZGARCVDMWAURF-HNNXBMFYSA-N 1 1 368.437 2.898 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114642782 508333588 /nfs/dbraw/zinc/33/35/88/508333588.db2.gz DLZRVUODTBARDZ-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000077928735 508392722 /nfs/dbraw/zinc/39/27/22/508392722.db2.gz ABURXHSMVUAFAU-STQMWFEESA-N 1 1 350.419 2.699 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1SC ZINC000115438376 508394536 /nfs/dbraw/zinc/39/45/36/508394536.db2.gz OTAVYXZRLGDDGR-GFCCVEGCSA-N 1 1 367.471 2.739 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152289565 508416378 /nfs/dbraw/zinc/41/63/78/508416378.db2.gz MAWCOWWGLXPZCS-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152289565 508416382 /nfs/dbraw/zinc/41/63/82/508416382.db2.gz MAWCOWWGLXPZCS-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152289565 508416387 /nfs/dbraw/zinc/41/63/87/508416387.db2.gz MAWCOWWGLXPZCS-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO Cc1cc(C(=O)NCc2ccc(C[NH+]3CCOCC3)cc2)cc([N+](=O)[O-])c1 ZINC000121893161 508442273 /nfs/dbraw/zinc/44/22/73/508442273.db2.gz IJKLBEHASOHAFC-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000152737927 508505437 /nfs/dbraw/zinc/50/54/37/508505437.db2.gz JGDWDJRHRYZJLL-MRXNPFEDSA-N 1 1 358.442 2.753 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(c4cccnn4)CC3)o2)cc1 ZINC000127948046 508525925 /nfs/dbraw/zinc/52/59/25/508525925.db2.gz FMGJJGCMJGXAFG-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153287350 508568592 /nfs/dbraw/zinc/56/85/92/508568592.db2.gz GGZHMGAKYALQIZ-UHFFFAOYSA-N 1 1 365.389 2.855 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COCc1ccccc1F)C2 ZINC000153400724 508579234 /nfs/dbraw/zinc/57/92/34/508579234.db2.gz LWPBKFKRPOKUGK-INIZCTEOSA-N 1 1 360.385 2.670 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COCc1ccccc1F)C2 ZINC000153400724 508579239 /nfs/dbraw/zinc/57/92/39/508579239.db2.gz LWPBKFKRPOKUGK-INIZCTEOSA-N 1 1 360.385 2.670 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000122832987 508593463 /nfs/dbraw/zinc/59/34/63/508593463.db2.gz WSQARMJTRPPPTF-DOTOQJQBSA-N 1 1 374.485 2.752 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N(C)[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000153610766 508607541 /nfs/dbraw/zinc/60/75/41/508607541.db2.gz YFWHILWOPLMSDG-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO COc1ccc2c(c1)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC2 ZINC000128534459 508607558 /nfs/dbraw/zinc/60/75/58/508607558.db2.gz GDTSKJSUMBGHNH-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000157818685 508617283 /nfs/dbraw/zinc/61/72/83/508617283.db2.gz RPCDHUUKVDNYMJ-NSHDSACASA-N 1 1 359.430 2.804 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000157904030 508629966 /nfs/dbraw/zinc/62/99/66/508629966.db2.gz DTFQBMSTOLGKIX-WBVHZDCISA-N 1 1 372.421 2.833 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000136071682 508668180 /nfs/dbraw/zinc/66/81/80/508668180.db2.gz XETJMRNSFMRIAY-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136071682 508668183 /nfs/dbraw/zinc/66/81/83/508668183.db2.gz XETJMRNSFMRIAY-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136071682 508668185 /nfs/dbraw/zinc/66/81/85/508668185.db2.gz XETJMRNSFMRIAY-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000153893955 508671901 /nfs/dbraw/zinc/67/19/01/508671901.db2.gz MNGYZXQYSGAADZ-GUYCJALGSA-N 1 1 359.426 2.692 20 5 FFBDMO CC[NH+]1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094366 508682099 /nfs/dbraw/zinc/68/20/99/508682099.db2.gz RRUJPDWJIDBPPS-CXAGYDPISA-N 1 1 366.437 2.725 20 5 FFBDMO CC[NH+]1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094366 508682102 /nfs/dbraw/zinc/68/21/02/508682102.db2.gz RRUJPDWJIDBPPS-CXAGYDPISA-N 1 1 366.437 2.725 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094366 508682107 /nfs/dbraw/zinc/68/21/07/508682107.db2.gz RRUJPDWJIDBPPS-CXAGYDPISA-N 1 1 366.437 2.725 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000129094366 508682110 /nfs/dbraw/zinc/68/21/10/508682110.db2.gz RRUJPDWJIDBPPS-CXAGYDPISA-N 1 1 366.437 2.725 20 5 FFBDMO COc1ccc(OCCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866016 508687570 /nfs/dbraw/zinc/68/75/70/508687570.db2.gz NYERRJDHMDISIL-HNNXBMFYSA-N 1 1 372.425 2.954 20 5 FFBDMO Cc1cccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866859 508689133 /nfs/dbraw/zinc/68/91/33/508689133.db2.gz OSYCCSQBRTYLKY-HOCLYGCPSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1cccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000118866859 508689135 /nfs/dbraw/zinc/68/91/35/508689135.db2.gz OSYCCSQBRTYLKY-HOCLYGCPSA-N 1 1 369.425 2.812 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000154086186 508713944 /nfs/dbraw/zinc/71/39/44/508713944.db2.gz DTQKPJAORGWDIM-GDBMZVCRSA-N 1 1 359.426 2.692 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000154086400 508714189 /nfs/dbraw/zinc/71/41/89/508714189.db2.gz DTQKPJAORGWDIM-GOEBONIOSA-N 1 1 359.426 2.692 20 5 FFBDMO CC1CCN(C[C@@H](O)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000158872352 508762493 /nfs/dbraw/zinc/76/24/93/508762493.db2.gz CIQYNACYRXVKCD-RBUKOAKNSA-N 1 1 361.486 2.598 20 5 FFBDMO CC1CC[NH+]([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])c2cccs2)CC1 ZINC000158940775 508771575 /nfs/dbraw/zinc/77/15/75/508771575.db2.gz GEMKLOXBQUFXPY-LBPRGKRZSA-N 1 1 363.443 2.582 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124068952 508778958 /nfs/dbraw/zinc/77/89/58/508778958.db2.gz ABLFHMQMMMCBHJ-BBRMVZONSA-N 1 1 371.441 2.550 20 5 FFBDMO Cn1cc([C@@H](O)C[C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cn1 ZINC000371464075 512416747 /nfs/dbraw/zinc/41/67/47/512416747.db2.gz OEDCMBAJGZXRLT-CJNGLKHVSA-N 1 1 371.397 2.558 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000119384491 508785469 /nfs/dbraw/zinc/78/54/69/508785469.db2.gz GRGBRLJTAIRTJV-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000142343781 508823185 /nfs/dbraw/zinc/82/31/85/508823185.db2.gz XEPJHAOCBJZGCA-INIZCTEOSA-N 1 1 358.442 2.505 20 5 FFBDMO CC(C)(C)[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000154708963 508839270 /nfs/dbraw/zinc/83/92/70/508839270.db2.gz IWHQMOZHCVMGQU-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO CC(C)(C)[C@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000154708963 508839273 /nfs/dbraw/zinc/83/92/73/508839273.db2.gz IWHQMOZHCVMGQU-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO CC(C)(C)[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000154708963 508839275 /nfs/dbraw/zinc/83/92/75/508839275.db2.gz IWHQMOZHCVMGQU-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159533726 508854454 /nfs/dbraw/zinc/85/44/54/508854454.db2.gz INANOZYIXWCUGE-ZETOZRRWSA-N 1 1 355.822 2.668 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000159556542 508857793 /nfs/dbraw/zinc/85/77/93/508857793.db2.gz QEWSKISRRQUHKM-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@@H+](CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000124643111 508863292 /nfs/dbraw/zinc/86/32/92/508863292.db2.gz HTRYOOOUSRVLNG-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1CCOC ZINC000130937677 508867866 /nfs/dbraw/zinc/86/78/66/508867866.db2.gz DWZSTBQTLCMNQF-OAHLLOKOSA-N 1 1 374.441 2.649 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC[N@@H+]1CCOC ZINC000131011639 508876898 /nfs/dbraw/zinc/87/68/98/508876898.db2.gz VZSSBVAXXMDKPG-CYBMUJFWSA-N 1 1 355.460 2.538 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)s2)CC[N@H+]1CCOC ZINC000131011639 508876902 /nfs/dbraw/zinc/87/69/02/508876902.db2.gz VZSSBVAXXMDKPG-CYBMUJFWSA-N 1 1 355.460 2.538 20 5 FFBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000160461921 508990866 /nfs/dbraw/zinc/99/08/66/508990866.db2.gz BHKXMOHPAVYXME-QFBILLFUSA-N 1 1 357.410 2.875 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000132458560 509034636 /nfs/dbraw/zinc/03/46/36/509034636.db2.gz IKRCXYWSEHQKOK-QGZVFWFLSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155674401 509050768 /nfs/dbraw/zinc/05/07/68/509050768.db2.gz GZGHWFUEOACTTE-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](c2nnc3ccccn32)C1 ZINC000155782065 509071012 /nfs/dbraw/zinc/07/10/12/509071012.db2.gz PNQYHKLJFKINJB-OAHLLOKOSA-N 1 1 367.409 2.896 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121124249 509133032 /nfs/dbraw/zinc/13/30/32/509133032.db2.gz CMUHXOSNRLJQAL-FXAWDEMLSA-N 1 1 374.529 2.779 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)CC2)c1 ZINC000162031417 509170104 /nfs/dbraw/zinc/17/01/04/509170104.db2.gz QODASMGHWBAPLJ-UHFFFAOYSA-N 1 1 365.393 2.742 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)n1 ZINC000191830965 509201042 /nfs/dbraw/zinc/20/10/42/509201042.db2.gz XPFYLUJHBHVSMF-OAHLLOKOSA-N 1 1 371.441 2.548 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1OC)[NH+](C)C ZINC000248010278 509216404 /nfs/dbraw/zinc/21/64/04/509216404.db2.gz PELFUNWILZJUJU-INIZCTEOSA-N 1 1 373.409 2.645 20 5 FFBDMO C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000172771634 509225449 /nfs/dbraw/zinc/22/54/49/509225449.db2.gz QGDAJHDYSQJOPL-CYBMUJFWSA-N 1 1 359.451 2.762 20 5 FFBDMO C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000172771634 509225455 /nfs/dbraw/zinc/22/54/55/509225455.db2.gz QGDAJHDYSQJOPL-CYBMUJFWSA-N 1 1 359.451 2.762 20 5 FFBDMO CC[C@H]1CN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000191891113 509233296 /nfs/dbraw/zinc/23/32/96/509233296.db2.gz SZHZFXSENZHWQU-INIZCTEOSA-N 1 1 371.441 2.548 20 5 FFBDMO CC[C@H]1CN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000191891113 509233300 /nfs/dbraw/zinc/23/33/00/509233300.db2.gz SZHZFXSENZHWQU-INIZCTEOSA-N 1 1 371.441 2.548 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172801697 509243462 /nfs/dbraw/zinc/24/34/62/509243462.db2.gz FAEOAIPVZCWCHB-TZMCWYRMSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176004348 509268635 /nfs/dbraw/zinc/26/86/35/509268635.db2.gz XBPQWHLJSFMMEP-GWCFXTLKSA-N 1 1 370.247 2.770 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000248555316 509361831 /nfs/dbraw/zinc/36/18/31/509361831.db2.gz BEEDVTMZOPOBMS-WFASDCNBSA-N 1 1 350.419 2.797 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000264285978 509433614 /nfs/dbraw/zinc/43/36/14/509433614.db2.gz JFZXEMLZZQLFGT-OAHLLOKOSA-N 1 1 359.451 2.951 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000248725149 509453119 /nfs/dbraw/zinc/45/31/19/509453119.db2.gz IDEWMDWXSPEMKQ-JKSUJKDBSA-N 1 1 363.458 2.770 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](C)[NH+]1CCN(c2ccccc2)CC1 ZINC000192495629 509539539 /nfs/dbraw/zinc/53/95/39/509539539.db2.gz JUEBPDSOEQLBOE-HNNXBMFYSA-N 1 1 372.473 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cn4cc(Cl)ccc4n3)C2)nc1 ZINC000173464500 509618016 /nfs/dbraw/zinc/61/80/16/509618016.db2.gz CFPXJQKKNAPHPY-CYBMUJFWSA-N 1 1 372.816 2.977 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cn4cc(Cl)ccc4n3)C2)nc1 ZINC000173464500 509618018 /nfs/dbraw/zinc/61/80/18/509618018.db2.gz CFPXJQKKNAPHPY-CYBMUJFWSA-N 1 1 372.816 2.977 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000173511794 509637707 /nfs/dbraw/zinc/63/77/07/509637707.db2.gz HPLFXIVQQAUKIL-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000173511794 509637714 /nfs/dbraw/zinc/63/77/14/509637714.db2.gz HPLFXIVQQAUKIL-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(NC2CC[NH+](CC(=O)Nc3ccccc3)CC2)c1 ZINC000192771406 509638977 /nfs/dbraw/zinc/63/89/77/509638977.db2.gz JONNDCDNQKNYLX-UHFFFAOYSA-N 1 1 369.425 2.692 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1C ZINC000173667897 509709319 /nfs/dbraw/zinc/70/93/19/509709319.db2.gz JQIZYUOBFLULIS-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000180109301 509756766 /nfs/dbraw/zinc/75/67/66/509756766.db2.gz LRXDHDZXNHMAQX-QAPCUYQASA-N 1 1 355.394 2.779 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000180115236 509760605 /nfs/dbraw/zinc/76/06/05/509760605.db2.gz GIARMDDTWZXIQX-YJBOKZPZSA-N 1 1 355.394 2.779 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000268183521 509801610 /nfs/dbraw/zinc/80/16/10/509801610.db2.gz LXOGJEQWMGNUEF-NOZJJQNGSA-N 1 1 357.332 2.826 20 5 FFBDMO CCOC(=O)c1cc(NC[C@@H](C(C)C)[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000177049134 509839638 /nfs/dbraw/zinc/83/96/38/509839638.db2.gz ZAWISYKRUWLYEV-KRWDZBQOSA-N 1 1 365.430 2.540 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000186717717 509869786 /nfs/dbraw/zinc/86/97/86/509869786.db2.gz AJJWSRZJRZTPBR-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C(C)(C)C)n1 ZINC000180345083 509878397 /nfs/dbraw/zinc/87/83/97/509878397.db2.gz HJLHQSCJPGMCRJ-CQSZACIVSA-N 1 1 358.446 2.707 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[N@H+]1C1CC1 ZINC000177154109 509905234 /nfs/dbraw/zinc/90/52/34/509905234.db2.gz OPHPKQDLLZYTGE-GOEBONIOSA-N 1 1 372.469 2.553 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180476304 509943257 /nfs/dbraw/zinc/94/32/57/509943257.db2.gz LTMGKYZULGHCIY-LLVKDONJSA-N 1 1 357.357 2.800 20 5 FFBDMO C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180497663 509954952 /nfs/dbraw/zinc/95/49/52/509954952.db2.gz TZPSKPPEJSMHOR-UWJYYQICSA-N 1 1 368.481 2.910 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180560165 509984102 /nfs/dbraw/zinc/98/41/02/509984102.db2.gz BSNSNUGLWIZFEU-SNVBAGLBSA-N 1 1 358.236 2.817 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000245535745 509988828 /nfs/dbraw/zinc/98/88/28/509988828.db2.gz FQLCXQZGVLRJNF-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000245535745 509988833 /nfs/dbraw/zinc/98/88/33/509988833.db2.gz FQLCXQZGVLRJNF-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177342758 510004458 /nfs/dbraw/zinc/00/44/58/510004458.db2.gz NFYQEVJANZQXSK-ZBFHGGJFSA-N 1 1 357.414 2.703 20 5 FFBDMO Cc1c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000265361956 510013899 /nfs/dbraw/zinc/01/38/99/510013899.db2.gz ZWVONHXTWHOIRS-CYBMUJFWSA-N 1 1 364.402 2.534 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000180619920 510018413 /nfs/dbraw/zinc/01/84/13/510018413.db2.gz KMRQZGMJCODCQX-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000180619920 510018420 /nfs/dbraw/zinc/01/84/20/510018420.db2.gz KMRQZGMJCODCQX-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)C[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183917597 510037662 /nfs/dbraw/zinc/03/76/62/510037662.db2.gz PVMHQIFIAZJMAA-LLVKDONJSA-N 1 1 364.427 2.734 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)C[C@@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183917597 510037672 /nfs/dbraw/zinc/03/76/72/510037672.db2.gz PVMHQIFIAZJMAA-LLVKDONJSA-N 1 1 364.427 2.734 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000177425856 510050985 /nfs/dbraw/zinc/05/09/85/510050985.db2.gz JXKKXJSJZSHVDP-APPDUMDISA-N 1 1 360.370 2.591 20 5 FFBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000245675452 510078088 /nfs/dbraw/zinc/07/80/88/510078088.db2.gz HCPPXYHMOGMXAA-IINYFYTJSA-N 1 1 370.247 2.816 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245716652 510104061 /nfs/dbraw/zinc/10/40/61/510104061.db2.gz QILUOPAPUCFFIS-NVXWUHKLSA-N 1 1 360.414 2.512 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000261921597 510116036 /nfs/dbraw/zinc/11/60/36/510116036.db2.gz IPIBTRSMXXVFRK-QGZVFWFLSA-N 1 1 359.813 2.964 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000265631345 510147530 /nfs/dbraw/zinc/14/75/30/510147530.db2.gz DTFQBMSTOLGKIX-DOTOQJQBSA-N 1 1 372.421 2.833 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC(CCC[NH+](CC)CC)CC2)c1[N+](=O)[O-] ZINC000180886708 510164537 /nfs/dbraw/zinc/16/45/37/510164537.db2.gz VCNIOHRQKGVGST-UHFFFAOYSA-N 1 1 365.478 2.855 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](c4cc[nH]n4)C3)o2)cc1 ZINC000193997015 510166831 /nfs/dbraw/zinc/16/68/31/510166831.db2.gz UVGFIWGVQHDWMF-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](c4cc[nH]n4)C3)o2)cc1 ZINC000193997015 510166839 /nfs/dbraw/zinc/16/68/39/510166839.db2.gz UVGFIWGVQHDWMF-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000246037544 510259081 /nfs/dbraw/zinc/25/90/81/510259081.db2.gz WSBZJWCEBIFDBD-BXUZGUMPSA-N 1 1 374.384 2.840 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@@H]2CCCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000246170371 510335779 /nfs/dbraw/zinc/33/57/79/510335779.db2.gz RTEGVVDQIVDMAI-IAGOWNOFSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@@H]2CCCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000246170371 510335787 /nfs/dbraw/zinc/33/57/87/510335787.db2.gz RTEGVVDQIVDMAI-IAGOWNOFSA-N 1 1 361.467 2.844 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269365559 510364938 /nfs/dbraw/zinc/36/49/38/510364938.db2.gz VKFZTWSXKWUKKC-ACJLOTCBSA-N 1 1 358.442 2.752 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269428955 510402615 /nfs/dbraw/zinc/40/26/15/510402615.db2.gz ZFGNNRCSTMSZOY-HNNXBMFYSA-N 1 1 371.441 2.836 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000171865185 510418126 /nfs/dbraw/zinc/41/81/26/510418126.db2.gz IDAMTTFZQQYSDG-CQSZACIVSA-N 1 1 369.421 2.666 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000171865185 510418134 /nfs/dbraw/zinc/41/81/34/510418134.db2.gz IDAMTTFZQQYSDG-CQSZACIVSA-N 1 1 369.421 2.666 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000174996805 510427226 /nfs/dbraw/zinc/42/72/26/510427226.db2.gz FVOMDHJWBZCQQZ-JKSUJKDBSA-N 1 1 358.442 2.868 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)[C@H](N2CCOCC2)C1 ZINC000246328462 510430372 /nfs/dbraw/zinc/43/03/72/510430372.db2.gz DLIYXHHXNCPSQT-MAUKXSAKSA-N 1 1 363.458 2.535 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000181569494 510478929 /nfs/dbraw/zinc/47/89/29/510478929.db2.gz OOFOHVLZUAUQQR-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO Cc1cc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cc([N+](=O)[O-])c1 ZINC000175109656 510486774 /nfs/dbraw/zinc/48/67/74/510486774.db2.gz AOBVPBWQYBJNRK-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000266418391 510574480 /nfs/dbraw/zinc/57/44/80/510574480.db2.gz RRPZDCHEBGPJMT-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182063214 510736226 /nfs/dbraw/zinc/73/62/26/510736226.db2.gz QDDSAHUTUMPKOC-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182063214 510736230 /nfs/dbraw/zinc/73/62/30/510736230.db2.gz QDDSAHUTUMPKOC-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@@H+](C)Cc1ccccc1 ZINC000182098119 510758480 /nfs/dbraw/zinc/75/84/80/510758480.db2.gz NVZPFDHMUFISGC-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732716 510759540 /nfs/dbraw/zinc/75/95/40/510759540.db2.gz BKGBFXCQFXPPOC-ZBFHGGJFSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732716 510759546 /nfs/dbraw/zinc/75/95/46/510759546.db2.gz BKGBFXCQFXPPOC-ZBFHGGJFSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732716 510759551 /nfs/dbraw/zinc/75/95/51/510759551.db2.gz BKGBFXCQFXPPOC-ZBFHGGJFSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732716 510759552 /nfs/dbraw/zinc/75/95/52/510759552.db2.gz BKGBFXCQFXPPOC-ZBFHGGJFSA-N 1 1 351.447 2.644 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC(c3ccncc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000191679498 510783131 /nfs/dbraw/zinc/78/31/31/510783131.db2.gz VXFMGICLCPHWAP-IBGZPJMESA-N 1 1 366.421 2.975 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000263680958 510785766 /nfs/dbraw/zinc/78/57/66/510785766.db2.gz OTPIWDCVCMXZKF-OCCSQVGLSA-N 1 1 374.397 2.791 20 5 FFBDMO CCC(CC)[C@@H](CNc1c([N+](=O)[O-])c(C)nn1CC)[NH+]1CCOCC1 ZINC000195343857 510794239 /nfs/dbraw/zinc/79/42/39/510794239.db2.gz BPERUGNKVXVDJW-OAHLLOKOSA-N 1 1 353.467 2.669 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000185306519 510800122 /nfs/dbraw/zinc/80/01/22/510800122.db2.gz XYLSXRGKHYLWJQ-ZDUSSCGKSA-N 1 1 361.348 2.961 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000185306519 510800125 /nfs/dbraw/zinc/80/01/25/510800125.db2.gz XYLSXRGKHYLWJQ-ZDUSSCGKSA-N 1 1 361.348 2.961 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)c(Cl)c1 ZINC000182200691 510810152 /nfs/dbraw/zinc/81/01/52/510810152.db2.gz VJEFNLRLUHKIGP-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)c(Cl)c1 ZINC000182200691 510810159 /nfs/dbraw/zinc/81/01/59/510810159.db2.gz VJEFNLRLUHKIGP-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2C[NH+]2CCOCC2)c(Cl)c1 ZINC000182200691 510810167 /nfs/dbraw/zinc/81/01/67/510810167.db2.gz VJEFNLRLUHKIGP-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000182258121 510836223 /nfs/dbraw/zinc/83/62/23/510836223.db2.gz QWTCYPDVOJISHA-CMPLNLGQSA-N 1 1 355.341 2.505 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@@H](C)C1 ZINC000247239046 510853839 /nfs/dbraw/zinc/85/38/39/510853839.db2.gz DGOMFXLTEIGFAL-KBXCAEBGSA-N 1 1 371.441 2.583 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C1 ZINC000247556755 510865660 /nfs/dbraw/zinc/86/56/60/510865660.db2.gz ZGTMBFDYOXXZMA-KBXCAEBGSA-N 1 1 371.441 2.583 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000282235489 510896825 /nfs/dbraw/zinc/89/68/25/510896825.db2.gz LKQINEOGLFWMPE-OAHLLOKOSA-N 1 1 356.426 2.692 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000294008357 510927172 /nfs/dbraw/zinc/92/71/72/510927172.db2.gz YEBQZQJPGMPEIU-ZWKOTPCHSA-N 1 1 361.442 2.653 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000282394880 510958792 /nfs/dbraw/zinc/95/87/92/510958792.db2.gz XPHDCCNQKOGWRX-CQSZACIVSA-N 1 1 367.471 2.546 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)C2)C1 ZINC000294195843 510987376 /nfs/dbraw/zinc/98/73/76/510987376.db2.gz PUWOVRUVUISNHA-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO COC(=O)[C@]1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000282515387 511007954 /nfs/dbraw/zinc/00/79/54/511007954.db2.gz PAPUKNYEJODQBU-KZULUSFZSA-N 1 1 359.382 2.881 20 5 FFBDMO CC(=O)NCC[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000282593105 511038028 /nfs/dbraw/zinc/03/80/28/511038028.db2.gz XHEIEWLMPLYYKY-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO CC(=O)NCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000282593105 511038033 /nfs/dbraw/zinc/03/80/33/511038033.db2.gz XHEIEWLMPLYYKY-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO CC(C)(CCC(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)[N+](=O)[O-] ZINC000294463272 511072137 /nfs/dbraw/zinc/07/21/37/511072137.db2.gz MWCQWHDVGVEYMU-UHFFFAOYSA-N 1 1 369.412 2.881 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000294597871 511116390 /nfs/dbraw/zinc/11/63/90/511116390.db2.gz ZAWSFVKEQYGNKU-CQSZACIVSA-N 1 1 373.384 2.747 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000279646835 511159620 /nfs/dbraw/zinc/15/96/20/511159620.db2.gz WHVBSBYIGJTGCG-SNVBAGLBSA-N 1 1 355.797 2.530 20 5 FFBDMO C[C@@H]([NH2+]Cc1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271698039 511292066 /nfs/dbraw/zinc/29/20/66/511292066.db2.gz GRBXDGLDRYHPLF-CYBMUJFWSA-N 1 1 363.439 2.696 20 5 FFBDMO O=C(c1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363021317 511301166 /nfs/dbraw/zinc/30/11/66/511301166.db2.gz KZZOMSODTICKCX-HOTGVXAUSA-N 1 1 358.442 2.870 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-] ZINC000271859761 511350199 /nfs/dbraw/zinc/35/01/99/511350199.db2.gz KEGLTZSXGHZFFE-UHFFFAOYSA-N 1 1 368.231 2.657 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295341750 511370534 /nfs/dbraw/zinc/37/05/34/511370534.db2.gz MRLIHZZRMPZKFI-OAHLLOKOSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291938241 511399239 /nfs/dbraw/zinc/39/92/39/511399239.db2.gz TYEAEBXHLBFENQ-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291938241 511399245 /nfs/dbraw/zinc/39/92/45/511399245.db2.gz TYEAEBXHLBFENQ-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO Cc1nn(C)c(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000280301225 511413003 /nfs/dbraw/zinc/41/30/03/511413003.db2.gz SWJOCGOGMJJGIB-UHFFFAOYSA-N 1 1 351.794 2.604 20 5 FFBDMO CCOc1cc(N2CCN(c3[nH+]cnc4[nH]ccc43)CC2)ccc1[N+](=O)[O-] ZINC000280366235 511438235 /nfs/dbraw/zinc/43/82/35/511438235.db2.gz YBSKKADPTOPXCI-UHFFFAOYSA-N 1 1 368.397 2.591 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000272260131 511483714 /nfs/dbraw/zinc/48/37/14/511483714.db2.gz UYIVZEXPWSBZCG-WFASDCNBSA-N 1 1 355.385 2.875 20 5 FFBDMO COc1ccc(NC(=O)Cn2c[nH+]c3c2C[C@H](C)[C@@H](C)C3)c([N+](=O)[O-])c1 ZINC000295716646 511493604 /nfs/dbraw/zinc/49/36/04/511493604.db2.gz GOFGPWQJLSZOIB-RYUDHWBXSA-N 1 1 358.398 2.809 20 5 FFBDMO CCCCC[C@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365509219 511494944 /nfs/dbraw/zinc/49/49/44/511494944.db2.gz JBTADSTVOLSWRA-AWEZNQCLSA-N 1 1 351.451 2.513 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363416269 511536235 /nfs/dbraw/zinc/53/62/35/511536235.db2.gz BHAQXWSBQOZYKC-FUHWJXTLSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@]2(CCOC2)O1 ZINC000280623855 511536408 /nfs/dbraw/zinc/53/64/08/511536408.db2.gz WVELQSDHLRNDIV-LIRRHRJNSA-N 1 1 373.409 2.672 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000299420230 511629276 /nfs/dbraw/zinc/62/92/76/511629276.db2.gz WUMPFVJDRMAMTC-JKSUJKDBSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2 ZINC000365794476 511656748 /nfs/dbraw/zinc/65/67/48/511656748.db2.gz JKOBTSOBYCBXQA-GOSISDBHSA-N 1 1 368.349 2.599 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCCNc1ccc(C)c[nH+]1 ZINC000280961406 511668500 /nfs/dbraw/zinc/66/85/00/511668500.db2.gz NKHCGEMZGPPPQS-UHFFFAOYSA-N 1 1 358.398 2.929 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)C[N@@H+](C)Cc2ccccc2)n1 ZINC000311403536 511775933 /nfs/dbraw/zinc/77/59/33/511775933.db2.gz UUMOGISDZSKRCW-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342991 511783314 /nfs/dbraw/zinc/78/33/14/511783314.db2.gz UVKGUDRFWJICFR-PBHICJAKSA-N 1 1 359.386 2.516 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342991 511783318 /nfs/dbraw/zinc/78/33/18/511783318.db2.gz UVKGUDRFWJICFR-PBHICJAKSA-N 1 1 359.386 2.516 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000312516902 511784624 /nfs/dbraw/zinc/78/46/24/511784624.db2.gz SWIRHADTCVOGKA-OAHLLOKOSA-N 1 1 370.409 2.710 20 5 FFBDMO Cc1cc(OCc2nc([C@@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348706 511786913 /nfs/dbraw/zinc/78/69/13/511786913.db2.gz GWZNFBDUFZDXNI-YJBOKZPZSA-N 1 1 374.397 2.791 20 5 FFBDMO Cc1cc(OCc2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348706 511786914 /nfs/dbraw/zinc/78/69/14/511786914.db2.gz GWZNFBDUFZDXNI-YJBOKZPZSA-N 1 1 374.397 2.791 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000274326643 511795600 /nfs/dbraw/zinc/79/56/00/511795600.db2.gz YUTFYRKOGVUFPL-ZFWWWQNUSA-N 1 1 371.441 2.692 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1[C@H]1CCCO1)Nc1cc([N+](=O)[O-])ccc1F ZINC000284656776 511812307 /nfs/dbraw/zinc/81/23/07/511812307.db2.gz GGFNXNNIDIKCNZ-HZPDHXFCSA-N 1 1 351.378 2.706 20 5 FFBDMO COC[C@@H]1C[C@H](OC)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000284673157 511819509 /nfs/dbraw/zinc/81/95/09/511819509.db2.gz OSKJKBOLXWLHQN-HOTGVXAUSA-N 1 1 361.398 2.528 20 5 FFBDMO C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CC2)C1 ZINC000296715272 511866896 /nfs/dbraw/zinc/86/68/96/511866896.db2.gz MKEOIGBTRNTUCP-ZDUSSCGKSA-N 1 1 357.414 2.561 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366199336 511895828 /nfs/dbraw/zinc/89/58/28/511895828.db2.gz GKZBWHACVKFNKU-ZBFHGGJFSA-N 1 1 354.410 2.773 20 5 FFBDMO COCCc1ccc(OC[C@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000293525507 511997467 /nfs/dbraw/zinc/99/74/67/511997467.db2.gz PBFBLIAUGGUGLR-GOSISDBHSA-N 1 1 374.437 2.655 20 5 FFBDMO COCCc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000293525507 511997469 /nfs/dbraw/zinc/99/74/69/511997469.db2.gz PBFBLIAUGGUGLR-GOSISDBHSA-N 1 1 374.437 2.655 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCO[C@@]4(CCCOC4)C3)o2)c1 ZINC000285274006 512060411 /nfs/dbraw/zinc/06/04/11/512060411.db2.gz IWHBHCRDXPORGI-IBGZPJMESA-N 1 1 373.409 2.674 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4cn[nH]c4)CC3)n2)c1 ZINC000364412554 512107383 /nfs/dbraw/zinc/10/73/83/512107383.db2.gz HYELHTZNUDOSFP-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO CCOC1CC2(C1)CC[N@H+]([C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)C2 ZINC000375767838 512496416 /nfs/dbraw/zinc/49/64/16/512496416.db2.gz JUAUJUPYGOPRLK-HFCFLWKCSA-N 1 1 359.426 2.591 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411336052 512585907 /nfs/dbraw/zinc/58/59/07/512585907.db2.gz SDMMDWKPPVHLHJ-OAHLLOKOSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411336052 512585911 /nfs/dbraw/zinc/58/59/11/512585911.db2.gz SDMMDWKPPVHLHJ-OAHLLOKOSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1cc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000367805605 512670481 /nfs/dbraw/zinc/67/04/81/512670481.db2.gz XOTPDWPHZYLQKW-KRWDZBQOSA-N 1 1 369.469 2.668 20 5 FFBDMO Cc1cc(N2CCN([C@H]3CCC[N@@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000367805605 512670484 /nfs/dbraw/zinc/67/04/84/512670484.db2.gz XOTPDWPHZYLQKW-KRWDZBQOSA-N 1 1 369.469 2.668 20 5 FFBDMO Cc1cc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000367805605 512670486 /nfs/dbraw/zinc/67/04/86/512670486.db2.gz XOTPDWPHZYLQKW-KRWDZBQOSA-N 1 1 369.469 2.668 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368003847 512758888 /nfs/dbraw/zinc/75/88/88/512758888.db2.gz BHTFFYYFQOWVPL-HNNXBMFYSA-N 1 1 365.393 2.830 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](n2ncc3ccccc32)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368003847 512758892 /nfs/dbraw/zinc/75/88/92/512758892.db2.gz BHTFFYYFQOWVPL-HNNXBMFYSA-N 1 1 365.393 2.830 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000376328385 512770244 /nfs/dbraw/zinc/77/02/44/512770244.db2.gz RWNPPQKYHJZSSZ-MRXNPFEDSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cnn(C)c1 ZINC000411812996 512826606 /nfs/dbraw/zinc/82/66/06/512826606.db2.gz BOCCGLINQBYNKA-UHFFFAOYSA-N 1 1 359.430 2.815 20 5 FFBDMO CCc1nn(C)c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000381013581 512874306 /nfs/dbraw/zinc/87/43/06/512874306.db2.gz PYPMNWCQMZQPGN-IAGOWNOFSA-N 1 1 369.469 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC([C@H]4CCOC4)CC3)n2)cc1 ZINC000368272061 512876210 /nfs/dbraw/zinc/87/62/10/512876210.db2.gz KXHVFNWUGJEXHR-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062533 512938588 /nfs/dbraw/zinc/93/85/88/512938588.db2.gz ASDYPLZYKSHJOQ-WDEREUQCSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062533 512938590 /nfs/dbraw/zinc/93/85/90/512938590.db2.gz ASDYPLZYKSHJOQ-WDEREUQCSA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@@H]1C[C@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[N@H+]1Cc1ccccc1 ZINC000397984488 512952145 /nfs/dbraw/zinc/95/21/45/512952145.db2.gz NSYJWHNOGIFWFJ-HIFRSBDPSA-N 1 1 351.410 2.968 20 5 FFBDMO C[C@]1(NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000406030312 512973725 /nfs/dbraw/zinc/97/37/25/512973725.db2.gz JUPMPPWNYQSRLS-IBGZPJMESA-N 1 1 354.410 2.571 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1 ZINC000412151647 512978121 /nfs/dbraw/zinc/97/81/21/512978121.db2.gz DFQKEOUPQASMBC-ZYSHUDEJSA-N 1 1 357.454 2.889 20 5 FFBDMO O=C(CCC(=O)N1CCC[N@@H+](CC2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000412312733 513035671 /nfs/dbraw/zinc/03/56/71/513035671.db2.gz HYNDGIRTZMQFCA-UHFFFAOYSA-N 1 1 373.453 2.892 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000433854803 513167354 /nfs/dbraw/zinc/16/73/54/513167354.db2.gz YDTNNUKCPFBLSW-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000433854803 513167359 /nfs/dbraw/zinc/16/73/59/513167359.db2.gz YDTNNUKCPFBLSW-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000428869438 513213385 /nfs/dbraw/zinc/21/33/85/513213385.db2.gz BDBIRALPLMAZRZ-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000428869438 513213389 /nfs/dbraw/zinc/21/33/89/513213389.db2.gz BDBIRALPLMAZRZ-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@H]1C ZINC000450500783 513223586 /nfs/dbraw/zinc/22/35/86/513223586.db2.gz OEASKYBKAHKMOK-OLZOCXBDSA-N 1 1 357.414 2.540 20 5 FFBDMO Cc1nc(NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450537435 513241392 /nfs/dbraw/zinc/24/13/92/513241392.db2.gz DKNIMFYMRNVJJY-QGZVFWFLSA-N 1 1 355.442 2.829 20 5 FFBDMO C[C@H](c1ccccc1)[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450566530 513253637 /nfs/dbraw/zinc/25/36/37/513253637.db2.gz KXYFLUQDTWFPPN-QGPMSJSTSA-N 1 1 356.426 2.641 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3Cc4cccc(O)c4C3)o2)cc1 ZINC000429224968 513308828 /nfs/dbraw/zinc/30/88/28/513308828.db2.gz CJLBYIVRNAILJV-CYBMUJFWSA-N 1 1 352.350 2.607 20 5 FFBDMO C[C@@H](C(=O)N(C)c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440481395 513330803 /nfs/dbraw/zinc/33/08/03/513330803.db2.gz ARZVMLDUYWHVNQ-LSDHHAIUSA-N 1 1 369.425 2.528 20 5 FFBDMO C[C@@H](C(=O)N(C)c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440481395 513330808 /nfs/dbraw/zinc/33/08/08/513330808.db2.gz ARZVMLDUYWHVNQ-LSDHHAIUSA-N 1 1 369.425 2.528 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@H]3Cc4cccc(O)c4C3)n2)c1 ZINC000429317165 513337721 /nfs/dbraw/zinc/33/77/21/513337721.db2.gz XPPXCBCZSGPMTN-ZDUSSCGKSA-N 1 1 352.350 2.607 20 5 FFBDMO C[C@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000450808374 513351645 /nfs/dbraw/zinc/35/16/45/513351645.db2.gz IHZRKFKSUDASSV-OAHLLOKOSA-N 1 1 368.437 2.652 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H]1C(C)C ZINC000429396426 513364404 /nfs/dbraw/zinc/36/44/04/513364404.db2.gz WMKFHDJMMAXRGZ-YOEHRIQHSA-N 1 1 366.414 2.502 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425003994 513364356 /nfs/dbraw/zinc/36/43/56/513364356.db2.gz MULJEIJCCBKNJP-AZUAARDMSA-N 1 1 365.433 2.870 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000421739252 513397989 /nfs/dbraw/zinc/39/79/89/513397989.db2.gz AAAVMLJQFXJFDQ-INIZCTEOSA-N 1 1 363.458 2.688 20 5 FFBDMO Cc1ccc([C@@H]2CCC[C@H]2[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000441358267 513551579 /nfs/dbraw/zinc/55/15/79/513551579.db2.gz VBPIHOAOPHWRNW-CEXWTWQISA-N 1 1 358.442 2.729 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H]2CCC[N@@H+]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435329468 513557737 /nfs/dbraw/zinc/55/77/37/513557737.db2.gz PQOOLYBUZURWFP-NSHDSACASA-N 1 1 371.235 2.881 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCO[C@@H]1C ZINC000425467613 513581817 /nfs/dbraw/zinc/58/18/17/513581817.db2.gz BTVHMGLPICWUMY-BXUZGUMPSA-N 1 1 373.247 2.983 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCO[C@@H]1C ZINC000425467613 513581819 /nfs/dbraw/zinc/58/18/19/513581819.db2.gz BTVHMGLPICWUMY-BXUZGUMPSA-N 1 1 373.247 2.983 20 5 FFBDMO CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2OC)CC[N@H+]1CCOC ZINC000430202444 513586351 /nfs/dbraw/zinc/58/63/51/513586351.db2.gz CTDNGRFRDJNTRA-KRWDZBQOSA-N 1 1 351.447 2.536 20 5 FFBDMO NC(=O)c1cccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000451203386 513586740 /nfs/dbraw/zinc/58/67/40/513586740.db2.gz PUMPROWMVMXAGP-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO CC[NH+](CC)CCOC1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430234399 513594732 /nfs/dbraw/zinc/59/47/32/513594732.db2.gz AAORECJVQAOIJU-UHFFFAOYSA-N 1 1 365.474 2.926 20 5 FFBDMO COC(=O)c1cnc([C@H](C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000425490817 513596238 /nfs/dbraw/zinc/59/62/38/513596238.db2.gz PVGOVVGTIAWRMA-JTQLQIEISA-N 1 1 351.384 2.568 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)CCc1ccc([N+](=O)[O-])cc1 ZINC000425542412 513629258 /nfs/dbraw/zinc/62/92/58/513629258.db2.gz NPQRCTXPUOHCPC-UHFFFAOYSA-N 1 1 367.405 2.755 20 5 FFBDMO CN(C(=O)C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000425558453 513639634 /nfs/dbraw/zinc/63/96/34/513639634.db2.gz XQPKCVCLJFOORZ-LJQANCHMSA-N 1 1 373.453 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@@H]3[C@@H]3CCCOC3)co2)cc1 ZINC000451302937 513663829 /nfs/dbraw/zinc/66/38/29/513663829.db2.gz LNBRRMVPEVDKEE-ZTFGCOKTSA-N 1 1 373.409 2.612 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H]1COc1ccccc1 ZINC000451310743 513667910 /nfs/dbraw/zinc/66/79/10/513667910.db2.gz GMYZLQOMHCPPQX-IRXDYDNUSA-N 1 1 372.421 2.878 20 5 FFBDMO Cc1cc(OCC(=O)Nc2c[nH+]ccc2-n2cccn2)ccc1[N+](=O)[O-] ZINC000430544816 513681157 /nfs/dbraw/zinc/68/11/57/513681157.db2.gz GWYCYMLWDVLUHG-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451414732 513734189 /nfs/dbraw/zinc/73/41/89/513734189.db2.gz IVTUBVANNDYIPN-CGTJXYLNSA-N 1 1 361.442 2.857 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451417259 513738569 /nfs/dbraw/zinc/73/85/69/513738569.db2.gz KYOCQLBIZNWGDC-CGTJXYLNSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCSC[C@H]2C2CCC2)c1 ZINC000419363172 513788628 /nfs/dbraw/zinc/78/86/28/513788628.db2.gz OPPSIOBOAPLGPR-RDJZCZTQSA-N 1 1 352.456 2.552 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCNCC12CCCCC2 ZINC000431067508 513818768 /nfs/dbraw/zinc/81/87/68/513818768.db2.gz FIPXPDPFWDLOKU-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCNCC12CCCCC2 ZINC000431067508 513818777 /nfs/dbraw/zinc/81/87/77/513818777.db2.gz FIPXPDPFWDLOKU-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO CCOCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549683 513825890 /nfs/dbraw/zinc/82/58/90/513825890.db2.gz QCNRZUDXXDSVGS-WBVHZDCISA-N 1 1 363.458 2.706 20 5 FFBDMO C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000448703567 513853991 /nfs/dbraw/zinc/85/39/91/513853991.db2.gz BYEXIWITJSVDGP-GJZGRUSLSA-N 1 1 361.442 2.794 20 5 FFBDMO C[N@@H+](CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000448776476 513892987 /nfs/dbraw/zinc/89/29/87/513892987.db2.gz GTMXVBMSOFKUSD-UHFFFAOYSA-N 1 1 369.421 2.806 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448780732 513896326 /nfs/dbraw/zinc/89/63/26/513896326.db2.gz KWJHYYACJWRNQQ-HUUCEWRRSA-N 1 1 361.442 2.794 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000443444984 513972672 /nfs/dbraw/zinc/97/26/72/513972672.db2.gz QFGIGPSBYPUVAF-ZDUSSCGKSA-N 1 1 372.416 2.882 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000448923417 513972725 /nfs/dbraw/zinc/97/27/25/513972725.db2.gz FUIJROUCKZXKHO-HNNXBMFYSA-N 1 1 359.426 2.691 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCN(CC(F)(F)F)CC1 ZINC000452027477 514144239 /nfs/dbraw/zinc/14/42/39/514144239.db2.gz ABLYPZMYSLEKHO-UHFFFAOYSA-N 1 1 371.363 2.930 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2CCC[N@H+]2CCCO)o1 ZINC000449384823 514189589 /nfs/dbraw/zinc/18/95/89/514189589.db2.gz CTVVXXLAWMMDQJ-HNNXBMFYSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)o1 ZINC000449384823 514189591 /nfs/dbraw/zinc/18/95/91/514189591.db2.gz CTVVXXLAWMMDQJ-HNNXBMFYSA-N 1 1 359.426 2.791 20 5 FFBDMO COC(=O)[C@@H]1CSCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000414580272 514191675 /nfs/dbraw/zinc/19/16/75/514191675.db2.gz JPLRHBRIYBSMRA-NRUITVPNSA-N 1 1 350.440 2.836 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000420609326 514200040 /nfs/dbraw/zinc/20/00/40/514200040.db2.gz GTOTYNVMQCWOLT-LBPRGKRZSA-N 1 1 360.439 2.638 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000420635585 514209347 /nfs/dbraw/zinc/20/93/47/514209347.db2.gz ZSEQEAUUPAGQQX-CYBMUJFWSA-N 1 1 369.425 2.611 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000449550063 514250715 /nfs/dbraw/zinc/25/07/15/514250715.db2.gz BXERSONCJLPBDB-IPYPFGDCSA-N 1 1 350.415 2.595 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000437856672 514253928 /nfs/dbraw/zinc/25/39/28/514253928.db2.gz YGFRQINPSNYTGC-OAHLLOKOSA-N 1 1 371.441 2.998 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000437856672 514253934 /nfs/dbraw/zinc/25/39/34/514253934.db2.gz YGFRQINPSNYTGC-OAHLLOKOSA-N 1 1 371.441 2.998 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000437856672 514253941 /nfs/dbraw/zinc/25/39/41/514253941.db2.gz YGFRQINPSNYTGC-OAHLLOKOSA-N 1 1 371.441 2.998 20 5 FFBDMO C[N@H+](Cc1cc(F)cc(F)c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000444697799 514297872 /nfs/dbraw/zinc/29/78/72/514297872.db2.gz ZAVWZGNFQACLAW-INIZCTEOSA-N 1 1 352.337 2.745 20 5 FFBDMO C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677695 514298866 /nfs/dbraw/zinc/29/88/66/514298866.db2.gz NKYLZBUTRPWCKW-BLLLJJGKSA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677695 514298872 /nfs/dbraw/zinc/29/88/72/514298872.db2.gz NKYLZBUTRPWCKW-BLLLJJGKSA-N 1 1 363.439 2.690 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc2c(cc[nH+]c2N(C)C)c1 ZINC000452358731 514307677 /nfs/dbraw/zinc/30/76/77/514307677.db2.gz UHDBYQIIDIUJME-UHFFFAOYSA-N 1 1 368.397 2.743 20 5 FFBDMO C[C@@H]1CN(CCO)CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788681 514353208 /nfs/dbraw/zinc/35/32/08/514353208.db2.gz YLCVBJZNTUWHOG-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1C[N@H+](CCO)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788681 514353221 /nfs/dbraw/zinc/35/32/21/514353221.db2.gz YLCVBJZNTUWHOG-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449788681 514353228 /nfs/dbraw/zinc/35/32/28/514353228.db2.gz YLCVBJZNTUWHOG-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000449969565 514448059 /nfs/dbraw/zinc/44/80/59/514448059.db2.gz RPQIBWFKHWITQN-CQSZACIVSA-N 1 1 369.425 2.543 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C[C@H]1C ZINC000449971137 514448159 /nfs/dbraw/zinc/44/81/59/514448159.db2.gz JSYSWFMKGGLGER-ZBFHGGJFSA-N 1 1 371.441 2.725 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCC[N@@H+]2Cc2ccccc2)n1 ZINC000445583323 514495567 /nfs/dbraw/zinc/49/55/67/514495567.db2.gz MZNQLJQWSGFOPW-CYBMUJFWSA-N 1 1 354.370 2.715 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC000445583323 514495570 /nfs/dbraw/zinc/49/55/70/514495570.db2.gz MZNQLJQWSGFOPW-CYBMUJFWSA-N 1 1 354.370 2.715 20 5 FFBDMO C[N@@H+](CC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCSC1 ZINC000452863715 514523260 /nfs/dbraw/zinc/52/32/60/514523260.db2.gz VXOXRWBQHVYDDD-DOTOQJQBSA-N 1 1 363.483 2.738 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000470675937 514569686 /nfs/dbraw/zinc/56/96/86/514569686.db2.gz VVPICTIVNRTSAV-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)cc1SC ZINC000458157609 514589235 /nfs/dbraw/zinc/58/92/35/514589235.db2.gz CTJWHIUHRBTCMU-GFCCVEGCSA-N 1 1 367.471 2.787 20 5 FFBDMO CC(C)[C@@H]1[C@@H](C(C)C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000453023697 514605947 /nfs/dbraw/zinc/60/59/47/514605947.db2.gz CJHJBNRLDLFVPK-IAGOWNOFSA-N 1 1 354.472 2.981 20 5 FFBDMO CC(C)[C@@H]1[C@@H](C(C)C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000453023697 514605948 /nfs/dbraw/zinc/60/59/48/514605948.db2.gz CJHJBNRLDLFVPK-IAGOWNOFSA-N 1 1 354.472 2.981 20 5 FFBDMO CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475307868 514613144 /nfs/dbraw/zinc/61/31/44/514613144.db2.gz IGHCWKAVUHFAGQ-LJQANCHMSA-N 1 1 353.422 2.870 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000461634260 514677716 /nfs/dbraw/zinc/67/77/16/514677716.db2.gz VYWRJUDQVFYUND-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO COc1c(C)cc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1C ZINC000453580181 514699289 /nfs/dbraw/zinc/69/92/89/514699289.db2.gz SKNDEURMXGBUDD-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)ccc1[N+](=O)[O-] ZINC000489140996 514726320 /nfs/dbraw/zinc/72/63/20/514726320.db2.gz REJTYNGNMXVTFG-CQSZACIVSA-N 1 1 357.414 2.521 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000471054154 514734447 /nfs/dbraw/zinc/73/44/47/514734447.db2.gz UVRHPYVJHRCZIH-UHFFFAOYSA-N 1 1 370.409 2.659 20 5 FFBDMO Cc1cc(NC[C@H](C)[NH+]2CCN(C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461783347 514735286 /nfs/dbraw/zinc/73/52/86/514735286.db2.gz DUWFZAHZATXXDT-LBPRGKRZSA-N 1 1 360.380 2.970 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2cccs2)cc1[N+](=O)[O-] ZINC000475708639 514772220 /nfs/dbraw/zinc/77/22/20/514772220.db2.gz GXDSBJDGVJMLLY-UHFFFAOYSA-N 1 1 364.423 2.883 20 5 FFBDMO Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461948223 514800899 /nfs/dbraw/zinc/80/08/99/514800899.db2.gz MHGQEEDSDGGBPY-GJZGRUSLSA-N 1 1 359.348 2.831 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461965811 514808342 /nfs/dbraw/zinc/80/83/42/514808342.db2.gz NWXVXXNPLWQGKW-ZDUSSCGKSA-N 1 1 374.363 2.674 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000467018945 514865964 /nfs/dbraw/zinc/86/59/64/514865964.db2.gz QXCAQBIOZZFGKK-NHYWBVRUSA-N 1 1 372.450 2.931 20 5 FFBDMO Cc1cccc(NCCNc2ncc([N+](=O)[O-])cc2Br)[nH+]1 ZINC000485137206 514931626 /nfs/dbraw/zinc/93/16/26/514931626.db2.gz VLLJTKIUBAJFAP-UHFFFAOYSA-N 1 1 352.192 2.980 20 5 FFBDMO Cc1ccc(CN2CC[C@@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000480472519 514970305 /nfs/dbraw/zinc/97/03/05/514970305.db2.gz VWNAMWTXFGCCHQ-GOSISDBHSA-N 1 1 357.385 2.933 20 5 FFBDMO COc1ccc(Br)cc1C[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000471700107 514986847 /nfs/dbraw/zinc/98/68/47/514986847.db2.gz HIPCFNZHTURKIB-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO COc1ccc(Br)cc1C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000471700107 514986855 /nfs/dbraw/zinc/98/68/55/514986855.db2.gz HIPCFNZHTURKIB-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCN(c2cccnn2)CC1 ZINC000509024642 514993816 /nfs/dbraw/zinc/99/38/16/514993816.db2.gz XQSIOAVUDXIDOT-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCN(c2cccnn2)CC1 ZINC000509024642 514993824 /nfs/dbraw/zinc/99/38/24/514993824.db2.gz XQSIOAVUDXIDOT-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000480581399 515006562 /nfs/dbraw/zinc/00/65/62/515006562.db2.gz BPVSHUCPLSRDOM-SJORKVTESA-N 1 1 369.421 2.739 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000485358980 515009214 /nfs/dbraw/zinc/00/92/14/515009214.db2.gz WWYSWZJPSHJPKL-UHFFFAOYSA-N 1 1 360.458 2.801 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)C[NH+]1CCOCC1 ZINC000485397797 515023405 /nfs/dbraw/zinc/02/34/05/515023405.db2.gz CMZJHUMIUXLDJH-AWEZNQCLSA-N 1 1 374.416 2.598 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000489977126 515054755 /nfs/dbraw/zinc/05/47/55/515054755.db2.gz DQZLDRMLMUXANS-NEPJUHHUSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467397 515192211 /nfs/dbraw/zinc/19/22/11/515192211.db2.gz XAHDSFGYPUHULR-ZMYBRWDISA-N 1 1 369.421 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467397 515192219 /nfs/dbraw/zinc/19/22/19/515192219.db2.gz XAHDSFGYPUHULR-ZMYBRWDISA-N 1 1 369.421 2.896 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000481388073 515312021 /nfs/dbraw/zinc/31/20/21/515312021.db2.gz CNZRFEKFJSZRIW-CABCVRRESA-N 1 1 369.487 2.705 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000499670365 515405846 /nfs/dbraw/zinc/40/58/46/515405846.db2.gz QJEBOZBGKXSUGW-INIZCTEOSA-N 1 1 371.441 2.775 20 5 FFBDMO COCC[N@@H+](C)CC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1 ZINC000505053915 515437470 /nfs/dbraw/zinc/43/74/70/515437470.db2.gz JWLCKEVMPIBSJM-HNNXBMFYSA-N 1 1 361.398 2.627 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000486439926 515483195 /nfs/dbraw/zinc/48/31/95/515483195.db2.gz VIMMPLXQXQANTL-CYBMUJFWSA-N 1 1 359.373 2.965 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-] ZINC000477621222 515529551 /nfs/dbraw/zinc/52/95/51/515529551.db2.gz KONVGNKFUYBNCP-UHFFFAOYSA-N 1 1 368.231 2.657 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505572321 515589908 /nfs/dbraw/zinc/58/99/08/515589908.db2.gz JADKNMMEMBBTOF-HNNXBMFYSA-N 1 1 371.441 2.790 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000494068633 515723747 /nfs/dbraw/zinc/72/37/47/515723747.db2.gz JAFNWAUNPSJCKU-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCc3cccs3)CC2)cc([N+](=O)[O-])c1 ZINC000500545094 515761290 /nfs/dbraw/zinc/76/12/90/515761290.db2.gz ARRMSHPJLJAZTA-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO C[C@@H](C(=O)NCc1ccccc1F)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073840 515767575 /nfs/dbraw/zinc/76/75/75/515767575.db2.gz NDCYOKARWQKOFI-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073840 515767582 /nfs/dbraw/zinc/76/75/82/515767582.db2.gz NDCYOKARWQKOFI-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694410 515773068 /nfs/dbraw/zinc/77/30/68/515773068.db2.gz WGOBDFGNOQNPAH-UONOGXRCSA-N 1 1 373.457 2.988 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694410 515773076 /nfs/dbraw/zinc/77/30/76/515773076.db2.gz WGOBDFGNOQNPAH-UONOGXRCSA-N 1 1 373.457 2.988 20 5 FFBDMO C[N@H+](CCCS(=O)(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511089288 515774161 /nfs/dbraw/zinc/77/41/61/515774161.db2.gz FVDYLCLYMTZNJL-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO C[N@@H+](CCCS(=O)(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511089288 515774166 /nfs/dbraw/zinc/77/41/66/515774166.db2.gz FVDYLCLYMTZNJL-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)CCc1ccccc1[N+](=O)[O-] ZINC000511139199 515800308 /nfs/dbraw/zinc/80/03/08/515800308.db2.gz HFFAPYVUGGJKIT-UHFFFAOYSA-N 1 1 367.405 2.755 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459785314 515804438 /nfs/dbraw/zinc/80/44/38/515804438.db2.gz ARDLZGBLSGFTRL-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459785314 515804442 /nfs/dbraw/zinc/80/44/42/515804442.db2.gz ARDLZGBLSGFTRL-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459812363 515823833 /nfs/dbraw/zinc/82/38/33/515823833.db2.gz VLOZPKYRHHFBSH-FUHWJXTLSA-N 1 1 361.442 2.715 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459812363 515823841 /nfs/dbraw/zinc/82/38/41/515823841.db2.gz VLOZPKYRHHFBSH-FUHWJXTLSA-N 1 1 361.442 2.715 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)ccc1Cl ZINC000500757538 515846229 /nfs/dbraw/zinc/84/62/29/515846229.db2.gz IOJNRRYWLZPTQT-UHFFFAOYSA-N 1 1 350.762 2.663 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000474146941 515904129 /nfs/dbraw/zinc/90/41/29/515904129.db2.gz ZFCGWHGKUGYNAM-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)Nc2ccncc2[N+](=O)[O-])CCC1 ZINC000455037227 515911283 /nfs/dbraw/zinc/91/12/83/515911283.db2.gz IYSBNNGMVYSCNO-UHFFFAOYSA-N 1 1 369.425 2.588 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000511559769 515944661 /nfs/dbraw/zinc/94/46/61/515944661.db2.gz JIHIJVASVUCJIZ-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487925644 516035445 /nfs/dbraw/zinc/03/54/45/516035445.db2.gz WVQYQZZDGFOOKU-IAQYHMDHSA-N 1 1 366.849 2.573 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000511850937 516053406 /nfs/dbraw/zinc/05/34/06/516053406.db2.gz VOEMHLNQVVOVCC-UHFFFAOYSA-N 1 1 351.794 2.643 20 5 FFBDMO C[C@]1(c2ccc(F)cc2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000483407396 516074611 /nfs/dbraw/zinc/07/46/11/516074611.db2.gz OCIHAJFUXPQZMQ-IBGZPJMESA-N 1 1 357.385 2.996 20 5 FFBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)C1 ZINC000465184853 516088272 /nfs/dbraw/zinc/08/82/72/516088272.db2.gz LAEKXTNOKLXCBN-ZDUSSCGKSA-N 1 1 358.398 2.896 20 5 FFBDMO COC(=O)C(C)(C)N1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000470202793 516169994 /nfs/dbraw/zinc/16/99/94/516169994.db2.gz LJBKCAVXYVDUIJ-NTCAYCPXSA-N 1 1 361.442 2.567 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000470203755 516171596 /nfs/dbraw/zinc/17/15/96/516171596.db2.gz FBKSNTAYBSCNBY-YRBHFNIASA-N 1 1 371.359 2.999 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000535659940 516439889 /nfs/dbraw/zinc/43/98/89/516439889.db2.gz QRGJTCBJISGUTH-ZBFHGGJFSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000535659940 516439897 /nfs/dbraw/zinc/43/98/97/516439897.db2.gz QRGJTCBJISGUTH-ZBFHGGJFSA-N 1 1 362.817 2.762 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1c(F)cccc1[N+](=O)[O-] ZINC000561229099 516466153 /nfs/dbraw/zinc/46/61/53/516466153.db2.gz GYEYJJCXKRTFET-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO C[C@H]1COc2ccccc2C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000543875432 516475205 /nfs/dbraw/zinc/47/52/05/516475205.db2.gz BBBMCBVNSIKDQP-WMLDXEAASA-N 1 1 358.394 2.618 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000557919993 516505864 /nfs/dbraw/zinc/50/58/64/516505864.db2.gz LWKJLFIOTLZICD-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000557919993 516505869 /nfs/dbraw/zinc/50/58/69/516505869.db2.gz LWKJLFIOTLZICD-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544072354 516567285 /nfs/dbraw/zinc/56/72/85/516567285.db2.gz VCPAIHQGOYAHRG-FHLIZLRMSA-N 1 1 366.458 2.860 20 5 FFBDMO Cc1nc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000513697789 516722762 /nfs/dbraw/zinc/72/27/62/516722762.db2.gz RPYXIDXKUAFZHN-QGZVFWFLSA-N 1 1 355.398 2.855 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000561746953 516745899 /nfs/dbraw/zinc/74/58/99/516745899.db2.gz PKYREHZJSOSVTR-OFQRWUPVSA-N 1 1 361.442 2.796 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000551583042 516772750 /nfs/dbraw/zinc/77/27/50/516772750.db2.gz JEKBYPQWYZFOPG-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@H+]1C ZINC000536600036 516846659 /nfs/dbraw/zinc/84/66/59/516846659.db2.gz RNCCGJIGANFBLN-CVEARBPZSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@@H+]1C ZINC000536600036 516846668 /nfs/dbraw/zinc/84/66/68/516846668.db2.gz RNCCGJIGANFBLN-CVEARBPZSA-N 1 1 363.461 2.706 20 5 FFBDMO COC(=O)c1cccc(C[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000561970736 516854889 /nfs/dbraw/zinc/85/48/89/516854889.db2.gz DFPVDILANFUJOA-UHFFFAOYSA-N 1 1 360.366 2.688 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879801 516855949 /nfs/dbraw/zinc/85/59/49/516855949.db2.gz UGVOEKONXGITFT-ZBFHGGJFSA-N 1 1 371.441 2.725 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000544720365 516892719 /nfs/dbraw/zinc/89/27/19/516892719.db2.gz LLRWRMNDVGHDKP-MRXNPFEDSA-N 1 1 369.487 2.669 20 5 FFBDMO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046603 517019343 /nfs/dbraw/zinc/01/93/43/517019343.db2.gz WNMAEGFKFSBUJU-NWDGAFQWSA-N 1 1 360.370 2.617 20 5 FFBDMO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046603 517019350 /nfs/dbraw/zinc/01/93/50/517019350.db2.gz WNMAEGFKFSBUJU-NWDGAFQWSA-N 1 1 360.370 2.617 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000552059006 517055855 /nfs/dbraw/zinc/05/58/55/517055855.db2.gz IKXCMPVFERRHHX-UHFFFAOYSA-N 1 1 360.414 2.580 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000555684933 517063114 /nfs/dbraw/zinc/06/31/14/517063114.db2.gz SRLRTDBLKLQURZ-MRXNPFEDSA-N 1 1 363.801 2.563 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000545162541 517079836 /nfs/dbraw/zinc/07/98/36/517079836.db2.gz JTVQSXMSNLRJNU-UHFFFAOYSA-N 1 1 357.332 2.995 20 5 FFBDMO CC(C)n1ncc2cc(C[N@@H+]3CCc4ncc([N+](=O)[O-])cc4C3)cnc21 ZINC000541620863 517145711 /nfs/dbraw/zinc/14/57/11/517145711.db2.gz QJORGTIAFPEPQQ-UHFFFAOYSA-N 1 1 352.398 2.874 20 5 FFBDMO CC(C)n1ncc2cc(C[N@H+]3CCc4ncc([N+](=O)[O-])cc4C3)cnc21 ZINC000541620863 517145719 /nfs/dbraw/zinc/14/57/19/517145719.db2.gz QJORGTIAFPEPQQ-UHFFFAOYSA-N 1 1 352.398 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCc4cncnc4C3)o2)c1 ZINC000532955627 517221344 /nfs/dbraw/zinc/22/13/44/517221344.db2.gz SGEHKPQATKWXHF-UHFFFAOYSA-N 1 1 351.366 2.641 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCS(=O)(=O)C1 ZINC000537616858 517263567 /nfs/dbraw/zinc/26/35/67/517263567.db2.gz XVCZFGWXGKAQKC-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCS(=O)(=O)C1 ZINC000537616858 517263575 /nfs/dbraw/zinc/26/35/75/517263575.db2.gz XVCZFGWXGKAQKC-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@@H+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C2 ZINC000537635332 517271085 /nfs/dbraw/zinc/27/10/85/517271085.db2.gz NRUJZJVYSQVRLS-GOSISDBHSA-N 1 1 372.450 2.820 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@H+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C2 ZINC000537635332 517271094 /nfs/dbraw/zinc/27/10/94/517271094.db2.gz NRUJZJVYSQVRLS-GOSISDBHSA-N 1 1 372.450 2.820 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc(NC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000548885519 517278495 /nfs/dbraw/zinc/27/84/95/517278495.db2.gz KEHKFHPQEPPGOM-GOSISDBHSA-N 1 1 368.437 2.986 20 5 FFBDMO Cc1ncsc1C[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000533281039 517381923 /nfs/dbraw/zinc/38/19/23/517381923.db2.gz DFDLHNHVHAHUSY-UHFFFAOYSA-N 1 1 362.411 2.790 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000559758149 517415442 /nfs/dbraw/zinc/41/54/42/517415442.db2.gz ACJMRBWXNMSBGD-UHFFFAOYSA-N 1 1 359.373 2.731 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000549156834 517428468 /nfs/dbraw/zinc/42/84/68/517428468.db2.gz OEXLTHRISIREAS-AWEZNQCLSA-N 1 1 373.375 2.870 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000549156834 517428473 /nfs/dbraw/zinc/42/84/73/517428473.db2.gz OEXLTHRISIREAS-AWEZNQCLSA-N 1 1 373.375 2.870 20 5 FFBDMO CC[N@@H+](C)CCNc1c2cc(Br)ccc2ncc1[N+](=O)[O-] ZINC000538086994 517460596 /nfs/dbraw/zinc/46/05/96/517460596.db2.gz NQPNWXNVWUYKFS-UHFFFAOYSA-N 1 1 353.220 2.691 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[NH+]2CCN(c3ccc(Cl)cn3)CC2)c1 ZINC000520790266 517514143 /nfs/dbraw/zinc/51/41/43/517514143.db2.gz HBNKQGNXBGXSNS-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000538262760 517528747 /nfs/dbraw/zinc/52/87/47/517528747.db2.gz HZWLVNFSFVNEPQ-BSXFFOKHSA-N 1 1 363.458 2.906 20 5 FFBDMO COc1ccc2c(c1)CCC[N@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2 ZINC000556686085 517569964 /nfs/dbraw/zinc/56/99/64/517569964.db2.gz MHTMUKDUGLBXSN-GOSISDBHSA-N 1 1 372.421 2.792 20 5 FFBDMO CC(C)(C)[C@H]1CCC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000527284009 517614931 /nfs/dbraw/zinc/61/49/31/517614931.db2.gz VFHQADJVHYJKGF-BBRMVZONSA-N 1 1 359.426 2.985 20 5 FFBDMO COc1ccc(CC(=O)N2CCC(n3c[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000530297571 517689235 /nfs/dbraw/zinc/68/92/35/517689235.db2.gz FEQOIKUELKGQQI-UHFFFAOYSA-N 1 1 358.398 2.515 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000538750894 517763152 /nfs/dbraw/zinc/76/31/52/517763152.db2.gz FNSFDZXZCDFEHD-GFCCVEGCSA-N 1 1 366.414 2.776 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000538750894 517763161 /nfs/dbraw/zinc/76/31/61/517763161.db2.gz FNSFDZXZCDFEHD-GFCCVEGCSA-N 1 1 366.414 2.776 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542852607 517783089 /nfs/dbraw/zinc/78/30/89/517783089.db2.gz MCQDGQWDBBCHGQ-GFCCVEGCSA-N 1 1 371.384 2.904 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2COc3ccc(C)cc32)cc1[N+](=O)[O-] ZINC000530547283 517843082 /nfs/dbraw/zinc/84/30/82/517843082.db2.gz FSTAZOZKTSRSPF-OAHLLOKOSA-N 1 1 372.377 2.678 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000530553308 517846893 /nfs/dbraw/zinc/84/68/93/517846893.db2.gz HOJRBXZEUTVKRS-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000530553308 517846900 /nfs/dbraw/zinc/84/69/00/517846900.db2.gz HOJRBXZEUTVKRS-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000553785597 517904560 /nfs/dbraw/zinc/90/45/60/517904560.db2.gz GXIBDXRTQQWTOC-IYOUNJFTSA-N 1 1 372.469 2.971 20 5 FFBDMO C[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000553867778 517942823 /nfs/dbraw/zinc/94/28/23/517942823.db2.gz XBJUPRZPEYIFQP-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1CCCCC1 ZINC000517169442 518048528 /nfs/dbraw/zinc/04/85/28/518048528.db2.gz CTWVRKDCNNKPTQ-UHFFFAOYSA-N 1 1 352.410 2.701 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1 ZINC000554113724 518066220 /nfs/dbraw/zinc/06/62/20/518066220.db2.gz UZBZMQFNSPGZBU-QWQRMKEZSA-N 1 1 361.442 2.796 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000543437356 518090344 /nfs/dbraw/zinc/09/03/44/518090344.db2.gz UBVMRRDKWLVVFD-NEPJUHHUSA-N 1 1 369.263 2.981 20 5 FFBDMO CN(C)Cc1cc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000563806538 518132873 /nfs/dbraw/zinc/13/28/73/518132873.db2.gz ZOVISGJURFAUEI-UHFFFAOYSA-N 1 1 374.416 2.914 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042399 518134425 /nfs/dbraw/zinc/13/44/25/518134425.db2.gz GJSXODSGSCKGIR-GJZGRUSLSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042399 518134429 /nfs/dbraw/zinc/13/44/29/518134429.db2.gz GJSXODSGSCKGIR-GJZGRUSLSA-N 1 1 356.426 2.668 20 5 FFBDMO CCC[C@@H]1CN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000563849078 518148922 /nfs/dbraw/zinc/14/89/22/518148922.db2.gz HPARUKZBKHDBRX-MAUKXSAKSA-N 1 1 363.458 2.658 20 5 FFBDMO CCc1cccnc1[C@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000543594987 518149417 /nfs/dbraw/zinc/14/94/17/518149417.db2.gz KMUHZZKKTXULNR-ZDUSSCGKSA-N 1 1 363.439 2.677 20 5 FFBDMO CC(C)[N@@H+]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000563900295 518220218 /nfs/dbraw/zinc/22/02/18/518220218.db2.gz DYHVSBHHJUVCTA-HNNXBMFYSA-N 1 1 357.458 2.815 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000563900295 518220221 /nfs/dbraw/zinc/22/02/21/518220221.db2.gz DYHVSBHHJUVCTA-HNNXBMFYSA-N 1 1 357.458 2.815 20 5 FFBDMO CC(C)Cc1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000578634602 518303255 /nfs/dbraw/zinc/30/32/55/518303255.db2.gz BOXKIDKIGRXFTE-OAHLLOKOSA-N 1 1 359.430 2.549 20 5 FFBDMO CN(C(=O)CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000569860825 518328865 /nfs/dbraw/zinc/32/88/65/518328865.db2.gz LUTZCVKODPZLKE-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO CN(C(=O)CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000569860825 518328870 /nfs/dbraw/zinc/32/88/70/518328870.db2.gz LUTZCVKODPZLKE-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000567238923 518423311 /nfs/dbraw/zinc/42/33/11/518423311.db2.gz BGTZIKIVUTUYBX-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cn2cc[nH+]c12 ZINC000584799044 518483450 /nfs/dbraw/zinc/48/34/50/518483450.db2.gz JOXSDMSDUOWZND-UHFFFAOYSA-N 1 1 354.322 2.574 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1N1CC[NH+](CCCOCC(F)(F)F)CC1 ZINC000564594627 518517281 /nfs/dbraw/zinc/51/72/81/518517281.db2.gz IYOWTWSFRQZXHR-UHFFFAOYSA-N 1 1 365.327 2.825 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCCCC[C@H]1CCO ZINC000585754835 518585362 /nfs/dbraw/zinc/58/53/62/518585362.db2.gz FESQZTSUBZNIBH-AWEZNQCLSA-N 1 1 363.414 2.520 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2ccc3cn[nH]c3c2)n1 ZINC000585765419 518589673 /nfs/dbraw/zinc/58/96/73/518589673.db2.gz BRHHNNBAWBSKIS-NVXWUHKLSA-N 1 1 354.414 2.984 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000579300454 518613152 /nfs/dbraw/zinc/61/31/52/518613152.db2.gz HPGYJHRYBPVKHW-CYBMUJFWSA-N 1 1 352.435 2.523 20 5 FFBDMO CC(C)[C@H]1CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C2CC2)CC[N@H+]1C ZINC000576591285 518667174 /nfs/dbraw/zinc/66/71/74/518667174.db2.gz IIEPIGDCJODLFH-QGZVFWFLSA-N 1 1 370.457 2.965 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000573722004 518804254 /nfs/dbraw/zinc/80/42/54/518804254.db2.gz REIKPQCAJDCGRG-GASCZTMLSA-N 1 1 360.458 2.750 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)s1 ZINC000582610872 518837798 /nfs/dbraw/zinc/83/77/98/518837798.db2.gz CRWISVFFFMYGGI-ZDUSSCGKSA-N 1 1 362.455 2.887 20 5 FFBDMO C[C@H]1C[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000571019503 518887012 /nfs/dbraw/zinc/88/70/12/518887012.db2.gz GJLREGDKHUZYLS-LSDHHAIUSA-N 1 1 373.457 2.798 20 5 FFBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CCn1cc(Br)cn1 ZINC000588986297 518888862 /nfs/dbraw/zinc/88/88/62/518888862.db2.gz AVQZFUPXXTXFJM-UHFFFAOYSA-N 1 1 353.220 2.728 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000589581609 519035546 /nfs/dbraw/zinc/03/55/46/519035546.db2.gz QWWKIFOGMHKYID-MRXNPFEDSA-N 1 1 356.426 2.955 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000590022645 519131405 /nfs/dbraw/zinc/13/14/05/519131405.db2.gz QCZZAICLZXTATL-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1cncc(/C=C\CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000571758729 519261565 /nfs/dbraw/zinc/26/15/65/519261565.db2.gz UJHZLZVTXFAKMK-ZENLRNHISA-N 1 1 369.425 2.983 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000590579366 519273578 /nfs/dbraw/zinc/27/35/78/519273578.db2.gz YSMFMZLILOKTIC-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)Cc1ccccc1 ZINC000571834757 519299993 /nfs/dbraw/zinc/29/99/93/519299993.db2.gz CFGBLFAIDLKTNE-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCCN(c3nc(N4CCOCC4)cc[nH+]3)C2)cc1 ZINC000590717447 519332122 /nfs/dbraw/zinc/33/21/22/519332122.db2.gz PSNCJSDNWHUDMZ-MRXNPFEDSA-N 1 1 369.425 2.605 20 5 FFBDMO CC(C)(C)c1csc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000569351219 519507136 /nfs/dbraw/zinc/50/71/36/519507136.db2.gz UJFUNYDYNWZJNV-GFCCVEGCSA-N 1 1 365.455 2.878 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000584035932 519558202 /nfs/dbraw/zinc/55/82/02/519558202.db2.gz LGAPSXCQEKSPBO-JTQLQIEISA-N 1 1 358.345 2.754 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000584035932 519558210 /nfs/dbraw/zinc/55/82/10/519558210.db2.gz LGAPSXCQEKSPBO-JTQLQIEISA-N 1 1 358.345 2.754 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000602872300 519939505 /nfs/dbraw/zinc/93/95/05/519939505.db2.gz BTZRUEIJLNRKOQ-KRWDZBQOSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000602894095 519957182 /nfs/dbraw/zinc/95/71/82/519957182.db2.gz YKBGAXPLMZRILQ-GFCCVEGCSA-N 1 1 371.363 2.930 20 5 FFBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000602894095 519957190 /nfs/dbraw/zinc/95/71/90/519957190.db2.gz YKBGAXPLMZRILQ-GFCCVEGCSA-N 1 1 371.363 2.930 20 5 FFBDMO COc1ccc(C[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H](C)CCCO)cc1 ZINC000602966939 519997528 /nfs/dbraw/zinc/99/75/28/519997528.db2.gz WSQJTAJVEIWVNI-AWEZNQCLSA-N 1 1 362.430 2.500 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H](C)CCCO)cc1 ZINC000602966939 519997532 /nfs/dbraw/zinc/99/75/32/519997532.db2.gz WSQJTAJVEIWVNI-AWEZNQCLSA-N 1 1 362.430 2.500 20 5 FFBDMO COc1cc(C[NH2+][C@@H]2CCOc3c(OC)cccc32)c([N+](=O)[O-])cc1O ZINC000594524494 520014510 /nfs/dbraw/zinc/01/45/10/520014510.db2.gz ZBZCMYRQXLCCFJ-CYBMUJFWSA-N 1 1 360.366 2.931 20 5 FFBDMO COC(=O)c1cc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000594592792 520042726 /nfs/dbraw/zinc/04/27/26/520042726.db2.gz XGNNIKSKPQBIJS-MELADBBJSA-N 1 1 365.430 2.599 20 5 FFBDMO COC(=O)c1cc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000594592792 520042732 /nfs/dbraw/zinc/04/27/32/520042732.db2.gz XGNNIKSKPQBIJS-MELADBBJSA-N 1 1 365.430 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCC[C@H]4CCOC4)CC3)nc2c1 ZINC000592101654 520184201 /nfs/dbraw/zinc/18/42/01/520184201.db2.gz CUTFUNWOCRAQGI-HNNXBMFYSA-N 1 1 373.457 2.800 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000600297367 520186816 /nfs/dbraw/zinc/18/68/16/520186816.db2.gz BLFJUJIGVBDBSF-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000600297367 520186823 /nfs/dbraw/zinc/18/68/23/520186823.db2.gz BLFJUJIGVBDBSF-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000600299149 520189566 /nfs/dbraw/zinc/18/95/66/520189566.db2.gz OZFIRBPUJVDWFI-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000600299149 520189576 /nfs/dbraw/zinc/18/95/76/520189576.db2.gz OZFIRBPUJVDWFI-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000600314172 520201345 /nfs/dbraw/zinc/20/13/45/520201345.db2.gz MFOBVCBHZZHDFA-OLZOCXBDSA-N 1 1 369.849 2.864 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000595003778 520252559 /nfs/dbraw/zinc/25/25/59/520252559.db2.gz JZUDNWCXPKGJLX-GDBMZVCRSA-N 1 1 351.447 2.611 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CN(CC(C)C)CCO1 ZINC000595003778 520252566 /nfs/dbraw/zinc/25/25/66/520252566.db2.gz JZUDNWCXPKGJLX-GDBMZVCRSA-N 1 1 351.447 2.611 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC1(N2CCCC2)CCOCC1 ZINC000595012862 520256932 /nfs/dbraw/zinc/25/69/32/520256932.db2.gz PJDILMGHFUKASL-OAHLLOKOSA-N 1 1 363.458 2.899 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C(=O)Nc1cccnc1C ZINC000595049132 520270090 /nfs/dbraw/zinc/27/00/90/520270090.db2.gz CAUJSGQYZIEFFZ-AAEUAGOBSA-N 1 1 358.398 2.985 20 5 FFBDMO Cn1cc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597859836 520285646 /nfs/dbraw/zinc/28/56/46/520285646.db2.gz YWNRNMBXZLQLJQ-OAHLLOKOSA-N 1 1 371.441 2.598 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609346756 520289828 /nfs/dbraw/zinc/28/98/28/520289828.db2.gz OROBMDCDUSDMPP-GASCZTMLSA-N 1 1 358.442 2.929 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000609471184 520323230 /nfs/dbraw/zinc/32/32/30/520323230.db2.gz HQIRNHGUJXSAGR-UHFFFAOYSA-N 1 1 364.446 2.537 20 5 FFBDMO CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597945579 520345006 /nfs/dbraw/zinc/34/50/06/520345006.db2.gz ITDLLUNPUSVAKO-WCQYABFASA-N 1 1 355.822 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCC[C@H]2CN2CCOCC2)cc1 ZINC000609541271 520352024 /nfs/dbraw/zinc/35/20/24/520352024.db2.gz YYIGCSGQYJXLCJ-SFHVURJKSA-N 1 1 363.458 2.550 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000609545879 520352800 /nfs/dbraw/zinc/35/28/00/520352800.db2.gz QZCVDDBAURIGFN-CQSZACIVSA-N 1 1 369.487 2.774 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000613178715 520371821 /nfs/dbraw/zinc/37/18/21/520371821.db2.gz WDYATMKAUVBNRW-MRXNPFEDSA-N 1 1 357.410 2.942 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000609657907 520396254 /nfs/dbraw/zinc/39/62/54/520396254.db2.gz QTWVBCFCHXINDW-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](CN1CCOCC1)c1ccccc1 ZINC000595412226 520453520 /nfs/dbraw/zinc/45/35/20/520453520.db2.gz WKCLOAGJWIJVQL-SFHVURJKSA-N 1 1 359.401 2.897 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595467032 520491425 /nfs/dbraw/zinc/49/14/25/520491425.db2.gz WZHCPFQSQPHATL-LJQANCHMSA-N 1 1 368.437 2.711 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000598220068 520501115 /nfs/dbraw/zinc/50/11/15/520501115.db2.gz OUSFSLOWGRWPMK-OAHLLOKOSA-N 1 1 361.442 2.805 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595522806 520527037 /nfs/dbraw/zinc/52/70/37/520527037.db2.gz OGSXXVMIRQYRFO-GOSISDBHSA-N 1 1 368.437 2.711 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C[C@@H]1C ZINC000610135392 520554644 /nfs/dbraw/zinc/55/46/44/520554644.db2.gz RADXFTVMNWARDZ-ZFWWWQNUSA-N 1 1 369.487 2.705 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3c(F)cccc3[N+](=O)[O-])sc2C1 ZINC000600966008 520561761 /nfs/dbraw/zinc/56/17/61/520561761.db2.gz FAXWNRONJFVIRH-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3c(F)cccc3[N+](=O)[O-])sc2C1 ZINC000600966008 520561776 /nfs/dbraw/zinc/56/17/76/520561776.db2.gz FAXWNRONJFVIRH-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO Cc1ccc(CNC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162185 520564619 /nfs/dbraw/zinc/56/46/19/520564619.db2.gz FWMAWSFKENIJMA-FQEVSTJZSA-N 1 1 355.438 2.630 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@@]2(O)CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162185 520564627 /nfs/dbraw/zinc/56/46/27/520564627.db2.gz FWMAWSFKENIJMA-FQEVSTJZSA-N 1 1 355.438 2.630 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000598341460 520564722 /nfs/dbraw/zinc/56/47/22/520564722.db2.gz BZXRNBKORAMFIP-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000598342466 520566307 /nfs/dbraw/zinc/56/63/07/520566307.db2.gz NPOZNSVIIWDZIH-ZDUSSCGKSA-N 1 1 360.439 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+](CCOCCO)C2CCC2)c1 ZINC000595596521 520580503 /nfs/dbraw/zinc/58/05/03/520580503.db2.gz NIHZJZZJJKKGHE-UHFFFAOYSA-N 1 1 362.348 2.977 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1c(F)cccc1[N+](=O)[O-] ZINC000600993863 520580963 /nfs/dbraw/zinc/58/09/63/520580963.db2.gz ONLFXIGVBFUBQS-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC2(CCC2)OC[C@@H]1C ZINC000595680528 520644810 /nfs/dbraw/zinc/64/48/10/520644810.db2.gz IKMHYSNSIIXDQH-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1cccc(OC)c1 ZINC000595683073 520645707 /nfs/dbraw/zinc/64/57/07/520645707.db2.gz FXWYHGVQMMEFKA-GOSISDBHSA-N 1 1 373.409 2.828 20 5 FFBDMO C[C@](CO)([NH2+]Cc1ccc(N2CCCC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000601150377 520661643 /nfs/dbraw/zinc/66/16/43/520661643.db2.gz WMKMOTPUDYSFKH-LJQANCHMSA-N 1 1 356.426 2.587 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)c2c1 ZINC000601171154 520671282 /nfs/dbraw/zinc/67/12/82/520671282.db2.gz GRKHMLQZNYWTRF-QGZVFWFLSA-N 1 1 361.423 2.548 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000601183149 520676196 /nfs/dbraw/zinc/67/61/96/520676196.db2.gz AGGBSJPQMMNTLM-DZGCQCFKSA-N 1 1 367.421 2.601 20 5 FFBDMO Cn1c(=O)ccc2c1CCC[C@@H]2Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601186534 520677345 /nfs/dbraw/zinc/67/73/45/520677345.db2.gz OMOCJZBAPNUNHS-INIZCTEOSA-N 1 1 350.378 2.753 20 5 FFBDMO CC(C)Oc1ccnc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000593019078 520688300 /nfs/dbraw/zinc/68/83/00/520688300.db2.gz PBMIHMAXMNDZAV-AWEZNQCLSA-N 1 1 357.414 2.858 20 5 FFBDMO CC(C)Oc1ccnc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000593019078 520688304 /nfs/dbraw/zinc/68/83/04/520688304.db2.gz PBMIHMAXMNDZAV-AWEZNQCLSA-N 1 1 357.414 2.858 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749849 520697617 /nfs/dbraw/zinc/69/76/17/520697617.db2.gz MACWTIKKFAIEKO-RTUWITSCSA-N 1 1 360.357 2.654 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749849 520697622 /nfs/dbraw/zinc/69/76/22/520697622.db2.gz MACWTIKKFAIEKO-RTUWITSCSA-N 1 1 360.357 2.654 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000595801031 520735480 /nfs/dbraw/zinc/73/54/80/520735480.db2.gz VPZARTFIKBNQEY-IRXDYDNUSA-N 1 1 360.458 2.968 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCOC(C3CC3)(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000595822361 520746836 /nfs/dbraw/zinc/74/68/36/520746836.db2.gz RXWGWZPRHVPWNP-UHFFFAOYSA-N 1 1 362.426 2.873 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOC(C3CC3)(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000595822361 520746843 /nfs/dbraw/zinc/74/68/43/520746843.db2.gz RXWGWZPRHVPWNP-UHFFFAOYSA-N 1 1 362.426 2.873 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645370 520758237 /nfs/dbraw/zinc/75/82/37/520758237.db2.gz INKMWNICLQAOIZ-JQWIXIFHSA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645370 520758241 /nfs/dbraw/zinc/75/82/41/520758241.db2.gz INKMWNICLQAOIZ-JQWIXIFHSA-N 1 1 360.357 2.655 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000595871969 520781490 /nfs/dbraw/zinc/78/14/90/520781490.db2.gz AOHKLSMQXNRHNI-UHFFFAOYSA-N 1 1 356.854 2.897 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593158655 520787229 /nfs/dbraw/zinc/78/72/29/520787229.db2.gz CKNWZVOOHIGKEP-UHFFFAOYSA-N 1 1 363.389 2.850 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000595908425 520812858 /nfs/dbraw/zinc/81/28/58/520812858.db2.gz IDJWRFCCRWMWEE-KDURUIRLSA-N 1 1 360.410 2.774 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000593188802 520813752 /nfs/dbraw/zinc/81/37/52/520813752.db2.gz QBULVCHSGGLTMK-AXFHLTTASA-N 1 1 370.247 2.910 20 5 FFBDMO CCS(=O)(=O)N(CCCn1cc[nH+]c1C)c1ccc([N+](=O)[O-])cc1C ZINC000598730541 520814206 /nfs/dbraw/zinc/81/42/06/520814206.db2.gz QISURJAAHVELEN-UHFFFAOYSA-N 1 1 366.443 2.655 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859767 520877357 /nfs/dbraw/zinc/87/73/57/520877357.db2.gz LYYOSSQMQVVDAD-GFCCVEGCSA-N 1 1 353.419 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859767 520877362 /nfs/dbraw/zinc/87/73/62/520877362.db2.gz LYYOSSQMQVVDAD-GFCCVEGCSA-N 1 1 353.419 2.677 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593321880 520907524 /nfs/dbraw/zinc/90/75/24/520907524.db2.gz JCGLLAHUZRPYRI-GOSISDBHSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000593321880 520907534 /nfs/dbraw/zinc/90/75/34/520907534.db2.gz JCGLLAHUZRPYRI-GOSISDBHSA-N 1 1 353.422 2.523 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596137768 520935030 /nfs/dbraw/zinc/93/50/30/520935030.db2.gz WIOKWAQVWVFWCU-QWRGUYRKSA-N 1 1 355.822 2.954 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596150504 520940093 /nfs/dbraw/zinc/94/00/93/520940093.db2.gz CALAZBNDOZAEPV-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO NC(=O)c1cc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)ccc1[N+](=O)[O-] ZINC000596204810 520969862 /nfs/dbraw/zinc/96/98/62/520969862.db2.gz YSQNCEBVYVVSIQ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO NC(=O)c1cc(NCC[N@H+]2CCc3c(Cl)cccc3C2)ccc1[N+](=O)[O-] ZINC000596204810 520969868 /nfs/dbraw/zinc/96/98/68/520969868.db2.gz YSQNCEBVYVVSIQ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO CCOc1cc(N2CCN(c3cc(CO)cc(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000596223044 520978529 /nfs/dbraw/zinc/97/85/29/520978529.db2.gz LEBNNLIATCYQJL-UHFFFAOYSA-N 1 1 372.425 2.516 20 5 FFBDMO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000599020011 520983357 /nfs/dbraw/zinc/98/33/57/520983357.db2.gz LRFKYXSGBIELGZ-INIZCTEOSA-N 1 1 356.426 2.834 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596258362 520998310 /nfs/dbraw/zinc/99/83/10/520998310.db2.gz ZLHUBICODDCBLR-NSHDSACASA-N 1 1 355.822 2.955 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596258362 520998314 /nfs/dbraw/zinc/99/83/14/520998314.db2.gz ZLHUBICODDCBLR-NSHDSACASA-N 1 1 355.822 2.955 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593454866 521003906 /nfs/dbraw/zinc/00/39/06/521003906.db2.gz NNEWNIJUYXKQJK-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000593479406 521020714 /nfs/dbraw/zinc/02/07/14/521020714.db2.gz DDXHVZVRYFHIBT-UHFFFAOYSA-N 1 1 373.457 2.949 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000611185036 521029098 /nfs/dbraw/zinc/02/90/98/521029098.db2.gz OOVYGDWAERFRHL-PXNSSMCTSA-N 1 1 371.437 2.856 20 5 FFBDMO Cn1c2cc(NC[C@@H]3CC[N@H+]3C3CCCCC3)c([N+](=O)[O-])cc2n(C)c1=O ZINC000599128379 521045472 /nfs/dbraw/zinc/04/54/72/521045472.db2.gz YVOYOHJSZSEFBL-AWEZNQCLSA-N 1 1 373.457 2.604 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000599138777 521049313 /nfs/dbraw/zinc/04/93/13/521049313.db2.gz FRWANQKSOYOMPO-ZDUSSCGKSA-N 1 1 373.438 2.999 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2CC[N@@H+]2Cc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000599139967 521051481 /nfs/dbraw/zinc/05/14/81/521051481.db2.gz QXURIXIBWHPDME-AWEZNQCLSA-N 1 1 359.430 2.586 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2CC[N@H+]2Cc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000599139967 521051487 /nfs/dbraw/zinc/05/14/87/521051487.db2.gz QXURIXIBWHPDME-AWEZNQCLSA-N 1 1 359.430 2.586 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593541461 521063092 /nfs/dbraw/zinc/06/30/92/521063092.db2.gz AXJCBNKSBAOPPA-CQSZACIVSA-N 1 1 351.422 2.761 20 5 FFBDMO CN(CC[N@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000611270913 521070980 /nfs/dbraw/zinc/07/09/80/521070980.db2.gz SQRIUKPYBHCXNN-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CN(CC[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000611270913 521070987 /nfs/dbraw/zinc/07/09/87/521070987.db2.gz SQRIUKPYBHCXNN-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274367 521072641 /nfs/dbraw/zinc/07/26/41/521072641.db2.gz HMPWKKVXTRWEGE-LBPRGKRZSA-N 1 1 364.398 2.530 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274367 521072645 /nfs/dbraw/zinc/07/26/45/521072645.db2.gz HMPWKKVXTRWEGE-LBPRGKRZSA-N 1 1 364.398 2.530 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000596498855 521100352 /nfs/dbraw/zinc/10/03/52/521100352.db2.gz IQNKEGSTJLWMDF-CYBMUJFWSA-N 1 1 350.394 2.977 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000593616331 521110223 /nfs/dbraw/zinc/11/02/23/521110223.db2.gz KNDSMZUWIRBRKI-UHFFFAOYSA-N 1 1 363.867 2.504 20 5 FFBDMO Cc1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000596537425 521121991 /nfs/dbraw/zinc/12/19/91/521121991.db2.gz FRKCCELBELLYQO-ZDUSSCGKSA-N 1 1 373.375 2.957 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596569608 521136426 /nfs/dbraw/zinc/13/64/26/521136426.db2.gz ACCFMCGFSUUTGX-AWEZNQCLSA-N 1 1 362.430 2.700 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596569705 521136993 /nfs/dbraw/zinc/13/69/93/521136993.db2.gz CQZXFQLNJGILRT-LBPRGKRZSA-N 1 1 369.263 2.708 20 5 FFBDMO CC(C)(C)Oc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000614829026 521160224 /nfs/dbraw/zinc/16/02/24/521160224.db2.gz BZZZSUAKLXOTQU-UHFFFAOYSA-N 1 1 351.447 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@H]2CCCC[N@H+]2CCO)C(F)(F)F)cc1 ZINC000593712020 521170089 /nfs/dbraw/zinc/17/00/89/521170089.db2.gz GOTKWBYNNHLOMT-CABCVRRESA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@H]2CCCC[N@@H+]2CCO)C(F)(F)F)cc1 ZINC000593712020 521170098 /nfs/dbraw/zinc/17/00/98/521170098.db2.gz GOTKWBYNNHLOMT-CABCVRRESA-N 1 1 361.364 2.635 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H]2CC[N@@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000599390054 521193281 /nfs/dbraw/zinc/19/32/81/521193281.db2.gz HPQXBHYKBVAOFM-ZDUSSCGKSA-N 1 1 373.500 2.650 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000599390054 521193287 /nfs/dbraw/zinc/19/32/87/521193287.db2.gz HPQXBHYKBVAOFM-ZDUSSCGKSA-N 1 1 373.500 2.650 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)[C@@]1(CO)CCOC1 ZINC000599395919 521198298 /nfs/dbraw/zinc/19/82/98/521198298.db2.gz LXMWFYQTFTWVGD-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccc1)[C@@]1(CO)CCOC1 ZINC000599395919 521198306 /nfs/dbraw/zinc/19/83/06/521198306.db2.gz LXMWFYQTFTWVGD-HXUWFJFHSA-N 1 1 372.421 2.757 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522875 521202217 /nfs/dbraw/zinc/20/22/17/521202217.db2.gz IJKGQUPMDJYLFU-HRBLRVMOSA-N 1 1 358.486 2.899 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611578668 521231972 /nfs/dbraw/zinc/23/19/72/521231972.db2.gz QXULITQCXLQXFH-ZDUSSCGKSA-N 1 1 357.357 2.935 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000599463104 521240683 /nfs/dbraw/zinc/24/06/83/521240683.db2.gz BXOVMHTULYNHJP-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(CNc2ncnc3ccc([N+](=O)[O-])cc32)c(N2CCCC2)[nH+]1 ZINC000611714409 521294984 /nfs/dbraw/zinc/29/49/84/521294984.db2.gz QLQVPDAZHLWGLB-UHFFFAOYSA-N 1 1 364.409 2.876 20 5 FFBDMO COC(=O)[C@@](C)(NCC[N@@H+]1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599651151 521362042 /nfs/dbraw/zinc/36/20/42/521362042.db2.gz HLBHHIAMIPDAES-KHYOSLBOSA-N 1 1 363.458 2.551 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000599684355 521399180 /nfs/dbraw/zinc/39/91/80/521399180.db2.gz NBZCTISSBVSIGZ-MNRXQERYSA-N 1 1 372.368 2.593 20 5 FFBDMO CCS(=O)(=O)C[C@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602543809 521404165 /nfs/dbraw/zinc/40/41/65/521404165.db2.gz AFHIEBQWINXCRK-VIFPVBQESA-N 1 1 354.350 2.526 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H](Cc3ccncc3)C1)OCCO2 ZINC000611983714 521419330 /nfs/dbraw/zinc/41/93/30/521419330.db2.gz CXFBAFAVSKHSNS-OAHLLOKOSA-N 1 1 355.394 2.826 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1C ZINC000599731744 521435031 /nfs/dbraw/zinc/43/50/31/521435031.db2.gz RAHWKOXGYKGHMJ-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000599731744 521435037 /nfs/dbraw/zinc/43/50/37/521435037.db2.gz RAHWKOXGYKGHMJ-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599739587 521441117 /nfs/dbraw/zinc/44/11/17/521441117.db2.gz NQTRZVPGPCWRDD-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000599739587 521441125 /nfs/dbraw/zinc/44/11/25/521441125.db2.gz NQTRZVPGPCWRDD-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000594197198 521462801 /nfs/dbraw/zinc/46/28/01/521462801.db2.gz AXHSBNSJFXCAKB-IRXDYDNUSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599829347 521498133 /nfs/dbraw/zinc/49/81/33/521498133.db2.gz FXVBWMTYEQWFEB-CYBMUJFWSA-N 1 1 357.414 2.995 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597094325 521499192 /nfs/dbraw/zinc/49/91/92/521499192.db2.gz DIQQYYQFLLXKBZ-SNVBAGLBSA-N 1 1 355.826 2.682 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[NH+]([C@@H](C)c2cccc(F)c2)CC1 ZINC000602797750 521538521 /nfs/dbraw/zinc/53/85/21/521538521.db2.gz DHQRBVFZYZMXOI-AWEZNQCLSA-N 1 1 361.421 2.618 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN([C@@H](C)c2cccc(F)c2)CC1 ZINC000602797750 521538525 /nfs/dbraw/zinc/53/85/25/521538525.db2.gz DHQRBVFZYZMXOI-AWEZNQCLSA-N 1 1 361.421 2.618 20 5 FFBDMO Cn1cc(C[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])n1 ZINC000602833888 521560147 /nfs/dbraw/zinc/56/01/47/521560147.db2.gz XDPWBYKNSXPKNU-CYBMUJFWSA-N 1 1 359.213 2.848 20 5 FFBDMO Cn1cc(C[NH2+][C@@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])n1 ZINC000602837361 521561997 /nfs/dbraw/zinc/56/19/97/521561997.db2.gz VJNHYMBNOSQWBE-ZDUSSCGKSA-N 1 1 358.320 2.560 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000619530283 521754699 /nfs/dbraw/zinc/75/46/99/521754699.db2.gz AOPUOIUMTNLZDB-QGZVFWFLSA-N 1 1 355.394 2.585 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000619530283 521754705 /nfs/dbraw/zinc/75/47/05/521754705.db2.gz AOPUOIUMTNLZDB-QGZVFWFLSA-N 1 1 355.394 2.585 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)ccc1Cl ZINC000619867100 521912076 /nfs/dbraw/zinc/91/20/76/521912076.db2.gz JVBLHTKITCSKAN-UHFFFAOYSA-N 1 1 369.830 2.986 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])s2)ccc1Cl ZINC000619867100 521912084 /nfs/dbraw/zinc/91/20/84/521912084.db2.gz JVBLHTKITCSKAN-UHFFFAOYSA-N 1 1 369.830 2.986 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC000736267996 598367617 /nfs/dbraw/zinc/36/76/17/598367617.db2.gz VUHPMPIIHYHJMU-LBPRGKRZSA-N 1 1 359.434 2.697 20 5 FFBDMO C[C@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000736027062 598676210 /nfs/dbraw/zinc/67/62/10/598676210.db2.gz WNHUJVOSJQGDBX-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820092428 607467578 /nfs/dbraw/zinc/46/75/78/607467578.db2.gz LPIAAYNYARXREY-ZDUSSCGKSA-N 1 1 359.434 2.555 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721714 720334087 /nfs/dbraw/zinc/33/40/87/720334087.db2.gz DBOXSGZSFROOPK-LSDHHAIUSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726101 720334334 /nfs/dbraw/zinc/33/43/34/720334334.db2.gz PSUQZVGVXFCUDF-CVEARBPZSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726101 720334338 /nfs/dbraw/zinc/33/43/38/720334338.db2.gz PSUQZVGVXFCUDF-CVEARBPZSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727321 720349162 /nfs/dbraw/zinc/34/91/62/720349162.db2.gz SUNFDVAHRDOQTI-UONOGXRCSA-N 1 1 359.817 2.891 20 5 FFBDMO COc1cc(C)nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164722584 720374153 /nfs/dbraw/zinc/37/41/53/720374153.db2.gz DOOAIGWTLNLREM-CVEARBPZSA-N 1 1 369.425 2.555 20 5 FFBDMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@H]2CN(c3cc([N+](=O)[O-])ccn3)CC[C@@H]21 ZINC001164837834 720509505 /nfs/dbraw/zinc/50/95/05/720509505.db2.gz PNZQHSILARIZJG-SZMVWBNQSA-N 1 1 370.457 2.564 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CCn2c(C[N@H+](C)C(C)C)cnc2[C@H]1C ZINC001164853523 720924361 /nfs/dbraw/zinc/92/43/61/720924361.db2.gz BMGVAFYMRLZDMM-CQSZACIVSA-N 1 1 358.446 2.916 20 5 FFBDMO CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926756 721855371 /nfs/dbraw/zinc/85/53/71/721855371.db2.gz JFJNMFVORBXGNZ-OALUTQOASA-N 1 1 361.493 2.998 20 5 FFBDMO C[NH+](C)CCN1CC[C@H]2[C@@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926756 721855373 /nfs/dbraw/zinc/85/53/73/721855373.db2.gz JFJNMFVORBXGNZ-OALUTQOASA-N 1 1 361.493 2.998 20 5 FFBDMO CCc1ccc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000747119165 735535458 /nfs/dbraw/zinc/53/54/58/735535458.db2.gz RXSIWKIYVHOPET-MRXNPFEDSA-N 1 1 350.415 2.671 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000170914836 728992103 /nfs/dbraw/zinc/99/21/03/728992103.db2.gz SFGGATKKRHPTTQ-AWEZNQCLSA-N 1 1 350.415 2.967 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000173638913 729051381 /nfs/dbraw/zinc/05/13/81/729051381.db2.gz UCOMXGQWRGVYJA-AWEZNQCLSA-N 1 1 368.865 2.993 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000252703379 729624864 /nfs/dbraw/zinc/62/48/64/729624864.db2.gz JTMOTBNUAHXNRE-MWLCHTKSSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000252703379 729624866 /nfs/dbraw/zinc/62/48/66/729624866.db2.gz JTMOTBNUAHXNRE-MWLCHTKSSA-N 1 1 357.204 2.598 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000861340487 730600773 /nfs/dbraw/zinc/60/07/73/730600773.db2.gz HYSXHYBICRLLNI-LRDDRELGSA-N 1 1 354.428 2.583 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000861349839 730603000 /nfs/dbraw/zinc/60/30/00/730603000.db2.gz WDWIFXKPTKHWGM-KDOFPFPSSA-N 1 1 350.415 2.984 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000925139036 738481112 /nfs/dbraw/zinc/48/11/12/738481112.db2.gz JDIPKXYXUQBFHD-UKRRQHHQSA-N 1 1 350.444 2.605 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])C[C@H]1C ZINC000866854647 731109129 /nfs/dbraw/zinc/10/91/29/731109129.db2.gz JGCVQWGVOUOELP-OLZOCXBDSA-N 1 1 373.450 2.536 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000866854649 731109175 /nfs/dbraw/zinc/10/91/75/731109175.db2.gz JGCVQWGVOUOELP-STQMWFEESA-N 1 1 373.450 2.536 20 5 FFBDMO C[C@@H]([NH2+]C[C@H](N1CCOCC1)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872071524 731726785 /nfs/dbraw/zinc/72/67/85/731726785.db2.gz QQKPBNKPKGSILT-MFKMUULPSA-N 1 1 365.327 2.648 20 5 FFBDMO C[C@@H]([NH2+]CCN1C[C@@H]2CCCCN2C1=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872088823 731728598 /nfs/dbraw/zinc/72/85/98/731728598.db2.gz RIRRSKVJUNPNIE-OLZOCXBDSA-N 1 1 350.394 2.675 20 5 FFBDMO CO[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878046454 732473870 /nfs/dbraw/zinc/47/38/70/732473870.db2.gz AGMAUBASJKPSLK-LLVKDONJSA-N 1 1 352.778 2.909 20 5 FFBDMO CO[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878046454 732473873 /nfs/dbraw/zinc/47/38/73/732473873.db2.gz AGMAUBASJKPSLK-LLVKDONJSA-N 1 1 352.778 2.909 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879561947 732724056 /nfs/dbraw/zinc/72/40/56/732724056.db2.gz XKXWIOBZDGXTBC-XQQFMLRXSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879561947 732724060 /nfs/dbraw/zinc/72/40/60/732724060.db2.gz XKXWIOBZDGXTBC-XQQFMLRXSA-N 1 1 365.455 2.615 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](C(F)(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000880053156 732834135 /nfs/dbraw/zinc/83/41/35/732834135.db2.gz PHKXUYILCXUEGN-ZDUSSCGKSA-N 1 1 361.320 2.577 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000885886582 733726108 /nfs/dbraw/zinc/72/61/08/733726108.db2.gz ZLZAOTJEEKIRPA-ZDUSSCGKSA-N 1 1 367.833 2.540 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827423 733845291 /nfs/dbraw/zinc/84/52/91/733845291.db2.gz KSVGEOFTWPFUNJ-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827423 733845295 /nfs/dbraw/zinc/84/52/95/733845295.db2.gz KSVGEOFTWPFUNJ-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000888834676 734103769 /nfs/dbraw/zinc/10/37/69/734103769.db2.gz NIEWIYQRLGJVBB-TZMCWYRMSA-N 1 1 350.419 2.940 20 5 FFBDMO CC(C)(C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000928095258 738821604 /nfs/dbraw/zinc/82/16/04/738821604.db2.gz NRZXRWZAGSHEPF-JKSUJKDBSA-N 1 1 363.483 2.568 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC000928431776 738868372 /nfs/dbraw/zinc/86/83/72/738868372.db2.gz OJTVZHCEBCXKIQ-IMTBSYHQSA-N 1 1 350.177 2.863 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CCO)c2cccs2)c2c(c1)COCO2 ZINC000740900064 735097566 /nfs/dbraw/zinc/09/75/66/735097566.db2.gz KSDNPCAIKBTNDP-AWEZNQCLSA-N 1 1 350.396 2.736 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCNCC[NH2+]CC3)o2)c(Cl)c1 ZINC000904396486 736248725 /nfs/dbraw/zinc/24/87/25/736248725.db2.gz INUCFNXWPLKXRT-UHFFFAOYSA-N 1 1 364.833 2.503 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000760550044 736649344 /nfs/dbraw/zinc/64/93/44/736649344.db2.gz LOTMMLAHLTWOGQ-UHFFFAOYSA-N 1 1 359.373 2.743 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507847 736741396 /nfs/dbraw/zinc/74/13/96/736741396.db2.gz ZDAUBYQAZIHWLU-OCCSQVGLSA-N 1 1 369.849 2.611 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000763677226 736958742 /nfs/dbraw/zinc/95/87/42/736958742.db2.gz VXGGOUJJYGSXMZ-GFCCVEGCSA-N 1 1 370.837 2.871 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCCS1(=O)=O ZINC000811484785 741528563 /nfs/dbraw/zinc/52/85/63/741528563.db2.gz KPNXNYVNWKZWDO-JTQLQIEISA-N 1 1 353.227 2.568 20 5 FFBDMO COCC1(C)CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000773727506 737931486 /nfs/dbraw/zinc/93/14/86/737931486.db2.gz MNGONQUZKFXNLV-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CC1 ZINC000774628375 738007031 /nfs/dbraw/zinc/00/70/31/738007031.db2.gz UNDXNUXDJLHEJG-JTQLQIEISA-N 1 1 366.805 2.829 20 5 FFBDMO CCN1CCC[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1=O ZINC000922638318 738177895 /nfs/dbraw/zinc/17/78/95/738177895.db2.gz AFOFIIQPIGCIOF-OAHLLOKOSA-N 1 1 360.439 2.819 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCS[C@@H]4COCC[C@H]43)c2)c1 ZINC000777963194 738335673 /nfs/dbraw/zinc/33/56/73/738335673.db2.gz IDFGLOMOXRFWEV-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCS[C@@H]4COCC[C@H]43)c2)c1 ZINC000777963194 738335676 /nfs/dbraw/zinc/33/56/76/738335676.db2.gz IDFGLOMOXRFWEV-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000784669621 738911453 /nfs/dbraw/zinc/91/14/53/738911453.db2.gz VRVZYPPNFYDFQO-GFCCVEGCSA-N 1 1 362.455 2.894 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000785732041 738992235 /nfs/dbraw/zinc/99/22/35/738992235.db2.gz IZFLLVHSGPOUPJ-QWRGUYRKSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)COC(=O)N1 ZINC000932020609 739374623 /nfs/dbraw/zinc/37/46/23/739374623.db2.gz IJRGEPFFXPYHCJ-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO Cc1c(CO[NH+]=C(N)CCNC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000789646089 739376254 /nfs/dbraw/zinc/37/62/54/739376254.db2.gz VXMNWRVDKQJFJB-UHFFFAOYSA-N 1 1 352.391 2.816 20 5 FFBDMO O=C1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCCCCN1 ZINC000934154291 739736893 /nfs/dbraw/zinc/73/68/93/739736893.db2.gz GFXOUHKWPFUARI-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO O=C1CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCCCCN1 ZINC000934154291 739736896 /nfs/dbraw/zinc/73/68/96/739736896.db2.gz GFXOUHKWPFUARI-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCSC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000934299081 739762369 /nfs/dbraw/zinc/76/23/69/739762369.db2.gz CCPXVGZCTYMEPJ-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801507844 740625434 /nfs/dbraw/zinc/62/54/34/740625434.db2.gz JFTQCSGACJEKIB-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801507844 740625435 /nfs/dbraw/zinc/62/54/35/740625435.db2.gz JFTQCSGACJEKIB-LLVKDONJSA-N 1 1 367.402 2.574 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000997767612 742024784 /nfs/dbraw/zinc/02/47/84/742024784.db2.gz INQRRHKUVFVJRX-IAGOWNOFSA-N 1 1 365.861 2.642 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1csc([N+](=O)[O-])c1 ZINC000817182145 742102353 /nfs/dbraw/zinc/10/23/53/742102353.db2.gz KZAIBEPLDAUASP-UHFFFAOYSA-N 1 1 362.407 2.846 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000817676529 742195158 /nfs/dbraw/zinc/19/51/58/742195158.db2.gz IMHOTVUBXUYUMU-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000821513399 742636861 /nfs/dbraw/zinc/63/68/61/742636861.db2.gz OCHPMLCXCIWPPX-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CN(CCCN(C)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC[NH+](C)C ZINC000821513399 742636866 /nfs/dbraw/zinc/63/68/66/742636866.db2.gz OCHPMLCXCIWPPX-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC[C@H]21 ZINC000827300396 743551524 /nfs/dbraw/zinc/55/15/24/743551524.db2.gz MQXLNXZWLBHPBT-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827311619 743553955 /nfs/dbraw/zinc/55/39/55/743553955.db2.gz QJMKOMBBXAGOKU-GWCFXTLKSA-N 1 1 368.231 2.524 20 5 FFBDMO CN(C)C(=O)O[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000830573796 745384204 /nfs/dbraw/zinc/38/42/04/745384204.db2.gz CDDCUHHYAUZDST-INIZCTEOSA-N 1 1 351.403 2.526 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)COc1ccc([N+](=O)[O-])c(F)c1F ZINC000834388039 745829282 /nfs/dbraw/zinc/82/92/82/745829282.db2.gz ODUCPGSHIWVAQD-ZDUSSCGKSA-N 1 1 352.337 2.745 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000836477788 746233744 /nfs/dbraw/zinc/23/37/44/746233744.db2.gz QBERNSDFWPQIAX-NSHDSACASA-N 1 1 371.235 2.915 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000838513980 746655503 /nfs/dbraw/zinc/65/55/03/746655503.db2.gz RIXMHIGDYIIDEA-ZDUSSCGKSA-N 1 1 354.838 2.874 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839470532 746833526 /nfs/dbraw/zinc/83/35/26/746833526.db2.gz PNZIQWBZOJRLCX-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839470532 746833529 /nfs/dbraw/zinc/83/35/29/746833529.db2.gz PNZIQWBZOJRLCX-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO COCCOC1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839494276 746839257 /nfs/dbraw/zinc/83/92/57/746839257.db2.gz OQTIBOBWMYLQAN-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO C[C@@H](C[NH+]1CCOCC1)N(C)Cc1cccc([N+](=O)[O-])c1Br ZINC000839591356 746865061 /nfs/dbraw/zinc/86/50/61/746865061.db2.gz XFUVRVLFNHQFEJ-LBPRGKRZSA-N 1 1 372.263 2.510 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCCCC[N@H+](C)C2CC2)c1[N+](=O)[O-] ZINC000840315679 747062520 /nfs/dbraw/zinc/06/25/20/747062520.db2.gz BNIHGSUHPMZLQV-UHFFFAOYSA-N 1 1 352.391 2.590 20 5 FFBDMO CCC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCNCC1 ZINC000843360727 747817620 /nfs/dbraw/zinc/81/76/20/747817620.db2.gz NAICPWSYJFQKQS-UHFFFAOYSA-N 1 1 352.410 2.527 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCNCC1 ZINC000843360727 747817624 /nfs/dbraw/zinc/81/76/24/747817624.db2.gz NAICPWSYJFQKQS-UHFFFAOYSA-N 1 1 352.410 2.527 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000843981555 747944833 /nfs/dbraw/zinc/94/48/33/747944833.db2.gz IVZNKNIMSWBXBN-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000845488556 748268355 /nfs/dbraw/zinc/26/83/55/748268355.db2.gz VFTSHTOQQIVJPS-ZDUSSCGKSA-N 1 1 370.856 2.994 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481180 748937105 /nfs/dbraw/zinc/93/71/05/748937105.db2.gz WGPRPBAMUSDAFB-SJORKVTESA-N 1 1 363.483 2.942 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481180 748937113 /nfs/dbraw/zinc/93/71/13/748937113.db2.gz WGPRPBAMUSDAFB-SJORKVTESA-N 1 1 363.483 2.942 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCO ZINC000852455999 749864063 /nfs/dbraw/zinc/86/40/63/749864063.db2.gz HMVUSVQQZSNFIB-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCO ZINC000852455999 749864071 /nfs/dbraw/zinc/86/40/71/749864071.db2.gz HMVUSVQQZSNFIB-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000854568495 750331131 /nfs/dbraw/zinc/33/11/31/750331131.db2.gz BGUDSTHVCZQWIS-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c1C ZINC000895667576 970835277 /nfs/dbraw/zinc/83/52/77/970835277.db2.gz BKXPNDNKJCDTDR-MRXNPFEDSA-N 1 1 361.442 2.539 20 5 FFBDMO COc1cc(C[NH+]2CCC(c3ccn(C)n3)CC2)c([N+](=O)[O-])cc1OC ZINC000896495690 971521166 /nfs/dbraw/zinc/52/11/66/971521166.db2.gz NQDQTLXGSHWOAP-UHFFFAOYSA-N 1 1 360.414 2.725 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2c(sc(N)c2-c2nn[nH]n2)C1 ZINC001575516581 949211781 /nfs/dbraw/zinc/21/17/81/949211781.db2.gz PYUJVGFTLWZITL-SECBINFHSA-N 1 1 371.426 2.538 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2c(sc(N)c2-c2nn[nH]n2)C1 ZINC001575516581 949211799 /nfs/dbraw/zinc/21/17/99/949211799.db2.gz PYUJVGFTLWZITL-SECBINFHSA-N 1 1 371.426 2.538 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)N(C)C(C)C)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121099484 961921995 /nfs/dbraw/zinc/92/19/95/961921995.db2.gz UVVCRRRCRIVVRJ-UHFFFAOYSA-N 1 1 373.457 2.789 20 5 FFBDMO CC(C)N(C(=O)[C@H](C)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)C ZINC000008474515 1013302664 /nfs/dbraw/zinc/30/26/64/1013302664.db2.gz WARDQJRNEWXGPP-INIZCTEOSA-N 1 1 362.474 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H](c3ccncc3)C3(CO)CCC3)nc2c1 ZINC001174891827 1013333312 /nfs/dbraw/zinc/33/33/12/1013333312.db2.gz XFDBMKQOEUHXMW-GOSISDBHSA-N 1 1 367.409 2.860 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC000706945726 963763672 /nfs/dbraw/zinc/76/36/72/963763672.db2.gz WCZFXRDEHBZWBJ-UHFFFAOYSA-N 1 1 355.369 2.692 20 5 FFBDMO CC(C)(C)c1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC000983653086 965654567 /nfs/dbraw/zinc/65/45/67/965654567.db2.gz GOOTVOZPDVDMBU-VDHUWJSZSA-N 1 1 359.470 2.634 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC001176028698 1013613664 /nfs/dbraw/zinc/61/36/64/1013613664.db2.gz OSFBSKQJAIIFJB-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000895005298 967151290 /nfs/dbraw/zinc/15/12/90/967151290.db2.gz WYXWEVQTOQVBML-LZVBJTEYSA-N 1 1 351.406 2.737 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1 ZINC001177008998 1013828680 /nfs/dbraw/zinc/82/86/80/1013828680.db2.gz UZCUWLRASISELQ-BGYRXZFFSA-N 1 1 373.453 2.689 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000892721386 970249244 /nfs/dbraw/zinc/24/92/44/970249244.db2.gz MGWXZGKLWZIVRJ-CQSZACIVSA-N 1 1 358.442 2.615 20 5 FFBDMO C[C@]1([C@@H]2CCCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)COC(=O)N1 ZINC000895531845 970707601 /nfs/dbraw/zinc/70/76/01/970707601.db2.gz MNFNGXJDMZTYAU-KZULUSFZSA-N 1 1 356.382 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@@H]4[C@@H]3CCC[N@@H+]4CCO)n2)cc1 ZINC000897219827 973456867 /nfs/dbraw/zinc/45/68/67/973456867.db2.gz OSXYDZICGXNUBY-SJORKVTESA-N 1 1 374.466 2.754 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC001211669855 974575679 /nfs/dbraw/zinc/57/56/79/974575679.db2.gz OJHJBGKQAMDVKN-UHFFFAOYSA-N 1 1 369.487 2.558 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000728834195 975058421 /nfs/dbraw/zinc/05/84/21/975058421.db2.gz RZYOSKLMPXJEIB-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2C1 ZINC000728834195 975058429 /nfs/dbraw/zinc/05/84/29/975058429.db2.gz RZYOSKLMPXJEIB-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000130165836 981193263 /nfs/dbraw/zinc/19/32/63/981193263.db2.gz LNGNFRUROINKGW-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO Nc1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc2ccccc2c1[N+](=O)[O-] ZINC000907789948 981294272 /nfs/dbraw/zinc/29/42/72/981294272.db2.gz MPKOVUJBALDRFU-CVEARBPZSA-N 1 1 372.400 2.589 20 5 FFBDMO C[C@@H]1CC2(CC([NH2+][C@H](c3nccn3C)c3ccc([N+](=O)[O-])cc3)C2)CO1 ZINC000897780627 982513940 /nfs/dbraw/zinc/51/39/40/982513940.db2.gz XYLFCOVGYHIWGR-OHNPGISMSA-N 1 1 356.426 2.965 20 5 FFBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000913534834 984291129 /nfs/dbraw/zinc/29/11/29/984291129.db2.gz MKRPDMDVKGGEKE-GASCZTMLSA-N 1 1 352.394 2.575 20 5 FFBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000913534834 984291136 /nfs/dbraw/zinc/29/11/36/984291136.db2.gz MKRPDMDVKGGEKE-GASCZTMLSA-N 1 1 352.394 2.575 20 5 FFBDMO Cc1c(C(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000060962149 985095502 /nfs/dbraw/zinc/09/55/02/985095502.db2.gz XMKBQXFJKKNOAC-GFCCVEGCSA-N 1 1 364.402 2.806 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1 ZINC000765456646 985099701 /nfs/dbraw/zinc/09/97/01/985099701.db2.gz TVFFYSFKHBCQRS-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO COc1ccccc1CC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172902335 985710668 /nfs/dbraw/zinc/71/06/68/985710668.db2.gz GLUFTDWFINTOGV-UHFFFAOYSA-N 1 1 367.409 2.994 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172902335 985710680 /nfs/dbraw/zinc/71/06/80/985710680.db2.gz GLUFTDWFINTOGV-UHFFFAOYSA-N 1 1 367.409 2.994 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000921851761 987251817 /nfs/dbraw/zinc/25/18/17/987251817.db2.gz RJCUCBTYDQIZCK-UHFFFAOYSA-N 1 1 367.421 2.697 20 5 FFBDMO CCCC[N@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000914784054 987906753 /nfs/dbraw/zinc/90/67/53/987906753.db2.gz UUVXGKINMJVZRQ-GOSISDBHSA-N 1 1 360.414 2.584 20 5 FFBDMO CCCC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000914784054 987906762 /nfs/dbraw/zinc/90/67/62/987906762.db2.gz UUVXGKINMJVZRQ-GOSISDBHSA-N 1 1 360.414 2.584 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(-c2noc(-c3cc([N+](=O)[O-])cn3C)n2)cn1 ZINC000761909007 987976742 /nfs/dbraw/zinc/97/67/42/987976742.db2.gz DCHGGABJDFPESH-UHFFFAOYSA-N 1 1 351.326 2.539 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243640 1015434896 /nfs/dbraw/zinc/43/48/96/1015434896.db2.gz KKXLPCJTLYYPIA-IEBWSBKVSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243640 1015434901 /nfs/dbraw/zinc/43/49/01/1015434901.db2.gz KKXLPCJTLYYPIA-IEBWSBKVSA-N 1 1 355.394 2.731 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000879244863 1015435406 /nfs/dbraw/zinc/43/54/06/1015435406.db2.gz UBUWDCXREMWAQX-UYAOXDASSA-N 1 1 369.421 2.756 20 5 FFBDMO CCC(CC)[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000918179376 990351454 /nfs/dbraw/zinc/35/14/54/990351454.db2.gz OWFAQEKREZDJSV-IBGZPJMESA-N 1 1 374.441 2.972 20 5 FFBDMO Cc1cc(C(=O)NCCC[N@H+](C)Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000068510798 991455137 /nfs/dbraw/zinc/45/51/37/991455137.db2.gz DXXIRTQTZLZAFJ-UHFFFAOYSA-N 1 1 356.426 2.737 20 5 FFBDMO CC[N@@H+](CCc1cccs1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001485032048 991821519 /nfs/dbraw/zinc/82/15/19/991821519.db2.gz YAGFFHWWYNYXFR-IAGOWNOFSA-N 1 1 365.499 2.516 20 5 FFBDMO CC[N@H+](CCc1cccs1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485032048 991821526 /nfs/dbraw/zinc/82/15/26/991821526.db2.gz YAGFFHWWYNYXFR-IAGOWNOFSA-N 1 1 365.499 2.516 20 5 FFBDMO CC[N@@H+](CCc1cccs1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485032048 991821533 /nfs/dbraw/zinc/82/15/33/991821533.db2.gz YAGFFHWWYNYXFR-IAGOWNOFSA-N 1 1 365.499 2.516 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001485450302 991943856 /nfs/dbraw/zinc/94/38/56/991943856.db2.gz GCOKGHKYIBVSBW-IAGOWNOFSA-N 1 1 363.433 2.708 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001124711439 992675239 /nfs/dbraw/zinc/67/52/39/992675239.db2.gz NGWBRKULCGYZEH-OKILXGFUSA-N 1 1 363.458 2.829 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001124711439 992675260 /nfs/dbraw/zinc/67/52/60/992675260.db2.gz NGWBRKULCGYZEH-OKILXGFUSA-N 1 1 363.458 2.829 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)CC[C@H]21 ZINC000880164944 1015770558 /nfs/dbraw/zinc/77/05/58/1015770558.db2.gz HIQPWPPHTVNWFA-BLLLJJGKSA-N 1 1 355.398 2.701 20 5 FFBDMO CCOc1cc(C(=O)O[C@@H](C)Cn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000810618465 994840212 /nfs/dbraw/zinc/84/02/12/994840212.db2.gz FUVFSSAPTQSHQY-NSHDSACASA-N 1 1 363.370 2.753 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810852798 994959219 /nfs/dbraw/zinc/95/92/19/994959219.db2.gz RBAKROBBZNQHAC-SJORKVTESA-N 1 1 356.382 2.564 20 5 FFBDMO Cc1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C)n1C ZINC000813170876 995631849 /nfs/dbraw/zinc/63/18/49/995631849.db2.gz MKHIEOKGNHKRTB-KRWDZBQOSA-N 1 1 357.410 2.981 20 5 FFBDMO Cc1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C)n1C ZINC000813170876 995631854 /nfs/dbraw/zinc/63/18/54/995631854.db2.gz MKHIEOKGNHKRTB-KRWDZBQOSA-N 1 1 357.410 2.981 20 5 FFBDMO COC1CCC(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813170870 995632635 /nfs/dbraw/zinc/63/26/35/995632635.db2.gz ZYBFVUDPMRIQHE-VJFUWPCTSA-N 1 1 362.426 2.918 20 5 FFBDMO COC1CCC(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000813170870 995632636 /nfs/dbraw/zinc/63/26/36/995632636.db2.gz ZYBFVUDPMRIQHE-VJFUWPCTSA-N 1 1 362.426 2.918 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC[C@@H]21 ZINC000827268064 1016087214 /nfs/dbraw/zinc/08/72/14/1016087214.db2.gz QFZYCCXORCPEQT-WBVHZDCISA-N 1 1 366.421 2.823 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C(C)(C)C ZINC001144024573 997943868 /nfs/dbraw/zinc/94/38/68/997943868.db2.gz MBALMKPPVICTEP-OAHLLOKOSA-N 1 1 353.850 2.979 20 5 FFBDMO O=C1CCCN1C[C@H]1CCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000732213519 998537852 /nfs/dbraw/zinc/53/78/52/998537852.db2.gz WSESPOCJRBWXLS-QGZVFWFLSA-N 1 1 361.442 2.841 20 5 FFBDMO C[C@@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000803855290 1016244942 /nfs/dbraw/zinc/24/49/42/1016244942.db2.gz FIFZPROCHFYMEO-UKRRQHHQSA-N 1 1 363.414 2.730 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000742423212 999773612 /nfs/dbraw/zinc/77/36/12/999773612.db2.gz IMLVCSMEWYQUTK-QGZVFWFLSA-N 1 1 368.437 2.665 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H](C)C(C)C ZINC000742557535 999778071 /nfs/dbraw/zinc/77/80/71/999778071.db2.gz ZNKFCASBQFTZHJ-UGSOOPFHSA-N 1 1 362.430 2.686 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H](C)C(C)C ZINC000742557534 999778195 /nfs/dbraw/zinc/77/81/95/999778195.db2.gz ZNKFCASBQFTZHJ-SCLBCKFNSA-N 1 1 362.430 2.686 20 5 FFBDMO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000743842070 999832839 /nfs/dbraw/zinc/83/28/39/999832839.db2.gz BDUHACPSAXDVKG-OAHLLOKOSA-N 1 1 372.347 2.693 20 5 FFBDMO O=C(NC[C@H]1C[C@H]([NH2+]CCc2ccc3ccccc3c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086363772 999872005 /nfs/dbraw/zinc/87/20/05/999872005.db2.gz JFABKQRCCBNMOA-HUYLIWGRSA-N 1 1 367.449 2.532 20 5 FFBDMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000745423433 999913695 /nfs/dbraw/zinc/91/36/95/999913695.db2.gz YCPRXOCRBBDYCU-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169011644 1000015604 /nfs/dbraw/zinc/01/56/04/1000015604.db2.gz LWVMMTXMISOGCL-RVKKMQEKSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169036866 1000016729 /nfs/dbraw/zinc/01/67/29/1000016729.db2.gz QIJDEHQFRWOMBH-RBGFHDKUSA-N 1 1 353.463 2.952 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cnn(CC3CC3)c21 ZINC001169018260 1000017197 /nfs/dbraw/zinc/01/71/97/1000017197.db2.gz AJHDBIKSNIBXSZ-BPQIPLTHSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOCc1nn(CC2CC2)c2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169024571 1000017932 /nfs/dbraw/zinc/01/79/32/1000017932.db2.gz XFCKRTPOOVYIKZ-CVEARBPZSA-N 1 1 362.474 2.633 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]12 ZINC001169052553 1000019042 /nfs/dbraw/zinc/01/90/42/1000019042.db2.gz HFSXODWPLMEOLV-CQJMVSDSSA-N 1 1 353.463 2.667 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC3(CCOCC3)C2)nc1-c1ccncc1 ZINC000742162343 1000141741 /nfs/dbraw/zinc/14/17/41/1000141741.db2.gz XUFRBMLEQWUNOA-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCCC3(CCOCC3)C2)nc1-c1ccncc1 ZINC000742162343 1000141742 /nfs/dbraw/zinc/14/17/42/1000141742.db2.gz XUFRBMLEQWUNOA-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO Cc1c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000769706785 1000582966 /nfs/dbraw/zinc/58/29/66/1000582966.db2.gz FNKYHTNNUNEOGA-UHFFFAOYSA-N 1 1 364.402 2.663 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000785733135 1001472986 /nfs/dbraw/zinc/47/29/86/1001472986.db2.gz PNMJAQCNPCETMQ-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000785733135 1001472989 /nfs/dbraw/zinc/47/29/89/1001472989.db2.gz PNMJAQCNPCETMQ-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCCOc1ccc([N+](=O)[O-])cc1 ZINC000786821758 1001633819 /nfs/dbraw/zinc/63/38/19/1001633819.db2.gz QMAFKTIETADXQW-UHFFFAOYSA-N 1 1 370.405 2.965 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c1 ZINC001171361849 1001712616 /nfs/dbraw/zinc/71/26/16/1001712616.db2.gz KMJIAHZTLLHAGP-HLAWJBBLSA-N 1 1 367.449 2.835 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2cc3ccccc3[nH]c2=O)c1[N+](=O)[O-] ZINC001184398603 1002591052 /nfs/dbraw/zinc/59/10/52/1002591052.db2.gz KHAUBCVVMGMUJK-UHFFFAOYSA-N 1 1 355.350 2.853 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000791752154 1002802434 /nfs/dbraw/zinc/80/24/34/1002802434.db2.gz DMNGATWSOIPYFN-UHFFFAOYSA-N 1 1 374.441 2.649 20 5 FFBDMO COCCCN1CCC([NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170306774 1003120250 /nfs/dbraw/zinc/12/02/50/1003120250.db2.gz BUTMOVPBAPKKHL-OAHLLOKOSA-N 1 1 365.474 2.625 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])[C@@H]1C ZINC001170345207 1003131547 /nfs/dbraw/zinc/13/15/47/1003131547.db2.gz HYRTVJQDWWWGBM-WOSRLPQWSA-N 1 1 350.415 2.808 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCN(c3ncccn3)CC2)c([N+](=O)[O-])c1 ZINC001170344679 1003131975 /nfs/dbraw/zinc/13/19/75/1003131975.db2.gz FCTKHVVTBTXLHY-OAHLLOKOSA-N 1 1 371.441 2.537 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001186571359 1003348296 /nfs/dbraw/zinc/34/82/96/1003348296.db2.gz IGQQDROIGDIOFU-VQIMIIECSA-N 1 1 351.406 2.966 20 5 FFBDMO Cc1c(C(=O)NCC[N@H+](C)C2CCCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000104575202 1004682887 /nfs/dbraw/zinc/68/28/87/1004682887.db2.gz KSERNWCXJISRPQ-UHFFFAOYSA-N 1 1 364.402 2.724 20 5 FFBDMO Cc1ccn([C@H](C)CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000851035649 1005857994 /nfs/dbraw/zinc/85/79/94/1005857994.db2.gz UIRQAZRDEXKOIN-QAPCUYQASA-N 1 1 372.425 2.869 20 5 FFBDMO Cc1ccn([C@H](C)CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000851035649 1005857997 /nfs/dbraw/zinc/85/79/97/1005857997.db2.gz UIRQAZRDEXKOIN-QAPCUYQASA-N 1 1 372.425 2.869 20 5 FFBDMO C[C@@H]1CO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000851415946 1005884720 /nfs/dbraw/zinc/88/47/20/1005884720.db2.gz QXXFOEYPUDVSSF-WBVHZDCISA-N 1 1 364.442 2.655 20 5 FFBDMO C[C@@H]1CO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000851415946 1005884722 /nfs/dbraw/zinc/88/47/22/1005884722.db2.gz QXXFOEYPUDVSSF-WBVHZDCISA-N 1 1 364.442 2.655 20 5 FFBDMO CC[C@@H](C)C[N@@H+](CC)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748263743 1017005102 /nfs/dbraw/zinc/00/51/02/1017005102.db2.gz XPSWQEBPCFPYAY-ACJLOTCBSA-N 1 1 362.430 2.687 20 5 FFBDMO Cc1noc(C[NH+]2CCC3(CN(C(=O)OC(C)(C)C)C3)CC2)c1[N+](=O)[O-] ZINC000852216716 1005952263 /nfs/dbraw/zinc/95/22/63/1005952263.db2.gz LEEKMFKXVJDUTP-UHFFFAOYSA-N 1 1 366.418 2.724 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)c1 ZINC000852520683 1006063175 /nfs/dbraw/zinc/06/31/75/1006063175.db2.gz NCESZVJEKVNIKV-SXLOBPIMSA-N 1 1 356.422 2.726 20 5 FFBDMO C[N@@H+](Cc1cn(C[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1)C1CCCCC1 ZINC000881411258 1006089259 /nfs/dbraw/zinc/08/92/59/1006089259.db2.gz XYWVRSJKWQNIDD-GOSISDBHSA-N 1 1 359.430 2.684 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000882041732 1006284922 /nfs/dbraw/zinc/28/49/22/1006284922.db2.gz DCFATUKTFYITRL-HNNXBMFYSA-N 1 1 372.469 2.655 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)nc1-c1ccccn1 ZINC000853501737 1006416963 /nfs/dbraw/zinc/41/69/63/1006416963.db2.gz XQLONOMGJWTHFB-GOSISDBHSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@]3(CCCOC3)C2)nc1-c1ccccn1 ZINC000853501737 1006416966 /nfs/dbraw/zinc/41/69/66/1006416966.db2.gz XQLONOMGJWTHFB-GOSISDBHSA-N 1 1 357.414 2.703 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1 ZINC000882666802 1006467954 /nfs/dbraw/zinc/46/79/54/1006467954.db2.gz RIXVEHYNSROWHB-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001134811232 1006487503 /nfs/dbraw/zinc/48/75/03/1006487503.db2.gz ORCHSGUIQCYTAY-UHFFFAOYSA-N 1 1 357.357 2.658 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@@H](O)c3cc4ccccc4o3)C2)nc1 ZINC000815070008 1006507262 /nfs/dbraw/zinc/50/72/62/1006507262.db2.gz NWOHOCPZWOIKME-GOEBONIOSA-N 1 1 368.393 2.956 20 5 FFBDMO CCCCCCNC(=O)[C@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000133132829 1007071538 /nfs/dbraw/zinc/07/15/38/1007071538.db2.gz PVHWKQXSBUFYHY-INIZCTEOSA-N 1 1 365.478 2.774 20 5 FFBDMO CCCCCCNC(=O)[C@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000133132829 1007071553 /nfs/dbraw/zinc/07/15/53/1007071553.db2.gz PVHWKQXSBUFYHY-INIZCTEOSA-N 1 1 365.478 2.774 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000817178710 1007459331 /nfs/dbraw/zinc/45/93/31/1007459331.db2.gz HQAPKDAKURMFLW-UHFFFAOYSA-N 1 1 356.378 2.784 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000885891686 1007824813 /nfs/dbraw/zinc/82/48/13/1007824813.db2.gz WULWOSADQFOESA-INIZCTEOSA-N 1 1 369.421 2.731 20 5 FFBDMO COc1ccc(CC[N@@H+](CC(C)C)Cn2cc([N+](=O)[O-])cn2)cc1OC ZINC000115513093 1008198376 /nfs/dbraw/zinc/19/83/76/1008198376.db2.gz WFUYHJCGVUJWPB-UHFFFAOYSA-N 1 1 362.430 2.967 20 5 FFBDMO CC(C)(C)OC(=O)N1CC(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000859238228 1008492097 /nfs/dbraw/zinc/49/20/97/1008492097.db2.gz VUYZDMIBAPMVMP-UHFFFAOYSA-N 1 1 362.430 2.605 20 5 FFBDMO CC(C)(C)OC(=O)N1CC(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000859238228 1008492100 /nfs/dbraw/zinc/49/21/00/1008492100.db2.gz VUYZDMIBAPMVMP-UHFFFAOYSA-N 1 1 362.430 2.605 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+](Cc3cccnc3[N+](=O)[O-])CC[C@H]21 ZINC000886215986 1008602535 /nfs/dbraw/zinc/60/25/35/1008602535.db2.gz UOLABBPTJNPJHY-DZGCQCFKSA-N 1 1 362.430 2.821 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])CC[C@H]21 ZINC000886215986 1008602544 /nfs/dbraw/zinc/60/25/44/1008602544.db2.gz UOLABBPTJNPJHY-DZGCQCFKSA-N 1 1 362.430 2.821 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(Cl)s1)[C@@H]1CC1[N+](=O)[O-] ZINC001178449769 1008979093 /nfs/dbraw/zinc/97/90/93/1008979093.db2.gz FZTOYUXFSOJNES-CHWSQXEVSA-N 1 1 359.879 2.833 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCOC1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464703 1008998691 /nfs/dbraw/zinc/99/86/91/1008998691.db2.gz YKZJDYSWDWBZEI-QZTJIDSGSA-N 1 1 369.506 2.657 20 5 FFBDMO Cc1ccccc1CCC[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178464252 1008999385 /nfs/dbraw/zinc/99/93/85/1008999385.db2.gz RNGCRPPNWKGYDI-RTBURBONSA-N 1 1 361.486 2.859 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000823286928 1009007039 /nfs/dbraw/zinc/00/70/39/1009007039.db2.gz VBDDQJWNLQIIJR-UHFFFAOYSA-N 1 1 368.397 2.735 20 5 FFBDMO Cc1ccc(NCCNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)[nH+]c1 ZINC001178610089 1009056181 /nfs/dbraw/zinc/05/61/81/1009056181.db2.gz PJNYINYTZDWEKY-UHFFFAOYSA-N 1 1 354.410 2.948 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@](C)(O)c1ccccc1 ZINC000823599746 1009137756 /nfs/dbraw/zinc/13/77/56/1009137756.db2.gz WNGNUGCUCKKYJF-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@](C)(O)c1ccccc1 ZINC000823599746 1009137764 /nfs/dbraw/zinc/13/77/64/1009137764.db2.gz WNGNUGCUCKKYJF-LJQANCHMSA-N 1 1 368.393 2.984 20 5 FFBDMO O=C(NCc1ccc(C[NH+]2CCCCCC2)cc1)c1n[nH]cc1[N+](=O)[O-] ZINC000125665721 1009201720 /nfs/dbraw/zinc/20/17/20/1009201720.db2.gz HAXHQJVFQIWFGM-UHFFFAOYSA-N 1 1 357.414 2.624 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000794588363 1010392273 /nfs/dbraw/zinc/39/22/73/1010392273.db2.gz SSWWTSTVFBHJQT-HNNXBMFYSA-N 1 1 359.357 2.553 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000773260686 1010966551 /nfs/dbraw/zinc/96/65/51/1010966551.db2.gz ZTMUSLCBBPXPJD-ZIAGYGMSSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000773260686 1010966554 /nfs/dbraw/zinc/96/65/54/1010966554.db2.gz ZTMUSLCBBPXPJD-ZIAGYGMSSA-N 1 1 361.398 2.599 20 5 FFBDMO C[C@H]1COc2ccccc2CN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867978997 1011137376 /nfs/dbraw/zinc/13/73/76/1011137376.db2.gz CHIZMZUTBCZBRF-ORAYPTAESA-N 1 1 355.394 2.578 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCN3CC(F)(F)C[C@H]3C1)CC2 ZINC001172922468 1012101283 /nfs/dbraw/zinc/10/12/83/1012101283.db2.gz XZYXFOBDQVRXDK-RDJZCZTQSA-N 1 1 351.397 2.867 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@H](c3ccc(O)cc3)C2)c1 ZINC000870079820 1012109666 /nfs/dbraw/zinc/10/96/66/1012109666.db2.gz ACBPSZLDFFSSKN-INIZCTEOSA-N 1 1 373.434 2.809 20 5 FFBDMO CSc1cccc(C(=O)N2CC[NH2+][C@H](c3ccc(O)cc3)C2)c1[N+](=O)[O-] ZINC000870088131 1012120175 /nfs/dbraw/zinc/12/01/75/1012120175.db2.gz ZIDCPNNSPQOLRR-HNNXBMFYSA-N 1 1 373.434 2.809 20 5 FFBDMO COCCCC[NH+]1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172913278 1012126160 /nfs/dbraw/zinc/12/61/60/1012126160.db2.gz QMQOCZQGAZNVPH-LJQANCHMSA-N 1 1 361.486 2.886 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCCO1 ZINC001173009443 1012179528 /nfs/dbraw/zinc/17/95/28/1012179528.db2.gz CICGFZDOPSPXRX-LBPRGKRZSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H]2CC[N@H+](CC(C)C)C2)c1F ZINC001173182275 1012326046 /nfs/dbraw/zinc/32/60/46/1012326046.db2.gz REWRUEKEJDIZAL-KBPBESRZSA-N 1 1 353.438 2.993 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H]2CC[N@@H+](CC(C)C)C2)c1F ZINC001173182275 1012326060 /nfs/dbraw/zinc/32/60/60/1012326060.db2.gz REWRUEKEJDIZAL-KBPBESRZSA-N 1 1 353.438 2.993 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@@H]2CCCN(C(C)=O)C2)c1F ZINC001173191459 1012332826 /nfs/dbraw/zinc/33/28/26/1012332826.db2.gz FKBXUVGSJHVORN-GXTWGEPZSA-N 1 1 367.421 2.616 20 5 FFBDMO Cc1ccn(C[C@@H](C)C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000870378178 1012341635 /nfs/dbraw/zinc/34/16/35/1012341635.db2.gz RWLKGMNIHYDFSO-KDOFPFPSSA-N 1 1 372.425 2.554 20 5 FFBDMO Cc1ccn(C[C@@H](C)C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000870378178 1012341646 /nfs/dbraw/zinc/34/16/46/1012341646.db2.gz RWLKGMNIHYDFSO-KDOFPFPSSA-N 1 1 372.425 2.554 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c(Br)c1 ZINC000252539383 1012559089 /nfs/dbraw/zinc/55/90/89/1012559089.db2.gz BMPJQSJHTCPVEQ-NWDGAFQWSA-N 1 1 356.220 2.632 20 5 FFBDMO CCOc1cc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])cc1OC ZINC000871150680 1012749915 /nfs/dbraw/zinc/74/99/15/1012749915.db2.gz RQPWTGQDWXCSBG-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000871283974 1012823546 /nfs/dbraw/zinc/82/35/46/1012823546.db2.gz JOCYHFMFICWPOX-QGZVFWFLSA-N 1 1 369.421 2.534 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000871283974 1012823563 /nfs/dbraw/zinc/82/35/63/1012823563.db2.gz JOCYHFMFICWPOX-QGZVFWFLSA-N 1 1 369.421 2.534 20 5 FFBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106425 1018367956 /nfs/dbraw/zinc/36/79/56/1018367956.db2.gz ZYQXAIWJOWYFMI-WMLDXEAASA-N 1 1 363.458 2.897 20 5 FFBDMO CCOc1ccc([C@H](C)NC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106425 1018367971 /nfs/dbraw/zinc/36/79/71/1018367971.db2.gz ZYQXAIWJOWYFMI-WMLDXEAASA-N 1 1 363.458 2.897 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928436247 1018978594 /nfs/dbraw/zinc/97/85/94/1018978594.db2.gz BDTMIPRRJYZQNH-RDTXWAMCSA-N 1 1 369.421 2.996 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)cc1 ZINC000801580568 1019138746 /nfs/dbraw/zinc/13/87/46/1019138746.db2.gz MZRAKPHZTQPLOD-UXHICEINSA-N 1 1 356.422 2.654 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc2cc[nH]c2c1 ZINC000929164712 1019299345 /nfs/dbraw/zinc/29/93/45/1019299345.db2.gz LHBVQTCLNKKRFP-INIZCTEOSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1ccc2cc[nH]c2c1 ZINC000929164712 1019299354 /nfs/dbraw/zinc/29/93/54/1019299354.db2.gz LHBVQTCLNKKRFP-INIZCTEOSA-N 1 1 355.394 2.948 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)Cc1ccccc1 ZINC000801891458 1019490120 /nfs/dbraw/zinc/49/01/20/1019490120.db2.gz LWROOOPGGHQZFR-LBPRGKRZSA-N 1 1 360.389 2.566 20 5 FFBDMO COc1ccc(Cc2nnc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC001217715763 1032846210 /nfs/dbraw/zinc/84/62/10/1032846210.db2.gz YNWDEGIKJHZZTE-MRXNPFEDSA-N 1 1 354.366 2.820 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)CC1 ZINC000929993295 1019799083 /nfs/dbraw/zinc/79/90/83/1019799083.db2.gz AACNDTWWXSNUOT-BZWBGLRVSA-N 1 1 365.380 2.644 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3cc(C)nnc3C)CC2)ccc1[N+](=O)[O-] ZINC000930284748 1019962609 /nfs/dbraw/zinc/96/26/09/1019962609.db2.gz BYZDBMLYZOBJLY-UHFFFAOYSA-N 1 1 371.441 2.723 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1cccc3ccccc31)C2 ZINC001072724861 1020294305 /nfs/dbraw/zinc/29/43/05/1020294305.db2.gz GPGFBGHMEGBBMS-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1cccc3ccccc31)C2 ZINC001072724861 1020294314 /nfs/dbraw/zinc/29/43/14/1020294314.db2.gz GPGFBGHMEGBBMS-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1cccc3ccccc31)C2 ZINC001072724861 1020294321 /nfs/dbraw/zinc/29/43/21/1020294321.db2.gz GPGFBGHMEGBBMS-RTBURBONSA-N 1 1 365.433 2.539 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777953285 1020307010 /nfs/dbraw/zinc/30/70/10/1020307010.db2.gz FUAZCTNYPZDAJJ-MRXNPFEDSA-N 1 1 358.398 2.833 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000777953285 1020307021 /nfs/dbraw/zinc/30/70/21/1020307021.db2.gz FUAZCTNYPZDAJJ-MRXNPFEDSA-N 1 1 358.398 2.833 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H]3O)CC2)cc([N+](=O)[O-])c1 ZINC000903123906 1020690152 /nfs/dbraw/zinc/69/01/52/1020690152.db2.gz CTPURCUYXAYGLV-FASAQXTFSA-N 1 1 363.458 2.632 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]CC(=O)NCCc2ccccc2)cc([N+](=O)[O-])c1 ZINC000903135403 1020696393 /nfs/dbraw/zinc/69/63/93/1020696393.db2.gz IYFIJNAWIMGUPP-CQSZACIVSA-N 1 1 357.410 2.613 20 5 FFBDMO O=C1N[C@H](C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)CO1 ZINC000932769587 1020896851 /nfs/dbraw/zinc/89/68/51/1020896851.db2.gz FTNNZXODVSLOHU-AWEZNQCLSA-N 1 1 373.331 2.934 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336381 1021199983 /nfs/dbraw/zinc/19/99/83/1021199983.db2.gz PJTQDZZEOQDPLF-XJKSGUPXSA-N 1 1 372.450 2.721 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336381 1021199990 /nfs/dbraw/zinc/19/99/90/1021199990.db2.gz PJTQDZZEOQDPLF-XJKSGUPXSA-N 1 1 372.450 2.721 20 5 FFBDMO COc1ccc(C[N@@H+](CCCO)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000934505743 1021267196 /nfs/dbraw/zinc/26/71/96/1021267196.db2.gz YVSGHPZTNUNMEK-LJQANCHMSA-N 1 1 360.410 2.521 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807072 1021428244 /nfs/dbraw/zinc/42/82/44/1021428244.db2.gz QIZRGKQCFBKYCE-RDJZCZTQSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807072 1021428248 /nfs/dbraw/zinc/42/82/48/1021428248.db2.gz QIZRGKQCFBKYCE-RDJZCZTQSA-N 1 1 373.384 2.918 20 5 FFBDMO C[C@@H](C1CC1)[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000042123207 1022140814 /nfs/dbraw/zinc/14/08/14/1022140814.db2.gz VETMQCRTIJCLAJ-HNNXBMFYSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001218296356 1033090970 /nfs/dbraw/zinc/09/09/70/1033090970.db2.gz JWZKBOJINZSXOB-IFXJQAMLSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001218296356 1033090988 /nfs/dbraw/zinc/09/09/88/1033090988.db2.gz JWZKBOJINZSXOB-IFXJQAMLSA-N 1 1 357.410 2.845 20 5 FFBDMO C/C(=C/C(=O)N1CCC[N@@H+](C[C@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000751690053 1022911680 /nfs/dbraw/zinc/91/16/80/1022911680.db2.gz YEDWAWLCUWRYNG-WLGQOEQESA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001218296155 1033091410 /nfs/dbraw/zinc/09/14/10/1033091410.db2.gz JWZKBOJINZSXOB-AUUYWEPGSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001218296155 1033091417 /nfs/dbraw/zinc/09/14/17/1033091417.db2.gz JWZKBOJINZSXOB-AUUYWEPGSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351083 1033114485 /nfs/dbraw/zinc/11/44/85/1033114485.db2.gz SRNHDZKCHZBUFO-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351083 1033114493 /nfs/dbraw/zinc/11/44/93/1033114493.db2.gz SRNHDZKCHZBUFO-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1OCCOC(=O)c1ccn(-c2cc[nH+]cc2)n1 ZINC001122642763 1023385927 /nfs/dbraw/zinc/38/59/27/1023385927.db2.gz CKNWESWDARMWGL-UHFFFAOYSA-N 1 1 368.349 2.720 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC001121200894 1023646143 /nfs/dbraw/zinc/64/61/43/1023646143.db2.gz YXWALRDAPKQGHE-DRZSPHRISA-N 1 1 369.874 2.797 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)[C@H](C)C1 ZINC001121269080 1023681359 /nfs/dbraw/zinc/68/13/59/1023681359.db2.gz YPQFFFMNFYFPAS-NEPJUHHUSA-N 1 1 364.475 2.618 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000195142781 1024947683 /nfs/dbraw/zinc/94/76/83/1024947683.db2.gz FPDWBSCHTHVQOL-UHFFFAOYSA-N 1 1 354.410 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c2nonc21 ZINC000795211279 1025357420 /nfs/dbraw/zinc/35/74/20/1025357420.db2.gz WUKWSFSTWSMUFK-GASCZTMLSA-N 1 1 365.393 2.699 20 5 FFBDMO Cc1cc(C)cc([C@@H](O)C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245458951 1025434884 /nfs/dbraw/zinc/43/48/84/1025434884.db2.gz VCKYFGMYZQNWQK-AEFFLSMTSA-N 1 1 356.426 2.826 20 5 FFBDMO Cc1c(C(=O)NCC[N@H+]2CCCC2(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000837178017 1025635049 /nfs/dbraw/zinc/63/50/49/1025635049.db2.gz SKIMCVQGYVAIRZ-UHFFFAOYSA-N 1 1 364.402 2.724 20 5 FFBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000838905914 1026529818 /nfs/dbraw/zinc/52/98/18/1026529818.db2.gz HICPLJQGBWZJAM-XBXGTLAGSA-N 1 1 374.315 2.634 20 5 FFBDMO O=C1C[C@@]2(CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643887 1026772285 /nfs/dbraw/zinc/77/22/85/1026772285.db2.gz MSYWOPXGQJDMFW-AZUAARDMSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@@]2(CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643887 1026772291 /nfs/dbraw/zinc/77/22/91/1026772291.db2.gz MSYWOPXGQJDMFW-AZUAARDMSA-N 1 1 368.389 2.738 20 5 FFBDMO CC(C)OCCOC1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000840142129 1026981521 /nfs/dbraw/zinc/98/15/21/1026981521.db2.gz CCJCBRYSKHAYDC-UHFFFAOYSA-N 1 1 362.430 2.808 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@@H](Nc2cc([N+](=O)[O-])ccn2)C1 ZINC001158586519 1027069498 /nfs/dbraw/zinc/06/94/98/1027069498.db2.gz ZKKYNWOCKSAJSH-WBVHZDCISA-N 1 1 370.409 2.861 20 5 FFBDMO Cc1cccc(C(=O)N2CC[NH+](CCCOC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC001153388847 1027860361 /nfs/dbraw/zinc/86/03/61/1027860361.db2.gz OZVYXHXFDUKWQF-UHFFFAOYSA-N 1 1 363.458 2.866 20 5 FFBDMO Nc1ccc[nH+]c1N1CCN(c2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC001154782380 1028448759 /nfs/dbraw/zinc/44/87/59/1028448759.db2.gz MNESPDUETJUYNF-UHFFFAOYSA-N 1 1 369.212 2.600 20 5 FFBDMO CC(C)CCC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162810611 1028663713 /nfs/dbraw/zinc/66/37/13/1028663713.db2.gz NFSOIVLVTOSDDE-RTBURBONSA-N 1 1 361.486 2.749 20 5 FFBDMO CC[NH+](CC)CCNC(=N)Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC001163129855 1028814866 /nfs/dbraw/zinc/81/48/66/1028814866.db2.gz SAWDNFGLFKDCNE-UHFFFAOYSA-N 1 1 356.430 2.935 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC001155726506 1028875340 /nfs/dbraw/zinc/87/53/40/1028875340.db2.gz IMHPDNHMYWOWBG-QGZVFWFLSA-N 1 1 368.437 2.835 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC001163371320 1028906960 /nfs/dbraw/zinc/90/69/60/1028906960.db2.gz ONXQOCOZUPGKEB-GXTWGEPZSA-N 1 1 350.419 2.697 20 5 FFBDMO Cc1c[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)cc1[N+](=O)[O-] ZINC001164485323 1029292255 /nfs/dbraw/zinc/29/22/55/1029292255.db2.gz IJLQOCDLZVBTQD-KZNAEPCWSA-N 1 1 368.437 2.859 20 5 FFBDMO Cn1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)cc([N+](=O)[O-])c1=O ZINC001164491799 1029297422 /nfs/dbraw/zinc/29/74/22/1029297422.db2.gz GKNLCTLIEWJBHX-BPQIPLTHSA-N 1 1 368.437 2.616 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1cc(N)c([N+](=O)[O-])cn1 ZINC001165183082 1029438600 /nfs/dbraw/zinc/43/86/00/1029438600.db2.gz PXKGATLLTAGDDP-KBXCAEBGSA-N 1 1 355.442 2.919 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)n1 ZINC001157067007 1029456598 /nfs/dbraw/zinc/45/65/98/1029456598.db2.gz RUXNXQQYEIJAHW-UHFFFAOYSA-N 1 1 359.405 2.933 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3nc(C(F)(F)F)nc(Cl)c3[N+](=O)[O-])C[C@H]21 ZINC001157272459 1029531596 /nfs/dbraw/zinc/53/15/96/1029531596.db2.gz MYKQWQIGNFLMCT-HTQZYQBOSA-N 1 1 365.743 2.587 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1nc(Cl)cc(Cl)c1[N+](=O)[O-])CC2 ZINC001166032985 1030213472 /nfs/dbraw/zinc/21/34/72/1030213472.db2.gz OSAJOBQKAUYMOG-UHFFFAOYSA-N 1 1 374.228 2.931 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)nc1Cl ZINC001166032732 1030214850 /nfs/dbraw/zinc/21/48/50/1030214850.db2.gz RUOGGMZAGKTINZ-UHFFFAOYSA-N 1 1 353.810 2.586 20 5 FFBDMO Cc1ccc(N(C)[C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000784375012 1030594510 /nfs/dbraw/zinc/59/45/10/1030594510.db2.gz PHXWMUGDEHNUKG-SFHVURJKSA-N 1 1 370.453 2.666 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@H]3CCCOC3)n2)cc1 ZINC000842613232 1030823239 /nfs/dbraw/zinc/82/32/39/1030823239.db2.gz BEIIXWLQJIEDCH-RDJZCZTQSA-N 1 1 357.414 2.702 20 5 FFBDMO C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C[C@](C)(O)c1ccccc1 ZINC000842626962 1030851184 /nfs/dbraw/zinc/85/11/84/1030851184.db2.gz QNCLIUIDPCPAPZ-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796706219 1030888110 /nfs/dbraw/zinc/88/81/10/1030888110.db2.gz IZUDGJOBPMQLCJ-IRXDYDNUSA-N 1 1 365.430 2.617 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C[C@@]2(C)C1 ZINC001149672721 1031568212 /nfs/dbraw/zinc/56/82/12/1031568212.db2.gz XROOWXMAKSWTQB-KDURUIRLSA-N 1 1 363.433 2.812 20 5 FFBDMO NC[C@@H]([NH3+])c1ccc(C(=O)Nc2cc3cccnc3c3ncccc23)cc1 ZINC001218980022 1033441546 /nfs/dbraw/zinc/44/15/46/1033441546.db2.gz PQJPJZQCRGFMGZ-QGZVFWFLSA-N 1 1 357.417 2.994 20 5 FFBDMO O=C1OCCN1C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000830130288 1033477853 /nfs/dbraw/zinc/47/78/53/1033477853.db2.gz PIOXICFJYWTKAY-LLVKDONJSA-N 1 1 373.331 2.888 20 5 FFBDMO O=C1OCCN1C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000830130288 1033477861 /nfs/dbraw/zinc/47/78/61/1033477861.db2.gz PIOXICFJYWTKAY-LLVKDONJSA-N 1 1 373.331 2.888 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000830529802 1033658599 /nfs/dbraw/zinc/65/85/99/1033658599.db2.gz POCYDAPYLGDUPW-CYBMUJFWSA-N 1 1 364.421 2.547 20 5 FFBDMO O=C(NCC(F)F)[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000832123896 1034578894 /nfs/dbraw/zinc/57/88/94/1034578894.db2.gz CWEDFFWIORNZBN-HNNXBMFYSA-N 1 1 371.384 2.600 20 5 FFBDMO O=C(NCC(F)F)[C@@H]1CCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000832123896 1034578903 /nfs/dbraw/zinc/57/89/03/1034578903.db2.gz CWEDFFWIORNZBN-HNNXBMFYSA-N 1 1 371.384 2.600 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cc3Cl)C[C@H]1[N@H+]2C ZINC001226761787 1034825351 /nfs/dbraw/zinc/82/53/51/1034825351.db2.gz FSJMLKBQUGWHBN-CAVOSLQRSA-N 1 1 354.790 2.794 20 5 FFBDMO c1cnnc(N2CC[NH+](Cc3ccc4ccc5cccnc5c4n3)CC2)c1 ZINC001232221976 1035504330 /nfs/dbraw/zinc/50/43/30/1035504330.db2.gz HLDPHYWJXSTLSP-UHFFFAOYSA-N 1 1 356.433 2.895 20 5 FFBDMO O=[N+]([O-])c1cc([N+](=O)[O-])c(OC2CC[NH+](CCF)CC2)c2ncccc12 ZINC001233901226 1036814021 /nfs/dbraw/zinc/81/40/21/1036814021.db2.gz GQIMEGGOWDINIT-UHFFFAOYSA-N 1 1 364.333 2.864 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc4ccc([N+](=O)[O-])cc4[nH]3)o2)C[C@H](C)O1 ZINC001258027807 1039126210 /nfs/dbraw/zinc/12/62/10/1039126210.db2.gz PZCRBAXRRRDOAU-TXEJJXNPSA-N 1 1 371.397 2.778 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cccc([N+](=O)[O-])c3Cl)o2)C[C@H](C)O1 ZINC001258139695 1039219916 /nfs/dbraw/zinc/21/99/16/1039219916.db2.gz VOPNXQVKSKMSDC-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@@H+]1CCO)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001210683434 1039669472 /nfs/dbraw/zinc/66/94/72/1039669472.db2.gz UCIFTXSDARGSGU-CQSZACIVSA-N 1 1 372.425 2.716 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479888 1040744871 /nfs/dbraw/zinc/74/48/71/1040744871.db2.gz PFXNHPWZAAPREY-CABCVRRESA-N 1 1 361.442 2.695 20 5 FFBDMO COc1cccnc1N1CC[NH+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254564386 1040803301 /nfs/dbraw/zinc/80/33/01/1040803301.db2.gz KZNXRNGYTRFPMM-OAHLLOKOSA-N 1 1 356.426 2.752 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597626 1040826782 /nfs/dbraw/zinc/82/67/82/1040826782.db2.gz UIFBMOKVQPWTLT-SJLPKXTDSA-N 1 1 356.426 2.524 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1-c1noc(-c2c[nH+]ccc2N2CCCC2)n1 ZINC001214682759 1041536253 /nfs/dbraw/zinc/53/62/53/1041536253.db2.gz NBAKNXMAAOPOPK-UHFFFAOYSA-N 1 1 356.317 2.841 20 5 FFBDMO O=C(NCc1ccc(CC[NH2+]CC2CCCCC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001266083732 1042893900 /nfs/dbraw/zinc/89/39/00/1042893900.db2.gz MEPVGOATROWABX-RTBURBONSA-N 1 1 359.470 2.680 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001310077183 1043633025 /nfs/dbraw/zinc/63/30/25/1043633025.db2.gz KOLHVSPJSCXDBM-OCCSQVGLSA-N 1 1 370.862 2.950 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC001311321028 1043886285 /nfs/dbraw/zinc/88/62/85/1043886285.db2.gz PRVHKQFFCVCGOH-IRXDYDNUSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@H](C(=O)NCc1ccco1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC001318793723 1044880786 /nfs/dbraw/zinc/88/07/86/1044880786.db2.gz YRXPHJOHSOUNQS-CQSZACIVSA-N 1 1 373.409 2.736 20 5 FFBDMO CCCC1CC[NH+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC001318891366 1044925240 /nfs/dbraw/zinc/92/52/40/1044925240.db2.gz HNDSGZLISLUYIW-LJQANCHMSA-N 1 1 374.441 2.831 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486397 1045169806 /nfs/dbraw/zinc/16/98/06/1045169806.db2.gz KLKXXXRBUIYVHV-MAUKXSAKSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486397 1045169810 /nfs/dbraw/zinc/16/98/10/1045169810.db2.gz KLKXXXRBUIYVHV-MAUKXSAKSA-N 1 1 373.384 2.918 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001323275245 1045526579 /nfs/dbraw/zinc/52/65/79/1045526579.db2.gz SBBGQZDYGLPSPF-GASCZTMLSA-N 1 1 360.458 2.988 20 5 FFBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC001324733135 1046193814 /nfs/dbraw/zinc/19/38/14/1046193814.db2.gz HHYCCQPGPWSTMQ-AWEZNQCLSA-N 1 1 372.263 2.950 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2c(C)cncc2[N+](=O)[O-])CC1 ZINC001323162395 1046367141 /nfs/dbraw/zinc/36/71/41/1046367141.db2.gz SVPLCBWOWPWTBL-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO CN(C)c1ccc(COC(=O)c2ccn(-c3cc[nH+]cc3)n2)cc1[N+](=O)[O-] ZINC001326416762 1046923595 /nfs/dbraw/zinc/92/35/95/1046923595.db2.gz ZVQGTVVPKWPADV-UHFFFAOYSA-N 1 1 367.365 2.599 20 5 FFBDMO CCOC(=O)C[C@H]1CCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC001326795209 1047090920 /nfs/dbraw/zinc/09/09/20/1047090920.db2.gz APMUVYGYPMPKCF-OAHLLOKOSA-N 1 1 358.398 2.833 20 5 FFBDMO CCOP(=O)(OCC)[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001327511189 1047927660 /nfs/dbraw/zinc/92/76/60/1047927660.db2.gz DRBQZSJGOLOOFQ-HNNXBMFYSA-N 1 1 358.331 2.537 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC001333317002 1048831869 /nfs/dbraw/zinc/83/18/69/1048831869.db2.gz QWBYEKFENOPYGO-GDBMZVCRSA-N 1 1 372.450 2.814 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC001333317002 1048831887 /nfs/dbraw/zinc/83/18/87/1048831887.db2.gz QWBYEKFENOPYGO-GDBMZVCRSA-N 1 1 372.450 2.814 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc(C[NH+](C)C)on1 ZINC001341604549 1050231662 /nfs/dbraw/zinc/23/16/62/1050231662.db2.gz UJAWMKVVQVDQLF-UHFFFAOYSA-N 1 1 352.778 2.570 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001342948244 1051562032 /nfs/dbraw/zinc/56/20/32/1051562032.db2.gz DCCBZBMFUUZNIV-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001305057851 1051792497 /nfs/dbraw/zinc/79/24/97/1051792497.db2.gz DGNNUBHPGFCJFP-HNNXBMFYSA-N 1 1 370.457 2.938 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ccncc2[N+](=O)[O-])CCOCC1 ZINC001343246139 1052099915 /nfs/dbraw/zinc/09/99/15/1052099915.db2.gz JYULLWLITQRQRQ-UHFFFAOYSA-N 1 1 356.426 2.505 20 5 FFBDMO O=C(Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1)[C@H]1CC[N@H+]1C1CCCC1 ZINC001306865128 1052206000 /nfs/dbraw/zinc/20/60/00/1052206000.db2.gz FODAXBUTTWUJRW-MRXNPFEDSA-N 1 1 355.398 2.940 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@@H]2CC2CCOCC2)cc1 ZINC001308137895 1052415318 /nfs/dbraw/zinc/41/53/18/1052415318.db2.gz WDHVZTRMDFKTOK-SFHVURJKSA-N 1 1 364.442 2.881 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2ccc3c(c2)OC(F)(F)O3)c1[N+](=O)[O-] ZINC001308833324 1052505492 /nfs/dbraw/zinc/50/54/92/1052505492.db2.gz FUUUGAAGGJNJLY-UHFFFAOYSA-N 1 1 368.292 2.920 20 5 FFBDMO COC(=O)[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001344042438 1052562382 /nfs/dbraw/zinc/56/23/82/1052562382.db2.gz ICBQFDHITBZUIQ-LERXQTSPSA-N 1 1 360.370 2.637 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c1F ZINC001336519737 1054040273 /nfs/dbraw/zinc/04/02/73/1054040273.db2.gz LFKVPSFEWFSJDB-ZDUSSCGKSA-N 1 1 361.348 2.968 20 5 FFBDMO Cc1nn(C(C)C)c(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC001336671552 1054128732 /nfs/dbraw/zinc/12/87/32/1054128732.db2.gz AGUMLHZOSODITM-UHFFFAOYSA-N 1 1 358.446 2.706 20 5 FFBDMO C/C(=C/C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178625 1055187399 /nfs/dbraw/zinc/18/73/99/1055187399.db2.gz RCUCLXAVXKHRCA-SPOJGYOESA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C/C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178625 1055187403 /nfs/dbraw/zinc/18/74/03/1055187403.db2.gz RCUCLXAVXKHRCA-SPOJGYOESA-N 1 1 361.442 2.612 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@H]2CCC[N@@H+](C)C2)n1C ZINC001338487660 1055559387 /nfs/dbraw/zinc/55/93/87/1055559387.db2.gz JHCFLASWHKJJGL-INIZCTEOSA-N 1 1 372.473 2.948 20 5 FFBDMO CC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC001300085897 1055718784 /nfs/dbraw/zinc/71/87/84/1055718784.db2.gz KVWDXLOLSRKITF-PHIMTYICSA-N 1 1 364.402 2.675 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC001300085897 1055718791 /nfs/dbraw/zinc/71/87/91/1055718791.db2.gz KVWDXLOLSRKITF-PHIMTYICSA-N 1 1 364.402 2.675 20 5 FFBDMO CCOC(=O)c1ccnc(NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000609964626 1056426070 /nfs/dbraw/zinc/42/60/70/1056426070.db2.gz NPRGKIPQAVNNJE-OKILXGFUSA-N 1 1 364.446 2.946 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@@H]1C(C)(C)C ZINC001452609008 1059259625 /nfs/dbraw/zinc/25/96/25/1059259625.db2.gz OBPKPLCTLYLYAO-MRXNPFEDSA-N 1 1 351.422 2.855 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C[C@H]1C ZINC001520580855 1059830483 /nfs/dbraw/zinc/83/04/83/1059830483.db2.gz QZNSHTIHZBWFSC-OLZOCXBDSA-N 1 1 356.426 2.885 20 5 FFBDMO COC(=O)CC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848475565 1060096171 /nfs/dbraw/zinc/09/61/71/1060096171.db2.gz SMDOJPHPNFRIMA-UHFFFAOYSA-N 1 1 358.398 2.691 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000848488179 1060135935 /nfs/dbraw/zinc/13/59/35/1060135935.db2.gz CCYFLEWDXXQJRW-HKUYNNGSSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000848488179 1060135938 /nfs/dbraw/zinc/13/59/38/1060135938.db2.gz CCYFLEWDXXQJRW-HKUYNNGSSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000848490240 1060146776 /nfs/dbraw/zinc/14/67/76/1060146776.db2.gz XUXSHLQLLNQREB-WBVHZDCISA-N 1 1 365.380 2.989 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000848490240 1060146779 /nfs/dbraw/zinc/14/67/79/1060146779.db2.gz XUXSHLQLLNQREB-WBVHZDCISA-N 1 1 365.380 2.989 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848783794 1060687699 /nfs/dbraw/zinc/68/76/99/1060687699.db2.gz CYSGIBPJPMTPNY-QZTJIDSGSA-N 1 1 358.442 2.916 20 5 FFBDMO C[C@@]1(O)CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001459787648 1060817961 /nfs/dbraw/zinc/81/79/61/1060817961.db2.gz KRWWQNSTVZQBFA-OAHLLOKOSA-N 1 1 352.778 2.645 20 5 FFBDMO C[C@@]1(O)CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001459787648 1060817971 /nfs/dbraw/zinc/81/79/71/1060817971.db2.gz KRWWQNSTVZQBFA-OAHLLOKOSA-N 1 1 352.778 2.645 20 5 FFBDMO O=C(CC[N@H+]1CCCC[C@]12CCOC2)Nc1cc([N+](=O)[O-])ccc1F ZINC001460957901 1061164392 /nfs/dbraw/zinc/16/43/92/1061164392.db2.gz AQLYAKGVLMEHMO-QGZVFWFLSA-N 1 1 351.378 2.708 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001440034345 1063252262 /nfs/dbraw/zinc/25/22/62/1063252262.db2.gz NWWRTVLAYUPCRR-UHFFFAOYSA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC001441359652 1063427828 /nfs/dbraw/zinc/42/78/28/1063427828.db2.gz HCQVPESHTQDPFL-QWRGUYRKSA-N 1 1 354.838 2.681 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001467550458 1063778419 /nfs/dbraw/zinc/77/84/19/1063778419.db2.gz XEQHMNLRPWHHQX-UHFFFAOYSA-N 1 1 373.457 2.753 20 5 FFBDMO CN(CCCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)CC[NH+](C)C ZINC001467550458 1063778432 /nfs/dbraw/zinc/77/84/32/1063778432.db2.gz XEQHMNLRPWHHQX-UHFFFAOYSA-N 1 1 373.457 2.753 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001469607200 1064178379 /nfs/dbraw/zinc/17/83/79/1064178379.db2.gz YRLKQZALRCPWGD-GASCZTMLSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969470 1078182831 /nfs/dbraw/zinc/18/28/31/1078182831.db2.gz KGCOSJRIBJAGFI-AXFHLTTASA-N 1 1 365.463 2.615 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969470 1078182832 /nfs/dbraw/zinc/18/28/32/1078182832.db2.gz KGCOSJRIBJAGFI-AXFHLTTASA-N 1 1 365.463 2.615 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H]1CN(c2ccccc2)C(=O)O1 ZINC001473767928 1065352264 /nfs/dbraw/zinc/35/22/64/1065352264.db2.gz PWJYBKWMINKABT-INIZCTEOSA-N 1 1 371.393 2.931 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)NCC(F)(F)F ZINC001473938999 1065424260 /nfs/dbraw/zinc/42/42/60/1065424260.db2.gz IXDAQEJVGHPIJQ-UHFFFAOYSA-N 1 1 357.288 2.623 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(C3(C)OCCO3)cc2)c([N+](=O)[O-])cc1O ZINC001474232092 1065472453 /nfs/dbraw/zinc/47/24/53/1065472453.db2.gz RLOZTFPQZCSZLV-UHFFFAOYSA-N 1 1 374.393 2.818 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3nccc4c3CCCC4)C2)nc1 ZINC001474324236 1065493149 /nfs/dbraw/zinc/49/31/49/1065493149.db2.gz ONGPHWMOSCQAKP-HNNXBMFYSA-N 1 1 353.426 2.950 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001585629531 1079482159 /nfs/dbraw/zinc/48/21/59/1079482159.db2.gz XCSLMYUZUBDOIK-ZIAGYGMSSA-N 1 1 354.410 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2CCO)nc1-c1ccccc1 ZINC001559195472 1076133992 /nfs/dbraw/zinc/13/39/92/1076133992.db2.gz KGYNENXXMYYKAN-INIZCTEOSA-N 1 1 356.426 2.916 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 ZINC001559230809 1076137176 /nfs/dbraw/zinc/13/71/76/1076137176.db2.gz PLQQEZXFSQUYFK-QGZVFWFLSA-N 1 1 373.428 2.979 20 5 FFBDMO O=c1c2cc([N+](=O)[O-])sc2ncn1Cc1[nH+]ccn1Cc1ccccc1 ZINC001559410709 1076156478 /nfs/dbraw/zinc/15/64/78/1076156478.db2.gz UYBHXGSMKCLSQP-UHFFFAOYSA-N 1 1 367.390 2.659 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1cnc(C)s1 ZINC001560057443 1076219124 /nfs/dbraw/zinc/21/91/24/1076219124.db2.gz RUGILWOPUXKBLQ-SECBINFHSA-N 1 1 350.400 2.658 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1F ZINC001561309337 1076360479 /nfs/dbraw/zinc/36/04/79/1076360479.db2.gz XVSUTUZMTMKEQX-CYBMUJFWSA-N 1 1 373.450 2.537 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c(C)c1[N+](=O)[O-] ZINC001561474841 1076382204 /nfs/dbraw/zinc/38/22/04/1076382204.db2.gz RJGUOXSUSZBAOM-OCCSQVGLSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(NCC1([NH2+]CCc2ccc3ccccc3c2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570104225 1077182712 /nfs/dbraw/zinc/18/27/12/1077182712.db2.gz YUZOQUNXUXRRSN-RTBURBONSA-N 1 1 367.449 2.676 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001586485481 1079637959 /nfs/dbraw/zinc/63/79/59/1079637959.db2.gz VJSXACWYRJUOMP-KUHUBIRLSA-N 1 1 368.437 2.939 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589695763 1080673968 /nfs/dbraw/zinc/67/39/68/1080673968.db2.gz VFEFUVQXWMOUIQ-UHFFFAOYSA-N 1 1 373.442 2.685 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1SC ZINC000103085385 250135457 /nfs/dbraw/zinc/13/54/57/250135457.db2.gz PGNDCULKVSIOLX-JTQLQIEISA-N 1 1 353.444 2.538 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000117573571 250352858 /nfs/dbraw/zinc/35/28/58/250352858.db2.gz VZXVUEXNFLVAPV-AWEZNQCLSA-N 1 1 351.790 2.803 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c2c(c1)COCO2 ZINC000131898051 251028853 /nfs/dbraw/zinc/02/88/53/251028853.db2.gz ZTTSGKUHLWPVHY-QGZVFWFLSA-N 1 1 357.366 2.510 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c2c(c1)COCO2 ZINC000131898051 251028857 /nfs/dbraw/zinc/02/88/57/251028857.db2.gz ZTTSGKUHLWPVHY-QGZVFWFLSA-N 1 1 357.366 2.510 20 5 FFBDMO CCOc1ccc([C@H](C)NC2CC[NH+](CCOC)CC2)cc1[N+](=O)[O-] ZINC000153218713 251113991 /nfs/dbraw/zinc/11/39/91/251113991.db2.gz GTFIOHWTJVXFRI-AWEZNQCLSA-N 1 1 351.447 2.755 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)[C@@H]2C1 ZINC000272383871 252024817 /nfs/dbraw/zinc/02/48/17/252024817.db2.gz CCDKXXOIKPULTE-MLGOLLRUSA-N 1 1 372.450 2.885 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000272417434 252032860 /nfs/dbraw/zinc/03/28/60/252032860.db2.gz GSTKPRZBGBSCDU-UKRRQHHQSA-N 1 1 371.441 2.521 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272470419 252045994 /nfs/dbraw/zinc/04/59/94/252045994.db2.gz AFPATKFGHWACMD-MJGOQNOKSA-N 1 1 366.421 2.783 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272776989 252128595 /nfs/dbraw/zinc/12/85/95/252128595.db2.gz DEFDGSBTESFVAH-ZDUSSCGKSA-N 1 1 350.419 2.799 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccnc1Cl ZINC000273402702 252299044 /nfs/dbraw/zinc/29/90/44/252299044.db2.gz GQTLKGYRWBOCFF-NSHDSACASA-N 1 1 369.830 2.768 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)c1 ZINC000285717455 257000974 /nfs/dbraw/zinc/00/09/74/257000974.db2.gz HLXKJTUPSTZPBV-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354373 256092544 /nfs/dbraw/zinc/09/25/44/256092544.db2.gz UXUBZKUKVUXJBM-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354373 256092545 /nfs/dbraw/zinc/09/25/45/256092545.db2.gz UXUBZKUKVUXJBM-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1ccc(NC(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000277342289 256187350 /nfs/dbraw/zinc/18/73/50/256187350.db2.gz DGNIKSPGRIZFME-CQSZACIVSA-N 1 1 350.419 2.526 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277645598 256221350 /nfs/dbraw/zinc/22/13/50/256221350.db2.gz SEOJFBZXAXPZQJ-MDJJKAFGSA-N 1 1 361.442 2.615 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000277925852 256256343 /nfs/dbraw/zinc/25/63/43/256256343.db2.gz HIDJPTUAWYKAFS-UHFFFAOYSA-N 1 1 357.370 2.769 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000278386538 256306833 /nfs/dbraw/zinc/30/68/33/256306833.db2.gz DJHVDUKJVWUCSB-UHFFFAOYSA-N 1 1 360.336 2.507 20 5 FFBDMO CC[NH+]1CCN(c2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278452150 256314739 /nfs/dbraw/zinc/31/47/39/256314739.db2.gz LPWSMUCUMBROGL-UHFFFAOYSA-N 1 1 354.279 2.786 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000278525384 256321989 /nfs/dbraw/zinc/32/19/89/256321989.db2.gz GRVUIFDPZANQPY-UHFFFAOYSA-N 1 1 356.382 2.564 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279147460 256386635 /nfs/dbraw/zinc/38/66/35/256386635.db2.gz ZVOGZZQIESILTB-UHFFFAOYSA-N 1 1 374.363 2.851 20 5 FFBDMO CC(C)(C)c1cnc(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000279203099 256392849 /nfs/dbraw/zinc/39/28/49/256392849.db2.gz VDITXXIBDPERFM-CZUORRHYSA-N 1 1 365.455 2.533 20 5 FFBDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000278892265 256359239 /nfs/dbraw/zinc/35/92/39/256359239.db2.gz IXSZQXAPEXVADW-MRXNPFEDSA-N 1 1 365.817 2.729 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000284116676 256914689 /nfs/dbraw/zinc/91/46/89/256914689.db2.gz ZARPRRNAJNPCOV-UHFFFAOYSA-N 1 1 367.203 2.601 20 5 FFBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000286116975 257021011 /nfs/dbraw/zinc/02/10/11/257021011.db2.gz UPBZIHOCPDBYHV-XJKSGUPXSA-N 1 1 350.415 2.977 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CCC(=O)Nc4ccc([N+](=O)[O-])cc4C)[C@H]1[C@H]3C2 ZINC000286464127 257038520 /nfs/dbraw/zinc/03/85/20/257038520.db2.gz KOGDAEPTCDDXNP-RSADAIHESA-N 1 1 359.426 2.587 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000286735040 257052282 /nfs/dbraw/zinc/05/22/82/257052282.db2.gz XWFPNENRNFDXHU-OORQEUNZSA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000286735040 257052283 /nfs/dbraw/zinc/05/22/83/257052283.db2.gz XWFPNENRNFDXHU-OORQEUNZSA-N 1 1 365.817 2.542 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCOC4CCC4)CC3)nc2c1 ZINC000287670151 257101663 /nfs/dbraw/zinc/10/16/63/257101663.db2.gz HQCOXRZMZZOQNP-UHFFFAOYSA-N 1 1 359.430 2.552 20 5 FFBDMO COCCOCc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000289748991 257297022 /nfs/dbraw/zinc/29/70/22/257297022.db2.gz PVIXECWUEFYUPA-UHFFFAOYSA-N 1 1 370.409 2.924 20 5 FFBDMO CC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC(C)(C)C1 ZINC000289762611 257297832 /nfs/dbraw/zinc/29/78/32/257297832.db2.gz KUBBZEIRHSFSAO-HNNXBMFYSA-N 1 1 370.471 2.648 20 5 FFBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000290266985 257322786 /nfs/dbraw/zinc/32/27/86/257322786.db2.gz XJHPFXBRTDTOMF-LJQANCHMSA-N 1 1 358.442 2.980 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)C2)C1 ZINC000294195845 257577933 /nfs/dbraw/zinc/57/79/33/257577933.db2.gz PUWOVRUVUISNHA-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000294899163 257607459 /nfs/dbraw/zinc/60/74/59/257607459.db2.gz JCOMFGGXOXHSFG-LBPRGKRZSA-N 1 1 353.394 2.546 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@@H](C)[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301187211 258032647 /nfs/dbraw/zinc/03/26/47/258032647.db2.gz KFNMUTZQGMYGDJ-LSDHHAIUSA-N 1 1 371.441 2.881 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+](C)C2CCC(OC)CC2)c([N+](=O)[O-])c1 ZINC000299407416 257991372 /nfs/dbraw/zinc/99/13/72/257991372.db2.gz VNTVUQFSTOGVOQ-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(Nc2cccc(C[NH+]3CCOCC3)c2)c1 ZINC000302099109 258088005 /nfs/dbraw/zinc/08/80/05/258088005.db2.gz PGGKGJUKYPJIJU-UHFFFAOYSA-N 1 1 371.393 2.957 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)c1 ZINC000302120777 258088961 /nfs/dbraw/zinc/08/89/61/258088961.db2.gz XTWZWINVXYGNJH-CHWSQXEVSA-N 1 1 365.430 2.681 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c2cccnc21 ZINC000301777153 258066915 /nfs/dbraw/zinc/06/69/15/258066915.db2.gz PBTGAPPAGZEYSV-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO COc1cc(NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000301871893 258071927 /nfs/dbraw/zinc/07/19/27/258071927.db2.gz DBDNXTJIPYMXLV-STQMWFEESA-N 1 1 367.446 2.912 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301878825 258072625 /nfs/dbraw/zinc/07/26/25/258072625.db2.gz JKUUSJZCPJZXSP-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301964446 258078374 /nfs/dbraw/zinc/07/83/74/258078374.db2.gz NTATVLHSSDZEMN-HOCLYGCPSA-N 1 1 366.425 2.960 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332263452 258222258 /nfs/dbraw/zinc/22/22/58/258222258.db2.gz DWEFOFFVOWHERZ-NWDGAFQWSA-N 1 1 355.341 2.553 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757816 258199473 /nfs/dbraw/zinc/19/94/73/258199473.db2.gz BDRCIYKNQRZUME-MJBXVCDLSA-N 1 1 363.462 2.919 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757816 258199474 /nfs/dbraw/zinc/19/94/74/258199474.db2.gz BDRCIYKNQRZUME-MJBXVCDLSA-N 1 1 363.462 2.919 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757816 258199475 /nfs/dbraw/zinc/19/94/75/258199475.db2.gz BDRCIYKNQRZUME-MJBXVCDLSA-N 1 1 363.462 2.919 20 5 FFBDMO COc1ccc(OC)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000054771836 132303269 /nfs/dbraw/zinc/30/32/69/132303269.db2.gz GNZIFMFGJPFHRX-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CCc1cc(N[C@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000064914308 506240265 /nfs/dbraw/zinc/24/02/65/506240265.db2.gz UWWNFVJOTLILFA-CQSZACIVSA-N 1 1 371.441 2.747 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267924 512194007 /nfs/dbraw/zinc/19/40/07/512194007.db2.gz RBYPAFAHIIOIJY-CQSZACIVSA-N 1 1 357.414 2.537 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCCC2(CC[NH+](C)CC2)C1 ZINC000366864600 512224242 /nfs/dbraw/zinc/22/42/42/512224242.db2.gz LMAWRGLVBXKCCG-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO CC(C)CCC[C@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373243759 512237290 /nfs/dbraw/zinc/23/72/90/512237290.db2.gz OWPNQCWRTNQMON-HNNXBMFYSA-N 1 1 365.478 2.759 20 5 FFBDMO Cc1ccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(C)c1 ZINC000373243423 512237443 /nfs/dbraw/zinc/23/74/43/512237443.db2.gz OFLFNQPQQQCWKN-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO C[N@@H+](CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)Cc1ccccc1 ZINC000065882128 506385498 /nfs/dbraw/zinc/38/54/98/506385498.db2.gz MVDXGXGFPQUYME-UHFFFAOYSA-N 1 1 366.421 2.798 20 5 FFBDMO CNC(=O)c1ccc(NC[C@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000053558768 506405985 /nfs/dbraw/zinc/40/59/85/506405985.db2.gz SOSLEYUXFVLZGI-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000053666704 506424192 /nfs/dbraw/zinc/42/41/92/506424192.db2.gz BWNWQOPYOIOIMA-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CCOC)CC1 ZINC000371225561 512276566 /nfs/dbraw/zinc/27/65/66/512276566.db2.gz KUIZRFVNWBAUPV-UHFFFAOYSA-N 1 1 367.471 2.501 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000375349945 512280466 /nfs/dbraw/zinc/28/04/66/512280466.db2.gz RFRLKMATSSEKFM-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000054394185 506552044 /nfs/dbraw/zinc/55/20/44/506552044.db2.gz FBJDBWPHJCMASU-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000054394185 506552050 /nfs/dbraw/zinc/55/20/50/506552050.db2.gz FBJDBWPHJCMASU-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCc2cccs2)CC1 ZINC000067232626 506799811 /nfs/dbraw/zinc/79/98/11/506799811.db2.gz HZILKRQLLBFVMP-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067379430 506851777 /nfs/dbraw/zinc/85/17/77/506851777.db2.gz VATUFGODFSETGS-QFBILLFUSA-N 1 1 366.421 2.887 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067379430 506851785 /nfs/dbraw/zinc/85/17/85/506851785.db2.gz VATUFGODFSETGS-QFBILLFUSA-N 1 1 366.421 2.887 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])c4cnccc34)C2)CC1 ZINC000369245563 512305501 /nfs/dbraw/zinc/30/55/01/512305501.db2.gz YPZBNIJKYJIIBM-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO Cc1cccc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000371283916 512306101 /nfs/dbraw/zinc/30/61/01/512306101.db2.gz MKWKINKTBBDVRI-PIIMJCKOSA-N 1 1 351.406 2.763 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCOc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000015100155 507019438 /nfs/dbraw/zinc/01/94/38/507019438.db2.gz HSTXWDDKEFKDOM-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCOc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000015100155 507019443 /nfs/dbraw/zinc/01/94/43/507019443.db2.gz HSTXWDDKEFKDOM-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085600 507104682 /nfs/dbraw/zinc/10/46/82/507104682.db2.gz JMTGWQXZZOXZGI-CHWSQXEVSA-N 1 1 359.430 2.569 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000068126625 507120276 /nfs/dbraw/zinc/12/02/76/507120276.db2.gz MGBQCYABPWEEAI-GFCCVEGCSA-N 1 1 352.410 2.701 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ncccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000046484442 507142314 /nfs/dbraw/zinc/14/23/14/507142314.db2.gz NFBASQOVWGZHCP-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO CN1CC[N@H+](CCCNc2ncccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000046484442 507142322 /nfs/dbraw/zinc/14/23/22/507142322.db2.gz NFBASQOVWGZHCP-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ncccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000046484442 507142329 /nfs/dbraw/zinc/14/23/29/507142329.db2.gz NFBASQOVWGZHCP-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000367073270 512325469 /nfs/dbraw/zinc/32/54/69/512325469.db2.gz JRTWVIGJZLFCLQ-QGZVFWFLSA-N 1 1 351.378 2.565 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000057348896 507244778 /nfs/dbraw/zinc/24/47/78/507244778.db2.gz NQNMGQUYQUGNBG-OAHLLOKOSA-N 1 1 352.394 2.923 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000047145505 507271843 /nfs/dbraw/zinc/27/18/43/507271843.db2.gz NAXRHTMFLZTZFN-INIZCTEOSA-N 1 1 374.485 2.659 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCN(C)c2ccccc2C1 ZINC000069090985 507405700 /nfs/dbraw/zinc/40/57/00/507405700.db2.gz IAUUIEYLAPXZLY-CQSZACIVSA-N 1 1 354.410 2.874 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000069090985 507405708 /nfs/dbraw/zinc/40/57/08/507405708.db2.gz IAUUIEYLAPXZLY-CQSZACIVSA-N 1 1 354.410 2.874 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000025136686 507471620 /nfs/dbraw/zinc/47/16/20/507471620.db2.gz BTFPUJJMRPCRJN-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000060706476 507574719 /nfs/dbraw/zinc/57/47/19/507574719.db2.gz RJRGGFIJRYVICT-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO Cc1cccc(OCC[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000027374265 507653562 /nfs/dbraw/zinc/65/35/62/507653562.db2.gz WZSIXUXCDGJPOL-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000027374265 507653569 /nfs/dbraw/zinc/65/35/69/507653569.db2.gz WZSIXUXCDGJPOL-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051049483 507728110 /nfs/dbraw/zinc/72/81/10/507728110.db2.gz PZXFFLJUADVAOK-JKSUJKDBSA-N 1 1 363.458 2.990 20 5 FFBDMO CCOC(=O)C1(COC)CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000373488801 512357211 /nfs/dbraw/zinc/35/72/11/512357211.db2.gz IJFOAYBWSUAAHM-UHFFFAOYSA-N 1 1 350.415 2.695 20 5 FFBDMO COc1ccc(C[NH+]2CCC(NC(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000051502975 507773351 /nfs/dbraw/zinc/77/33/51/507773351.db2.gz SHBNSHPQDXKAOW-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000052160060 507800187 /nfs/dbraw/zinc/80/01/87/507800187.db2.gz SMDAVRFULWOKMB-RYUDHWBXSA-N 1 1 366.418 2.836 20 5 FFBDMO Cc1nn(C)c(Nc2cccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)c2)c1[N+](=O)[O-] ZINC000077983154 507823563 /nfs/dbraw/zinc/82/35/63/507823563.db2.gz WMGVONHMGYFOMB-BETUJISGSA-N 1 1 359.430 2.990 20 5 FFBDMO CCCNC(=O)C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089883033 507877924 /nfs/dbraw/zinc/87/79/24/507877924.db2.gz UCYKXSRZFXFOFW-UHFFFAOYSA-N 1 1 372.425 2.988 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000108395297 507892181 /nfs/dbraw/zinc/89/21/81/507892181.db2.gz WYACXZKEUYWJGN-KRWDZBQOSA-N 1 1 361.442 2.765 20 5 FFBDMO C[N@@H+](CCCOc1cccc(Cl)c1)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090518870 507924900 /nfs/dbraw/zinc/92/49/00/507924900.db2.gz NGUJXZZBSIZHFQ-UHFFFAOYSA-N 1 1 365.817 2.811 20 5 FFBDMO COCCCOCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000091101668 507956036 /nfs/dbraw/zinc/95/60/36/507956036.db2.gz NYXPBFPTUHBHJY-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000091101668 507956039 /nfs/dbraw/zinc/95/60/39/507956039.db2.gz NYXPBFPTUHBHJY-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000079649090 507987039 /nfs/dbraw/zinc/98/70/39/507987039.db2.gz HHYPXCYKOAOYQC-UHFFFAOYSA-N 1 1 357.332 2.781 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(n4ccnc4)CC3)n2)c1 ZINC000109795713 507988168 /nfs/dbraw/zinc/98/81/68/507988168.db2.gz NUULTOXYUASDEX-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[N@@H+]1CCc2ccccc2C1 ZINC000110048667 508003740 /nfs/dbraw/zinc/00/37/40/508003740.db2.gz HXIOMAILIGEVKM-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2ccccc2C1 ZINC000110048667 508003742 /nfs/dbraw/zinc/00/37/42/508003742.db2.gz HXIOMAILIGEVKM-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCO)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000074312415 508009647 /nfs/dbraw/zinc/00/96/47/508009647.db2.gz KMJSFCBGZYHKPM-SFHVURJKSA-N 1 1 369.421 2.566 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000074325531 508012356 /nfs/dbraw/zinc/01/23/56/508012356.db2.gz ZPGNZLZOYAXUCQ-AWEZNQCLSA-N 1 1 356.426 2.880 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000110654271 508039690 /nfs/dbraw/zinc/03/96/90/508039690.db2.gz WIXUETOYNVOFJG-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000110815018 508049284 /nfs/dbraw/zinc/04/92/84/508049284.db2.gz XWTGUOLRQNFQRN-INIZCTEOSA-N 1 1 374.485 2.999 20 5 FFBDMO CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000074775069 508054304 /nfs/dbraw/zinc/05/43/04/508054304.db2.gz MMQQMEHXGKMFDR-QGZVFWFLSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000080230706 508054498 /nfs/dbraw/zinc/05/44/98/508054498.db2.gz ZEJJLJIALRSMQQ-HIFRSBDPSA-N 1 1 369.425 2.554 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](N2CCCC2=O)C1 ZINC000111292026 508087208 /nfs/dbraw/zinc/08/72/08/508087208.db2.gz BPBRLQMRNIRGSO-KRWDZBQOSA-N 1 1 361.442 2.969 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](N2CCCC2=O)C1 ZINC000111292026 508087210 /nfs/dbraw/zinc/08/72/10/508087210.db2.gz BPBRLQMRNIRGSO-KRWDZBQOSA-N 1 1 361.442 2.969 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3ccc([N+](=O)[O-])cc3C)CC2)CC1 ZINC000080636054 508090455 /nfs/dbraw/zinc/09/04/55/508090455.db2.gz AQOHLQAJRHIGMJ-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO CCc1nn(C)c(N2CCC[N@@H+](Cc3ccc(OC)cc3)CC2)c1[N+](=O)[O-] ZINC000092827665 508103538 /nfs/dbraw/zinc/10/35/38/508103538.db2.gz KYRSDIJVUVXRPX-UHFFFAOYSA-N 1 1 373.457 2.612 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095401 508137020 /nfs/dbraw/zinc/13/70/20/508137020.db2.gz ZMQCLQMABAHUAS-CJNGLKHVSA-N 1 1 359.430 2.807 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000081126540 508140262 /nfs/dbraw/zinc/14/02/62/508140262.db2.gz LQBVJPUMDNBANL-KRWDZBQOSA-N 1 1 368.437 2.740 20 5 FFBDMO CC(=O)Nc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534395 508148449 /nfs/dbraw/zinc/14/84/49/508148449.db2.gz DXJUBCHCGLGIGL-INIZCTEOSA-N 1 1 355.398 2.635 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000076487377 508212831 /nfs/dbraw/zinc/21/28/31/508212831.db2.gz PVVZUHJTUQOXJL-WBMJQRKESA-N 1 1 353.850 2.979 20 5 FFBDMO CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170227 508239012 /nfs/dbraw/zinc/23/90/12/508239012.db2.gz QYXUWSYZVQNWOA-CYBMUJFWSA-N 1 1 360.414 2.720 20 5 FFBDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170227 508239017 /nfs/dbraw/zinc/23/90/17/508239017.db2.gz QYXUWSYZVQNWOA-CYBMUJFWSA-N 1 1 360.414 2.720 20 5 FFBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000114370986 508308341 /nfs/dbraw/zinc/30/83/41/508308341.db2.gz MMGQQRUYHOIUNM-AWEZNQCLSA-N 1 1 363.458 2.733 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104680067 508341018 /nfs/dbraw/zinc/34/10/18/508341018.db2.gz VTAZPUVOVIVXRG-AWEZNQCLSA-N 1 1 358.398 2.522 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115273566 508380283 /nfs/dbraw/zinc/38/02/83/508380283.db2.gz YYJPGCHXYXKSNE-CRAIPNDOSA-N 1 1 363.458 2.770 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000077932960 508393362 /nfs/dbraw/zinc/39/33/62/508393362.db2.gz JKNIMFFTAQNWCI-STQMWFEESA-N 1 1 350.419 2.699 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000115519759 508405322 /nfs/dbraw/zinc/40/53/22/508405322.db2.gz ANENQUHFCDHVEJ-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000156388269 508412423 /nfs/dbraw/zinc/41/24/23/508412423.db2.gz BFMKIDBNXZOSRQ-KRWDZBQOSA-N 1 1 369.487 2.525 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000152294333 508417188 /nfs/dbraw/zinc/41/71/88/508417188.db2.gz NAFBEPGKHCLLOZ-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000115640060 508420490 /nfs/dbraw/zinc/42/04/90/508420490.db2.gz VDCCLMSEVGPAFL-RHSMWYFYSA-N 1 1 364.446 2.853 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1ccnc1 ZINC000156455075 508423699 /nfs/dbraw/zinc/42/36/99/508423699.db2.gz DFRWGSJKLRESGA-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1ccnc1 ZINC000156455075 508423704 /nfs/dbraw/zinc/42/37/04/508423704.db2.gz DFRWGSJKLRESGA-CJNGLKHVSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000115844511 508446895 /nfs/dbraw/zinc/44/68/95/508446895.db2.gz BYUXXTADPYHLQU-QLFBSQMISA-N 1 1 367.471 2.621 20 5 FFBDMO C[N@@H+](CCNC(=O)CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000115866815 508449234 /nfs/dbraw/zinc/44/92/34/508449234.db2.gz CDNYEYKPYPZICK-UHFFFAOYSA-N 1 1 357.410 2.612 20 5 FFBDMO Cc1c(Br)cc(C(=O)NC[C@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000122526458 508548809 /nfs/dbraw/zinc/54/88/09/508548809.db2.gz HPSKRAKGRHWPMF-LLVKDONJSA-N 1 1 370.247 2.737 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000122946422 508611665 /nfs/dbraw/zinc/61/16/65/508611665.db2.gz SAQNOUSMISBFCF-TZMCWYRMSA-N 1 1 369.849 2.958 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1SC ZINC000123206729 508652156 /nfs/dbraw/zinc/65/21/56/508652156.db2.gz SLUFCUOHQUGOLZ-VXGBXAGGSA-N 1 1 367.471 2.880 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)CCOCC(F)(F)F)ccc1Cl ZINC000153918677 508676731 /nfs/dbraw/zinc/67/67/31/508676731.db2.gz YKUNJOXFMKTMBD-UHFFFAOYSA-N 1 1 356.728 2.621 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000137432769 508756463 /nfs/dbraw/zinc/75/64/63/508756463.db2.gz YEOILEHXMYXTIN-RDJZCZTQSA-N 1 1 368.437 2.786 20 5 FFBDMO CC1CCN(C[C@@H](O)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000158872066 508762229 /nfs/dbraw/zinc/76/22/29/508762229.db2.gz CIQYNACYRXVKCD-OALUTQOASA-N 1 1 361.486 2.598 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000138259421 508771230 /nfs/dbraw/zinc/77/12/30/508771230.db2.gz YXIPDVNOKWTSOC-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO CCNC(=O)C[N@H+](CC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000119318778 508772440 /nfs/dbraw/zinc/77/24/40/508772440.db2.gz KIMLVGFFTXARDW-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO CCNC(=O)C[N@@H+](CC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000119318778 508772442 /nfs/dbraw/zinc/77/24/42/508772442.db2.gz KIMLVGFFTXARDW-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO O=C(c1ccc(O)cc1)C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000154480654 508793561 /nfs/dbraw/zinc/79/35/61/508793561.db2.gz PPXIGGLCJNTXCU-LJQANCHMSA-N 1 1 370.405 2.929 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000124268608 508806890 /nfs/dbraw/zinc/80/68/90/508806890.db2.gz BPRWPWYEOUJXAE-MRXNPFEDSA-N 1 1 363.458 2.848 20 5 FFBDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CCCC1 ZINC000159274028 508817757 /nfs/dbraw/zinc/81/77/57/508817757.db2.gz AEPRQVMWCOOINI-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3ncnc4ccsc43)CC2)cc1 ZINC000124460384 508835635 /nfs/dbraw/zinc/83/56/35/508835635.db2.gz HGBLXZBLJSIKJN-UHFFFAOYSA-N 1 1 369.450 2.964 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744640 508854969 /nfs/dbraw/zinc/85/49/69/508854969.db2.gz RWBKDWQAKXAOCG-NDGNNOQLSA-N 1 1 358.486 2.899 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150880301 508914123 /nfs/dbraw/zinc/91/41/23/508914123.db2.gz GXYAVSSPTVCZQR-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Nc1ccc(F)c(NC(=O)CC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131316686 508914607 /nfs/dbraw/zinc/91/46/07/508914607.db2.gz NDDHOSDOPVRNBM-UHFFFAOYSA-N 1 1 358.373 2.703 20 5 FFBDMO Nc1ccc(F)c(NC(=O)CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000131316686 508914611 /nfs/dbraw/zinc/91/46/11/508914611.db2.gz NDDHOSDOPVRNBM-UHFFFAOYSA-N 1 1 358.373 2.703 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000160245333 508959938 /nfs/dbraw/zinc/95/99/38/508959938.db2.gz OVEAETJKHVPBBF-KUHUBIRLSA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000120265335 508961589 /nfs/dbraw/zinc/96/15/89/508961589.db2.gz ASVZDYUWDCLVOB-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000160471713 508991501 /nfs/dbraw/zinc/99/15/01/508991501.db2.gz VWQJNQHXJJGBRU-GUTXKFCHSA-N 1 1 364.402 2.581 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000160471713 508991504 /nfs/dbraw/zinc/99/15/04/508991504.db2.gz VWQJNQHXJJGBRU-GUTXKFCHSA-N 1 1 364.402 2.581 20 5 FFBDMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1ccc([N+](=O)[O-])cc1 ZINC000151697721 509068574 /nfs/dbraw/zinc/06/85/74/509068574.db2.gz DWTQCBLRXLGOQG-IBGZPJMESA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1ccc([N+](=O)[O-])cc1 ZINC000151697721 509068577 /nfs/dbraw/zinc/06/85/77/509068577.db2.gz DWTQCBLRXLGOQG-IBGZPJMESA-N 1 1 369.421 2.502 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000377761354 512436246 /nfs/dbraw/zinc/43/62/46/512436246.db2.gz PFRVAZRHZOCWOS-MRXNPFEDSA-N 1 1 357.414 2.684 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000161340368 509104415 /nfs/dbraw/zinc/10/44/15/509104415.db2.gz XVFITMASNUQPND-YGRLFVJLSA-N 1 1 370.247 2.816 20 5 FFBDMO O=C1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@H]2N1 ZINC000133289684 509142997 /nfs/dbraw/zinc/14/29/97/509142997.db2.gz KZAXKEFAPCTGGK-CVEARBPZSA-N 1 1 370.409 2.535 20 5 FFBDMO O=C1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@H]2N1 ZINC000133289684 509143002 /nfs/dbraw/zinc/14/30/02/509143002.db2.gz KZAXKEFAPCTGGK-CVEARBPZSA-N 1 1 370.409 2.535 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000162089386 509172074 /nfs/dbraw/zinc/17/20/74/509172074.db2.gz JWQKALRMUKWUPG-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000185448247 509182117 /nfs/dbraw/zinc/18/21/17/509182117.db2.gz CWZNDBQDJMFBHG-CQSZACIVSA-N 1 1 374.466 2.974 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185493516 509204779 /nfs/dbraw/zinc/20/47/79/509204779.db2.gz HQVCUOVUSKXFRS-FZKQIMNGSA-N 1 1 353.382 2.560 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]2CCCC[C@H]21 ZINC000248411194 509306055 /nfs/dbraw/zinc/30/60/55/509306055.db2.gz DNILVSZDFQBVSC-MBNYWOFBSA-N 1 1 361.398 2.773 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](C4OCCO4)C3)co2)cc1 ZINC000179184175 509307849 /nfs/dbraw/zinc/30/78/49/509307849.db2.gz NRCHKNSNBRCEBT-CQSZACIVSA-N 1 1 359.382 2.835 20 5 FFBDMO O=C(c1cc(F)ccc1F)C1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000267027680 509314735 /nfs/dbraw/zinc/31/47/35/509314735.db2.gz AIYBMMBJEWLDBM-UHFFFAOYSA-N 1 1 364.352 2.664 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182585986 509318591 /nfs/dbraw/zinc/31/85/91/509318591.db2.gz HDIHKKFJADXEMS-UHFFFAOYSA-N 1 1 368.340 2.863 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@H]2C1 ZINC000182644235 509348826 /nfs/dbraw/zinc/34/88/26/509348826.db2.gz XWOGNNRRSNPCCP-LBPRGKRZSA-N 1 1 355.847 2.647 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)CCn1ccc([N+](=O)[O-])n1 ZINC000176236512 509395715 /nfs/dbraw/zinc/39/57/15/509395715.db2.gz YUTSZCUEKVALQZ-UHFFFAOYSA-N 1 1 372.404 2.885 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@@H+](CC(C)C)C1 ZINC000176253396 509404731 /nfs/dbraw/zinc/40/47/31/509404731.db2.gz WPPLPWDRFYPHSZ-ZDUSSCGKSA-N 1 1 350.419 2.703 20 5 FFBDMO Cc1cc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000182824534 509444213 /nfs/dbraw/zinc/44/42/13/509444213.db2.gz MUCGNTFPBISQLZ-UONOGXRCSA-N 1 1 360.458 2.868 20 5 FFBDMO C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831109 509447335 /nfs/dbraw/zinc/44/73/35/509447335.db2.gz GUIWDXQROKXZCK-STQMWFEESA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182831109 509447341 /nfs/dbraw/zinc/44/73/41/509447341.db2.gz GUIWDXQROKXZCK-STQMWFEESA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831109 509447349 /nfs/dbraw/zinc/44/73/49/509447349.db2.gz GUIWDXQROKXZCK-STQMWFEESA-N 1 1 371.441 2.854 20 5 FFBDMO CC[NH+]1CCN(CCCCNC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000186337214 509655332 /nfs/dbraw/zinc/65/53/32/509655332.db2.gz FZVDIHOEQRFXJI-WUKNDPDISA-N 1 1 374.485 2.532 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183210678 509659970 /nfs/dbraw/zinc/65/99/70/509659970.db2.gz BVAFZRNWQJWYKF-PHIMTYICSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183210678 509659975 /nfs/dbraw/zinc/65/99/75/509659975.db2.gz BVAFZRNWQJWYKF-PHIMTYICSA-N 1 1 357.863 2.891 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173644441 509694721 /nfs/dbraw/zinc/69/47/21/509694721.db2.gz LJYQVSNGGFBZQA-GOSISDBHSA-N 1 1 361.442 2.839 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)nn21 ZINC000192958021 509714255 /nfs/dbraw/zinc/71/42/55/509714255.db2.gz XZJGJGLNSAZHLZ-OAHLLOKOSA-N 1 1 352.398 2.572 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268108155 509760938 /nfs/dbraw/zinc/76/09/38/509760938.db2.gz GDBGPBFXHSNRHW-XHDPSFHLSA-N 1 1 354.838 2.730 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000249802596 509767075 /nfs/dbraw/zinc/76/70/75/509767075.db2.gz ZNYXUAWRUPAZGT-STQMWFEESA-N 1 1 350.419 2.845 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000264950872 509793117 /nfs/dbraw/zinc/79/31/17/509793117.db2.gz JYBYWLQZZHBBBR-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)c1 ZINC000177062833 509847558 /nfs/dbraw/zinc/84/75/58/509847558.db2.gz SHFRQGJUAOLOCU-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000268336896 509875217 /nfs/dbraw/zinc/87/52/17/509875217.db2.gz GEQYWZQDEIRWSE-MFKMUULPSA-N 1 1 370.247 2.816 20 5 FFBDMO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000177124385 509887062 /nfs/dbraw/zinc/88/70/62/509887062.db2.gz BIFRSCVKKVLFTI-MRXNPFEDSA-N 1 1 354.414 2.998 20 5 FFBDMO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000177124385 509887066 /nfs/dbraw/zinc/88/70/66/509887066.db2.gz BIFRSCVKKVLFTI-MRXNPFEDSA-N 1 1 354.414 2.998 20 5 FFBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000255583522 509929454 /nfs/dbraw/zinc/92/94/54/509929454.db2.gz OJTOOUOATZAZCU-KIUVSXKZSA-N 1 1 352.456 2.896 20 5 FFBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000255583522 509929459 /nfs/dbraw/zinc/92/94/59/509929459.db2.gz OJTOOUOATZAZCU-KIUVSXKZSA-N 1 1 352.456 2.896 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245440540 509935340 /nfs/dbraw/zinc/93/53/40/509935340.db2.gz UPSVCKKXTQQYLP-WMLDXEAASA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000245440540 509935344 /nfs/dbraw/zinc/93/53/44/509935344.db2.gz UPSVCKKXTQQYLP-WMLDXEAASA-N 1 1 362.474 2.894 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC000177204900 509935950 /nfs/dbraw/zinc/93/59/50/509935950.db2.gz FCCWKYZBYJTYPT-PVAVHDDUSA-N 1 1 352.456 2.695 20 5 FFBDMO C[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000180465111 509937844 /nfs/dbraw/zinc/93/78/44/509937844.db2.gz HCRZXFQSOQIXQZ-LAUBAEHRSA-N 1 1 368.481 2.910 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000265294001 509971553 /nfs/dbraw/zinc/97/15/53/509971553.db2.gz VQQUGINLUDNEDY-UHFFFAOYSA-N 1 1 366.805 2.729 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@H]21 ZINC000245534636 509988323 /nfs/dbraw/zinc/98/83/23/509988323.db2.gz WDZDIJRSIPTQOP-BXUZGUMPSA-N 1 1 369.368 2.753 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)OCCO1 ZINC000183843008 510001938 /nfs/dbraw/zinc/00/19/38/510001938.db2.gz GSRCKXNDFNHXTN-CQSZACIVSA-N 1 1 374.397 2.620 20 5 FFBDMO C[C@H](C(=O)NC1CCCC1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242732 510020370 /nfs/dbraw/zinc/02/03/70/510020370.db2.gz MYCGSEKWZKGKKU-CQSZACIVSA-N 1 1 361.442 2.885 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)OCCO1 ZINC000183881071 510020850 /nfs/dbraw/zinc/02/08/50/510020850.db2.gz XCHGQKALCSWLNP-CQSZACIVSA-N 1 1 374.397 2.620 20 5 FFBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCCCCC1 ZINC000174247293 510023260 /nfs/dbraw/zinc/02/32/60/510023260.db2.gz BFAFCGKSWJVVCK-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO O=C(CN1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000265471274 510072193 /nfs/dbraw/zinc/07/21/93/510072193.db2.gz IAGGPNQVXWOLSJ-UHFFFAOYSA-N 1 1 363.805 2.789 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193794371 510075167 /nfs/dbraw/zinc/07/51/67/510075167.db2.gz ROIBMPMDRQCCEL-QGZVFWFLSA-N 1 1 353.422 2.776 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000268842754 510094983 /nfs/dbraw/zinc/09/49/83/510094983.db2.gz OYUQRJPWLZMUCQ-HOTGVXAUSA-N 1 1 360.458 2.654 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180799651 510115850 /nfs/dbraw/zinc/11/58/50/510115850.db2.gz MLGLTLVBLHCKBG-JTQLQIEISA-N 1 1 368.340 2.767 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000262024782 510151209 /nfs/dbraw/zinc/15/12/09/510151209.db2.gz RUTUWQPPTINGAK-KRWDZBQOSA-N 1 1 359.813 2.964 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(O)CCCCCC1 ZINC000187366464 510222445 /nfs/dbraw/zinc/22/24/45/510222445.db2.gz CJEJOTBRGWHOLC-UHFFFAOYSA-N 1 1 365.430 2.559 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000245977301 510235545 /nfs/dbraw/zinc/23/55/45/510235545.db2.gz GLSJGDKHDNTIKG-WFASDCNBSA-N 1 1 350.419 2.797 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000174667871 510241396 /nfs/dbraw/zinc/24/13/96/510241396.db2.gz GUWAFUVBMQTNQU-UHFFFAOYSA-N 1 1 355.460 2.787 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000177787984 510254207 /nfs/dbraw/zinc/25/42/07/510254207.db2.gz MRLUWPJXGYKOCY-ZBFHGGJFSA-N 1 1 360.458 2.842 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1CN1CCCC1 ZINC000171708299 510323169 /nfs/dbraw/zinc/32/31/69/510323169.db2.gz HETRIHGBHVCUMD-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1CN1CCCC1 ZINC000171708299 510323174 /nfs/dbraw/zinc/32/31/74/510323174.db2.gz HETRIHGBHVCUMD-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000269355079 510357647 /nfs/dbraw/zinc/35/76/47/510357647.db2.gz TZBXAVJSAFLDKN-GFCCVEGCSA-N 1 1 361.402 2.601 20 5 FFBDMO CCOC(=O)[C@H](C)[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000190828721 510363602 /nfs/dbraw/zinc/36/36/02/510363602.db2.gz PVDKEPWPPSHMAQ-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000190828721 510363607 /nfs/dbraw/zinc/36/36/07/510363607.db2.gz PVDKEPWPPSHMAQ-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174949340 510401808 /nfs/dbraw/zinc/40/18/08/510401808.db2.gz OBFRAJSZWFTQRO-CQSZACIVSA-N 1 1 359.430 2.809 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000246305730 510417020 /nfs/dbraw/zinc/41/70/20/510417020.db2.gz FQRADVQSLVZYJP-HOTGVXAUSA-N 1 1 374.485 2.780 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000246309566 510420398 /nfs/dbraw/zinc/42/03/98/510420398.db2.gz FZADILRLDLVJNZ-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000246309566 510420403 /nfs/dbraw/zinc/42/04/03/510420403.db2.gz FZADILRLDLVJNZ-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000184622184 510422117 /nfs/dbraw/zinc/42/21/17/510422117.db2.gz OEHKPWIMDFYBGN-DNVCBOLYSA-N 1 1 370.453 2.665 20 5 FFBDMO CC[N@H+]1CC[C@H]([NH+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478542 /nfs/dbraw/zinc/47/85/42/510478542.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[NH+]1CC[C@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478546 /nfs/dbraw/zinc/47/85/46/510478546.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[NH+]1CC[C@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478549 /nfs/dbraw/zinc/47/85/49/510478549.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478554 /nfs/dbraw/zinc/47/85/54/510478554.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478557 /nfs/dbraw/zinc/47/85/57/510478557.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478560 /nfs/dbraw/zinc/47/85/60/510478560.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415086 510478565 /nfs/dbraw/zinc/47/85/65/510478565.db2.gz BKGBFXCQFXPPOC-HOCLYGCPSA-N 1 1 351.447 2.644 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606571 510481031 /nfs/dbraw/zinc/48/10/31/510481031.db2.gz QHLOSAZHFDPERQ-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606571 510481035 /nfs/dbraw/zinc/48/10/35/510481035.db2.gz QHLOSAZHFDPERQ-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606571 510481038 /nfs/dbraw/zinc/48/10/38/510481038.db2.gz QHLOSAZHFDPERQ-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000266304524 510507710 /nfs/dbraw/zinc/50/77/10/510507710.db2.gz LMWSGCDSRRBJNA-CQSZACIVSA-N 1 1 351.472 2.877 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000175156462 510509108 /nfs/dbraw/zinc/50/91/08/510509108.db2.gz RTJALHGLYPIFBI-HNNXBMFYSA-N 1 1 363.458 2.978 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CNC(=O)C(C)C)C1 ZINC000175156462 510509112 /nfs/dbraw/zinc/50/91/12/510509112.db2.gz RTJALHGLYPIFBI-HNNXBMFYSA-N 1 1 363.458 2.978 20 5 FFBDMO O=C(CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475041 510509699 /nfs/dbraw/zinc/50/96/99/510509699.db2.gz GEZRZMHTPNXOPD-YJBOKZPZSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475041 510509733 /nfs/dbraw/zinc/50/97/33/510509733.db2.gz GEZRZMHTPNXOPD-YJBOKZPZSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000246475041 510509740 /nfs/dbraw/zinc/50/97/40/510509740.db2.gz GEZRZMHTPNXOPD-YJBOKZPZSA-N 1 1 372.469 2.872 20 5 FFBDMO COc1ccc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181675399 510534020 /nfs/dbraw/zinc/53/40/20/510534020.db2.gz KRPPUPZSWBOKND-UKRRQHHQSA-N 1 1 361.442 2.986 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000269844346 510566906 /nfs/dbraw/zinc/56/69/06/510566906.db2.gz QQONUESXCMLTCB-UHFFFAOYSA-N 1 1 374.441 2.507 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000178434465 510601640 /nfs/dbraw/zinc/60/16/40/510601640.db2.gz JYOIXAUPAUHFIV-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266549320 510652016 /nfs/dbraw/zinc/65/20/16/510652016.db2.gz SVIGGZLYSGGMNA-IAQYHMDHSA-N 1 1 372.347 2.864 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2ccc([S@](C)=O)cc2)c([N+](=O)[O-])cc1O ZINC000270126560 510685143 /nfs/dbraw/zinc/68/51/43/510685143.db2.gz PAIZAILWGXYXKP-NDHGSNPTSA-N 1 1 364.423 2.897 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188280870 510687792 /nfs/dbraw/zinc/68/77/92/510687792.db2.gz DEUCYHUQCXSIIG-FQEVSTJZSA-N 1 1 355.438 2.664 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000178823284 510790850 /nfs/dbraw/zinc/79/08/50/510790850.db2.gz YJAJTYIQHNYAMS-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000178832912 510794945 /nfs/dbraw/zinc/79/49/45/510794945.db2.gz BSMDQMCSAXJCDL-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO CC(C)(C)OC(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182179544 510798926 /nfs/dbraw/zinc/79/89/26/510798926.db2.gz DQZMRHVJWLVXJL-CYBMUJFWSA-N 1 1 350.419 2.598 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000185422066 510841447 /nfs/dbraw/zinc/84/14/47/510841447.db2.gz ZDBBRSPCMYJARD-GUYCJALGSA-N 1 1 354.410 2.626 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000247216391 510852532 /nfs/dbraw/zinc/85/25/32/510852532.db2.gz CKUCIAZYQPYRRM-DOTOQJQBSA-N 1 1 374.485 2.610 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c1 ZINC000293865536 510879577 /nfs/dbraw/zinc/87/95/77/510879577.db2.gz DYYDZZXHUKZKGO-IBGZPJMESA-N 1 1 361.442 2.616 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275760645 510916073 /nfs/dbraw/zinc/91/60/73/510916073.db2.gz FLWBBRWBBGORTL-OAHLLOKOSA-N 1 1 365.433 2.544 20 5 FFBDMO COCC[N@H+]1CC[C@@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275760645 510916076 /nfs/dbraw/zinc/91/60/76/510916076.db2.gz FLWBBRWBBGORTL-OAHLLOKOSA-N 1 1 365.433 2.544 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000364596110 510961091 /nfs/dbraw/zinc/96/10/91/510961091.db2.gz SBOHYJUTPMTGMV-QGZVFWFLSA-N 1 1 357.435 2.984 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000364596110 510961094 /nfs/dbraw/zinc/96/10/94/510961094.db2.gz SBOHYJUTPMTGMV-QGZVFWFLSA-N 1 1 357.435 2.984 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270857509 511007043 /nfs/dbraw/zinc/00/70/43/511007043.db2.gz YVMYPUZVFGGTOT-FZKQIMNGSA-N 1 1 358.442 2.752 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)C2)C1 ZINC000294301747 511019258 /nfs/dbraw/zinc/01/92/58/511019258.db2.gz VXPWFEPSJIVHDK-KRWDZBQOSA-N 1 1 369.368 2.754 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000364810006 511093597 /nfs/dbraw/zinc/09/35/97/511093597.db2.gz OBKGORQKFVBTOA-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@H](CO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000298067059 511165227 /nfs/dbraw/zinc/16/52/27/511165227.db2.gz JFXPPOAQIITTSX-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO CN(C)c1[nH+]cc(CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1C ZINC000291409439 511185711 /nfs/dbraw/zinc/18/57/11/511185711.db2.gz AIYVIBOLGGPWSS-UHFFFAOYSA-N 1 1 372.212 2.631 20 5 FFBDMO CCc1[nH]nc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1[N+](=O)[O-] ZINC000279825175 511230745 /nfs/dbraw/zinc/23/07/45/511230745.db2.gz AIKQFACNMQOSGC-UHFFFAOYSA-N 1 1 351.794 2.848 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000295042126 511261748 /nfs/dbraw/zinc/26/17/48/511261748.db2.gz OWFNWOFUIYVHBJ-QGZVFWFLSA-N 1 1 356.426 2.725 20 5 FFBDMO CC(C)([NH2+]Cc1cnc(N2CCOCC2)s1)c1ccccc1[N+](=O)[O-] ZINC000291641795 511279932 /nfs/dbraw/zinc/27/99/32/511279932.db2.gz BRKNJFDWJQSMKL-UHFFFAOYSA-N 1 1 362.455 2.913 20 5 FFBDMO COC(=O)c1ccc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271792694 511325370 /nfs/dbraw/zinc/32/53/70/511325370.db2.gz UYYFQURAMWTKBB-ZDUSSCGKSA-N 1 1 371.393 2.979 20 5 FFBDMO C[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000295454955 511411519 /nfs/dbraw/zinc/41/15/19/511411519.db2.gz PKEFJTNHJSTISB-HNNXBMFYSA-N 1 1 373.453 2.891 20 5 FFBDMO C[C@@H]1OCC[C@@]12C[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)CCO2 ZINC000280334817 511425646 /nfs/dbraw/zinc/42/56/46/511425646.db2.gz HMOSARWONYKYLZ-IFXJQAMLSA-N 1 1 373.409 2.672 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000283724815 511475709 /nfs/dbraw/zinc/47/57/09/511475709.db2.gz WEMCCMQKKXYZLQ-QGZVFWFLSA-N 1 1 362.474 2.899 20 5 FFBDMO CCC(=O)c1ccc(N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c([N+](=O)[O-])c1 ZINC000280698301 511566954 /nfs/dbraw/zinc/56/69/54/511566954.db2.gz KATKLELYHUUEQF-KRWDZBQOSA-N 1 1 374.485 2.794 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000299286050 511578051 /nfs/dbraw/zinc/57/80/51/511578051.db2.gz GGYDWDJLJNLMFD-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292404058 511585641 /nfs/dbraw/zinc/58/56/41/511585641.db2.gz TZXFJGRHCBTETJ-LSDHHAIUSA-N 1 1 360.458 2.728 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292463842 511606583 /nfs/dbraw/zinc/60/65/83/511606583.db2.gz AEJQPSPANMIXOO-ZDUSSCGKSA-N 1 1 362.430 2.942 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)c1 ZINC000365737571 511628185 /nfs/dbraw/zinc/62/81/85/511628185.db2.gz XWEJCQAPMHBOQI-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000296148009 511634789 /nfs/dbraw/zinc/63/47/89/511634789.db2.gz TVFCAWHLLIKOBO-INIZCTEOSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000299447822 511639873 /nfs/dbraw/zinc/63/98/73/511639873.db2.gz OPEMYYUPCOTEEC-ZDUSSCGKSA-N 1 1 371.441 2.931 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccccc2)CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000303794637 511751365 /nfs/dbraw/zinc/75/13/65/511751365.db2.gz VOXZTLGHUFMZON-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000303794637 511751367 /nfs/dbraw/zinc/75/13/67/511751367.db2.gz VOXZTLGHUFMZON-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO O=C1N[C@H]2CC[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2CO1 ZINC000281356275 511816044 /nfs/dbraw/zinc/81/60/44/511816044.db2.gz UNIFBXKEYLVTTC-DOMZBBRYSA-N 1 1 374.422 2.649 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2CO1 ZINC000281356275 511816047 /nfs/dbraw/zinc/81/60/47/511816047.db2.gz UNIFBXKEYLVTTC-DOMZBBRYSA-N 1 1 374.422 2.649 20 5 FFBDMO C[C@H]1CN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000296699752 511859773 /nfs/dbraw/zinc/85/97/73/511859773.db2.gz KVMPOSYPTANAKJ-LBPRGKRZSA-N 1 1 366.849 2.603 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1 ZINC000281507811 511871566 /nfs/dbraw/zinc/87/15/66/511871566.db2.gz IAJMOIVCKDEPJP-UHFFFAOYSA-N 1 1 365.821 2.844 20 5 FFBDMO Cc1cc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000364112864 511965550 /nfs/dbraw/zinc/96/55/50/511965550.db2.gz WTSKJQJEXWQKQF-MRXNPFEDSA-N 1 1 369.469 2.668 20 5 FFBDMO CC(=O)Nc1cccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285180838 512028692 /nfs/dbraw/zinc/02/86/92/512028692.db2.gz BSRXPAROYHAOAE-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO CC(=O)Nc1cccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285180838 512028696 /nfs/dbraw/zinc/02/86/96/512028696.db2.gz BSRXPAROYHAOAE-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000275134019 512051215 /nfs/dbraw/zinc/05/12/15/512051215.db2.gz SNJLKVXKUVHBTG-JTQLQIEISA-N 1 1 365.739 2.749 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000366554538 512083532 /nfs/dbraw/zinc/08/35/32/512083532.db2.gz MKQFGPKQPIZPPK-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000366554538 512083536 /nfs/dbraw/zinc/08/35/36/512083536.db2.gz MKQFGPKQPIZPPK-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000411068167 512458816 /nfs/dbraw/zinc/45/88/16/512458816.db2.gz XIACDBHLPLTQQB-LBPRGKRZSA-N 1 1 367.471 2.882 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000411068167 512458820 /nfs/dbraw/zinc/45/88/20/512458820.db2.gz XIACDBHLPLTQQB-LBPRGKRZSA-N 1 1 367.471 2.882 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCCc3ccccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000369646442 512531742 /nfs/dbraw/zinc/53/17/42/512531742.db2.gz IQLYJSBBBBLLLS-UHFFFAOYSA-N 1 1 368.437 2.874 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000411283473 512561569 /nfs/dbraw/zinc/56/15/69/512561569.db2.gz YWDDEOAGNFFLQC-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000411283155 512561817 /nfs/dbraw/zinc/56/18/17/512561817.db2.gz YNWNCYDEWCXVSO-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000378051755 512565032 /nfs/dbraw/zinc/56/50/32/512565032.db2.gz UBPZXEGUOLAFJL-AWEZNQCLSA-N 1 1 354.410 2.853 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C(C)C)C2CCOCC2)c([N+](=O)[O-])c1 ZINC000411385868 512611453 /nfs/dbraw/zinc/61/14/53/512611453.db2.gz IVZWUMQQQNPKLT-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO CCOc1ccc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000369799897 512618121 /nfs/dbraw/zinc/61/81/21/512618121.db2.gz PVOYKLNPYZRYHA-UHFFFAOYSA-N 1 1 358.398 2.976 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1F ZINC000411414769 512624623 /nfs/dbraw/zinc/62/46/23/512624623.db2.gz BZAGILSBMDUUDV-CHWSQXEVSA-N 1 1 367.421 2.522 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1F ZINC000411414183 512624743 /nfs/dbraw/zinc/62/47/43/512624743.db2.gz HSHJKCAJGNISAY-CHWSQXEVSA-N 1 1 367.421 2.664 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4c[nH]cn4)CC3)n2)cc1 ZINC000374207379 512707191 /nfs/dbraw/zinc/70/71/91/512707191.db2.gz JCBPSTMBSWURLP-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCc3c2cnn3CCO)c(Cl)c1 ZINC000368181771 512834565 /nfs/dbraw/zinc/83/45/65/512834565.db2.gz SOEQUSVGTKWNRF-HNNXBMFYSA-N 1 1 350.806 2.604 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000368229067 512855354 /nfs/dbraw/zinc/85/53/54/512855354.db2.gz STMWYFJZKONZNS-LJQANCHMSA-N 1 1 358.442 2.836 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000374533411 512878438 /nfs/dbraw/zinc/87/84/38/512878438.db2.gz BHMNPKBLGNPNCS-KRWDZBQOSA-N 1 1 357.458 2.719 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@@H](O)C[C@H]3c3ccccc3)o2)cc1 ZINC000411956655 512889352 /nfs/dbraw/zinc/88/93/52/512889352.db2.gz WJUBYKVTVCYENV-IRXDYDNUSA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H](O)C[C@H]3c3ccccc3)o2)cc1 ZINC000411956655 512889357 /nfs/dbraw/zinc/88/93/57/512889357.db2.gz WJUBYKVTVCYENV-IRXDYDNUSA-N 1 1 366.377 2.953 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)n1 ZINC000390491310 512907643 /nfs/dbraw/zinc/90/76/43/512907643.db2.gz QNJHILDZBRSTLX-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](N3CCCC3=O)CC2)ccc1[N+](=O)[O-] ZINC000412057588 512935326 /nfs/dbraw/zinc/93/53/26/512935326.db2.gz RPEFPYOGZCNHCA-MRXNPFEDSA-N 1 1 361.442 2.970 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060923 512938180 /nfs/dbraw/zinc/93/81/80/512938180.db2.gz HDXUECYVQUFODX-SCLBCKFNSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060923 512938184 /nfs/dbraw/zinc/93/81/84/512938184.db2.gz HDXUECYVQUFODX-SCLBCKFNSA-N 1 1 363.414 2.505 20 5 FFBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC(=O)N1 ZINC000412064312 512939823 /nfs/dbraw/zinc/93/98/23/512939823.db2.gz CBQBTSHJSWVTCY-OAHLLOKOSA-N 1 1 372.425 2.781 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@](O)(c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000374866690 513045817 /nfs/dbraw/zinc/04/58/17/513045817.db2.gz XAIJSQVVKWAJSS-LJQANCHMSA-N 1 1 373.384 2.656 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412692211 513226900 /nfs/dbraw/zinc/22/69/00/513226900.db2.gz CXSRJMZPPNGBNR-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412692211 513226901 /nfs/dbraw/zinc/22/69/01/513226901.db2.gz CXSRJMZPPNGBNR-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000412704573 513236293 /nfs/dbraw/zinc/23/62/93/513236293.db2.gz ZSYSUBUFGJRQHK-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000412704573 513236299 /nfs/dbraw/zinc/23/62/99/513236299.db2.gz ZSYSUBUFGJRQHK-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@H]1CN(c2ccc(Cl)c(F)c2)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000429015056 513253588 /nfs/dbraw/zinc/25/35/88/513253588.db2.gz ZGBTWLNXTUJOSB-GFCCVEGCSA-N 1 1 367.812 2.795 20 5 FFBDMO C[C@@H]1CN(c2ccc(Cl)c(F)c2)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000429015056 513253593 /nfs/dbraw/zinc/25/35/93/513253593.db2.gz ZGBTWLNXTUJOSB-GFCCVEGCSA-N 1 1 367.812 2.795 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000429012730 513254623 /nfs/dbraw/zinc/25/46/23/513254623.db2.gz VBJJGKZGCYJVBE-JKIFEVAISA-N 1 1 371.441 2.807 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ncc([N+](=O)[O-])cc2C(N)=O)CCC1 ZINC000450708278 513310160 /nfs/dbraw/zinc/31/01/60/513310160.db2.gz CHFSLJLKBPHUEY-UHFFFAOYSA-N 1 1 369.425 2.555 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@@H]2CCCN(c3cccc(C)c3[N+](=O)[O-])C2)CC1 ZINC000450773505 513334460 /nfs/dbraw/zinc/33/44/60/513334460.db2.gz MPACXDFGTCFAQZ-SFHVURJKSA-N 1 1 374.485 2.674 20 5 FFBDMO Cn1c(=O)c2cc3ccccc3cc2nc1SCC[N@H+]1CCCOCC1 ZINC000412992255 513383816 /nfs/dbraw/zinc/38/38/16/513383816.db2.gz ULRKFWIJUGFADR-UHFFFAOYSA-N 1 1 369.490 2.901 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)cc1[N+](=O)[O-] ZINC000440738562 513394921 /nfs/dbraw/zinc/39/49/21/513394921.db2.gz NTDQNGMXTCOQJE-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000434708802 513403131 /nfs/dbraw/zinc/40/31/31/513403131.db2.gz DQWDWJHTUBINQK-UHFFFAOYSA-N 1 1 365.474 2.925 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000434708802 513403134 /nfs/dbraw/zinc/40/31/34/513403134.db2.gz DQWDWJHTUBINQK-UHFFFAOYSA-N 1 1 365.474 2.925 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c1C ZINC000434767353 513423716 /nfs/dbraw/zinc/42/37/16/513423716.db2.gz WGKDWURYUKUCED-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1C ZINC000434767353 513423725 /nfs/dbraw/zinc/42/37/25/513423725.db2.gz WGKDWURYUKUCED-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c1C ZINC000434767352 513424173 /nfs/dbraw/zinc/42/41/73/513424173.db2.gz WGKDWURYUKUCED-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1C ZINC000434767352 513424179 /nfs/dbraw/zinc/42/41/79/513424179.db2.gz WGKDWURYUKUCED-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@@]3([NH+]4CCOCC4)CCSC3)c2c1 ZINC000413073656 513426815 /nfs/dbraw/zinc/42/68/15/513426815.db2.gz OYHPLSSEXLAIRF-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccccc2C[N@@H+]2CCC[C@H]2CO)c(F)c1 ZINC000413232581 513536509 /nfs/dbraw/zinc/53/65/09/513536509.db2.gz CIYSYIPHHMVXLO-HNNXBMFYSA-N 1 1 360.389 2.698 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCO[C@@H]1C ZINC000425467615 513581310 /nfs/dbraw/zinc/58/13/10/513581310.db2.gz BTVHMGLPICWUMY-RISCZKNCSA-N 1 1 373.247 2.983 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCO[C@@H]1C ZINC000425467615 513581320 /nfs/dbraw/zinc/58/13/20/513581320.db2.gz BTVHMGLPICWUMY-RISCZKNCSA-N 1 1 373.247 2.983 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451277124 513646381 /nfs/dbraw/zinc/64/63/81/513646381.db2.gz ZZRKPGASKGVHQI-OALUTQOASA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451277124 513646390 /nfs/dbraw/zinc/64/63/90/513646390.db2.gz ZZRKPGASKGVHQI-OALUTQOASA-N 1 1 360.385 2.774 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282712 513650055 /nfs/dbraw/zinc/65/00/55/513650055.db2.gz MDGWHMCHYJQVFP-APWZRJJASA-N 1 1 360.385 2.903 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282712 513650061 /nfs/dbraw/zinc/65/00/61/513650061.db2.gz MDGWHMCHYJQVFP-APWZRJJASA-N 1 1 360.385 2.903 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1F ZINC000451294018 513659477 /nfs/dbraw/zinc/65/94/77/513659477.db2.gz ISOICFZDTIRGFS-HNNXBMFYSA-N 1 1 353.394 2.593 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451349119 513692838 /nfs/dbraw/zinc/69/28/38/513692838.db2.gz WOZOJSTWEUACDM-RNJTYBCJSA-N 1 1 361.442 2.937 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@@H]3O)n2)c1 ZINC000451420465 513740485 /nfs/dbraw/zinc/74/04/85/513740485.db2.gz PAHHYBSWNYBGRH-OAGGEKHMSA-N 1 1 358.398 2.770 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000426068454 513839270 /nfs/dbraw/zinc/83/92/70/513839270.db2.gz YHYBJVIRRUYHLJ-GWCFXTLKSA-N 1 1 374.363 2.896 20 5 FFBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426313656 513899149 /nfs/dbraw/zinc/89/91/49/513899149.db2.gz XJEOSCSUCGROSW-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426313656 513899155 /nfs/dbraw/zinc/89/91/55/513899155.db2.gz XJEOSCSUCGROSW-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000451691482 513913273 /nfs/dbraw/zinc/91/32/73/513913273.db2.gz CHAPOFQEYSACFM-BZUAXINKSA-N 1 1 361.442 2.715 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](CO)CC(C)(C)C ZINC000451773998 513973301 /nfs/dbraw/zinc/97/33/01/513973301.db2.gz ARSMAJBKLFGVKD-LBPRGKRZSA-N 1 1 357.838 2.916 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000448934806 513980040 /nfs/dbraw/zinc/98/00/40/513980040.db2.gz XHFRSOJYAUUXLX-INIZCTEOSA-N 1 1 369.425 2.685 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CCSC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451963609 514098614 /nfs/dbraw/zinc/09/86/14/514098614.db2.gz HQUXUUJHQWGRNW-GOSISDBHSA-N 1 1 361.467 2.703 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]1[NH2+]CCc2ccccc21 ZINC000423431312 514140500 /nfs/dbraw/zinc/14/05/00/514140500.db2.gz QJRMJGWVOOYDCS-AUUYWEPGSA-N 1 1 368.437 2.789 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000420463250 514158252 /nfs/dbraw/zinc/15/82/52/514158252.db2.gz RLYLSZJNDQFCCI-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000423610329 514182055 /nfs/dbraw/zinc/18/20/55/514182055.db2.gz LUWNFFWAQVQCLA-SFHVURJKSA-N 1 1 357.385 2.758 20 5 FFBDMO C[C@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000420585761 514193002 /nfs/dbraw/zinc/19/30/02/514193002.db2.gz MYTHOSYRSTWVIT-LLVKDONJSA-N 1 1 360.439 2.614 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000452106137 514194963 /nfs/dbraw/zinc/19/49/63/514194963.db2.gz QEDWFYWJWAPDEY-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000452120841 514205439 /nfs/dbraw/zinc/20/54/39/514205439.db2.gz JNTUOKHUXPMVJV-HDMKZQKVSA-N 1 1 373.453 2.746 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c2c(c1)COCO2 ZINC000449455051 514216875 /nfs/dbraw/zinc/21/68/75/514216875.db2.gz QEBYSMRJMBFYSK-KZNAEPCWSA-N 1 1 362.426 2.977 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000452169546 514227891 /nfs/dbraw/zinc/22/78/91/514227891.db2.gz GILCMHNRLPPBJK-LLVKDONJSA-N 1 1 369.368 2.753 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CF)CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449488146 514228208 /nfs/dbraw/zinc/22/82/08/514228208.db2.gz DANHLARJKXRFJB-MRXNPFEDSA-N 1 1 362.405 2.774 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000452181765 514236247 /nfs/dbraw/zinc/23/62/47/514236247.db2.gz JPGIVEWQERUMPZ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000452181765 514236256 /nfs/dbraw/zinc/23/62/56/514236256.db2.gz JPGIVEWQERUMPZ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000444621321 514275085 /nfs/dbraw/zinc/27/50/85/514275085.db2.gz YZCJMXQSZRZXMN-UHFFFAOYSA-N 1 1 351.472 2.925 20 5 FFBDMO CCC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000444770172 514324975 /nfs/dbraw/zinc/32/49/75/514324975.db2.gz YRVHXMZMGCMUHI-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000444770172 514324986 /nfs/dbraw/zinc/32/49/86/514324986.db2.gz YRVHXMZMGCMUHI-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000444778507 514329681 /nfs/dbraw/zinc/32/96/81/514329681.db2.gz WBIPYBNMTJODEJ-SFHVURJKSA-N 1 1 363.414 2.520 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000449752409 514335800 /nfs/dbraw/zinc/33/58/00/514335800.db2.gz FLCCBPCRBFGKJY-SJORKVTESA-N 1 1 370.405 2.992 20 5 FFBDMO O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000427910272 514345229 /nfs/dbraw/zinc/34/52/29/514345229.db2.gz AYKCYFISWPXBRS-GOSISDBHSA-N 1 1 355.394 2.867 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]1[NH2+]CCc2ccccc21 ZINC000414942077 514367038 /nfs/dbraw/zinc/36/70/38/514367038.db2.gz BGYNRQHGHMRWPQ-KUHUBIRLSA-N 1 1 368.437 2.789 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420938481 514388198 /nfs/dbraw/zinc/38/81/98/514388198.db2.gz AWYVRSDJBZDBOM-OCCSQVGLSA-N 1 1 362.348 2.999 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)cc1[N+](=O)[O-] ZINC000424187280 514409499 /nfs/dbraw/zinc/40/94/99/514409499.db2.gz AQJGNEYCJVOVQA-IEBWSBKVSA-N 1 1 374.368 2.874 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000449968952 514446228 /nfs/dbraw/zinc/44/62/28/514446228.db2.gz CKIGKHBGWRNEDT-BBRMVZONSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@@H]1C ZINC000449968952 514446230 /nfs/dbraw/zinc/44/62/30/514446230.db2.gz CKIGKHBGWRNEDT-BBRMVZONSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@@H]1C ZINC000449968952 514446233 /nfs/dbraw/zinc/44/62/33/514446233.db2.gz CKIGKHBGWRNEDT-BBRMVZONSA-N 1 1 371.441 2.930 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c([N+](=O)[O-])cc1F ZINC000450007727 514462858 /nfs/dbraw/zinc/46/28/58/514462858.db2.gz CNUMKUIYYZABJT-OLZOCXBDSA-N 1 1 365.405 2.830 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450017416 514466577 /nfs/dbraw/zinc/46/65/77/514466577.db2.gz NWSKWRIXGRSRNR-OAHLLOKOSA-N 1 1 371.441 2.931 20 5 FFBDMO CN(CC[C@H]1CCCC[N@@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000450017416 514466583 /nfs/dbraw/zinc/46/65/83/514466583.db2.gz NWSKWRIXGRSRNR-OAHLLOKOSA-N 1 1 371.441 2.931 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000450017416 514466587 /nfs/dbraw/zinc/46/65/87/514466587.db2.gz NWSKWRIXGRSRNR-OAHLLOKOSA-N 1 1 371.441 2.931 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000450017415 514466705 /nfs/dbraw/zinc/46/67/05/514466705.db2.gz NWSKWRIXGRSRNR-HNNXBMFYSA-N 1 1 371.441 2.931 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000450017415 514466711 /nfs/dbraw/zinc/46/67/11/514466711.db2.gz NWSKWRIXGRSRNR-HNNXBMFYSA-N 1 1 371.441 2.931 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000450017415 514466716 /nfs/dbraw/zinc/46/67/16/514466716.db2.gz NWSKWRIXGRSRNR-HNNXBMFYSA-N 1 1 371.441 2.931 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000475173459 514578794 /nfs/dbraw/zinc/57/87/94/514578794.db2.gz MZAQCMXKJLUJOX-NSHDSACASA-N 1 1 368.397 2.622 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ncc(C(F)(F)F)cn2)n1 ZINC000453309828 514597019 /nfs/dbraw/zinc/59/70/19/514597019.db2.gz PXHHELFFFJXKAY-NEPJUHHUSA-N 1 1 370.335 2.874 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000475314507 514616324 /nfs/dbraw/zinc/61/63/24/514616324.db2.gz UQYFBCFEAFFGII-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)Cc2ccsc2)c1[N+](=O)[O-] ZINC000458235943 514652435 /nfs/dbraw/zinc/65/24/35/514652435.db2.gz ZYSNRYKJINDJSQ-UHFFFAOYSA-N 1 1 365.459 2.707 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@]3(CCCOC3)C2)c([N+](=O)[O-])c1 ZINC000475746818 514791233 /nfs/dbraw/zinc/79/12/33/514791233.db2.gz HIUNZXXWIGUCET-SFHVURJKSA-N 1 1 350.415 2.875 20 5 FFBDMO Cc1cc(N2CCN(c3[nH+]ccn3C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461937868 514796739 /nfs/dbraw/zinc/79/67/39/514796739.db2.gz QZYQMCYLSKHZHZ-UHFFFAOYSA-N 1 1 369.347 2.982 20 5 FFBDMO Cc1cc(N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461946063 514800923 /nfs/dbraw/zinc/80/09/23/514800923.db2.gz LZVZZOHEKYBJTQ-RYUDHWBXSA-N 1 1 361.364 2.813 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471272442 514821142 /nfs/dbraw/zinc/82/11/42/514821142.db2.gz KAAZQAJZNGMMIU-MRXNPFEDSA-N 1 1 371.412 2.915 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000489416115 514836671 /nfs/dbraw/zinc/83/66/71/514836671.db2.gz YYMHWPAUFUCVHA-MPGHIAIKSA-N 1 1 360.458 2.509 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)cc2)c1C ZINC000485061101 514894551 /nfs/dbraw/zinc/89/45/51/514894551.db2.gz AENZTJKSKYLGEZ-UHFFFAOYSA-N 1 1 368.397 2.968 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000489717055 514949570 /nfs/dbraw/zinc/94/95/70/514949570.db2.gz PTGWMEJLEIHEGJ-CQSZACIVSA-N 1 1 363.414 2.564 20 5 FFBDMO CN(Cc1c(F)cc([N+](=O)[O-])cc1F)CC(C)(C)C[NH+]1CCOCC1 ZINC000508979142 514972811 /nfs/dbraw/zinc/97/28/11/514972811.db2.gz QJESAAXLMKOEBM-UHFFFAOYSA-N 1 1 357.401 2.663 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC[NH+]2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467423373 515001832 /nfs/dbraw/zinc/00/18/32/515001832.db2.gz MLVGPKFYWDICTK-QWRGUYRKSA-N 1 1 361.489 2.506 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCCN2CCN(c3cc[nH+]cc3)CC2)c(F)c1 ZINC000498690783 515027123 /nfs/dbraw/zinc/02/71/23/515027123.db2.gz YUQJTZGINBYTRI-UHFFFAOYSA-N 1 1 359.405 2.753 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[N@@H+](C)C1CC1 ZINC000462482891 515077659 /nfs/dbraw/zinc/07/76/59/515077659.db2.gz BWYSSSZXBBWLEV-AWEZNQCLSA-N 1 1 356.426 2.885 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000467710924 515087701 /nfs/dbraw/zinc/08/77/01/515087701.db2.gz OUFNTROXSZXOKS-LKFCYVNXSA-N 1 1 368.231 2.570 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1C ZINC000480936772 515142343 /nfs/dbraw/zinc/14/23/43/515142343.db2.gz PBLYPVCNVNZIEX-AWEZNQCLSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000480985832 515162349 /nfs/dbraw/zinc/16/23/49/515162349.db2.gz WEWGXMOYPHHDIX-DZGCQCFKSA-N 1 1 369.487 2.705 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340589 515233411 /nfs/dbraw/zinc/23/34/11/515233411.db2.gz NMGIIXQONJYFML-KRWDZBQOSA-N 1 1 362.474 2.713 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371488 515248059 /nfs/dbraw/zinc/24/80/59/515248059.db2.gz ZQMSLZGREYVVQE-MRXNPFEDSA-N 1 1 362.474 2.571 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN(C)c2ccc([N+](=O)[O-])nc2)[C@@H]1c1cnn(C)c1 ZINC000509631613 515265858 /nfs/dbraw/zinc/26/58/58/515265858.db2.gz GFRCWNZQZZZGEB-KBXCAEBGSA-N 1 1 358.446 2.633 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@]1(c2ccccc2)CCCCC1=O ZINC000472595495 515331898 /nfs/dbraw/zinc/33/18/98/515331898.db2.gz HTNXEHPJAACSKY-FQEVSTJZSA-N 1 1 369.421 2.727 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@]1(c2ccccc2)CCCCC1=O ZINC000472595495 515331909 /nfs/dbraw/zinc/33/19/09/515331909.db2.gz HTNXEHPJAACSKY-FQEVSTJZSA-N 1 1 369.421 2.727 20 5 FFBDMO COCC1(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCC1 ZINC000463126750 515376461 /nfs/dbraw/zinc/37/64/61/515376461.db2.gz VOXXODMKTXFZBL-UHFFFAOYSA-N 1 1 373.457 2.800 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000510102084 515433859 /nfs/dbraw/zinc/43/38/59/515433859.db2.gz FNULPXKPGYDMRN-OAHLLOKOSA-N 1 1 371.397 2.843 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000510102084 515433867 /nfs/dbraw/zinc/43/38/67/515433867.db2.gz FNULPXKPGYDMRN-OAHLLOKOSA-N 1 1 371.397 2.843 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C(C)C)N1CCN(C)CC1 ZINC000468654878 515455337 /nfs/dbraw/zinc/45/53/37/515455337.db2.gz CZBMEOGXZMIRKS-KZFLWGQDSA-N 1 1 360.502 2.860 20 5 FFBDMO CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000468689099 515470909 /nfs/dbraw/zinc/47/09/09/515470909.db2.gz SACJTIWEYNPXEA-GFCCVEGCSA-N 1 1 360.439 2.827 20 5 FFBDMO C[C@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510259443 515486209 /nfs/dbraw/zinc/48/62/09/515486209.db2.gz QAZRFSQXWSLLOY-GOEBONIOSA-N 1 1 356.426 2.953 20 5 FFBDMO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000510258614 515486356 /nfs/dbraw/zinc/48/63/56/515486356.db2.gz ZXOFNIBEKBOKLL-KYJSFNMBSA-N 1 1 374.441 2.634 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929495 515726688 /nfs/dbraw/zinc/72/66/88/515726688.db2.gz DOCMPUOMVGAASJ-BBRMVZONSA-N 1 1 355.394 2.866 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929495 515726697 /nfs/dbraw/zinc/72/66/97/515726697.db2.gz DOCMPUOMVGAASJ-BBRMVZONSA-N 1 1 355.394 2.866 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000500507615 515744642 /nfs/dbraw/zinc/74/46/42/515744642.db2.gz ICVAMRBAFMCLGV-UHFFFAOYSA-N 1 1 355.822 2.570 20 5 FFBDMO C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000511062385 515760581 /nfs/dbraw/zinc/76/05/81/515760581.db2.gz KBVRAQOZEPNPMM-LBPRGKRZSA-N 1 1 363.439 2.650 20 5 FFBDMO CN(Cc1ccc(F)cc1)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124674 515794322 /nfs/dbraw/zinc/79/43/22/515794322.db2.gz UCTROUKLKKENDC-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO CN(Cc1ccc(F)cc1)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124674 515794330 /nfs/dbraw/zinc/79/43/30/515794330.db2.gz UCTROUKLKKENDC-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459785315 515804480 /nfs/dbraw/zinc/80/44/80/515804480.db2.gz ARDLZGBLSGFTRL-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459785315 515804484 /nfs/dbraw/zinc/80/44/84/515804484.db2.gz ARDLZGBLSGFTRL-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000464598800 515887827 /nfs/dbraw/zinc/88/78/27/515887827.db2.gz XBTZTNUOEVVTHC-UHFFFAOYSA-N 1 1 374.441 2.778 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000494606961 515894965 /nfs/dbraw/zinc/89/49/65/515894965.db2.gz CYZACJQFIXLXNX-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000494687936 515925539 /nfs/dbraw/zinc/92/55/39/515925539.db2.gz WHVRRIVDBFFNRU-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511531533 515936093 /nfs/dbraw/zinc/93/60/93/515936093.db2.gz ZCBCDKMMHDRFFJ-HZPDHXFCSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000501087493 515973996 /nfs/dbraw/zinc/97/39/96/515973996.db2.gz UQWQGTDFMDRWST-GXSJLCMTSA-N 1 1 371.235 2.962 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000501228236 516024056 /nfs/dbraw/zinc/02/40/56/516024056.db2.gz MRCQQNKSHFJBPX-NVXWUHKLSA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000488028079 516085743 /nfs/dbraw/zinc/08/57/43/516085743.db2.gz SGOHGLFXGBDLPN-HDMKZQKVSA-N 1 1 360.458 2.509 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])n3C)cc2)C1 ZINC000465198539 516090552 /nfs/dbraw/zinc/09/05/52/516090552.db2.gz VDMMGFXCFIRARX-CQSZACIVSA-N 1 1 372.425 2.906 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1c2ccccc2ncc1[N+](=O)[O-] ZINC000488092304 516113455 /nfs/dbraw/zinc/11/34/55/516113455.db2.gz RFWNFDFHGRPPAZ-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO C[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000512118134 516160010 /nfs/dbraw/zinc/16/00/10/516160010.db2.gz GNSNPHMBQWVICG-NEPJUHHUSA-N 1 1 367.833 2.782 20 5 FFBDMO CC[N@@H+](CC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000479444736 516195680 /nfs/dbraw/zinc/19/56/80/516195680.db2.gz YGVCEXSJRZKRLY-UHFFFAOYSA-N 1 1 374.363 2.626 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000507618704 516264154 /nfs/dbraw/zinc/26/41/54/516264154.db2.gz SXERDXXWNYOCIL-DOTOQJQBSA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000465875061 516278142 /nfs/dbraw/zinc/27/81/42/516278142.db2.gz LNACPVNSTJXJRF-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO C[C@H](C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000554280147 516358669 /nfs/dbraw/zinc/35/86/69/516358669.db2.gz XJDGGCVGZMLKNI-CABCVRRESA-N 1 1 371.437 2.680 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815826 516371536 /nfs/dbraw/zinc/37/15/36/516371536.db2.gz DWQUWLJUTUHQPE-RYUDHWBXSA-N 1 1 357.357 2.791 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815826 516371543 /nfs/dbraw/zinc/37/15/43/516371543.db2.gz DWQUWLJUTUHQPE-RYUDHWBXSA-N 1 1 357.357 2.791 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000523286589 516423403 /nfs/dbraw/zinc/42/34/03/516423403.db2.gz BQRWPZZFGZJYTL-UHFFFAOYSA-N 1 1 373.457 2.683 20 5 FFBDMO CCC[N@@H+]1CCC[C@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000513068240 516458777 /nfs/dbraw/zinc/45/87/77/516458777.db2.gz IQLCDQAURJTALM-SFHVURJKSA-N 1 1 357.458 2.959 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000513068240 516458784 /nfs/dbraw/zinc/45/87/84/516458784.db2.gz IQLCDQAURJTALM-SFHVURJKSA-N 1 1 357.458 2.959 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] ZINC000523622363 516521843 /nfs/dbraw/zinc/52/18/43/516521843.db2.gz BLMJQBRIXWEUNS-HNNXBMFYSA-N 1 1 369.487 2.836 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000551014617 516522983 /nfs/dbraw/zinc/52/29/83/516522983.db2.gz OGJYCSYDNPHYFR-LBPRGKRZSA-N 1 1 357.332 2.922 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)c1[N+](=O)[O-] ZINC000557983769 516535321 /nfs/dbraw/zinc/53/53/21/516535321.db2.gz FZKURPFALUJYFF-UHFFFAOYSA-N 1 1 351.451 2.607 20 5 FFBDMO O=C(Nc1ccccc1C[NH+]1CCSCC1)c1ccc([N+](=O)[O-])cn1 ZINC000531627021 516562110 /nfs/dbraw/zinc/56/21/10/516562110.db2.gz FUQFFJATFYHINQ-UHFFFAOYSA-N 1 1 358.423 2.791 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+](C2CCC2)C1 ZINC000561534331 516638537 /nfs/dbraw/zinc/63/85/37/516638537.db2.gz KLYMOTJFNDUFSS-GFCCVEGCSA-N 1 1 367.396 2.748 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000518505353 516684767 /nfs/dbraw/zinc/68/47/67/516684767.db2.gz PNMRKFINUBDHIV-INIZCTEOSA-N 1 1 368.437 2.652 20 5 FFBDMO CC[N@@H+](CCC1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1)CC1CC1 ZINC000536615214 516856926 /nfs/dbraw/zinc/85/69/26/516856926.db2.gz QLCKZUHOEVGJQP-UHFFFAOYSA-N 1 1 372.473 2.976 20 5 FFBDMO COc1ccc(NC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000541100983 516875127 /nfs/dbraw/zinc/87/51/27/516875127.db2.gz LXFVLMXPECMTQV-CHWSQXEVSA-N 1 1 350.419 2.845 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000541100985 516875168 /nfs/dbraw/zinc/87/51/68/516875168.db2.gz LXFVLMXPECMTQV-OLZOCXBDSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000525024172 516899393 /nfs/dbraw/zinc/89/93/93/516899393.db2.gz PEYWHOFOWPWRPG-MBNYWOFBSA-N 1 1 369.849 2.814 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000544767618 516919015 /nfs/dbraw/zinc/91/90/15/516919015.db2.gz VWWPTXNIXQSUMS-INIZCTEOSA-N 1 1 354.410 2.726 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000544767618 516919019 /nfs/dbraw/zinc/91/90/19/516919019.db2.gz VWWPTXNIXQSUMS-INIZCTEOSA-N 1 1 354.410 2.726 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000544848588 516959316 /nfs/dbraw/zinc/95/93/16/516959316.db2.gz FQSGKRAFWBTGOH-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NCC[NH+]1CCN(c2ccccc2)CC1 ZINC000532501621 517006501 /nfs/dbraw/zinc/00/65/01/517006501.db2.gz RGDVBSJZYNVRJG-UHFFFAOYSA-N 1 1 361.833 2.877 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000545151333 517074027 /nfs/dbraw/zinc/07/40/27/517074027.db2.gz JMGHKNXZWVJOON-UHFFFAOYSA-N 1 1 360.458 2.869 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc([N+](=O)[O-])c1OC ZINC000525579711 517081702 /nfs/dbraw/zinc/08/17/02/517081702.db2.gz ISYSBLCLYLGSSS-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO C[C@H](C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719600 517085223 /nfs/dbraw/zinc/08/52/23/517085223.db2.gz IYHHNRSVZXGMTK-KFWWJZLASA-N 1 1 363.458 2.702 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000541524964 517093425 /nfs/dbraw/zinc/09/34/25/517093425.db2.gz BGIAWSCSGMZUQI-UHFFFAOYSA-N 1 1 364.446 2.619 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]CCNc2cnccn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545513 517107304 /nfs/dbraw/zinc/10/73/04/517107304.db2.gz INRPGBKPUIMDNY-IBGZPJMESA-N 1 1 367.409 2.753 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000532717190 517111869 /nfs/dbraw/zinc/11/18/69/517111869.db2.gz ALJYFWKPSHFJAV-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000532717190 517111888 /nfs/dbraw/zinc/11/18/88/517111888.db2.gz ALJYFWKPSHFJAV-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000559248315 517131244 /nfs/dbraw/zinc/13/12/44/517131244.db2.gz ACJZPUCKXQCBMI-UHFFFAOYSA-N 1 1 370.453 2.953 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000537312124 517139602 /nfs/dbraw/zinc/13/96/02/517139602.db2.gz QZRAOTFSGRGIPN-HNNXBMFYSA-N 1 1 361.442 2.805 20 5 FFBDMO COC(=O)c1cc(NC(=O)CC[N@@H+](C)C2CCCCC2)cc([N+](=O)[O-])c1 ZINC000548716970 517163194 /nfs/dbraw/zinc/16/31/94/517163194.db2.gz SCJKJTFWEFWOBV-UHFFFAOYSA-N 1 1 363.414 2.975 20 5 FFBDMO Cc1cccc(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)n1 ZINC000552265403 517169398 /nfs/dbraw/zinc/16/93/98/517169398.db2.gz XGPOEIVNGPORAF-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1Cc2ccccc2C1 ZINC000532929087 517207912 /nfs/dbraw/zinc/20/79/12/517207912.db2.gz UZBRXOBOVAHCRF-UHFFFAOYSA-N 1 1 367.405 2.992 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000559563177 517317756 /nfs/dbraw/zinc/31/77/56/517317756.db2.gz DGWBXIPRBJQFTQ-SECBINFHSA-N 1 1 370.247 2.878 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294727 517387300 /nfs/dbraw/zinc/38/73/00/517387300.db2.gz CUCHQRBMBQNDPW-SJORKVTESA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294727 517387307 /nfs/dbraw/zinc/38/73/07/517387307.db2.gz CUCHQRBMBQNDPW-SJORKVTESA-N 1 1 361.442 2.619 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000533312691 517401805 /nfs/dbraw/zinc/40/18/05/517401805.db2.gz NQNRUCONUIBKRL-WMLDXEAASA-N 1 1 358.442 2.725 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000533371133 517430758 /nfs/dbraw/zinc/43/07/58/517430758.db2.gz INAQUTYYOPUJPF-UHFFFAOYSA-N 1 1 365.336 2.822 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000533371133 517430769 /nfs/dbraw/zinc/43/07/69/517430769.db2.gz INAQUTYYOPUJPF-UHFFFAOYSA-N 1 1 365.336 2.822 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000533386016 517436781 /nfs/dbraw/zinc/43/67/81/517436781.db2.gz AUUYXDVLILCJJY-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000533386016 517436790 /nfs/dbraw/zinc/43/67/90/517436790.db2.gz AUUYXDVLILCJJY-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3c(F)cccc3[N+](=O)[O-])cc2)CC1 ZINC000552937831 517448144 /nfs/dbraw/zinc/44/81/44/517448144.db2.gz QEKGXFCLLVIVML-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cnc(C)[nH]c3=O)o2)c([N+](=O)[O-])c1 ZINC000542309748 517498475 /nfs/dbraw/zinc/49/84/75/517498475.db2.gz FMBYKMYSHSETFZ-UHFFFAOYSA-N 1 1 370.365 2.957 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000559988719 517519203 /nfs/dbraw/zinc/51/92/03/517519203.db2.gz FQUKQWFYYDZDDJ-SFHVURJKSA-N 1 1 350.415 2.885 20 5 FFBDMO CCOc1cc(C(=O)N2CC[NH2+]Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000562976346 517549540 /nfs/dbraw/zinc/54/95/40/517549540.db2.gz WEUOZEJLCGDTBO-UHFFFAOYSA-N 1 1 371.393 2.752 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000520968177 517563882 /nfs/dbraw/zinc/56/38/82/517563882.db2.gz YZEHUQOZPOMKBW-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO CNC(=O)C[NH+]1CCC(Nc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000549462818 517576089 /nfs/dbraw/zinc/57/60/89/517576089.db2.gz HHORFJGZHDFHCK-UHFFFAOYSA-N 1 1 374.363 2.544 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542654158 517671632 /nfs/dbraw/zinc/67/16/32/517671632.db2.gz UPFAGGYLRVGRBS-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C[C@@H]2C)cc1OC ZINC000530361345 517728016 /nfs/dbraw/zinc/72/80/16/517728016.db2.gz VNASMJWGDKDPJW-YDHLFZDLSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C[C@@H]2C)cc1OC ZINC000530361345 517728028 /nfs/dbraw/zinc/72/80/28/517728028.db2.gz VNASMJWGDKDPJW-YDHLFZDLSA-N 1 1 352.431 2.983 20 5 FFBDMO COc1cc(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000563235265 517760934 /nfs/dbraw/zinc/76/09/34/517760934.db2.gz OXANEJJSTZHFMK-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1cc(C)c(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)n1 ZINC000542856095 517781531 /nfs/dbraw/zinc/78/15/31/517781531.db2.gz JTDYSSURPRRURW-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[NH+]1CCOCC1 ZINC000534245262 517801887 /nfs/dbraw/zinc/80/18/87/517801887.db2.gz DAEXKWBAVPKZEM-CQSZACIVSA-N 1 1 374.441 2.553 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000530709898 517933068 /nfs/dbraw/zinc/93/30/68/517933068.db2.gz KJSDWHRIPIZBGT-ZBFHGGJFSA-N 1 1 356.426 2.716 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCN([C@H]3CC[N@@H+](Cc4ccccc4)C3)C2)nc1 ZINC000560729799 517992326 /nfs/dbraw/zinc/99/23/26/517992326.db2.gz OTBMXCOGLQDGPD-MJGOQNOKSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]([C@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729799 517992335 /nfs/dbraw/zinc/99/23/35/517992335.db2.gz OTBMXCOGLQDGPD-MJGOQNOKSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729799 517992341 /nfs/dbraw/zinc/99/23/41/517992341.db2.gz OTBMXCOGLQDGPD-MJGOQNOKSA-N 1 1 367.453 2.751 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2c3ccccc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000563650659 518045405 /nfs/dbraw/zinc/04/54/05/518045405.db2.gz NCRVYNCWXAKVIZ-HXPMCKFVSA-N 1 1 372.377 2.758 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H](c3[nH+]ccn3C)C2)ncc1[N+](=O)[O-] ZINC000543435148 518088957 /nfs/dbraw/zinc/08/89/57/518088957.db2.gz IHHFNHQNXWTIBU-JTQLQIEISA-N 1 1 366.219 2.788 20 5 FFBDMO COc1ccc(CNC(=O)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000522427538 518106204 /nfs/dbraw/zinc/10/62/04/518106204.db2.gz MBEGKKQUNUKDOA-UHFFFAOYSA-N 1 1 364.446 2.667 20 5 FFBDMO COc1ccc(Cc2nc([C@@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843684 518146145 /nfs/dbraw/zinc/14/61/45/518146145.db2.gz URQFMDCJHMINDY-YJBOKZPZSA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(Cc2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843684 518146149 /nfs/dbraw/zinc/14/61/49/518146149.db2.gz URQFMDCJHMINDY-YJBOKZPZSA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC(C)(C)[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000566884677 518246687 /nfs/dbraw/zinc/24/66/87/518246687.db2.gz QNOLNTSZRCZQRF-SJORKVTESA-N 1 1 350.415 2.872 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NCC1([N@@H+](C)Cc2ccccc2)CCC1 ZINC000578957462 518452044 /nfs/dbraw/zinc/45/20/44/518452044.db2.gz VNKAROIRDQDAMZ-UHFFFAOYSA-N 1 1 356.426 2.718 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000581868915 518476210 /nfs/dbraw/zinc/47/62/10/518476210.db2.gz GTYFGYBWMZNCLG-UHFFFAOYSA-N 1 1 374.485 2.802 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000570233627 518507538 /nfs/dbraw/zinc/50/75/38/518507538.db2.gz WMGGJOYAOUQXOA-ZWKOTPCHSA-N 1 1 357.458 2.882 20 5 FFBDMO C[C@@]1(NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000573125000 518519490 /nfs/dbraw/zinc/51/94/90/518519490.db2.gz RVRMEBXUTFEBRQ-HXUWFJFHSA-N 1 1 353.422 2.918 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccccc1)[C@@]1(CO)CCOC1 ZINC000585718507 518573179 /nfs/dbraw/zinc/57/31/79/518573179.db2.gz JEEGKIGWMUKVNG-HXUWFJFHSA-N 1 1 372.421 2.627 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000564754281 518597507 /nfs/dbraw/zinc/59/75/07/518597507.db2.gz KKADDFZGFWDQTE-FCEWJHQRSA-N 1 1 374.485 2.895 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000587994479 518694235 /nfs/dbraw/zinc/69/42/35/518694235.db2.gz KTZKDQHRKYYHOY-TXEJJXNPSA-N 1 1 365.459 2.901 20 5 FFBDMO C[C@H]1CC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000576737977 518739511 /nfs/dbraw/zinc/73/95/11/518739511.db2.gz UMGOPVBCGCNCBU-AWEZNQCLSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@H]1CC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000576737977 518739515 /nfs/dbraw/zinc/73/95/15/518739515.db2.gz UMGOPVBCGCNCBU-AWEZNQCLSA-N 1 1 352.456 2.881 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000582623516 518844377 /nfs/dbraw/zinc/84/43/77/518844377.db2.gz JTOHZOALBUMQFW-CQSZACIVSA-N 1 1 361.442 2.940 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164133 518935696 /nfs/dbraw/zinc/93/56/96/518935696.db2.gz FHMNGIAGYHHVBK-VQIMIIECSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164133 518935700 /nfs/dbraw/zinc/93/57/00/518935700.db2.gz FHMNGIAGYHHVBK-VQIMIIECSA-N 1 1 366.421 2.975 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000568353126 518993820 /nfs/dbraw/zinc/99/38/20/518993820.db2.gz SXOHMDBNMZTYFZ-INIZCTEOSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(Cc2nc([C@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303314 519012321 /nfs/dbraw/zinc/01/23/21/519012321.db2.gz MYKGBQAVLHSVNX-CRAIPNDOSA-N 1 1 358.398 2.803 20 5 FFBDMO Cc1c(Cc2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303314 519012327 /nfs/dbraw/zinc/01/23/27/519012327.db2.gz MYKGBQAVLHSVNX-CRAIPNDOSA-N 1 1 358.398 2.803 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c1 ZINC000589518593 519023449 /nfs/dbraw/zinc/02/34/49/519023449.db2.gz ZVZJQDJXLLWYLH-CJNGLKHVSA-N 1 1 350.415 2.897 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000589534942 519026396 /nfs/dbraw/zinc/02/63/96/519026396.db2.gz JAFXHYNJUUAAPV-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000568468356 519050895 /nfs/dbraw/zinc/05/08/95/519050895.db2.gz VVRVHTGKAAQHAA-GFCCVEGCSA-N 1 1 359.373 2.731 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000580238762 519074613 /nfs/dbraw/zinc/07/46/13/519074613.db2.gz VMKCYWUMBQWOIH-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000590014364 519129601 /nfs/dbraw/zinc/12/96/01/519129601.db2.gz BSRIDNIQDJWCMW-SJKOYZFVSA-N 1 1 367.833 2.570 20 5 FFBDMO Cn1cc([C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2(C)C)cn1 ZINC000565842680 519158285 /nfs/dbraw/zinc/15/82/85/519158285.db2.gz UMDYXYAGMBRMOD-CQSZACIVSA-N 1 1 354.414 2.830 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2(C)C)cn1 ZINC000565842680 519158291 /nfs/dbraw/zinc/15/82/91/519158291.db2.gz UMDYXYAGMBRMOD-CQSZACIVSA-N 1 1 354.414 2.830 20 5 FFBDMO Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140278 519159635 /nfs/dbraw/zinc/15/96/35/519159635.db2.gz ODLNOKVGPNXAAQ-LSDHHAIUSA-N 1 1 359.348 2.831 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862264 519256165 /nfs/dbraw/zinc/25/61/65/519256165.db2.gz JASLCQHYTUTCAX-YJBOKZPZSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862264 519256170 /nfs/dbraw/zinc/25/61/70/519256170.db2.gz JASLCQHYTUTCAX-YJBOKZPZSA-N 1 1 352.394 2.585 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[NH+](CC3CC3)CC2)ccc1[N+](=O)[O-] ZINC000590575012 519271380 /nfs/dbraw/zinc/27/13/80/519271380.db2.gz UKFRBUJZSOLSAC-UHFFFAOYSA-N 1 1 353.806 2.567 20 5 FFBDMO COc1cccc2c1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000590759691 519354922 /nfs/dbraw/zinc/35/49/22/519354922.db2.gz IJUVPYQGBBZHPP-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CC[C@@H](C)[NH2+][C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000580793375 519361495 /nfs/dbraw/zinc/36/14/95/519361495.db2.gz DXCGASLDEZDDQD-IAQYHMDHSA-N 1 1 371.397 2.923 20 5 FFBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569283756 519469149 /nfs/dbraw/zinc/46/91/49/519469149.db2.gz OCWPQTJDNZZYGI-CYBMUJFWSA-N 1 1 361.446 2.647 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000602872869 519939016 /nfs/dbraw/zinc/93/90/16/519939016.db2.gz AZHJLHVAXBAVHJ-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602875314 519942553 /nfs/dbraw/zinc/94/25/53/519942553.db2.gz ZMKYUMDBCXYBKV-YOEHRIQHSA-N 1 1 362.474 2.892 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461776 519973111 /nfs/dbraw/zinc/97/31/11/519973111.db2.gz VYABRAXCKXGQTC-ONGXEEELSA-N 1 1 362.386 2.886 20 5 FFBDMO O=C(NC1CC1)c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594604475 520051293 /nfs/dbraw/zinc/05/12/93/520051293.db2.gz ZORZQZBNOXUCOE-WBVHZDCISA-N 1 1 358.442 2.916 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC([C@H]3CCC[NH2+]C3)CC1)OCCO2 ZINC000594735198 520122938 /nfs/dbraw/zinc/12/29/38/520122938.db2.gz HOATVDBLOOZZAW-HNNXBMFYSA-N 1 1 361.442 2.578 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000597606088 520131938 /nfs/dbraw/zinc/13/19/38/520131938.db2.gz ULSLRAGZARHXKS-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO C[N@H+](Cc1ccccc1)CC1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC000608964755 520168575 /nfs/dbraw/zinc/16/85/75/520168575.db2.gz XNOVYQFMUCYMOD-UHFFFAOYSA-N 1 1 356.426 2.907 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000600297805 520188749 /nfs/dbraw/zinc/18/87/49/520188749.db2.gz FXFBUTKHUBKIQL-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000600297805 520188756 /nfs/dbraw/zinc/18/87/56/520188756.db2.gz FXFBUTKHUBKIQL-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000600299249 520189710 /nfs/dbraw/zinc/18/97/10/520189710.db2.gz RQWNQWVTYIIPDE-QGZVFWFLSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000600299249 520189716 /nfs/dbraw/zinc/18/97/16/520189716.db2.gz RQWNQWVTYIIPDE-QGZVFWFLSA-N 1 1 355.394 2.608 20 5 FFBDMO Cc1ccc(C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592145812 520224306 /nfs/dbraw/zinc/22/43/06/520224306.db2.gz CAICIYLPTXNIPJ-SFHVURJKSA-N 1 1 371.437 2.950 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000609233549 520240136 /nfs/dbraw/zinc/24/01/36/520240136.db2.gz GJBNUVJJLIMQHN-QUCCMNQESA-N 1 1 372.421 2.798 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000594994280 520247108 /nfs/dbraw/zinc/24/71/08/520247108.db2.gz JLXHTPQNWIHIFJ-IBGZPJMESA-N 1 1 372.444 2.640 20 5 FFBDMO CN1CCN(Cc2ccccc2)[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000594994280 520247115 /nfs/dbraw/zinc/24/71/15/520247115.db2.gz JLXHTPQNWIHIFJ-IBGZPJMESA-N 1 1 372.444 2.640 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CCN([C@H]3CCOC3)CC2)c1 ZINC000594994387 520247233 /nfs/dbraw/zinc/24/72/33/520247233.db2.gz UMPXEEXPMVLGKM-HNNXBMFYSA-N 1 1 371.384 2.539 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600469863 520279496 /nfs/dbraw/zinc/27/94/96/520279496.db2.gz LSJMSAKYECIUPC-QGZVFWFLSA-N 1 1 359.426 2.691 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000600474038 520281727 /nfs/dbraw/zinc/28/17/27/520281727.db2.gz WLUCLYWCQKLLRI-CQSZACIVSA-N 1 1 354.410 2.890 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[NH+]1CCC(C)CC1 ZINC000603612362 520328477 /nfs/dbraw/zinc/32/84/77/520328477.db2.gz TYAVLMKCPHFDSY-QGZVFWFLSA-N 1 1 373.457 2.957 20 5 FFBDMO CCOc1cc(C(=O)NC[C@@H]2CCCC[N@H+]2CC)c([N+](=O)[O-])cc1OC ZINC000609489437 520330816 /nfs/dbraw/zinc/33/08/16/520330816.db2.gz MRFZJJSMUWFHIP-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO O=[N+]([O-])c1sccc1N1CC[NH+](CCCOCC(F)(F)F)CC1 ZINC000609560545 520359050 /nfs/dbraw/zinc/35/90/50/520359050.db2.gz IJGCPRPWUOQPFW-UHFFFAOYSA-N 1 1 353.366 2.747 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3CC3)C2)nc1OCc1ccccc1 ZINC000613179953 520371052 /nfs/dbraw/zinc/37/10/52/520371052.db2.gz BXMLANCJUOXPTF-KRWDZBQOSA-N 1 1 368.437 2.887 20 5 FFBDMO CN1CC[N@@H+](CCCNc2cccnc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000603849986 520377202 /nfs/dbraw/zinc/37/72/02/520377202.db2.gz QBMIFMBGXABQEE-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2cccnc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000603849986 520377210 /nfs/dbraw/zinc/37/72/10/520377210.db2.gz QBMIFMBGXABQEE-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@H+]1CCN(CCCNc2cccnc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000603849986 520377218 /nfs/dbraw/zinc/37/72/18/520377218.db2.gz QBMIFMBGXABQEE-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000592478717 520407633 /nfs/dbraw/zinc/40/76/33/520407633.db2.gz ITGSKIVCVWQHOH-MAUKXSAKSA-N 1 1 360.458 2.696 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609730673 520416180 /nfs/dbraw/zinc/41/61/80/520416180.db2.gz GIPFGBBZIHKSFK-ZDUSSCGKSA-N 1 1 369.849 2.864 20 5 FFBDMO CCOc1cc(C[NH2+][C@@H](c2cnn(C)c2)C2(CO)CCC2)ccc1[N+](=O)[O-] ZINC000595496002 520507643 /nfs/dbraw/zinc/50/76/43/520507643.db2.gz XCNYAIBTTBCYLO-SFHVURJKSA-N 1 1 374.441 2.721 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000598342482 520567254 /nfs/dbraw/zinc/56/72/54/520567254.db2.gz NTELWNLSLCPWCR-NSHDSACASA-N 1 1 353.444 2.539 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](CO)Cc1ccccc1 ZINC000595599818 520582514 /nfs/dbraw/zinc/58/25/14/520582514.db2.gz ZMHVUMRXVFVKKX-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](CO)Cc1ccccc1 ZINC000595599818 520582520 /nfs/dbraw/zinc/58/25/20/520582520.db2.gz ZMHVUMRXVFVKKX-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO CCCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000592833216 520608858 /nfs/dbraw/zinc/60/88/58/520608858.db2.gz WRSXGMPYCOWGCC-GXTWGEPZSA-N 1 1 369.849 2.958 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000604573293 520609232 /nfs/dbraw/zinc/60/92/32/520609232.db2.gz DAPZLRPWKAIPTM-MRXNPFEDSA-N 1 1 373.409 2.668 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598466579 520629733 /nfs/dbraw/zinc/62/97/33/520629733.db2.gz PZXLBQUTOFCMSO-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO COc1ccc(NC(=O)CC[NH2+][C@@H](C)c2cscn2)c([N+](=O)[O-])c1 ZINC000595668703 520635696 /nfs/dbraw/zinc/63/56/96/520635696.db2.gz OPDWGYGNFOXPSM-JTQLQIEISA-N 1 1 350.400 2.739 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105312 520638154 /nfs/dbraw/zinc/63/81/54/520638154.db2.gz ZJXQDWMNXYGUKH-AWEZNQCLSA-N 1 1 354.410 2.886 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cncc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000601148565 520658665 /nfs/dbraw/zinc/65/86/65/520658665.db2.gz CWDNNVJXBRFLBX-OAHLLOKOSA-N 1 1 366.215 2.750 20 5 FFBDMO C[NH+](C)CCOc1ccc(CN[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1 ZINC000601149158 520659165 /nfs/dbraw/zinc/65/91/65/520659165.db2.gz KAFYMHBDZRYOMJ-FQEVSTJZSA-N 1 1 373.453 2.533 20 5 FFBDMO Cc1cccn2cc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)nc12 ZINC000610391471 520662959 /nfs/dbraw/zinc/66/29/59/520662959.db2.gz UWPWOIZACAJZRL-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1cccn2cc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)nc12 ZINC000610391471 520662968 /nfs/dbraw/zinc/66/29/68/520662968.db2.gz UWPWOIZACAJZRL-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598511584 520672319 /nfs/dbraw/zinc/67/23/19/520672319.db2.gz TUWLSPHOIGISAN-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598511584 520672323 /nfs/dbraw/zinc/67/23/23/520672323.db2.gz TUWLSPHOIGISAN-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO COCc1ncc2c(n1)CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)C2 ZINC000601207342 520686141 /nfs/dbraw/zinc/68/61/41/520686141.db2.gz HLVBOUWUTCEZOK-UHFFFAOYSA-N 1 1 351.366 2.642 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000598561411 520707363 /nfs/dbraw/zinc/70/73/63/520707363.db2.gz QSHOKIYNWHPKGD-OAHLLOKOSA-N 1 1 368.437 2.995 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[NH+]2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 ZINC000610484867 520710161 /nfs/dbraw/zinc/71/01/61/520710161.db2.gz VOWKQEAMZUZECZ-IUCAKERBSA-N 1 1 360.258 2.854 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N2CC[NH+](Cc3ccc(O)cc3)CC2)s1 ZINC000601256398 520711101 /nfs/dbraw/zinc/71/11/01/520711101.db2.gz ANXMFFVTFMNNJJ-UHFFFAOYSA-N 1 1 371.422 2.627 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595788322 520725457 /nfs/dbraw/zinc/72/54/57/520725457.db2.gz JCKGWSIWZNQEEC-CRAIPNDOSA-N 1 1 361.442 2.839 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595790884 520728065 /nfs/dbraw/zinc/72/80/65/520728065.db2.gz ZJUCSCFRNMUJNU-LZLYRXPVSA-N 1 1 364.442 2.616 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595869489 520778807 /nfs/dbraw/zinc/77/88/07/520778807.db2.gz DLKDUKGQIDYTCR-APPDUMDISA-N 1 1 374.384 2.698 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3cccnc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000610677925 520793891 /nfs/dbraw/zinc/79/38/91/520793891.db2.gz HYEALHORXLTWLO-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO Cc1cc(CNC(=O)c2c(F)cccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000601590050 520852934 /nfs/dbraw/zinc/85/29/34/520852934.db2.gz QSIBHKPHEQUGGM-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951110 520918454 /nfs/dbraw/zinc/91/84/54/520918454.db2.gz GZESEVVKGXVFRX-JSGCOSHPSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951110 520918462 /nfs/dbraw/zinc/91/84/62/520918462.db2.gz GZESEVVKGXVFRX-JSGCOSHPSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951110 520918471 /nfs/dbraw/zinc/91/84/71/520918471.db2.gz GZESEVVKGXVFRX-JSGCOSHPSA-N 1 1 361.446 2.530 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596127023 520928778 /nfs/dbraw/zinc/92/87/78/520928778.db2.gz SOULVUBANZLBNL-LSDHHAIUSA-N 1 1 360.458 2.785 20 5 FFBDMO C[N@@H+](CCC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000601779307 520946995 /nfs/dbraw/zinc/94/69/95/520946995.db2.gz PHLNBCOHEFMWIU-IBGZPJMESA-N 1 1 363.458 2.573 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088168 520978764 /nfs/dbraw/zinc/97/87/64/520978764.db2.gz HRTUPZMLRUAEAT-LBPRGKRZSA-N 1 1 355.822 2.570 20 5 FFBDMO CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000611092117 520981558 /nfs/dbraw/zinc/98/15/58/520981558.db2.gz JDHZPBLESAPXLX-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045003 520998206 /nfs/dbraw/zinc/99/82/06/520998206.db2.gz XHJWJJDOWPWYQD-HNNXBMFYSA-N 1 1 355.442 2.723 20 5 FFBDMO C[NH+]1CCC(N2CC[C@H](Nc3ccc4cnccc4c3[N+](=O)[O-])C2)CC1 ZINC000599045003 520998213 /nfs/dbraw/zinc/99/82/13/520998213.db2.gz XHJWJJDOWPWYQD-HNNXBMFYSA-N 1 1 355.442 2.723 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000596309862 521020792 /nfs/dbraw/zinc/02/07/92/521020792.db2.gz YSDHJNLWDCRFCV-MRXNPFEDSA-N 1 1 362.474 2.712 20 5 FFBDMO O=C(NC1CC1)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599165779 521065884 /nfs/dbraw/zinc/06/58/84/521065884.db2.gz SLAOALGYGAJYJY-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000593617259 521109189 /nfs/dbraw/zinc/10/91/89/521109189.db2.gz YTXUUZBTKCNMKT-UHFFFAOYSA-N 1 1 363.867 2.504 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596570825 521138162 /nfs/dbraw/zinc/13/81/62/521138162.db2.gz OIZLVMCKFMWJBD-AWEZNQCLSA-N 1 1 367.471 2.532 20 5 FFBDMO CCN(C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CC[N@@H+](C)C1 ZINC000596585185 521146796 /nfs/dbraw/zinc/14/67/96/521146796.db2.gz DYVLRRKUAOCENE-ZDUSSCGKSA-N 1 1 374.363 2.849 20 5 FFBDMO CCc1n[nH]c(C(=O)NCCC[N@H+](CC)C2CCCCC2)c1[N+](=O)[O-] ZINC000593786689 521211931 /nfs/dbraw/zinc/21/19/31/521211931.db2.gz LXGDNWMJOFGANI-UHFFFAOYSA-N 1 1 351.451 2.655 20 5 FFBDMO COC(=O)[C@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000611574646 521228811 /nfs/dbraw/zinc/22/88/11/521228811.db2.gz GVYSAODWDLDPQI-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1ccc([C@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000599599908 521323280 /nfs/dbraw/zinc/32/32/80/521323280.db2.gz HVAICMRTWPOQOF-ZDUSSCGKSA-N 1 1 373.409 2.926 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987350 521331449 /nfs/dbraw/zinc/33/14/49/521331449.db2.gz NOTFAJDNIONUEG-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987350 521331457 /nfs/dbraw/zinc/33/14/57/521331457.db2.gz NOTFAJDNIONUEG-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC000593997928 521338911 /nfs/dbraw/zinc/33/89/11/521338911.db2.gz DRMUXMCLSVSJCI-HNNXBMFYSA-N 1 1 360.458 2.872 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCCC2)O1 ZINC000594057196 521378759 /nfs/dbraw/zinc/37/87/59/521378759.db2.gz ASZAZVITQIHWDQ-JKSUJKDBSA-N 1 1 364.442 2.758 20 5 FFBDMO CN(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602517416 521391779 /nfs/dbraw/zinc/39/17/79/521391779.db2.gz BHCAUDWNTPMPFU-OAHLLOKOSA-N 1 1 354.410 2.999 20 5 FFBDMO CC[C@@H](C)NC(=O)[C@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602585279 521425811 /nfs/dbraw/zinc/42/58/11/521425811.db2.gz COIXJGVOZAZJEE-SFYZADRCSA-N 1 1 364.265 2.812 20 5 FFBDMO C[C@@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000599750396 521446571 /nfs/dbraw/zinc/44/65/71/521446571.db2.gz VNYFRNHNJRYXHW-SNVBAGLBSA-N 1 1 368.231 2.738 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000594198714 521464385 /nfs/dbraw/zinc/46/43/85/521464385.db2.gz VFPGQRSUYZPBKF-HOCLYGCPSA-N 1 1 369.425 2.527 20 5 FFBDMO CC[C@H](C)C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(=O)OC ZINC000602702035 521485799 /nfs/dbraw/zinc/48/57/99/521485799.db2.gz MWLMKTQSKWJVTF-BBRMVZONSA-N 1 1 364.446 2.526 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612121694 521494398 /nfs/dbraw/zinc/49/43/98/521494398.db2.gz LHDBLEULJFWQIL-AGIUHOORSA-N 1 1 362.348 2.997 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC1 ZINC000597091709 521497269 /nfs/dbraw/zinc/49/72/69/521497269.db2.gz CKYFVTVSHYEYGQ-UHFFFAOYSA-N 1 1 355.826 2.778 20 5 FFBDMO CCN(C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](CC)C1 ZINC000597092072 521498495 /nfs/dbraw/zinc/49/84/95/521498495.db2.gz JMLBJKNAVDKJDU-LLVKDONJSA-N 1 1 355.826 2.778 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000602772879 521524954 /nfs/dbraw/zinc/52/49/54/521524954.db2.gz MKSLLGNAZHWEAW-HNNXBMFYSA-N 1 1 358.398 2.708 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000602772880 521526286 /nfs/dbraw/zinc/52/62/86/521526286.db2.gz MKSLLGNAZHWEAW-OAHLLOKOSA-N 1 1 358.398 2.708 20 5 FFBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccc([N+](=O)[O-])[nH]1 ZINC000612285762 521560848 /nfs/dbraw/zinc/56/08/48/521560848.db2.gz DKJIIUWXJVTFSL-IXDOHACOSA-N 1 1 368.437 2.953 20 5 FFBDMO O=C1CCCN1C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597228345 521585760 /nfs/dbraw/zinc/58/57/60/521585760.db2.gz LOKBZBGYUMTVST-LBPRGKRZSA-N 1 1 369.368 2.641 20 5 FFBDMO O=C1CCCN1C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597228345 521585765 /nfs/dbraw/zinc/58/57/65/521585765.db2.gz LOKBZBGYUMTVST-LBPRGKRZSA-N 1 1 369.368 2.641 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000826028464 607967892 /nfs/dbraw/zinc/96/78/92/607967892.db2.gz APOUIAIRWJQIHV-WBVHZDCISA-N 1 1 365.397 2.632 20 5 FFBDMO CCC[C@H]1CN(c2ccc([N+](=O)[O-])cc2COC)CC[N@H+]1CCOC ZINC000162458337 728945332 /nfs/dbraw/zinc/94/53/32/728945332.db2.gz MOBZJVNHXVWTOD-KRWDZBQOSA-N 1 1 351.447 2.678 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CCC[N@H+](CCF)C1 ZINC000899221966 735461671 /nfs/dbraw/zinc/46/16/71/735461671.db2.gz ZYDZGDVLKWNOGY-LBPRGKRZSA-N 1 1 357.813 2.731 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CCC[N@@H+](CCF)C1 ZINC000899221966 735461673 /nfs/dbraw/zinc/46/16/73/735461673.db2.gz ZYDZGDVLKWNOGY-LBPRGKRZSA-N 1 1 357.813 2.731 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000192728419 729457420 /nfs/dbraw/zinc/45/74/20/729457420.db2.gz SMYVFCYZROTMIT-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245423785 729569609 /nfs/dbraw/zinc/56/96/09/729569609.db2.gz JRAVLPFOIBHNAA-SWLSCSKDSA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ncc([N+](=O)[O-])s3)C2)ccn1 ZINC000856533195 730345428 /nfs/dbraw/zinc/34/54/28/730345428.db2.gz APZAORRAZKCUSO-CQSZACIVSA-N 1 1 363.443 2.556 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000861349843 730602833 /nfs/dbraw/zinc/60/28/33/730602833.db2.gz WDWIFXKPTKHWGM-RDTXWAMCSA-N 1 1 350.415 2.984 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000864857668 730885455 /nfs/dbraw/zinc/88/54/55/730885455.db2.gz BVCCVOZWHULJTC-UHFFFAOYSA-N 1 1 372.263 2.746 20 5 FFBDMO COCCN(Cc1cccs1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867950674 731245029 /nfs/dbraw/zinc/24/50/29/731245029.db2.gz YOBOBMRSIKVGNA-QGZVFWFLSA-N 1 1 363.439 2.505 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879575731 732727389 /nfs/dbraw/zinc/72/73/89/732727389.db2.gz MYBKEAHCKURVSS-BFQNTYOBSA-N 1 1 366.849 2.601 20 5 FFBDMO CO[C@@]1(C(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000880304497 732883627 /nfs/dbraw/zinc/88/36/27/732883627.db2.gz PQGYLBVLOFXDTE-AWEZNQCLSA-N 1 1 361.320 2.577 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCSC[C@@H]1c1ccccc1 ZINC000880387985 732900425 /nfs/dbraw/zinc/90/04/25/732900425.db2.gz ODQKWUMNBKJTBG-QGZVFWFLSA-N 1 1 359.451 2.937 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)s1 ZINC000886288821 733770511 /nfs/dbraw/zinc/77/05/11/733770511.db2.gz IDHOEZLXJAQVFR-GFCCVEGCSA-N 1 1 362.411 2.613 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)s1 ZINC000886288821 733770512 /nfs/dbraw/zinc/77/05/12/733770512.db2.gz IDHOEZLXJAQVFR-GFCCVEGCSA-N 1 1 362.411 2.613 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000886305278 733771997 /nfs/dbraw/zinc/77/19/97/733771997.db2.gz CKHREVZUUCMPRA-TZMCWYRMSA-N 1 1 350.419 2.582 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827426 733845111 /nfs/dbraw/zinc/84/51/11/733845111.db2.gz KSVGEOFTWPFUNJ-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827426 733845114 /nfs/dbraw/zinc/84/51/14/733845114.db2.gz KSVGEOFTWPFUNJ-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000782978428 738770116 /nfs/dbraw/zinc/77/01/16/738770116.db2.gz HBXNOKXDRHBDSG-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO C[C@]1(Br)C[C@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078502 734512482 /nfs/dbraw/zinc/51/24/82/734512482.db2.gz NNZPRCFSJWHBIQ-WDMOLILDSA-N 1 1 355.236 2.650 20 5 FFBDMO CSc1ccc(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928104550 738825673 /nfs/dbraw/zinc/82/56/73/738825673.db2.gz VZUWCALUWWYBQW-OCCSQVGLSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928104550 738825680 /nfs/dbraw/zinc/82/56/80/738825680.db2.gz VZUWCALUWWYBQW-OCCSQVGLSA-N 1 1 367.496 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c1 ZINC000735562390 734950856 /nfs/dbraw/zinc/95/08/56/734950856.db2.gz KAXXXJXZPNQELV-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO CCO/C=C\[C@](O)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000895710504 735044510 /nfs/dbraw/zinc/04/45/10/735044510.db2.gz MDKMZRYUWWTSOK-SZZPACECSA-N 1 1 352.284 2.667 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])n(C)c1C ZINC000896019322 735089256 /nfs/dbraw/zinc/08/92/56/735089256.db2.gz PPTCUUZVYVLTKU-UHFFFAOYSA-N 1 1 351.790 2.972 20 5 FFBDMO C[C@@]1(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)COC(=O)N1 ZINC000896459353 735165029 /nfs/dbraw/zinc/16/50/29/735165029.db2.gz FGAZCVOCHZCFSH-INIZCTEOSA-N 1 1 353.806 2.959 20 5 FFBDMO COc1cc(C(=O)OCC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000752449329 735987169 /nfs/dbraw/zinc/98/71/69/735987169.db2.gz WJAXBYXMHRHCJZ-GFCCVEGCSA-N 1 1 352.387 2.643 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000754222800 736136801 /nfs/dbraw/zinc/13/68/01/736136801.db2.gz FBLBVRIZWWXXDV-SECBINFHSA-N 1 1 374.210 2.663 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000754222800 736136802 /nfs/dbraw/zinc/13/68/02/736136802.db2.gz FBLBVRIZWWXXDV-SECBINFHSA-N 1 1 374.210 2.663 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755026991 736227665 /nfs/dbraw/zinc/22/76/65/736227665.db2.gz ZKYNVJVPQMNLMD-SNVBAGLBSA-N 1 1 357.208 2.573 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755026986 736227837 /nfs/dbraw/zinc/22/78/37/736227837.db2.gz ZKYNVJVPQMNLMD-JTQLQIEISA-N 1 1 357.208 2.573 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000756934079 736374285 /nfs/dbraw/zinc/37/42/85/736374285.db2.gz MXAQPOSMCQDLHN-UHFFFAOYSA-N 1 1 354.838 2.922 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000760875072 736676914 /nfs/dbraw/zinc/67/69/14/736676914.db2.gz XVYGXDPKJKRDIA-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@@H+]1C ZINC000760875072 736676919 /nfs/dbraw/zinc/67/69/19/736676919.db2.gz XVYGXDPKJKRDIA-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000764300355 737009782 /nfs/dbraw/zinc/00/97/82/737009782.db2.gz ZHWHFZHKNCGCRR-CABCVRRESA-N 1 1 367.833 2.621 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CC1 ZINC000774628377 738006938 /nfs/dbraw/zinc/00/69/38/738006938.db2.gz UNDXNUXDJLHEJG-SNVBAGLBSA-N 1 1 366.805 2.829 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639559 738008147 /nfs/dbraw/zinc/00/81/47/738008147.db2.gz LVKWPAHTVXCFTA-BLLLJJGKSA-N 1 1 363.849 2.972 20 5 FFBDMO CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388930 738135628 /nfs/dbraw/zinc/13/56/28/738135628.db2.gz RZBIUCSXAJRUKU-BDXSIMOUSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388930 738135629 /nfs/dbraw/zinc/13/56/29/738135629.db2.gz RZBIUCSXAJRUKU-BDXSIMOUSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000922388930 738135631 /nfs/dbraw/zinc/13/56/31/738135631.db2.gz RZBIUCSXAJRUKU-BDXSIMOUSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC1 ZINC000931793488 739330650 /nfs/dbraw/zinc/33/06/50/739330650.db2.gz CSJMUOYCJQACFM-UHFFFAOYSA-N 1 1 358.801 2.526 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CCCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000931903934 739350264 /nfs/dbraw/zinc/35/02/64/739350264.db2.gz REIQOZLIHMMWOS-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@@]1(C2CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)COC(=O)N1 ZINC000932093739 739385203 /nfs/dbraw/zinc/38/52/03/739385203.db2.gz RDMPFZCRABPQOX-INIZCTEOSA-N 1 1 353.806 2.959 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)s1 ZINC000932671666 739490619 /nfs/dbraw/zinc/49/06/19/739490619.db2.gz UNNCLMXFINXYNC-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)s1 ZINC000932671666 739490620 /nfs/dbraw/zinc/49/06/20/739490620.db2.gz UNNCLMXFINXYNC-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO CCO[C@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000932972515 739547979 /nfs/dbraw/zinc/54/79/79/739547979.db2.gz QCYYJLAPVBUTNL-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO CCO[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000932972515 739547981 /nfs/dbraw/zinc/54/79/81/739547981.db2.gz QCYYJLAPVBUTNL-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO CN1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@@H+](C)CC1 ZINC000933993211 739718667 /nfs/dbraw/zinc/71/86/67/739718667.db2.gz XRQKAEZNFXEFOG-UHFFFAOYSA-N 1 1 361.273 2.581 20 5 FFBDMO CO[C@@H]1CC[C@H]1[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107647 739731698 /nfs/dbraw/zinc/73/16/98/739731698.db2.gz XNXTVPSKQHRMDC-DGCLKSJQSA-N 1 1 352.778 2.907 20 5 FFBDMO CO[C@@H]1CC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107647 739731702 /nfs/dbraw/zinc/73/17/02/739731702.db2.gz XNXTVPSKQHRMDC-DGCLKSJQSA-N 1 1 352.778 2.907 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Cc3nccs3)C2)c2c(c1)COCO2 ZINC000934337637 739768968 /nfs/dbraw/zinc/76/89/68/739768968.db2.gz TZAWOVSGRMZQDQ-GFCCVEGCSA-N 1 1 361.423 2.982 20 5 FFBDMO C[C@H]1C[N@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C[C@H]1C ZINC000795436128 740021948 /nfs/dbraw/zinc/02/19/48/740021948.db2.gz VEUOARDMBDYSFR-AOOOYVTPSA-N 1 1 368.231 2.858 20 5 FFBDMO C[C@H]1C[N@@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C[C@H]1C ZINC000795436128 740021951 /nfs/dbraw/zinc/02/19/51/740021951.db2.gz VEUOARDMBDYSFR-AOOOYVTPSA-N 1 1 368.231 2.858 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C[C@@H]2C1 ZINC000812339734 741611688 /nfs/dbraw/zinc/61/16/88/741611688.db2.gz AAZTZGQFOPQJLR-PWSUYJOCSA-N 1 1 357.332 2.637 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CC1(Cl)Cl ZINC000813170358 741684659 /nfs/dbraw/zinc/68/46/59/741684659.db2.gz CKEMYPGKEDEJPL-STQMWFEESA-N 1 1 359.209 2.906 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CC1(Cl)Cl ZINC000813170358 741684661 /nfs/dbraw/zinc/68/46/61/741684661.db2.gz CKEMYPGKEDEJPL-STQMWFEESA-N 1 1 359.209 2.906 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@@H]1CCC[N@H+]1C ZINC000817292259 742118921 /nfs/dbraw/zinc/11/89/21/742118921.db2.gz SCQNKSBOEBBGRS-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC([N@H+](Cc2ccsc2)CC2CC2)CC1 ZINC001039485953 742992336 /nfs/dbraw/zinc/99/23/36/742992336.db2.gz WBQZXTDRYFMGQJ-IAGOWNOFSA-N 1 1 363.483 2.616 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@@H+](Cc2ccsc2)CC2CC2)CC1 ZINC001039485953 742992339 /nfs/dbraw/zinc/99/23/39/742992339.db2.gz WBQZXTDRYFMGQJ-IAGOWNOFSA-N 1 1 363.483 2.616 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@H+](Cc2ccsc2)CC2CC2)CC1 ZINC001039485953 742992344 /nfs/dbraw/zinc/99/23/44/742992344.db2.gz WBQZXTDRYFMGQJ-IAGOWNOFSA-N 1 1 363.483 2.616 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3c(Br)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000827216708 743535514 /nfs/dbraw/zinc/53/55/14/743535514.db2.gz CNUKZOBDCKAFTH-ZYHUDNBSSA-N 1 1 368.231 2.524 20 5 FFBDMO CCOc1cc(CN2C[C@@H](C)[N@H+](CCOC)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000830074295 745301980 /nfs/dbraw/zinc/30/19/80/745301980.db2.gz DXDYTGXONCPHMW-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000830451722 745360835 /nfs/dbraw/zinc/36/08/35/745360835.db2.gz SKFIOZNGIXVNJD-ZDUSSCGKSA-N 1 1 373.837 2.566 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000830451722 745360839 /nfs/dbraw/zinc/36/08/39/745360839.db2.gz SKFIOZNGIXVNJD-ZDUSSCGKSA-N 1 1 373.837 2.566 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N(C)CCC[N@H+](C)CCN(C)C)cc1[N+](=O)[O-] ZINC000832124861 745640504 /nfs/dbraw/zinc/64/05/04/745640504.db2.gz RDWDAHNLPBUXOR-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N(C)CCCN(C)CC[NH+](C)C)cc1[N+](=O)[O-] ZINC000832124861 745640505 /nfs/dbraw/zinc/64/05/05/745640505.db2.gz RDWDAHNLPBUXOR-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO CN1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c2ccc[nH+]c21 ZINC000839533074 746849506 /nfs/dbraw/zinc/84/95/06/746849506.db2.gz FKMNGNPIMJHFDK-UHFFFAOYSA-N 1 1 361.789 2.538 20 5 FFBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839568209 746858251 /nfs/dbraw/zinc/85/82/51/746858251.db2.gz KTZVYFWGNFEBTG-BDJLRTHQSA-N 1 1 355.822 2.670 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000839640960 746879435 /nfs/dbraw/zinc/87/94/35/746879435.db2.gz OGRLTZBHWQKQJR-JKSUJKDBSA-N 1 1 359.813 2.949 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000844903348 748133336 /nfs/dbraw/zinc/13/33/36/748133336.db2.gz XQEUCXROZXHCAV-XGWLTEMNSA-N 1 1 353.850 2.967 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481175 748937189 /nfs/dbraw/zinc/93/71/89/748937189.db2.gz WGPRPBAMUSDAFB-DLBZAZTESA-N 1 1 363.483 2.942 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481175 748937195 /nfs/dbraw/zinc/93/71/95/748937195.db2.gz WGPRPBAMUSDAFB-DLBZAZTESA-N 1 1 363.483 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1F ZINC000855054889 750419126 /nfs/dbraw/zinc/41/91/26/750419126.db2.gz AOYPOZQOFDDIPU-NWDGAFQWSA-N 1 1 353.369 2.928 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000795186694 1013047453 /nfs/dbraw/zinc/04/74/53/1013047453.db2.gz BLRLFXSKRJDIIL-KUHUBIRLSA-N 1 1 359.401 2.978 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)n1 ZINC001125936485 971759719 /nfs/dbraw/zinc/75/97/19/971759719.db2.gz TWQKFRGJPKRYIG-CQSZACIVSA-N 1 1 370.409 2.944 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121237809 963068865 /nfs/dbraw/zinc/06/88/65/963068865.db2.gz AWQKGYKOUDTFGT-CQSZACIVSA-N 1 1 354.414 2.509 20 5 FFBDMO CN(C(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000135194330 963822457 /nfs/dbraw/zinc/82/24/57/963822457.db2.gz FFLZTWXYFUHBGU-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000873261708 1013449976 /nfs/dbraw/zinc/44/99/76/1013449976.db2.gz QTKUEGNXJSHTNW-NOVWEMISSA-N 1 1 355.442 2.538 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC1 ZINC001143565651 965132009 /nfs/dbraw/zinc/13/20/09/965132009.db2.gz OZYMJFRKVDWVKE-UHFFFAOYSA-N 1 1 356.426 2.887 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001176767947 1013776236 /nfs/dbraw/zinc/77/62/36/1013776236.db2.gz ZGVLSKZCUNIGKR-CALCHBBNSA-N 1 1 354.834 2.595 20 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CCOC(=O)CC[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000103458074 970403209 /nfs/dbraw/zinc/40/32/09/970403209.db2.gz NHKNZPJTOJLZBU-UHFFFAOYSA-N 1 1 358.398 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@H](CN1CCOCC1)c1ccccc1 ZINC000182136082 977195938 /nfs/dbraw/zinc/19/59/38/977195938.db2.gz MYNPHQBGWCISAA-GOSISDBHSA-N 1 1 359.401 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1 ZINC001211759076 977831714 /nfs/dbraw/zinc/83/17/14/977831714.db2.gz UGKKRSYTIJPAOQ-INIZCTEOSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2ccc(Cl)s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001482044048 977956781 /nfs/dbraw/zinc/95/67/81/977956781.db2.gz ZVIMJARFFNUBOI-ZIAGYGMSSA-N 1 1 371.890 2.785 20 5 FFBDMO C[N@@H+](CCN1CCN(c2cccc(F)c2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000729185110 978199179 /nfs/dbraw/zinc/19/91/79/978199179.db2.gz JXAAZABMMBZMKL-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1C ZINC001029964794 980156580 /nfs/dbraw/zinc/15/65/80/980156580.db2.gz ZXDAVAOLGUQZRC-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001029964794 980156585 /nfs/dbraw/zinc/15/65/85/980156585.db2.gz ZXDAVAOLGUQZRC-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001029964794 980156591 /nfs/dbraw/zinc/15/65/91/980156591.db2.gz ZXDAVAOLGUQZRC-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO C[N@H+](Cc1ccc(C2CC2)cc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964664 980156645 /nfs/dbraw/zinc/15/66/45/980156645.db2.gz UPCRRRQMOFFXNQ-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO C[N@@H+](Cc1ccc(C2CC2)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964664 980156650 /nfs/dbraw/zinc/15/66/50/980156650.db2.gz UPCRRRQMOFFXNQ-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO C[N@H+](Cc1ccc(C2CC2)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964664 980156656 /nfs/dbraw/zinc/15/66/56/980156656.db2.gz UPCRRRQMOFFXNQ-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO CN(C)[C@@H]1CC[N@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CCO)cc2)C1 ZINC000906180668 980592598 /nfs/dbraw/zinc/59/25/98/980592598.db2.gz YJFKWJGPOYQZDT-HXUWFJFHSA-N 1 1 369.465 2.933 20 5 FFBDMO CN(C)[C@@H]1CC[N@@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CCO)cc2)C1 ZINC000906180668 980592604 /nfs/dbraw/zinc/59/26/04/980592604.db2.gz YJFKWJGPOYQZDT-HXUWFJFHSA-N 1 1 369.465 2.933 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC3(CC2)CC[NH+](C)CC3)c1 ZINC000877684103 1014675892 /nfs/dbraw/zinc/67/58/92/1014675892.db2.gz GGMCKWPRXGNHKW-UHFFFAOYSA-N 1 1 361.442 2.689 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CCC[NH+]1CCN(C(C)C)CC1 ZINC000908267711 981402937 /nfs/dbraw/zinc/40/29/37/981402937.db2.gz IEAAYIRIOWPRJN-UHFFFAOYSA-N 1 1 362.474 2.956 20 5 FFBDMO CC1(C)CCC(C[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)CC1 ZINC000963791143 1014765954 /nfs/dbraw/zinc/76/59/54/1014765954.db2.gz OCPYNEUOZXGCDY-SWGIKSQZSA-N 1 1 363.502 2.885 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000164804557 984403046 /nfs/dbraw/zinc/40/30/46/984403046.db2.gz KQBAMIQRLUYGQL-MSOLQXFVSA-N 1 1 355.442 2.735 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000765845234 986710351 /nfs/dbraw/zinc/71/03/51/986710351.db2.gz OJHZDYYZDVNYIJ-NRFANRHFSA-N 1 1 369.465 2.925 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913686538 986830087 /nfs/dbraw/zinc/83/00/87/986830087.db2.gz ZFJPDJNBZCBQCN-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913686538 986830098 /nfs/dbraw/zinc/83/00/98/986830098.db2.gz ZFJPDJNBZCBQCN-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1 ZINC000451099859 987357528 /nfs/dbraw/zinc/35/75/28/987357528.db2.gz ZNYJAXYJWHCZNS-LSDHHAIUSA-N 1 1 374.368 2.828 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000761602207 987542290 /nfs/dbraw/zinc/54/22/90/987542290.db2.gz ZFRVGNBNCKDNHA-ZDUSSCGKSA-N 1 1 365.393 2.904 20 5 FFBDMO Cn1nc2c(c1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)COCC2 ZINC000922066285 987599423 /nfs/dbraw/zinc/59/94/23/987599423.db2.gz AMFIKXBUEBFDAX-UHFFFAOYSA-N 1 1 370.331 2.710 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000762638100 988543597 /nfs/dbraw/zinc/54/35/97/988543597.db2.gz AIQXIRNYLWIISA-FUHWJXTLSA-N 1 1 361.398 2.524 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccc3ccccc3c2)CC1 ZINC001005384188 989741338 /nfs/dbraw/zinc/74/13/38/989741338.db2.gz YIQUUCDIVLBHOL-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000154328835 990175650 /nfs/dbraw/zinc/17/56/50/990175650.db2.gz WLHIISUKAAYEHW-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000154328835 990175658 /nfs/dbraw/zinc/17/56/58/990175658.db2.gz WLHIISUKAAYEHW-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)c(C)c1 ZINC001035186424 990401314 /nfs/dbraw/zinc/40/13/14/990401314.db2.gz DSQMXQDSZFHKIE-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c(C)c1 ZINC001035186424 990401319 /nfs/dbraw/zinc/40/13/19/990401319.db2.gz DSQMXQDSZFHKIE-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c(C)c1 ZINC001035186424 990401321 /nfs/dbraw/zinc/40/13/21/990401321.db2.gz DSQMXQDSZFHKIE-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](C/C=C\c3ccccc3)C2)CC1 ZINC001035186686 990410211 /nfs/dbraw/zinc/41/02/11/990410211.db2.gz JKKWZPIOAVYNCR-ZSKSOVMSSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](C/C=C\c3ccccc3)C2)CC1 ZINC001035186686 990410213 /nfs/dbraw/zinc/41/02/13/990410213.db2.gz JKKWZPIOAVYNCR-ZSKSOVMSSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](C/C=C\c3ccccc3)C2)CC1 ZINC001035186686 990410215 /nfs/dbraw/zinc/41/02/15/990410215.db2.gz JKKWZPIOAVYNCR-ZSKSOVMSSA-N 1 1 369.465 2.680 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000180153769 991440100 /nfs/dbraw/zinc/44/01/00/991440100.db2.gz OFPGUDORLRVHRG-CRAIPNDOSA-N 1 1 354.410 2.661 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)c(N)c([N+](=O)[O-])c1 ZINC000068510498 991454621 /nfs/dbraw/zinc/45/46/21/991454621.db2.gz XPVXFABVMCZKDN-UHFFFAOYSA-N 1 1 368.437 2.752 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810842131 994948535 /nfs/dbraw/zinc/94/85/35/994948535.db2.gz SSPORWHEYPVCOI-BBRMVZONSA-N 1 1 356.382 2.564 20 5 FFBDMO CC(C)(CCc1noc([C@H]2CCC[N@@H+](Cc3cccnc3)C2)n1)[N+](=O)[O-] ZINC000812814020 995538286 /nfs/dbraw/zinc/53/82/86/995538286.db2.gz TWQCWRLZIDIBTM-HNNXBMFYSA-N 1 1 359.430 2.832 20 5 FFBDMO O=C(/C=C\c1cncc(F)c1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172321 995633839 /nfs/dbraw/zinc/63/38/39/995633839.db2.gz IQDQTXLLZPIXRG-XDXAGZTOSA-N 1 1 371.368 2.960 20 5 FFBDMO O=C(/C=C\c1cncc(F)c1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172321 995633841 /nfs/dbraw/zinc/63/38/41/995633841.db2.gz IQDQTXLLZPIXRG-XDXAGZTOSA-N 1 1 371.368 2.960 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000824688631 997054450 /nfs/dbraw/zinc/05/44/50/997054450.db2.gz VZNMKXJRNAOHAH-IAGOWNOFSA-N 1 1 373.453 2.585 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1 ZINC000843889499 997482410 /nfs/dbraw/zinc/48/24/10/997482410.db2.gz CIKRYJCSBRCLAY-OAHLLOKOSA-N 1 1 373.384 2.861 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000803858284 1016247392 /nfs/dbraw/zinc/24/73/92/1016247392.db2.gz NZTULOGXOHTYRE-AWEZNQCLSA-N 1 1 374.397 2.953 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741022661 999703742 /nfs/dbraw/zinc/70/37/42/999703742.db2.gz WAGRMAYQOFCJTC-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741022661 999703744 /nfs/dbraw/zinc/70/37/44/999703744.db2.gz WAGRMAYQOFCJTC-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741022663 999703844 /nfs/dbraw/zinc/70/38/44/999703844.db2.gz WAGRMAYQOFCJTC-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741022663 999703847 /nfs/dbraw/zinc/70/38/47/999703847.db2.gz WAGRMAYQOFCJTC-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO Cc1c(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000741579290 999732263 /nfs/dbraw/zinc/73/22/63/999732263.db2.gz LBKYRFSFRUIMJM-HZMBPMFUSA-N 1 1 364.402 2.532 20 5 FFBDMO C[N@H+](CCc1cccs1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000743382253 999815847 /nfs/dbraw/zinc/81/58/47/999815847.db2.gz MUXQTKVQHHSZGV-UHFFFAOYSA-N 1 1 374.422 2.557 20 5 FFBDMO C[N@@H+](CCc1cccs1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000743382253 999815850 /nfs/dbraw/zinc/81/58/50/999815850.db2.gz MUXQTKVQHHSZGV-UHFFFAOYSA-N 1 1 374.422 2.557 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000744394850 999854126 /nfs/dbraw/zinc/85/41/26/999854126.db2.gz JAHQGPPJRDLCNC-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO CC(C)Cc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086363574 999871980 /nfs/dbraw/zinc/87/19/80/999871980.db2.gz BJBKHANOGQLGHV-NCXUSEDFSA-N 1 1 359.470 2.535 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000745088438 999891669 /nfs/dbraw/zinc/89/16/69/999891669.db2.gz NXKKTJTZQPYTIJ-CZUORRHYSA-N 1 1 363.414 2.585 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000745943429 999938227 /nfs/dbraw/zinc/93/82/27/999938227.db2.gz DGTCXPAAKZAVDY-OAHLLOKOSA-N 1 1 365.430 2.915 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169011330 1000015677 /nfs/dbraw/zinc/01/56/77/1000015677.db2.gz JWLVDVSZWXCLND-YHUYYLMFSA-N 1 1 353.463 2.763 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169030280 1000016129 /nfs/dbraw/zinc/01/61/29/1000016129.db2.gz XWLBPDBIYOJUJE-IMFGXOCKSA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC3(CC2)CN(Cc2ccccc2)CCO3)C1 ZINC001169019594 1000017586 /nfs/dbraw/zinc/01/75/86/1000017586.db2.gz GSNAMIYUYWHECH-UXHICEINSA-N 1 1 373.497 2.799 20 5 FFBDMO CCN1CC[C@@]2(C[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2c2ccccc2)C1=O ZINC001169026669 1000018105 /nfs/dbraw/zinc/01/81/05/1000018105.db2.gz YNGVVWVEGYYIJR-LYSIVYOWSA-N 1 1 371.481 2.770 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+](C2CC2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169048694 1000018696 /nfs/dbraw/zinc/01/86/96/1000018696.db2.gz APTKGIJMMDTWNL-NUEKZKHPSA-N 1 1 353.463 2.906 20 5 FFBDMO O=C1c2cccc(F)c2CN1[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169056297 1000019028 /nfs/dbraw/zinc/01/90/28/1000019028.db2.gz RGKAVOICKRGZRS-RRFJBIMHSA-N 1 1 361.417 2.691 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2nc(C)ccc2[N+](=O)[O-])c2ccccc12 ZINC001169114211 1000026421 /nfs/dbraw/zinc/02/64/21/1000026421.db2.gz ICZHZRAZLXRXSO-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(O)(c3ccccc3)CC1)OCCO2 ZINC000768530581 1000286207 /nfs/dbraw/zinc/28/62/07/1000286207.db2.gz MGKXQBGHDLTPTK-UHFFFAOYSA-N 1 1 370.405 2.850 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846931960 1000482303 /nfs/dbraw/zinc/48/23/03/1000482303.db2.gz OLORIYFLYNEVKE-HNNXBMFYSA-N 1 1 359.386 2.862 20 5 FFBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c(c1)CC(=O)N2C ZINC000769787613 1000602676 /nfs/dbraw/zinc/60/26/76/1000602676.db2.gz RIJVGTUNBCEKFF-NSHDSACASA-N 1 1 365.393 2.841 20 5 FFBDMO CN(C)c1cc(NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)cc[nH+]1 ZINC001148924635 1001240593 /nfs/dbraw/zinc/24/05/93/1001240593.db2.gz UAEJIJDQPLCVPG-UHFFFAOYSA-N 1 1 353.741 2.683 20 5 FFBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000772357867 1001361583 /nfs/dbraw/zinc/36/15/83/1001361583.db2.gz SPXNZDZWEBEADB-HZPDHXFCSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1cc(F)ccc1[C@@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000746669449 1001681698 /nfs/dbraw/zinc/68/16/98/1001681698.db2.gz CLPAQVNUVQOFET-YOEHRIQHSA-N 1 1 360.389 2.657 20 5 FFBDMO COc1c(O)ccc(C[N@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001183168946 1002198592 /nfs/dbraw/zinc/19/85/92/1002198592.db2.gz AWNQEAKRNMGHIE-LLVKDONJSA-N 1 1 369.418 2.654 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001183168946 1002198597 /nfs/dbraw/zinc/19/85/97/1002198597.db2.gz AWNQEAKRNMGHIE-LLVKDONJSA-N 1 1 369.418 2.654 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000790284845 1002318771 /nfs/dbraw/zinc/31/87/71/1002318771.db2.gz IDUKFBXSSNMZJE-CQSZACIVSA-N 1 1 366.418 2.836 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CC[C@@H](C)C1 ZINC000790481338 1002389285 /nfs/dbraw/zinc/38/92/85/1002389285.db2.gz XLQFWMLJUBXTEO-GDBMZVCRSA-N 1 1 359.430 2.948 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)Cc1ccccc1 ZINC000791301167 1002639052 /nfs/dbraw/zinc/63/90/52/1002639052.db2.gz MKTXQFASJHWYBJ-UHFFFAOYSA-N 1 1 360.389 2.568 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[NH+](C[C@@H]3CCCO3)CC2)cccc1C(F)(F)F ZINC001184702819 1002687530 /nfs/dbraw/zinc/68/75/30/1002687530.db2.gz GRMIPQNBWSVFJJ-LBPRGKRZSA-N 1 1 359.348 2.915 20 5 FFBDMO CCN(CC)C(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774860750 1002910533 /nfs/dbraw/zinc/91/05/33/1002910533.db2.gz AYWJQGIVRKDYFM-UHFFFAOYSA-N 1 1 364.402 2.583 20 5 FFBDMO COc1cc(F)c([N+](=O)[O-])c(NCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000747204607 1003773478 /nfs/dbraw/zinc/77/34/78/1003773478.db2.gz ZAICQBDIBDYXCB-UHFFFAOYSA-N 1 1 374.416 2.977 20 5 FFBDMO C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000804720343 1003799329 /nfs/dbraw/zinc/79/93/29/1003799329.db2.gz ROFBQRYBFREBOI-MRXNPFEDSA-N 1 1 351.410 2.606 20 5 FFBDMO CN(CCn1cc([N+](=O)[O-])cn1)C[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001197420862 1004216555 /nfs/dbraw/zinc/21/65/55/1004216555.db2.gz CNDWDCACMCMGND-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H]1CCCCN1Cc1ccccc1 ZINC001197420862 1004216561 /nfs/dbraw/zinc/21/65/61/1004216561.db2.gz CNDWDCACMCMGND-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H]1CCCCN1Cc1ccccc1 ZINC001197420862 1004216568 /nfs/dbraw/zinc/21/65/68/1004216568.db2.gz CNDWDCACMCMGND-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO COc1cc(C[N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)sn1 ZINC001198122757 1004504344 /nfs/dbraw/zinc/50/43/44/1004504344.db2.gz WLIDHTGTYRRKTF-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)sn1 ZINC001198122757 1004504349 /nfs/dbraw/zinc/50/43/49/1004504349.db2.gz WLIDHTGTYRRKTF-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO Cc1cn(C[N@@H+]2CCC[C@H](C3CC3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000808229699 1004780694 /nfs/dbraw/zinc/78/06/94/1004780694.db2.gz BYHKMIGUXYRUDW-INIZCTEOSA-N 1 1 356.426 2.935 20 5 FFBDMO Cc1cn(C[N@H+]2CCC[C@H](C3CC3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000808229699 1004780699 /nfs/dbraw/zinc/78/06/99/1004780699.db2.gz BYHKMIGUXYRUDW-INIZCTEOSA-N 1 1 356.426 2.935 20 5 FFBDMO Cn1cc(C[NH2+][C@H](c2ccccc2)[C@@H](O)c2ccccc2)c([N+](=O)[O-])n1 ZINC001194816733 1004822821 /nfs/dbraw/zinc/82/28/21/1004822821.db2.gz FZZJQKGWICQBME-MSOLQXFVSA-N 1 1 352.394 2.893 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)[N@@H+](C)Cc1ccccc1 ZINC000110349881 1005931453 /nfs/dbraw/zinc/93/14/53/1005931453.db2.gz XMENIEYBWBIZQU-OAHLLOKOSA-N 1 1 370.453 2.911 20 5 FFBDMO CN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000776592655 1006010080 /nfs/dbraw/zinc/01/00/80/1006010080.db2.gz WWXJIJYCXOXDBF-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000776592655 1006010086 /nfs/dbraw/zinc/01/00/86/1006010086.db2.gz WWXJIJYCXOXDBF-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000776592655 1006010093 /nfs/dbraw/zinc/01/00/93/1006010093.db2.gz WWXJIJYCXOXDBF-WOJBJXKFSA-N 1 1 355.438 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000776595895 1006038346 /nfs/dbraw/zinc/03/83/46/1006038346.db2.gz CEBRWAIZVCYMSC-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595895 1006038360 /nfs/dbraw/zinc/03/83/60/1006038360.db2.gz CEBRWAIZVCYMSC-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595895 1006038375 /nfs/dbraw/zinc/03/83/75/1006038375.db2.gz CEBRWAIZVCYMSC-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)c1 ZINC000852520682 1006063318 /nfs/dbraw/zinc/06/33/18/1006063318.db2.gz NCESZVJEKVNIKV-DFQSSKMNSA-N 1 1 356.422 2.726 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1 ZINC001050517393 1017035518 /nfs/dbraw/zinc/03/55/18/1017035518.db2.gz RPUHGKPJXGOSPB-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1 ZINC000853492942 1006410520 /nfs/dbraw/zinc/41/05/20/1006410520.db2.gz FYBJTBNXYKKIGD-UHFFFAOYSA-N 1 1 358.446 2.617 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3cccnc3)C2)nc1-c1ccccn1 ZINC000853517715 1006425514 /nfs/dbraw/zinc/42/55/14/1006425514.db2.gz BXOLFCWMDAKYRZ-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3cccnc3)C2)nc1-c1ccccn1 ZINC000853517715 1006425517 /nfs/dbraw/zinc/42/55/17/1006425517.db2.gz BXOLFCWMDAKYRZ-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171107 1032169178 /nfs/dbraw/zinc/16/91/78/1032169178.db2.gz OLSJDBSXFDNCBQ-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001116171107 1032169183 /nfs/dbraw/zinc/16/91/83/1032169183.db2.gz OLSJDBSXFDNCBQ-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000112694922 1007000539 /nfs/dbraw/zinc/00/05/39/1007000539.db2.gz LPFKFMHDHNVNAE-AWEZNQCLSA-N 1 1 373.457 2.776 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000112694922 1007000555 /nfs/dbraw/zinc/00/05/55/1007000555.db2.gz LPFKFMHDHNVNAE-AWEZNQCLSA-N 1 1 373.457 2.776 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000855287129 1007246072 /nfs/dbraw/zinc/24/60/72/1007246072.db2.gz IZGXUPFMIGQTBM-AWEZNQCLSA-N 1 1 360.458 2.798 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001116250314 1032217694 /nfs/dbraw/zinc/21/76/94/1032217694.db2.gz IDPDXBFZUMGRJW-AWEZNQCLSA-N 1 1 352.822 2.628 20 5 FFBDMO O=[N+]([O-])c1ncccc1CN1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000885955765 1007850964 /nfs/dbraw/zinc/85/09/64/1007850964.db2.gz AAVMVDJDLBRAKL-UHFFFAOYSA-N 1 1 363.421 2.856 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000886433249 1008680042 /nfs/dbraw/zinc/68/00/42/1008680042.db2.gz DVOGGWJVKXCSMO-GOSISDBHSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000886433249 1008680048 /nfs/dbraw/zinc/68/00/48/1008680048.db2.gz DVOGGWJVKXCSMO-GOSISDBHSA-N 1 1 357.410 2.816 20 5 FFBDMO C[C@@]1(NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000823921527 1009282965 /nfs/dbraw/zinc/28/29/65/1009282965.db2.gz WQDGNGLQPKZSML-LJQANCHMSA-N 1 1 369.425 2.963 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000130600810 1009352299 /nfs/dbraw/zinc/35/22/99/1009352299.db2.gz QILUOPAPUCFFIS-RDJZCZTQSA-N 1 1 360.414 2.512 20 5 FFBDMO COc1cccc(OC)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001179937540 1009498354 /nfs/dbraw/zinc/49/83/54/1009498354.db2.gz MOZOCRHFMOAADY-CYBMUJFWSA-N 1 1 358.398 2.693 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)C[C@]2(C)C1 ZINC000887927828 1009683306 /nfs/dbraw/zinc/68/33/06/1009683306.db2.gz KWIMPKXLNYWHBO-QRQCRPRQSA-N 1 1 361.445 2.705 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889158582 1009843931 /nfs/dbraw/zinc/84/39/31/1009843931.db2.gz OTZNPRPDFSQIRI-MLGOLLRUSA-N 1 1 356.426 2.742 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863504691 1010231335 /nfs/dbraw/zinc/23/13/35/1010231335.db2.gz XKSFXMWPEZTFFY-KXBFYZLASA-N 1 1 374.441 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H](C[C@H]4CCOC4)C3)n2)cc1 ZINC000773267717 1011006009 /nfs/dbraw/zinc/00/60/09/1011006009.db2.gz VFCMKUPLRCLRQM-JKSUJKDBSA-N 1 1 371.441 2.949 20 5 FFBDMO CCCc1[nH]nc(C(=O)OCC[N@@H+](C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000796259497 1011548673 /nfs/dbraw/zinc/54/86/73/1011548673.db2.gz LJBJAJAUDDRVMT-UHFFFAOYSA-N 1 1 364.377 2.698 20 5 FFBDMO CCC(=O)c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1 ZINC000795074019 1011756061 /nfs/dbraw/zinc/75/60/61/1011756061.db2.gz IBJCHQMHPXEJBC-INIZCTEOSA-N 1 1 361.442 2.879 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909139 1012074998 /nfs/dbraw/zinc/07/49/98/1012074998.db2.gz GMOSGWVORWQREV-YJBOKZPZSA-N 1 1 370.453 2.817 20 5 FFBDMO CSc1cccc(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)c1[N+](=O)[O-] ZINC000870088132 1012119241 /nfs/dbraw/zinc/11/92/41/1012119241.db2.gz ZIDCPNNSPQOLRR-OAHLLOKOSA-N 1 1 373.434 2.809 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@]1(C)O ZINC001173009261 1012176001 /nfs/dbraw/zinc/17/60/01/1012176001.db2.gz ANYPJDBSCVRIHW-SGTLLEGYSA-N 1 1 369.412 2.935 20 5 FFBDMO CC[C@H]1COCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015448 1012187120 /nfs/dbraw/zinc/18/71/20/1012187120.db2.gz QPBDWYCMPCSICQ-LBPRGKRZSA-N 1 1 355.385 2.953 20 5 FFBDMO CC(=O)[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018827 1012188687 /nfs/dbraw/zinc/18/86/87/1012188687.db2.gz FVKDKGXHBOEIAH-LBPRGKRZSA-N 1 1 353.369 2.753 20 5 FFBDMO CCOC(=O)C1CC[NH+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173182846 1012325691 /nfs/dbraw/zinc/32/56/91/1012325691.db2.gz UVHUDEIZXFEAKJ-GFCCVEGCSA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173198015 1012342129 /nfs/dbraw/zinc/34/21/29/1012342129.db2.gz XLHNYBCZBGNHFY-CHWSQXEVSA-N 1 1 368.405 2.949 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001173224444 1012358824 /nfs/dbraw/zinc/35/88/24/1012358824.db2.gz FWOVRMCFNQYBJR-UTKZUKDTSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001173224444 1012358836 /nfs/dbraw/zinc/35/88/36/1012358836.db2.gz FWOVRMCFNQYBJR-UTKZUKDTSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001173224444 1012358855 /nfs/dbraw/zinc/35/88/55/1012358855.db2.gz FWOVRMCFNQYBJR-UTKZUKDTSA-N 1 1 369.465 2.705 20 5 FFBDMO COc1ccnc(O[C@H]2CCC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237405 1012381815 /nfs/dbraw/zinc/38/18/15/1012381815.db2.gz JCIWXWOGPJNBGO-YOEHRIQHSA-N 1 1 372.425 2.868 20 5 FFBDMO C[N@@H+](CC(C)(C)C)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173699016 1012902061 /nfs/dbraw/zinc/90/20/61/1012902061.db2.gz YHOHSYNKFGMMLK-UHFFFAOYSA-N 1 1 369.487 2.726 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000802008042 1019615724 /nfs/dbraw/zinc/61/57/24/1019615724.db2.gz VMXPBXKDRDYSFI-KTWXZFIHSA-N 1 1 356.426 2.772 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCC1OCCCO1)[C@H]1CC[C@H](O)CC1 ZINC000828806852 1032848533 /nfs/dbraw/zinc/84/85/33/1032848533.db2.gz DWICLCOFUAQSHG-QAQDUYKDSA-N 1 1 364.442 2.853 20 5 FFBDMO O=C1C[C@H]([C@@H]2CCCO2)CN1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291665 1020057917 /nfs/dbraw/zinc/05/79/17/1020057917.db2.gz XQTZAFBRWRSUJT-LNLFQRSKSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1C[C@H]([C@@H]2CCCO2)CN1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291665 1020057930 /nfs/dbraw/zinc/05/79/30/1020057930.db2.gz XQTZAFBRWRSUJT-LNLFQRSKSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]CC2CC3(CCC3)C2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048607845 1020352112 /nfs/dbraw/zinc/35/21/12/1020352112.db2.gz NSJDMAIYBSRDTP-JOCBIADPSA-N 1 1 363.502 2.744 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](Cc3nccs3)C2)nc1-c1ccncc1 ZINC000902650243 1020375028 /nfs/dbraw/zinc/37/50/28/1020375028.db2.gz YOQQOMFDEDYICS-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](Cc3nccs3)C2)nc1-c1ccncc1 ZINC000902650243 1020375041 /nfs/dbraw/zinc/37/50/41/1020375041.db2.gz YOQQOMFDEDYICS-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)c1 ZINC000931795688 1020590789 /nfs/dbraw/zinc/59/07/89/1020590789.db2.gz IAXGMIUNLUDZFS-ICSRJNTNSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)c1 ZINC000931795688 1020590791 /nfs/dbraw/zinc/59/07/91/1020590791.db2.gz IAXGMIUNLUDZFS-ICSRJNTNSA-N 1 1 364.405 2.999 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932136892 1020717954 /nfs/dbraw/zinc/71/79/54/1020717954.db2.gz LOACDOBSFOVLLT-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932136892 1020717961 /nfs/dbraw/zinc/71/79/61/1020717961.db2.gz LOACDOBSFOVLLT-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO O=C1N[C@@H](C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)CO1 ZINC000932769588 1020896158 /nfs/dbraw/zinc/89/61/58/1020896158.db2.gz FTNNZXODVSLOHU-CQSZACIVSA-N 1 1 373.331 2.934 20 5 FFBDMO Cc1csc(C[C@@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933134141 1020960913 /nfs/dbraw/zinc/96/09/13/1020960913.db2.gz LCDLSNDGWAHYPJ-AWEZNQCLSA-N 1 1 374.466 2.887 20 5 FFBDMO Cc1csc(C[C@@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933134141 1020960919 /nfs/dbraw/zinc/96/09/19/1020960919.db2.gz LCDLSNDGWAHYPJ-AWEZNQCLSA-N 1 1 374.466 2.887 20 5 FFBDMO CCN1C[C@H](C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000749663470 1021017643 /nfs/dbraw/zinc/01/76/43/1021017643.db2.gz FUEGTQJNDFHKSF-HKUYNNGSSA-N 1 1 371.437 2.848 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[nH+]1 ZINC001116319434 1021166124 /nfs/dbraw/zinc/16/61/24/1021166124.db2.gz NNPFTKSKBKXPQR-ZDUSSCGKSA-N 1 1 372.429 2.861 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[nH+]1 ZINC001116319434 1021166132 /nfs/dbraw/zinc/16/61/32/1021166132.db2.gz NNPFTKSKBKXPQR-ZDUSSCGKSA-N 1 1 372.429 2.861 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)nc1 ZINC000934344944 1021204417 /nfs/dbraw/zinc/20/44/17/1021204417.db2.gz IFFOIBUUSGZDKV-DNVCBOLYSA-N 1 1 373.409 2.575 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934840510 1021424350 /nfs/dbraw/zinc/42/43/50/1021424350.db2.gz FXJOBENBFZHDIU-IAGOWNOFSA-N 1 1 373.453 2.623 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934841629 1021426096 /nfs/dbraw/zinc/42/60/96/1021426096.db2.gz NBCALIFUCPDXJQ-SJORKVTESA-N 1 1 373.453 2.623 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778942694 1022556034 /nfs/dbraw/zinc/55/60/34/1022556034.db2.gz PPHBSGMHLJCXJR-CQSZACIVSA-N 1 1 365.430 2.950 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCC1CCCCC1)CC2 ZINC001040700312 1022954327 /nfs/dbraw/zinc/95/43/27/1022954327.db2.gz LXNHEFPKGQZOSY-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO C/C(=C\C(=O)N1CC[NH+](CCOC(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000752500255 1023152378 /nfs/dbraw/zinc/15/23/78/1023152378.db2.gz CHKNTRHCCLCGIM-JQIJEIRASA-N 1 1 361.442 2.567 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@]2(O)CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000829338016 1033110046 /nfs/dbraw/zinc/11/00/46/1033110046.db2.gz PHCQVXDYKUCFDB-HXUWFJFHSA-N 1 1 372.421 2.748 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@@H](c3ccco3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752791415 1023205951 /nfs/dbraw/zinc/20/59/51/1023205951.db2.gz FGIZDBMUVSZOHV-CQSZACIVSA-N 1 1 356.382 2.877 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@@H](c3ccco3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752791415 1023205957 /nfs/dbraw/zinc/20/59/57/1023205957.db2.gz FGIZDBMUVSZOHV-CQSZACIVSA-N 1 1 356.382 2.877 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000754360889 1023459667 /nfs/dbraw/zinc/45/96/67/1023459667.db2.gz OMGZBCHTFGOQGY-VPHMPFFRSA-N 1 1 373.453 2.758 20 5 FFBDMO CCC[C@@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000757612863 1023838042 /nfs/dbraw/zinc/83/80/42/1023838042.db2.gz WHNPRYGZLMHZNF-CQSZACIVSA-N 1 1 360.414 2.833 20 5 FFBDMO Cc1c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000837186310 1025640560 /nfs/dbraw/zinc/64/05/60/1025640560.db2.gz PNEZJHGPDGODAA-CYBMUJFWSA-N 1 1 364.402 2.675 20 5 FFBDMO C[N@@H+](CCOC(=O)COc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1 ZINC000837478122 1025837141 /nfs/dbraw/zinc/83/71/41/1025837141.db2.gz UQMOJIPFZXWEJG-UHFFFAOYSA-N 1 1 362.357 2.788 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000246999945 1026608703 /nfs/dbraw/zinc/60/87/03/1026608703.db2.gz KQBAMIQRLUYGQL-QZTJIDSGSA-N 1 1 355.442 2.735 20 5 FFBDMO O=C1C[C@]2(CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644081 1026771671 /nfs/dbraw/zinc/77/16/71/1026771671.db2.gz NTSPQZITMYPWFF-ICSRJNTNSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@]2(CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644081 1026771677 /nfs/dbraw/zinc/77/16/77/1026771677.db2.gz NTSPQZITMYPWFF-ICSRJNTNSA-N 1 1 368.389 2.738 20 5 FFBDMO CO[C@@H]1C[C@H]([N@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138870 1026978596 /nfs/dbraw/zinc/97/85/96/1026978596.db2.gz GNYRPFKENNJWFM-DLBZAZTESA-N 1 1 374.441 2.684 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138870 1026978603 /nfs/dbraw/zinc/97/86/03/1026978603.db2.gz GNYRPFKENNJWFM-DLBZAZTESA-N 1 1 374.441 2.684 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000840141754 1026981322 /nfs/dbraw/zinc/98/13/22/1026981322.db2.gz RXESDQZACNVNBU-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO COc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001158523687 1027052474 /nfs/dbraw/zinc/05/24/74/1027052474.db2.gz OEJRAQUOLMZUNB-ZIAGYGMSSA-N 1 1 371.441 2.801 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001141947483 1027201240 /nfs/dbraw/zinc/20/12/40/1027201240.db2.gz YYRBNFUPNLWOIF-LBPRGKRZSA-N 1 1 367.409 2.901 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC2CCC3(CC3)CC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160107765 1027595961 /nfs/dbraw/zinc/59/59/61/1027595961.db2.gz SMHDKFKUWKYAHV-QZTJIDSGSA-N 1 1 361.486 2.760 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CC2CCC3(CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107765 1027595975 /nfs/dbraw/zinc/59/59/75/1027595975.db2.gz SMHDKFKUWKYAHV-QZTJIDSGSA-N 1 1 361.486 2.760 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC2CCC3(CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107765 1027595983 /nfs/dbraw/zinc/59/59/83/1027595983.db2.gz SMHDKFKUWKYAHV-QZTJIDSGSA-N 1 1 361.486 2.760 20 5 FFBDMO COc1cc(C)nc(NC2CC[NH+](CC(=O)C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC001161119808 1028020964 /nfs/dbraw/zinc/02/09/64/1028020964.db2.gz IHXJVYYGHFBZRN-UHFFFAOYSA-N 1 1 364.446 2.798 20 5 FFBDMO CCC(CC)C[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162811060 1028664315 /nfs/dbraw/zinc/66/43/15/1028664315.db2.gz YZCLODDEMUUSKU-RTBURBONSA-N 1 1 361.486 2.749 20 5 FFBDMO CO[C@@H](C[NH+]1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1)c1ccccc1 ZINC001155705644 1028861679 /nfs/dbraw/zinc/86/16/79/1028861679.db2.gz JKWRONOEZUVNIY-KRWDZBQOSA-N 1 1 360.389 2.639 20 5 FFBDMO Cc1c[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)cc1[N+](=O)[O-] ZINC001164485322 1029294103 /nfs/dbraw/zinc/29/41/03/1029294103.db2.gz IJLQOCDLZVBTQD-FGTMMUONSA-N 1 1 368.437 2.859 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1F ZINC001164486909 1029295172 /nfs/dbraw/zinc/29/51/72/1029295172.db2.gz SLRVCGFQLLCNQW-BZUAXINKSA-N 1 1 372.400 2.690 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1ccc([N+](=O)[O-])c(N)n1 ZINC001165180455 1029435626 /nfs/dbraw/zinc/43/56/26/1029435626.db2.gz AXOVQHZQXBIURK-RHSMWYFYSA-N 1 1 355.442 2.919 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782526166 1029732685 /nfs/dbraw/zinc/73/26/85/1029732685.db2.gz HQSNWAAABQPTGK-KBPBESRZSA-N 1 1 365.405 2.811 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1C1CCOCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782532232 1029733992 /nfs/dbraw/zinc/73/39/92/1029733992.db2.gz ZTGYDJMNIWGFQS-QGZVFWFLSA-N 1 1 365.405 2.954 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ccc3ccc([N+](=O)[O-])cc3n1)CC2 ZINC001166031937 1030213364 /nfs/dbraw/zinc/21/33/64/1030213364.db2.gz IBIDCCZEUYMTFY-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO Cc1nc([C@@H]2CCCCN2c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)no1 ZINC001166717507 1030493091 /nfs/dbraw/zinc/49/30/91/1030493091.db2.gz PWVGLXDBTFZNQG-KGXGESDWSA-N 1 1 358.402 2.945 20 5 FFBDMO CCOC(=O)C1(C)CCN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CC1 ZINC001166794254 1030520459 /nfs/dbraw/zinc/52/04/59/1030520459.db2.gz SUNGYBPCNGAYCP-RMKNXTFCSA-N 1 1 362.430 2.692 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCN(c2ncccc2F)CC1 ZINC000784410438 1030608509 /nfs/dbraw/zinc/60/85/09/1030608509.db2.gz VHVGEVSQHBHKOR-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN(c2ncccc2F)CC1 ZINC000784410438 1030608517 /nfs/dbraw/zinc/60/85/17/1030608517.db2.gz VHVGEVSQHBHKOR-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]3[C@@H]3CCCOC3)n2)c1 ZINC000842616425 1030827164 /nfs/dbraw/zinc/82/71/64/1030827164.db2.gz ORMKIKGISRKJBW-NVXWUHKLSA-N 1 1 357.414 2.702 20 5 FFBDMO C[N@H+](CCC(C)(C)C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000842632238 1030856335 /nfs/dbraw/zinc/85/63/35/1030856335.db2.gz WFDJPFGEVDHCKA-GOSISDBHSA-N 1 1 362.430 2.687 20 5 FFBDMO C[N@@H+](CCC(C)(C)C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000842632238 1030856354 /nfs/dbraw/zinc/85/63/54/1030856354.db2.gz WFDJPFGEVDHCKA-GOSISDBHSA-N 1 1 362.430 2.687 20 5 FFBDMO COc1cc(C(=O)OC[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000842836191 1030987339 /nfs/dbraw/zinc/98/73/39/1030987339.db2.gz NFGOWKAIDCSGOQ-CYBMUJFWSA-N 1 1 366.414 2.889 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000797517129 1031142081 /nfs/dbraw/zinc/14/20/81/1031142081.db2.gz CADGKMLXMWVDOJ-ZDUSSCGKSA-N 1 1 365.430 2.950 20 5 FFBDMO CC[NH2+]Cc1noc(-c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 ZINC000843143826 1031209954 /nfs/dbraw/zinc/20/99/54/1031209954.db2.gz ZJALGQPXIIQBDD-UHFFFAOYSA-N 1 1 356.386 2.616 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C1(C(N)=O)CC1 ZINC001143166867 1031277745 /nfs/dbraw/zinc/27/77/45/1031277745.db2.gz KLUXIZPLFIWUIR-UHFFFAOYSA-N 1 1 362.433 2.966 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]21 ZINC001149656457 1031562290 /nfs/dbraw/zinc/56/22/90/1031562290.db2.gz WCOJVGJCEXQGHH-DZGCQCFKSA-N 1 1 351.834 2.733 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](c4ccccn4)C3)n2)c1 ZINC000799159312 1031674119 /nfs/dbraw/zinc/67/41/19/1031674119.db2.gz YESKYXISGXTQAY-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO Cc1ccccc1[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC001150361824 1031704445 /nfs/dbraw/zinc/70/44/45/1031704445.db2.gz XWJJQBGJPBSRDZ-GOSISDBHSA-N 1 1 368.437 2.878 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(Cl)cc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530722 1031787143 /nfs/dbraw/zinc/78/71/43/1031787143.db2.gz NLUBYZYPZJJSLD-HZPDHXFCSA-N 1 1 365.861 2.914 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC001151375427 1031938443 /nfs/dbraw/zinc/93/84/43/1031938443.db2.gz FLDLBGWQILJRLY-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC001151375427 1031938452 /nfs/dbraw/zinc/93/84/52/1031938452.db2.gz FLDLBGWQILJRLY-CYBMUJFWSA-N 1 1 369.849 2.821 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]C/C=C\c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001276977531 1033916893 /nfs/dbraw/zinc/91/68/93/1033916893.db2.gz UVBWPCGMNOQYQD-PYNSWYFLSA-N 1 1 363.845 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](OC[C@H]1C[N@H+](Cc3ccccc3)CCO1)C2 ZINC001224955244 1034069826 /nfs/dbraw/zinc/06/98/26/1034069826.db2.gz FCNBIQMFSKQQMG-NHCUHLMSSA-N 1 1 368.433 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](OC[C@H]1C[N@@H+](Cc3ccccc3)CCO1)C2 ZINC001224955244 1034069837 /nfs/dbraw/zinc/06/98/37/1034069837.db2.gz FCNBIQMFSKQQMG-NHCUHLMSSA-N 1 1 368.433 2.980 20 5 FFBDMO C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111681 1034938971 /nfs/dbraw/zinc/93/89/71/1034938971.db2.gz QBZKMIPYZORFNM-DGCLKSJQSA-N 1 1 359.342 2.507 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111681 1034938979 /nfs/dbraw/zinc/93/89/79/1034938979.db2.gz QBZKMIPYZORFNM-DGCLKSJQSA-N 1 1 359.342 2.507 20 5 FFBDMO Cc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c([N+](=O)[O-])cc1Br ZINC001228001124 1035862149 /nfs/dbraw/zinc/86/21/49/1035862149.db2.gz MVDGZMVCMGUZKU-UAKXVISKSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])cc1Br ZINC001228001124 1035862166 /nfs/dbraw/zinc/86/21/66/1035862166.db2.gz MVDGZMVCMGUZKU-UAKXVISKSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1[nH]c(=O)cc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC001228688082 1036257787 /nfs/dbraw/zinc/25/77/87/1036257787.db2.gz DLXOBDSWZCJJJA-INIZCTEOSA-N 1 1 373.409 2.674 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229151939 1036524968 /nfs/dbraw/zinc/52/49/68/1036524968.db2.gz ITEYAKCHWABAGR-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229375859 1036638344 /nfs/dbraw/zinc/63/83/44/1036638344.db2.gz OOFZGKKGKNISQG-IUODEOHRSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375859 1036638351 /nfs/dbraw/zinc/63/83/51/1036638351.db2.gz OOFZGKKGKNISQG-IUODEOHRSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375859 1036638358 /nfs/dbraw/zinc/63/83/58/1036638358.db2.gz OOFZGKKGKNISQG-IUODEOHRSA-N 1 1 358.398 2.688 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1cc[n+]([O-])cc1[N+](=O)[O-] ZINC001229452999 1036684590 /nfs/dbraw/zinc/68/45/90/1036684590.db2.gz ZHYYLWRETIERTP-GOSISDBHSA-N 1 1 357.410 2.908 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ccnc([N+](=O)[O-])c3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001233859285 1036793467 /nfs/dbraw/zinc/79/34/67/1036793467.db2.gz LFYQZLWMKNQBKP-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC001536675923 1070034009 /nfs/dbraw/zinc/03/40/09/1070034009.db2.gz MMOSIVGRVNGIJV-INIZCTEOSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@H+]1CCc2c(cccc2O[C@H]2CCN(c3ccc([N+](=O)[O-])cn3)C2)C1 ZINC001234423525 1037030620 /nfs/dbraw/zinc/03/06/20/1037030620.db2.gz LVTWXUIWCDMISF-INIZCTEOSA-N 1 1 354.410 2.635 20 5 FFBDMO Cc1c(Br)c(OC2CC[NH+](CCF)CC2)ncc1[N+](=O)[O-] ZINC001231095930 1037467492 /nfs/dbraw/zinc/46/74/92/1037467492.db2.gz UGHVPTUYZNUWQX-UHFFFAOYSA-N 1 1 362.199 2.873 20 5 FFBDMO CCCC(=O)Nc1c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)cccc1[N+](=O)[O-] ZINC001231360198 1037548089 /nfs/dbraw/zinc/54/80/89/1037548089.db2.gz YKKZREYZJKWUAA-PEYYIBSZSA-N 1 1 361.398 2.516 20 5 FFBDMO CCCC(=O)Nc1c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)cccc1[N+](=O)[O-] ZINC001231360198 1037548098 /nfs/dbraw/zinc/54/80/98/1037548098.db2.gz YKKZREYZJKWUAA-PEYYIBSZSA-N 1 1 361.398 2.516 20 5 FFBDMO COc1cc(N2CCC([N@H+]3Cc4cccnc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256095040 1038378670 /nfs/dbraw/zinc/37/86/70/1038378670.db2.gz WFVIDZZEZFDEPJ-UHFFFAOYSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](O)[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093262 1038379079 /nfs/dbraw/zinc/37/90/79/1038379079.db2.gz JAFGXVLEWZGMHG-KDOFPFPSSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCN(C)C(C)(C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100261 1038383768 /nfs/dbraw/zinc/38/37/68/1038383768.db2.gz CFAJUXNUNLEGBD-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001276649943 1038989452 /nfs/dbraw/zinc/98/94/52/1038989452.db2.gz CGLKKXWCPWACLL-MJGOQNOKSA-N 1 1 351.406 2.941 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc(/C=C/c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC001258012720 1039113366 /nfs/dbraw/zinc/11/33/66/1039113366.db2.gz RRNZNROOFLFESM-JLVOYYQZSA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1c(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc(F)cc1[N+](=O)[O-] ZINC001258147240 1039229767 /nfs/dbraw/zinc/22/97/67/1039229767.db2.gz XIAAHJCBYSQLAI-PHIMTYICSA-N 1 1 364.377 2.744 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@H]3CC[C@@H](C)CN3)CC2)ccc1[N+](=O)[O-] ZINC001246111247 1039246745 /nfs/dbraw/zinc/24/67/45/1039246745.db2.gz IPBGZKHFIYZNTA-GDBMZVCRSA-N 1 1 362.474 2.550 20 5 FFBDMO COc1cc(N2CCC(NC[C@H]3CC[C@@H](C)C[NH2+]3)CC2)ccc1[N+](=O)[O-] ZINC001246111247 1039246755 /nfs/dbraw/zinc/24/67/55/1039246755.db2.gz IPBGZKHFIYZNTA-GDBMZVCRSA-N 1 1 362.474 2.550 20 5 FFBDMO COCCC[N@H+]([C@@H]1CCCNC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807337 1039487177 /nfs/dbraw/zinc/48/71/77/1039487177.db2.gz JISSIVKFZKXFHD-AZUAARDMSA-N 1 1 361.486 2.933 20 5 FFBDMO COCCC[N@@H+]([C@@H]1CCCNC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807337 1039487180 /nfs/dbraw/zinc/48/71/80/1039487180.db2.gz JISSIVKFZKXFHD-AZUAARDMSA-N 1 1 361.486 2.933 20 5 FFBDMO Cn1cc2cccc(-c3noc([C@@H]([NH3+])Cc4ccccc4[N+](=O)[O-])n3)c2n1 ZINC001247666909 1039873792 /nfs/dbraw/zinc/87/37/92/1039873792.db2.gz QAFJCMOSJUZWHQ-AWEZNQCLSA-N 1 1 364.365 2.774 20 5 FFBDMO Cc1ccc(CNC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC001253394184 1040149112 /nfs/dbraw/zinc/14/91/12/1040149112.db2.gz AYAAIWSHNHMXQA-GOSISDBHSA-N 1 1 368.437 2.977 20 5 FFBDMO CCn1ncc2c1[C@H](COC)C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254562214 1040799183 /nfs/dbraw/zinc/79/91/83/1040799183.db2.gz PKEIBMREPOFLGQ-YOEHRIQHSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254562212 1040799976 /nfs/dbraw/zinc/79/99/76/1040799976.db2.gz PKEIBMREPOFLGQ-RHSMWYFYSA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(Cc2cccc(N)c2)CC1 ZINC001254571313 1040808441 /nfs/dbraw/zinc/80/84/41/1040808441.db2.gz SFHUEGMJILYJMA-INIZCTEOSA-N 1 1 354.454 2.926 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]31)C2 ZINC001254596694 1040825480 /nfs/dbraw/zinc/82/54/80/1040825480.db2.gz QLGAYJBXFHKPLC-VNTMZGSJSA-N 1 1 358.438 2.720 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]31)C2 ZINC001254596694 1040825492 /nfs/dbraw/zinc/82/54/92/1040825492.db2.gz QLGAYJBXFHKPLC-VNTMZGSJSA-N 1 1 358.438 2.720 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cn(CC)nc21 ZINC001254597143 1040826809 /nfs/dbraw/zinc/82/68/09/1040826809.db2.gz UTUUDVGPXOABHV-MJGOQNOKSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596892 1040827334 /nfs/dbraw/zinc/82/73/34/1040827334.db2.gz QRRCHSZXAQXTGV-WMZOPIPTSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596892 1040827345 /nfs/dbraw/zinc/82/73/45/1040827345.db2.gz QRRCHSZXAQXTGV-WMZOPIPTSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598341 1040828303 /nfs/dbraw/zinc/82/83/03/1040828303.db2.gz WLDKFGGMFXDYAH-FUHWJXTLSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598341 1040828324 /nfs/dbraw/zinc/82/83/24/1040828324.db2.gz WLDKFGGMFXDYAH-FUHWJXTLSA-N 1 1 370.453 2.914 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21 ZINC001254610640 1040838454 /nfs/dbraw/zinc/83/84/54/1040838454.db2.gz LWUUXAVMBHRENC-XIRDDKMYSA-N 1 1 359.426 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCn3ncc(Br)c3C1)C2 ZINC001254610172 1040839510 /nfs/dbraw/zinc/83/95/10/1040839510.db2.gz HRMMRGGFRJNGHT-CYBMUJFWSA-N 1 1 363.215 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCn3ncc(Br)c3C1)C2 ZINC001254610172 1040839525 /nfs/dbraw/zinc/83/95/25/1040839525.db2.gz HRMMRGGFRJNGHT-CYBMUJFWSA-N 1 1 363.215 2.537 20 5 FFBDMO Cc1nc(Nc2cc([N+](=O)[O-])cnc2C)cc(N2C[C@@H](C)O[C@H](C)C2)[nH+]1 ZINC001249546956 1040860247 /nfs/dbraw/zinc/86/02/47/1040860247.db2.gz SVTGJNWEBUHBAO-GHMZBOCLSA-N 1 1 358.402 2.754 20 5 FFBDMO C[N@H+]1C[C@@]23CN(c4cc5nc[nH]c(=O)c5cc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001262716415 1041811948 /nfs/dbraw/zinc/81/19/48/1041811948.db2.gz FABFEEQAWUBSSN-KDURUIRLSA-N 1 1 369.425 2.556 20 5 FFBDMO c1nn(CC[NH+]2CCOCC2)cc1-c1ncnc2cc3ccccc3cc21 ZINC001240541520 1044379314 /nfs/dbraw/zinc/37/93/14/1044379314.db2.gz ULRCJIYDNNFEGE-UHFFFAOYSA-N 1 1 359.433 2.979 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001316614298 1045147870 /nfs/dbraw/zinc/14/78/70/1045147870.db2.gz BVWUNZAQAPPHEA-IEXMBPEJSA-N 1 1 363.845 2.503 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001319574566 1045200643 /nfs/dbraw/zinc/20/06/43/1045200643.db2.gz ZUYHLWHXKXHYIN-MSOLQXFVSA-N 1 1 372.400 2.979 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2ncnc3cccc([N+](=O)[O-])c32)C1 ZINC001320383534 1045400429 /nfs/dbraw/zinc/40/04/29/1045400429.db2.gz XYVMQCXBJKRYQK-ZDUSSCGKSA-N 1 1 352.398 2.731 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001323222533 1045511130 /nfs/dbraw/zinc/51/11/30/1045511130.db2.gz XYGUAJKYECGEFR-QGZVFWFLSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[N@@H+]1CCc2ccccc2C1 ZINC001323221322 1045511230 /nfs/dbraw/zinc/51/12/30/1045511230.db2.gz LJRPDDXKFQCQQM-CQSZACIVSA-N 1 1 351.406 2.884 20 5 FFBDMO C[C@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCc2ccccc2C1 ZINC001323221322 1045511231 /nfs/dbraw/zinc/51/12/31/1045511231.db2.gz LJRPDDXKFQCQQM-CQSZACIVSA-N 1 1 351.406 2.884 20 5 FFBDMO O=C(NC1(C[NH2+]C/C=C\c2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282606941 1045954467 /nfs/dbraw/zinc/95/44/67/1045954467.db2.gz GWEXXPWSMHAPJS-HJPCAMOWSA-N 1 1 357.454 2.774 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001324649504 1046145556 /nfs/dbraw/zinc/14/55/56/1046145556.db2.gz DHTROHVSGVVUHR-LLVKDONJSA-N 1 1 371.235 2.963 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC001322606365 1046148329 /nfs/dbraw/zinc/14/83/29/1046148329.db2.gz GPTZVOFXPHKWTD-UHFFFAOYSA-N 1 1 360.414 2.824 20 5 FFBDMO Cc1ccnc(NCc2cccc(C[NH+]3CCN(C)CC3)c2)c1[N+](=O)[O-] ZINC001322902911 1046266987 /nfs/dbraw/zinc/26/69/87/1046266987.db2.gz JIXZBTGYOITFHH-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO CS[C@H]1CC[C@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219762 1046422615 /nfs/dbraw/zinc/42/26/15/1046422615.db2.gz BNMPVRMWWBQKLC-KBPBESRZSA-N 1 1 358.485 2.584 20 5 FFBDMO CS[C@H]1CC[C@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219762 1046422619 /nfs/dbraw/zinc/42/26/19/1046422619.db2.gz BNMPVRMWWBQKLC-KBPBESRZSA-N 1 1 358.485 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](CC4CCC(O)CC4)CC3)nc2c1 ZINC001329893714 1048955445 /nfs/dbraw/zinc/95/54/45/1048955445.db2.gz CFFHLNMDILYTDB-UHFFFAOYSA-N 1 1 373.457 2.534 20 5 FFBDMO C[C@H](NC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC001340030031 1050440937 /nfs/dbraw/zinc/44/09/37/1050440937.db2.gz PSDXFMCOEZWWJA-KBXCAEBGSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@H](NC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC001340030031 1050440942 /nfs/dbraw/zinc/44/09/42/1050440942.db2.gz PSDXFMCOEZWWJA-KBXCAEBGSA-N 1 1 354.410 2.832 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC2CC2)CC1 ZINC001345163784 1052298566 /nfs/dbraw/zinc/29/85/66/1052298566.db2.gz ZXTUSXILKJOAKN-AWEZNQCLSA-N 1 1 364.494 2.582 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC001307999853 1052380268 /nfs/dbraw/zinc/38/02/68/1052380268.db2.gz PUBUJVSXQBPCQX-INIZCTEOSA-N 1 1 366.320 2.914 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308123579 1052412843 /nfs/dbraw/zinc/41/28/43/1052412843.db2.gz BJBAAKUPIRSGMJ-GFCCVEGCSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308123579 1052412847 /nfs/dbraw/zinc/41/28/47/1052412847.db2.gz BJBAAKUPIRSGMJ-GFCCVEGCSA-N 1 1 354.407 2.628 20 5 FFBDMO CCc1ccc2c(c1)C[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC001308173658 1052426388 /nfs/dbraw/zinc/42/63/88/1052426388.db2.gz DCNVKZBIEXOXRV-GOSISDBHSA-N 1 1 356.422 2.955 20 5 FFBDMO CCC[C@@H](C)C(=O)NCC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001308414187 1052454638 /nfs/dbraw/zinc/45/46/38/1052454638.db2.gz ZPABRRHINRBLGF-LLVKDONJSA-N 1 1 372.263 2.999 20 5 FFBDMO C[C@@H](Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001336570428 1054067346 /nfs/dbraw/zinc/06/73/46/1054067346.db2.gz TZBLCDHSJFGOKG-OLZOCXBDSA-N 1 1 374.441 2.991 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@H+](C)CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470091 1054717742 /nfs/dbraw/zinc/71/77/42/1054717742.db2.gz JIDMMAXCIMVRBC-LXZKKBNFSA-N 1 1 365.455 2.705 20 5 FFBDMO CS[C@@H]1CC[C@H]([N@@H+](C)CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470091 1054717756 /nfs/dbraw/zinc/71/77/56/1054717756.db2.gz JIDMMAXCIMVRBC-LXZKKBNFSA-N 1 1 365.455 2.705 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)[C@H](C)C1 ZINC001338153340 1055276106 /nfs/dbraw/zinc/27/61/06/1055276106.db2.gz LLWFCSMTEAHQMM-CZUORRHYSA-N 1 1 372.473 2.865 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)[C@@H]2C1 ZINC001338299000 1055400017 /nfs/dbraw/zinc/40/00/17/1055400017.db2.gz XVCCKHMVKCFHQA-XKQJLSEDSA-N 1 1 358.442 2.583 20 5 FFBDMO O=C1O[C@@H](C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1c1ccccc1 ZINC001338751485 1055784391 /nfs/dbraw/zinc/78/43/91/1055784391.db2.gz ZMELOHIQNBEYJQ-SFHVURJKSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C1O[C@@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1c1ccccc1 ZINC001338751485 1055784394 /nfs/dbraw/zinc/78/43/94/1055784394.db2.gz ZMELOHIQNBEYJQ-SFHVURJKSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001357257035 1055845174 /nfs/dbraw/zinc/84/51/74/1055845174.db2.gz DQCFYHLLLJOGNH-UHFFFAOYSA-N 1 1 363.377 2.980 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+](C)C2)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001339688779 1056709862 /nfs/dbraw/zinc/70/98/62/1056709862.db2.gz MYFGGVHNFWWLAM-HNNXBMFYSA-N 1 1 370.457 2.578 20 5 FFBDMO C[C@@H](NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1 ZINC001447566239 1058670410 /nfs/dbraw/zinc/67/04/10/1058670410.db2.gz YGSQUJVTYLQHKN-GFCCVEGCSA-N 1 1 354.410 2.710 20 5 FFBDMO COc1ccc(NC(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC001520130046 1059417151 /nfs/dbraw/zinc/41/71/51/1059417151.db2.gz ZLRIAEGRGKNDQY-UHFFFAOYSA-N 1 1 371.397 2.661 20 5 FFBDMO C[N@@H+](CCc1nccc(C(F)(F)F)n1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001355083148 1059871312 /nfs/dbraw/zinc/87/13/12/1059871312.db2.gz DCIAMDXCJGFKCB-CYBMUJFWSA-N 1 1 370.331 2.612 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]2C1 ZINC001355171866 1059956768 /nfs/dbraw/zinc/95/67/68/1059956768.db2.gz PQAVPINKEJSZLQ-XDTLVQLUSA-N 1 1 357.332 2.684 20 5 FFBDMO CC(C)CO[C@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482647 1060120916 /nfs/dbraw/zinc/12/09/16/1060120916.db2.gz SHTJDKNVAGDHPO-ROUUACIJSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)CO[C@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482647 1060120924 /nfs/dbraw/zinc/12/09/24/1060120924.db2.gz SHTJDKNVAGDHPO-ROUUACIJSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000848485261 1060126905 /nfs/dbraw/zinc/12/69/05/1060126905.db2.gz XFTNUYWYGQKLCP-OALUTQOASA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000848485261 1060126916 /nfs/dbraw/zinc/12/69/16/1060126916.db2.gz XFTNUYWYGQKLCP-OALUTQOASA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000848490363 1060146739 /nfs/dbraw/zinc/14/67/39/1060146739.db2.gz ZZLOHHNZLUQQRG-NEWSRXKRSA-N 1 1 373.453 2.759 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC001459979937 1060864219 /nfs/dbraw/zinc/86/42/19/1060864219.db2.gz LGOGIQIVXGLPTB-UHFFFAOYSA-N 1 1 374.393 2.657 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ncccn2)CC1 ZINC001460804862 1061108278 /nfs/dbraw/zinc/10/82/78/1061108278.db2.gz DSDVGHAYIROOOK-CYBMUJFWSA-N 1 1 355.398 2.591 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)c(Cl)c1 ZINC001460889021 1061140158 /nfs/dbraw/zinc/14/01/58/1061140158.db2.gz JEFURAIJZBWXOY-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)c(Cl)c1 ZINC001460889021 1061140162 /nfs/dbraw/zinc/14/01/62/1061140162.db2.gz JEFURAIJZBWXOY-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO C[C@@H]1CC[C@](CO)([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccccc21 ZINC001460944263 1061159745 /nfs/dbraw/zinc/15/97/45/1061159745.db2.gz FSPUJIQUCPSIRO-ZUOKHONESA-N 1 1 369.421 2.568 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 ZINC001493370772 1063143700 /nfs/dbraw/zinc/14/37/00/1063143700.db2.gz OAHUMQYRWYFKED-UYAOXDASSA-N 1 1 367.449 2.894 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001493370772 1063143707 /nfs/dbraw/zinc/14/37/07/1063143707.db2.gz OAHUMQYRWYFKED-UYAOXDASSA-N 1 1 367.449 2.894 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001493370772 1063143720 /nfs/dbraw/zinc/14/37/20/1063143720.db2.gz OAHUMQYRWYFKED-UYAOXDASSA-N 1 1 367.449 2.894 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([N+](=O)[O-])cc(C)n1)[N@H+]1CCc2ccccc2C1 ZINC001441242275 1063414754 /nfs/dbraw/zinc/41/47/54/1063414754.db2.gz PWKDELZYQYSKFY-QGZVFWFLSA-N 1 1 368.437 2.865 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2cc(Cl)ccc2F)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001495157720 1063450953 /nfs/dbraw/zinc/45/09/53/1063450953.db2.gz CQJQYBDQDCIDQV-UKRRQHHQSA-N 1 1 369.824 2.663 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[NH2+]2)cc1 ZINC001467501684 1063762051 /nfs/dbraw/zinc/76/20/51/1063762051.db2.gz FKNKSVBWVMOGPA-SFHVURJKSA-N 1 1 354.410 2.526 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCCOC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC001471551861 1064712790 /nfs/dbraw/zinc/71/27/90/1064712790.db2.gz CKBZRCZNTLCVIY-UHFFFAOYSA-N 1 1 363.458 2.866 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCNc2cccc(C(F)(F)F)c2[N+](=O)[O-])C1 ZINC001472677748 1065125721 /nfs/dbraw/zinc/12/57/21/1065125721.db2.gz FXSPHZBMSAZNNX-NSHDSACASA-N 1 1 374.363 2.613 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(NC[C@@H]3CC[N@@H+](CC(C)C)C3)c2c1 ZINC001472730259 1065136265 /nfs/dbraw/zinc/13/62/65/1065136265.db2.gz KIDOIOHXWHPBFA-AWEZNQCLSA-N 1 1 358.442 2.963 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(NC[C@H]3CC[N@@H+](CC(C)C)C3)c2c1 ZINC001472730260 1065136315 /nfs/dbraw/zinc/13/63/15/1065136315.db2.gz KIDOIOHXWHPBFA-CQSZACIVSA-N 1 1 358.442 2.963 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC001473124955 1065204701 /nfs/dbraw/zinc/20/47/01/1065204701.db2.gz VHJUKFQNOPESFC-UHFFFAOYSA-N 1 1 365.430 2.753 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@@H](CCO)C2)o1 ZINC001473150024 1065209033 /nfs/dbraw/zinc/20/90/33/1065209033.db2.gz CLNQUXIAUAVOOZ-NSHDSACASA-N 1 1 366.805 2.893 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@@H](CCO)C2)o1 ZINC001473150024 1065209041 /nfs/dbraw/zinc/20/90/41/1065209041.db2.gz CLNQUXIAUAVOOZ-NSHDSACASA-N 1 1 366.805 2.893 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(c2ccccc2Cl)CC1 ZINC001473452752 1065266757 /nfs/dbraw/zinc/26/67/57/1065266757.db2.gz ZOVBLLBMSMKEEO-UHFFFAOYSA-N 1 1 363.849 2.965 20 5 FFBDMO C[C@]([NH3+])(C(=O)Nc1n[nH]c2c1cccc2Cl)c1cccc([N+](=O)[O-])c1 ZINC001576084833 1078193702 /nfs/dbraw/zinc/19/37/02/1078193702.db2.gz FWJBWDUDOQKUJW-MRXNPFEDSA-N 1 1 359.773 2.937 20 5 FFBDMO C[C@@]([NH3+])(C(=O)Nc1nc2c(cccc2Cl)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC001576084870 1078194100 /nfs/dbraw/zinc/19/41/00/1078194100.db2.gz GNGSPERCEVUYIB-INIZCTEOSA-N 1 1 359.773 2.937 20 5 FFBDMO Cc1ccc(OCCN(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC001579728482 1078670879 /nfs/dbraw/zinc/67/08/79/1078670879.db2.gz UVFGXVBPDILVPW-IBGZPJMESA-N 1 1 357.410 2.615 20 5 FFBDMO Nc1ccc(NC(=O)[C@@H]([NH3+])c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC001580448282 1078806669 /nfs/dbraw/zinc/80/66/69/1078806669.db2.gz ZUNMNAJLEZLJEQ-ZDUSSCGKSA-N 1 1 354.288 2.834 20 5 FFBDMO Nc1ccc(NC(=O)[C@H]([NH3+])c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC001580448281 1078806883 /nfs/dbraw/zinc/80/68/83/1078806883.db2.gz ZUNMNAJLEZLJEQ-CYBMUJFWSA-N 1 1 354.288 2.834 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC001580494247 1078815055 /nfs/dbraw/zinc/81/50/55/1078815055.db2.gz RJCCYGUCKANUHB-AHKGRUIUSA-N 1 1 355.369 2.920 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C(C)(C)C1 ZINC001558527868 1076025430 /nfs/dbraw/zinc/02/54/30/1076025430.db2.gz SWOFYSQCOSGMQW-AWEZNQCLSA-N 1 1 364.402 2.580 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@@H](C)[C@H](CCNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001560140958 1076234475 /nfs/dbraw/zinc/23/44/75/1076234475.db2.gz BXCKNUKAAPEBBB-DGCLKSJQSA-N 1 1 368.434 2.874 20 5 FFBDMO CCOC(=O)c1cnn2cc(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])cnc12 ZINC001560995265 1076318035 /nfs/dbraw/zinc/31/80/35/1076318035.db2.gz GGLZQKRGRKYNFU-GFCCVEGCSA-N 1 1 369.381 2.665 20 5 FFBDMO Cc1ccc(NCCCNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])[nH+]c1 ZINC001587308709 1077429167 /nfs/dbraw/zinc/42/91/67/1077429167.db2.gz JKEISFFLYZEJFJ-UHFFFAOYSA-N 1 1 360.389 2.988 20 5 FFBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001590043546 1080969741 /nfs/dbraw/zinc/96/97/41/1080969741.db2.gz OTQAGNNWJNGXFB-SJCJKPOMSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001590045883 1080972991 /nfs/dbraw/zinc/97/29/91/1080972991.db2.gz FNFGUTXEYIVOOM-ZDUSSCGKSA-N 1 1 368.397 2.847 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072860148 249783276 /nfs/dbraw/zinc/78/32/76/249783276.db2.gz DSEGCQSEGMBDPR-QWHCGFSZSA-N 1 1 368.865 2.849 20 5 FFBDMO COc1cc(C[N@H+](C)CC[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093481463 250035322 /nfs/dbraw/zinc/03/53/22/250035322.db2.gz RFTRAOFYHYGLFO-JTQLQIEISA-N 1 1 366.336 2.747 20 5 FFBDMO COc1cc(C[N@@H+](C)CC[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093481463 250035326 /nfs/dbraw/zinc/03/53/26/250035326.db2.gz RFTRAOFYHYGLFO-JTQLQIEISA-N 1 1 366.336 2.747 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCn1ccnc1 ZINC000181108630 251242767 /nfs/dbraw/zinc/24/27/67/251242767.db2.gz CVYSTDMVSJDVBM-GFCCVEGCSA-N 1 1 365.821 2.794 20 5 FFBDMO CCc1n[nH]c(C(=O)NCc2cccc(C[N@@H+](C)C(C)C)c2)c1[N+](=O)[O-] ZINC000192552452 251287646 /nfs/dbraw/zinc/28/76/46/251287646.db2.gz ZMPXKOWCLPQMEA-UHFFFAOYSA-N 1 1 359.430 2.651 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000192483858 251278138 /nfs/dbraw/zinc/27/81/38/251278138.db2.gz PCXYNEKTQQXAKK-GFCCVEGCSA-N 1 1 364.427 2.755 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000192483858 251278141 /nfs/dbraw/zinc/27/81/41/251278141.db2.gz PCXYNEKTQQXAKK-GFCCVEGCSA-N 1 1 364.427 2.755 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000268788116 251384348 /nfs/dbraw/zinc/38/43/48/251384348.db2.gz FNGSXMBEBBHQBG-UHFFFAOYSA-N 1 1 372.263 2.640 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000272465983 252045928 /nfs/dbraw/zinc/04/59/28/252045928.db2.gz HPGXGZIUZJQBKJ-SWLSCSKDSA-N 1 1 368.865 2.915 20 5 FFBDMO CCC(CC)(C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(=O)OC ZINC000272544575 252065311 /nfs/dbraw/zinc/06/53/11/252065311.db2.gz PXXSDQMJDRDLSK-INIZCTEOSA-N 1 1 374.441 2.987 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084832 /nfs/dbraw/zinc/08/48/32/252084832.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@@H]3CCN(C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084836 /nfs/dbraw/zinc/08/48/36/252084836.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3CCN(C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625527 252084837 /nfs/dbraw/zinc/08/48/37/252084837.db2.gz MKHXDKGSVHEZJN-KSSFIOAISA-N 1 1 355.442 2.521 20 5 FFBDMO C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272860071 252150682 /nfs/dbraw/zinc/15/06/82/252150682.db2.gz IFDQXQWILVDYAR-JTQLQIEISA-N 1 1 357.332 2.994 20 5 FFBDMO CC(C)[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000272895041 252158549 /nfs/dbraw/zinc/15/85/49/252158549.db2.gz YPTMBUSQPFNSGT-GFCCVEGCSA-N 1 1 361.489 2.592 20 5 FFBDMO CCOc1cccc(N2CCN(C[C@H]3CCCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000273150085 252232213 /nfs/dbraw/zinc/23/22/13/252232213.db2.gz HLPWRIPFSIJYEK-MRXNPFEDSA-N 1 1 362.474 2.600 20 5 FFBDMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273467565 252313131 /nfs/dbraw/zinc/31/31/31/252313131.db2.gz IOGKGTBLISJIFO-LRDDRELGSA-N 1 1 364.423 2.875 20 5 FFBDMO CSc1ccc(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000277654152 256222403 /nfs/dbraw/zinc/22/24/03/256222403.db2.gz SVFLIIBILFSUNY-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@]2(CCOC2)O1 ZINC000280623848 256542805 /nfs/dbraw/zinc/54/28/05/256542805.db2.gz WVELQSDHLRNDIV-IFXJQAMLSA-N 1 1 373.409 2.672 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000288320517 257174675 /nfs/dbraw/zinc/17/46/75/257174675.db2.gz HVSWCODPKBIMDI-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@H](C)C1 ZINC000288320517 257174677 /nfs/dbraw/zinc/17/46/77/257174677.db2.gz HVSWCODPKBIMDI-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@H]1C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000290829204 257359965 /nfs/dbraw/zinc/35/99/65/257359965.db2.gz UIQJRQGIXLMTJB-DZGCQCFKSA-N 1 1 369.425 2.554 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291678547 257416846 /nfs/dbraw/zinc/41/68/46/257416846.db2.gz CCGRDFZDNIAUAR-XJKSGUPXSA-N 1 1 354.410 2.570 20 5 FFBDMO CCOC(=O)c1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[nH]c1C ZINC000296972723 257774477 /nfs/dbraw/zinc/77/44/77/257774477.db2.gz UUZAMDJWJZSUPY-UHFFFAOYSA-N 1 1 357.370 2.574 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000302163214 258092062 /nfs/dbraw/zinc/09/20/62/258092062.db2.gz IKQPPQZZDLMUAT-RDTXWAMCSA-N 1 1 368.437 2.887 20 5 FFBDMO CCOc1cccc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c1[N+](=O)[O-] ZINC000302167420 258092360 /nfs/dbraw/zinc/09/23/60/258092360.db2.gz SDSALDCSXLQLPY-SJPCQFCGSA-N 1 1 374.485 2.741 20 5 FFBDMO Cc1cc(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000302431322 258101968 /nfs/dbraw/zinc/10/19/68/258101968.db2.gz LFRSWXXMLZNRHW-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Br)CC[N@@H+]1CC(C)(C)O ZINC000302497649 258103935 /nfs/dbraw/zinc/10/39/35/258103935.db2.gz NDTSGKPEILJUMM-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1CC(C)(C)O ZINC000302497649 258103936 /nfs/dbraw/zinc/10/39/36/258103936.db2.gz NDTSGKPEILJUMM-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCc3c2cnn3CCO)c1 ZINC000324412180 258115778 /nfs/dbraw/zinc/11/57/78/258115778.db2.gz WBDXUVMCJJIQQQ-OAHLLOKOSA-N 1 1 350.806 2.604 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000301557121 258056034 /nfs/dbraw/zinc/05/60/34/258056034.db2.gz SMXRGFCYDOZBOX-ZDUSSCGKSA-N 1 1 352.391 2.590 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000301690876 258063176 /nfs/dbraw/zinc/06/31/76/258063176.db2.gz WJBZPRDTTRRBCN-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000301703476 258063917 /nfs/dbraw/zinc/06/39/17/258063917.db2.gz UPZPCMZDRQYBTD-BETUJISGSA-N 1 1 362.430 2.706 20 5 FFBDMO Cc1cnc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)c([N+](=O)[O-])c1 ZINC000301731035 258065327 /nfs/dbraw/zinc/06/53/27/258065327.db2.gz SLCAWAHEQKRRNU-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000301757277 258066411 /nfs/dbraw/zinc/06/64/11/258066411.db2.gz DXZSLNAUZCZUHZ-AWEZNQCLSA-N 1 1 369.487 2.778 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301989647 258081000 /nfs/dbraw/zinc/08/10/00/258081000.db2.gz OQVKRXRFVXMQGB-XQQFMLRXSA-N 1 1 362.430 2.704 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CCC[N@H+]3Cc3ccccc3)nn21 ZINC000302011205 258081400 /nfs/dbraw/zinc/08/14/00/258081400.db2.gz WIXTXOOLZPCLKD-HNNXBMFYSA-N 1 1 352.398 2.714 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000332088242 258213425 /nfs/dbraw/zinc/21/34/25/258213425.db2.gz JWPLJCBOSSBOOI-CVEARBPZSA-N 1 1 361.442 2.757 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000332121571 258214801 /nfs/dbraw/zinc/21/48/01/258214801.db2.gz AFSDKPFZQWYSDC-LJQANCHMSA-N 1 1 374.485 2.616 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1C ZINC000332608924 258237202 /nfs/dbraw/zinc/23/72/02/258237202.db2.gz BEIAPZKVXFXAJR-WCQYABFASA-N 1 1 360.439 2.931 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000331738460 258199018 /nfs/dbraw/zinc/19/90/18/258199018.db2.gz UWVNWRILWKVTPW-CYBMUJFWSA-N 1 1 365.405 2.577 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000331738460 258199019 /nfs/dbraw/zinc/19/90/19/258199019.db2.gz UWVNWRILWKVTPW-CYBMUJFWSA-N 1 1 365.405 2.577 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000065866560 506382340 /nfs/dbraw/zinc/38/23/40/506382340.db2.gz HBHXLNIIDITDDJ-QGZVFWFLSA-N 1 1 368.437 2.788 20 5 FFBDMO CC(C)CCC[C@@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373243762 512237375 /nfs/dbraw/zinc/23/73/75/512237375.db2.gz OWPNQCWRTNQMON-OAHLLOKOSA-N 1 1 365.478 2.759 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000054122439 506494225 /nfs/dbraw/zinc/49/42/25/506494225.db2.gz QNAAKMNGONEYFZ-UHFFFAOYSA-N 1 1 362.817 2.924 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000054122439 506494230 /nfs/dbraw/zinc/49/42/30/506494230.db2.gz QNAAKMNGONEYFZ-UHFFFAOYSA-N 1 1 362.817 2.924 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000054348101 506540454 /nfs/dbraw/zinc/54/04/54/506540454.db2.gz IZFSOPTVZSOVFK-UHFFFAOYSA-N 1 1 358.398 2.857 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000375391201 512300560 /nfs/dbraw/zinc/30/05/60/512300560.db2.gz MIAVYEGCVXHIBE-UHFFFAOYSA-N 1 1 351.366 2.606 20 5 FFBDMO COc1cccc(C[N@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000067374694 506850159 /nfs/dbraw/zinc/85/01/59/506850159.db2.gz YJSXDPXGMXYFQI-SFHVURJKSA-N 1 1 355.394 2.841 20 5 FFBDMO COc1cccc(C[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000067374694 506850166 /nfs/dbraw/zinc/85/01/66/506850166.db2.gz YJSXDPXGMXYFQI-SFHVURJKSA-N 1 1 355.394 2.841 20 5 FFBDMO CNC(=O)[C@@H]1Cc2ccccc2C[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000055901064 506880531 /nfs/dbraw/zinc/88/05/31/506880531.db2.gz XCKDUABCPMQGJU-IBGZPJMESA-N 1 1 369.421 2.537 20 5 FFBDMO CNC(=O)[C@@H]1Cc2ccccc2C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000055901064 506880535 /nfs/dbraw/zinc/88/05/35/506880535.db2.gz XCKDUABCPMQGJU-IBGZPJMESA-N 1 1 369.421 2.537 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000056040339 506916667 /nfs/dbraw/zinc/91/66/67/506916667.db2.gz MZYPOCQJFWNTIU-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068265789 507167519 /nfs/dbraw/zinc/16/75/19/507167519.db2.gz FKDGRCLEWAVVKL-DGCLKSJQSA-N 1 1 355.822 2.616 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000068775369 507320263 /nfs/dbraw/zinc/32/02/63/507320263.db2.gz IIWSZYJTVFQSTI-ZDUSSCGKSA-N 1 1 369.849 2.958 20 5 FFBDMO C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000025939324 507546488 /nfs/dbraw/zinc/54/64/88/507546488.db2.gz LLVJLHPSALIHPX-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000063647716 507755830 /nfs/dbraw/zinc/75/58/30/507755830.db2.gz GWDKZZNRONPRPP-UHFFFAOYSA-N 1 1 371.328 2.641 20 5 FFBDMO Cc1ccc(OCC[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000029121117 507761983 /nfs/dbraw/zinc/76/19/83/507761983.db2.gz ARGOIULXNDMVQP-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000029121117 507761988 /nfs/dbraw/zinc/76/19/88/507761988.db2.gz ARGOIULXNDMVQP-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051380778 507766464 /nfs/dbraw/zinc/76/64/64/507766464.db2.gz JWDVMLKHTGLNLA-GFCCVEGCSA-N 1 1 358.423 2.685 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000090003580 507899282 /nfs/dbraw/zinc/89/92/82/507899282.db2.gz RWKLRSAWXQGHJF-HNNXBMFYSA-N 1 1 371.441 2.612 20 5 FFBDMO O=C(C[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O)c1cccs1 ZINC000090559312 507927627 /nfs/dbraw/zinc/92/76/27/507927627.db2.gz SYDDCQVQUXFVAH-CYBMUJFWSA-N 1 1 361.423 2.555 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCCC4(C3)OCCO4)o2)c1 ZINC000090563087 507928056 /nfs/dbraw/zinc/92/80/56/507928056.db2.gz ZCKHCZQPDDFUOP-UHFFFAOYSA-N 1 1 359.382 2.631 20 5 FFBDMO Cc1cnn([C@@H]2CCC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000109133065 507941922 /nfs/dbraw/zinc/94/19/22/507941922.db2.gz SLFVEHYIYHQQNS-QZTJIDSGSA-N 1 1 369.425 2.542 20 5 FFBDMO Cc1cnn([C@@H]2CCC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000109133065 507941924 /nfs/dbraw/zinc/94/19/24/507941924.db2.gz SLFVEHYIYHQQNS-QZTJIDSGSA-N 1 1 369.425 2.542 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000110007092 508000255 /nfs/dbraw/zinc/00/02/55/508000255.db2.gz GUWRVJZFSWAAER-UHFFFAOYSA-N 1 1 360.458 2.753 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000074323834 508012773 /nfs/dbraw/zinc/01/27/73/508012773.db2.gz ZTHBWHCWWGZSIG-CQSZACIVSA-N 1 1 365.861 2.981 20 5 FFBDMO CCOCCO[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000092067293 508038742 /nfs/dbraw/zinc/03/87/42/508038742.db2.gz ATHNZHDATJOOQM-SFHVURJKSA-N 1 1 374.441 2.623 20 5 FFBDMO Cc1cc(N[C@@H](C[NH+]2CCN(C)CC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000074747186 508051877 /nfs/dbraw/zinc/05/18/77/508051877.db2.gz PNONSQQXPGXJDT-KRWDZBQOSA-N 1 1 355.442 2.699 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765697 508053205 /nfs/dbraw/zinc/05/32/05/508053205.db2.gz OUYRRRQTEHAZPF-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765697 508053207 /nfs/dbraw/zinc/05/32/07/508053207.db2.gz OUYRRRQTEHAZPF-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000110965702 508060676 /nfs/dbraw/zinc/06/06/76/508060676.db2.gz YHFINTVPEUVFJE-HNNXBMFYSA-N 1 1 356.426 2.643 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000080463233 508075104 /nfs/dbraw/zinc/07/51/04/508075104.db2.gz AYKLSRPNSDGKNP-OAHLLOKOSA-N 1 1 361.442 2.797 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000377651511 512377211 /nfs/dbraw/zinc/37/72/11/512377211.db2.gz UNOHDAZGIITKGQ-UHFFFAOYSA-N 1 1 370.409 2.780 20 5 FFBDMO Cc1ccc2ncc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2c1 ZINC000093534932 508148110 /nfs/dbraw/zinc/14/81/10/508148110.db2.gz ZCCDSBJZNFREOQ-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1ccc2ncc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2c1 ZINC000093534932 508148111 /nfs/dbraw/zinc/14/81/11/508148111.db2.gz ZCCDSBJZNFREOQ-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3=Cc4ccccc4OC3)C2)nc1 ZINC000093534453 508148150 /nfs/dbraw/zinc/14/81/50/508148150.db2.gz QRGUBYGOVDJBHR-INIZCTEOSA-N 1 1 352.394 2.952 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000081361453 508166804 /nfs/dbraw/zinc/16/68/04/508166804.db2.gz RBCNFEFMILDJCX-AWEZNQCLSA-N 1 1 360.458 2.973 20 5 FFBDMO CCc1nn(C)c(N2CC[NH+]([C@@H](C)c3cccc(OC)c3)CC2)c1[N+](=O)[O-] ZINC000094155610 508171302 /nfs/dbraw/zinc/17/13/02/508171302.db2.gz CZWBIXFBHBOFQJ-AWEZNQCLSA-N 1 1 373.457 2.783 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[NH+](C2CC2)CC1 ZINC000077202245 508286138 /nfs/dbraw/zinc/28/61/38/508286138.db2.gz CFVURJHABKASQF-UHFFFAOYSA-N 1 1 356.329 2.508 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114642918 508333745 /nfs/dbraw/zinc/33/37/45/508333745.db2.gz RPIQEFHMGPCLLL-SFHVURJKSA-N 1 1 369.421 2.754 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc(F)cc1[N+](=O)[O-] ZINC000114695022 508338740 /nfs/dbraw/zinc/33/87/40/508338740.db2.gz UUCJIICPBPUNGV-HNNXBMFYSA-N 1 1 372.400 2.711 20 5 FFBDMO C[C@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000104684652 508342135 /nfs/dbraw/zinc/34/21/35/508342135.db2.gz IMIZDMIWNJSROO-ZDUSSCGKSA-N 1 1 350.415 2.977 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)[C@H](C)C1 ZINC000115270945 508379743 /nfs/dbraw/zinc/37/97/43/508379743.db2.gz MJGLHZHQYKHUHG-TZMCWYRMSA-N 1 1 369.487 2.832 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000077932806 508393256 /nfs/dbraw/zinc/39/32/56/508393256.db2.gz RHBFRZWKPPRRAZ-UHFFFAOYSA-N 1 1 358.398 2.710 20 5 FFBDMO O=C(C[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O)c1ccc(F)cc1 ZINC000133783025 508448928 /nfs/dbraw/zinc/44/89/28/508448928.db2.gz HWNBVACYQXXQMS-MRXNPFEDSA-N 1 1 373.384 2.633 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152762840 508510776 /nfs/dbraw/zinc/51/07/76/508510776.db2.gz WDSUYDGGPVRIJM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152762840 508510777 /nfs/dbraw/zinc/51/07/77/508510777.db2.gz WDSUYDGGPVRIJM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCc2ccccc2C1 ZINC000117333185 508593673 /nfs/dbraw/zinc/59/36/73/508593673.db2.gz JWAFVBQSFRAKQN-UHFFFAOYSA-N 1 1 353.378 2.951 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOC4(CCOCC4)C3)o2)c1 ZINC000135603781 508630559 /nfs/dbraw/zinc/63/05/59/508630559.db2.gz TZUIKIRUCRMXOJ-UHFFFAOYSA-N 1 1 373.409 2.674 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000153729938 508636955 /nfs/dbraw/zinc/63/69/55/508636955.db2.gz ACTNXUGRZKYWKX-LBPRGKRZSA-N 1 1 363.414 2.505 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153931022 508679494 /nfs/dbraw/zinc/67/94/94/508679494.db2.gz ZOKAQECTMHJLMK-INIZCTEOSA-N 1 1 365.430 2.571 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153931022 508679496 /nfs/dbraw/zinc/67/94/96/508679496.db2.gz ZOKAQECTMHJLMK-INIZCTEOSA-N 1 1 365.430 2.571 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@@H]1CO)Nc1cc([N+](=O)[O-])ccc1F ZINC000129125244 508687826 /nfs/dbraw/zinc/68/78/26/508687826.db2.gz FSKMHCMNNNVTMB-SFHVURJKSA-N 1 1 373.384 2.654 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@H](C)C1 ZINC000158418707 508701330 /nfs/dbraw/zinc/70/13/30/508701330.db2.gz YLQFHDVUSLADMN-GDBMZVCRSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)c1ccc(C(=O)NC2CCN(c3[nH+]ccn3C)CC2)cc1[N+](=O)[O-] ZINC000373590867 512413933 /nfs/dbraw/zinc/41/39/33/512413933.db2.gz CKQJHFMNDRWZBX-UHFFFAOYSA-N 1 1 371.441 2.851 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137527446 508759169 /nfs/dbraw/zinc/75/91/69/508759169.db2.gz AGYDHZJKODIEMD-YJBOKZPZSA-N 1 1 353.422 2.917 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000137564480 508760344 /nfs/dbraw/zinc/76/03/44/508760344.db2.gz QLSHYUZFZHMNIZ-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123942827 508760804 /nfs/dbraw/zinc/76/08/04/508760804.db2.gz WMKQORYTWWGCSF-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000138369787 508772312 /nfs/dbraw/zinc/77/23/12/508772312.db2.gz NTDOLWXNKPETLH-CQSZACIVSA-N 1 1 369.421 2.753 20 5 FFBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cn1 ZINC000371464074 512416740 /nfs/dbraw/zinc/41/67/40/512416740.db2.gz OEDCMBAJGZXRLT-BBRMVZONSA-N 1 1 371.397 2.558 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139939994 508797670 /nfs/dbraw/zinc/79/76/70/508797670.db2.gz NAMXVAZLCAUTKH-WFASDCNBSA-N 1 1 366.849 2.603 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000124268806 508806850 /nfs/dbraw/zinc/80/68/50/508806850.db2.gz BPRWPWYEOUJXAE-INIZCTEOSA-N 1 1 363.458 2.848 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000369458945 512419748 /nfs/dbraw/zinc/41/97/48/512419748.db2.gz SNGWOXXRYFTORW-ZIAGYGMSSA-N 1 1 367.833 2.760 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000119597373 508825847 /nfs/dbraw/zinc/82/58/47/508825847.db2.gz KUTPVQDOUDALNW-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO CCc1cc(N[C@H](C)[C@@H]2C[N@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832211 508865605 /nfs/dbraw/zinc/86/56/05/508865605.db2.gz FUCDGWAQJCDDJF-DYVFJYSZSA-N 1 1 371.441 2.745 20 5 FFBDMO CCc1cc(N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832211 508865607 /nfs/dbraw/zinc/86/56/07/508865607.db2.gz FUCDGWAQJCDDJF-DYVFJYSZSA-N 1 1 371.441 2.745 20 5 FFBDMO CCC(CC)(C[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(=O)OC ZINC000159663034 508872949 /nfs/dbraw/zinc/87/29/49/508872949.db2.gz VXZJZXXSCUBGNM-UHFFFAOYSA-N 1 1 362.386 2.714 20 5 FFBDMO Cc1sc(S(=O)(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000124828163 508891062 /nfs/dbraw/zinc/89/10/62/508891062.db2.gz GUIMQKBWXHEIED-CYBMUJFWSA-N 1 1 373.500 2.508 20 5 FFBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159850957 508900022 /nfs/dbraw/zinc/90/00/22/508900022.db2.gz WKIYBHGPKZGTKZ-GOSISDBHSA-N 1 1 356.426 2.660 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000119967983 508900707 /nfs/dbraw/zinc/90/07/07/508900707.db2.gz RABNTDQUBHHAAN-WBVHZDCISA-N 1 1 369.421 2.610 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000155120594 508928351 /nfs/dbraw/zinc/92/83/51/508928351.db2.gz BDTHXDIYRLQRGG-SJORKVTESA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155138195 508932065 /nfs/dbraw/zinc/93/20/65/508932065.db2.gz SLORYHVQIPAHNS-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000120209269 508950683 /nfs/dbraw/zinc/95/06/83/508950683.db2.gz QZSGHVJNBOFYCJ-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[NH+]2CCOCC2)nc1-c1ccccc1 ZINC000160385763 508979311 /nfs/dbraw/zinc/97/93/11/508979311.db2.gz WXGHIIGTDHRYAQ-QGZVFWFLSA-N 1 1 368.437 2.958 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000155526983 509020157 /nfs/dbraw/zinc/02/01/57/509020157.db2.gz QPSCETIOLMNWTA-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3[C@@H](C)C[NH+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000155771725 509068725 /nfs/dbraw/zinc/06/87/25/509068725.db2.gz QGIMZRHIPRAAPP-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC(C)(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)Nc1ccc(F)cc1 ZINC000152055708 509137892 /nfs/dbraw/zinc/13/78/92/509137892.db2.gz ICHLNEKPVLUHGF-UHFFFAOYSA-N 1 1 363.393 2.670 20 5 FFBDMO CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC1 ZINC000161669323 509142194 /nfs/dbraw/zinc/14/21/94/509142194.db2.gz GXUPTQDFSSZYMH-UHFFFAOYSA-N 1 1 360.458 2.633 20 5 FFBDMO CC(C)(C)C(=O)N1CCC(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC1 ZINC000161669323 509142198 /nfs/dbraw/zinc/14/21/98/509142198.db2.gz GXUPTQDFSSZYMH-UHFFFAOYSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697434 509310334 /nfs/dbraw/zinc/31/03/34/509310334.db2.gz ZUKWNLUWLYRZKR-CABCVRRESA-N 1 1 360.458 2.776 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cc(Br)ccc1F ZINC000176219929 509386633 /nfs/dbraw/zinc/38/66/33/509386633.db2.gz XKJAKHJSVJNBLF-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cc(Br)ccc1F ZINC000176219929 509386634 /nfs/dbraw/zinc/38/66/34/509386634.db2.gz XKJAKHJSVJNBLF-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000264257378 509417018 /nfs/dbraw/zinc/41/70/18/509417018.db2.gz CGYRNSMFAKMWQP-KRWDZBQOSA-N 1 1 353.422 2.889 20 5 FFBDMO CCOc1ccc(NC(=O)CN2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416858 509468518 /nfs/dbraw/zinc/46/85/18/509468518.db2.gz JMZOGFBMTQZZRT-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO O=[N+]([O-])c1cccc(CNC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000192357632 509479509 /nfs/dbraw/zinc/47/95/09/509479509.db2.gz FWPNEMPFRIDJBM-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000248898500 509536371 /nfs/dbraw/zinc/53/63/71/509536371.db2.gz UEKGQFYWMCULRP-CXAGYDPISA-N 1 1 357.385 2.984 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCS[C@H](C)CC1 ZINC000249027599 509575339 /nfs/dbraw/zinc/57/53/39/509575339.db2.gz LQAULHMVBQHHGB-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000249027599 509575343 /nfs/dbraw/zinc/57/53/43/509575343.db2.gz LQAULHMVBQHHGB-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000264655050 509626648 /nfs/dbraw/zinc/62/66/48/509626648.db2.gz PSYZUEYLUCJBHF-UHFFFAOYSA-N 1 1 360.380 2.687 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])cc1OCC(F)F ZINC000179913441 509670891 /nfs/dbraw/zinc/67/08/91/509670891.db2.gz HODBRJDXDHRWKA-FUNVUKJBSA-N 1 1 372.368 2.735 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])cc1OCC(F)F ZINC000179913441 509670898 /nfs/dbraw/zinc/67/08/98/509670898.db2.gz HODBRJDXDHRWKA-FUNVUKJBSA-N 1 1 372.368 2.735 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(Nc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000170651063 509698637 /nfs/dbraw/zinc/69/86/37/509698637.db2.gz SASPGGKFAISOKP-UHFFFAOYSA-N 1 1 372.400 2.909 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000189681385 509700356 /nfs/dbraw/zinc/70/03/56/509700356.db2.gz PKMZWDXRBAQODC-AWEZNQCLSA-N 1 1 369.487 2.922 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268045687 509734022 /nfs/dbraw/zinc/73/40/22/509734022.db2.gz ZKIQKUSCJINTAH-GXSJLCMTSA-N 1 1 368.231 2.712 20 5 FFBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249817390 509768410 /nfs/dbraw/zinc/76/84/10/509768410.db2.gz LNBTWUQUIWXTQT-YQQAZPJKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249817390 509768415 /nfs/dbraw/zinc/76/84/15/509768415.db2.gz LNBTWUQUIWXTQT-YQQAZPJKSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)(C)CCNC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173798528 509784503 /nfs/dbraw/zinc/78/45/03/509784503.db2.gz XLLWUOAZUVGAJO-UHFFFAOYSA-N 1 1 363.458 2.990 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176974553 509792434 /nfs/dbraw/zinc/79/24/34/509792434.db2.gz LZDPXTGJQABDJP-INIZCTEOSA-N 1 1 368.437 2.771 20 5 FFBDMO COc1ccc(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000177057533 509843928 /nfs/dbraw/zinc/84/39/28/509843928.db2.gz HYGZOIVGXRYZPD-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Nc2ccncc2[N+](=O)[O-])cc1F ZINC000183578895 509869788 /nfs/dbraw/zinc/86/97/88/509869788.db2.gz JBUKBQFTZSJYBO-UHFFFAOYSA-N 1 1 370.344 2.945 20 5 FFBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245407837 509912104 /nfs/dbraw/zinc/91/21/04/509912104.db2.gz DDDWLHPUNDTHLB-APWZRJJASA-N 1 1 359.426 2.900 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000193585067 509977726 /nfs/dbraw/zinc/97/77/26/509977726.db2.gz RUJQZKYSENXXBL-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC(c4[nH]cc[nH+]4)CC3)n2)cc1 ZINC000265492964 510083806 /nfs/dbraw/zinc/08/38/06/510083806.db2.gz NQBMYYPJOKTNNG-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC[C@H]21 ZINC000268865953 510108288 /nfs/dbraw/zinc/10/82/88/510108288.db2.gz SPABZKQFWDOCBF-MAUKXSAKSA-N 1 1 372.469 2.751 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC1 ZINC000193886175 510113666 /nfs/dbraw/zinc/11/36/66/510113666.db2.gz RKIZMQWEAYMSKC-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(O)CCCCCC1 ZINC000187330005 510200178 /nfs/dbraw/zinc/20/01/78/510200178.db2.gz UJDUTWSPBPXWSJ-UHFFFAOYSA-N 1 1 361.442 2.501 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000177788013 510253584 /nfs/dbraw/zinc/25/35/84/510253584.db2.gz MRLUWPJXGYKOCY-GDBMZVCRSA-N 1 1 360.458 2.842 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc(C)cs1 ZINC000184356755 510283140 /nfs/dbraw/zinc/28/31/40/510283140.db2.gz BHTDZVCUELNFBY-AWEZNQCLSA-N 1 1 360.439 2.990 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269288768 510325686 /nfs/dbraw/zinc/32/56/86/510325686.db2.gz UBXZWOHCHHLKLF-QZTJIDSGSA-N 1 1 358.442 2.896 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000174819447 510327368 /nfs/dbraw/zinc/32/73/68/510327368.db2.gz ISMQWZOOEWKVPE-GJZGRUSLSA-N 1 1 371.224 2.688 20 5 FFBDMO Cc1ccc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)c(OCC[NH+](C)C)c1 ZINC000269305182 510333140 /nfs/dbraw/zinc/33/31/40/510333140.db2.gz WMYZCNOHYVNESO-UHFFFAOYSA-N 1 1 359.382 2.802 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181385107 510385287 /nfs/dbraw/zinc/38/52/87/510385287.db2.gz NBPQDZKSBJDRPA-CYBMUJFWSA-N 1 1 371.393 2.574 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174953672 510404306 /nfs/dbraw/zinc/40/43/06/510404306.db2.gz YOTIBZCYEWAWFF-QGZVFWFLSA-N 1 1 368.437 2.892 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000175017744 510438866 /nfs/dbraw/zinc/43/88/66/510438866.db2.gz INPLEWFYGKULQB-DZGCQCFKSA-N 1 1 351.834 2.876 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194604292 510441790 /nfs/dbraw/zinc/44/17/90/510441790.db2.gz ABJSAQGGFPPUSH-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1cccc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000175095670 510480819 /nfs/dbraw/zinc/48/08/19/510480819.db2.gz ACBPNRUZIKVBTA-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000184730336 510488042 /nfs/dbraw/zinc/48/80/42/510488042.db2.gz VRIKDTPKIJSWMD-LLVKDONJSA-N 1 1 352.822 2.532 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000194723298 510496512 /nfs/dbraw/zinc/49/65/12/510496512.db2.gz LUIVBYLMIYHAPD-LBPRGKRZSA-N 1 1 374.363 2.626 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184785561 510514513 /nfs/dbraw/zinc/51/45/13/510514513.db2.gz PKQKWHLJUPVTQW-NSHDSACASA-N 1 1 365.821 2.889 20 5 FFBDMO COc1ccc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181675417 510534066 /nfs/dbraw/zinc/53/40/66/510534066.db2.gz KRPPUPZSWBOKND-ZFWWWQNUSA-N 1 1 361.442 2.986 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000246546181 510548453 /nfs/dbraw/zinc/54/84/53/510548453.db2.gz AVESPDCOWVNIJK-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000246546181 510548460 /nfs/dbraw/zinc/54/84/60/510548460.db2.gz AVESPDCOWVNIJK-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ncc(-c2ccccc2)o1 ZINC000184905685 510574948 /nfs/dbraw/zinc/57/49/48/510574948.db2.gz YRHOCMKRBRWKHG-ZDUSSCGKSA-N 1 1 354.366 2.762 20 5 FFBDMO Cc1ccc([C@H](C)[NH2+]CC(=O)N2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000181838475 510619084 /nfs/dbraw/zinc/61/90/84/510619084.db2.gz QMAWELPWTLUKHS-ZDUSSCGKSA-N 1 1 368.393 2.539 20 5 FFBDMO C[C@@H](CCNC(=O)c1ccc([N+](=O)[O-])c([O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000175386053 510619514 /nfs/dbraw/zinc/61/95/14/510619514.db2.gz DGQCWWGDHDMWNB-AWEZNQCLSA-N 1 1 357.410 2.941 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC000246702111 510625438 /nfs/dbraw/zinc/62/54/38/510625438.db2.gz JPGQVJPDOLUNSU-CJNGLKHVSA-N 1 1 350.806 2.643 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000181931717 510666497 /nfs/dbraw/zinc/66/64/97/510666497.db2.gz OUSDZZUUMCWSGQ-SOUVJXGZSA-N 1 1 354.472 2.941 20 5 FFBDMO C[N@H+](Cc1ccccc1N1CCOCC1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178569896 510668393 /nfs/dbraw/zinc/66/83/93/510668393.db2.gz XEQYRUWHDIPNLG-HXUWFJFHSA-N 1 1 371.437 2.597 20 5 FFBDMO COC[C@H](Cc1ccccc1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191486248 510683021 /nfs/dbraw/zinc/68/30/21/510683021.db2.gz WRYGWVXHEQLUFQ-INIZCTEOSA-N 1 1 357.410 2.723 20 5 FFBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191486248 510683028 /nfs/dbraw/zinc/68/30/28/510683028.db2.gz WRYGWVXHEQLUFQ-INIZCTEOSA-N 1 1 357.410 2.723 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000246812554 510689342 /nfs/dbraw/zinc/68/93/42/510689342.db2.gz NJYNWJUTOZPPFZ-CLCXKQKWSA-N 1 1 372.469 2.871 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H](CCO)c1ccccc1 ZINC000266628749 510697876 /nfs/dbraw/zinc/69/78/76/510697876.db2.gz ORDKQCMMSMCGPT-SFHVURJKSA-N 1 1 369.421 2.539 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H](CCO)c1ccccc1 ZINC000266628749 510697884 /nfs/dbraw/zinc/69/78/84/510697884.db2.gz ORDKQCMMSMCGPT-SFHVURJKSA-N 1 1 369.421 2.539 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1 ZINC000246868027 510718885 /nfs/dbraw/zinc/71/88/85/510718885.db2.gz RZXXLUITEWCKIC-DOTOQJQBSA-N 1 1 363.458 2.770 20 5 FFBDMO CN(C(=O)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993748 510788250 /nfs/dbraw/zinc/78/82/50/510788250.db2.gz WNZXZSBSQSZGGJ-HNAYVOBHSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000191722157 510802357 /nfs/dbraw/zinc/80/23/57/510802357.db2.gz AEUUACQLFDKWGT-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000191722157 510802363 /nfs/dbraw/zinc/80/23/63/510802363.db2.gz AEUUACQLFDKWGT-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000182190933 510805499 /nfs/dbraw/zinc/80/54/99/510805499.db2.gz ZTHKRDUEMGHUST-MRXNPFEDSA-N 1 1 360.410 2.654 20 5 FFBDMO Cc1cnc([C@@H]([NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C2CC2)s1 ZINC000185324968 510806344 /nfs/dbraw/zinc/80/63/44/510806344.db2.gz SVVLHPTVOPTBNB-KRWDZBQOSA-N 1 1 372.450 2.990 20 5 FFBDMO CCSCC[C@H](C)[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182194351 510807541 /nfs/dbraw/zinc/80/75/41/510807541.db2.gz SOYIKOOBTMVAKO-ZDUSSCGKSA-N 1 1 360.501 2.832 20 5 FFBDMO CCSCC[C@H](C)[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182194351 510807546 /nfs/dbraw/zinc/80/75/46/510807546.db2.gz SOYIKOOBTMVAKO-ZDUSSCGKSA-N 1 1 360.501 2.832 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000247069422 510825625 /nfs/dbraw/zinc/82/56/25/510825625.db2.gz UTPWFSWXVHGRIE-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000247069422 510825628 /nfs/dbraw/zinc/82/56/28/510825628.db2.gz UTPWFSWXVHGRIE-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)n1 ZINC000191782410 510829156 /nfs/dbraw/zinc/82/91/56/510829156.db2.gz SFQOPESBFIWDIU-UHFFFAOYSA-N 1 1 363.462 2.539 20 5 FFBDMO CC(C)c1[nH+]ccn1CCC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000188585437 510834985 /nfs/dbraw/zinc/83/49/85/510834985.db2.gz FTNGNDDERBYPJX-UHFFFAOYSA-N 1 1 358.398 2.595 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000247454068 510861288 /nfs/dbraw/zinc/86/12/88/510861288.db2.gz QLJYHESONXMVPU-GDBMZVCRSA-N 1 1 360.458 2.607 20 5 FFBDMO Cc1csc2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc(=O)n12 ZINC000285440082 510907622 /nfs/dbraw/zinc/90/76/22/510907622.db2.gz XLVDCJNQIYKHTC-UHFFFAOYSA-N 1 1 358.423 2.647 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000293964412 510912201 /nfs/dbraw/zinc/91/22/01/510912201.db2.gz UCEKATJJXJMODU-MRXNPFEDSA-N 1 1 369.874 2.895 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000361035446 510984098 /nfs/dbraw/zinc/98/40/98/510984098.db2.gz ZQBGNAVEJWZFSK-IFXJQAMLSA-N 1 1 368.437 2.939 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270801239 510988235 /nfs/dbraw/zinc/98/82/35/510988235.db2.gz MACWWXIRTDQYHH-ROUUACIJSA-N 1 1 358.442 2.896 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000294716830 511153752 /nfs/dbraw/zinc/15/37/52/511153752.db2.gz UTQNQXRTURRYCX-INIZCTEOSA-N 1 1 369.425 2.685 20 5 FFBDMO COc1cc(C[NH2+]Cc2cnc(OC)c(Cl)c2)c([N+](=O)[O-])cc1O ZINC000294732225 511158749 /nfs/dbraw/zinc/15/87/49/511158749.db2.gz DKCJOTSOCMUFCF-UHFFFAOYSA-N 1 1 353.762 2.656 20 5 FFBDMO C[C@H]1CN(c2c(Br)cncc2[N+](=O)[O-])CC[N@@H+](C2CC2)C1 ZINC000294877920 511207033 /nfs/dbraw/zinc/20/70/33/511207033.db2.gz FRQWACXZFHAGKT-SNVBAGLBSA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@H]1CN(c2c(Br)cncc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000294877920 511207035 /nfs/dbraw/zinc/20/70/35/511207035.db2.gz FRQWACXZFHAGKT-SNVBAGLBSA-N 1 1 355.236 2.673 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@H](C)C1 ZINC000294946457 511230024 /nfs/dbraw/zinc/23/00/24/511230024.db2.gz LUVFCFLGNLFLRY-ACJLOTCBSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000294946457 511230027 /nfs/dbraw/zinc/23/00/27/511230027.db2.gz LUVFCFLGNLFLRY-ACJLOTCBSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000294946457 511230029 /nfs/dbraw/zinc/23/00/29/511230029.db2.gz LUVFCFLGNLFLRY-ACJLOTCBSA-N 1 1 371.441 2.787 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CCOCC2)C1=O ZINC000365098131 511255203 /nfs/dbraw/zinc/25/52/03/511255203.db2.gz HZVFRJNLKGKLGA-GOSISDBHSA-N 1 1 361.442 2.585 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1SC ZINC000362958215 511279246 /nfs/dbraw/zinc/27/92/46/511279246.db2.gz PDPLYUNKRPDHQR-NEPJUHHUSA-N 1 1 365.455 2.682 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000298443524 511286414 /nfs/dbraw/zinc/28/64/14/511286414.db2.gz ZGPRYQKXWPXMBA-ZBFHGGJFSA-N 1 1 369.368 2.909 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(n4cccn4)CC3)o2)cc1 ZINC000365161445 511292457 /nfs/dbraw/zinc/29/24/57/511292457.db2.gz FKZLNDXEPAQCAL-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000291737720 511316492 /nfs/dbraw/zinc/31/64/92/511316492.db2.gz AZAPOQVMSVSQNP-SNVBAGLBSA-N 1 1 358.236 2.816 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(NCc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000283326876 511322243 /nfs/dbraw/zinc/32/22/43/511322243.db2.gz JFFLIHNCHAUSGM-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO COCCC[N@@H+](C)CCNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291865849 511370307 /nfs/dbraw/zinc/37/03/07/511370307.db2.gz HBHYGIXMXLJPKJ-UHFFFAOYSA-N 1 1 364.229 2.600 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC(F)(F)[C@@H](CO)C3)o2)c1 ZINC000291907058 511386671 /nfs/dbraw/zinc/38/66/71/511386671.db2.gz RPZXGUGPHHOGGM-CYBMUJFWSA-N 1 1 367.352 2.742 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000272022804 511403802 /nfs/dbraw/zinc/40/38/02/511403802.db2.gz VNCJYXTYLHJTEO-UHFFFAOYSA-N 1 1 356.329 2.580 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)C[N@H+](C)C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000291957764 511406814 /nfs/dbraw/zinc/40/68/14/511406814.db2.gz RATHBQGIWAVFAF-SNVBAGLBSA-N 1 1 352.391 2.578 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295568323 511447692 /nfs/dbraw/zinc/44/76/92/511447692.db2.gz UPONUTCHGCXIIE-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295568323 511447698 /nfs/dbraw/zinc/44/76/98/511447698.db2.gz UPONUTCHGCXIIE-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)c2cc(C[NH+]3CCCC3)on2)cc1[N+](=O)[O-] ZINC000292127770 511475475 /nfs/dbraw/zinc/47/54/75/511475475.db2.gz NRSVWCSYMRIGSR-ZDUSSCGKSA-N 1 1 358.398 2.978 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272250225 511480166 /nfs/dbraw/zinc/48/01/66/511480166.db2.gz YHBNMAYDDJLTNJ-CHWSQXEVSA-N 1 1 355.341 2.553 20 5 FFBDMO CC(C)[N@H+]1CCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000292315866 511549966 /nfs/dbraw/zinc/54/99/66/511549966.db2.gz BAGHCSVVTUIPIM-ZDUSSCGKSA-N 1 1 368.865 2.991 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000299203361 511551148 /nfs/dbraw/zinc/55/11/48/511551148.db2.gz XQHFDSRRHJPQME-CKEIUWERSA-N 1 1 362.430 2.700 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2ccncc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000295968540 511571961 /nfs/dbraw/zinc/57/19/61/511571961.db2.gz NHFDDPSWHAFTLQ-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2ccncc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000295968540 511571966 /nfs/dbraw/zinc/57/19/66/511571966.db2.gz NHFDDPSWHAFTLQ-QGZVFWFLSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(c1ccccc1)c1ccc(NCC[NH+]2CCC(O)CC2)c([N+](=O)[O-])c1 ZINC000296133825 511630887 /nfs/dbraw/zinc/63/08/87/511630887.db2.gz WUGVEOVPWAZKQV-UHFFFAOYSA-N 1 1 369.421 2.694 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273867398 511637574 /nfs/dbraw/zinc/63/75/74/511637574.db2.gz PINZQPXLUNBDMB-CYBMUJFWSA-N 1 1 351.422 2.812 20 5 FFBDMO COc1ccc([C@H](CCO)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000284230521 511651013 /nfs/dbraw/zinc/65/10/13/511651013.db2.gz VATQDNMPIFNBQB-INIZCTEOSA-N 1 1 361.354 2.725 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2ncc(Br)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301710504 511700740 /nfs/dbraw/zinc/70/07/40/511700740.db2.gz XOBUUCUZPBXXOE-PHIMTYICSA-N 1 1 373.251 2.664 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCN(C)c1ccccc1 ZINC000303333771 511735205 /nfs/dbraw/zinc/73/52/05/511735205.db2.gz WZFVMOVJNDXRMZ-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303333771 511735210 /nfs/dbraw/zinc/73/52/10/511735210.db2.gz WZFVMOVJNDXRMZ-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)C1 ZINC000293001158 511802045 /nfs/dbraw/zinc/80/20/45/511802045.db2.gz OWCODVMRMAGMHX-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO Cc1c(NC(=O)CC[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cccc1[N+](=O)[O-] ZINC000293076019 511830157 /nfs/dbraw/zinc/83/01/57/511830157.db2.gz VWUXABDMORVWTR-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cccc1[N+](=O)[O-] ZINC000293076019 511830159 /nfs/dbraw/zinc/83/01/59/511830159.db2.gz VWUXABDMORVWTR-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cccc1[N+](=O)[O-] ZINC000293076019 511830163 /nfs/dbraw/zinc/83/01/63/511830163.db2.gz VWUXABDMORVWTR-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000293076019 511830168 /nfs/dbraw/zinc/83/01/68/511830168.db2.gz VWUXABDMORVWTR-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@]3(C2)CCCN(C)C3)cccc1[N+](=O)[O-] ZINC000293076019 511830172 /nfs/dbraw/zinc/83/01/72/511830172.db2.gz VWUXABDMORVWTR-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000281682172 511929873 /nfs/dbraw/zinc/92/98/73/511929873.db2.gz USBQMQWRPAMMRB-HOTGVXAUSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000364060075 511936015 /nfs/dbraw/zinc/93/60/15/511936015.db2.gz KOSYAPMQVMJUBH-KRWDZBQOSA-N 1 1 372.469 2.895 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000274949638 511997059 /nfs/dbraw/zinc/99/70/59/511997059.db2.gz SDDNPIRBQAGSCM-MJGOQNOKSA-N 1 1 366.421 2.611 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000281880846 511999557 /nfs/dbraw/zinc/99/95/57/511999557.db2.gz GFDHKYZXBQTVLU-OLZOCXBDSA-N 1 1 350.419 2.940 20 5 FFBDMO COCc1ccccc1CNC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285178934 512028309 /nfs/dbraw/zinc/02/83/09/512028309.db2.gz BPEPLIJAYDWVMC-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1ccccc1CNC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285178934 512028312 /nfs/dbraw/zinc/02/83/12/512028312.db2.gz BPEPLIJAYDWVMC-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+](C2CCC2)C1 ZINC000293665009 512044534 /nfs/dbraw/zinc/04/45/34/512044534.db2.gz JTTLKJYPCWNLQV-CQSZACIVSA-N 1 1 360.458 2.607 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000275112889 512045815 /nfs/dbraw/zinc/04/58/15/512045815.db2.gz NIUMXHOFSGYQKN-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000275112889 512045820 /nfs/dbraw/zinc/04/58/20/512045820.db2.gz NIUMXHOFSGYQKN-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000364404783 512106863 /nfs/dbraw/zinc/10/68/63/512106863.db2.gz PCFCPYZMRVSISL-YOEHRIQHSA-N 1 1 354.410 2.630 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000411063646 512456144 /nfs/dbraw/zinc/45/61/44/512456144.db2.gz SLHVAKUKRGTKEE-LLVKDONJSA-N 1 1 357.357 2.753 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000411063646 512456147 /nfs/dbraw/zinc/45/61/47/512456147.db2.gz SLHVAKUKRGTKEE-LLVKDONJSA-N 1 1 357.357 2.753 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])c4cccnc34)C2)CC1 ZINC000367517298 512538702 /nfs/dbraw/zinc/53/87/02/512538702.db2.gz KWCRFFPMYHYKAU-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)CC1 ZINC000374075257 512650717 /nfs/dbraw/zinc/65/07/17/512650717.db2.gz RKKISCPFLWAEFT-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO Cc1nn(CCC(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)c(C)c1[N+](=O)[O-] ZINC000376178753 512696009 /nfs/dbraw/zinc/69/60/09/512696009.db2.gz UHSKVVXHXWWSPA-UHFFFAOYSA-N 1 1 369.425 2.915 20 5 FFBDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000374211259 512708229 /nfs/dbraw/zinc/70/82/29/512708229.db2.gz MZOSNIBJUNAPNN-HNNXBMFYSA-N 1 1 357.414 2.666 20 5 FFBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000374329135 512770594 /nfs/dbraw/zinc/77/05/94/512770594.db2.gz LAPOMLGPJQUJNB-UHFFFAOYSA-N 1 1 367.405 2.837 20 5 FFBDMO CC(=O)c1ccc2c(c1)CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000374329135 512770598 /nfs/dbraw/zinc/77/05/98/512770598.db2.gz LAPOMLGPJQUJNB-UHFFFAOYSA-N 1 1 367.405 2.837 20 5 FFBDMO Cc1noc([C@H]2CCCC[N@@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411730405 512782559 /nfs/dbraw/zinc/78/25/59/512782559.db2.gz OELKWNAHYKKJQF-OAHLLOKOSA-N 1 1 359.386 2.842 20 5 FFBDMO Cc1noc([C@H]2CCCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411730405 512782566 /nfs/dbraw/zinc/78/25/66/512782566.db2.gz OELKWNAHYKKJQF-OAHLLOKOSA-N 1 1 359.386 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1F ZINC000411735118 512784873 /nfs/dbraw/zinc/78/48/73/512784873.db2.gz JDPHQQRDSDQMMM-CYBMUJFWSA-N 1 1 367.421 2.522 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376365524 512787292 /nfs/dbraw/zinc/78/72/92/512787292.db2.gz FKMXQSDDYUWZIB-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSC[C@@H]2C2CC2)c([N+](=O)[O-])c1 ZINC000411783215 512809270 /nfs/dbraw/zinc/80/92/70/512809270.db2.gz FNAPVHFLQGCUJX-MRXNPFEDSA-N 1 1 365.455 2.759 20 5 FFBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000378639136 512861143 /nfs/dbraw/zinc/86/11/43/512861143.db2.gz DPBGPSSFWATKAO-KBXCAEBGSA-N 1 1 357.410 2.848 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000372453329 512883174 /nfs/dbraw/zinc/88/31/74/512883174.db2.gz CGDLZHRCVVRHHT-LBPRGKRZSA-N 1 1 372.425 2.871 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]2CCCCN12 ZINC000374591067 512906275 /nfs/dbraw/zinc/90/62/75/512906275.db2.gz FYAFROCLMZSBAP-HZPDHXFCSA-N 1 1 372.450 2.961 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412110896 512965568 /nfs/dbraw/zinc/96/55/68/512965568.db2.gz DZWMPAYWSASLAM-ZDUSSCGKSA-N 1 1 367.421 2.666 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075633 512994734 /nfs/dbraw/zinc/99/47/34/512994734.db2.gz ZQSCELOCRODPTN-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075633 512994729 /nfs/dbraw/zinc/99/47/29/512994729.db2.gz ZQSCELOCRODPTN-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090915 512996822 /nfs/dbraw/zinc/99/68/22/512996822.db2.gz VXBOJXNXKQQLSK-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090915 512996826 /nfs/dbraw/zinc/99/68/26/512996826.db2.gz VXBOJXNXKQQLSK-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000412214342 512999464 /nfs/dbraw/zinc/99/94/64/512999464.db2.gz GHQYQPGQECJZFR-MTQWCTHYSA-N 1 1 365.433 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370584898 513004634 /nfs/dbraw/zinc/00/46/34/513004634.db2.gz VYUMSHKPZWOBHS-HNNXBMFYSA-N 1 1 354.410 2.726 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCC[N@H+]2CCCC(C)(C)C2)c1F ZINC000412292335 513027874 /nfs/dbraw/zinc/02/78/74/513027874.db2.gz MDWAQFDYKHREFS-UHFFFAOYSA-N 1 1 367.421 2.523 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000412371751 513056424 /nfs/dbraw/zinc/05/64/24/513056424.db2.gz YQOCRIFTQOZLOO-ITOHMHRPSA-N 1 1 357.454 2.887 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000439684852 513162124 /nfs/dbraw/zinc/16/21/24/513162124.db2.gz MKMUTHFSTGZHNP-MRXNPFEDSA-N 1 1 363.458 2.990 20 5 FFBDMO CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000450391789 513173485 /nfs/dbraw/zinc/17/34/85/513173485.db2.gz RLARFJCHGLYIOZ-AEFFLSMTSA-N 1 1 371.441 2.785 20 5 FFBDMO CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000450391789 513173491 /nfs/dbraw/zinc/17/34/91/513173491.db2.gz RLARFJCHGLYIOZ-AEFFLSMTSA-N 1 1 371.441 2.785 20 5 FFBDMO CCOc1ccccc1C[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)[C@@H](C)C1 ZINC000450497376 513222238 /nfs/dbraw/zinc/22/22/38/513222238.db2.gz CVVKFMYXOWPDNY-AWEZNQCLSA-N 1 1 371.441 2.803 20 5 FFBDMO CCOc1ccccc1C[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)[C@@H](C)C1 ZINC000450497376 513222244 /nfs/dbraw/zinc/22/22/44/513222244.db2.gz CVVKFMYXOWPDNY-AWEZNQCLSA-N 1 1 371.441 2.803 20 5 FFBDMO Cc1nc(N2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)ncc1[N+](=O)[O-] ZINC000450537588 513240442 /nfs/dbraw/zinc/24/04/42/513240442.db2.gz DZGPVLMVAWHSSJ-SJORKVTESA-N 1 1 353.426 2.652 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](CCO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000421403031 513249726 /nfs/dbraw/zinc/24/97/26/513249726.db2.gz WTQGWEVUZOZEQZ-OAHLLOKOSA-N 1 1 358.442 2.980 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044413 513265467 /nfs/dbraw/zinc/26/54/67/513265467.db2.gz UHWNZPVDCTYUHB-YZVOILCLSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044413 513265473 /nfs/dbraw/zinc/26/54/73/513265473.db2.gz UHWNZPVDCTYUHB-YZVOILCLSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044413 513265479 /nfs/dbraw/zinc/26/54/79/513265479.db2.gz UHWNZPVDCTYUHB-YZVOILCLSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429041006 513265592 /nfs/dbraw/zinc/26/55/92/513265592.db2.gz NTDWPAFPWWLPCP-GTACMHHNSA-N 1 1 374.485 2.892 20 5 FFBDMO CC(C)([NH2+]CC(=O)NC(=O)NC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000429225499 513309468 /nfs/dbraw/zinc/30/94/68/513309468.db2.gz GAHJHTSLWNDMMB-UHFFFAOYSA-N 1 1 362.430 2.578 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ccc3ncc([N+](=O)[O-])n3n2)CCC1 ZINC000450708851 513310737 /nfs/dbraw/zinc/31/07/37/513310737.db2.gz DEZNVMDSFKPQBO-UHFFFAOYSA-N 1 1 366.425 2.526 20 5 FFBDMO COC(=O)c1ccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429244380 513314918 /nfs/dbraw/zinc/31/49/18/513314918.db2.gz FWYFWDOAUOLQNS-UHFFFAOYSA-N 1 1 371.393 2.845 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000434439944 513324004 /nfs/dbraw/zinc/32/40/04/513324004.db2.gz WIBOXUGNHXFZIO-HNNXBMFYSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000434444799 513324559 /nfs/dbraw/zinc/32/45/59/513324559.db2.gz FNWZILMWUMUXIT-KRWDZBQOSA-N 1 1 372.469 2.942 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C(C)C ZINC000429357109 513350802 /nfs/dbraw/zinc/35/08/02/513350802.db2.gz XTOVJNRLDRCUPU-HOCLYGCPSA-N 1 1 374.397 2.664 20 5 FFBDMO C[C@@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@@H+](Cc2ccccc2)C1 ZINC000450814449 513352202 /nfs/dbraw/zinc/35/22/02/513352202.db2.gz VHTQNOLYQCKUTP-HNNXBMFYSA-N 1 1 366.425 2.596 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000424997534 513359721 /nfs/dbraw/zinc/35/97/21/513359721.db2.gz CGLKKXWCPWACLL-PKOBYXMFSA-N 1 1 351.406 2.941 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418107571 513375306 /nfs/dbraw/zinc/37/53/06/513375306.db2.gz FBFUFFIGPUELSM-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)CN1CCO ZINC000418107571 513375308 /nfs/dbraw/zinc/37/53/08/513375308.db2.gz FBFUFFIGPUELSM-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)CN1CCO ZINC000418107571 513375312 /nfs/dbraw/zinc/37/53/12/513375312.db2.gz FBFUFFIGPUELSM-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO Cc1c(Br)cc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000421709776 513380433 /nfs/dbraw/zinc/38/04/33/513380433.db2.gz HBFYHPWEZZAFHQ-GFCCVEGCSA-N 1 1 370.247 2.832 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000421709103 513380984 /nfs/dbraw/zinc/38/09/84/513380984.db2.gz CNOXTDNWQKVOHO-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000421711323 513382636 /nfs/dbraw/zinc/38/26/36/513382636.db2.gz OJWHZOZYBYRMBQ-QMMMGPOBSA-N 1 1 362.249 2.585 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000451078588 513502280 /nfs/dbraw/zinc/50/22/80/513502280.db2.gz MXHBCDWFHQXWMW-ZDUSSCGKSA-N 1 1 353.369 2.788 20 5 FFBDMO C[N@@H+]1CCCC(C)(C)[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000447818353 513581299 /nfs/dbraw/zinc/58/12/99/513581299.db2.gz WHGPPLLSQRZIBT-AWEZNQCLSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000447818353 513581308 /nfs/dbraw/zinc/58/13/08/513581308.db2.gz WHGPPLLSQRZIBT-AWEZNQCLSA-N 1 1 355.460 2.531 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H](O)COCc1ccccc1 ZINC000430239857 513594795 /nfs/dbraw/zinc/59/47/95/513594795.db2.gz MXXSPGFIPOKHON-GOSISDBHSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H](O)COCc1ccccc1 ZINC000430239857 513594799 /nfs/dbraw/zinc/59/47/99/513594799.db2.gz MXXSPGFIPOKHON-GOSISDBHSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1cc(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c([N+](=O)[O-])cc1F ZINC000451221629 513604832 /nfs/dbraw/zinc/60/48/32/513604832.db2.gz ZMSXIXCJIGTUTA-UHFFFAOYSA-N 1 1 353.394 2.594 20 5 FFBDMO Cc1c(Br)c(NCCCC[N@H+](C)C2CC2)ncc1[N+](=O)[O-] ZINC000413343659 513605353 /nfs/dbraw/zinc/60/53/53/513605353.db2.gz BNNVKQNZHKAIQZ-UHFFFAOYSA-N 1 1 357.252 2.769 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H](n4ccnn4)C3)o2)c1 ZINC000425521396 513619174 /nfs/dbraw/zinc/61/91/74/513619174.db2.gz ZPBJZBBPKAJBRV-MRXNPFEDSA-N 1 1 368.397 2.721 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@H]3[C@H]3CCCOC3)co2)cc1 ZINC000451302936 513663871 /nfs/dbraw/zinc/66/38/71/513663871.db2.gz LNBRRMVPEVDKEE-QGTPRVQTSA-N 1 1 373.409 2.612 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1COc1ccccc1 ZINC000451310742 513668161 /nfs/dbraw/zinc/66/81/61/513668161.db2.gz GMYZLQOMHCPPQX-DLBZAZTESA-N 1 1 372.421 2.878 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451344439 513689876 /nfs/dbraw/zinc/68/98/76/513689876.db2.gz PQQCJBRYMRLTFB-UXLLHSPISA-N 1 1 361.442 2.857 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000430683738 513721827 /nfs/dbraw/zinc/72/18/27/513721827.db2.gz KUJLCVJSJFLZDT-INIZCTEOSA-N 1 1 361.442 2.663 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000416462478 513783926 /nfs/dbraw/zinc/78/39/26/513783926.db2.gz QPQAACDWGBRDMG-LSDHHAIUSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448590722 513798099 /nfs/dbraw/zinc/79/80/99/513798099.db2.gz DLYUMVATVORGGK-OAHLLOKOSA-N 1 1 361.442 2.938 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000431039545 513812030 /nfs/dbraw/zinc/81/20/30/513812030.db2.gz XNHJQOGRRYNPAG-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448723771 513866495 /nfs/dbraw/zinc/86/64/95/513866495.db2.gz IVAJDXYFKRMOSJ-NWDGAFQWSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC[N@H+]1C ZINC000426209176 513872628 /nfs/dbraw/zinc/87/26/28/513872628.db2.gz HNBBBWYXCAPQAC-HZMBPMFUSA-N 1 1 374.363 2.896 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000448926556 513973967 /nfs/dbraw/zinc/97/39/67/513973967.db2.gz VASZAVZBULFIOV-CQSZACIVSA-N 1 1 369.425 2.732 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(C)(C)CN1CCOCC1 ZINC000443655293 514014304 /nfs/dbraw/zinc/01/43/04/514014304.db2.gz YZLUTFLVPPGSDO-UHFFFAOYSA-N 1 1 365.474 2.654 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])[NH+](C)C ZINC000443926033 514073087 /nfs/dbraw/zinc/07/30/87/514073087.db2.gz ZQYHPEIVYMTUFN-HNNXBMFYSA-N 1 1 373.409 2.645 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432340282 514165133 /nfs/dbraw/zinc/16/51/33/514165133.db2.gz XWOUFXIVTBIYIJ-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO COC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000452089959 514184488 /nfs/dbraw/zinc/18/44/88/514184488.db2.gz RUPQUIYHIGDXHO-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000452089959 514184492 /nfs/dbraw/zinc/18/44/92/514184492.db2.gz RUPQUIYHIGDXHO-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601933 514197519 /nfs/dbraw/zinc/19/75/19/514197519.db2.gz AKIBCHRISHFJPG-BBRMVZONSA-N 1 1 354.410 2.626 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000452121272 514205570 /nfs/dbraw/zinc/20/55/70/514205570.db2.gz SGOZRZBKTKUHJG-ZDUSSCGKSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000449427517 514206314 /nfs/dbraw/zinc/20/63/14/514206314.db2.gz SLWGINYTKIQFPD-DGCLKSJQSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1ccc(CSCC(=O)N[C@H](C)C[N@@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000427483347 514231215 /nfs/dbraw/zinc/23/12/15/514231215.db2.gz FBEHTYGOILUWCS-CYBMUJFWSA-N 1 1 369.487 2.682 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000444770349 514324134 /nfs/dbraw/zinc/32/41/34/514324134.db2.gz BYJWVAQMKFJYQP-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000444770349 514324142 /nfs/dbraw/zinc/32/41/42/514324142.db2.gz BYJWVAQMKFJYQP-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000449752407 514336030 /nfs/dbraw/zinc/33/60/30/514336030.db2.gz FLCCBPCRBFGKJY-IRXDYDNUSA-N 1 1 370.405 2.992 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000449913727 514420644 /nfs/dbraw/zinc/42/06/44/514420644.db2.gz OKYRLABAWGSELY-UHFFFAOYSA-N 1 1 365.405 2.833 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC(OC(C)(C)C)C1 ZINC000420987651 514426247 /nfs/dbraw/zinc/42/62/47/514426247.db2.gz QIAVAIZMPFVLJE-ISXOHVOVSA-N 1 1 352.431 2.612 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000445717364 514510178 /nfs/dbraw/zinc/51/01/78/514510178.db2.gz CSZVITBXTUAUNU-GOSISDBHSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000475086197 514553395 /nfs/dbraw/zinc/55/33/95/514553395.db2.gz PFUHMKZNYMSHCJ-WMZOPIPTSA-N 1 1 373.432 2.738 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000475108204 514559363 /nfs/dbraw/zinc/55/93/63/514559363.db2.gz MQYYKZQZWSXCAK-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000475108204 514559373 /nfs/dbraw/zinc/55/93/73/514559373.db2.gz MQYYKZQZWSXCAK-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458155828 514588533 /nfs/dbraw/zinc/58/85/33/514588533.db2.gz AXNFWQYBHQWMEO-CHWSQXEVSA-N 1 1 369.849 2.864 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000502362852 514626470 /nfs/dbraw/zinc/62/64/70/514626470.db2.gz DAQQUHPHMJVWPV-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000461646112 514682761 /nfs/dbraw/zinc/68/27/61/514682761.db2.gz LDVKVEUHWALXTP-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000475550868 514712581 /nfs/dbraw/zinc/71/25/81/514712581.db2.gz SGDPBKCQTVXLJJ-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COCC[C@@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000502653623 514729360 /nfs/dbraw/zinc/72/93/60/514729360.db2.gz MNXCNBVTVKXZLG-CVEARBPZSA-N 1 1 359.382 2.661 20 5 FFBDMO Cc1cc(N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461946064 514800785 /nfs/dbraw/zinc/80/07/85/514800785.db2.gz LZVZZOHEKYBJTQ-VXGBXAGGSA-N 1 1 361.364 2.813 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000489342750 514807789 /nfs/dbraw/zinc/80/77/89/514807789.db2.gz YJCFBZHKDRFSMR-INIZCTEOSA-N 1 1 351.422 2.810 20 5 FFBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502954785 514857888 /nfs/dbraw/zinc/85/78/88/514857888.db2.gz HYWUNDRSVXUBIF-AWEZNQCLSA-N 1 1 359.430 2.958 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000467214552 514943198 /nfs/dbraw/zinc/94/31/98/514943198.db2.gz CXSLRMOWDWETAC-BMIGLBTASA-N 1 1 352.822 2.530 20 5 FFBDMO C[N@@H+](CCNc1c2cc(Br)ccc2ncc1[N+](=O)[O-])C1CC1 ZINC000480401412 514945253 /nfs/dbraw/zinc/94/52/53/514945253.db2.gz GTEVHINRVGMMOG-UHFFFAOYSA-N 1 1 365.231 2.834 20 5 FFBDMO Nc1c(F)c(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000480582525 515008627 /nfs/dbraw/zinc/00/86/27/515008627.db2.gz UHTOTSOABLXQPA-GASCZTMLSA-N 1 1 356.401 2.884 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000509294656 515112618 /nfs/dbraw/zinc/11/26/18/515112618.db2.gz PXACTGVPQDSBPH-MJBXVCDLSA-N 1 1 369.412 2.947 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000509294656 515112628 /nfs/dbraw/zinc/11/26/28/515112628.db2.gz PXACTGVPQDSBPH-MJBXVCDLSA-N 1 1 369.412 2.947 20 5 FFBDMO CCS[C@@H]1CCCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000480866805 515117832 /nfs/dbraw/zinc/11/78/32/515117832.db2.gz RKUVMKCTISTZMH-NVXWUHKLSA-N 1 1 354.472 2.942 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000462776127 515238803 /nfs/dbraw/zinc/23/88/03/515238803.db2.gz DWOSZURTWAOTNI-QAPCUYQASA-N 1 1 354.410 2.812 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000472460615 515276813 /nfs/dbraw/zinc/27/68/13/515276813.db2.gz DSOFNTWOFDWORE-RDJZCZTQSA-N 1 1 374.485 2.894 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000462950283 515312188 /nfs/dbraw/zinc/31/21/88/515312188.db2.gz ZXPKWRVULBRCIS-AWEZNQCLSA-N 1 1 362.430 2.843 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000468626821 515444109 /nfs/dbraw/zinc/44/41/09/515444109.db2.gz JKVLOQNSLDDQLW-XUDLPTGHSA-N 1 1 360.502 2.861 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000468740937 515497370 /nfs/dbraw/zinc/49/73/70/515497370.db2.gz VERKGYDSJZPMPG-KISGQOJYSA-N 1 1 359.470 2.966 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000468740937 515497378 /nfs/dbraw/zinc/49/73/78/515497378.db2.gz VERKGYDSJZPMPG-KISGQOJYSA-N 1 1 359.470 2.966 20 5 FFBDMO O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457004760 515578080 /nfs/dbraw/zinc/57/80/80/515578080.db2.gz YOTFPDYSPQEJIU-SFHVURJKSA-N 1 1 366.421 2.956 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505572427 515589858 /nfs/dbraw/zinc/58/98/58/515589858.db2.gz KCWAQIARPVJFID-SFHVURJKSA-N 1 1 368.437 2.742 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454644266 515635649 /nfs/dbraw/zinc/63/56/49/515635649.db2.gz OHVKKPSVJDNAMI-HOTGVXAUSA-N 1 1 358.442 2.721 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000457089852 515641255 /nfs/dbraw/zinc/64/12/55/515641255.db2.gz LORTXBXYVJROKS-GFCCVEGCSA-N 1 1 357.357 2.751 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1nc2ccccc2cc1[N+](=O)[O-] ZINC000473519607 515645127 /nfs/dbraw/zinc/64/51/27/515645127.db2.gz NXXAEHTYWUGVES-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505870008 515703375 /nfs/dbraw/zinc/70/33/75/515703375.db2.gz RVLMNYILFIBNFJ-INIZCTEOSA-N 1 1 369.421 2.959 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](COc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000505870008 515703385 /nfs/dbraw/zinc/70/33/85/515703385.db2.gz RVLMNYILFIBNFJ-INIZCTEOSA-N 1 1 369.421 2.959 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)cc1 ZINC000478117436 515706024 /nfs/dbraw/zinc/70/60/24/515706024.db2.gz YOKGEMLRUHTRNA-CYBMUJFWSA-N 1 1 357.414 2.955 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000510906292 515710721 /nfs/dbraw/zinc/71/07/21/515710721.db2.gz XZKAZLMQDAPRRG-CYBMUJFWSA-N 1 1 359.348 2.875 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000494068634 515724501 /nfs/dbraw/zinc/72/45/01/515724501.db2.gz JAFNWAUNPSJCKU-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494070186 515726819 /nfs/dbraw/zinc/72/68/19/515726819.db2.gz VOEDGIWECGYNNV-DNVCBOLYSA-N 1 1 353.422 2.917 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000487026729 515727379 /nfs/dbraw/zinc/72/73/79/515727379.db2.gz KXBZBIWKQOTCRF-KRWDZBQOSA-N 1 1 353.422 2.889 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000487086586 515752975 /nfs/dbraw/zinc/75/29/75/515752975.db2.gz HLCRJKBDDINGTP-GFCCVEGCSA-N 1 1 358.236 2.782 20 5 FFBDMO CC(C)[N@@H+]1CCCC[C@@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O ZINC000487086586 515752970 /nfs/dbraw/zinc/75/29/70/515752970.db2.gz HLCRJKBDDINGTP-GFCCVEGCSA-N 1 1 358.236 2.782 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1cccc2[nH]ccc21 ZINC000511095868 515779084 /nfs/dbraw/zinc/77/90/84/515779084.db2.gz XVEVWADXYLVDEF-MRXNPFEDSA-N 1 1 369.421 2.990 20 5 FFBDMO CN1C(=O)C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)c(F)c1 ZINC000482734460 515786492 /nfs/dbraw/zinc/78/64/92/515786492.db2.gz PVLITDIARYOVNY-CJNGLKHVSA-N 1 1 367.377 2.996 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)c(F)c1 ZINC000494269407 515788862 /nfs/dbraw/zinc/78/88/62/515788862.db2.gz XYWCPGOVEAYKJD-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1ccc2c(c1)OCO2)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511138726 515800433 /nfs/dbraw/zinc/80/04/33/515800433.db2.gz OUOTWODQMDAUJP-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1ccc2c(c1)OCO2)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511138726 515800442 /nfs/dbraw/zinc/80/04/42/515800442.db2.gz OUOTWODQMDAUJP-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H]2COC[C@@H]2OC)cc1OC ZINC000459825761 515832088 /nfs/dbraw/zinc/83/20/88/515832088.db2.gz LNDCYSDTRLFXAP-DFHBCGBQSA-N 1 1 368.430 2.532 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000494600912 515893770 /nfs/dbraw/zinc/89/37/70/515893770.db2.gz WXCKUFIONFYNJV-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000483115959 515935706 /nfs/dbraw/zinc/93/57/06/515935706.db2.gz DMXIYHUAFHIBFI-CRAIPNDOSA-N 1 1 360.385 2.963 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000478733126 515946128 /nfs/dbraw/zinc/94/61/28/515946128.db2.gz AAAWWKLWHGXBQK-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3OC)sc2C1 ZINC000474379889 516020350 /nfs/dbraw/zinc/02/03/50/516020350.db2.gz SUUYKBYCZRCEIS-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3OC)sc2C1 ZINC000474379889 516020360 /nfs/dbraw/zinc/02/03/60/516020360.db2.gz SUUYKBYCZRCEIS-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC(C)[C@H]1CN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000487960525 516053519 /nfs/dbraw/zinc/05/35/19/516053519.db2.gz FJIHAGQBYKWISX-XJKSGUPXSA-N 1 1 359.430 2.978 20 5 FFBDMO CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000507104190 516089906 /nfs/dbraw/zinc/08/99/06/516089906.db2.gz QKKAGYWYICBARL-INIZCTEOSA-N 1 1 373.409 2.964 20 5 FFBDMO CNC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000507104190 516089911 /nfs/dbraw/zinc/08/99/11/516089911.db2.gz QKKAGYWYICBARL-INIZCTEOSA-N 1 1 373.409 2.964 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000460284496 516101132 /nfs/dbraw/zinc/10/11/32/516101132.db2.gz QMMSQBNLMMLPPN-MRXNPFEDSA-N 1 1 356.430 2.546 20 5 FFBDMO C[C@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000488090917 516114850 /nfs/dbraw/zinc/11/48/50/516114850.db2.gz BNLBRDQXGVHLFU-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000488090917 516114856 /nfs/dbraw/zinc/11/48/56/516114856.db2.gz BNLBRDQXGVHLFU-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000507275828 516150847 /nfs/dbraw/zinc/15/08/47/516150847.db2.gz DBUQWXPMBCRISQ-OKILXGFUSA-N 1 1 369.487 2.630 20 5 FFBDMO CCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000470176080 516162731 /nfs/dbraw/zinc/16/27/31/516162731.db2.gz UJTDVWRUPZGNQE-QXSWTLKVSA-N 1 1 352.456 2.897 20 5 FFBDMO CCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000470176080 516162741 /nfs/dbraw/zinc/16/27/41/516162741.db2.gz UJTDVWRUPZGNQE-QXSWTLKVSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000470203754 516171627 /nfs/dbraw/zinc/17/16/27/516171627.db2.gz FBKSNTAYBSCNBY-WEKMIXOTSA-N 1 1 371.359 2.999 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000507618705 516264192 /nfs/dbraw/zinc/26/41/92/516264192.db2.gz SXERDXXWNYOCIL-NVXWUHKLSA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@H]1C[C@@H]1[N@@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747344 516300367 /nfs/dbraw/zinc/30/03/67/516300367.db2.gz FFZJONYWFFOEOW-GVXVVHGQSA-N 1 1 369.263 2.919 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747344 516300371 /nfs/dbraw/zinc/30/03/71/516300371.db2.gz FFZJONYWFFOEOW-GVXVVHGQSA-N 1 1 369.263 2.919 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000497412341 516320812 /nfs/dbraw/zinc/32/08/12/516320812.db2.gz ZFBQZIMHDYGYCF-DOTOQJQBSA-N 1 1 364.405 2.904 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000497481302 516323661 /nfs/dbraw/zinc/32/36/61/516323661.db2.gz HGUHMNYWDKXFDC-CQSZACIVSA-N 1 1 354.838 2.574 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497535600 516325680 /nfs/dbraw/zinc/32/56/80/516325680.db2.gz WDFJCNZPKSNIPR-CQSZACIVSA-N 1 1 369.487 2.921 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000561153975 516411298 /nfs/dbraw/zinc/41/12/98/516411298.db2.gz LUDRSZZYRSJCMM-AWEZNQCLSA-N 1 1 359.430 2.732 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3c[nH]nc3-c3cccs3)CC2)cn1 ZINC000535785554 516508144 /nfs/dbraw/zinc/50/81/44/516508144.db2.gz WWTKNMLNEZODBP-UHFFFAOYSA-N 1 1 370.438 2.764 20 5 FFBDMO COCCSc1ccc([C@@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000540406050 516539818 /nfs/dbraw/zinc/53/98/18/516539818.db2.gz RLHIQHPOPCSXIK-GFCCVEGCSA-N 1 1 350.444 2.918 20 5 FFBDMO C[C@H]1CC[C@@]2(CC[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120677 516598660 /nfs/dbraw/zinc/59/86/60/516598660.db2.gz VYMCLPVTPJTHKJ-WMLDXEAASA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120677 516598669 /nfs/dbraw/zinc/59/86/69/516598669.db2.gz VYMCLPVTPJTHKJ-WMLDXEAASA-N 1 1 352.456 2.881 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000536034835 516599893 /nfs/dbraw/zinc/59/98/93/516599893.db2.gz HTPQBPMMWSWUKB-SFHVURJKSA-N 1 1 364.405 2.852 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000536034835 516599902 /nfs/dbraw/zinc/59/99/02/516599902.db2.gz HTPQBPMMWSWUKB-SFHVURJKSA-N 1 1 364.405 2.852 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000523909705 516606224 /nfs/dbraw/zinc/60/62/24/516606224.db2.gz HFIXVMSWHMGNQL-OAHLLOKOSA-N 1 1 362.474 2.901 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1 ZINC000540687077 516670114 /nfs/dbraw/zinc/67/01/14/516670114.db2.gz FIXBAPGCCAHOKN-KRWDZBQOSA-N 1 1 363.458 2.909 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCCC[C@@H]3[NH+]3CCOCC3)cc2N1 ZINC000531911010 516708594 /nfs/dbraw/zinc/70/85/94/516708594.db2.gz GBIGDYKKLVKKBA-PBHICJAKSA-N 1 1 374.441 2.535 20 5 FFBDMO Cc1cc(C)n(CCC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)n1 ZINC000513763243 516746139 /nfs/dbraw/zinc/74/61/39/516746139.db2.gz WGCXOVQGSVLOLR-GOSISDBHSA-N 1 1 368.441 2.911 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000555114706 516787482 /nfs/dbraw/zinc/78/74/82/516787482.db2.gz JAFXHYNJUUAAPV-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO CCOC(=O)CC(C)(C)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000561866912 516805969 /nfs/dbraw/zinc/80/59/69/516805969.db2.gz KMZODQGQGFKZKG-CQSZACIVSA-N 1 1 364.446 2.846 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879799 516856205 /nfs/dbraw/zinc/85/62/05/516856205.db2.gz UGVOEKONXGITFT-GOEBONIOSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@@H+](C)C[C@H]1C ZINC000525024168 516899322 /nfs/dbraw/zinc/89/93/22/516899322.db2.gz PEYWHOFOWPWRPG-DYEKYZERSA-N 1 1 369.849 2.814 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000562254331 516988537 /nfs/dbraw/zinc/98/85/37/516988537.db2.gz OZTYXEAJYXSPGO-CQSZACIVSA-N 1 1 364.446 2.619 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](CCOCCOc2ccccc2)CC1 ZINC000532463976 516988861 /nfs/dbraw/zinc/98/88/61/516988861.db2.gz PIJDVSUMKLCBHE-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000532583157 517046249 /nfs/dbraw/zinc/04/62/49/517046249.db2.gz VFWURGRWDVZEHR-KRWDZBQOSA-N 1 1 356.426 2.961 20 5 FFBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCN(C2CC2)C1 ZINC000532583157 517046256 /nfs/dbraw/zinc/04/62/56/517046256.db2.gz VFWURGRWDVZEHR-KRWDZBQOSA-N 1 1 356.426 2.961 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCN(C2CC2)C1 ZINC000532583157 517046264 /nfs/dbraw/zinc/04/62/64/517046264.db2.gz VFWURGRWDVZEHR-KRWDZBQOSA-N 1 1 356.426 2.961 20 5 FFBDMO CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000548692502 517148236 /nfs/dbraw/zinc/14/82/36/517148236.db2.gz PFQWEZQHMPMGQW-INIZCTEOSA-N 1 1 361.445 2.990 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552252769 517162343 /nfs/dbraw/zinc/16/23/43/517162343.db2.gz WQSOGEXHGRHCKE-MJGOQNOKSA-N 1 1 366.421 2.783 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](CS(C)(=O)=O)C1 ZINC000552274509 517174033 /nfs/dbraw/zinc/17/40/33/517174033.db2.gz XRICHCTYSYLOPL-MBSJSRAVSA-N 1 1 352.456 2.755 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](CS(C)(=O)=O)C1 ZINC000552274509 517174040 /nfs/dbraw/zinc/17/40/40/517174040.db2.gz XRICHCTYSYLOPL-MBSJSRAVSA-N 1 1 352.456 2.755 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCO[C@@H](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552282317 517177118 /nfs/dbraw/zinc/17/71/18/517177118.db2.gz AFVRJWJZRFPKQA-KBAYOESNSA-N 1 1 356.426 2.965 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000541721610 517187629 /nfs/dbraw/zinc/18/76/29/517187629.db2.gz VGFMWKPXAYPFTO-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000541785066 517215176 /nfs/dbraw/zinc/21/51/76/517215176.db2.gz FAKTVGCWEAIOKS-CQSZACIVSA-N 1 1 368.409 2.699 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969884 517229484 /nfs/dbraw/zinc/22/94/84/517229484.db2.gz IDOFYNKBHPYXSB-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969884 517229493 /nfs/dbraw/zinc/22/94/93/517229493.db2.gz IDOFYNKBHPYXSB-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000532988300 517238222 /nfs/dbraw/zinc/23/82/22/517238222.db2.gz ACCDSAPUAUPOAG-QWHCGFSZSA-N 1 1 368.865 2.991 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCc2ccc(O)cc2C1 ZINC000533071448 517279123 /nfs/dbraw/zinc/27/91/23/517279123.db2.gz FOQJPWRSEZIGOQ-UHFFFAOYSA-N 1 1 369.377 2.657 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCc2ccc(O)cc2C1 ZINC000533071448 517279133 /nfs/dbraw/zinc/27/91/33/517279133.db2.gz FOQJPWRSEZIGOQ-UHFFFAOYSA-N 1 1 369.377 2.657 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3CCC4(CCCCC4)O3)CC2)cn1 ZINC000526964534 517415860 /nfs/dbraw/zinc/41/58/60/517415860.db2.gz GQUZNJGZOQTWRH-KRWDZBQOSA-N 1 1 360.458 2.994 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000556521444 517475796 /nfs/dbraw/zinc/47/57/96/517475796.db2.gz WVKAUKSAYNDZNK-ZBFHGGJFSA-N 1 1 361.398 2.536 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000556565020 517495043 /nfs/dbraw/zinc/49/50/43/517495043.db2.gz XSSYAYKWDJHIJV-NVXWUHKLSA-N 1 1 360.458 2.826 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000538344718 517577626 /nfs/dbraw/zinc/57/76/26/517577626.db2.gz VFWWYCBXERXOIC-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000556740397 517620704 /nfs/dbraw/zinc/62/07/04/517620704.db2.gz WXHKFOYOMDOGLK-JTQLQIEISA-N 1 1 371.235 2.821 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000563108033 517663933 /nfs/dbraw/zinc/66/39/33/517663933.db2.gz SVBRMXIQPDZAEI-GOSISDBHSA-N 1 1 369.421 2.627 20 5 FFBDMO C[NH+](C)CCOc1cc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])ccn1 ZINC000521370496 517708254 /nfs/dbraw/zinc/70/82/54/517708254.db2.gz VVSPKIUYPMQHRK-KRWDZBQOSA-N 1 1 356.426 2.707 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000560336515 517711019 /nfs/dbraw/zinc/71/10/19/517711019.db2.gz NZKGOHLRWPNWCD-OAHLLOKOSA-N 1 1 362.474 2.974 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000546540139 517715907 /nfs/dbraw/zinc/71/59/07/517715907.db2.gz SRKHJYDXAPSIHT-CHWSQXEVSA-N 1 1 351.422 2.953 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538791497 517781490 /nfs/dbraw/zinc/78/14/90/517781490.db2.gz ADRPXEZOQUWHEJ-QAPCUYQASA-N 1 1 356.426 2.996 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000549918769 517782031 /nfs/dbraw/zinc/78/20/31/517782031.db2.gz ITXVVPURZFPSCH-HNNXBMFYSA-N 1 1 357.332 2.716 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000549918769 517782039 /nfs/dbraw/zinc/78/20/39/517782039.db2.gz ITXVVPURZFPSCH-HNNXBMFYSA-N 1 1 357.332 2.716 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000557025568 517810784 /nfs/dbraw/zinc/81/07/84/517810784.db2.gz QEFXOKMEBYVMOB-LJQANCHMSA-N 1 1 369.421 2.733 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918427 517843967 /nfs/dbraw/zinc/84/39/67/517843967.db2.gz ARSTYYUFTKZKPV-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918427 517843976 /nfs/dbraw/zinc/84/39/76/517843976.db2.gz ARSTYYUFTKZKPV-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000553693535 517856539 /nfs/dbraw/zinc/85/65/39/517856539.db2.gz CEGAMLZBOFTSCM-KRWDZBQOSA-N 1 1 374.485 2.802 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534516829 517923056 /nfs/dbraw/zinc/92/30/56/517923056.db2.gz VITWQEXIQBCVHF-CABCVRRESA-N 1 1 360.458 2.783 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000534858657 518059640 /nfs/dbraw/zinc/05/96/40/518059640.db2.gz ISGMLUYABZYGNS-GDBMZVCRSA-N 1 1 360.801 2.818 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000534858657 518059651 /nfs/dbraw/zinc/05/96/51/518059651.db2.gz ISGMLUYABZYGNS-GDBMZVCRSA-N 1 1 360.801 2.818 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558266 518111564 /nfs/dbraw/zinc/11/15/64/518111564.db2.gz FPNFCBZDYRRKKI-SUMWQHHRSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558266 518111568 /nfs/dbraw/zinc/11/15/68/518111568.db2.gz FPNFCBZDYRRKKI-SUMWQHHRSA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000578569178 518269215 /nfs/dbraw/zinc/26/92/15/518269215.db2.gz MJMZNQQUDIBHSM-HIFRSBDPSA-N 1 1 373.457 2.743 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000575768546 518273722 /nfs/dbraw/zinc/27/37/22/518273722.db2.gz IEVAUCDOMIVESU-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000575768546 518273728 /nfs/dbraw/zinc/27/37/28/518273728.db2.gz IEVAUCDOMIVESU-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000584409118 518327137 /nfs/dbraw/zinc/32/71/37/518327137.db2.gz LYJSKNOPMKYMCL-HOCLYGCPSA-N 1 1 350.415 2.873 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000564361329 518417839 /nfs/dbraw/zinc/41/78/39/518417839.db2.gz CMZNPHLRBOMLNY-ZDUSSCGKSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000564361329 518417844 /nfs/dbraw/zinc/41/78/44/518417844.db2.gz CMZNPHLRBOMLNY-ZDUSSCGKSA-N 1 1 360.439 2.885 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000570253857 518516376 /nfs/dbraw/zinc/51/63/76/518516376.db2.gz VIMILLWGYXXHNY-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO CCCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113621 518528515 /nfs/dbraw/zinc/52/85/15/518528515.db2.gz UACVBLCPCXKJOH-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113621 518528523 /nfs/dbraw/zinc/52/85/23/518528523.db2.gz UACVBLCPCXKJOH-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113621 518528527 /nfs/dbraw/zinc/52/85/27/518528527.db2.gz UACVBLCPCXKJOH-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000582177521 518623641 /nfs/dbraw/zinc/62/36/41/518623641.db2.gz FUMFJBGCFZRNNI-CYBMUJFWSA-N 1 1 373.400 2.773 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000576509616 518627728 /nfs/dbraw/zinc/62/77/28/518627728.db2.gz BSVHKDVADXVTQD-OKILXGFUSA-N 1 1 364.446 2.730 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000576509616 518627734 /nfs/dbraw/zinc/62/77/34/518627734.db2.gz BSVHKDVADXVTQD-OKILXGFUSA-N 1 1 364.446 2.730 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000564917211 518691415 /nfs/dbraw/zinc/69/14/15/518691415.db2.gz ZKYYICYADDGLBE-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000564917211 518691422 /nfs/dbraw/zinc/69/14/22/518691422.db2.gz ZKYYICYADDGLBE-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000570653541 518714293 /nfs/dbraw/zinc/71/42/93/518714293.db2.gz ZALFDOCXMKLFSU-HOTGVXAUSA-N 1 1 357.410 2.651 20 5 FFBDMO COc1ccc(CNC(=O)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000565183718 518830890 /nfs/dbraw/zinc/83/08/90/518830890.db2.gz XIGKNLNQYLFXIW-KRWDZBQOSA-N 1 1 369.421 2.742 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164132 518935658 /nfs/dbraw/zinc/93/56/58/518935658.db2.gz FHMNGIAGYHHVBK-QFBILLFUSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164132 518935659 /nfs/dbraw/zinc/93/56/59/518935659.db2.gz FHMNGIAGYHHVBK-QFBILLFUSA-N 1 1 366.421 2.975 20 5 FFBDMO COc1ncccc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000589350865 518986683 /nfs/dbraw/zinc/98/66/83/518986683.db2.gz QBSIOSDBQMOTHJ-QGZVFWFLSA-N 1 1 367.409 2.654 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1(C)C ZINC000565548025 519012898 /nfs/dbraw/zinc/01/28/98/519012898.db2.gz FEWOSPVLSBWEIC-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1(C)C ZINC000565548025 519012904 /nfs/dbraw/zinc/01/29/04/519012904.db2.gz FEWOSPVLSBWEIC-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO NC(=O)c1cccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000574304254 519089869 /nfs/dbraw/zinc/08/98/69/519089869.db2.gz XHUZDTRFTCEYDG-HNNXBMFYSA-N 1 1 354.410 2.628 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000565778048 519127380 /nfs/dbraw/zinc/12/73/80/519127380.db2.gz NRWMANNDXLCVAH-WMLDXEAASA-N 1 1 368.437 2.817 20 5 FFBDMO COc1ccc(-c2ccc(CN3CC[C@H]4C[N@@H+](C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052743 519137431 /nfs/dbraw/zinc/13/74/31/519137431.db2.gz KENXLDSQUBEHBK-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]4CN(C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052743 519137438 /nfs/dbraw/zinc/13/74/38/519137438.db2.gz KENXLDSQUBEHBK-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H]4CN(C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052743 519137450 /nfs/dbraw/zinc/13/74/50/519137450.db2.gz KENXLDSQUBEHBK-SCLBCKFNSA-N 1 1 357.410 2.999 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000580891097 519411958 /nfs/dbraw/zinc/41/19/58/519411958.db2.gz RVRHIITUFWVOPS-HNNXBMFYSA-N 1 1 369.487 2.652 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](CCC(=O)OC(C)(C)C)C1 ZINC000602847556 519924850 /nfs/dbraw/zinc/92/48/50/519924850.db2.gz WBKOAXBHGOCMNO-OAHLLOKOSA-N 1 1 366.462 2.934 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21 ZINC000602997443 520013511 /nfs/dbraw/zinc/01/35/11/520013511.db2.gz JXRUGUZBSPVZQT-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(F)c1N1CCOCC1 ZINC000594546560 520019308 /nfs/dbraw/zinc/01/93/08/520019308.db2.gz QXCBIEZVVQGJOM-UONOGXRCSA-N 1 1 364.421 2.609 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000600252630 520159669 /nfs/dbraw/zinc/15/96/69/520159669.db2.gz KSLFAQJHVUYXLG-GOSISDBHSA-N 1 1 356.426 2.906 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1C ZINC000594793070 520159707 /nfs/dbraw/zinc/15/97/07/520159707.db2.gz UETZBILHRXJKET-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000594854520 520191191 /nfs/dbraw/zinc/19/11/91/520191191.db2.gz OYRJRVDCIWWSTG-AWEZNQCLSA-N 1 1 367.471 2.589 20 5 FFBDMO COc1nccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)n1 ZINC000592132543 520206648 /nfs/dbraw/zinc/20/66/48/520206648.db2.gz IRZKAIIBOIZVID-QAQDUYKDSA-N 1 1 372.425 2.699 20 5 FFBDMO COc1nccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)n1 ZINC000592132543 520206656 /nfs/dbraw/zinc/20/66/56/520206656.db2.gz IRZKAIIBOIZVID-QAQDUYKDSA-N 1 1 372.425 2.699 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000609196596 520228089 /nfs/dbraw/zinc/22/80/89/520228089.db2.gz ZRWIMUSZIXRFDF-CQSZACIVSA-N 1 1 369.487 2.700 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000609269516 520248451 /nfs/dbraw/zinc/24/84/51/520248451.db2.gz SDLKWNUJLZLZAL-OAHLLOKOSA-N 1 1 363.458 2.733 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000609268920 520249348 /nfs/dbraw/zinc/24/93/48/520249348.db2.gz IPNBFCBCKZCTQT-CYBMUJFWSA-N 1 1 363.439 2.650 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 ZINC000609268920 520249354 /nfs/dbraw/zinc/24/93/54/520249354.db2.gz IPNBFCBCKZCTQT-CYBMUJFWSA-N 1 1 363.439 2.650 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)C(=O)NCc1ccccc1 ZINC000595006253 520252334 /nfs/dbraw/zinc/25/23/34/520252334.db2.gz HSDPCWZNAHDMMO-KGLIPLIRSA-N 1 1 357.410 2.959 20 5 FFBDMO COc1ccc(CNC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595004563 520252655 /nfs/dbraw/zinc/25/26/55/520252655.db2.gz BGQVGVSYYMCGTR-ZDUSSCGKSA-N 1 1 373.409 2.579 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)nc1 ZINC000595004920 520253556 /nfs/dbraw/zinc/25/35/56/520253556.db2.gz UGRXELZODYFVNP-CQSZACIVSA-N 1 1 372.425 2.686 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000609310212 520270524 /nfs/dbraw/zinc/27/05/24/520270524.db2.gz XIHMFEWEPXZRJV-INIZCTEOSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000597859318 520286167 /nfs/dbraw/zinc/28/61/67/520286167.db2.gz UKJNVFLEUNDRQU-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO CCOc1ccc([C@H](C)NC2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106581 520297520 /nfs/dbraw/zinc/29/75/20/520297520.db2.gz VKZIXAQCNATUIO-WMLDXEAASA-N 1 1 363.458 2.897 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(CNc3ccsc3[N+](=O)[O-])c2)C1 ZINC000609384126 520300675 /nfs/dbraw/zinc/30/06/75/520300675.db2.gz RDLGSLGCQZILKF-HNNXBMFYSA-N 1 1 374.466 2.966 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000597925879 520326114 /nfs/dbraw/zinc/32/61/14/520326114.db2.gz XPVVBJRJTDAJIZ-NSHDSACASA-N 1 1 370.247 2.960 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@@H]1CC[N@@H+](C)C1 ZINC000597945056 520344322 /nfs/dbraw/zinc/34/43/22/520344322.db2.gz HFPXRLXJPWASII-LLVKDONJSA-N 1 1 370.247 2.832 20 5 FFBDMO CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597945596 520344426 /nfs/dbraw/zinc/34/44/26/520344426.db2.gz JKZIBDDBMDKMEW-CYBMUJFWSA-N 1 1 355.822 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cnc4ccccc4n3)C2)nc1 ZINC000595371689 520435597 /nfs/dbraw/zinc/43/55/97/520435597.db2.gz RCBYLGMTOOSOGM-ZDUSSCGKSA-N 1 1 350.382 2.619 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000592528487 520441236 /nfs/dbraw/zinc/44/12/36/520441236.db2.gz SAROHBWPPXYCGT-CSPWOOARSA-N 1 1 357.332 2.608 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])ccc1OCCO ZINC000595414983 520456308 /nfs/dbraw/zinc/45/63/08/520456308.db2.gz PGHKCKDUACDMAY-GFCCVEGCSA-N 1 1 364.373 2.964 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595467545 520491507 /nfs/dbraw/zinc/49/15/07/520491507.db2.gz HPUYAJITRGFUHJ-MRXNPFEDSA-N 1 1 360.458 2.844 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@H+]2CCCC[C@H]2CC)c1[N+](=O)[O-] ZINC000609963710 520492123 /nfs/dbraw/zinc/49/21/23/520492123.db2.gz HVQZWASCAOEMCD-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000610004364 520503194 /nfs/dbraw/zinc/50/31/94/520503194.db2.gz XWVAURPOMIDKMI-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000595504256 520515363 /nfs/dbraw/zinc/51/53/63/520515363.db2.gz HIYDEAJGCBBYOG-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000595505294 520515492 /nfs/dbraw/zinc/51/54/92/520515492.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000595505294 520515496 /nfs/dbraw/zinc/51/54/96/520515496.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@]2(CC[NH+](C)C2)C1 ZINC000595505294 520515509 /nfs/dbraw/zinc/51/55/09/520515509.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@]2(CC[N@@H+](C)C2)C1 ZINC000595505294 520515513 /nfs/dbraw/zinc/51/55/13/520515513.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@]2(CC[N@H+](C)C2)C1 ZINC000595505294 520515519 /nfs/dbraw/zinc/51/55/19/520515519.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000595505294 520515524 /nfs/dbraw/zinc/51/55/24/520515524.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@]2(CCN(C)C2)C1 ZINC000595505294 520515532 /nfs/dbraw/zinc/51/55/32/520515532.db2.gz RMTSDZSXJRZFED-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595576541 520564475 /nfs/dbraw/zinc/56/44/75/520564475.db2.gz ZQOBAENQJMWICJ-QGZVFWFLSA-N 1 1 360.458 2.559 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000610200269 520576579 /nfs/dbraw/zinc/57/65/79/520576579.db2.gz WOBIBWXIASNXCM-NHYWBVRUSA-N 1 1 363.443 2.501 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601002758 520588300 /nfs/dbraw/zinc/58/83/00/520588300.db2.gz UXRQVFQTKVWJLN-AWEZNQCLSA-N 1 1 356.426 2.974 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670799 520636901 /nfs/dbraw/zinc/63/69/01/520636901.db2.gz DLUZKWOKUDSBLL-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670799 520636907 /nfs/dbraw/zinc/63/69/07/520636907.db2.gz DLUZKWOKUDSBLL-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595683400 520646788 /nfs/dbraw/zinc/64/67/88/520646788.db2.gz IONNRPYZFZINQM-SFHVURJKSA-N 1 1 373.409 2.828 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601147261 520660427 /nfs/dbraw/zinc/66/04/27/520660427.db2.gz XKQHSZKYDQJYQN-ZIAGYGMSSA-N 1 1 359.382 2.690 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000593012741 520683925 /nfs/dbraw/zinc/68/39/25/520683925.db2.gz YIGAHXAHLDCRKY-QGZVFWFLSA-N 1 1 357.385 2.667 20 5 FFBDMO CC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000593022783 520689767 /nfs/dbraw/zinc/68/97/67/520689767.db2.gz KSFAOIINHHCJJH-HNNXBMFYSA-N 1 1 360.414 2.973 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CO)c1cccc(Cl)c1Cl ZINC000595750021 520697872 /nfs/dbraw/zinc/69/78/72/520697872.db2.gz QDGOJWANUBXHFM-LBPRGKRZSA-N 1 1 359.213 2.764 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CO)c1cccc(Cl)c1Cl ZINC000595750021 520697874 /nfs/dbraw/zinc/69/78/74/520697874.db2.gz QDGOJWANUBXHFM-LBPRGKRZSA-N 1 1 359.213 2.764 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C2(O)CC2)CC1 ZINC000593049295 520707225 /nfs/dbraw/zinc/70/72/25/520707225.db2.gz KRJMDTPJJRMNKM-GFCCVEGCSA-N 1 1 358.398 2.943 20 5 FFBDMO COc1cc(C[NH+]2CCC(C3(O)CC3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000593051031 520709794 /nfs/dbraw/zinc/70/97/94/520709794.db2.gz RUMKRQRYNALROT-UHFFFAOYSA-N 1 1 372.368 2.942 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000610574826 520745038 /nfs/dbraw/zinc/74/50/38/520745038.db2.gz KNFUDDIXUVKMGD-RUZDIDTESA-N 1 1 364.423 2.639 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000598627704 520752100 /nfs/dbraw/zinc/75/21/00/520752100.db2.gz XQUMAXHIDPYDHV-XJKSGUPXSA-N 1 1 370.409 2.851 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914419 520818542 /nfs/dbraw/zinc/81/85/42/520818542.db2.gz HFXHEEOVHNWWTC-PIGZYNQJSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914419 520818549 /nfs/dbraw/zinc/81/85/49/520818549.db2.gz HFXHEEOVHNWWTC-PIGZYNQJSA-N 1 1 371.384 2.976 20 5 FFBDMO NC(=O)c1cc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596079653 520899341 /nfs/dbraw/zinc/89/93/41/520899341.db2.gz VBXNHWIODBTYRA-INIZCTEOSA-N 1 1 354.410 2.770 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000593316000 520902716 /nfs/dbraw/zinc/90/27/16/520902716.db2.gz OKTRDCMNEGDRMU-CPUCHLNUSA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNc3cc[nH]c(=O)c3[N+](=O)[O-])c2)CCO1 ZINC000596087635 520903834 /nfs/dbraw/zinc/90/38/34/520903834.db2.gz IZAXVQHKBSGYID-ZDUSSCGKSA-N 1 1 358.398 2.528 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNc3cc[nH]c(=O)c3[N+](=O)[O-])c2)CCO1 ZINC000596087635 520903840 /nfs/dbraw/zinc/90/38/40/520903840.db2.gz IZAXVQHKBSGYID-ZDUSSCGKSA-N 1 1 358.398 2.528 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596102879 520912931 /nfs/dbraw/zinc/91/29/31/520912931.db2.gz SDVZZNCNECIWJA-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@H+](CCCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596102879 520912939 /nfs/dbraw/zinc/91/29/39/520912939.db2.gz SDVZZNCNECIWJA-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596102879 520912945 /nfs/dbraw/zinc/91/29/45/520912945.db2.gz SDVZZNCNECIWJA-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593331257 520914293 /nfs/dbraw/zinc/91/42/93/520914293.db2.gz QQXZJVGZQQZTPH-IBGZPJMESA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593331257 520914299 /nfs/dbraw/zinc/91/42/99/520914299.db2.gz QQXZJVGZQQZTPH-IBGZPJMESA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596127578 520929502 /nfs/dbraw/zinc/92/95/02/520929502.db2.gz ANIHFDVHJCCEGI-UHFFFAOYSA-N 1 1 372.263 2.640 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000593418640 520982233 /nfs/dbraw/zinc/98/22/33/520982233.db2.gz IOKYTFADJZPHRH-UHFFFAOYSA-N 1 1 351.422 2.855 20 5 FFBDMO CC(=O)N1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000611225014 521046444 /nfs/dbraw/zinc/04/64/44/521046444.db2.gz BHAAWPWJCFMSNL-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO CC(=O)N1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC000611225014 521046453 /nfs/dbraw/zinc/04/64/53/521046453.db2.gz BHAAWPWJCFMSNL-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C(F)F)CC1 ZINC000601971651 521048151 /nfs/dbraw/zinc/04/81/51/521048151.db2.gz DHMWTDXJNWNXMZ-AWEZNQCLSA-N 1 1 357.357 2.588 20 5 FFBDMO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cc([N+](=O)[O-])c[nH]1 ZINC000596485472 521094699 /nfs/dbraw/zinc/09/46/99/521094699.db2.gz JNIRVQNOWDLOLE-INIZCTEOSA-N 1 1 368.437 2.955 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350405 521112541 /nfs/dbraw/zinc/11/25/41/521112541.db2.gz LACVHEBUQMJPKX-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350405 521112547 /nfs/dbraw/zinc/11/25/47/521112547.db2.gz LACVHEBUQMJPKX-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@@H]2CCCC[N@H+]2CCO)C(F)(F)F)cc1 ZINC000593712021 521169251 /nfs/dbraw/zinc/16/92/51/521169251.db2.gz GOTKWBYNNHLOMT-GJZGRUSLSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@@H]2CCCC[N@@H+]2CCO)C(F)(F)F)cc1 ZINC000593712021 521169261 /nfs/dbraw/zinc/16/92/61/521169261.db2.gz GOTKWBYNNHLOMT-GJZGRUSLSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@@H]2CCC[N@@H+]2CCCO)C(F)(F)F)cc1 ZINC000593713128 521170041 /nfs/dbraw/zinc/17/00/41/521170041.db2.gz UXAFWIIPHFVWOZ-LSDHHAIUSA-N 1 1 361.364 2.635 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CO)CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000611560772 521219382 /nfs/dbraw/zinc/21/93/82/521219382.db2.gz RYLSHGZURWDQBX-QGZVFWFLSA-N 1 1 358.442 2.950 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000611560787 521219585 /nfs/dbraw/zinc/21/95/85/521219585.db2.gz XHRDTQNPCKGQBE-LMMKCTJWSA-N 1 1 358.442 2.949 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)nc1 ZINC000599443104 521228400 /nfs/dbraw/zinc/22/84/00/521228400.db2.gz IWSWETAZRKSKNA-UHFFFAOYSA-N 1 1 359.382 2.677 20 5 FFBDMO C[NH+](C)C[C@@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c(Cl)c1 ZINC000599628989 521342821 /nfs/dbraw/zinc/34/28/21/521342821.db2.gz WKYKXLUZOSUFMX-OAHLLOKOSA-N 1 1 372.256 2.991 20 5 FFBDMO CC1(C)[C@@H](c2cccc(F)c2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599629781 521342875 /nfs/dbraw/zinc/34/28/75/521342875.db2.gz MHPFWEWUHGKZAV-DLBZAZTESA-N 1 1 362.405 2.559 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2cc(C(F)(F)F)ccc2C1 ZINC000599635181 521346824 /nfs/dbraw/zinc/34/68/24/521346824.db2.gz OAXSHXPXYDRBSV-UHFFFAOYSA-N 1 1 367.327 2.834 20 5 FFBDMO COc1cc(C[N@H+]2CCCCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000594016658 521350700 /nfs/dbraw/zinc/35/07/00/521350700.db2.gz CIELSRGHXXFCRI-ZDUSSCGKSA-N 1 1 374.384 2.984 20 5 FFBDMO COc1cccc2c1C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000599645608 521357642 /nfs/dbraw/zinc/35/76/42/521357642.db2.gz QQILPBRPABOARX-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO COc1cccc2c1C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000599645608 521357649 /nfs/dbraw/zinc/35/76/49/521357649.db2.gz QQILPBRPABOARX-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731741 521434832 /nfs/dbraw/zinc/43/48/32/521434832.db2.gz RAHWKOXGYKGHMJ-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731741 521434842 /nfs/dbraw/zinc/43/48/42/521434842.db2.gz RAHWKOXGYKGHMJ-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO COc1ccc(NC(=O)[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000599745774 521444094 /nfs/dbraw/zinc/44/40/94/521444094.db2.gz YMJNIJGENAAERN-JKSUJKDBSA-N 1 1 355.394 2.887 20 5 FFBDMO COc1cc(F)cc(OC)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602639411 521451500 /nfs/dbraw/zinc/45/15/00/521451500.db2.gz IKESXQJHJGULED-UHFFFAOYSA-N 1 1 364.377 2.785 20 5 FFBDMO C[N@@H+]1CCN(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000602653090 521459018 /nfs/dbraw/zinc/45/90/18/521459018.db2.gz ARRRIZSWGJCNOC-UHFFFAOYSA-N 1 1 374.407 2.729 20 5 FFBDMO C[N@H+]1CCN(CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000602653090 521459023 /nfs/dbraw/zinc/45/90/23/521459023.db2.gz ARRRIZSWGJCNOC-UHFFFAOYSA-N 1 1 374.407 2.729 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000594198967 521464181 /nfs/dbraw/zinc/46/41/81/521464181.db2.gz WQICGJKXWJUHKM-ZIAGYGMSSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000594198700 521464496 /nfs/dbraw/zinc/46/44/96/521464496.db2.gz VCPGVBPGRAHVAS-HOTGVXAUSA-N 1 1 369.425 2.527 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)c1 ZINC000619254079 521473091 /nfs/dbraw/zinc/47/30/91/521473091.db2.gz HTDHOQWOFLLHGD-UKRRQHHQSA-N 1 1 353.419 2.575 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCC[N@@H+](CCCO)C1 ZINC000602675884 521474542 /nfs/dbraw/zinc/47/45/42/521474542.db2.gz WPBRABFSADBYKG-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN[C@H]1CCC[N@H+](CCCO)C1 ZINC000602675884 521474550 /nfs/dbraw/zinc/47/45/50/521474550.db2.gz WPBRABFSADBYKG-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](CCC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1 ZINC000602693474 521481100 /nfs/dbraw/zinc/48/11/00/521481100.db2.gz MOAVKQHNLYURAL-ZDUSSCGKSA-N 1 1 352.435 2.662 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000602709658 521488852 /nfs/dbraw/zinc/48/88/52/521488852.db2.gz OSAPATYYPRAZQH-AWEZNQCLSA-N 1 1 359.348 2.520 20 5 FFBDMO CCS(=O)(=O)C1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602717652 521492902 /nfs/dbraw/zinc/49/29/02/521492902.db2.gz IJZHUFYWAWFCMO-UHFFFAOYSA-N 1 1 366.361 2.671 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](OCc4ccccn4)C3)nc2c1 ZINC000602716685 521493370 /nfs/dbraw/zinc/49/33/70/521493370.db2.gz WPNJJYXGVHEJRQ-OAHLLOKOSA-N 1 1 354.366 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](OCc4ccccn4)C3)nc2c1 ZINC000602716685 521493376 /nfs/dbraw/zinc/49/33/76/521493376.db2.gz WPNJJYXGVHEJRQ-OAHLLOKOSA-N 1 1 354.366 2.922 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599830057 521497338 /nfs/dbraw/zinc/49/73/38/521497338.db2.gz PSJYDOXQCZAVNY-ZDUSSCGKSA-N 1 1 357.414 2.996 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000599831192 521500200 /nfs/dbraw/zinc/50/02/00/521500200.db2.gz PQNDBQBVFYTTCI-CHWSQXEVSA-N 1 1 355.398 2.891 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000597102543 521507604 /nfs/dbraw/zinc/50/76/04/521507604.db2.gz XUCAYUCKMYLIEO-MFKMUULPSA-N 1 1 367.837 2.778 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597103914 521509762 /nfs/dbraw/zinc/50/97/62/521509762.db2.gz MQUMWIRNVRHAFU-MWLCHTKSSA-N 1 1 355.826 2.777 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[NH+]([C@H](C)c2cccc(F)c2)CC1 ZINC000602797752 521537629 /nfs/dbraw/zinc/53/76/29/521537629.db2.gz DHQRBVFZYZMXOI-CQSZACIVSA-N 1 1 361.421 2.618 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000602797752 521537634 /nfs/dbraw/zinc/53/76/34/521537634.db2.gz DHQRBVFZYZMXOI-CQSZACIVSA-N 1 1 361.421 2.618 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@H]2N1 ZINC000597207818 521575394 /nfs/dbraw/zinc/57/53/94/521575394.db2.gz VTRRKYDXDPBJHP-WMLDXEAASA-N 1 1 355.394 2.955 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000619863437 521909778 /nfs/dbraw/zinc/90/97/78/521909778.db2.gz FUDKKTIACPVLER-QFBILLFUSA-N 1 1 374.441 2.625 20 5 FFBDMO COc1ccc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000027334250 536748707 /nfs/dbraw/zinc/74/87/07/536748707.db2.gz KBXXTPWBVFGCQK-OAHLLOKOSA-N 1 1 359.382 2.763 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@H]1c1ccccc1 ZINC000826028545 607967809 /nfs/dbraw/zinc/96/78/09/607967809.db2.gz CBLQFYPAKILVJE-IAGOWNOFSA-N 1 1 365.397 2.632 20 5 FFBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1cccc(-c2nn[nH]n2)c1 ZINC000825914625 608521473 /nfs/dbraw/zinc/52/14/73/608521473.db2.gz MBDXBFFYUKUNIV-UITAMQMPSA-N 1 1 350.382 2.920 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723558 720350467 /nfs/dbraw/zinc/35/04/67/720350467.db2.gz HYBPQQIBCATRMQ-KBPBESRZSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723930 720368254 /nfs/dbraw/zinc/36/82/54/720368254.db2.gz IDIJMOKSVQGAQY-CABCVRRESA-N 1 1 359.817 2.891 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000154081809 728795803 /nfs/dbraw/zinc/79/58/03/728795803.db2.gz VKWIQTHAOWOYFJ-UHFFFAOYSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000897990799 735301223 /nfs/dbraw/zinc/30/12/23/735301223.db2.gz ZFNVRMJMCSRHDE-GFCCVEGCSA-N 1 1 364.789 2.856 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000778888064 738419166 /nfs/dbraw/zinc/41/91/66/738419166.db2.gz QFJKYDLDXAYOTK-UHFFFAOYSA-N 1 1 355.297 2.948 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778943659 738423354 /nfs/dbraw/zinc/42/33/54/738423354.db2.gz HEWBRINQZMPARM-ZDUSSCGKSA-N 1 1 351.403 2.702 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](NC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778943659 738423355 /nfs/dbraw/zinc/42/33/55/738423355.db2.gz HEWBRINQZMPARM-ZDUSSCGKSA-N 1 1 351.403 2.702 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000856763167 730355830 /nfs/dbraw/zinc/35/58/30/730355830.db2.gz BTVZBYZAFYRFGT-PHIMTYICSA-N 1 1 356.220 2.632 20 5 FFBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000859529009 730457680 /nfs/dbraw/zinc/45/76/80/730457680.db2.gz HATMAIJRUVAVMU-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000859529009 730457681 /nfs/dbraw/zinc/45/76/81/730457681.db2.gz HATMAIJRUVAVMU-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000861343846 730601438 /nfs/dbraw/zinc/60/14/38/730601438.db2.gz LODGZZVCIABZGK-MEDUHNTESA-N 1 1 354.428 2.583 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000861349816 730603064 /nfs/dbraw/zinc/60/30/64/730603064.db2.gz VUJIKWNTCMTFHF-ZBEGNZNMSA-N 1 1 354.428 2.583 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1F ZINC000863031911 730744530 /nfs/dbraw/zinc/74/45/30/730744530.db2.gz KFQRFIALFMFYKP-GFCCVEGCSA-N 1 1 353.369 2.928 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000865955582 731015376 /nfs/dbraw/zinc/01/53/76/731015376.db2.gz HILXMGIOXLZXFQ-LLVKDONJSA-N 1 1 360.241 2.937 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000780768253 738575069 /nfs/dbraw/zinc/57/50/69/738575069.db2.gz QJPKWDDLHWLWGH-LSDHHAIUSA-N 1 1 364.496 2.856 20 5 FFBDMO CC(C)(O)CN1CC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000877665175 732408614 /nfs/dbraw/zinc/40/86/14/732408614.db2.gz KIGQBBOLSRYIEJ-LBPRGKRZSA-N 1 1 362.257 2.836 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC1(CO)CCCC1 ZINC000878208195 732499018 /nfs/dbraw/zinc/49/90/18/732499018.db2.gz SCHWNBXHFSVFSB-OAHLLOKOSA-N 1 1 356.850 2.984 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CC1(CO)CCCC1 ZINC000878208195 732499023 /nfs/dbraw/zinc/49/90/23/732499023.db2.gz SCHWNBXHFSVFSB-OAHLLOKOSA-N 1 1 356.850 2.984 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H](C)CC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000880439637 732908812 /nfs/dbraw/zinc/90/88/12/732908812.db2.gz GDUXDMYKZYOIJP-JQWIXIFHSA-N 1 1 360.357 2.593 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782063566 738685192 /nfs/dbraw/zinc/68/51/92/738685192.db2.gz NGVIYSMUWXXRGC-CQSZACIVSA-N 1 1 367.764 2.649 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ncsc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782636606 738740972 /nfs/dbraw/zinc/74/09/72/738740972.db2.gz YATZWRHKCDFDAY-UHFFFAOYSA-N 1 1 350.375 2.577 20 5 FFBDMO O=C(CC[N@H+]1CCc2ncsc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782636606 738740976 /nfs/dbraw/zinc/74/09/76/738740976.db2.gz YATZWRHKCDFDAY-UHFFFAOYSA-N 1 1 350.375 2.577 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000886551382 733801661 /nfs/dbraw/zinc/80/16/61/733801661.db2.gz GXVCYFIVMSXZCD-CYBMUJFWSA-N 1 1 364.789 2.856 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105073 738825260 /nfs/dbraw/zinc/82/52/60/738825260.db2.gz ZDTNSSAOIBHGGM-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105073 738825265 /nfs/dbraw/zinc/82/52/65/738825265.db2.gz ZDTNSSAOIBHGGM-UONOGXRCSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCCC[C@@H]3C[NH+]3CCOCC3)sc2c1 ZINC000732049380 734714548 /nfs/dbraw/zinc/71/45/48/734714548.db2.gz SJKGZDGPDOYCII-CQSZACIVSA-N 1 1 362.455 2.896 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000894999358 734949910 /nfs/dbraw/zinc/94/99/10/734949910.db2.gz BOTZPBLYVLGAHA-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000901135544 735747975 /nfs/dbraw/zinc/74/79/75/735747975.db2.gz ODPGEFWEANLYOW-GWCFXTLKSA-N 1 1 355.797 2.944 20 5 FFBDMO CC(C)(C)c1ccc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000750875679 735821233 /nfs/dbraw/zinc/82/12/33/735821233.db2.gz BWMGDXLZFYQJGK-UHFFFAOYSA-N 1 1 350.415 2.771 20 5 FFBDMO CSCC1CC[NH+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000902392761 735941741 /nfs/dbraw/zinc/94/17/41/735941741.db2.gz LQJGLPBUDLXAOG-QGZVFWFLSA-N 1 1 363.483 2.943 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2C[C@H]3CC[C@@H](C2)N3C2CC[NH2+]CC2)c1 ZINC000903508671 736103899 /nfs/dbraw/zinc/10/38/99/736103899.db2.gz QDWVXXDWWRUBQP-CALCHBBNSA-N 1 1 364.877 2.649 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000754613910 736179858 /nfs/dbraw/zinc/17/98/58/736179858.db2.gz KQDJJGADFFBKSS-BETUJISGSA-N 1 1 352.391 2.804 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000756967373 736378404 /nfs/dbraw/zinc/37/84/04/736378404.db2.gz WMLCUEHUXMKLDT-OLZOCXBDSA-N 1 1 352.822 2.674 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000906362171 736490561 /nfs/dbraw/zinc/49/05/61/736490561.db2.gz QCDJGCBPDANYJY-GFCCVEGCSA-N 1 1 351.834 2.781 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000906848207 736550836 /nfs/dbraw/zinc/55/08/36/736550836.db2.gz VGNLOKBHYRFUSS-CYBMUJFWSA-N 1 1 353.850 2.981 20 5 FFBDMO O=C(N[C@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000764300362 737009851 /nfs/dbraw/zinc/00/98/51/737009851.db2.gz ZHWHFZHKNCGCRR-LSDHHAIUSA-N 1 1 367.833 2.621 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000910282409 737052512 /nfs/dbraw/zinc/05/25/12/737052512.db2.gz PCAQPEOYBYQZQO-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000768100855 737397728 /nfs/dbraw/zinc/39/77/28/737397728.db2.gz DFSOZXIAKWMJTG-OWCLPIDISA-N 1 1 365.499 2.918 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000768100855 737397734 /nfs/dbraw/zinc/39/77/34/737397734.db2.gz DFSOZXIAKWMJTG-OWCLPIDISA-N 1 1 365.499 2.918 20 5 FFBDMO O=C1OC[C@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000769482608 737534343 /nfs/dbraw/zinc/53/43/43/737534343.db2.gz DGYIKACZAMILOY-GFCCVEGCSA-N 1 1 359.407 2.960 20 5 FFBDMO O=C1OC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000769482608 737534346 /nfs/dbraw/zinc/53/43/46/737534346.db2.gz DGYIKACZAMILOY-GFCCVEGCSA-N 1 1 359.407 2.960 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000923267480 738264032 /nfs/dbraw/zinc/26/40/32/738264032.db2.gz WSQLARHUHAHKMD-NWDGAFQWSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000923274498 738264812 /nfs/dbraw/zinc/26/48/12/738264812.db2.gz LNRMSWFZDWOFJJ-CMPLNLGQSA-N 1 1 355.341 2.505 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000777923766 738331709 /nfs/dbraw/zinc/33/17/09/738331709.db2.gz SIYXXBQVBOLJAZ-AWEZNQCLSA-N 1 1 370.906 2.739 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000785547490 738976144 /nfs/dbraw/zinc/97/61/44/738976144.db2.gz YVVDULVJDZARHN-XHBSWPGZSA-N 1 1 353.394 2.544 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000785829551 739002084 /nfs/dbraw/zinc/00/20/84/739002084.db2.gz BKPUQGHVMOGAFV-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CC[C@H](C(F)(F)F)O3)C2)nc1 ZINC000929986647 739045471 /nfs/dbraw/zinc/04/54/71/739045471.db2.gz IDLZNCHOFBODIA-KGYLQXTDSA-N 1 1 360.336 2.586 20 5 FFBDMO CON1CCC([N@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000930684868 739146944 /nfs/dbraw/zinc/14/69/44/739146944.db2.gz CNSOZHOTPWDGOF-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000930684868 739146945 /nfs/dbraw/zinc/14/69/45/739146945.db2.gz CNSOZHOTPWDGOF-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000787579434 739148291 /nfs/dbraw/zinc/14/82/91/739148291.db2.gz VRLAHHVBAFJOBS-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000931901750 739349541 /nfs/dbraw/zinc/34/95/41/739349541.db2.gz CJPKAKDRLZVNLK-CQSZACIVSA-N 1 1 350.419 2.940 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000931901748 739349586 /nfs/dbraw/zinc/34/95/86/739349586.db2.gz CJPKAKDRLZVNLK-AWEZNQCLSA-N 1 1 350.419 2.940 20 5 FFBDMO C[C@@]1(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)COC(=O)N1 ZINC000932092218 739385035 /nfs/dbraw/zinc/38/50/35/739385035.db2.gz JXKBVVIBUFYRRC-INIZCTEOSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790543036 739467869 /nfs/dbraw/zinc/46/78/69/739467869.db2.gz OMBZVEKWQTXFBA-NSHDSACASA-N 1 1 357.813 2.920 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790544584 739468338 /nfs/dbraw/zinc/46/83/38/739468338.db2.gz ZTXWIKSHBUTVBQ-NSHDSACASA-N 1 1 357.813 2.778 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000790912658 739512274 /nfs/dbraw/zinc/51/22/74/739512274.db2.gz XXEXAOOPHYJDFG-MNOVXSKESA-N 1 1 357.813 2.871 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000791868187 739611048 /nfs/dbraw/zinc/61/10/48/739611048.db2.gz AKAROCPJGQORIR-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000933437237 739625182 /nfs/dbraw/zinc/62/51/82/739625182.db2.gz BIVJOAIZXUVJAY-CZUORRHYSA-N 1 1 351.422 2.855 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792925007 739719304 /nfs/dbraw/zinc/71/93/04/739719304.db2.gz JQKAVNJOTOLRMA-ZFWWWQNUSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792925007 739719306 /nfs/dbraw/zinc/71/93/06/739719306.db2.gz JQKAVNJOTOLRMA-ZFWWWQNUSA-N 1 1 353.806 2.830 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333011 739767012 /nfs/dbraw/zinc/76/70/12/739767012.db2.gz NJYQLGWHKORVNQ-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934333011 739767016 /nfs/dbraw/zinc/76/70/16/739767016.db2.gz NJYQLGWHKORVNQ-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c1 ZINC000934333680 739767107 /nfs/dbraw/zinc/76/71/07/739767107.db2.gz YTFLHVPVWUFNSL-LBPRGKRZSA-N 1 1 361.423 2.903 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCNC(=O)OC(C)(C)C ZINC000797520402 740253183 /nfs/dbraw/zinc/25/31/83/740253183.db2.gz XZQOPHMKSBKKSK-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO COC(=O)c1nn(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1Cl ZINC000800866055 740558220 /nfs/dbraw/zinc/55/82/20/740558220.db2.gz QNXZUFJUCYJXPZ-UHFFFAOYSA-N 1 1 366.805 2.672 20 5 FFBDMO COC(=O)c1nn(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1Cl ZINC000800866055 740558223 /nfs/dbraw/zinc/55/82/23/740558223.db2.gz QNXZUFJUCYJXPZ-UHFFFAOYSA-N 1 1 366.805 2.672 20 5 FFBDMO Cc1ccc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c([N+](=O)[O-])c1Br ZINC000804397635 740868988 /nfs/dbraw/zinc/86/89/88/740868988.db2.gz ZXWNVOBOFGMAEE-NWDGAFQWSA-N 1 1 370.247 2.941 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810844734 741455279 /nfs/dbraw/zinc/45/52/79/741455279.db2.gz QOVDCCJGOABDMI-NEPJUHHUSA-N 1 1 356.325 2.980 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCCOc2ccccc2[N+](=O)[O-])C1 ZINC000811448751 741524112 /nfs/dbraw/zinc/52/41/12/741524112.db2.gz ZPTSTVYOXAKOOM-KRWDZBQOSA-N 1 1 354.378 2.729 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CCO)c2cccs2)c1 ZINC000811481037 741527896 /nfs/dbraw/zinc/52/78/96/741527896.db2.gz MYEPAUVWTSXJCQ-ZDUSSCGKSA-N 1 1 350.396 2.656 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000811601237 741541988 /nfs/dbraw/zinc/54/19/88/741541988.db2.gz SNGKPMFYPXDRHE-LLVKDONJSA-N 1 1 352.391 2.662 20 5 FFBDMO CCCCO[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173797 741684943 /nfs/dbraw/zinc/68/49/43/741684943.db2.gz JRBDPOIXHHUQJE-PBHICJAKSA-N 1 1 350.415 2.918 20 5 FFBDMO CCCCO[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173797 741684946 /nfs/dbraw/zinc/68/49/46/741684946.db2.gz JRBDPOIXHHUQJE-PBHICJAKSA-N 1 1 350.415 2.918 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000822138808 742701902 /nfs/dbraw/zinc/70/19/02/742701902.db2.gz LKPCOTZBDRNDFP-NSHDSACASA-N 1 1 371.235 2.963 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827308977 743552950 /nfs/dbraw/zinc/55/29/50/743552950.db2.gz DTXHRFONAXZOLO-GWCFXTLKSA-N 1 1 357.332 2.780 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC000827328399 743556078 /nfs/dbraw/zinc/55/60/78/743556078.db2.gz FBFVVMRUPXHCRM-OUCADQQQSA-N 1 1 367.833 2.568 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000828264100 745049197 /nfs/dbraw/zinc/04/91/97/745049197.db2.gz XELPIPHPDORNLP-LLVKDONJSA-N 1 1 367.833 2.955 20 5 FFBDMO C[C@@H]1C[N@H+](CCO)CCN1c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000829578191 745227751 /nfs/dbraw/zinc/22/77/51/745227751.db2.gz WPQWOKULKPDGSW-SECBINFHSA-N 1 1 367.755 2.770 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)CCN1c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000829578191 745227754 /nfs/dbraw/zinc/22/77/54/745227754.db2.gz WPQWOKULKPDGSW-SECBINFHSA-N 1 1 367.755 2.770 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C[C@@H]1C ZINC000831786416 745584091 /nfs/dbraw/zinc/58/40/91/745584091.db2.gz BBTPSONLDDEIAE-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)C[C@@H]1C ZINC000831786416 745584094 /nfs/dbraw/zinc/58/40/94/745584094.db2.gz BBTPSONLDDEIAE-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO NC(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2Br)CCCCC1 ZINC000839522473 746846577 /nfs/dbraw/zinc/84/65/77/746846577.db2.gz VWVCGHGFQKLUGO-UHFFFAOYSA-N 1 1 356.220 2.635 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1C1(O)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839619468 746873651 /nfs/dbraw/zinc/87/36/51/746873651.db2.gz WXKFNDQDBBMBFP-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1C1(O)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839619468 746873660 /nfs/dbraw/zinc/87/36/60/746873660.db2.gz WXKFNDQDBBMBFP-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(C(F)F)CC1 ZINC000848482175 748938001 /nfs/dbraw/zinc/93/80/01/748938001.db2.gz LECYYXCGZHLDIX-OAHLLOKOSA-N 1 1 353.369 2.845 20 5 FFBDMO C[C@@H]1C[NH+](CCCNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)O1 ZINC000486447154 887168926 /nfs/dbraw/zinc/16/89/26/887168926.db2.gz DYTBKXRCCYGVQR-CHWSQXEVSA-N 1 1 361.402 2.556 20 5 FFBDMO CC(C)(C)[C@@H]1CSCC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001573829430 949956366 /nfs/dbraw/zinc/95/63/66/949956366.db2.gz ZCYONLWYIQQOGU-AWEZNQCLSA-N 1 1 362.459 2.738 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134929300 960375318 /nfs/dbraw/zinc/37/53/18/960375318.db2.gz NJYNWJUTOZPPFZ-SPYBWZPUSA-N 1 1 372.469 2.871 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000872280818 1013198154 /nfs/dbraw/zinc/19/81/54/1013198154.db2.gz VJUSRDFJSNGZEI-GOSISDBHSA-N 1 1 373.453 2.908 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(=O)OCCn2ccc([N+](=O)[O-])n2)cc1)C(C)C ZINC000748121554 961500042 /nfs/dbraw/zinc/50/00/42/961500042.db2.gz RYJAKKIGTCLLLT-UHFFFAOYSA-N 1 1 360.414 2.879 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cc(C)n3)C2)cc1 ZINC001174844351 1013323458 /nfs/dbraw/zinc/32/34/58/1013323458.db2.gz WOHCIMYDSNRFRL-MRXNPFEDSA-N 1 1 354.410 2.611 20 5 FFBDMO Cn1nc2c(c1C[N@H+]1CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C1)COCC2 ZINC000894719221 965630699 /nfs/dbraw/zinc/63/06/99/965630699.db2.gz NCDRBURTNROCSV-OAHLLOKOSA-N 1 1 356.426 2.781 20 5 FFBDMO COc1c(O)ccc(CNc2ccc(C[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000892318552 967134111 /nfs/dbraw/zinc/13/41/11/967134111.db2.gz RTTMESHJSONTQI-UHFFFAOYSA-N 1 1 373.409 2.753 20 5 FFBDMO O=C(CC[NH2+][C@@H](CO)c1cc(F)ccc1F)Nc1ccccc1[N+](=O)[O-] ZINC001176927508 1013799665 /nfs/dbraw/zinc/79/96/65/1013799665.db2.gz SOEJEUDFZXNRSR-HNNXBMFYSA-N 1 1 365.336 2.525 20 5 FFBDMO O=C(CC[NH2+][C@H](CO)c1cc(F)ccc1F)Nc1ccccc1[N+](=O)[O-] ZINC001176927509 1013800056 /nfs/dbraw/zinc/80/00/56/1013800056.db2.gz SOEJEUDFZXNRSR-OAHLLOKOSA-N 1 1 365.336 2.525 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCc2ccccc2C1 ZINC000255716210 968705285 /nfs/dbraw/zinc/70/52/85/968705285.db2.gz DQXHIADELVGICA-YFHOEESVSA-N 1 1 351.406 2.783 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2cnn(C)c2)C1 ZINC000875054487 1013958775 /nfs/dbraw/zinc/95/87/75/1013958775.db2.gz UNRULVSPQBWPSS-ZWKOTPCHSA-N 1 1 371.441 2.781 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)CC[C@H]21 ZINC000897016385 973154887 /nfs/dbraw/zinc/15/48/87/973154887.db2.gz GRHSAGVYWSAMQL-WMLDXEAASA-N 1 1 368.437 2.887 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@@H]4[C@H]3CCC[N@@H+]4CCO)n2)cc1 ZINC000897219825 973456969 /nfs/dbraw/zinc/45/69/69/973456969.db2.gz OSXYDZICGXNUBY-IAGOWNOFSA-N 1 1 374.466 2.754 20 5 FFBDMO C[Si](C)(C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC001167778363 974281305 /nfs/dbraw/zinc/28/13/05/974281305.db2.gz FCEQCRPIVCTGHX-OAHLLOKOSA-N 1 1 356.502 2.631 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1NCc1ccc(N)[nH+]c1C ZINC001167788205 975244297 /nfs/dbraw/zinc/24/42/97/975244297.db2.gz SEDGOHSNFKJDRP-UHFFFAOYSA-N 1 1 350.762 2.933 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@@H+]1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000726590880 978223120 /nfs/dbraw/zinc/22/31/20/978223120.db2.gz WRCUOPJOGIJKNQ-CYBMUJFWSA-N 1 1 372.360 2.818 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@H+]1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 ZINC000726590880 978223129 /nfs/dbraw/zinc/22/31/29/978223129.db2.gz WRCUOPJOGIJKNQ-CYBMUJFWSA-N 1 1 372.360 2.818 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000108302200 978459154 /nfs/dbraw/zinc/45/91/54/978459154.db2.gz XSADLBKDTCXPCO-INIZCTEOSA-N 1 1 372.469 2.799 20 5 FFBDMO CC(C)CC[NH2+]C[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001105423251 979412253 /nfs/dbraw/zinc/41/22/53/979412253.db2.gz KQIJAEMAQVEEEO-MLYOOKFZSA-N 1 1 359.470 2.504 20 5 FFBDMO C[C@H]1CCCC[N@@H+]1CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237514079 979626253 /nfs/dbraw/zinc/62/62/53/979626253.db2.gz RIGALRDUMLAMBL-HNNXBMFYSA-N 1 1 357.458 2.959 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237514079 979626265 /nfs/dbraw/zinc/62/62/65/979626265.db2.gz RIGALRDUMLAMBL-HNNXBMFYSA-N 1 1 357.458 2.959 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C[C@H]1C ZINC000905712364 980494089 /nfs/dbraw/zinc/49/40/89/980494089.db2.gz PDAJJHXUDIXKHT-UKRRQHHQSA-N 1 1 358.398 2.547 20 5 FFBDMO CN(C)[C@@H]1CC[N@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CO)cc2)C1 ZINC000906173117 980590223 /nfs/dbraw/zinc/59/02/23/980590223.db2.gz YNTVVWPAXXOKLB-LJQANCHMSA-N 1 1 355.438 2.890 20 5 FFBDMO CN(C)[C@@H]1CC[N@@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CO)cc2)C1 ZINC000906173117 980590227 /nfs/dbraw/zinc/59/02/27/980590227.db2.gz YNTVVWPAXXOKLB-LJQANCHMSA-N 1 1 355.438 2.890 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687932 1014682011 /nfs/dbraw/zinc/68/20/11/1014682011.db2.gz NXOZDLCCOBCNAC-SJORKVTESA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687932 1014682019 /nfs/dbraw/zinc/68/20/19/1014682019.db2.gz NXOZDLCCOBCNAC-SJORKVTESA-N 1 1 354.410 2.599 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CC[C@H](C3CCOCC3)C2)o1 ZINC000878300474 1014975391 /nfs/dbraw/zinc/97/53/91/1014975391.db2.gz FRSDLXMGJKFPOS-AWEZNQCLSA-N 1 1 358.398 2.893 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000170903476 985171447 /nfs/dbraw/zinc/17/14/47/985171447.db2.gz XBRHFOXLZKIQON-CQSZACIVSA-N 1 1 367.450 2.554 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000170903476 985171450 /nfs/dbraw/zinc/17/14/50/985171450.db2.gz XBRHFOXLZKIQON-CQSZACIVSA-N 1 1 367.450 2.554 20 5 FFBDMO Cc1cn(C[N@H+](C)C(C2CC2)C2CC2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000171559574 985312193 /nfs/dbraw/zinc/31/21/93/985312193.db2.gz METGUGSKLCSEHQ-UHFFFAOYSA-N 1 1 356.426 2.934 20 5 FFBDMO C/C(=C/C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000762612340 988512579 /nfs/dbraw/zinc/51/25/79/988512579.db2.gz KSQLXDAWSVRMPA-KGAUPUERSA-N 1 1 361.442 2.615 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(N2CCN(C)CC2)nc1 ZINC000130496197 990164139 /nfs/dbraw/zinc/16/41/39/990164139.db2.gz RQHHCUBFEMVIRU-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H](c2ccccc2)C1 ZINC000917462499 990220378 /nfs/dbraw/zinc/22/03/78/990220378.db2.gz GXBXVUBIHFYJHJ-LJQANCHMSA-N 1 1 351.410 2.891 20 5 FFBDMO Cc1ccc(F)cc1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001034815977 990275269 /nfs/dbraw/zinc/27/52/69/990275269.db2.gz HQOGUQUVUNBHEC-RTBURBONSA-N 1 1 371.412 2.705 20 5 FFBDMO COc1cccc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000194844374 990590716 /nfs/dbraw/zinc/59/07/16/990590716.db2.gz FODHMQFWOKRBOQ-KBPBESRZSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373094096 990715613 /nfs/dbraw/zinc/71/56/13/990715613.db2.gz FFXQIIPFJBEYRY-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373094096 990715617 /nfs/dbraw/zinc/71/56/17/990715617.db2.gz FFXQIIPFJBEYRY-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000919877935 990752716 /nfs/dbraw/zinc/75/27/16/990752716.db2.gz QOHUWSFDJGMABG-QLFBSQMISA-N 1 1 362.474 2.757 20 5 FFBDMO CC[N@H+](CCc1ccccn1)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000920256571 990820967 /nfs/dbraw/zinc/82/09/67/990820967.db2.gz OWUDYPGNEBNKPM-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000920256571 990820974 /nfs/dbraw/zinc/82/09/74/990820974.db2.gz OWUDYPGNEBNKPM-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO Cc1cncc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000879750345 1015664526 /nfs/dbraw/zinc/66/45/26/1015664526.db2.gz TUJGKQFAKNHLFA-SJORKVTESA-N 1 1 357.410 2.875 20 5 FFBDMO CCCc1ccc(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000940107358 991933629 /nfs/dbraw/zinc/93/36/29/991933629.db2.gz JWZXIQZCVWCIMW-QZTJIDSGSA-N 1 1 359.470 2.775 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000880007159 1015729392 /nfs/dbraw/zinc/72/93/92/1015729392.db2.gz CJILUIUYMDHSQO-AWEZNQCLSA-N 1 1 372.450 2.738 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000880007159 1015729402 /nfs/dbraw/zinc/72/94/02/1015729402.db2.gz CJILUIUYMDHSQO-AWEZNQCLSA-N 1 1 372.450 2.738 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C ZINC000880489240 1015848825 /nfs/dbraw/zinc/84/88/25/1015848825.db2.gz QURAGYRGHLYSEG-JKTUTYCYSA-N 1 1 373.453 2.614 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C ZINC000880489242 1015849102 /nfs/dbraw/zinc/84/91/02/1015849102.db2.gz QURAGYRGHLYSEG-UQPQFNMUSA-N 1 1 373.453 2.614 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810842141 994949931 /nfs/dbraw/zinc/94/99/31/994949931.db2.gz SSPORWHEYPVCOI-XJKSGUPXSA-N 1 1 356.382 2.564 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810844089 994951339 /nfs/dbraw/zinc/95/13/39/994951339.db2.gz ZZGGYGNEJDKQIM-CABCVRRESA-N 1 1 356.382 2.564 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)C[C@@H]2C1 ZINC000812322520 995405470 /nfs/dbraw/zinc/40/54/70/995405470.db2.gz IUCFXTSVDHGKHZ-CVEARBPZSA-N 1 1 361.445 2.705 20 5 FFBDMO CN(CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000813170123 995632182 /nfs/dbraw/zinc/63/21/82/995632182.db2.gz HMGAKAPCJIQBHU-IBGZPJMESA-N 1 1 369.421 2.849 20 5 FFBDMO CN(CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000813170123 995632188 /nfs/dbraw/zinc/63/21/88/995632188.db2.gz HMGAKAPCJIQBHU-IBGZPJMESA-N 1 1 369.421 2.849 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cccc2c[nH]nc21 ZINC000813171942 995632352 /nfs/dbraw/zinc/63/23/52/995632352.db2.gz DRPLBECYNFBICA-INIZCTEOSA-N 1 1 366.377 2.902 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cccc2c[nH]nc21 ZINC000813171942 995632357 /nfs/dbraw/zinc/63/23/57/995632357.db2.gz DRPLBECYNFBICA-INIZCTEOSA-N 1 1 366.377 2.902 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c(c1)OCO2 ZINC000813171313 995633914 /nfs/dbraw/zinc/63/39/14/995633914.db2.gz SNEHXTGUFICATA-INIZCTEOSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2c(c1)OCO2 ZINC000813171313 995633917 /nfs/dbraw/zinc/63/39/17/995633917.db2.gz SNEHXTGUFICATA-INIZCTEOSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1=CCCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264537 1015996214 /nfs/dbraw/zinc/99/62/14/1015996214.db2.gz JCEAESXSLGMDST-RTBURBONSA-N 1 1 355.438 2.784 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CC1=CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264537 1015996223 /nfs/dbraw/zinc/99/62/23/1015996223.db2.gz JCEAESXSLGMDST-RTBURBONSA-N 1 1 355.438 2.784 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1=CCCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264537 1015996232 /nfs/dbraw/zinc/99/62/32/1015996232.db2.gz JCEAESXSLGMDST-RTBURBONSA-N 1 1 355.438 2.784 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000823994013 996773855 /nfs/dbraw/zinc/77/38/55/996773855.db2.gz NBMYQENUGKWEOB-CYBMUJFWSA-N 1 1 357.414 2.819 20 5 FFBDMO Nc1ccc(NC(=O)NCCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000824002720 996775331 /nfs/dbraw/zinc/77/53/31/996775331.db2.gz FYGYNOXWHPLXRQ-UHFFFAOYSA-N 1 1 369.425 2.747 20 5 FFBDMO COc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000825198980 997271998 /nfs/dbraw/zinc/27/19/98/997271998.db2.gz NPGPAMVBIVSSMX-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc(C[N@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1F ZINC000731480673 997979684 /nfs/dbraw/zinc/97/96/84/997979684.db2.gz CWYRBMYTJWQNQT-KRWDZBQOSA-N 1 1 373.384 2.980 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)cc1F ZINC000731480673 997979694 /nfs/dbraw/zinc/97/96/94/997979694.db2.gz CWYRBMYTJWQNQT-KRWDZBQOSA-N 1 1 373.384 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[NH+]3CCC(Cn4cnnc4)CC3)c2c1 ZINC000844735225 998130437 /nfs/dbraw/zinc/13/04/37/998130437.db2.gz HUABDZLFRWMMRQ-UHFFFAOYSA-N 1 1 374.426 2.833 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000732166296 998497447 /nfs/dbraw/zinc/49/74/47/998497447.db2.gz NRMHEVQSESECQZ-MRXNPFEDSA-N 1 1 358.442 2.504 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000845735435 998641993 /nfs/dbraw/zinc/64/19/93/998641993.db2.gz XKSWZXMXBVWZNW-CYBMUJFWSA-N 1 1 358.398 2.810 20 5 FFBDMO COc1cc(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000824613968 999246397 /nfs/dbraw/zinc/24/63/97/999246397.db2.gz UHJCFDKSDGMWKN-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1cc(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000824613968 999246402 /nfs/dbraw/zinc/24/64/02/999246402.db2.gz UHJCFDKSDGMWKN-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000741033368 999701775 /nfs/dbraw/zinc/70/17/75/999701775.db2.gz QQODHQLKVIDNBD-KGLIPLIRSA-N 1 1 363.414 2.730 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@H](C)C(C)C ZINC000742557530 999778255 /nfs/dbraw/zinc/77/82/55/999778255.db2.gz ZNKFCASBQFTZHJ-ACJLOTCBSA-N 1 1 362.430 2.686 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169036011 1000016654 /nfs/dbraw/zinc/01/66/54/1000016654.db2.gz FCQMIMYBBKZDQW-IBEHDNSVSA-N 1 1 353.463 2.667 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCn3cnc(COc4cccnc4)c3C2)C1 ZINC001169018395 1000017346 /nfs/dbraw/zinc/01/73/46/1000017346.db2.gz AYLRYSOYPLOASX-JKSUJKDBSA-N 1 1 371.441 2.508 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)CN1c1ccc(F)cc1 ZINC001169021544 1000017443 /nfs/dbraw/zinc/01/74/43/1000017443.db2.gz OWOZMSOXPPDABE-FNHZYXHNSA-N 1 1 361.417 2.700 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCC1(F)F ZINC001169046381 1000018475 /nfs/dbraw/zinc/01/84/75/1000018475.db2.gz LNWLJXXPSAKAPE-YNEHKIRRSA-N 1 1 363.405 2.666 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](Oc3cc(C(F)(F)F)ncn3)C2)C1 ZINC001169053588 1000019076 /nfs/dbraw/zinc/01/90/76/1000019076.db2.gz JCZJIHQAQVXYIL-UPJWGTAASA-N 1 1 374.363 2.784 20 5 FFBDMO CCC[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000767122670 1000100178 /nfs/dbraw/zinc/10/01/78/1000100178.db2.gz HVFPVNIGLGZRAR-VOCYLRNQSA-N 1 1 361.442 2.567 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)CC1 ZINC000769146511 1000447145 /nfs/dbraw/zinc/44/71/45/1000447145.db2.gz SKIQUBCOGKGSQS-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)CC1 ZINC000769146511 1000447149 /nfs/dbraw/zinc/44/71/49/1000447149.db2.gz SKIQUBCOGKGSQS-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+](Cc2cccnc2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116135891 1032147620 /nfs/dbraw/zinc/14/76/20/1032147620.db2.gz OBDZMMVZGPMGCD-QGZVFWFLSA-N 1 1 366.421 2.744 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC001147162867 1000836922 /nfs/dbraw/zinc/83/69/22/1000836922.db2.gz DGHGLIWHNNMARG-ZDUSSCGKSA-N 1 1 353.850 2.981 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)CC1 ZINC000771403696 1001102570 /nfs/dbraw/zinc/10/25/70/1001102570.db2.gz HLESADPFHDFBSQ-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)CC1 ZINC000771403696 1001102573 /nfs/dbraw/zinc/10/25/73/1001102573.db2.gz HLESADPFHDFBSQ-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCCc1cn2c([nH+]1)CCCC2 ZINC000785738803 1001473892 /nfs/dbraw/zinc/47/38/92/1001473892.db2.gz NSYCYLSQBWUEEK-UHFFFAOYSA-N 1 1 369.425 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](Oc3ncccc3F)C2)cc1 ZINC000785841258 1001492170 /nfs/dbraw/zinc/49/21/70/1001492170.db2.gz QTPRTXSGJQCJGO-WBVHZDCISA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](Oc3ncccc3F)C2)cc1 ZINC000785841258 1001492173 /nfs/dbraw/zinc/49/21/73/1001492173.db2.gz QTPRTXSGJQCJGO-WBVHZDCISA-N 1 1 361.373 2.706 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000786828720 1001628006 /nfs/dbraw/zinc/62/80/06/1001628006.db2.gz ZCPSNXIAIFYGQG-UHFFFAOYSA-N 1 1 368.389 2.769 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000791222579 1002611430 /nfs/dbraw/zinc/61/14/30/1002611430.db2.gz WNIKEWCJPQRGGO-ZDUSSCGKSA-N 1 1 366.437 2.508 20 5 FFBDMO O=[N+]([O-])c1cnc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)c(F)c1 ZINC001184681055 1002699431 /nfs/dbraw/zinc/69/94/31/1002699431.db2.gz IUJDGNAFLAVCGU-UHFFFAOYSA-N 1 1 373.432 2.749 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](Oc3ncncc3C)C2)c([N+](=O)[O-])c1 ZINC001170355007 1003122341 /nfs/dbraw/zinc/12/23/41/1003122341.db2.gz UIAJYXLOWWALAS-RHSMWYFYSA-N 1 1 372.425 2.786 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000804870140 1003880505 /nfs/dbraw/zinc/88/05/05/1003880505.db2.gz QTRLEGMNXKMWMH-UHFFFAOYSA-N 1 1 364.377 2.503 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)OC(=O)C(C)(C)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000805608462 1004065762 /nfs/dbraw/zinc/06/57/62/1004065762.db2.gz DCTCQLBRQPGISH-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(N3CCCCC3)nc2)c([N+](=O)[O-])cc1O ZINC001199321042 1004910044 /nfs/dbraw/zinc/91/00/44/1004910044.db2.gz TUZCRERLCJLLOD-UHFFFAOYSA-N 1 1 372.425 2.984 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](CC4(O)CCCCC4)CC3)nc2c1 ZINC000775672077 1005046006 /nfs/dbraw/zinc/04/60/06/1005046006.db2.gz DEHFGEKUNDQQBZ-UHFFFAOYSA-N 1 1 373.457 2.678 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000107894131 1005554428 /nfs/dbraw/zinc/55/44/28/1005554428.db2.gz MGKLOQDJGGBLPS-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO CC1(C)OC[C@@H]2C[C@@]21C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035657 1005857973 /nfs/dbraw/zinc/85/79/73/1005857973.db2.gz UPYSCCWRUVLOGK-QOKNQOGYSA-N 1 1 360.410 2.527 20 5 FFBDMO CC1(C)OC[C@@H]2C[C@@]21C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035657 1005857976 /nfs/dbraw/zinc/85/79/76/1005857976.db2.gz UPYSCCWRUVLOGK-QOKNQOGYSA-N 1 1 360.410 2.527 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000851825389 1005916754 /nfs/dbraw/zinc/91/67/54/1005916754.db2.gz GRQPTDOMGFFHEA-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000851825389 1005916756 /nfs/dbraw/zinc/91/67/56/1005916756.db2.gz GRQPTDOMGFFHEA-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001134056745 1006107909 /nfs/dbraw/zinc/10/79/09/1006107909.db2.gz UCQZAMIFZDTDPL-MRXNPFEDSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC001134056745 1006107914 /nfs/dbraw/zinc/10/79/14/1006107914.db2.gz UCQZAMIFZDTDPL-MRXNPFEDSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000882328933 1006356858 /nfs/dbraw/zinc/35/68/58/1006356858.db2.gz XTSQROQPFVLNCK-UHFFFAOYSA-N 1 1 367.421 2.697 20 5 FFBDMO CC[N@@H+]1CCCC[C@@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111392602 1006427055 /nfs/dbraw/zinc/42/70/55/1006427055.db2.gz FSSVGRGMWKJEJA-GOSISDBHSA-N 1 1 357.458 2.959 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111392602 1006427059 /nfs/dbraw/zinc/42/70/59/1006427059.db2.gz FSSVGRGMWKJEJA-GOSISDBHSA-N 1 1 357.458 2.959 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000776765911 1007035725 /nfs/dbraw/zinc/03/57/25/1007035725.db2.gz MNTPIRWTBALIBA-IBGZPJMESA-N 1 1 370.384 2.943 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](Oc3ccc(C)cn3)C2)c1 ZINC000858012493 1008277036 /nfs/dbraw/zinc/27/70/36/1008277036.db2.gz IJISQSXRRLHLED-INIZCTEOSA-N 1 1 371.393 2.738 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](Oc3ccc(C)cn3)C2)c1 ZINC000858012493 1008277041 /nfs/dbraw/zinc/27/70/41/1008277041.db2.gz IJISQSXRRLHLED-INIZCTEOSA-N 1 1 371.393 2.738 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001136409076 1008407378 /nfs/dbraw/zinc/40/73/78/1008407378.db2.gz IOZTWRRHNUFPHM-UKRRQHHQSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000886433250 1008680304 /nfs/dbraw/zinc/68/03/04/1008680304.db2.gz DVOGGWJVKXCSMO-SFHVURJKSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000886433250 1008680309 /nfs/dbraw/zinc/68/03/09/1008680309.db2.gz DVOGGWJVKXCSMO-SFHVURJKSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000886435555 1008681859 /nfs/dbraw/zinc/68/18/59/1008681859.db2.gz BVHDBXFCHFIUAM-KRWDZBQOSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000886435555 1008681867 /nfs/dbraw/zinc/68/18/67/1008681867.db2.gz BVHDBXFCHFIUAM-KRWDZBQOSA-N 1 1 357.410 2.816 20 5 FFBDMO O=[N+]([O-])c1ncccc1CN1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000886647989 1008794014 /nfs/dbraw/zinc/79/40/14/1008794014.db2.gz IKUIOSLVRVNCSI-PKOBYXMFSA-N 1 1 352.438 2.944 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458378 1008995349 /nfs/dbraw/zinc/99/53/49/1008995349.db2.gz DQXZRJUHGZXMLH-HZPDHXFCSA-N 1 1 353.850 2.771 20 5 FFBDMO C[C@H]1CN(c2cc[nH+]cc2)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000887132836 1009044896 /nfs/dbraw/zinc/04/48/96/1009044896.db2.gz OJEVFCLYYIPRDR-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000887861644 1009656292 /nfs/dbraw/zinc/65/62/92/1009656292.db2.gz YDBIRHSUAQIYHS-OKILXGFUSA-N 1 1 363.458 2.829 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1C ZINC000887861644 1009656296 /nfs/dbraw/zinc/65/62/96/1009656296.db2.gz YDBIRHSUAQIYHS-OKILXGFUSA-N 1 1 363.458 2.829 20 5 FFBDMO CN1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+](C)CC1 ZINC000888995449 1009788463 /nfs/dbraw/zinc/78/84/63/1009788463.db2.gz OVAITYOPVLTKPN-UHFFFAOYSA-N 1 1 362.477 2.707 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H](O)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000866638043 1011028861 /nfs/dbraw/zinc/02/88/61/1011028861.db2.gz CTWOKGNYJVICBP-MSOLQXFVSA-N 1 1 358.442 2.949 20 5 FFBDMO COCCCOC1CC[NH+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000121223198 1011049408 /nfs/dbraw/zinc/04/94/08/1011049408.db2.gz RIRJSEXIIMINIJ-UHFFFAOYSA-N 1 1 362.430 2.728 20 5 FFBDMO COc1ccc2c(c1)CCCN2C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867944611 1011126755 /nfs/dbraw/zinc/12/67/55/1011126755.db2.gz YIPKETNJPPXELX-LJQANCHMSA-N 1 1 355.394 2.757 20 5 FFBDMO C[C@@H]1COc2ccccc2CN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867978995 1011137590 /nfs/dbraw/zinc/13/75/90/1011137590.db2.gz CHIZMZUTBCZBRF-BFUOFWGJSA-N 1 1 355.394 2.578 20 5 FFBDMO O=C(N1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1)C(F)(F)F ZINC001172903031 1012077254 /nfs/dbraw/zinc/07/72/54/1012077254.db2.gz DIFJDKHTTXGRPP-CQSZACIVSA-N 1 1 371.359 2.549 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870086974 1012116349 /nfs/dbraw/zinc/11/63/49/1012116349.db2.gz HRCPLYLPGRFVIJ-XUDAUXSOSA-N 1 1 367.405 2.877 20 5 FFBDMO C/C(=C/C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870087821 1012120362 /nfs/dbraw/zinc/12/03/62/1012120362.db2.gz ULRAFMXSIWGZQH-LUQQZNFBSA-N 1 1 367.405 2.877 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@]1(C)O ZINC001173009258 1012176505 /nfs/dbraw/zinc/17/65/05/1012176505.db2.gz ANYPJDBSCVRIHW-KPZWWZAWSA-N 1 1 369.412 2.935 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN([C@@H](C)Cc3c(F)c(OC)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC001173191322 1012331282 /nfs/dbraw/zinc/33/12/82/1012331282.db2.gz BXZMNNKEJKGIPV-SOUVJXGZSA-N 1 1 365.449 2.947 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ncc2n1CCCC2 ZINC000870377094 1012341230 /nfs/dbraw/zinc/34/12/30/1012341230.db2.gz GYIIQYLTTGLQAQ-KRWDZBQOSA-N 1 1 370.409 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ncc2n1CCCC2 ZINC000870377094 1012341245 /nfs/dbraw/zinc/34/12/45/1012341245.db2.gz GYIIQYLTTGLQAQ-KRWDZBQOSA-N 1 1 370.409 2.559 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173220751 1012352241 /nfs/dbraw/zinc/35/22/41/1012352241.db2.gz CDCGTHDLOJNRSX-AHRSYUTCSA-N 1 1 366.465 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CCC1(C)C ZINC000871150339 1012750095 /nfs/dbraw/zinc/75/00/95/1012750095.db2.gz NXTTZWOUHFACNM-UHFFFAOYSA-N 1 1 374.485 2.754 20 5 FFBDMO CC[C@H]1CCC[N@H+]1C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173698854 1012901595 /nfs/dbraw/zinc/90/15/95/1012901595.db2.gz RNBVPDFVAWVKTO-AWEZNQCLSA-N 1 1 367.471 2.622 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)CC[C@@H]21 ZINC000827364404 1017780734 /nfs/dbraw/zinc/78/07/34/1017780734.db2.gz FSVDXLMXTDJSLZ-YJBOKZPZSA-N 1 1 372.469 2.751 20 5 FFBDMO COC(=O)c1cncc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000929750226 1019628007 /nfs/dbraw/zinc/62/80/07/1019628007.db2.gz SQSJWZKYPRQADZ-UHFFFAOYSA-N 1 1 371.393 2.820 20 5 FFBDMO O=C1OCC[C@H]1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000828807697 1032845789 /nfs/dbraw/zinc/84/57/89/1032845789.db2.gz PXOYYCUQBCHNDH-DJIMGWMZSA-N 1 1 362.426 2.654 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 ZINC001048525419 1020275295 /nfs/dbraw/zinc/27/52/95/1020275295.db2.gz UGEROERRRJINKE-KWXDATOUSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525419 1020275302 /nfs/dbraw/zinc/27/53/02/1020275302.db2.gz UGEROERRRJINKE-KWXDATOUSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525419 1020275313 /nfs/dbraw/zinc/27/53/13/1020275313.db2.gz UGEROERRRJINKE-KWXDATOUSA-N 1 1 371.481 2.828 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000931495362 1020490570 /nfs/dbraw/zinc/49/05/70/1020490570.db2.gz JMBBWADDUAYGRP-MRXNPFEDSA-N 1 1 362.430 2.532 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000933945119 1021118245 /nfs/dbraw/zinc/11/82/45/1021118245.db2.gz QRVAKMQUDZRZQV-HNNXBMFYSA-N 1 1 363.433 2.857 20 5 FFBDMO O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020139645 1022564461 /nfs/dbraw/zinc/56/44/61/1022564461.db2.gz JJVZETGBRGGQCQ-NCXUSEDFSA-N 1 1 357.454 2.746 20 5 FFBDMO COCC[C@@]1([NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CCOC1 ZINC001119855835 1023133380 /nfs/dbraw/zinc/13/33/80/1023133380.db2.gz VBLCGQMROBPXOT-CQSZACIVSA-N 1 1 359.220 2.643 20 5 FFBDMO C[N@H+](CN1CCN(c2ccccc2[N+](=O)[O-])C1=O)C1Cc2ccccc2C1 ZINC000752789021 1023203911 /nfs/dbraw/zinc/20/39/11/1023203911.db2.gz KTPTWKQSIWQRLE-UHFFFAOYSA-N 1 1 366.421 2.894 20 5 FFBDMO C[N@@H+](CN1CCN(c2ccccc2[N+](=O)[O-])C1=O)C1Cc2ccccc2C1 ZINC000752789021 1023203920 /nfs/dbraw/zinc/20/39/20/1023203920.db2.gz KTPTWKQSIWQRLE-UHFFFAOYSA-N 1 1 366.421 2.894 20 5 FFBDMO COc1c(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cccc1[N+](=O)[O-] ZINC001120756624 1023453286 /nfs/dbraw/zinc/45/32/86/1023453286.db2.gz SKVJFEBANCCLBE-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001120764916 1023456702 /nfs/dbraw/zinc/45/67/02/1023456702.db2.gz ALDBQXKURRDXDU-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192752143 1024264972 /nfs/dbraw/zinc/26/49/72/1024264972.db2.gz ZEINMMLMDHDSRH-GDBMZVCRSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H](c2ccccc2)C1 ZINC000195598204 1025037303 /nfs/dbraw/zinc/03/73/03/1025037303.db2.gz TTZZJJWGEOZQCU-LJQANCHMSA-N 1 1 351.410 2.891 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000779867414 1025178593 /nfs/dbraw/zinc/17/85/93/1025178593.db2.gz IJEBYJYBLAXIHK-HNNXBMFYSA-N 1 1 354.414 2.880 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H]2Cn2c(C)nc3ccccc32)cc1[N+](=O)[O-] ZINC000779867414 1025178601 /nfs/dbraw/zinc/17/86/01/1025178601.db2.gz IJEBYJYBLAXIHK-HNNXBMFYSA-N 1 1 354.414 2.880 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000795547445 1026809721 /nfs/dbraw/zinc/80/97/21/1026809721.db2.gz VVYUCTUHDAUBMS-HNNXBMFYSA-N 1 1 369.393 2.582 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000795547445 1026809733 /nfs/dbraw/zinc/80/97/33/1026809733.db2.gz VVYUCTUHDAUBMS-HNNXBMFYSA-N 1 1 369.393 2.582 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000840114584 1026961380 /nfs/dbraw/zinc/96/13/80/1026961380.db2.gz GXLQRWKQSBUHMH-DRMAHVMPSA-N 1 1 351.410 2.955 20 5 FFBDMO C[NH+](C)/C=C/c1cc(Nc2cccn(CC3CC3)c2=O)ncc1[N+](=O)[O-] ZINC001158534322 1027054568 /nfs/dbraw/zinc/05/45/68/1027054568.db2.gz CVVMUOUPQVUYFX-VQHVLOKHSA-N 1 1 355.398 2.837 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3cc(OC)c([N+](=O)[O-])cn3)C2)c1 ZINC001161188165 1028057517 /nfs/dbraw/zinc/05/75/17/1028057517.db2.gz RKTTUZSMXLYIAQ-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000795754544 1028094847 /nfs/dbraw/zinc/09/48/47/1028094847.db2.gz WRZJDLZIGOEYNX-UHFFFAOYSA-N 1 1 357.414 2.949 20 5 FFBDMO CN(CCC[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21)Cc1ccco1 ZINC000795754544 1028094864 /nfs/dbraw/zinc/09/48/64/1028094864.db2.gz WRZJDLZIGOEYNX-UHFFFAOYSA-N 1 1 357.414 2.949 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000249752073 1028294012 /nfs/dbraw/zinc/29/40/12/1028294012.db2.gz RMCCUNUMVXLOET-NEPJUHHUSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1nnc2ccccn21 ZINC001154813999 1028466963 /nfs/dbraw/zinc/46/69/63/1028466963.db2.gz BBUZYPIOGTYXMR-YPUOHESYSA-N 1 1 353.386 2.738 20 5 FFBDMO Cn1c2ccccc2c(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1=O ZINC001163817298 1029072848 /nfs/dbraw/zinc/07/28/48/1029072848.db2.gz HTVOILAFIZCUQM-HNNXBMFYSA-N 1 1 370.453 2.981 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC001164145998 1029184786 /nfs/dbraw/zinc/18/47/86/1029184786.db2.gz LNTCBVAYDNVDNT-ZDUSSCGKSA-N 1 1 362.430 2.620 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C(C)(C)C1 ZINC001156837487 1029371194 /nfs/dbraw/zinc/37/11/94/1029371194.db2.gz UXNDLPMTOWWNAL-OAHLLOKOSA-N 1 1 351.422 2.858 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3nc(C(F)(F)F)nc(Cl)c3[N+](=O)[O-])C[C@@H]21 ZINC001157272462 1029531650 /nfs/dbraw/zinc/53/16/50/1029531650.db2.gz MYKQWQIGNFLMCT-YUMQZZPRSA-N 1 1 365.743 2.587 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001158208668 1029756611 /nfs/dbraw/zinc/75/66/11/1029756611.db2.gz WZAQHIZGWRFLTA-FDFHNCONSA-N 1 1 359.473 2.826 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2ncc(F)cc2[N+](=O)[O-])c2ccccc12 ZINC001158235873 1029766224 /nfs/dbraw/zinc/76/62/24/1029766224.db2.gz FBBIEUBMOKDVTR-SFHVURJKSA-N 1 1 372.356 2.506 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@H]2[NH2+]C[C@H]21 ZINC001158421752 1029825992 /nfs/dbraw/zinc/82/59/92/1029825992.db2.gz FSUOAGVAJXLZKI-BHDDXSALSA-N 1 1 359.473 2.826 20 5 FFBDMO CC(C)(C(=O)O[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)n1cc([N+](=O)[O-])cn1 ZINC000783441074 1030098073 /nfs/dbraw/zinc/09/80/73/1030098073.db2.gz RPSMYKZOXNFJOG-QGZVFWFLSA-N 1 1 372.425 2.734 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000783997197 1030401755 /nfs/dbraw/zinc/40/17/55/1030401755.db2.gz AUDXHEMTHCCGCL-OAHLLOKOSA-N 1 1 374.441 2.728 20 5 FFBDMO Cc1c(C[NH2+]CCc2ccc(N3CCN(C)CC3)cc2)cccc1[N+](=O)[O-] ZINC001204111836 1031106285 /nfs/dbraw/zinc/10/62/85/1031106285.db2.gz XZGJTVOOELUNRC-UHFFFAOYSA-N 1 1 368.481 2.987 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3ccccn3)C2)nc1-c1ccncc1 ZINC000799158731 1031675454 /nfs/dbraw/zinc/67/54/54/1031675454.db2.gz RGVDZRYOCUBPTN-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3ccccn3)C2)nc1-c1ccncc1 ZINC000799158731 1031675466 /nfs/dbraw/zinc/67/54/66/1031675466.db2.gz RGVDZRYOCUBPTN-OAHLLOKOSA-N 1 1 350.382 2.695 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195200 1031690898 /nfs/dbraw/zinc/69/08/98/1031690898.db2.gz WRJASIOZGTZHPS-ZIAGYGMSSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195200 1031690902 /nfs/dbraw/zinc/69/09/02/1031690902.db2.gz WRJASIOZGTZHPS-ZIAGYGMSSA-N 1 1 370.409 2.815 20 5 FFBDMO Cc1cc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)ncc1[N+](=O)[O-] ZINC001225660077 1034355234 /nfs/dbraw/zinc/35/52/34/1034355234.db2.gz BKGZSCPKZFGTGC-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000835081530 1035520831 /nfs/dbraw/zinc/52/08/31/1035520831.db2.gz AANSOBYNMRIUEH-MRXNPFEDSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CCCO1 ZINC000835081530 1035520840 /nfs/dbraw/zinc/52/08/40/1035520840.db2.gz AANSOBYNMRIUEH-MRXNPFEDSA-N 1 1 365.430 2.710 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000835396342 1035744986 /nfs/dbraw/zinc/74/49/86/1035744986.db2.gz MFGJSKNLEAEVKH-GJZGRUSLSA-N 1 1 356.382 2.564 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[O-] ZINC001228809479 1036335838 /nfs/dbraw/zinc/33/58/38/1036335838.db2.gz GHAUNSSUBWTSGR-AWEZNQCLSA-N 1 1 372.377 2.740 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1O ZINC001228809479 1036335862 /nfs/dbraw/zinc/33/58/62/1036335862.db2.gz GHAUNSSUBWTSGR-AWEZNQCLSA-N 1 1 372.377 2.740 20 5 FFBDMO COC(=O)c1c(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC001229050061 1036473369 /nfs/dbraw/zinc/47/33/69/1036473369.db2.gz SLMLKCQKPCXLAX-UONOGXRCSA-N 1 1 371.393 2.991 20 5 FFBDMO Cc1nc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381713 1036644511 /nfs/dbraw/zinc/64/45/11/1036644511.db2.gz ORLXIVTZVLOQLE-ZSHCYNCHSA-N 1 1 370.409 2.973 20 5 FFBDMO Cc1nc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381713 1036644518 /nfs/dbraw/zinc/64/45/18/1036644518.db2.gz ORLXIVTZVLOQLE-ZSHCYNCHSA-N 1 1 370.409 2.973 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc2nc(OC3CC(=O)C3)c3ccccc3c2c1 ZINC001229808933 1036912441 /nfs/dbraw/zinc/91/24/41/1036912441.db2.gz WKGFDNIIVHKMCZ-UHFFFAOYSA-N 1 1 363.417 2.998 20 5 FFBDMO COc1c(C)cc([N+](=O)[O-])c(OC2CC[NH+](CCF)CC2)c1[N+](=O)[O-] ZINC001229868331 1036948540 /nfs/dbraw/zinc/94/85/40/1036948540.db2.gz JFFUYJXBHSEQPU-UHFFFAOYSA-N 1 1 357.338 2.633 20 5 FFBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC001229869577 1036950698 /nfs/dbraw/zinc/95/06/98/1036950698.db2.gz DCDUJLHYSMHXTI-GDNZZTSVSA-N 1 1 351.359 2.824 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2cc(O)c(OC)c3c2c(=O)c2ccccc2n3C)C1 ZINC001234168879 1036954762 /nfs/dbraw/zinc/95/47/62/1036954762.db2.gz AQVGYTYAMBWGFI-ZDUSSCGKSA-N 1 1 368.433 2.879 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001229964086 1037005809 /nfs/dbraw/zinc/00/58/09/1037005809.db2.gz NZUSUTKVJPZSGE-GDJRKYJOSA-N 1 1 354.790 2.794 20 5 FFBDMO Nc1[nH]c2cc(O[C@H]3CCN(c4c(F)cccc4[N+](=O)[O-])C3)ccc2[nH+]1 ZINC001230516862 1037299117 /nfs/dbraw/zinc/29/91/17/1037299117.db2.gz VBJSCFFPKPGXRG-NSHDSACASA-N 1 1 357.345 2.850 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)CC3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC001256092958 1038379820 /nfs/dbraw/zinc/37/98/20/1038379820.db2.gz CGKXWKISVPXKGP-UHFFFAOYSA-N 1 1 363.458 2.931 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H]4OCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100776 1038384175 /nfs/dbraw/zinc/38/41/75/1038384175.db2.gz OTBJXHXCQXEJRO-KSSFIOAISA-N 1 1 361.442 2.683 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@]34CCOC4)CC2)ccc1[N+](=O)[O-] ZINC001256100973 1038384508 /nfs/dbraw/zinc/38/45/08/1038384508.db2.gz WTVPKZSOJVMRQI-IBGZPJMESA-N 1 1 361.442 2.827 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H]4CCCC(=O)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103854 1038388797 /nfs/dbraw/zinc/38/87/97/1038388797.db2.gz PKJCJSUDIHNNRO-WMLDXEAASA-N 1 1 373.453 2.873 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H]4CCCC(=O)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103823 1038390002 /nfs/dbraw/zinc/39/00/02/1038390002.db2.gz PKJCJSUDIHNNRO-RHSMWYFYSA-N 1 1 373.453 2.873 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NS(=O)(=O)N(C)C ZINC001251098646 1038945858 /nfs/dbraw/zinc/94/58/58/1038945858.db2.gz SNAJDMUMJJFVDO-UHFFFAOYSA-N 1 1 358.467 2.981 20 5 FFBDMO Cc1c(Cc2nnc(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cccc1[N+](=O)[O-] ZINC001258070585 1039153836 /nfs/dbraw/zinc/15/38/36/1039153836.db2.gz HJYGGCUKBXJXEK-BETUJISGSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1c(Cc2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cccc1[N+](=O)[O-] ZINC001258070585 1039153838 /nfs/dbraw/zinc/15/38/38/1039153838.db2.gz HJYGGCUKBXJXEK-BETUJISGSA-N 1 1 360.414 2.529 20 5 FFBDMO C[C@H]1CC[C@H](CN)[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569304 1039401573 /nfs/dbraw/zinc/40/15/73/1039401573.db2.gz OTIWZJASLGSYQN-GXTWGEPZSA-N 1 1 368.428 2.901 20 5 FFBDMO C[C@H]1CC[C@H](CN)[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569304 1039401578 /nfs/dbraw/zinc/40/15/78/1039401578.db2.gz OTIWZJASLGSYQN-GXTWGEPZSA-N 1 1 368.428 2.901 20 5 FFBDMO C[C@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H](C)CN1 ZINC001246875445 1039515229 /nfs/dbraw/zinc/51/52/29/1039515229.db2.gz VXUDFWTTZQJLFU-RYUDHWBXSA-N 1 1 354.401 2.524 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H](C)CN1 ZINC001246875445 1039515242 /nfs/dbraw/zinc/51/52/42/1039515242.db2.gz VXUDFWTTZQJLFU-RYUDHWBXSA-N 1 1 354.401 2.524 20 5 FFBDMO COc1cc(N2CC[NH+](C)CC2)ccc1Nc1ccc(O)c([N+](=O)[O-])c1 ZINC001210394642 1039519119 /nfs/dbraw/zinc/51/91/19/1039519119.db2.gz DZEJSAVDQHJDKV-UHFFFAOYSA-N 1 1 358.398 2.804 20 5 FFBDMO COCOc1ccccc1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248207285 1040172019 /nfs/dbraw/zinc/17/20/19/1040172019.db2.gz CCSMXEREELSCJO-OAHLLOKOSA-N 1 1 370.365 2.870 20 5 FFBDMO CCCNC(=O)[C@H]1CCCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479315 1040744249 /nfs/dbraw/zinc/74/42/49/1040744249.db2.gz XJRXIDSVZYXSAE-LJQANCHMSA-N 1 1 374.485 2.944 20 5 FFBDMO COC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254483020 1040748794 /nfs/dbraw/zinc/74/87/94/1040748794.db2.gz OYZHNCCWXMAVMW-BVGQSLNGSA-N 1 1 359.426 2.590 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560820 1040797272 /nfs/dbraw/zinc/79/72/72/1040797272.db2.gz HNPSRMWQAWVNSF-GDBMZVCRSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560820 1040797287 /nfs/dbraw/zinc/79/72/87/1040797287.db2.gz HNPSRMWQAWVNSF-GDBMZVCRSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001254563213 1040803152 /nfs/dbraw/zinc/80/31/52/1040803152.db2.gz XXFQMYIQXKAHJO-WMLDXEAASA-N 1 1 358.442 2.895 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254605249 1040834282 /nfs/dbraw/zinc/83/42/82/1040834282.db2.gz ARIZZCNTUPTTDF-KRWDZBQOSA-N 1 1 352.390 2.907 20 5 FFBDMO Cc1cncnc1O[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612418 1040841501 /nfs/dbraw/zinc/84/15/01/1040841501.db2.gz WEDBVAWMABQSAQ-ROUUACIJSA-N 1 1 354.410 2.704 20 5 FFBDMO Cc1nc(Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)ncc1[N+](=O)[O-] ZINC001261261094 1041109275 /nfs/dbraw/zinc/10/92/75/1041109275.db2.gz JGCBTBIBHPUWBU-UHFFFAOYSA-N 1 1 362.821 2.842 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc(F)cc(C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001262636698 1041767252 /nfs/dbraw/zinc/76/72/52/1041767252.db2.gz YVZFGSCJVNLGIB-QGZVFWFLSA-N 1 1 373.384 2.838 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]CCC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001279254699 1042969116 /nfs/dbraw/zinc/96/91/16/1042969116.db2.gz TVFMESAKBLRZDS-BRSBDYLESA-N 1 1 351.491 2.744 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001310077182 1043633329 /nfs/dbraw/zinc/63/33/29/1043633329.db2.gz KOLHVSPJSCXDBM-JSGCOSHPSA-N 1 1 370.862 2.950 20 5 FFBDMO O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC001318960256 1044960360 /nfs/dbraw/zinc/96/03/60/1044960360.db2.gz VHHDLWHWGZZLJN-LBPRGKRZSA-N 1 1 368.231 2.668 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2[nH]1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC001320887252 1045488306 /nfs/dbraw/zinc/48/83/06/1045488306.db2.gz AVZGBUCOXXUECP-MRXNPFEDSA-N 1 1 355.394 2.948 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc(F)cc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282607466 1045954585 /nfs/dbraw/zinc/95/45/85/1045954585.db2.gz PHQMLIXBYRDOID-GDBMZVCRSA-N 1 1 367.396 2.539 20 5 FFBDMO C[N@@H+](CCOCCO)Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001322652164 1046165350 /nfs/dbraw/zinc/16/53/50/1046165350.db2.gz KAIYGZUBGHTKGW-UHFFFAOYSA-N 1 1 354.790 2.949 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)c1F ZINC001540111353 1070767505 /nfs/dbraw/zinc/76/75/05/1070767505.db2.gz CCJZUPZPBSWKGI-KDURUIRLSA-N 1 1 361.417 2.990 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1-c1noc(CCCC[NH+]2CCOCC2)n1 ZINC001325478159 1046520548 /nfs/dbraw/zinc/52/05/48/1046520548.db2.gz BZJNNGAPZUEHTL-UHFFFAOYSA-N 1 1 360.414 2.917 20 5 FFBDMO CC[N@H+]1CCC[C@H](CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001327891852 1048085442 /nfs/dbraw/zinc/08/54/42/1048085442.db2.gz PFMQLQZQQWDLQM-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001332718781 1048525612 /nfs/dbraw/zinc/52/56/12/1048525612.db2.gz USSKWYINLXSSGM-SJKOYZFVSA-N 1 1 366.801 2.826 20 5 FFBDMO C[C@H](CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[N@H+]1CCCC[C@H]1C ZINC001540833308 1071014430 /nfs/dbraw/zinc/01/44/30/1071014430.db2.gz LUMTUHRXJKXOCW-ZIAGYGMSSA-N 1 1 371.441 2.978 20 5 FFBDMO Cc1nc(N2CC[NH+](Cc3cccc4cccnc43)CC2)ncc1[N+](=O)[O-] ZINC001333768677 1049110048 /nfs/dbraw/zinc/11/00/48/1049110048.db2.gz TZBBUXZBVOVZAJ-UHFFFAOYSA-N 1 1 364.409 2.564 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(C)ccc([N+](=O)[O-])c2C)CC[N@@H+]1CCOC ZINC001295226973 1049906772 /nfs/dbraw/zinc/90/67/72/1049906772.db2.gz FVNZWUVWXFSCBO-MRXNPFEDSA-N 1 1 363.458 2.785 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC001295226973 1049906783 /nfs/dbraw/zinc/90/67/83/1049906783.db2.gz FVNZWUVWXFSCBO-MRXNPFEDSA-N 1 1 363.458 2.785 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001299849455 1050622771 /nfs/dbraw/zinc/62/27/71/1050622771.db2.gz URTVAHZPDNEYFD-QAPCUYQASA-N 1 1 368.437 2.712 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC001301749866 1050972037 /nfs/dbraw/zinc/97/20/37/1050972037.db2.gz CSYGAPZOHIOOCK-OALUTQOASA-N 1 1 351.406 2.623 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C(C)(C)C1 ZINC001304042379 1051511405 /nfs/dbraw/zinc/51/14/05/1051511405.db2.gz HUJMBKPGDYLARE-ZDUSSCGKSA-N 1 1 357.357 2.656 20 5 FFBDMO C[N@@H+]1CCC[C@H]1c1cc(C(=O)Nc2nccc3c2cccc3[N+](=O)[O-])n[nH]1 ZINC001306862820 1052203383 /nfs/dbraw/zinc/20/33/83/1052203383.db2.gz PBTUIDZQKZWFQU-INIZCTEOSA-N 1 1 366.381 2.885 20 5 FFBDMO C[N@H+]1CCC[C@H]1c1cc(C(=O)Nc2nccc3c2cccc3[N+](=O)[O-])n[nH]1 ZINC001306862820 1052203395 /nfs/dbraw/zinc/20/33/95/1052203395.db2.gz PBTUIDZQKZWFQU-INIZCTEOSA-N 1 1 366.381 2.885 20 5 FFBDMO COCC[N@H+]1CCCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC001306930493 1052223453 /nfs/dbraw/zinc/22/34/53/1052223453.db2.gz AGQUBBVZIYGJMX-UHFFFAOYSA-N 1 1 364.833 2.955 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC001339267980 1052255243 /nfs/dbraw/zinc/25/52/43/1052255243.db2.gz YQYXDNUOEKBUTE-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)CCOc1ccccc1[N+](=O)[O-] ZINC001307922250 1052366192 /nfs/dbraw/zinc/36/61/92/1052366192.db2.gz NZCMEHYOUNNKHI-UHFFFAOYSA-N 1 1 353.419 2.820 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC(c3c[nH+]cn3C)CC2)cccc1[N+](=O)[O-] ZINC001308167803 1052423288 /nfs/dbraw/zinc/42/32/88/1052423288.db2.gz JLUKXQKPMBQWCQ-CQSZACIVSA-N 1 1 371.441 2.843 20 5 FFBDMO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1nc(C(C)(C)C)no1 ZINC001308740723 1052492874 /nfs/dbraw/zinc/49/28/74/1052492874.db2.gz XRBDXHGPBGSNOT-LBPRGKRZSA-N 1 1 374.445 2.990 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348234059 1054563107 /nfs/dbraw/zinc/56/31/07/1054563107.db2.gz HXBKELQCFZILDD-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348234059 1054563117 /nfs/dbraw/zinc/56/31/17/1054563117.db2.gz HXBKELQCFZILDD-FOIQADDNSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348236244 1054564880 /nfs/dbraw/zinc/56/48/80/1054564880.db2.gz XVODROPMVNWIQR-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001348236244 1054564893 /nfs/dbraw/zinc/56/48/93/1054564893.db2.gz XVODROPMVNWIQR-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)[C@@H](C)C1 ZINC001338153338 1055275827 /nfs/dbraw/zinc/27/58/27/1055275827.db2.gz LLWFCSMTEAHQMM-BBRMVZONSA-N 1 1 372.473 2.865 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2ccccc2)[C@H](C)CO)c1 ZINC001349499521 1055298525 /nfs/dbraw/zinc/29/85/25/1055298525.db2.gz XVLMGCBWFJZYEW-CQSZACIVSA-N 1 1 358.394 2.764 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2ccccc2)[C@H](C)CO)c1 ZINC001349499521 1055298544 /nfs/dbraw/zinc/29/85/44/1055298544.db2.gz XVLMGCBWFJZYEW-CQSZACIVSA-N 1 1 358.394 2.764 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1 ZINC001300097454 1055748590 /nfs/dbraw/zinc/74/85/90/1055748590.db2.gz OGSCYWQRYQKYTB-KRWDZBQOSA-N 1 1 363.458 2.861 20 5 FFBDMO C[C@@H]1C[N@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@@H](C)CO1 ZINC001350499281 1055801827 /nfs/dbraw/zinc/80/18/27/1055801827.db2.gz FBHZKIPVLZSNMF-WDEREUQCSA-N 1 1 365.821 2.713 20 5 FFBDMO C[C@@H]1C[N@@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)[C@@H](C)CO1 ZINC001350499281 1055801840 /nfs/dbraw/zinc/80/18/40/1055801840.db2.gz FBHZKIPVLZSNMF-WDEREUQCSA-N 1 1 365.821 2.713 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)CC2)c1 ZINC001353395229 1056361689 /nfs/dbraw/zinc/36/16/89/1056361689.db2.gz NXHXKHWSAUIPLK-UHFFFAOYSA-N 1 1 359.361 2.791 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)C1 ZINC001339440914 1056455386 /nfs/dbraw/zinc/45/53/86/1056455386.db2.gz QXRWFXMFPQCMFM-GFCCVEGCSA-N 1 1 364.475 2.620 20 5 FFBDMO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCCO1 ZINC001339476543 1056492027 /nfs/dbraw/zinc/49/20/27/1056492027.db2.gz YZOAATGQRPDKSE-KGLIPLIRSA-N 1 1 359.220 2.641 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001446876518 1058567509 /nfs/dbraw/zinc/56/75/09/1058567509.db2.gz ASZMQHQSRFOHSX-CABCVRRESA-N 1 1 351.834 2.924 20 5 FFBDMO CC[N@@H+](CCn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1)C(C)C ZINC001515710726 1059757248 /nfs/dbraw/zinc/75/72/48/1059757248.db2.gz LUGPEYMRFIUEFZ-UHFFFAOYSA-N 1 1 372.473 2.788 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC(O[C@H]3CCOC3)CC2)c1 ZINC000848480993 1060114421 /nfs/dbraw/zinc/11/44/21/1060114421.db2.gz UHAGAFFZDUWSTM-KRWDZBQOSA-N 1 1 372.425 2.686 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CO)Cc1ccccc1 ZINC001460412791 1060985717 /nfs/dbraw/zinc/98/57/17/1060985717.db2.gz BMRKQONDAHFJPK-HNNXBMFYSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CO)Cc1ccccc1 ZINC001460412791 1060985737 /nfs/dbraw/zinc/98/57/37/1060985737.db2.gz BMRKQONDAHFJPK-HNNXBMFYSA-N 1 1 368.393 2.680 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCN(CC(F)(F)F)C1 ZINC001460544262 1061012648 /nfs/dbraw/zinc/01/26/48/1061012648.db2.gz VGKMEVAHYDJFNB-CYBMUJFWSA-N 1 1 361.364 2.932 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@H]3CSC[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001460900398 1061143311 /nfs/dbraw/zinc/14/33/11/1061143311.db2.gz ZQJLQGXIILKWDE-NVGCLXPQSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@H]3CSC[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001460900398 1061143320 /nfs/dbraw/zinc/14/33/20/1061143320.db2.gz ZQJLQGXIILKWDE-NVGCLXPQSA-N 1 1 365.455 2.615 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@H+](C3CCCC3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001475686343 1061205577 /nfs/dbraw/zinc/20/55/77/1061205577.db2.gz WXLIOBFIASCPJL-AWEZNQCLSA-N 1 1 367.471 2.541 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001475686343 1061205597 /nfs/dbraw/zinc/20/55/97/1061205597.db2.gz WXLIOBFIASCPJL-AWEZNQCLSA-N 1 1 367.471 2.541 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)c(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC001461729017 1061390668 /nfs/dbraw/zinc/39/06/68/1061390668.db2.gz JUNZIDUNGSSIBY-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO COC1(OC)CCOC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001461732927 1061392737 /nfs/dbraw/zinc/39/27/37/1061392737.db2.gz XNLIWAZHBGPLSS-QGZVFWFLSA-N 1 1 362.382 2.722 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC001462487077 1061643755 /nfs/dbraw/zinc/64/37/55/1061643755.db2.gz VGDBVBLTVJHUHQ-LLVKDONJSA-N 1 1 362.386 2.835 20 5 FFBDMO CCc1ccc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001463526940 1062146265 /nfs/dbraw/zinc/14/62/65/1062146265.db2.gz KGCQKRZQBMKAIF-UONOGXRCSA-N 1 1 369.487 2.556 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccco1 ZINC001463648842 1062198814 /nfs/dbraw/zinc/19/88/14/1062198814.db2.gz GDRXPKBAETXMFQ-AWEZNQCLSA-N 1 1 351.790 2.803 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH+]([C@H](C)c3ccccc3)CC2)n1 ZINC001531079274 1062691620 /nfs/dbraw/zinc/69/16/20/1062691620.db2.gz QHIKHVMWINJMGL-OAHLLOKOSA-N 1 1 354.410 2.817 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001468974479 1064067498 /nfs/dbraw/zinc/06/74/98/1064067498.db2.gz LMLLOKNAABXWHM-AWEZNQCLSA-N 1 1 359.430 2.983 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H]1C(C)(C)C ZINC001469614172 1064179601 /nfs/dbraw/zinc/17/96/01/1064179601.db2.gz ACBCGURCNXNVSP-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001472677868 1065125615 /nfs/dbraw/zinc/12/56/15/1065125615.db2.gz JNLRZWJFTTVYGL-LLVKDONJSA-N 1 1 374.363 2.613 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)cc1C ZINC001472846807 1065156927 /nfs/dbraw/zinc/15/69/27/1065156927.db2.gz GWXOLVLBMFBQKK-KDURUIRLSA-N 1 1 361.442 2.858 20 5 FFBDMO C[C@H](Cc1cccc(F)c1)N(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001576052463 1078190357 /nfs/dbraw/zinc/19/03/57/1078190357.db2.gz JPVCFTDQZMJBBX-YJYMSZOUSA-N 1 1 359.401 2.997 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC001473819672 1065376881 /nfs/dbraw/zinc/37/68/81/1065376881.db2.gz MBZUSTOVTACWEY-ZIAGYGMSSA-N 1 1 363.414 2.505 20 5 FFBDMO NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C2 ZINC001473836571 1065384044 /nfs/dbraw/zinc/38/40/44/1065384044.db2.gz FJJXMDWLDPYUFR-BONVTDFDSA-N 1 1 358.225 2.989 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cnc(N3CCOCC3)s2)c1 ZINC001474069781 1065450193 /nfs/dbraw/zinc/45/01/93/1065450193.db2.gz PYLNAGCSMZQCLR-UHFFFAOYSA-N 1 1 368.846 2.831 20 5 FFBDMO COc1c(O)ccc(CN2CC([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001474567468 1065552731 /nfs/dbraw/zinc/55/27/31/1065552731.db2.gz FOWMMWDBSJEOAI-UHFFFAOYSA-N 1 1 357.410 2.625 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001474834552 1065620348 /nfs/dbraw/zinc/62/03/48/1065620348.db2.gz NENKCEXUSSJMJW-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001584827517 1079393365 /nfs/dbraw/zinc/39/33/65/1079393365.db2.gz IMHHOPROCCONLZ-UHFFFAOYSA-N 1 1 351.422 2.999 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001585138973 1079430428 /nfs/dbraw/zinc/43/04/28/1079430428.db2.gz OUCJTTHGBBDEKB-HNNXBMFYSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001585138973 1079430430 /nfs/dbraw/zinc/43/04/30/1079430430.db2.gz OUCJTTHGBBDEKB-HNNXBMFYSA-N 1 1 351.472 2.876 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)n1 ZINC001556897479 1075787113 /nfs/dbraw/zinc/78/71/13/1075787113.db2.gz LYDAPZQLQGEOOV-PBHICJAKSA-N 1 1 354.410 2.691 20 5 FFBDMO C[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCC(C)(C)C1 ZINC001559806940 1076192396 /nfs/dbraw/zinc/19/23/96/1076192396.db2.gz NLANNNBNYJYFDT-GOSISDBHSA-N 1 1 374.485 2.754 20 5 FFBDMO O=C(CC[N@@H+]1CCS[C@@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC001560146980 1076235837 /nfs/dbraw/zinc/23/58/37/1076235837.db2.gz DRAUMAZRGLQALC-GFCCVEGCSA-N 1 1 363.361 2.903 20 5 FFBDMO O=C(CC[N@H+]1CCS[C@@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC001560146980 1076235842 /nfs/dbraw/zinc/23/58/42/1076235842.db2.gz DRAUMAZRGLQALC-GFCCVEGCSA-N 1 1 363.361 2.903 20 5 FFBDMO COc1ccc(C[NH2+]C2CN(C(=O)OCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001560502766 1076276399 /nfs/dbraw/zinc/27/63/99/1076276399.db2.gz WQFBBNWDBBUPEC-UHFFFAOYSA-N 1 1 371.393 2.714 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc(Cl)cc2F)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001567998494 1077065318 /nfs/dbraw/zinc/06/53/18/1077065318.db2.gz NVYAGVJXZOGRFC-UKRRQHHQSA-N 1 1 369.824 2.663 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001587795322 1079866098 /nfs/dbraw/zinc/86/60/98/1079866098.db2.gz FGKZMJAHMYIQIS-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590052743 1080980717 /nfs/dbraw/zinc/98/07/17/1080980717.db2.gz TXBFOOOEOPNKBE-SJCJKPOMSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590166169 1081064576 /nfs/dbraw/zinc/06/45/76/1081064576.db2.gz VTLCRCUSEVJLBZ-KCJUWKMLSA-N 1 1 356.308 2.548 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1c(Br)cncc1[N+](=O)[O-])CC2 ZINC000368880910 512118174 /nfs/dbraw/zinc/11/81/74/512118174.db2.gz BTASGDSWFJRHQL-UHFFFAOYSA-N 1 1 355.236 2.817 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CO)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000092764793 250000700 /nfs/dbraw/zinc/00/07/00/250000700.db2.gz LSVBOGYFPZYKIF-KRWDZBQOSA-N 1 1 372.421 2.997 20 5 FFBDMO C[C@@H](CCO)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000093304652 250027323 /nfs/dbraw/zinc/02/73/23/250027323.db2.gz LNPISXWPWLVIBQ-HNNXBMFYSA-N 1 1 357.410 2.806 20 5 FFBDMO C[C@@H](CCO)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000093304652 250027327 /nfs/dbraw/zinc/02/73/27/250027327.db2.gz LNPISXWPWLVIBQ-HNNXBMFYSA-N 1 1 357.410 2.806 20 5 FFBDMO CCN1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000106478895 250270811 /nfs/dbraw/zinc/27/08/11/250270811.db2.gz GHHGJPCMESVXMY-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO Cc1cc(N2CCC(Nc3nc4sccn4c3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000267400189 251345493 /nfs/dbraw/zinc/34/54/93/251345493.db2.gz PHFYZCBAUBKHPO-UHFFFAOYSA-N 1 1 373.442 2.792 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000272425330 252034377 /nfs/dbraw/zinc/03/43/77/252034377.db2.gz CARKBRLVZRYJET-LRDDRELGSA-N 1 1 366.849 2.874 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272527030 252059654 /nfs/dbraw/zinc/05/96/54/252059654.db2.gz MGGNGMVKISUEHY-QAPCUYQASA-N 1 1 357.458 2.882 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CSCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000272588181 252073497 /nfs/dbraw/zinc/07/34/97/252073497.db2.gz ZQNRMZWYZCHNGT-CABCVRRESA-N 1 1 364.496 2.856 20 5 FFBDMO Cn1cc(CN2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083908 /nfs/dbraw/zinc/08/39/08/252083908.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@H]3CCN(C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083910 /nfs/dbraw/zinc/08/39/10/252083910.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]3CCN(C)C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625524 252083914 /nfs/dbraw/zinc/08/39/14/252083914.db2.gz MKHXDKGSVHEZJN-KDOFPFPSSA-N 1 1 355.442 2.521 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000272843892 252144413 /nfs/dbraw/zinc/14/44/13/252144413.db2.gz PDOBWHGUDKQKEK-CYBMUJFWSA-N 1 1 350.419 2.703 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000273308097 252278202 /nfs/dbraw/zinc/27/82/02/252278202.db2.gz XIEJWRYFRJJEJG-SMDDNHRTSA-N 1 1 369.874 2.893 20 5 FFBDMO Cc1cnc(C2CC[NH+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)s1 ZINC000277476914 256202309 /nfs/dbraw/zinc/20/23/09/256202309.db2.gz QCYDMHQEEYEWRZ-UHFFFAOYSA-N 1 1 360.439 2.838 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000277930268 256256862 /nfs/dbraw/zinc/25/68/62/256256862.db2.gz YPEDYWPKNUHIMH-KRWDZBQOSA-N 1 1 353.394 2.690 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285786508 257004672 /nfs/dbraw/zinc/00/46/72/257004672.db2.gz SWHAKUJTVKLUGS-SFHVURJKSA-N 1 1 363.458 2.741 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1CCCCCC1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285786508 257004673 /nfs/dbraw/zinc/00/46/73/257004673.db2.gz SWHAKUJTVKLUGS-SFHVURJKSA-N 1 1 363.458 2.741 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000278817064 256351481 /nfs/dbraw/zinc/35/14/81/256351481.db2.gz IDABUGLCHCWKMX-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO COC(=O)c1cc(C)nc(NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000286426043 257036623 /nfs/dbraw/zinc/03/66/23/257036623.db2.gz VUAPHEOLYGRNCM-CYBMUJFWSA-N 1 1 350.419 2.617 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000286375535 257033783 /nfs/dbraw/zinc/03/37/83/257033783.db2.gz COYUEHKMVIMAGT-UHFFFAOYSA-N 1 1 364.377 2.503 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCOC(C)(C)C1 ZINC000290014166 257311291 /nfs/dbraw/zinc/31/12/91/257311291.db2.gz ZXOKCXJAAHXRQY-INIZCTEOSA-N 1 1 361.442 2.763 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)c1 ZINC000290276650 257323714 /nfs/dbraw/zinc/32/37/14/257323714.db2.gz CQSDTNLABCKUDB-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO NC(=O)c1ccnc(NC[C@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000290542344 257340075 /nfs/dbraw/zinc/34/00/75/257340075.db2.gz INRMIIRZZOFURD-OAHLLOKOSA-N 1 1 369.425 2.555 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000290727508 257354720 /nfs/dbraw/zinc/35/47/20/257354720.db2.gz YGNWHQBMNRJDAP-GFCCVEGCSA-N 1 1 360.414 2.699 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292131624 257462570 /nfs/dbraw/zinc/46/25/70/257462570.db2.gz LFTUAXIRVUJDKL-YVEFUNNKSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1cc(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294407975 257586509 /nfs/dbraw/zinc/58/65/09/257586509.db2.gz IVAGJEXVTRIIMH-CYBMUJFWSA-N 1 1 367.421 2.984 20 5 FFBDMO Nc1ccc(N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c[nH+]1 ZINC000301162920 258030487 /nfs/dbraw/zinc/03/04/87/258030487.db2.gz CLDKENKADFLYRD-UHFFFAOYSA-N 1 1 367.331 2.917 20 5 FFBDMO COc1cc(NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000301382159 258046430 /nfs/dbraw/zinc/04/64/30/258046430.db2.gz ZTJKUFLIMSHCRZ-KRWDZBQOSA-N 1 1 357.410 2.916 20 5 FFBDMO COc1cc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000301382159 258046432 /nfs/dbraw/zinc/04/64/32/258046432.db2.gz ZTJKUFLIMSHCRZ-KRWDZBQOSA-N 1 1 357.410 2.916 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302151067 258091024 /nfs/dbraw/zinc/09/10/24/258091024.db2.gz BOIIIVQNUUNRFL-DZGCQCFKSA-N 1 1 352.398 2.570 20 5 FFBDMO Cc1cccc(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000302506969 258104202 /nfs/dbraw/zinc/10/42/02/258104202.db2.gz QTWFQQWNJUXLAJ-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C[C@@H](C)O ZINC000301428787 258049552 /nfs/dbraw/zinc/04/95/52/258049552.db2.gz FEGREVFYOMLCKL-VXGBXAGGSA-N 1 1 361.364 2.895 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301835353 258069772 /nfs/dbraw/zinc/06/97/72/258069772.db2.gz LCRKVZYVRVKOEX-AEFFLSMTSA-N 1 1 354.410 2.812 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000301873852 258071874 /nfs/dbraw/zinc/07/18/74/258071874.db2.gz HZAVMJPFMIGKIX-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000301873852 258071875 /nfs/dbraw/zinc/07/18/75/258071875.db2.gz HZAVMJPFMIGKIX-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc(NC2CCN(CC[NH+](C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302017995 258082344 /nfs/dbraw/zinc/08/23/44/258082344.db2.gz MLTDMWCZKDAKOB-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000330554591 258165422 /nfs/dbraw/zinc/16/54/22/258165422.db2.gz GIDZHFJTJWHNGW-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000331148484 258178488 /nfs/dbraw/zinc/17/84/88/258178488.db2.gz NYJPZXRPKVPKJU-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000331212507 258179830 /nfs/dbraw/zinc/17/98/30/258179830.db2.gz KFKYEFNLAOQMJN-FRRDWIJNSA-N 1 1 351.451 2.538 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[NH+](CCC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000331218209 258179987 /nfs/dbraw/zinc/17/99/87/258179987.db2.gz ROXOMVWGRKSOMT-UHFFFAOYSA-N 1 1 351.451 2.635 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000332007020 258209619 /nfs/dbraw/zinc/20/96/19/258209619.db2.gz JJQONTLPJIUVJF-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000332343499 258226213 /nfs/dbraw/zinc/22/62/13/258226213.db2.gz SRCLUXCLRCDYFD-UONOGXRCSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000064960352 506246561 /nfs/dbraw/zinc/24/65/61/506246561.db2.gz UIRVHUMDEPEKHC-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2ccccc2)CC1 ZINC000032723372 506283675 /nfs/dbraw/zinc/28/36/75/506283675.db2.gz LPDTVSXNXXXJBW-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO C[N@@H+](CCCNC(=O)COc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000032766055 506291916 /nfs/dbraw/zinc/29/19/16/506291916.db2.gz SZIPXUPOTJKVDY-UHFFFAOYSA-N 1 1 357.410 2.612 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCCC2(CC[NH+](C)CC2)C1 ZINC000366864599 512224046 /nfs/dbraw/zinc/22/40/46/512224046.db2.gz LMAWRGLVBXKCCG-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCCC2(CC[NH+](C)CC2)C1 ZINC000366884817 512233501 /nfs/dbraw/zinc/23/35/01/512233501.db2.gz ORNPEGMJPZCVMJ-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000366955483 512267662 /nfs/dbraw/zinc/26/76/62/512267662.db2.gz RBZOLWWNPROZBK-OAHLLOKOSA-N 1 1 371.393 2.529 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000366955483 512267664 /nfs/dbraw/zinc/26/76/64/512267664.db2.gz RBZOLWWNPROZBK-OAHLLOKOSA-N 1 1 371.393 2.529 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC1 ZINC000053574779 506409173 /nfs/dbraw/zinc/40/91/73/506409173.db2.gz PSDDCPDBHBULQW-UHFFFAOYSA-N 1 1 362.474 2.903 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000039537294 506452194 /nfs/dbraw/zinc/45/21/94/506452194.db2.gz CNVJESUZIGKVIE-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000054011670 506477289 /nfs/dbraw/zinc/47/72/89/506477289.db2.gz IFNFLXNRRFNDHX-UHFFFAOYSA-N 1 1 368.397 2.798 20 5 FFBDMO CC(C)COC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000054325220 506539173 /nfs/dbraw/zinc/53/91/73/506539173.db2.gz ZZNFVZKNLUTQLP-UHFFFAOYSA-N 1 1 361.442 2.621 20 5 FFBDMO Cc1csc(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000055902529 506880570 /nfs/dbraw/zinc/88/05/70/506880570.db2.gz NMYOJXISYDCOBU-UHFFFAOYSA-N 1 1 362.455 2.951 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000045623716 506993414 /nfs/dbraw/zinc/99/34/14/506993414.db2.gz JOGBXAXGRVJILD-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000015307636 507031654 /nfs/dbraw/zinc/03/16/54/507031654.db2.gz WFSFEXGBARHSRX-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000015307636 507031664 /nfs/dbraw/zinc/03/16/64/507031664.db2.gz WFSFEXGBARHSRX-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000056519608 507036514 /nfs/dbraw/zinc/03/65/14/507036514.db2.gz ZNYXUAWRUPAZGT-QWHCGFSZSA-N 1 1 350.419 2.845 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000067910592 507049947 /nfs/dbraw/zinc/04/99/47/507049947.db2.gz UOGRRSKQYUVFQS-UHFFFAOYSA-N 1 1 371.437 2.914 20 5 FFBDMO O=[N+]([O-])c1cccc(OCCN2CC[NH+](CCOc3ccccc3)CC2)c1 ZINC000046055803 507068446 /nfs/dbraw/zinc/06/84/46/507068446.db2.gz NJYIFVFVNHQDQW-UHFFFAOYSA-N 1 1 371.437 2.670 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000067961859 507069317 /nfs/dbraw/zinc/06/93/17/507069317.db2.gz GSDNUJYFUHSYFS-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000067961859 507069322 /nfs/dbraw/zinc/06/93/22/507069322.db2.gz GSDNUJYFUHSYFS-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1C)[N@H+]1CCc2ccccc2C1 ZINC000046246583 507104636 /nfs/dbraw/zinc/10/46/36/507104636.db2.gz GTHDUUDKQDSMJQ-KRWDZBQOSA-N 1 1 368.437 2.865 20 5 FFBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccc(F)cc1 ZINC000051326290 507762713 /nfs/dbraw/zinc/76/27/13/507762713.db2.gz QBEXCKZTUNKPIZ-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000063711019 507763269 /nfs/dbraw/zinc/76/32/69/507763269.db2.gz BFLVLAPRRNEHES-HNNXBMFYSA-N 1 1 358.442 2.786 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000063758655 507768517 /nfs/dbraw/zinc/76/85/17/507768517.db2.gz FWOHDACXEMKQFC-IYBDPMFKSA-N 1 1 363.458 2.848 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2ccc(C(N)=O)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000051475224 507772216 /nfs/dbraw/zinc/77/22/16/507772216.db2.gz RBALBVZAZGBDAD-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCc3ccc4c(c3)CCO4)C2)nc1 ZINC000072665288 507840435 /nfs/dbraw/zinc/84/04/35/507840435.db2.gz NKDZEGWFHSGXHX-INIZCTEOSA-N 1 1 354.410 2.654 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000089644542 507853320 /nfs/dbraw/zinc/85/33/20/507853320.db2.gz KLDXLFRYXUQKOJ-HUUCEWRRSA-N 1 1 362.817 2.691 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000089925249 507884948 /nfs/dbraw/zinc/88/49/48/507884948.db2.gz NLAKHGLFUDBUTG-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO Cc1cnc(N[C@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667440 507895399 /nfs/dbraw/zinc/89/53/99/507895399.db2.gz FRKPJFSYZDQZLS-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cnc(N[C@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667440 507895401 /nfs/dbraw/zinc/89/54/01/507895401.db2.gz FRKPJFSYZDQZLS-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2CCc2ccccc2)c1 ZINC000090010440 507900927 /nfs/dbraw/zinc/90/09/27/507900927.db2.gz GBJGMYMBMSWLBS-HKUYNNGSSA-N 1 1 358.442 2.640 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCC[C@H](C)C1 ZINC000109291397 507953042 /nfs/dbraw/zinc/95/30/42/507953042.db2.gz OQDCHXWRUJVNLF-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO COCCCOCC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000091101669 507956150 /nfs/dbraw/zinc/95/61/50/507956150.db2.gz NYXPBFPTUHBHJY-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000091101669 507956152 /nfs/dbraw/zinc/95/61/52/507956152.db2.gz NYXPBFPTUHBHJY-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO C[C@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000110351213 508022028 /nfs/dbraw/zinc/02/20/28/508022028.db2.gz MJXVKFZMZHOJCA-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO Cc1cc(N[C@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765698 508053120 /nfs/dbraw/zinc/05/31/20/508053120.db2.gz OUYRRRQTEHAZPF-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cc(N[C@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765698 508053122 /nfs/dbraw/zinc/05/31/22/508053122.db2.gz OUYRRRQTEHAZPF-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000111178879 508075938 /nfs/dbraw/zinc/07/59/38/508075938.db2.gz XCBSYIZOOSUPLL-UHFFFAOYSA-N 1 1 369.469 2.918 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC000075329204 508098469 /nfs/dbraw/zinc/09/84/69/508098469.db2.gz OKUQDFJXAFYYJE-ZDUSSCGKSA-N 1 1 364.402 2.615 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000080959607 508117110 /nfs/dbraw/zinc/11/71/10/508117110.db2.gz AKDWPACILQYNDU-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000075588834 508120290 /nfs/dbraw/zinc/12/02/90/508120290.db2.gz FSMPWCOSJHILKC-PVUWLOKVSA-N 1 1 360.414 2.533 20 5 FFBDMO CCCc1n[nH]c(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122303 508140346 /nfs/dbraw/zinc/14/03/46/508140346.db2.gz JTBQCPLUQDAFIT-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122303 508140347 /nfs/dbraw/zinc/14/03/47/508140347.db2.gz JTBQCPLUQDAFIT-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000081122303 508140348 /nfs/dbraw/zinc/14/03/48/508140348.db2.gz JTBQCPLUQDAFIT-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CC(=O)Nc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534396 508148280 /nfs/dbraw/zinc/14/82/80/508148280.db2.gz DXJUBCHCGLGIGL-MRXNPFEDSA-N 1 1 355.398 2.635 20 5 FFBDMO Cc1cccn2c(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cnc12 ZINC000093534523 508148519 /nfs/dbraw/zinc/14/85/19/508148519.db2.gz WLRYMAKURGFNPU-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO COCC[N@@H+](C)CCCC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000093769385 508154525 /nfs/dbraw/zinc/15/45/25/508154525.db2.gz WXKDDHNDVKABKV-UHFFFAOYSA-N 1 1 365.474 2.871 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000081534134 508187186 /nfs/dbraw/zinc/18/71/86/508187186.db2.gz YABSQSOXKZQYKL-KRWDZBQOSA-N 1 1 368.437 2.740 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCO)CCc1ccccc1 ZINC000112698552 508210731 /nfs/dbraw/zinc/21/07/31/508210731.db2.gz MDSHPMCZLCIDLR-UHFFFAOYSA-N 1 1 371.437 2.769 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000367204490 512384567 /nfs/dbraw/zinc/38/45/67/512384567.db2.gz DABJWLYUILPJAF-FQEVSTJZSA-N 1 1 368.437 2.940 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000083248806 508242963 /nfs/dbraw/zinc/24/29/63/508242963.db2.gz IVKUTSMEPCOVQD-ZDUSSCGKSA-N 1 1 354.410 2.534 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000083248806 508242967 /nfs/dbraw/zinc/24/29/67/508242967.db2.gz IVKUTSMEPCOVQD-ZDUSSCGKSA-N 1 1 354.410 2.534 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000076757096 508251136 /nfs/dbraw/zinc/25/11/36/508251136.db2.gz SPYAKFPDJAFAKE-MRXNPFEDSA-N 1 1 354.410 2.744 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](Nc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000076757096 508251138 /nfs/dbraw/zinc/25/11/38/508251138.db2.gz SPYAKFPDJAFAKE-MRXNPFEDSA-N 1 1 354.410 2.744 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000114193974 508299425 /nfs/dbraw/zinc/29/94/25/508299425.db2.gz NTFBAXYEUBAMTJ-GOSISDBHSA-N 1 1 369.421 2.566 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114642916 508333381 /nfs/dbraw/zinc/33/33/81/508333381.db2.gz RPIQEFHMGPCLLL-GOSISDBHSA-N 1 1 369.421 2.754 20 5 FFBDMO CCOC(=O)c1ccnc(NCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000077905332 508390774 /nfs/dbraw/zinc/39/07/74/508390774.db2.gz JCRDHGYYPOPUDB-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2nc3sccn3c2[N+](=O)[O-])[C@H](C)C1 ZINC000115521392 508405110 /nfs/dbraw/zinc/40/51/10/508405110.db2.gz PGQQUFPRUIGPID-CHWSQXEVSA-N 1 1 367.475 2.853 20 5 FFBDMO CC[C@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000127261552 508422600 /nfs/dbraw/zinc/42/26/00/508422600.db2.gz MGHLCOGMEZJBBY-KRWDZBQOSA-N 1 1 368.437 2.924 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000156688061 508462322 /nfs/dbraw/zinc/46/23/22/508462322.db2.gz CELXJNXCAQZVCB-LRDDRELGSA-N 1 1 372.400 2.566 20 5 FFBDMO C[C@@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000116748329 508554118 /nfs/dbraw/zinc/55/41/18/508554118.db2.gz VDGOALYDABQWEC-NSHDSACASA-N 1 1 355.822 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000134918824 508575499 /nfs/dbraw/zinc/57/54/99/508575499.db2.gz SPTFVWARVUCHDM-HOCLYGCPSA-N 1 1 369.421 2.996 20 5 FFBDMO CSC[C@H]1CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000135484938 508611401 /nfs/dbraw/zinc/61/14/01/508611401.db2.gz SDNLLFSPTILDPG-CYBMUJFWSA-N 1 1 351.428 2.720 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(C2CCOCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000153648021 508616557 /nfs/dbraw/zinc/61/65/57/508616557.db2.gz ONJGGCRIUHCWOI-UHFFFAOYSA-N 1 1 361.442 2.696 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000123090624 508635071 /nfs/dbraw/zinc/63/50/71/508635071.db2.gz TXRDDTNDRYJURB-UHFFFAOYSA-N 1 1 361.489 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(-n4ccnc4)cc3)C2)nc1 ZINC000118866041 508687683 /nfs/dbraw/zinc/68/76/83/508687683.db2.gz NTDPNJNHCNGKAK-INIZCTEOSA-N 1 1 364.409 2.862 20 5 FFBDMO C[NH+](C)CCCC1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000123446414 508688275 /nfs/dbraw/zinc/68/82/75/508688275.db2.gz COFQUPUCOFCFKC-LJQANCHMSA-N 1 1 374.485 2.754 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000123626890 508716813 /nfs/dbraw/zinc/71/68/13/508716813.db2.gz XKUMXXYQHVMOEH-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@@H]21 ZINC000158593465 508725426 /nfs/dbraw/zinc/72/54/26/508725426.db2.gz SPPLINHUNNJSBU-HOCLYGCPSA-N 1 1 357.414 2.561 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000129742064 508760801 /nfs/dbraw/zinc/76/08/01/508760801.db2.gz WKQYCAKHPDGLGV-UHFFFAOYSA-N 1 1 369.487 2.867 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129778678 508765395 /nfs/dbraw/zinc/76/53/95/508765395.db2.gz CMIUPKJKCHUGME-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129778678 508765397 /nfs/dbraw/zinc/76/53/97/508765397.db2.gz CMIUPKJKCHUGME-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000159053082 508786454 /nfs/dbraw/zinc/78/64/54/508786454.db2.gz LSZQHVSJIWBHCG-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000139668498 508792920 /nfs/dbraw/zinc/79/29/20/508792920.db2.gz XQHFDSRRHJPQME-CPUCHLNUSA-N 1 1 362.430 2.700 20 5 FFBDMO Nc1ccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)cc1[N+](=O)[O-] ZINC000140179078 508800682 /nfs/dbraw/zinc/80/06/82/508800682.db2.gz KKXPBZHBGLVALX-CYBMUJFWSA-N 1 1 374.466 2.881 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000119597219 508825398 /nfs/dbraw/zinc/82/53/98/508825398.db2.gz KUTPVQDOUDALNW-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000119874305 508881423 /nfs/dbraw/zinc/88/14/23/508881423.db2.gz JEULZMRYLIHUQN-HNNXBMFYSA-N 1 1 365.430 2.679 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000155001540 508901028 /nfs/dbraw/zinc/90/10/28/508901028.db2.gz DBKKRYMNZCMEMW-CYBMUJFWSA-N 1 1 358.320 2.513 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)n1 ZINC000155001540 508901031 /nfs/dbraw/zinc/90/10/31/508901031.db2.gz DBKKRYMNZCMEMW-CYBMUJFWSA-N 1 1 358.320 2.513 20 5 FFBDMO Cc1ccccc1CC(=O)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000155119970 508928263 /nfs/dbraw/zinc/92/82/63/508928263.db2.gz BNUSNARFTBDXDH-UHFFFAOYSA-N 1 1 367.449 2.833 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000120110563 508930633 /nfs/dbraw/zinc/93/06/33/508930633.db2.gz FQVYEZATUAFGMT-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000125379317 508974816 /nfs/dbraw/zinc/97/48/16/508974816.db2.gz NMNIODQFXIBEPG-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000132411108 509027805 /nfs/dbraw/zinc/02/78/05/509027805.db2.gz WBDWXGKMYFMZCD-TZIWHRDSSA-N 1 1 374.529 2.778 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)CCC2CCOCC2)c([N+](=O)[O-])c1 ZINC000120622823 509033628 /nfs/dbraw/zinc/03/36/28/509033628.db2.gz YDOOYIMCMKODNY-UHFFFAOYSA-N 1 1 365.430 2.681 20 5 FFBDMO CC(C)(C)[N@H+](Cc1ccc(F)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000132775493 509073943 /nfs/dbraw/zinc/07/39/43/509073943.db2.gz DOTWZZBCOXXNMR-INIZCTEOSA-N 1 1 350.394 2.592 20 5 FFBDMO Cc1ccc([C@@H](C)NC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782581 509081943 /nfs/dbraw/zinc/08/19/43/509081943.db2.gz OAUBAUOTASBPRK-OXQOHEQNSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1ccc([C@@H](C)NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782581 509081948 /nfs/dbraw/zinc/08/19/48/509081948.db2.gz OAUBAUOTASBPRK-OXQOHEQNSA-N 1 1 369.465 2.973 20 5 FFBDMO C[C@H](NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801269 509085620 /nfs/dbraw/zinc/08/56/20/509085620.db2.gz BQPQZHQVFITUOO-MGPUTAFESA-N 1 1 355.438 2.665 20 5 FFBDMO C[C@H](NC[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000151801269 509085625 /nfs/dbraw/zinc/08/56/25/509085625.db2.gz BQPQZHQVFITUOO-MGPUTAFESA-N 1 1 355.438 2.665 20 5 FFBDMO CSCC[C@@H](C)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000126605194 509101648 /nfs/dbraw/zinc/10/16/48/509101648.db2.gz MQRSOHGBAUZDSV-GFCCVEGCSA-N 1 1 353.444 2.966 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2C)[nH+]1 ZINC000369496050 512437917 /nfs/dbraw/zinc/43/79/17/512437917.db2.gz HWQBJDDQTCISQN-CQSZACIVSA-N 1 1 355.398 2.718 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000156108523 509128562 /nfs/dbraw/zinc/12/85/62/509128562.db2.gz BEEDVTMZOPOBMS-DOMZBBRYSA-N 1 1 350.419 2.797 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)CC1 ZINC000195508956 509202784 /nfs/dbraw/zinc/20/27/84/509202784.db2.gz ZFCUPKXBBKFRDN-UHFFFAOYSA-N 1 1 361.471 2.801 20 5 FFBDMO C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185493463 509205577 /nfs/dbraw/zinc/20/55/77/509205577.db2.gz HQVCUOVUSKXFRS-UGSOOPFHSA-N 1 1 353.382 2.560 20 5 FFBDMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266834960 509218835 /nfs/dbraw/zinc/21/88/35/509218835.db2.gz FIKLNUUZERGXDH-CHWSQXEVSA-N 1 1 363.439 2.915 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H]1c1ccccc1 ZINC000248029578 509219890 /nfs/dbraw/zinc/21/98/90/509219890.db2.gz KAUABHDMDALFDP-SJLPKXTDSA-N 1 1 365.393 2.646 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000172834651 509263923 /nfs/dbraw/zinc/26/39/23/509263923.db2.gz DZQVCOODAGTLJP-OAHLLOKOSA-N 1 1 371.441 2.727 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000179132791 509279415 /nfs/dbraw/zinc/27/94/15/509279415.db2.gz RYKUPPNLPHJJEU-OALUTQOASA-N 1 1 368.437 2.882 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000163091627 509339165 /nfs/dbraw/zinc/33/91/65/509339165.db2.gz MEZYPDJNHWFJSH-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO CCOC(=O)C[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000182625239 509340664 /nfs/dbraw/zinc/34/06/64/509340664.db2.gz MEXGCAPEGOINFN-GFCCVEGCSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)c1 ZINC000173133760 509411938 /nfs/dbraw/zinc/41/19/38/509411938.db2.gz KSNBDKRTPJSHOE-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO C[C@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000227817812 509414611 /nfs/dbraw/zinc/41/46/11/509414611.db2.gz PQWOJKFYCBQVLY-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO COC[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000189417501 509565484 /nfs/dbraw/zinc/56/54/84/509565484.db2.gz CUEPSRLOYXNLML-XJKSGUPXSA-N 1 1 361.398 2.528 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000249474352 509689796 /nfs/dbraw/zinc/68/97/96/509689796.db2.gz JEAYUQVOYFNGJR-LSDHHAIUSA-N 1 1 369.487 2.562 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000249783706 509762172 /nfs/dbraw/zinc/76/21/72/509762172.db2.gz QVWFQQUIBIJMAR-KGLIPLIRSA-N 1 1 364.446 2.523 20 5 FFBDMO C[C@H](O)C[NH+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000189845623 509784411 /nfs/dbraw/zinc/78/44/11/509784411.db2.gz UMYQJSLLMJHVDC-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H](O)CN1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000189845623 509784420 /nfs/dbraw/zinc/78/44/20/509784420.db2.gz UMYQJSLLMJHVDC-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO NC(=O)c1ccc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000189847726 509785577 /nfs/dbraw/zinc/78/55/77/509785577.db2.gz XJWJJVPZPNYMMQ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO NC(=O)c1ccc(NCC[N@H+]2CCc3c(Cl)cccc3C2)c([N+](=O)[O-])c1 ZINC000189847726 509785588 /nfs/dbraw/zinc/78/55/88/509785588.db2.gz XJWJJVPZPNYMMQ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177038914 509832716 /nfs/dbraw/zinc/83/27/16/509832716.db2.gz QVQLKCZCPRCVED-ZDUSSCGKSA-N 1 1 360.414 2.864 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177038914 509832718 /nfs/dbraw/zinc/83/27/18/509832718.db2.gz QVQLKCZCPRCVED-ZDUSSCGKSA-N 1 1 360.414 2.864 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[C@H](C)C1 ZINC000190007474 509881445 /nfs/dbraw/zinc/88/14/45/509881445.db2.gz JEAYUQVOYFNGJR-CABCVRRESA-N 1 1 369.487 2.562 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)C[C@@H](O)c2ccco2)n1 ZINC000177160261 509910607 /nfs/dbraw/zinc/91/06/07/509910607.db2.gz JQWUUMHGUVGFOF-MRXNPFEDSA-N 1 1 356.382 2.620 20 5 FFBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245407838 509910889 /nfs/dbraw/zinc/91/08/89/509910889.db2.gz DDDWLHPUNDTHLB-VQIMIIECSA-N 1 1 359.426 2.900 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c1C ZINC000261648572 510013864 /nfs/dbraw/zinc/01/38/64/510013864.db2.gz JHNRIUJCFWQWPK-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265443708 510057643 /nfs/dbraw/zinc/05/76/43/510057643.db2.gz AGUFLYAOXWNGMB-QWHCGFSZSA-N 1 1 368.865 2.849 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000265492891 510083955 /nfs/dbraw/zinc/08/39/55/510083955.db2.gz NMVVJNZLVUJTEC-GFCCVEGCSA-N 1 1 373.413 2.533 20 5 FFBDMO C[C@@H](C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000184013101 510087057 /nfs/dbraw/zinc/08/70/57/510087057.db2.gz SMGDPOUMUPCBHZ-JSGCOSHPSA-N 1 1 351.428 2.527 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)c1[N+](=O)[O-] ZINC000171368267 510110611 /nfs/dbraw/zinc/11/06/11/510110611.db2.gz MCSPEDXFMYJADK-ZDUSSCGKSA-N 1 1 365.821 2.566 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245751075 510129158 /nfs/dbraw/zinc/12/91/58/510129158.db2.gz YTWTYGHLHOKVEF-YOEHRIQHSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245751075 510129171 /nfs/dbraw/zinc/12/91/71/510129171.db2.gz YTWTYGHLHOKVEF-YOEHRIQHSA-N 1 1 357.414 2.621 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]2N1C1CC1 ZINC000245788542 510144940 /nfs/dbraw/zinc/14/49/40/510144940.db2.gz NHYOTLHCQRVBOG-BLLLJJGKSA-N 1 1 370.409 2.711 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]2N1C1CC1 ZINC000245788542 510144947 /nfs/dbraw/zinc/14/49/47/510144947.db2.gz NHYOTLHCQRVBOG-BLLLJJGKSA-N 1 1 370.409 2.711 20 5 FFBDMO CCc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2OC)cc1[N+](=O)[O-] ZINC000262073655 510168193 /nfs/dbraw/zinc/16/81/93/510168193.db2.gz XBSVYVDZOBDRDU-GOSISDBHSA-N 1 1 369.421 2.953 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000262103331 510178975 /nfs/dbraw/zinc/17/89/75/510178975.db2.gz ZLTYOUCSRHABBJ-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cc1Br ZINC000265757259 510212963 /nfs/dbraw/zinc/21/29/63/510212963.db2.gz JHWQPNODCMDALK-ZIAGYGMSSA-N 1 1 368.231 2.714 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)C2 ZINC000174679136 510247746 /nfs/dbraw/zinc/24/77/46/510247746.db2.gz RCQKTBPMJOANGZ-CMPLNLGQSA-N 1 1 368.231 2.666 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000265936167 510311381 /nfs/dbraw/zinc/31/13/81/510311381.db2.gz FCPNCCQEBLHMIW-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000246154456 510325076 /nfs/dbraw/zinc/32/50/76/510325076.db2.gz KQLWXKXSDWELGB-OWCLPIDISA-N 1 1 374.485 2.759 20 5 FFBDMO CCc1[nH]nc(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000171870748 510421214 /nfs/dbraw/zinc/42/12/14/510421214.db2.gz GDCXZGVEXYCAEV-LBPRGKRZSA-N 1 1 373.413 2.526 20 5 FFBDMO C[NH+]1CCC(N2CCC(Nc3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000269647622 510498289 /nfs/dbraw/zinc/49/82/89/510498289.db2.gz PTPYPEOGRMNWAW-UHFFFAOYSA-N 1 1 354.401 2.844 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2Cc2ccccc2Cl)c1 ZINC000246661875 510606994 /nfs/dbraw/zinc/60/69/94/510606994.db2.gz FHTFXGAUYDKNHJ-GOEBONIOSA-N 1 1 364.833 2.513 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000246730091 510639601 /nfs/dbraw/zinc/63/96/01/510639601.db2.gz MVZOVJDKHONBLT-HZPDHXFCSA-N 1 1 350.806 2.643 20 5 FFBDMO COc1cccc(N2CC[NH+](CCOc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000185109427 510689026 /nfs/dbraw/zinc/68/90/26/510689026.db2.gz SAZINVKLQKDVPE-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246883648 510727381 /nfs/dbraw/zinc/72/73/81/510727381.db2.gz TYBFDUPMYZJKEF-BBRMVZONSA-N 1 1 367.421 2.601 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000246914902 510743055 /nfs/dbraw/zinc/74/30/55/510743055.db2.gz INPLEWFYGKULQB-HIFRSBDPSA-N 1 1 351.834 2.876 20 5 FFBDMO CC[N@@H+](CC(=O)[O-])C1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000263550660 510745943 /nfs/dbraw/zinc/74/59/43/510745943.db2.gz KOQPVOGXEPZPHW-UHFFFAOYSA-N 1 1 372.425 2.827 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732734 510758986 /nfs/dbraw/zinc/75/89/86/510758986.db2.gz BKGBFXCQFXPPOC-GDBMZVCRSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732734 510758990 /nfs/dbraw/zinc/75/89/90/510758990.db2.gz BKGBFXCQFXPPOC-GDBMZVCRSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732734 510758994 /nfs/dbraw/zinc/75/89/94/510758994.db2.gz BKGBFXCQFXPPOC-GDBMZVCRSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000175732734 510758998 /nfs/dbraw/zinc/75/89/98/510758998.db2.gz BKGBFXCQFXPPOC-GDBMZVCRSA-N 1 1 351.447 2.644 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185298432 510795866 /nfs/dbraw/zinc/79/58/66/510795866.db2.gz LNEGVGVUBPTELS-IBGZPJMESA-N 1 1 368.437 2.939 20 5 FFBDMO O=C(CCN1CCC[N@H+](C2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000172584428 510805248 /nfs/dbraw/zinc/80/52/48/510805248.db2.gz QVXOBYFSJSWYKL-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000178865200 510810403 /nfs/dbraw/zinc/81/04/03/510810403.db2.gz TZGBHDXNICAWOI-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1csc([N+](=O)[O-])c1 ZINC000172596962 510812030 /nfs/dbraw/zinc/81/20/30/510812030.db2.gz LSPNYEPTYXPNNE-AWEZNQCLSA-N 1 1 374.466 2.597 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C(N)=O)c1ccccn1 ZINC000297428731 510942778 /nfs/dbraw/zinc/94/27/78/510942778.db2.gz VDPXSLBLIFRBOX-LRDDRELGSA-N 1 1 360.439 2.677 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282469209 510990793 /nfs/dbraw/zinc/99/07/93/510990793.db2.gz NQMHGPJZOIWJOS-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(OC)c(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282469209 510990799 /nfs/dbraw/zinc/99/07/99/510990799.db2.gz NQMHGPJZOIWJOS-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279313148 511042284 /nfs/dbraw/zinc/04/22/84/511042284.db2.gz OPCMKOMCYNLNJT-YMTOWFKASA-N 1 1 355.797 2.529 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000271117735 511088611 /nfs/dbraw/zinc/08/86/11/511088611.db2.gz WSMILKOKABFCCI-UHFFFAOYSA-N 1 1 366.414 2.777 20 5 FFBDMO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000362253499 511154993 /nfs/dbraw/zinc/15/49/93/511154993.db2.gz DWKGTYVKDFUMMQ-QGZVFWFLSA-N 1 1 366.893 2.849 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+]1C ZINC000294934735 511226317 /nfs/dbraw/zinc/22/63/17/511226317.db2.gz LEVDQBITTNXWDI-SWLSCSKDSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@@H+]1C ZINC000294934735 511226321 /nfs/dbraw/zinc/22/63/21/511226321.db2.gz LEVDQBITTNXWDI-SWLSCSKDSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@H+]1C ZINC000294934735 511226325 /nfs/dbraw/zinc/22/63/25/511226325.db2.gz LEVDQBITTNXWDI-SWLSCSKDSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)c2C[C@@H]1C ZINC000295109396 511284837 /nfs/dbraw/zinc/28/48/37/511284837.db2.gz HJQYWLPNPBMZLR-MNOVXSKESA-N 1 1 372.381 2.530 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3OC)sc2C1 ZINC000365176357 511301845 /nfs/dbraw/zinc/30/18/45/511301845.db2.gz JGTAYMWHJLBARV-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3OC)sc2C1 ZINC000365176357 511301848 /nfs/dbraw/zinc/30/18/48/511301848.db2.gz JGTAYMWHJLBARV-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000363026745 511306055 /nfs/dbraw/zinc/30/60/55/511306055.db2.gz MPRFWZOOZVMRJA-HUUCEWRRSA-N 1 1 358.442 2.552 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000291764046 511327972 /nfs/dbraw/zinc/32/79/72/511327972.db2.gz DHYROVJPWRFRTQ-SNVBAGLBSA-N 1 1 358.236 2.816 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000298659290 511364559 /nfs/dbraw/zinc/36/45/59/511364559.db2.gz XVMYYKLRYFXUIJ-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000298659290 511364563 /nfs/dbraw/zinc/36/45/63/511364563.db2.gz XVMYYKLRYFXUIJ-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000272027853 511406728 /nfs/dbraw/zinc/40/67/28/511406728.db2.gz WCXSDNHTGGALSA-UHFFFAOYSA-N 1 1 358.442 2.577 20 5 FFBDMO CCOc1cc(N2CCN(CC[C@@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322630 511420805 /nfs/dbraw/zinc/42/08/05/511420805.db2.gz YNQBIXCJRJIOPR-INIZCTEOSA-N 1 1 362.474 2.600 20 5 FFBDMO C[C@@H](CO)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC1CCC1 ZINC000280494460 511487497 /nfs/dbraw/zinc/48/74/97/511487497.db2.gz MNQFBWMIVCTQSK-LBPRGKRZSA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625975 511567762 /nfs/dbraw/zinc/56/77/62/511567762.db2.gz IUUOGPVIVOMLBV-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633067 511571637 /nfs/dbraw/zinc/57/16/37/511571637.db2.gz URKOPWBWVHRRDF-ZDUSSCGKSA-N 1 1 358.398 2.574 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CSC)C1 ZINC000292382762 511577261 /nfs/dbraw/zinc/57/72/61/511577261.db2.gz JTESFFDUDZQMJG-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CSC)C1 ZINC000292382762 511577268 /nfs/dbraw/zinc/57/72/68/511577268.db2.gz JTESFFDUDZQMJG-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C2CC2)O1 ZINC000280743848 511584901 /nfs/dbraw/zinc/58/49/01/511584901.db2.gz ZYYAGUAIMYYLQU-FZKQIMNGSA-N 1 1 356.426 2.995 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C2CC2)O1 ZINC000280743848 511584904 /nfs/dbraw/zinc/58/49/04/511584904.db2.gz ZYYAGUAIMYYLQU-FZKQIMNGSA-N 1 1 356.426 2.995 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562305 511629496 /nfs/dbraw/zinc/62/94/96/511629496.db2.gz LLLIARJLBOAOFQ-QWHCGFSZSA-N 1 1 373.413 2.533 20 5 FFBDMO O=c1[nH]c(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000281027216 511693826 /nfs/dbraw/zinc/69/38/26/511693826.db2.gz SZUDZEJXQMXVCT-AWEZNQCLSA-N 1 1 365.393 2.930 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](O)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000296402845 511729602 /nfs/dbraw/zinc/72/96/02/511729602.db2.gz UWDSOQCCWLTOCI-ZWNOBZJWSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](O)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000296402845 511729606 /nfs/dbraw/zinc/72/96/06/511729606.db2.gz UWDSOQCCWLTOCI-ZWNOBZJWSA-N 1 1 360.357 2.593 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(c3ncc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000292865947 511751340 /nfs/dbraw/zinc/75/13/40/511751340.db2.gz SQGYAHIJVDYEDZ-CQSZACIVSA-N 1 1 355.236 2.674 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388262 511799789 /nfs/dbraw/zinc/79/97/89/511799789.db2.gz KOPBTYOSAQJPCY-MAUKXSAKSA-N 1 1 373.413 2.558 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388262 511799797 /nfs/dbraw/zinc/79/97/97/511799797.db2.gz KOPBTYOSAQJPCY-MAUKXSAKSA-N 1 1 373.413 2.558 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)C1 ZINC000293001157 511801786 /nfs/dbraw/zinc/80/17/86/511801786.db2.gz OWCODVMRMAGMHX-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO COc1c(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000350402004 511802571 /nfs/dbraw/zinc/80/25/71/511802571.db2.gz RRQDZJNPNZZUDP-CXAGYDPISA-N 1 1 360.370 2.579 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110229 511843420 /nfs/dbraw/zinc/84/34/20/511843420.db2.gz QVNHGZZAQBRWQN-KXBFYZLASA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110229 511843422 /nfs/dbraw/zinc/84/34/22/511843422.db2.gz QVNHGZZAQBRWQN-KXBFYZLASA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@@H](c1cnccn1)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274860783 511967861 /nfs/dbraw/zinc/96/78/61/511967861.db2.gz UEDQEISRMSTCQR-ZDUSSCGKSA-N 1 1 367.413 2.534 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)c1 ZINC000375688651 512456212 /nfs/dbraw/zinc/45/62/12/512456212.db2.gz BQELWMLEEBCMCD-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000373746645 512484723 /nfs/dbraw/zinc/48/47/23/512484723.db2.gz PNNLLIZGIOWLEB-UHFFFAOYSA-N 1 1 367.409 2.987 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000374028431 512629949 /nfs/dbraw/zinc/62/99/49/512629949.db2.gz QBJFLZCZPWXGDR-IIDMSEBBSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000374028431 512629954 /nfs/dbraw/zinc/62/99/54/512629954.db2.gz QBJFLZCZPWXGDR-IIDMSEBBSA-N 1 1 350.415 2.632 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378192616 512631472 /nfs/dbraw/zinc/63/14/72/512631472.db2.gz UGJVYPACLFYAHK-OLZOCXBDSA-N 1 1 368.231 2.714 20 5 FFBDMO COc1cc(C[NH2+][C@H]2CN(C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000378271388 512668585 /nfs/dbraw/zinc/66/85/85/512668585.db2.gz MQOSPVFFKODGHS-INIZCTEOSA-N 1 1 357.410 2.888 20 5 FFBDMO CN(c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000376175520 512695372 /nfs/dbraw/zinc/69/53/72/512695372.db2.gz WYDGNRPRRGDRCL-XYPWUTKMSA-N 1 1 358.442 2.548 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cncs1 ZINC000411678493 512753535 /nfs/dbraw/zinc/75/35/35/512753535.db2.gz SESYHHQOAZFMEL-UHFFFAOYSA-N 1 1 364.427 2.529 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000372272177 512791388 /nfs/dbraw/zinc/79/13/88/512791388.db2.gz GDLQHJOTEKFODF-FQEVSTJZSA-N 1 1 367.405 2.715 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000376395929 512799930 /nfs/dbraw/zinc/79/99/30/512799930.db2.gz NJEKTGNNJVTVPD-NSHDSACASA-N 1 1 358.427 2.792 20 5 FFBDMO Cn1ncc2c1CCC[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000411861833 512849057 /nfs/dbraw/zinc/84/90/57/512849057.db2.gz XSEFFQZFTNAWOQ-UHFFFAOYSA-N 1 1 367.409 2.974 20 5 FFBDMO CNc1c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000389892133 512903215 /nfs/dbraw/zinc/90/32/15/512903215.db2.gz WOLVNSRVWOVZMD-PBHICJAKSA-N 1 1 368.437 2.887 20 5 FFBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446346 512939070 /nfs/dbraw/zinc/93/90/70/512939070.db2.gz CODWTJWTHWFVOP-KSSFIOAISA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446346 512939076 /nfs/dbraw/zinc/93/90/76/512939076.db2.gz CODWTJWTHWFVOP-KSSFIOAISA-N 1 1 366.421 2.962 20 5 FFBDMO CNc1c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000396456972 512942512 /nfs/dbraw/zinc/94/25/12/512942512.db2.gz UGYKAVXEOCZQLK-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO CNc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000396456972 512942515 /nfs/dbraw/zinc/94/25/15/512942515.db2.gz UGYKAVXEOCZQLK-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408001217 512981806 /nfs/dbraw/zinc/98/18/06/512981806.db2.gz OAIWXKNJHFIJJJ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408001217 512981809 /nfs/dbraw/zinc/98/18/09/512981809.db2.gz OAIWXKNJHFIJJJ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C ZINC000408003323 512982661 /nfs/dbraw/zinc/98/26/61/512982661.db2.gz DZSIQOLWKVYIFY-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C ZINC000408003323 512982663 /nfs/dbraw/zinc/98/26/63/512982663.db2.gz DZSIQOLWKVYIFY-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@](O)(c4ccc(F)cc4)C3)nc2c1 ZINC000374898548 513061182 /nfs/dbraw/zinc/06/11/82/513061182.db2.gz ODWFQCAURHCSKF-GOSISDBHSA-N 1 1 357.341 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@](O)(c4ccc(F)cc4)C3)nc2c1 ZINC000374898548 513061184 /nfs/dbraw/zinc/06/11/84/513061184.db2.gz ODWFQCAURHCSKF-GOSISDBHSA-N 1 1 357.341 2.969 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000439705432 513168863 /nfs/dbraw/zinc/16/88/63/513168863.db2.gz USHHIOYCLZAQPR-CYBMUJFWSA-N 1 1 352.410 2.556 20 5 FFBDMO C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000450417560 513185564 /nfs/dbraw/zinc/18/55/64/513185564.db2.gz JVJVYYYSMXEZKN-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000450417560 513185568 /nfs/dbraw/zinc/18/55/68/513185568.db2.gz JVJVYYYSMXEZKN-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450473251 513210607 /nfs/dbraw/zinc/21/06/07/513210607.db2.gz HCESENCPFFJIIK-ZDUSSCGKSA-N 1 1 362.455 2.611 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020142 513258232 /nfs/dbraw/zinc/25/82/32/513258232.db2.gz MQHBXDXHCUTVDK-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@H]1N1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020142 513258240 /nfs/dbraw/zinc/25/82/40/513258240.db2.gz MQHBXDXHCUTVDK-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@H]1N1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020142 513258248 /nfs/dbraw/zinc/25/82/48/513258248.db2.gz MQHBXDXHCUTVDK-IIDMSEBBSA-N 1 1 360.458 2.586 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1N[C@@H]1CCC[N@H+](CCCO)C1 ZINC000450621444 513276434 /nfs/dbraw/zinc/27/64/34/513276434.db2.gz WXLNAGVYSYQQNE-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000429171700 513297782 /nfs/dbraw/zinc/29/77/82/513297782.db2.gz OIBGMBDBYPFOKE-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000429171700 513297791 /nfs/dbraw/zinc/29/77/91/513297791.db2.gz OIBGMBDBYPFOKE-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000446724220 513324413 /nfs/dbraw/zinc/32/44/13/513324413.db2.gz YOYRUSUELMFLGY-UYAOXDASSA-N 1 1 356.422 2.998 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1C(C)C ZINC000429376623 513356850 /nfs/dbraw/zinc/35/68/50/513356850.db2.gz GRXMOXJWMTYPFP-HOCLYGCPSA-N 1 1 374.397 2.664 20 5 FFBDMO Cc1c(Br)cc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000421709777 513379907 /nfs/dbraw/zinc/37/99/07/513379907.db2.gz HBFYHPWEZZAFHQ-LBPRGKRZSA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000425061332 513398159 /nfs/dbraw/zinc/39/81/59/513398159.db2.gz YTGGNBAFSMWQPR-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])c4ncccc43)CC2)CCO1 ZINC000413074379 513426800 /nfs/dbraw/zinc/42/68/00/513426800.db2.gz JABCPBQOYSMABG-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413089585 513437483 /nfs/dbraw/zinc/43/74/83/513437483.db2.gz HSQOZGIZKSNLIH-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294424 513533559 /nfs/dbraw/zinc/53/35/59/513533559.db2.gz HKRZARUVOZMENS-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441294424 513533561 /nfs/dbraw/zinc/53/35/61/513533561.db2.gz HKRZARUVOZMENS-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO C[C@@H](CN1CCOCC1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425466412 513581027 /nfs/dbraw/zinc/58/10/27/513581027.db2.gz ASXMYQPUWWFHCR-LBPRGKRZSA-N 1 1 372.263 2.510 20 5 FFBDMO C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425466412 513581033 /nfs/dbraw/zinc/58/10/33/513581033.db2.gz ASXMYQPUWWFHCR-LBPRGKRZSA-N 1 1 372.263 2.510 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000430238729 513594691 /nfs/dbraw/zinc/59/46/91/513594691.db2.gz ISAJPPKPWMSVQW-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000430238729 513594694 /nfs/dbraw/zinc/59/46/94/513594694.db2.gz ISAJPPKPWMSVQW-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](n2ccnn2)C1 ZINC000425497122 513602009 /nfs/dbraw/zinc/60/20/09/513602009.db2.gz CAVNCQNJIDJHBW-SWLSCSKDSA-N 1 1 369.385 2.634 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](n2ccnn2)C1 ZINC000425497122 513602017 /nfs/dbraw/zinc/60/20/17/513602017.db2.gz CAVNCQNJIDJHBW-SWLSCSKDSA-N 1 1 369.385 2.634 20 5 FFBDMO COc1cc(CNC[C@@H]2[N@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000447899969 513620411 /nfs/dbraw/zinc/62/04/11/513620411.db2.gz YPNWRUJLTJMKLJ-KRWDZBQOSA-N 1 1 351.447 2.822 20 5 FFBDMO COc1cc(CNC[C@@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000447899969 513620419 /nfs/dbraw/zinc/62/04/19/513620419.db2.gz YPNWRUJLTJMKLJ-KRWDZBQOSA-N 1 1 351.447 2.822 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1C[C@H](c2ccccc2)[C@](F)(CO)C1 ZINC000451262356 513634843 /nfs/dbraw/zinc/63/48/43/513634843.db2.gz KPUZLDQXQCMKHP-VQIMIIECSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@H](c2ccccc2)[C@](F)(CO)C1 ZINC000451262356 513634853 /nfs/dbraw/zinc/63/48/53/513634853.db2.gz KPUZLDQXQCMKHP-VQIMIIECSA-N 1 1 360.385 2.774 20 5 FFBDMO COc1cccc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000435903320 513711377 /nfs/dbraw/zinc/71/13/77/513711377.db2.gz QQDSMACQWQSIRS-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000430683739 513721308 /nfs/dbraw/zinc/72/13/08/513721308.db2.gz KUJLCVJSJFLZDT-MRXNPFEDSA-N 1 1 361.442 2.663 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451417260 513738421 /nfs/dbraw/zinc/73/84/21/513738421.db2.gz KYOCQLBIZNWGDC-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c1 ZINC000419311419 513772213 /nfs/dbraw/zinc/77/22/13/513772213.db2.gz CWQQAUXEAIFCSC-YLJYHZDGSA-N 1 1 372.421 2.878 20 5 FFBDMO O=C(C[N@@H+]1CCSC[C@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000419371403 513789914 /nfs/dbraw/zinc/78/99/14/513789914.db2.gz IWCOOALYTOSBFC-KRWDZBQOSA-N 1 1 361.467 2.701 20 5 FFBDMO O=C(C[N@H+]1CCSC[C@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000419371403 513789917 /nfs/dbraw/zinc/78/99/17/513789917.db2.gz IWCOOALYTOSBFC-KRWDZBQOSA-N 1 1 361.467 2.701 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000448695985 513849482 /nfs/dbraw/zinc/84/94/82/513849482.db2.gz CKYZXQHPJIUYHN-RYUDHWBXSA-N 1 1 353.394 2.735 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC2(O)CCCCCC2)c([N+](=O)[O-])c1 ZINC000426240722 513880934 /nfs/dbraw/zinc/88/09/34/513880934.db2.gz ROKGNCWMAWMJEP-UHFFFAOYSA-N 1 1 352.431 2.999 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000448821735 513915059 /nfs/dbraw/zinc/91/50/59/513915059.db2.gz HRSZSSOFXOOKEV-AWEZNQCLSA-N 1 1 371.441 2.835 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448984990 514007360 /nfs/dbraw/zinc/00/73/60/514007360.db2.gz VKHNQVXHFSAYDY-INIZCTEOSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414334430 514053544 /nfs/dbraw/zinc/05/35/44/514053544.db2.gz XFPDWFHBBYALRU-JTQLQIEISA-N 1 1 361.427 2.831 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1S(C)(=O)=O ZINC000444001087 514095906 /nfs/dbraw/zinc/09/59/06/514095906.db2.gz JROFDJVDKJLFBF-UHFFFAOYSA-N 1 1 352.387 2.736 20 5 FFBDMO CC[N@@H+](CCNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1)C(C)C ZINC000444175445 514144474 /nfs/dbraw/zinc/14/44/74/514144474.db2.gz KBHKGAIUDGDUGV-UHFFFAOYSA-N 1 1 363.867 2.565 20 5 FFBDMO CC(C)[N@@H+]1CCO[C@@H](c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)C1 ZINC000420497634 514173903 /nfs/dbraw/zinc/17/39/03/514173903.db2.gz CRCYBIZHRZTXQK-OAHLLOKOSA-N 1 1 373.413 2.785 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](c2nc(-c3ccc([N+](=O)[O-])c4c3CCCN4)no2)C1 ZINC000420497634 514173908 /nfs/dbraw/zinc/17/39/08/514173908.db2.gz CRCYBIZHRZTXQK-OAHLLOKOSA-N 1 1 373.413 2.785 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414563247 514181866 /nfs/dbraw/zinc/18/18/66/514181866.db2.gz VVMLGXHCRAQVRJ-LJQANCHMSA-N 1 1 372.425 2.770 20 5 FFBDMO COc1ccc(C[N@@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000449666479 514290447 /nfs/dbraw/zinc/29/04/47/514290447.db2.gz PJJYEJMJLZLWHJ-LBPRGKRZSA-N 1 1 361.364 2.919 20 5 FFBDMO COc1ccc(C[N@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000449666479 514290456 /nfs/dbraw/zinc/29/04/56/514290456.db2.gz PJJYEJMJLZLWHJ-LBPRGKRZSA-N 1 1 361.364 2.919 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423940578 514297794 /nfs/dbraw/zinc/29/77/94/514297794.db2.gz CFWBAZMCWZYILS-SFHVURJKSA-N 1 1 354.410 2.900 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000432983612 514342654 /nfs/dbraw/zinc/34/26/54/514342654.db2.gz KBAZXPWJRFDEJX-AWEZNQCLSA-N 1 1 350.419 2.526 20 5 FFBDMO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000432986392 514342887 /nfs/dbraw/zinc/34/28/87/514342887.db2.gz VVYNFTLXZJQECK-JTQLQIEISA-N 1 1 367.203 2.877 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C ZINC000444896551 514363639 /nfs/dbraw/zinc/36/36/39/514363639.db2.gz MMDNJTKMWZUHCW-OLZOCXBDSA-N 1 1 350.419 2.940 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCSC1 ZINC000433194344 514416518 /nfs/dbraw/zinc/41/65/18/514416518.db2.gz WGYWHQONRSXKBR-OAHLLOKOSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCSC1 ZINC000433194344 514416522 /nfs/dbraw/zinc/41/65/22/514416522.db2.gz WGYWHQONRSXKBR-OAHLLOKOSA-N 1 1 367.471 2.686 20 5 FFBDMO C[N@@H+](CC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCSC1 ZINC000452863723 514523327 /nfs/dbraw/zinc/52/33/27/514523327.db2.gz VXOXRWBQHVYDDD-WBVHZDCISA-N 1 1 363.483 2.738 20 5 FFBDMO CC(C)(CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[NH+]1CCOCC1 ZINC000450211664 514542696 /nfs/dbraw/zinc/54/26/96/514542696.db2.gz AMFMAAHDDSGJHM-UHFFFAOYSA-N 1 1 362.455 2.663 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3nccc4cc([N+](=O)[O-])ccc43)CC2)CCO1 ZINC000450260387 514569301 /nfs/dbraw/zinc/56/93/01/514569301.db2.gz JLWCLXRWGQWVKS-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458155833 514588853 /nfs/dbraw/zinc/58/88/53/514588853.db2.gz AXNFWQYBHQWMEO-QWHCGFSZSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1c(C[N@@H+](C)C[C@@H]2C[C@H](F)CN2Cc2ncccn2)cccc1[N+](=O)[O-] ZINC000470810746 514619849 /nfs/dbraw/zinc/61/98/49/514619849.db2.gz IHPSWUSZVLTSIT-IRXDYDNUSA-N 1 1 373.432 2.738 20 5 FFBDMO C[NH+](C)CCN(Cc1ccsc1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000458201442 514622365 /nfs/dbraw/zinc/62/23/65/514622365.db2.gz MLEKVOBZZSIUIS-UHFFFAOYSA-N 1 1 373.438 2.737 20 5 FFBDMO Cc1ccc(S(=O)(=O)N(CC[NH+](C)C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000508016586 514638143 /nfs/dbraw/zinc/63/81/43/514638143.db2.gz UGMUCTCMUNSWNK-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000458228499 514646344 /nfs/dbraw/zinc/64/63/44/514646344.db2.gz UUFNAKDONMNJMI-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475423150 514656167 /nfs/dbraw/zinc/65/61/67/514656167.db2.gz QIZCPRUNFDAFJS-KRWDZBQOSA-N 1 1 369.421 2.707 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000461616815 514668601 /nfs/dbraw/zinc/66/86/01/514668601.db2.gz ILMJHIHNUUYTMH-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000489315715 514794261 /nfs/dbraw/zinc/79/42/61/514794261.db2.gz REZQVKYPECBJOV-IUODEOHRSA-N 1 1 369.849 2.814 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[C@@H](C)C1 ZINC000484855045 514816292 /nfs/dbraw/zinc/81/62/92/514816292.db2.gz GLUZLZDUXSJTQR-GDBMZVCRSA-N 1 1 361.442 2.621 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC000484884016 514829487 /nfs/dbraw/zinc/82/94/87/514829487.db2.gz MFKGSIKYFNHTIO-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919891 514845684 /nfs/dbraw/zinc/84/56/84/514845684.db2.gz MFPHFDPDUJCQFH-GJZGRUSLSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919891 514845741 /nfs/dbraw/zinc/84/57/41/514845741.db2.gz MFPHFDPDUJCQFH-GJZGRUSLSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919891 514845754 /nfs/dbraw/zinc/84/57/54/514845754.db2.gz MFPHFDPDUJCQFH-GJZGRUSLSA-N 1 1 351.447 2.787 20 5 FFBDMO Cc1cc(F)cc2c1C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC2 ZINC000502969300 514863126 /nfs/dbraw/zinc/86/31/26/514863126.db2.gz KVCDZLJCCXJGJD-QGZVFWFLSA-N 1 1 360.385 2.840 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000467214554 514942885 /nfs/dbraw/zinc/94/28/85/514942885.db2.gz CXSLRMOWDWETAC-BONVTDFDSA-N 1 1 352.822 2.530 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000485203979 514954461 /nfs/dbraw/zinc/95/44/61/514954461.db2.gz ICODQMLWMXMGEJ-AWEZNQCLSA-N 1 1 369.421 2.753 20 5 FFBDMO O=C1[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCN1Cc1ccc(F)cc1 ZINC000480473793 514970286 /nfs/dbraw/zinc/97/02/86/514970286.db2.gz SWMYGQBEWTUMGA-KRWDZBQOSA-N 1 1 361.348 2.764 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467409385 514999191 /nfs/dbraw/zinc/99/91/91/514999191.db2.gz WSBVLWHOGLXQKL-WDEREUQCSA-N 1 1 361.489 2.506 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467409385 514999196 /nfs/dbraw/zinc/99/91/96/514999196.db2.gz WSBVLWHOGLXQKL-WDEREUQCSA-N 1 1 361.489 2.506 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)C[NH+]1CCOCC1 ZINC000485397798 515023105 /nfs/dbraw/zinc/02/31/05/515023105.db2.gz CMZJHUMIUXLDJH-CQSZACIVSA-N 1 1 374.416 2.598 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000476381877 515027954 /nfs/dbraw/zinc/02/79/54/515027954.db2.gz YEYXDRGEKZQOAK-GOEBONIOSA-N 1 1 371.441 2.626 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC[C@H]1C ZINC000498711320 515035910 /nfs/dbraw/zinc/03/59/10/515035910.db2.gz SYBGJLSVFUIZMJ-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000472227235 515177659 /nfs/dbraw/zinc/17/76/59/515177659.db2.gz XYIPXVFEMTUJEH-LBPRGKRZSA-N 1 1 357.838 2.864 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)CC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490371449 515191056 /nfs/dbraw/zinc/19/10/56/515191056.db2.gz PYFAKSAHTWCHIK-UHFFFAOYSA-N 1 1 373.400 2.773 20 5 FFBDMO CCN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000472440707 515271677 /nfs/dbraw/zinc/27/16/77/515271677.db2.gz RXUJBCSFGWFXKA-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000472440707 515271682 /nfs/dbraw/zinc/27/16/82/515271682.db2.gz RXUJBCSFGWFXKA-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000472440707 515271689 /nfs/dbraw/zinc/27/16/89/515271689.db2.gz RXUJBCSFGWFXKA-AEFFLSMTSA-N 1 1 357.458 2.949 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000490671455 515279287 /nfs/dbraw/zinc/27/92/87/515279287.db2.gz LHHLCRPVRVVWGE-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO COc1c(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)cccc1[N+](=O)[O-] ZINC000477081350 515320188 /nfs/dbraw/zinc/32/01/88/515320188.db2.gz BGQMHTQFMONKAE-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000486160603 515359612 /nfs/dbraw/zinc/35/96/12/515359612.db2.gz VWVZOCNOTVONDR-LJQANCHMSA-N 1 1 371.437 2.572 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000481717005 515436780 /nfs/dbraw/zinc/43/67/80/515436780.db2.gz UXDCLNATUGGKSV-CYBMUJFWSA-N 1 1 368.865 2.822 20 5 FFBDMO C[C@@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])n2C)C[N@H+]1Cc1ccccc1 ZINC000510150547 515451230 /nfs/dbraw/zinc/45/12/30/515451230.db2.gz WMKVEKYAKKDKMB-NVXWUHKLSA-N 1 1 370.453 2.964 20 5 FFBDMO C[C@@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510259441 515486273 /nfs/dbraw/zinc/48/62/73/515486273.db2.gz QAZRFSQXWSLLOY-GDBMZVCRSA-N 1 1 356.426 2.953 20 5 FFBDMO CC[N@@H+](CCNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000454467909 515510557 /nfs/dbraw/zinc/51/05/57/515510557.db2.gz NQZGXQRZFVUUCW-INIZCTEOSA-N 1 1 360.458 2.968 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486527718 515524788 /nfs/dbraw/zinc/52/47/88/515524788.db2.gz DRFUKDNWBOELGM-LBPRGKRZSA-N 1 1 355.385 2.748 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000463492668 515525029 /nfs/dbraw/zinc/52/50/29/515525029.db2.gz UYJNKFYAWDDINK-UHFFFAOYSA-N 1 1 354.378 2.908 20 5 FFBDMO CCn1c2cc(F)ccc2[nH+]c1NCc1cc(OC)c(O)cc1[N+](=O)[O-] ZINC000463502828 515528377 /nfs/dbraw/zinc/52/83/77/515528377.db2.gz VNRLDZJNHZRNRZ-UHFFFAOYSA-N 1 1 360.345 2.852 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000492629351 515549333 /nfs/dbraw/zinc/54/93/33/515549333.db2.gz JXUKVXGSCFBVIH-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000493341246 515624254 /nfs/dbraw/zinc/62/42/54/515624254.db2.gz YMXHYWZVWQMXOL-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO O=c1cc2c(n[nH]1)CC[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000482295291 515638772 /nfs/dbraw/zinc/63/87/72/515638772.db2.gz VTQDXHOASUCTQN-UHFFFAOYSA-N 1 1 352.350 2.909 20 5 FFBDMO C[NH+]1CCN(CCC(C)(C)Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473530075 515649071 /nfs/dbraw/zinc/64/90/71/515649071.db2.gz XAUNNSZGQRYPDO-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO C[C@H]1[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000494045867 515719063 /nfs/dbraw/zinc/71/90/63/515719063.db2.gz CNRPIDYKQMBXLO-HNAYVOBHSA-N 1 1 369.421 2.753 20 5 FFBDMO C[N@@H+](CCn1cc(Br)cc([N+](=O)[O-])c1=O)Cc1ccccc1 ZINC000487099281 515756916 /nfs/dbraw/zinc/75/69/16/515756916.db2.gz LMXOEXHFNQGPOD-UHFFFAOYSA-N 1 1 366.215 2.651 20 5 FFBDMO CC(C)[C@H]1CN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)CC[N@H+]1C ZINC000487138628 515774676 /nfs/dbraw/zinc/77/46/76/515774676.db2.gz NRORSSUEDMMSHU-GOSISDBHSA-N 1 1 360.458 2.607 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000511122593 515792561 /nfs/dbraw/zinc/79/25/61/515792561.db2.gz ONJASKQTYCXRDU-SNVBAGLBSA-N 1 1 365.377 2.937 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000511122593 515792571 /nfs/dbraw/zinc/79/25/71/515792571.db2.gz ONJASKQTYCXRDU-SNVBAGLBSA-N 1 1 365.377 2.937 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487294878 515818677 /nfs/dbraw/zinc/81/86/77/515818677.db2.gz DIVWMEMFYSOYHX-GOEBONIOSA-N 1 1 356.426 2.574 20 5 FFBDMO CCC1(CC)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000464581335 515882670 /nfs/dbraw/zinc/88/26/70/515882670.db2.gz ODWVUNFRCKLIGN-AWEZNQCLSA-N 1 1 354.472 2.942 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000500856657 515885322 /nfs/dbraw/zinc/88/53/22/515885322.db2.gz ICQQNAQATCHATR-INIZCTEOSA-N 1 1 363.462 2.570 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000500872054 515890810 /nfs/dbraw/zinc/89/08/10/515890810.db2.gz VPLNYCRGBXVGIF-HNNXBMFYSA-N 1 1 363.462 2.570 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000469686121 515917632 /nfs/dbraw/zinc/91/76/32/515917632.db2.gz SPTJCYWBMXFCOG-KRWDZBQOSA-N 1 1 371.441 2.690 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000501076273 515968502 /nfs/dbraw/zinc/96/85/02/515968502.db2.gz QVVBJDOBGUPZBJ-JTQLQIEISA-N 1 1 371.235 2.821 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000487838947 516000335 /nfs/dbraw/zinc/00/03/35/516000335.db2.gz OGNRVOFGNIAEHK-RISCZKNCSA-N 1 1 354.838 2.573 20 5 FFBDMO O=C(C[N@@H+](CC1CC1)CC1CCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000483261892 516007617 /nfs/dbraw/zinc/00/76/17/516007617.db2.gz OBMOJMHGAQMHJX-UHFFFAOYSA-N 1 1 361.398 2.774 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000470173988 516161996 /nfs/dbraw/zinc/16/19/96/516161996.db2.gz HDPZVCXALZHADS-CYBMUJFWSA-N 1 1 369.368 2.943 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000507328432 516174008 /nfs/dbraw/zinc/17/40/08/516174008.db2.gz HPWJBMGIKUKVHC-LBPRGKRZSA-N 1 1 373.450 2.523 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000488713937 516291628 /nfs/dbraw/zinc/29/16/28/516291628.db2.gz MJTOOYAYMUBKKG-WDMOLILDSA-N 1 1 369.263 2.919 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000512668150 516319901 /nfs/dbraw/zinc/31/99/01/516319901.db2.gz JGTFUSXXAAMLGP-GPCFVJJQSA-N 1 1 361.467 2.648 20 5 FFBDMO O=C([C@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000512668150 516319904 /nfs/dbraw/zinc/31/99/04/516319904.db2.gz JGTFUSXXAAMLGP-GPCFVJJQSA-N 1 1 361.467 2.648 20 5 FFBDMO C[C@@H](C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000554280148 516358889 /nfs/dbraw/zinc/35/88/89/516358889.db2.gz XJDGGCVGZMLKNI-GJZGRUSLSA-N 1 1 371.437 2.680 20 5 FFBDMO Cc1cc(N2C[C@H]([NH+]3CCOCC3)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000557696345 516388998 /nfs/dbraw/zinc/38/89/98/516388998.db2.gz CLHCLOIWEPIRIO-HUUCEWRRSA-N 1 1 356.426 2.751 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2cc(O)ccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000513145754 516493041 /nfs/dbraw/zinc/49/30/41/516493041.db2.gz XWEJTHIDSBLUJM-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=C(CC[N@H+]1CCOc2cc(O)ccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000513145754 516493047 /nfs/dbraw/zinc/49/30/47/516493047.db2.gz XWEJTHIDSBLUJM-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000523605671 516517562 /nfs/dbraw/zinc/51/75/62/516517562.db2.gz JFVBJFJRJXTOGF-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO COCC[N@@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000523605671 516517567 /nfs/dbraw/zinc/51/75/67/516517567.db2.gz JFVBJFJRJXTOGF-UHFFFAOYSA-N 1 1 374.393 2.981 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCO[C@@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000540427531 516551716 /nfs/dbraw/zinc/55/17/16/516551716.db2.gz VJDJLAIFTWCTRS-RLFYNMQTSA-N 1 1 363.458 2.957 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000558096938 516592737 /nfs/dbraw/zinc/59/27/37/516592737.db2.gz YZDVMQDAUZJCQU-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO C[C@H]1CC[N@@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140114 516646769 /nfs/dbraw/zinc/64/67/69/516646769.db2.gz LAXFBSLUEBHELQ-XJKSGUPXSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@H]1CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140114 516646775 /nfs/dbraw/zinc/64/67/75/516646775.db2.gz LAXFBSLUEBHELQ-XJKSGUPXSA-N 1 1 357.410 2.739 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCCC[C@H]3[NH+]3CCOCC3)cc2N1 ZINC000531911012 516708757 /nfs/dbraw/zinc/70/87/57/516708757.db2.gz GBIGDYKKLVKKBA-WMLDXEAASA-N 1 1 374.441 2.535 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)C1 ZINC000561749741 516747277 /nfs/dbraw/zinc/74/72/77/516747277.db2.gz ZARHAHARDYIDOX-SUNYJGFJSA-N 1 1 368.437 2.945 20 5 FFBDMO Cc1cccc(N2CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)c1[N+](=O)[O-] ZINC000555121635 516790794 /nfs/dbraw/zinc/79/07/94/516790794.db2.gz MXPAPXORHKFAGQ-UHFFFAOYSA-N 1 1 369.421 2.997 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)n1 ZINC000541004453 516826671 /nfs/dbraw/zinc/82/66/71/516826671.db2.gz CBOAXEPLKXDMPR-KRWDZBQOSA-N 1 1 356.426 2.785 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600038 516845458 /nfs/dbraw/zinc/84/54/58/516845458.db2.gz RNCCGJIGANFBLN-HZPDHXFCSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600038 516845468 /nfs/dbraw/zinc/84/54/68/516845468.db2.gz RNCCGJIGANFBLN-HZPDHXFCSA-N 1 1 363.461 2.706 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541064560 516854906 /nfs/dbraw/zinc/85/49/06/516854906.db2.gz KKWQIERATZCHMO-OCCSQVGLSA-N 1 1 369.849 2.611 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514183605 516892307 /nfs/dbraw/zinc/89/23/07/516892307.db2.gz NNVKHSLGIWHXGH-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514183605 516892322 /nfs/dbraw/zinc/89/23/22/516892322.db2.gz NNVKHSLGIWHXGH-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO COCCN(Cc1ccc2c(c1)OCO2)Cc1cc(O)ccc1[N+](=O)[O-] ZINC000555364679 516900829 /nfs/dbraw/zinc/90/08/29/516900829.db2.gz NRXGNUCQHLZVIJ-UHFFFAOYSA-N 1 1 360.366 2.678 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C1CCCC1 ZINC000514204826 516901184 /nfs/dbraw/zinc/90/11/84/516901184.db2.gz VZSOYZGNLVHANW-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO C[N@@H+](CCC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C1CCCCC1 ZINC000548391968 516955429 /nfs/dbraw/zinc/95/54/29/516955429.db2.gz WUWRKFHAWHDNQR-UHFFFAOYSA-N 1 1 361.442 2.839 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc(NC)c([N+](=O)[O-])c1)CCC(F)(F)F ZINC000514704233 517012298 /nfs/dbraw/zinc/01/22/98/517012298.db2.gz OLFDCKAQNWDQGG-UHFFFAOYSA-N 1 1 362.352 2.641 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000541386328 517022298 /nfs/dbraw/zinc/02/22/98/517022298.db2.gz PAPWXROIXCIPBU-UHFFFAOYSA-N 1 1 373.409 2.812 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000525554727 517074177 /nfs/dbraw/zinc/07/41/77/517074177.db2.gz PEUUTBNRAOYPTK-MLGOLLRUSA-N 1 1 362.455 2.808 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000525560305 517075395 /nfs/dbraw/zinc/07/53/95/517075395.db2.gz NVINIKZMKHEPLM-CHWSQXEVSA-N 1 1 365.430 2.605 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000552112662 517085356 /nfs/dbraw/zinc/08/53/56/517085356.db2.gz ORAUQDYMKWFOCP-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000545228457 517118004 /nfs/dbraw/zinc/11/80/04/517118004.db2.gz ZSGQSROALBUDHZ-GFCCVEGCSA-N 1 1 354.838 2.778 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@@H](C)c3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000541594293 517130396 /nfs/dbraw/zinc/13/03/96/517130396.db2.gz ALTGBQSKGFTBQR-AWEZNQCLSA-N 1 1 372.400 2.890 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)CC2 ZINC000514984118 517154146 /nfs/dbraw/zinc/15/41/46/517154146.db2.gz IXXWAXMUAHQTAV-UHFFFAOYSA-N 1 1 353.369 2.502 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC(C[N@H+](C)C(C)C)CC1 ZINC000532949861 517218769 /nfs/dbraw/zinc/21/87/69/517218769.db2.gz ZWYFIFLWKLDMPW-UHFFFAOYSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc(C2CC[NH+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000542053669 517360873 /nfs/dbraw/zinc/36/08/73/517360873.db2.gz OPUQWAAUEYYTFL-UHFFFAOYSA-N 1 1 357.414 2.835 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000537825509 517363369 /nfs/dbraw/zinc/36/33/69/517363369.db2.gz USPXUNHUTAEPOP-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO Cc1cc(NCC2([NH+]3CCCC3)CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000542102781 517383811 /nfs/dbraw/zinc/38/38/11/517383811.db2.gz DVLKGFXRTVOJII-UHFFFAOYSA-N 1 1 370.453 2.930 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000533312690 517401087 /nfs/dbraw/zinc/40/10/87/517401087.db2.gz NQNRUCONUIBKRL-RHSMWYFYSA-N 1 1 358.442 2.725 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC000520526617 517423212 /nfs/dbraw/zinc/42/32/12/517423212.db2.gz DIKWXFWNQJQMTA-UHFFFAOYSA-N 1 1 356.426 2.670 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C(C)(C)C1 ZINC000520526617 517423219 /nfs/dbraw/zinc/42/32/19/517423219.db2.gz DIKWXFWNQJQMTA-UHFFFAOYSA-N 1 1 356.426 2.670 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1C ZINC000552883157 517427288 /nfs/dbraw/zinc/42/72/88/517427288.db2.gz RBMOIROKOFJXGV-GASCZTMLSA-N 1 1 369.487 2.753 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000542227358 517446713 /nfs/dbraw/zinc/44/67/13/517446713.db2.gz YRQDDMYCDDNFKM-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000542227358 517446720 /nfs/dbraw/zinc/44/67/20/517446720.db2.gz YRQDDMYCDDNFKM-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO COC(=O)c1ccc(C[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000521116199 517618671 /nfs/dbraw/zinc/61/86/71/517618671.db2.gz HLRCMXIYAQZOCO-UHFFFAOYSA-N 1 1 360.366 2.688 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc1)[NH+]1CCOCC1 ZINC000521144563 517627417 /nfs/dbraw/zinc/62/74/17/517627417.db2.gz QLACOOFUOQPCOJ-ZDUSSCGKSA-N 1 1 358.398 2.579 20 5 FFBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708886 517665859 /nfs/dbraw/zinc/66/58/59/517665859.db2.gz GKYNFAORANJAMT-IUODEOHRSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708886 517665866 /nfs/dbraw/zinc/66/58/66/517665866.db2.gz GKYNFAORANJAMT-IUODEOHRSA-N 1 1 373.375 2.909 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000516508119 517715918 /nfs/dbraw/zinc/71/59/18/517715918.db2.gz YIXIYKTVMJLACM-AWEZNQCLSA-N 1 1 357.476 2.610 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542781114 517736137 /nfs/dbraw/zinc/73/61/37/517736137.db2.gz IVLJWYNCAHAIOK-CYBMUJFWSA-N 1 1 368.865 2.964 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556934968 517759308 /nfs/dbraw/zinc/75/93/08/517759308.db2.gz ZIHKRKPWKGKXAF-LJQANCHMSA-N 1 1 353.422 2.836 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556934968 517759314 /nfs/dbraw/zinc/75/93/14/517759314.db2.gz ZIHKRKPWKGKXAF-LJQANCHMSA-N 1 1 353.422 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC[N@@H+]2CC=CCC2)nc1OCc1ccccc1 ZINC000530430712 517770891 /nfs/dbraw/zinc/77/08/91/517770891.db2.gz YTHHAFVBCXPQFK-UHFFFAOYSA-N 1 1 354.410 2.665 20 5 FFBDMO COc1ccc(CNC(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000521908591 517895037 /nfs/dbraw/zinc/89/50/37/517895037.db2.gz KCBSEBXQBZVHBS-UHFFFAOYSA-N 1 1 364.446 2.619 20 5 FFBDMO CCN(CC[NH+]1CCCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000553800730 517913830 /nfs/dbraw/zinc/91/38/30/517913830.db2.gz PVFXKBCVCDQSME-UHFFFAOYSA-N 1 1 359.430 2.809 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)NCc1ccco1 ZINC000534524668 517928801 /nfs/dbraw/zinc/92/88/01/517928801.db2.gz OCBGUJJISCPKHP-UHFFFAOYSA-N 1 1 355.350 2.854 20 5 FFBDMO CC[N@H+](C)[C@@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000560615210 517933439 /nfs/dbraw/zinc/93/34/39/517933439.db2.gz LCOPNTXGECJANJ-MRXNPFEDSA-N 1 1 353.382 2.525 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000560615210 517933446 /nfs/dbraw/zinc/93/34/46/517933446.db2.gz LCOPNTXGECJANJ-MRXNPFEDSA-N 1 1 353.382 2.525 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000547421570 518131399 /nfs/dbraw/zinc/13/13/99/518131399.db2.gz DPDUUVFNUZNEPM-SFHVURJKSA-N 1 1 356.426 2.876 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CNC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000543613948 518152999 /nfs/dbraw/zinc/15/29/99/518152999.db2.gz QMIUNWVHGRPHPX-FQEVSTJZSA-N 1 1 355.438 2.630 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000543613948 518153002 /nfs/dbraw/zinc/15/30/02/518153002.db2.gz QMIUNWVHGRPHPX-FQEVSTJZSA-N 1 1 355.438 2.630 20 5 FFBDMO COc1cccc([C@H]2[C@H](Nc3c([N+](=O)[O-])ncn3C)CC[N@H+]2C2CC2)c1 ZINC000539773758 518158267 /nfs/dbraw/zinc/15/82/67/518158267.db2.gz FQQHDPKXLWZVBG-CVEARBPZSA-N 1 1 357.414 2.727 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000539800644 518162858 /nfs/dbraw/zinc/16/28/58/518162858.db2.gz BJDWZODBRSMGFI-UHFFFAOYSA-N 1 1 362.817 2.682 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCCC[C@H]1C ZINC000535282377 518173262 /nfs/dbraw/zinc/17/32/62/518173262.db2.gz VVUAHSCYWNADNB-HUUCEWRRSA-N 1 1 360.458 2.925 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000535340498 518175437 /nfs/dbraw/zinc/17/54/37/518175437.db2.gz OZKQLBPCLXCCGY-IYBDPMFKSA-N 1 1 362.474 2.805 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000564068064 518292461 /nfs/dbraw/zinc/29/24/61/518292461.db2.gz UEHOMKOGRGYVQJ-CQSZACIVSA-N 1 1 373.457 2.792 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2CCCC[N@H+]2Cc2cccc(Cl)c2)nc1 ZINC000564484110 518470453 /nfs/dbraw/zinc/47/04/53/518470453.db2.gz GGBMTCZIWAFSIX-OAHLLOKOSA-N 1 1 361.833 2.927 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000579026173 518486066 /nfs/dbraw/zinc/48/60/66/518486066.db2.gz LYVFFDAPHJETRB-SFHVURJKSA-N 1 1 371.441 2.727 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000581901153 518493231 /nfs/dbraw/zinc/49/32/31/518493231.db2.gz HJLKDDFUTNFIHZ-UHFFFAOYSA-N 1 1 371.397 2.795 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000582042654 518558976 /nfs/dbraw/zinc/55/89/76/518558976.db2.gz SORPMHCBRZQIQC-INIZCTEOSA-N 1 1 371.441 2.534 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000585764647 518589482 /nfs/dbraw/zinc/58/94/82/518589482.db2.gz CWJPJRYSNCCIAL-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000585764647 518589487 /nfs/dbraw/zinc/58/94/87/518589487.db2.gz CWJPJRYSNCCIAL-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000567644093 518629830 /nfs/dbraw/zinc/62/98/30/518629830.db2.gz SDIDTVYZQAEVGN-UHFFFAOYSA-N 1 1 361.446 2.650 20 5 FFBDMO C[N@@H+]1CCO[C@H](CSCc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000564959113 518714054 /nfs/dbraw/zinc/71/40/54/518714054.db2.gz VZMMJBKEUCKICK-LBPRGKRZSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@H](CSCc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000564959113 518714062 /nfs/dbraw/zinc/71/40/62/518714062.db2.gz VZMMJBKEUCKICK-LBPRGKRZSA-N 1 1 361.261 2.921 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3c[nH+]cn3C2)nc1OCc1ccccc1 ZINC000588067785 518714797 /nfs/dbraw/zinc/71/47/97/518714797.db2.gz PLIGPWZZXADBCG-HNNXBMFYSA-N 1 1 365.393 2.614 20 5 FFBDMO CN(C)c1noc([C@H]2CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000588600589 518789308 /nfs/dbraw/zinc/78/93/08/518789308.db2.gz GDOHAWULFYCOEM-KKTNHOPESA-N 1 1 357.414 2.937 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576869842 518803767 /nfs/dbraw/zinc/80/37/67/518803767.db2.gz DHJVPQSZBYLZIZ-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589187595 518943381 /nfs/dbraw/zinc/94/33/81/518943381.db2.gz BCCPRWHRCSTQOU-ZFWWWQNUSA-N 1 1 350.415 2.882 20 5 FFBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000589195499 518947022 /nfs/dbraw/zinc/94/70/22/518947022.db2.gz APUHAJUTOSPKKB-SUOMESGTSA-N 1 1 358.486 2.708 20 5 FFBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000589195499 518947026 /nfs/dbraw/zinc/94/70/26/518947026.db2.gz APUHAJUTOSPKKB-SUOMESGTSA-N 1 1 358.486 2.708 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000589307556 518978319 /nfs/dbraw/zinc/97/83/19/518978319.db2.gz VVDYVERQIJIRTI-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000565504865 518988170 /nfs/dbraw/zinc/98/81/70/518988170.db2.gz JHKRISHRRVFMFG-FRRDWIJNSA-N 1 1 369.849 2.957 20 5 FFBDMO Cc1cc(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)cc(N2CCCC2)[nH+]1 ZINC000589604151 519039046 /nfs/dbraw/zinc/03/90/46/519039046.db2.gz UQIIIAGWNJIZEL-UHFFFAOYSA-N 1 1 357.414 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@](CO)(c3ccccc3)C2)cc1 ZINC000589749312 519075089 /nfs/dbraw/zinc/07/50/89/519075089.db2.gz HEMUECHEISISIC-FQEVSTJZSA-N 1 1 356.422 3.000 20 5 FFBDMO COCc1nc(C[NH2+][C@@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cs1 ZINC000583174035 519110614 /nfs/dbraw/zinc/11/06/14/519110614.db2.gz QGWZIIICODBJSK-NSHDSACASA-N 1 1 364.427 2.705 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000565763091 519119800 /nfs/dbraw/zinc/11/98/00/519119800.db2.gz GSUFLDOYGRYNEI-UHFFFAOYSA-N 1 1 365.393 2.982 20 5 FFBDMO CC1(C)C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000577591024 519156490 /nfs/dbraw/zinc/15/64/90/519156490.db2.gz DNMPZTIBBYRFKU-HOTGVXAUSA-N 1 1 352.456 2.879 20 5 FFBDMO CC1(C)C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000577591024 519156499 /nfs/dbraw/zinc/15/64/99/519156499.db2.gz DNMPZTIBBYRFKU-HOTGVXAUSA-N 1 1 352.456 2.879 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCOC[C@@H]2[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590566389 519268751 /nfs/dbraw/zinc/26/87/51/519268751.db2.gz ZRKUXBIHXYTAME-FUHWJXTLSA-N 1 1 361.442 2.653 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000580656751 519288312 /nfs/dbraw/zinc/28/83/12/519288312.db2.gz FFVOGGAYXMPJKW-DOTOQJQBSA-N 1 1 357.410 2.527 20 5 FFBDMO C[C@@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000590723431 519332943 /nfs/dbraw/zinc/33/29/43/519332943.db2.gz ZSXFHDXZUGPIGU-HNNXBMFYSA-N 1 1 370.453 2.628 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000583782301 519428674 /nfs/dbraw/zinc/42/86/74/519428674.db2.gz FFUUNBLICGRCBM-INIZCTEOSA-N 1 1 364.446 2.636 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569229156 519444214 /nfs/dbraw/zinc/44/42/14/519444214.db2.gz AKMXVIKVNSOWFT-CXAGYDPISA-N 1 1 368.441 2.861 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C(=O)OC(C)(C)C ZINC000590972807 519464916 /nfs/dbraw/zinc/46/49/16/519464916.db2.gz WBHUSBFEOMQNEJ-LBPRGKRZSA-N 1 1 366.414 2.776 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC(C)(C)OCC2(C)C)c([N+](=O)[O-])c1 ZINC000591014726 519475574 /nfs/dbraw/zinc/47/55/74/519475574.db2.gz HUGDPKGQHDYJHL-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])cc1Br ZINC000584015366 519547958 /nfs/dbraw/zinc/54/79/58/519547958.db2.gz CTJKINSWVAVIIL-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO CN(CCCNc1ccc([N+](=O)[O-])cc1Br)CC[NH+](C)C ZINC000584015366 519547965 /nfs/dbraw/zinc/54/79/65/519547965.db2.gz CTJKINSWVAVIIL-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000572438244 519610979 /nfs/dbraw/zinc/61/09/79/519610979.db2.gz HSXIPWKLHJNGKB-UHFFFAOYSA-N 1 1 371.441 2.570 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](O)[C@H]1CCc1ccccc1 ZINC000602851523 519923797 /nfs/dbraw/zinc/92/37/97/519923797.db2.gz LOIRZUISEHHLNW-MSOLQXFVSA-N 1 1 358.442 2.558 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](c2cccnc2)C1 ZINC000602856890 519927933 /nfs/dbraw/zinc/92/79/33/519927933.db2.gz STXWIYJJNHQBLB-SJORKVTESA-N 1 1 357.410 2.609 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000602855822 519929728 /nfs/dbraw/zinc/92/97/28/519929728.db2.gz PQYMUTUFHUMHHG-SJLPKXTDSA-N 1 1 357.410 2.609 20 5 FFBDMO CCOc1cc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000616179498 519935139 /nfs/dbraw/zinc/93/51/39/519935139.db2.gz DXRJXBCVRVOSCM-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[NH+](Cc4cccs4)CC3)c21 ZINC000612437894 519960573 /nfs/dbraw/zinc/96/05/73/519960573.db2.gz RJNIBUMMOXLPHS-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594602740 520048932 /nfs/dbraw/zinc/04/89/32/520048932.db2.gz SCUKZXCUFJBVPG-NWDGAFQWSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594602740 520048942 /nfs/dbraw/zinc/04/89/42/520048942.db2.gz SCUKZXCUFJBVPG-NWDGAFQWSA-N 1 1 355.236 2.603 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000600230520 520140169 /nfs/dbraw/zinc/14/01/69/520140169.db2.gz SYJKABQTDKJHJP-MRXNPFEDSA-N 1 1 361.442 2.805 20 5 FFBDMO CCc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594793932 520161612 /nfs/dbraw/zinc/16/16/12/520161612.db2.gz WPNGTOUOTVVYII-CYBMUJFWSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1[nH+]ccn1Cc1cn(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)nn1 ZINC000603237963 520174550 /nfs/dbraw/zinc/17/45/50/520174550.db2.gz VSZMBSOVLKKZTM-UHFFFAOYSA-N 1 1 366.303 2.807 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000609029691 520180091 /nfs/dbraw/zinc/18/00/91/520180091.db2.gz WHMNOLJMWHJBMO-GOSISDBHSA-N 1 1 356.426 2.816 20 5 FFBDMO CCCCNC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130378 520205491 /nfs/dbraw/zinc/20/54/91/520205491.db2.gz GEMNFNVYYUAKMK-QAQDUYKDSA-N 1 1 363.458 2.617 20 5 FFBDMO CCCCNC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130378 520205498 /nfs/dbraw/zinc/20/54/98/520205498.db2.gz GEMNFNVYYUAKMK-QAQDUYKDSA-N 1 1 363.458 2.617 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155528 520231647 /nfs/dbraw/zinc/23/16/47/520231647.db2.gz OFPBNIIRDSPVEK-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000592155206 520232292 /nfs/dbraw/zinc/23/22/92/520232292.db2.gz MSZVLKUBBIJBGZ-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO COc1ccc(Cc2nc(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)no2)cc1[N+](=O)[O-] ZINC000612954199 520235792 /nfs/dbraw/zinc/23/57/92/520235792.db2.gz CYZIREUHQIYXRR-AGUYFDCRSA-N 1 1 358.398 2.917 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000595050611 520270613 /nfs/dbraw/zinc/27/06/13/520270613.db2.gz SREDMIIONOYHMM-IRXDYDNUSA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000597859317 520286076 /nfs/dbraw/zinc/28/60/76/520286076.db2.gz UKJNVFLEUNDRQU-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609476782 520322922 /nfs/dbraw/zinc/32/29/22/520322922.db2.gz REXKPCAQHDTPFP-GFCCVEGCSA-N 1 1 351.451 2.511 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1C ZINC000603659050 520337158 /nfs/dbraw/zinc/33/71/58/520337158.db2.gz UGOKHXACJLLPPF-OCCSQVGLSA-N 1 1 369.487 2.610 20 5 FFBDMO CCN(C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597945544 520344985 /nfs/dbraw/zinc/34/49/85/520344985.db2.gz HYFJKDQNYHKUFI-GFCCVEGCSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(=O)NCc1cccs1 ZINC000592374870 520356745 /nfs/dbraw/zinc/35/67/45/520356745.db2.gz NHHHVBGNHVVJSV-OAHLLOKOSA-N 1 1 351.403 2.980 20 5 FFBDMO O=C(C[NH+]1C[C@@H]2CN(c3ccccc3)C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000603906196 520400007 /nfs/dbraw/zinc/40/00/07/520400007.db2.gz WPPXKJQHTKZOOF-HZPDHXFCSA-N 1 1 366.421 2.602 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000603909090 520400490 /nfs/dbraw/zinc/40/04/90/520400490.db2.gz HGJJDGJZZDSIKB-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592478842 520406539 /nfs/dbraw/zinc/40/65/39/520406539.db2.gz KBSYNKOONYQHQZ-DOTOQJQBSA-N 1 1 360.458 2.696 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705267 520411254 /nfs/dbraw/zinc/41/12/54/520411254.db2.gz NEGHAMSYECYZPG-TZMCWYRMSA-N 1 1 369.849 2.611 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)n2)cc1 ZINC000592492986 520416328 /nfs/dbraw/zinc/41/63/28/520416328.db2.gz LAFKKPKJURYOSQ-JKSUJKDBSA-N 1 1 371.441 2.856 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493036 520417085 /nfs/dbraw/zinc/41/70/85/520417085.db2.gz MUNIEVNUEFMLNL-PMPSAXMXSA-N 1 1 360.458 2.633 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000604197939 520480875 /nfs/dbraw/zinc/48/08/75/520480875.db2.gz CBNJSXDEUUNXQG-GFCCVEGCSA-N 1 1 374.363 2.626 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473003 520493426 /nfs/dbraw/zinc/49/34/26/520493426.db2.gz RZUDLFWBRNIKPW-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO CCOc1cc(CN2CCC[C@H]([NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000595473003 520493432 /nfs/dbraw/zinc/49/34/32/520493432.db2.gz RZUDLFWBRNIKPW-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO COc1cccc([C@H]2[C@H]([NH2+]Cc3onc(C)c3[N+](=O)[O-])CCN2C2CC2)c1 ZINC000595475920 520494582 /nfs/dbraw/zinc/49/45/82/520494582.db2.gz KHWVSAUAHBYGFZ-APWZRJJASA-N 1 1 372.425 2.967 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C[C@H]1C ZINC000610135391 520553816 /nfs/dbraw/zinc/55/38/16/520553816.db2.gz RADXFTVMNWARDZ-UKRRQHHQSA-N 1 1 369.487 2.705 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000598341906 520564779 /nfs/dbraw/zinc/56/47/79/520564779.db2.gz IBHOSPCMAISJDK-GFCCVEGCSA-N 1 1 356.220 2.571 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000595585129 520570999 /nfs/dbraw/zinc/57/09/99/520570999.db2.gz LPJGAHTYVKANKA-AWEZNQCLSA-N 1 1 368.865 2.963 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](C)c1cscn1 ZINC000595666836 520632350 /nfs/dbraw/zinc/63/23/50/520632350.db2.gz DKYLHALIEBHVQD-JTQLQIEISA-N 1 1 350.400 2.739 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000592883123 520633097 /nfs/dbraw/zinc/63/30/97/520633097.db2.gz XEXXXEAQIKYTFH-MJGOQNOKSA-N 1 1 353.422 2.599 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000610335348 520641112 /nfs/dbraw/zinc/64/11/12/520641112.db2.gz LILQZIUTCXNADR-CYBMUJFWSA-N 1 1 359.213 2.591 20 5 FFBDMO O=C(NC1CC1)[C@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000593041289 520702490 /nfs/dbraw/zinc/70/24/90/520702490.db2.gz PMXYPSXPSHPKFM-HXUWFJFHSA-N 1 1 365.433 2.843 20 5 FFBDMO O=C(NC1CC1)[C@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000593041289 520702497 /nfs/dbraw/zinc/70/24/97/520702497.db2.gz PMXYPSXPSHPKFM-HXUWFJFHSA-N 1 1 365.433 2.843 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000598560081 520705284 /nfs/dbraw/zinc/70/52/84/520705284.db2.gz KNMRMMQGEJOVHU-HNNXBMFYSA-N 1 1 361.442 2.845 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595761037 520705222 /nfs/dbraw/zinc/70/52/22/520705222.db2.gz WDTMZBLQVKFLSJ-BZNIZROVSA-N 1 1 358.341 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[NH+](Cc4ccc(O)cc4)CC3)c2c1 ZINC000601256559 520712106 /nfs/dbraw/zinc/71/21/06/520712106.db2.gz FGDUWTYFWGAFNJ-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c2ccncc21 ZINC000610489250 520712537 /nfs/dbraw/zinc/71/25/37/520712537.db2.gz SNOBOYBTUWUBDX-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO COC(=O)c1ccnc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000598598727 520735567 /nfs/dbraw/zinc/73/55/67/520735567.db2.gz UADDUSUUDNASHE-OAHLLOKOSA-N 1 1 370.409 2.853 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593088512 520735626 /nfs/dbraw/zinc/73/56/26/520735626.db2.gz FYYVUUUFBKWYCT-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593088512 520735631 /nfs/dbraw/zinc/73/56/31/520735631.db2.gz FYYVUUUFBKWYCT-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593088512 520735633 /nfs/dbraw/zinc/73/56/33/520735633.db2.gz FYYVUUUFBKWYCT-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595831419 520755066 /nfs/dbraw/zinc/75/50/66/520755066.db2.gz NHLHEYXCQBIJCC-MOPGFXCFSA-N 1 1 367.405 2.853 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595831419 520755075 /nfs/dbraw/zinc/75/50/75/520755075.db2.gz NHLHEYXCQBIJCC-MOPGFXCFSA-N 1 1 367.405 2.853 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC000595831604 520755985 /nfs/dbraw/zinc/75/59/85/520755985.db2.gz GIZQAQNSOJYHFH-HNNXBMFYSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC000595831604 520755994 /nfs/dbraw/zinc/75/59/94/520755994.db2.gz GIZQAQNSOJYHFH-HNNXBMFYSA-N 1 1 352.456 2.881 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000598645780 520757714 /nfs/dbraw/zinc/75/77/14/520757714.db2.gz IBTUWDKYMAGNCT-DGCLKSJQSA-N 1 1 374.384 2.698 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593132432 520769521 /nfs/dbraw/zinc/76/95/21/520769521.db2.gz QSDHCNMSKKMSJC-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593132432 520769531 /nfs/dbraw/zinc/76/95/31/520769531.db2.gz QSDHCNMSKKMSJC-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000593187553 520811498 /nfs/dbraw/zinc/81/14/98/520811498.db2.gz LSZIVBFEAFPINF-ARFHVFGLSA-N 1 1 374.485 2.751 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1 ZINC000596077508 520897535 /nfs/dbraw/zinc/89/75/35/520897535.db2.gz RKPOPFDZZDHMQB-UHFFFAOYSA-N 1 1 368.437 2.714 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000593316002 520903812 /nfs/dbraw/zinc/90/38/12/520903812.db2.gz OKTRDCMNEGDRMU-VBQJREDUSA-N 1 1 353.850 2.967 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](Cc2ccccc2)C1 ZINC000593323583 520909891 /nfs/dbraw/zinc/90/98/91/520909891.db2.gz QKYMEIRSZGTGNC-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](Cc2ccccc2)C1 ZINC000593323583 520909896 /nfs/dbraw/zinc/90/98/96/520909896.db2.gz QKYMEIRSZGTGNC-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000596150991 520940735 /nfs/dbraw/zinc/94/07/35/520940735.db2.gz GWDIBOVKSOTSEH-QWRGUYRKSA-N 1 1 355.822 2.811 20 5 FFBDMO NC(=O)c1cc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596223608 520978579 /nfs/dbraw/zinc/97/85/79/520978579.db2.gz PTCUKSJFOGSIMW-OAHLLOKOSA-N 1 1 354.410 2.628 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611087874 520978685 /nfs/dbraw/zinc/97/86/85/520978685.db2.gz PHOXBORYBLETBT-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611087874 520978694 /nfs/dbraw/zinc/97/86/94/520978694.db2.gz PHOXBORYBLETBT-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO C[C@H]1CN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O ZINC000596223947 520978821 /nfs/dbraw/zinc/97/88/21/520978821.db2.gz VDGPPOSKYPUAFT-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000618288440 520982833 /nfs/dbraw/zinc/98/28/33/520982833.db2.gz PURCUXIFKJLTOG-SCLBCKFNSA-N 1 1 355.442 2.920 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000611104578 520986100 /nfs/dbraw/zinc/98/61/00/520986100.db2.gz OXWYCNCHRJSWJY-STQMWFEESA-N 1 1 353.785 2.978 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000611104578 520986114 /nfs/dbraw/zinc/98/61/14/520986114.db2.gz OXWYCNCHRJSWJY-STQMWFEESA-N 1 1 353.785 2.978 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1CCC[N@H+]1CCCO ZINC000596260172 520997430 /nfs/dbraw/zinc/99/74/30/520997430.db2.gz YTPLEFJTMRAOBY-NSHDSACASA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1CCC[N@@H+]1CCCO ZINC000596260172 520997438 /nfs/dbraw/zinc/99/74/38/520997438.db2.gz YTPLEFJTMRAOBY-NSHDSACASA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596269024 521002474 /nfs/dbraw/zinc/00/24/74/521002474.db2.gz QXAFAEIGIGHMHT-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)s1 ZINC000593496324 521031614 /nfs/dbraw/zinc/03/16/14/521031614.db2.gz NZMWOXOSKOPVTL-HUUCEWRRSA-N 1 1 360.439 2.531 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CCCC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000599140258 521050593 /nfs/dbraw/zinc/05/05/93/521050593.db2.gz UAPLXMSTWKTSSF-LLVKDONJSA-N 1 1 357.252 2.626 20 5 FFBDMO COc1cccc(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1[N+](=O)[O-] ZINC000596425277 521064978 /nfs/dbraw/zinc/06/49/78/521064978.db2.gz XKWKQFUTOJIMJN-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000611400585 521137350 /nfs/dbraw/zinc/13/73/50/521137350.db2.gz SBCPKEVXXQRDEQ-IUODEOHRSA-N 1 1 367.471 2.544 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000611400585 521137352 /nfs/dbraw/zinc/13/73/52/521137352.db2.gz SBCPKEVXXQRDEQ-IUODEOHRSA-N 1 1 367.471 2.544 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599453814 521236498 /nfs/dbraw/zinc/23/64/98/521236498.db2.gz BOBWKZZQQJHUIE-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000618829907 521254687 /nfs/dbraw/zinc/25/46/87/521254687.db2.gz TWZMIRCQNHBZOS-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H]1C[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H](C)C1(F)F ZINC000599512744 521269722 /nfs/dbraw/zinc/26/97/22/521269722.db2.gz MEESXMCCPWORFG-LALPHHSUSA-N 1 1 353.369 2.923 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](C)[C@H](O)C2)cc1OC ZINC000611668760 521272374 /nfs/dbraw/zinc/27/23/74/521272374.db2.gz VGXCGRFESWXFMH-HEHGZKQESA-N 1 1 352.431 2.841 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](C)[C@H](O)C2)cc1OC ZINC000611668760 521272381 /nfs/dbraw/zinc/27/23/81/521272381.db2.gz VGXCGRFESWXFMH-HEHGZKQESA-N 1 1 352.431 2.841 20 5 FFBDMO CN(C(=O)c1c(Br)cccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000599576515 521308439 /nfs/dbraw/zinc/30/84/39/521308439.db2.gz ONVAJPFKTDSVBI-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000596843285 521325817 /nfs/dbraw/zinc/32/58/17/521325817.db2.gz JDWUKJVGLOCXHY-INIZCTEOSA-N 1 1 370.409 2.999 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599608890 521328428 /nfs/dbraw/zinc/32/84/28/521328428.db2.gz DDLUKQDRONXCEI-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599608891 521328758 /nfs/dbraw/zinc/32/87/58/521328758.db2.gz DDLUKQDRONXCEI-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)n[nH]1 ZINC000611796947 521337085 /nfs/dbraw/zinc/33/70/85/521337085.db2.gz RPXLGUUFJZZOQB-GOSISDBHSA-N 1 1 369.425 2.611 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)CC2)[nH]n1 ZINC000611796947 521337092 /nfs/dbraw/zinc/33/70/92/521337092.db2.gz RPXLGUUFJZZOQB-GOSISDBHSA-N 1 1 369.425 2.611 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC000599643982 521354588 /nfs/dbraw/zinc/35/45/88/521354588.db2.gz JVKYVIDJZYZEDD-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2Cc3cccc(OC)c3C2)c([N+](=O)[O-])c1 ZINC000599643982 521354596 /nfs/dbraw/zinc/35/45/96/521354596.db2.gz JVKYVIDJZYZEDD-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487394 521375645 /nfs/dbraw/zinc/37/56/45/521375645.db2.gz ZKJRGLAQRDXYLF-OAHLLOKOSA-N 1 1 354.414 2.651 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599664461 521377051 /nfs/dbraw/zinc/37/70/51/521377051.db2.gz NVPYQZDHSCTMJX-JOYOIKCWSA-N 1 1 368.231 2.570 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000599670202 521382443 /nfs/dbraw/zinc/38/24/43/521382443.db2.gz SIUJUHSNGSKENJ-GOSISDBHSA-N 1 1 356.378 2.746 20 5 FFBDMO CN(C)CC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(C)(C)C ZINC000602547346 521405406 /nfs/dbraw/zinc/40/54/06/521405406.db2.gz SRFRAWGELSWACC-QGZVFWFLSA-N 1 1 363.506 2.915 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599759582 521454062 /nfs/dbraw/zinc/45/40/62/521454062.db2.gz FJZIKFNXHQYOMA-UHFFFAOYSA-N 1 1 368.231 2.739 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000594199243 521465279 /nfs/dbraw/zinc/46/52/79/521465279.db2.gz IHWVGXQXVXBBLG-DOTOQJQBSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C1[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C[C@H]2CCCCN12 ZINC000602686763 521478878 /nfs/dbraw/zinc/47/88/78/521478878.db2.gz HTGAXDMFWBPGMZ-KCJUWKMLSA-N 1 1 374.260 2.662 20 5 FFBDMO CC[C@@H](C)C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(=O)OC ZINC000602702036 521485204 /nfs/dbraw/zinc/48/52/04/521485204.db2.gz MWLMKTQSKWJVTF-CJNGLKHVSA-N 1 1 364.446 2.526 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000602722109 521496339 /nfs/dbraw/zinc/49/63/39/521496339.db2.gz MQFVZFKJHHXXQZ-HNNXBMFYSA-N 1 1 373.375 2.645 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2cc3ccncc3s2)CC1 ZINC000597148317 521538118 /nfs/dbraw/zinc/53/81/18/521538118.db2.gz BPHZDCLLQZZMIF-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000602834302 521560259 /nfs/dbraw/zinc/56/02/59/521560259.db2.gz YKLOTPVMLQSGHR-KZNAEPCWSA-N 1 1 356.426 2.604 20 5 FFBDMO Cc1cc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000470867459 560992575 /nfs/dbraw/zinc/99/25/75/560992575.db2.gz SGLDOMAASFMSBO-UHFFFAOYSA-N 1 1 369.469 2.918 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@H]1c1ccccc1 ZINC000826028544 607967703 /nfs/dbraw/zinc/96/77/03/607967703.db2.gz CBLQFYPAKILVJE-DLBZAZTESA-N 1 1 365.397 2.632 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723934 720367793 /nfs/dbraw/zinc/36/77/93/720367793.db2.gz IDIJMOKSVQGAQY-HUUCEWRRSA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164722048 720394085 /nfs/dbraw/zinc/39/40/85/720394085.db2.gz BTWYRVZYWUBDOB-DLBZAZTESA-N 1 1 353.426 2.855 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000092627252 728469614 /nfs/dbraw/zinc/46/96/14/728469614.db2.gz ICJCTHBHEIUJJC-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CCCC[N@@H+](C)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000112333516 728544833 /nfs/dbraw/zinc/54/48/33/728544833.db2.gz ZVEITSPEKKDBNK-UHFFFAOYSA-N 1 1 365.402 2.735 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000112681456 728547242 /nfs/dbraw/zinc/54/72/42/728547242.db2.gz OYBNEORFIQHGOQ-ZDUSSCGKSA-N 1 1 370.837 2.607 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C[C@@H]1CCCC[C@@H]1O ZINC000130073170 728714940 /nfs/dbraw/zinc/71/49/40/728714940.db2.gz PSEZAVOMYMOSFM-LRDDRELGSA-N 1 1 353.394 2.545 20 5 FFBDMO O=C1[C@@H]([N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1CC(F)(F)F ZINC000130212945 728715967 /nfs/dbraw/zinc/71/59/67/728715967.db2.gz DDAYNJLPQRVMSO-AWEZNQCLSA-N 1 1 357.332 2.722 20 5 FFBDMO O=C1[C@@H]([N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCN1CC(F)(F)F ZINC000130212945 728715968 /nfs/dbraw/zinc/71/59/68/728715968.db2.gz DDAYNJLPQRVMSO-AWEZNQCLSA-N 1 1 357.332 2.722 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000165132526 728971614 /nfs/dbraw/zinc/97/16/14/728971614.db2.gz MNHANZKUTFDEEP-LBPRGKRZSA-N 1 1 364.427 2.630 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000165132526 728971616 /nfs/dbraw/zinc/97/16/16/728971616.db2.gz MNHANZKUTFDEEP-LBPRGKRZSA-N 1 1 364.427 2.630 20 5 FFBDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000171955007 729016149 /nfs/dbraw/zinc/01/61/49/729016149.db2.gz AIUKMNUSBYCFJD-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@H](O)c3ccccc3Cl)C2)nc1 ZINC000245467341 729570443 /nfs/dbraw/zinc/57/04/43/729570443.db2.gz ZKVQGLNERAVNEA-WBMJQRKESA-N 1 1 362.817 2.863 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@H]1CC[N@@H+](CC)C1 ZINC000857310873 730390838 /nfs/dbraw/zinc/39/08/38/730390838.db2.gz JKBXBYFCOJNYHG-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000859532425 730457790 /nfs/dbraw/zinc/45/77/90/730457790.db2.gz YMSCLZYSLHSUCZ-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccns1 ZINC000860055393 730474520 /nfs/dbraw/zinc/47/45/20/730474520.db2.gz XSPXYMDNIMAOFD-NXEZZACHSA-N 1 1 350.400 2.738 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000860098183 730476143 /nfs/dbraw/zinc/47/61/43/730476143.db2.gz MCJRLEVQCQEEFE-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCOc1ccccc1C(=O)OCCC[N+](=O)[O-] ZINC000860918548 730559302 /nfs/dbraw/zinc/55/93/02/730559302.db2.gz MDHKALIYAJOUQL-OAHLLOKOSA-N 1 1 350.415 2.763 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000861996880 730659929 /nfs/dbraw/zinc/65/99/29/730659929.db2.gz QQHAFTCKNLLYFA-CYBMUJFWSA-N 1 1 360.267 2.659 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000872020345 731721149 /nfs/dbraw/zinc/72/11/49/731721149.db2.gz GJNAAKDXYZWAGP-PBHICJAKSA-N 1 1 352.454 2.657 20 5 FFBDMO C[C@H](N[C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872036523 731723032 /nfs/dbraw/zinc/72/30/32/731723032.db2.gz TVSPWSXVCHGJPE-UONOGXRCSA-N 1 1 350.438 2.553 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C(C)(C)C ZINC000878841803 732603571 /nfs/dbraw/zinc/60/35/71/732603571.db2.gz ZTWAXPJSKFGJQB-HNNXBMFYSA-N 1 1 368.865 2.849 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2ccnn2C)c([N+](=O)[O-])cc1OC(F)F ZINC000879684618 732750629 /nfs/dbraw/zinc/75/06/29/732750629.db2.gz LHKMZTMHALTLGR-VIFPVBQESA-N 1 1 356.329 2.789 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000879963046 732809938 /nfs/dbraw/zinc/80/99/38/732809938.db2.gz DBZCZJQITDSPFC-LBPRGKRZSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880145545 732855646 /nfs/dbraw/zinc/85/56/46/732855646.db2.gz NXGYNJICFJDGNS-WDEREUQCSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880145545 732855650 /nfs/dbraw/zinc/85/56/50/732855650.db2.gz NXGYNJICFJDGNS-WDEREUQCSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H]1C[C@@H](C(=O)NCc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000881865146 733123247 /nfs/dbraw/zinc/12/32/47/733123247.db2.gz NOHVPUYGYAGISS-QWRGUYRKSA-N 1 1 370.247 2.704 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](OC(F)F)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782531108 738731090 /nfs/dbraw/zinc/73/10/90/738731090.db2.gz OEKKESDSTAGOHK-NSHDSACASA-N 1 1 361.320 2.766 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000888288153 734032266 /nfs/dbraw/zinc/03/22/66/734032266.db2.gz CQBGLVFOVSDULT-VXGBXAGGSA-N 1 1 368.821 2.541 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105071 738825479 /nfs/dbraw/zinc/82/54/79/738825479.db2.gz ZDTNSSAOIBHGGM-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105071 738825483 /nfs/dbraw/zinc/82/54/83/738825483.db2.gz ZDTNSSAOIBHGGM-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO COCCOc1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000892601119 734579098 /nfs/dbraw/zinc/57/90/98/734579098.db2.gz ZUECVJNPQNSLLE-UHFFFAOYSA-N 1 1 351.790 2.958 20 5 FFBDMO CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000895688983 735040797 /nfs/dbraw/zinc/04/07/97/735040797.db2.gz SQTPXGVCSGUDJD-MGCOHNPYSA-N 1 1 353.227 2.567 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558410 735731120 /nfs/dbraw/zinc/73/11/20/735731120.db2.gz JAQWYGMYISJDEA-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558410 735731122 /nfs/dbraw/zinc/73/11/22/735731122.db2.gz JAQWYGMYISJDEA-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000751913260 735933283 /nfs/dbraw/zinc/93/32/83/735933283.db2.gz FRMFMMQBRAICAP-HIFRSBDPSA-N 1 1 350.488 2.913 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](C2CCOCC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000755057159 736229489 /nfs/dbraw/zinc/22/94/89/736229489.db2.gz LZEHCLRRJZKZSG-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](C2CCOCC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000755057159 736229492 /nfs/dbraw/zinc/22/94/92/736229492.db2.gz LZEHCLRRJZKZSG-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO CN(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC000929130011 738946587 /nfs/dbraw/zinc/94/65/87/738946587.db2.gz QFEGFNVIVGRARC-UHFFFAOYSA-N 1 1 370.247 2.658 20 5 FFBDMO O=C(N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000764294486 737009397 /nfs/dbraw/zinc/00/93/97/737009397.db2.gz VYDFEWIKKFMILK-HOCLYGCPSA-N 1 1 367.833 2.621 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000910282766 737052282 /nfs/dbraw/zinc/05/22/82/737052282.db2.gz HZMYEFLEHIEHQK-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CCOCC[NH+]1CCN(c2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000765488435 737123439 /nfs/dbraw/zinc/12/34/39/737123439.db2.gz GTOQNOOUGYMFPS-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766950831 737278848 /nfs/dbraw/zinc/27/88/48/737278848.db2.gz RFGKUNGYFOUJEF-ZBFHGGJFSA-N 1 1 350.415 2.682 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000913813844 737452312 /nfs/dbraw/zinc/45/23/12/737452312.db2.gz HUFFSBSOGDVGMF-JKSUJKDBSA-N 1 1 351.834 2.876 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])c1F ZINC000771756094 737752315 /nfs/dbraw/zinc/75/23/15/737752315.db2.gz AVLXRJWPRCEYRQ-BETUJISGSA-N 1 1 373.450 2.584 20 5 FFBDMO CN(Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000774739904 738020820 /nfs/dbraw/zinc/02/08/20/738020820.db2.gz QHKPJAUJXFQWBB-QGZVFWFLSA-N 1 1 366.893 2.849 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000777996395 738340529 /nfs/dbraw/zinc/34/05/29/738340529.db2.gz AFLBGVHMCSIUNG-CYBMUJFWSA-N 1 1 373.450 2.585 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000778219469 738364634 /nfs/dbraw/zinc/36/46/34/738364634.db2.gz FPSCXILVSONUEP-LLVKDONJSA-N 1 1 363.443 2.594 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546168 738976214 /nfs/dbraw/zinc/97/62/14/738976214.db2.gz NBWHLJPGIHJFMU-JTNHKYCSSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546168 738976216 /nfs/dbraw/zinc/97/62/16/738976216.db2.gz NBWHLJPGIHJFMU-JTNHKYCSSA-N 1 1 355.822 2.668 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930088952 739058304 /nfs/dbraw/zinc/05/83/04/739058304.db2.gz CYFAEFXICMRPTA-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930088952 739058312 /nfs/dbraw/zinc/05/83/12/739058312.db2.gz CYFAEFXICMRPTA-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)COC(=O)N1 ZINC000932020608 739374755 /nfs/dbraw/zinc/37/47/55/739374755.db2.gz IJRGEPFFXPYHCJ-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000789763861 739386028 /nfs/dbraw/zinc/38/60/28/739386028.db2.gz RFHDTOFJYGDUQV-GFCCVEGCSA-N 1 1 372.263 2.510 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790588983 739472189 /nfs/dbraw/zinc/47/21/89/739472189.db2.gz AZWHYRJEGFWBAJ-NSHDSACASA-N 1 1 357.813 2.776 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@@H]1C ZINC000933371283 739611821 /nfs/dbraw/zinc/61/18/21/739611821.db2.gz SKBDCAAALVHGIP-UWVGGRQHSA-N 1 1 372.828 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CCCO2)[C@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871476 739714461 /nfs/dbraw/zinc/71/44/61/739714461.db2.gz LPUOZHMMCUXXAW-GJZGRUSLSA-N 1 1 367.427 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCO2)[C@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871476 739714465 /nfs/dbraw/zinc/71/44/65/739714465.db2.gz LPUOZHMMCUXXAW-GJZGRUSLSA-N 1 1 367.427 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@H](O)c2ncc[nH]2)CC1 ZINC000793189965 739750412 /nfs/dbraw/zinc/75/04/12/739750412.db2.gz DPMVIAZDFOPCPB-HNNXBMFYSA-N 1 1 350.806 2.917 20 5 FFBDMO C[C@H]1CSCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000934301611 739763167 /nfs/dbraw/zinc/76/31/67/739763167.db2.gz LIUNLRRSUXTBRE-LBPRGKRZSA-N 1 1 351.428 2.720 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934337319 739769041 /nfs/dbraw/zinc/76/90/41/739769041.db2.gz VVQBOZWHLDKCNF-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934337319 739769042 /nfs/dbraw/zinc/76/90/42/739769042.db2.gz VVQBOZWHLDKCNF-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000934576247 739808543 /nfs/dbraw/zinc/80/85/43/739808543.db2.gz MDKZAALLJLVTHY-ABAIWWIYSA-N 1 1 351.834 2.780 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000934951157 739871120 /nfs/dbraw/zinc/87/11/20/739871120.db2.gz NNUXRNIYRCPGHQ-SKDRFNHKSA-N 1 1 370.812 2.526 20 5 FFBDMO CCOC(=O)/C(=C\c1ncc(C[NH+](C)C)s1)c1ccc([N+](=O)[O-])cn1 ZINC000794711267 739922711 /nfs/dbraw/zinc/92/27/11/739922711.db2.gz CBQBWUOGTDGDOJ-QPEQYQDCSA-N 1 1 362.411 2.612 20 5 FFBDMO C[C@@H]1CC[N@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C1 ZINC000795423394 740019602 /nfs/dbraw/zinc/01/96/02/740019602.db2.gz PIAHZJKLVUSUDK-SECBINFHSA-N 1 1 354.204 2.612 20 5 FFBDMO C[C@@H]1CC[N@@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C1 ZINC000795423394 740019604 /nfs/dbraw/zinc/01/96/04/740019604.db2.gz PIAHZJKLVUSUDK-SECBINFHSA-N 1 1 354.204 2.612 20 5 FFBDMO C[C@H]1C[N@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])cc1Br ZINC000798397975 740328082 /nfs/dbraw/zinc/32/80/82/740328082.db2.gz NVMJPHXMNRKCRK-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])cc1Br ZINC000798397975 740328088 /nfs/dbraw/zinc/32/80/88/740328088.db2.gz NVMJPHXMNRKCRK-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO CC[N@@H+](CC1CCCCC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713201 740553322 /nfs/dbraw/zinc/55/33/22/740553322.db2.gz RFYPJSZVUQDHDC-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CC[N@H+](CC1CCCCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713201 740553327 /nfs/dbraw/zinc/55/33/27/740553327.db2.gz RFYPJSZVUQDHDC-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CC[N@@H+](CC1CCCCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713201 740553332 /nfs/dbraw/zinc/55/33/32/740553332.db2.gz RFYPJSZVUQDHDC-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1(C)C ZINC000808005970 741177439 /nfs/dbraw/zinc/17/74/39/741177439.db2.gz NYMOXGAZNVEULN-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1(C)C ZINC000808005970 741177442 /nfs/dbraw/zinc/17/74/42/741177442.db2.gz NYMOXGAZNVEULN-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000808563325 741237338 /nfs/dbraw/zinc/23/73/38/741237338.db2.gz MVTKWWYVLYLQPU-UHFFFAOYSA-N 1 1 353.325 2.944 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000809917247 741360650 /nfs/dbraw/zinc/36/06/50/741360650.db2.gz DJPNMDVTNWCANL-LBPRGKRZSA-N 1 1 368.821 2.577 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCCS(=O)(=O)C1 ZINC000811481668 741528207 /nfs/dbraw/zinc/52/82/07/741528207.db2.gz IXSOSZYFNDAOBO-SNVBAGLBSA-N 1 1 353.227 2.568 20 5 FFBDMO Cc1nc(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cs1 ZINC000813172525 741684561 /nfs/dbraw/zinc/68/45/61/741684561.db2.gz JULLPCAVYWUAIE-INIZCTEOSA-N 1 1 361.423 2.720 20 5 FFBDMO Cc1nc(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cs1 ZINC000813172525 741684562 /nfs/dbraw/zinc/68/45/62/741684562.db2.gz JULLPCAVYWUAIE-INIZCTEOSA-N 1 1 361.423 2.720 20 5 FFBDMO CCn1cc([C@@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cn1 ZINC000832310218 745675801 /nfs/dbraw/zinc/67/58/01/745675801.db2.gz PCFHWAPYYZIHPV-SNVBAGLBSA-N 1 1 351.794 2.754 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000832545137 745716990 /nfs/dbraw/zinc/71/69/90/745716990.db2.gz SFZZSVGOTSQRHP-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000838909468 746734872 /nfs/dbraw/zinc/73/48/72/746734872.db2.gz IPEBTAATATYNSI-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CN(CCCN(C)C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)CC[NH+](C)C ZINC000838909468 746734875 /nfs/dbraw/zinc/73/48/75/746734875.db2.gz IPEBTAATATYNSI-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839417192 746825323 /nfs/dbraw/zinc/82/53/23/746825323.db2.gz ZWNSDXMNVROOQD-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839417192 746825330 /nfs/dbraw/zinc/82/53/30/746825330.db2.gz ZWNSDXMNVROOQD-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839464145 746832476 /nfs/dbraw/zinc/83/24/76/746832476.db2.gz BQNZZQPVZYWFOI-NSHDSACASA-N 1 1 353.806 2.688 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839525271 746846779 /nfs/dbraw/zinc/84/67/79/746846779.db2.gz QFVYJWHFOIBRHX-LLVKDONJSA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839525271 746846784 /nfs/dbraw/zinc/84/67/84/746846784.db2.gz QFVYJWHFOIBRHX-LLVKDONJSA-N 1 1 357.204 2.885 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577701 746860911 /nfs/dbraw/zinc/86/09/11/746860911.db2.gz VJQFZAIMRAGMAF-ZETOZRRWSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577701 746860918 /nfs/dbraw/zinc/86/09/18/746860918.db2.gz VJQFZAIMRAGMAF-ZETOZRRWSA-N 1 1 355.822 2.668 20 5 FFBDMO O=C(C[N@H+]1CCCCC[C@H]1CCO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839596316 746867157 /nfs/dbraw/zinc/86/71/57/746867157.db2.gz VQOQVYJDYYUSHF-ZDUSSCGKSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@H]1CCO)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839596316 746867163 /nfs/dbraw/zinc/86/71/63/746867163.db2.gz VQOQVYJDYYUSHF-ZDUSSCGKSA-N 1 1 355.822 2.814 20 5 FFBDMO CC(C)[N@H+](C[C@H]1CCC(=O)N1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000840187999 747033374 /nfs/dbraw/zinc/03/33/74/747033374.db2.gz JQQJOULQOQTDFC-LLVKDONJSA-N 1 1 364.427 2.818 20 5 FFBDMO CC(C)[N@@H+](C[C@H]1CCC(=O)N1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000840187999 747033381 /nfs/dbraw/zinc/03/33/81/747033381.db2.gz JQQJOULQOQTDFC-LLVKDONJSA-N 1 1 364.427 2.818 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1CCO ZINC000852455995 749864280 /nfs/dbraw/zinc/86/42/80/749864280.db2.gz HMVUSVQQZSNFIB-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1CCO ZINC000852455995 749864286 /nfs/dbraw/zinc/86/42/86/749864286.db2.gz HMVUSVQQZSNFIB-FZMZJTMJSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCc1ccc(F)cc1[N+](=O)[O-] ZINC000853697434 750138086 /nfs/dbraw/zinc/13/80/86/750138086.db2.gz HOIDVUUECVYRMO-UHFFFAOYSA-N 1 1 356.354 2.647 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000854568496 750330772 /nfs/dbraw/zinc/33/07/72/750330772.db2.gz BGUDSTHVCZQWIS-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1[N+](=O)[O-] ZINC000026349588 972256391 /nfs/dbraw/zinc/25/63/91/972256391.db2.gz XDNPRTKTBLIHBE-UHFFFAOYSA-N 1 1 358.354 2.964 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134940073 960547889 /nfs/dbraw/zinc/54/78/89/960547889.db2.gz FTDYDGGAQKIUSB-CRAIPNDOSA-N 1 1 353.422 2.917 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000683548137 960955206 /nfs/dbraw/zinc/95/52/06/960955206.db2.gz QGXFGXVOVWNSLE-OAHLLOKOSA-N 1 1 361.445 2.895 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001174975001 1013344899 /nfs/dbraw/zinc/34/48/99/1013344899.db2.gz IWNMSTUQBZPAKH-GFCCVEGCSA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001174975001 1013344917 /nfs/dbraw/zinc/34/49/17/1013344917.db2.gz IWNMSTUQBZPAKH-GFCCVEGCSA-N 1 1 362.361 2.623 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccnc(N2CCN(C)CC2)c1 ZINC000873014499 1013348014 /nfs/dbraw/zinc/34/80/14/1013348014.db2.gz RQWMYPHBBNTNNF-UHFFFAOYSA-N 1 1 369.469 2.648 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]([C@H]2CCCO2)C1 ZINC000933181438 963675776 /nfs/dbraw/zinc/67/57/76/963675776.db2.gz QUJQXMHEDBSXKE-KBAYOESNSA-N 1 1 362.426 2.570 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@H](c2ccccc2)C1 ZINC000126428663 964283816 /nfs/dbraw/zinc/28/38/16/964283816.db2.gz JKUCTPINQUYXJZ-SFHVURJKSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@H](c2ccccc2)C1 ZINC000126428663 964283823 /nfs/dbraw/zinc/28/38/23/964283823.db2.gz JKUCTPINQUYXJZ-SFHVURJKSA-N 1 1 357.385 2.792 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000891741169 964996974 /nfs/dbraw/zinc/99/69/74/964996974.db2.gz LRECGCLYNBONSX-OAHLLOKOSA-N 1 1 374.416 2.973 20 5 FFBDMO C/C(=C\C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000785109947 966003844 /nfs/dbraw/zinc/00/38/44/966003844.db2.gz QRQRLSJDFBWYFM-YIMOIBLRSA-N 1 1 361.442 2.614 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000895005296 967151202 /nfs/dbraw/zinc/15/12/02/967151202.db2.gz WYXWEVQTOQVBML-IEJURRBGSA-N 1 1 351.406 2.737 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050901704 968104522 /nfs/dbraw/zinc/10/45/22/968104522.db2.gz HIGFVDBABMHHRG-CQSZACIVSA-N 1 1 359.430 2.530 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@@H]1C ZINC000892642113 969676384 /nfs/dbraw/zinc/67/63/84/969676384.db2.gz MCCIZUKRRRHABF-KBPBESRZSA-N 1 1 358.442 2.756 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000875745069 1014070837 /nfs/dbraw/zinc/07/08/37/1014070837.db2.gz HRXTUZHZPANRSR-IAGOWNOFSA-N 1 1 371.441 2.565 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825827644 1014092465 /nfs/dbraw/zinc/09/24/65/1014092465.db2.gz WZOYLLWBUYIQMR-RHSMWYFYSA-N 1 1 363.458 2.645 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000825842159 1014110683 /nfs/dbraw/zinc/11/06/83/1014110683.db2.gz ZJDYMPHCSFILGF-JKSUJKDBSA-N 1 1 361.442 2.621 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC000178570173 977361252 /nfs/dbraw/zinc/36/12/52/977361252.db2.gz UTQRBYXHNWWZMI-FQEVSTJZSA-N 1 1 355.438 2.836 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687931 1014682572 /nfs/dbraw/zinc/68/25/72/1014682572.db2.gz NXOZDLCCOBCNAC-IRXDYDNUSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687931 1014682577 /nfs/dbraw/zinc/68/25/77/1014682577.db2.gz NXOZDLCCOBCNAC-IRXDYDNUSA-N 1 1 354.410 2.599 20 5 FFBDMO COc1cc(CN2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877743308 1014705240 /nfs/dbraw/zinc/70/52/40/1014705240.db2.gz JNIOJSKHEXBNCV-WCQYABFASA-N 1 1 371.384 2.731 20 5 FFBDMO COc1ccc(C[N@H+]2Cc3cccnc3N3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000877762564 1014717010 /nfs/dbraw/zinc/71/70/10/1014717010.db2.gz MHEIVRCXLCGNQZ-INIZCTEOSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1ccc(C[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000877762564 1014717020 /nfs/dbraw/zinc/71/70/20/1014717020.db2.gz MHEIVRCXLCGNQZ-INIZCTEOSA-N 1 1 354.410 2.983 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000877818575 1014741449 /nfs/dbraw/zinc/74/14/49/1014741449.db2.gz KVKLQWVJWMHESA-ZDUSSCGKSA-N 1 1 364.398 2.547 20 5 FFBDMO CN(CCC[NH2+]Cc1c(Cl)cccc1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001483464613 982269803 /nfs/dbraw/zinc/26/98/03/982269803.db2.gz ODLZYWLHMZOZNW-QMTHXVAHSA-N 1 1 360.241 2.597 20 5 FFBDMO C[C@H](C[NH+](C)C)[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000912814267 984126464 /nfs/dbraw/zinc/12/64/64/984126464.db2.gz UURMYGPZWQICSI-WBMJQRKESA-N 1 1 359.430 2.664 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000156448397 984333586 /nfs/dbraw/zinc/33/35/86/984333586.db2.gz PGTGQOLTQUKYKZ-HOTGVXAUSA-N 1 1 359.430 2.946 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC([C@@H]3CCOC3)CC2)o1 ZINC000878402946 1015027203 /nfs/dbraw/zinc/02/72/03/1015027203.db2.gz SJLMMEOGZKAWRD-CQSZACIVSA-N 1 1 358.398 2.893 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084583 984957047 /nfs/dbraw/zinc/95/70/47/984957047.db2.gz WEDJSFZCPNKNSV-ACJLOTCBSA-N 1 1 354.414 2.990 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000765793904 985851966 /nfs/dbraw/zinc/85/19/66/985851966.db2.gz AGSUENBVEUFRIP-UHFFFAOYSA-N 1 1 353.382 2.893 20 5 FFBDMO C[C@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000173508341 985854339 /nfs/dbraw/zinc/85/43/39/985854339.db2.gz QMFHOEOBXJYGCZ-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@H+](C[C@H](O)c1ccc(C)cc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000174281038 986175998 /nfs/dbraw/zinc/17/59/98/986175998.db2.gz YGYMKAHTQQLIGX-ICSRJNTNSA-N 1 1 374.437 2.698 20 5 FFBDMO COc1ccc(CC(=O)OC[C@@H]2CCC[N@H+]2Cc2ccco2)cc1[N+](=O)[O-] ZINC000765966477 987488263 /nfs/dbraw/zinc/48/82/63/987488263.db2.gz GAKPPYGVROJQNV-HNNXBMFYSA-N 1 1 374.393 2.947 20 5 FFBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000914784534 987906431 /nfs/dbraw/zinc/90/64/31/987906431.db2.gz DNXIKTDHBWYSJQ-VVFCZOMOSA-N 1 1 374.441 2.830 20 5 FFBDMO CN(c1nc2ccccn2c1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000761909986 987978076 /nfs/dbraw/zinc/97/80/76/987978076.db2.gz AXLAPQRWDWVFNP-INIZCTEOSA-N 1 1 351.410 2.953 20 5 FFBDMO CC[N@@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@@H]1C(C)C ZINC000922392710 988553453 /nfs/dbraw/zinc/55/34/53/988553453.db2.gz GOGRAJNCOPJJOR-YRXWBPOGSA-N 1 1 365.449 2.693 20 5 FFBDMO CC[N@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@@H]1C(C)C ZINC000922392710 988553460 /nfs/dbraw/zinc/55/34/60/988553460.db2.gz GOGRAJNCOPJJOR-YRXWBPOGSA-N 1 1 365.449 2.693 20 5 FFBDMO COC(=O)Nc1cccc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000796492298 1015458983 /nfs/dbraw/zinc/45/89/83/1015458983.db2.gz ZXTZAHIMMSRHNW-UHFFFAOYSA-N 1 1 373.365 2.834 20 5 FFBDMO Nc1ccc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000031566120 989475031 /nfs/dbraw/zinc/47/50/31/989475031.db2.gz NRAFPHGYJVZKDN-MRXNPFEDSA-N 1 1 354.410 2.571 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000879419997 1015523217 /nfs/dbraw/zinc/52/32/17/1015523217.db2.gz RGIZYICYQZNXON-XYPHTWIQSA-N 1 1 365.405 2.688 20 5 FFBDMO NC(=O)COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000917176193 990167965 /nfs/dbraw/zinc/16/79/65/990167965.db2.gz XJHFRYJDEOEJAM-UHFFFAOYSA-N 1 1 355.394 2.624 20 5 FFBDMO C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000154312901 990171480 /nfs/dbraw/zinc/17/14/80/990171480.db2.gz TUPNRGCUVIFZGM-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000154312901 990171487 /nfs/dbraw/zinc/17/14/87/990171487.db2.gz TUPNRGCUVIFZGM-MOPGFXCFSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000923310201 991062111 /nfs/dbraw/zinc/06/21/11/991062111.db2.gz YWHCGTDMLGYOBR-DOTOQJQBSA-N 1 1 372.469 2.894 20 5 FFBDMO CC[N@@H+]1C[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC001127682974 992007349 /nfs/dbraw/zinc/00/73/49/992007349.db2.gz GWBOTSRWJSZEOG-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC001127682974 992007358 /nfs/dbraw/zinc/00/73/58/992007358.db2.gz GWBOTSRWJSZEOG-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001124711440 992675370 /nfs/dbraw/zinc/67/53/70/992675370.db2.gz NGWBRKULCGYZEH-ZIAGYGMSSA-N 1 1 363.458 2.829 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000072073677 992735121 /nfs/dbraw/zinc/73/51/21/992735121.db2.gz FHIUZVINDXJABC-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000072073677 992735131 /nfs/dbraw/zinc/73/51/31/992735131.db2.gz FHIUZVINDXJABC-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO COc1cccc2c1CC[C@@]2(CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000880383544 1015823772 /nfs/dbraw/zinc/82/37/72/1015823772.db2.gz GKXITGKFPWYEIM-IBGZPJMESA-N 1 1 358.394 2.536 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1 ZINC000808795330 994270575 /nfs/dbraw/zinc/27/05/75/994270575.db2.gz TYRQLRJHOUPSBY-UXHICEINSA-N 1 1 374.412 2.694 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000809228122 994456711 /nfs/dbraw/zinc/45/67/11/994456711.db2.gz ZZFVKJLCKKUFEG-UHFFFAOYSA-N 1 1 355.398 2.720 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810852789 994959002 /nfs/dbraw/zinc/95/90/02/994959002.db2.gz RBAKROBBZNQHAC-DLBZAZTESA-N 1 1 356.382 2.564 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000888830803 1015951960 /nfs/dbraw/zinc/95/19/60/1015951960.db2.gz CYQSPNOFADBMTO-GOSISDBHSA-N 1 1 362.430 2.943 20 5 FFBDMO O=C(CCC1CCOCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173760 995633045 /nfs/dbraw/zinc/63/30/45/995633045.db2.gz JUTJIPYEPAEEDF-SFHVURJKSA-N 1 1 362.426 2.919 20 5 FFBDMO O=C(CCC1CCOCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173760 995633050 /nfs/dbraw/zinc/63/30/50/995633050.db2.gz JUTJIPYEPAEEDF-SFHVURJKSA-N 1 1 362.426 2.919 20 5 FFBDMO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171466 995633357 /nfs/dbraw/zinc/63/33/57/995633357.db2.gz LJLXEUPBNRLLBZ-ZWKOTPCHSA-N 1 1 361.442 2.587 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171466 995633366 /nfs/dbraw/zinc/63/33/66/995633366.db2.gz LJLXEUPBNRLLBZ-ZWKOTPCHSA-N 1 1 361.442 2.587 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn2ccccc12 ZINC000813173999 995633935 /nfs/dbraw/zinc/63/39/35/995633935.db2.gz NYIPIRCPRNJHOV-INIZCTEOSA-N 1 1 366.377 2.674 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn2ccccc12 ZINC000813173999 995633939 /nfs/dbraw/zinc/63/39/39/995633939.db2.gz NYIPIRCPRNJHOV-INIZCTEOSA-N 1 1 366.377 2.674 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)c1[N+](=O)[O-] ZINC000825170238 997235645 /nfs/dbraw/zinc/23/56/45/997235645.db2.gz UZXDFZXVPSJKAN-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)c1 ZINC000825180240 997240058 /nfs/dbraw/zinc/24/00/58/997240058.db2.gz KKCMKIHYOSYGED-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1c(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)cccc1[N+](=O)[O-] ZINC000825163282 997253990 /nfs/dbraw/zinc/25/39/90/997253990.db2.gz VPVBCGDUPIZGMI-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO O=C(NC1(C2CC[NH+](CCC3=CCCCC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000155128 1016250015 /nfs/dbraw/zinc/25/00/15/1016250015.db2.gz RVSDIJPAEYTNMW-QZTJIDSGSA-N 1 1 361.486 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1CN[C@@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC000734000519 999169384 /nfs/dbraw/zinc/16/93/84/999169384.db2.gz QRKYNJITGXCYHE-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1CN[C@@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000734000519 999169389 /nfs/dbraw/zinc/16/93/89/999169389.db2.gz QRKYNJITGXCYHE-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO C[C@H]1CCCCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000738227504 999623370 /nfs/dbraw/zinc/62/33/70/999623370.db2.gz WJRVSIPOHKONQV-SCLBCKFNSA-N 1 1 360.414 2.584 20 5 FFBDMO CC[C@]1(C)CCC[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386232 999816096 /nfs/dbraw/zinc/81/60/96/999816096.db2.gz FMGYBYHMELNBPQ-RTBURBONSA-N 1 1 374.441 2.831 20 5 FFBDMO CC[C@]1(C)CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386232 999816097 /nfs/dbraw/zinc/81/60/97/999816097.db2.gz FMGYBYHMELNBPQ-RTBURBONSA-N 1 1 374.441 2.831 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2CCC[C@@H]21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000744407308 999855812 /nfs/dbraw/zinc/85/58/12/999855812.db2.gz SOYKJRGVVYGDIX-APWZRJJASA-N 1 1 372.469 2.508 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000744798054 999876153 /nfs/dbraw/zinc/87/61/53/999876153.db2.gz FPTKPZOMHQICHL-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCN(c3c(Cl)cncc3Cl)CC2)C1 ZINC001169036680 1000016552 /nfs/dbraw/zinc/01/65/52/1000016552.db2.gz PPOHJXSFWSFZHA-NEPJUHHUSA-N 1 1 359.257 2.956 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)CN1c1ccc(F)cc1 ZINC001169021546 1000017631 /nfs/dbraw/zinc/01/76/31/1000017631.db2.gz OWOZMSOXPPDABE-LJHODMEESA-N 1 1 361.417 2.700 20 5 FFBDMO CCN1CC[C@@]2(C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2c2ccccc2)C1=O ZINC001169026672 1000018282 /nfs/dbraw/zinc/01/82/82/1000018282.db2.gz YNGVVWVEGYYIJR-VELGLUOQSA-N 1 1 371.481 2.770 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc3ccccc3c2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000674227 1016423193 /nfs/dbraw/zinc/42/31/93/1016423193.db2.gz MUERGPMYARXQCY-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO O=C(NCC1=CC[N@H+](Cc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674227 1016423207 /nfs/dbraw/zinc/42/32/07/1016423207.db2.gz MUERGPMYARXQCY-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000674227 1016423220 /nfs/dbraw/zinc/42/32/20/1016423220.db2.gz MUERGPMYARXQCY-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395804 1001100346 /nfs/dbraw/zinc/10/03/46/1001100346.db2.gz MAAAMAFFMSRTRP-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000771395804 1001100350 /nfs/dbraw/zinc/10/03/50/1001100350.db2.gz MAAAMAFFMSRTRP-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000786821107 1001633081 /nfs/dbraw/zinc/63/30/81/1001633081.db2.gz YIIUXHYSDUTOCI-ZFWWWQNUSA-N 1 1 354.410 2.742 20 5 FFBDMO C[C@H](CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839252 1002734856 /nfs/dbraw/zinc/73/48/56/1002734856.db2.gz FOODNWFTRLULNS-ZIAGYGMSSA-N 1 1 358.442 2.979 20 5 FFBDMO CCc1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341524 1003130439 /nfs/dbraw/zinc/13/04/39/1003130439.db2.gz QYTYRBBJRAPBGA-AWEZNQCLSA-N 1 1 370.453 2.988 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](CC(N)=O)c1ccccc1 ZINC000792881400 1003217965 /nfs/dbraw/zinc/21/79/65/1003217965.db2.gz MCEQVCDTOYXFLN-OAHLLOKOSA-N 1 1 358.354 2.552 20 5 FFBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](CC(N)=O)c1ccccc1 ZINC000792881400 1003217973 /nfs/dbraw/zinc/21/79/73/1003217973.db2.gz MCEQVCDTOYXFLN-OAHLLOKOSA-N 1 1 358.354 2.552 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000804607274 1003741929 /nfs/dbraw/zinc/74/19/29/1003741929.db2.gz PZXDCPRNFYATRJ-OAHLLOKOSA-N 1 1 372.381 2.682 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC001192895485 1004313485 /nfs/dbraw/zinc/31/34/85/1004313485.db2.gz MKEVCOKHLRXPCC-UHFFFAOYSA-N 1 1 363.867 2.647 20 5 FFBDMO Cc1cccc(C[N@H+](C)Cc2ccccc2CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1 ZINC001050244382 1016928619 /nfs/dbraw/zinc/92/86/19/1016928619.db2.gz PCICPNPRBRCTHK-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1cccc(C[N@@H+](C)Cc2ccccc2CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1 ZINC001050244382 1016928633 /nfs/dbraw/zinc/92/86/33/1016928633.db2.gz PCICPNPRBRCTHK-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1cccc(C[N@H+](C)Cc2ccccc2CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1 ZINC001050244382 1016928650 /nfs/dbraw/zinc/92/86/50/1016928650.db2.gz PCICPNPRBRCTHK-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO CCc1cccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001050326128 1016968634 /nfs/dbraw/zinc/96/86/34/1016968634.db2.gz SHCIOHBQPKCSDO-NXWXRZEISA-N 1 1 359.470 2.679 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776592680 1006009820 /nfs/dbraw/zinc/00/98/20/1006009820.db2.gz SFBRWOHOVBEPHH-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO CN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000776592651 1006010027 /nfs/dbraw/zinc/01/00/27/1006010027.db2.gz WWXJIJYCXOXDBF-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000776592651 1006010032 /nfs/dbraw/zinc/01/00/32/1006010032.db2.gz WWXJIJYCXOXDBF-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000776592651 1006010038 /nfs/dbraw/zinc/01/00/38/1006010038.db2.gz WWXJIJYCXOXDBF-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@@H]1CC[C@@H](C)C1 ZINC000853507864 1006420659 /nfs/dbraw/zinc/42/06/59/1006420659.db2.gz CHSCVPGGFXIYEQ-HUUCEWRRSA-N 1 1 359.430 2.948 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000853601702 1006469420 /nfs/dbraw/zinc/46/94/20/1006469420.db2.gz FZSPOMJZDVRPRJ-MRXNPFEDSA-N 1 1 371.441 2.652 20 5 FFBDMO CC(C)(C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1CCCC1 ZINC000805610777 1006940667 /nfs/dbraw/zinc/94/06/67/1006940667.db2.gz JJFOUIYKEGUBGN-UHFFFAOYSA-N 1 1 360.370 2.562 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2 ZINC000854736791 1006966492 /nfs/dbraw/zinc/96/64/92/1006966492.db2.gz JJITULUGDNKBCD-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)Nc1cc(-c3cccc([N+](=O)[O-])c3)[nH]n1)CC2 ZINC000816911791 1007269352 /nfs/dbraw/zinc/26/93/52/1007269352.db2.gz YSUGLKAATRUNGG-ZDUSSCGKSA-N 1 1 366.381 2.691 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000856354915 1007785354 /nfs/dbraw/zinc/78/53/54/1007785354.db2.gz MCXYNSOLRKRUGO-OAHLLOKOSA-N 1 1 370.365 2.507 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000856354915 1007785362 /nfs/dbraw/zinc/78/53/62/1007785362.db2.gz MCXYNSOLRKRUGO-OAHLLOKOSA-N 1 1 370.365 2.507 20 5 FFBDMO CN1CC[N@@H+](C)Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc21 ZINC000819465920 1008161806 /nfs/dbraw/zinc/16/18/06/1008161806.db2.gz GZEHDRVGKZQBRG-IBGZPJMESA-N 1 1 356.426 2.622 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001136409074 1008407282 /nfs/dbraw/zinc/40/72/82/1008407282.db2.gz IOZTWRRHNUFPHM-DZGCQCFKSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000137512797 1008617287 /nfs/dbraw/zinc/61/72/87/1008617287.db2.gz LBFADFHJRCWQJZ-GOEBONIOSA-N 1 1 368.437 2.878 20 5 FFBDMO Cc1cc(=O)[nH]c(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000886656372 1008799142 /nfs/dbraw/zinc/79/91/42/1008799142.db2.gz BXRYMYYYTHUFLE-CQSZACIVSA-N 1 1 357.414 2.590 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(OC)c2c(c1)OCCO2 ZINC001178294814 1008941546 /nfs/dbraw/zinc/94/15/46/1008941546.db2.gz BIXLDJHGBNUJRP-UHFFFAOYSA-N 1 1 360.366 2.673 20 5 FFBDMO C[N@@H+](C[C@](C)(O)c1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000823597792 1009134964 /nfs/dbraw/zinc/13/49/64/1009134964.db2.gz BLPUHQYQSWCAFB-ICSRJNTNSA-N 1 1 369.421 2.540 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@]2(C)C1 ZINC000887934612 1009686727 /nfs/dbraw/zinc/68/67/27/1009686727.db2.gz NXFQKJWQGXLLKT-ACJLOTCBSA-N 1 1 372.450 2.742 20 5 FFBDMO COCCC1CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000863270120 1010153233 /nfs/dbraw/zinc/15/32/33/1010153233.db2.gz XEWCZWAVXIJCKY-UHFFFAOYSA-N 1 1 362.430 2.543 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001181839383 1010277609 /nfs/dbraw/zinc/27/76/09/1010277609.db2.gz LMWGOOBKSKJYAZ-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000773260683 1010966670 /nfs/dbraw/zinc/96/66/70/1010966670.db2.gz ZTMUSLCBBPXPJD-KBPBESRZSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000773260683 1010966677 /nfs/dbraw/zinc/96/66/77/1010966677.db2.gz ZTMUSLCBBPXPJD-KBPBESRZSA-N 1 1 361.398 2.599 20 5 FFBDMO CCN(Cc1ccc(OC)cc1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867949797 1011128726 /nfs/dbraw/zinc/12/87/26/1011128726.db2.gz JBARAVWRFQTTEX-IBGZPJMESA-N 1 1 357.410 2.826 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@](O)(c3ccc(F)cc3)C1)OCCO2 ZINC000777436443 1011290205 /nfs/dbraw/zinc/29/02/05/1011290205.db2.gz BRDZPTJVEYUOEF-LJQANCHMSA-N 1 1 374.368 2.599 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@](O)(c3ccc(F)cc3)C1)OCCO2 ZINC000777436443 1011290220 /nfs/dbraw/zinc/29/02/20/1011290220.db2.gz BRDZPTJVEYUOEF-LJQANCHMSA-N 1 1 374.368 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCN(C3CCOCC3)CC1)CC2 ZINC001172916073 1012099710 /nfs/dbraw/zinc/09/97/10/1012099710.db2.gz QKNGLKGXQFCNSI-SFHVURJKSA-N 1 1 359.470 2.639 20 5 FFBDMO CSc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)cc1[N+](=O)[O-] ZINC000870078676 1012108604 /nfs/dbraw/zinc/10/86/04/1012108604.db2.gz GGDVVQWGNBBXJP-OAHLLOKOSA-N 1 1 373.434 2.809 20 5 FFBDMO C[C@H](C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870087306 1012118032 /nfs/dbraw/zinc/11/80/32/1012118032.db2.gz BYCRXBQKUHZVTG-UGSOOPFHSA-N 1 1 355.394 2.577 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([NH+]3CC4(C3)CCCO4)CC2)c(F)c1 ZINC001173009918 1012178820 /nfs/dbraw/zinc/17/88/20/1012178820.db2.gz JQUHWDWJMARXNN-UHFFFAOYSA-N 1 1 353.369 2.707 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[N@H+]3CCC[C@H]3C2)c1F ZINC001173190520 1012331383 /nfs/dbraw/zinc/33/13/83/1012331383.db2.gz UUFJUGKNZLRXQW-KBPBESRZSA-N 1 1 351.422 2.844 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)Cc2cc(C)nn2C)c1F ZINC001173189840 1012331732 /nfs/dbraw/zinc/33/17/32/1012331732.db2.gz MXZHXKOFXGMZDZ-LBPRGKRZSA-N 1 1 350.394 2.847 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@@H]1C ZINC001173192225 1012334579 /nfs/dbraw/zinc/33/45/79/1012334579.db2.gz JUEOHMNMIDBDAF-JHJVBQTASA-N 1 1 368.405 2.947 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192206 1012334672 /nfs/dbraw/zinc/33/46/72/1012334672.db2.gz JORSQPUQUBJAQI-QWHCGFSZSA-N 1 1 367.421 2.664 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192206 1012334691 /nfs/dbraw/zinc/33/46/91/1012334691.db2.gz JORSQPUQUBJAQI-QWHCGFSZSA-N 1 1 367.421 2.664 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@H]2COC ZINC001173222011 1012352186 /nfs/dbraw/zinc/35/21/86/1012352186.db2.gz OHHDORIDGHJYAG-HOCLYGCPSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@H]2COC ZINC001173222011 1012352202 /nfs/dbraw/zinc/35/22/02/1012352202.db2.gz OHHDORIDGHJYAG-HOCLYGCPSA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC001173223110 1012354789 /nfs/dbraw/zinc/35/47/89/1012354789.db2.gz XXUNDXQHMGYGSY-SJWGOKEGSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001173223184 1012355279 /nfs/dbraw/zinc/35/52/79/1012355279.db2.gz AHAQCCZJQJEPNJ-PCVOSPCESA-N 1 1 369.421 2.900 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001173223184 1012355298 /nfs/dbraw/zinc/35/52/98/1012355298.db2.gz AHAQCCZJQJEPNJ-PCVOSPCESA-N 1 1 369.421 2.900 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@@](C)(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870905688 1012626864 /nfs/dbraw/zinc/62/68/64/1012626864.db2.gz BWARNVHEVVKUDY-UXHICEINSA-N 1 1 369.421 2.543 20 5 FFBDMO Cc1ccc(CCC[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001045437160 1019965819 /nfs/dbraw/zinc/96/58/19/1019965819.db2.gz GQFXZQZGAPKJSY-QZTJIDSGSA-N 1 1 359.470 2.564 20 5 FFBDMO CC(C)[C@@H](C)NC(=O)C1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000725786738 1020257591 /nfs/dbraw/zinc/25/75/91/1020257591.db2.gz MLZAMRWSDUQNQU-CQSZACIVSA-N 1 1 373.457 2.775 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCc3nc[nH]c3C23CCOCC3)cc1 ZINC000931103669 1020322444 /nfs/dbraw/zinc/32/24/44/1020322444.db2.gz WGGMGAJXCCYJHV-UHFFFAOYSA-N 1 1 372.425 2.651 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1 ZINC000777956831 1020331546 /nfs/dbraw/zinc/33/15/46/1020331546.db2.gz QXPCCVHMIYFGGW-ZDUSSCGKSA-N 1 1 358.398 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@@H](Cc4nccs4)C3)n2)cc1 ZINC000902649532 1020374578 /nfs/dbraw/zinc/37/45/78/1020374578.db2.gz NZXPIKFJMCJMLN-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](Cc4nccs4)C3)n2)cc1 ZINC000902649532 1020374591 /nfs/dbraw/zinc/37/45/91/1020374591.db2.gz NZXPIKFJMCJMLN-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO Cn1ccc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000932133627 1020714237 /nfs/dbraw/zinc/71/42/37/1020714237.db2.gz FDMREMSRPVDHGD-AWEZNQCLSA-N 1 1 357.414 2.537 20 5 FFBDMO Cn1ccc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000932133628 1020714964 /nfs/dbraw/zinc/71/49/64/1020714964.db2.gz FDMREMSRPVDHGD-CQSZACIVSA-N 1 1 357.414 2.537 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H]([C@H]2CCCO2)C1 ZINC000933183021 1020974074 /nfs/dbraw/zinc/97/40/74/1020974074.db2.gz ZVKNIKACKZMOPW-FHLIZLRMSA-N 1 1 362.426 2.836 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H]([C@@H]2CCCO2)C1 ZINC000933183023 1020974714 /nfs/dbraw/zinc/97/47/14/1020974714.db2.gz ZVKNIKACKZMOPW-OLMNPRSZSA-N 1 1 362.426 2.836 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000749601189 1021012380 /nfs/dbraw/zinc/01/23/80/1021012380.db2.gz DZYVWWXFDHZJPP-CQSZACIVSA-N 1 1 364.402 2.887 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCC[N@H+]2C[C@@H](O)c2cccc([N+](=O)[O-])c2)n1 ZINC001116351699 1021175951 /nfs/dbraw/zinc/17/59/51/1021175951.db2.gz ISHFVUOFCWVLBW-ZWKOTPCHSA-N 1 1 356.426 2.908 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])nc1 ZINC000934343790 1021203299 /nfs/dbraw/zinc/20/32/99/1021203299.db2.gz PLYVPNHFKIJCRI-PBHICJAKSA-N 1 1 373.409 2.575 20 5 FFBDMO CC1(C)C[N@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)CCO1 ZINC001117737610 1021848532 /nfs/dbraw/zinc/84/85/32/1021848532.db2.gz PRLOMGVGJJMLTG-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO CC1(C)C[N@@H+](CCNc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)CCO1 ZINC001117737610 1021848547 /nfs/dbraw/zinc/84/85/47/1021848547.db2.gz PRLOMGVGJJMLTG-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO Cc1ccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1C ZINC001040701330 1022954140 /nfs/dbraw/zinc/95/41/40/1022954140.db2.gz ZSTGVLAFQNMJDG-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001120756644 1023453332 /nfs/dbraw/zinc/45/33/32/1023453332.db2.gz TXWIASKLHKQPRX-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@H]2CN2CCCC2=O)ccc1[N+](=O)[O-] ZINC000755001875 1023552885 /nfs/dbraw/zinc/55/28/85/1023552885.db2.gz MTKXLJOBNHEUIZ-INIZCTEOSA-N 1 1 361.442 2.970 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)[C@@H](C)C1 ZINC001121269082 1023681308 /nfs/dbraw/zinc/68/13/08/1023681308.db2.gz YPQFFFMNFYFPAS-RYUDHWBXSA-N 1 1 364.475 2.618 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000757790932 1023860558 /nfs/dbraw/zinc/86/05/58/1023860558.db2.gz SVCVSRODCJIYGX-RNCFNFMXSA-N 1 1 370.356 2.800 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C ZINC001121698219 1023933942 /nfs/dbraw/zinc/93/39/42/1023933942.db2.gz CVHSMZVGPNHNLK-STQMWFEESA-N 1 1 362.434 2.633 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001121700259 1023934825 /nfs/dbraw/zinc/93/48/25/1023934825.db2.gz UNTHOXWKJXLOKU-JYJNAYRXSA-N 1 1 364.494 2.727 20 5 FFBDMO CCC(CC)C[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540691 1024884780 /nfs/dbraw/zinc/88/47/80/1024884780.db2.gz PNPDZFDOYYKYHR-IAGOWNOFSA-N 1 1 353.507 2.942 20 5 FFBDMO C[N@@H+](CCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)Cc1ccccc1 ZINC000837386018 1025763666 /nfs/dbraw/zinc/76/36/66/1025763666.db2.gz JFTJIFNAHUJNGX-UHFFFAOYSA-N 1 1 372.377 2.655 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC000838906490 1026529951 /nfs/dbraw/zinc/52/99/51/1026529951.db2.gz NHJKJTVEGOGUFP-NXHRZFHOSA-N 1 1 362.426 2.570 20 5 FFBDMO O=C1C[C@]2(CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643894 1026771712 /nfs/dbraw/zinc/77/17/12/1026771712.db2.gz MSYWOPXGQJDMFW-QUCCMNQESA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@]2(CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643894 1026771718 /nfs/dbraw/zinc/77/17/18/1026771718.db2.gz MSYWOPXGQJDMFW-QUCCMNQESA-N 1 1 368.389 2.738 20 5 FFBDMO CN(C)C(=O)OC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000840089912 1026952630 /nfs/dbraw/zinc/95/26/30/1026952630.db2.gz DHKJIVDUNGYJBD-UHFFFAOYSA-N 1 1 373.413 2.578 20 5 FFBDMO COC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840126713 1026970370 /nfs/dbraw/zinc/97/03/70/1026970370.db2.gz QMUDIFVLOJUKMI-LPHOPBHVSA-N 1 1 361.442 2.617 20 5 FFBDMO COC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840126713 1026970378 /nfs/dbraw/zinc/97/03/78/1026970378.db2.gz QMUDIFVLOJUKMI-LPHOPBHVSA-N 1 1 361.442 2.617 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840159735 1026992075 /nfs/dbraw/zinc/99/20/75/1026992075.db2.gz KYDAZKBWFVRVGN-GOSISDBHSA-N 1 1 360.414 2.956 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840159735 1026992081 /nfs/dbraw/zinc/99/20/81/1026992081.db2.gz KYDAZKBWFVRVGN-GOSISDBHSA-N 1 1 360.414 2.956 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1C ZINC001160106786 1027593350 /nfs/dbraw/zinc/59/33/50/1027593350.db2.gz BUYXYMJFRYQPCJ-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001160106786 1027593360 /nfs/dbraw/zinc/59/33/60/1027593360.db2.gz BUYXYMJFRYQPCJ-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001160106786 1027593371 /nfs/dbraw/zinc/59/33/71/1027593371.db2.gz BUYXYMJFRYQPCJ-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc(C(=O)OCC)cc([N+](=O)[O-])c1 ZINC001160702110 1027813812 /nfs/dbraw/zinc/81/38/12/1027813812.db2.gz GFCDUJVBSGDKEI-ZDUSSCGKSA-N 1 1 365.430 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(N[C@@H]3CCC[C@@H]3[NH+]3CCOCC3)nn2)cc1 ZINC001160722880 1027824983 /nfs/dbraw/zinc/82/49/83/1027824983.db2.gz DJVROAJCCSMHMB-MSOLQXFVSA-N 1 1 369.425 2.717 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[NH+]2CCC3(CCC3)CC2)C1=O ZINC000795715343 1027947109 /nfs/dbraw/zinc/94/71/09/1027947109.db2.gz XBCMHEIIRXWBHF-SFHVURJKSA-N 1 1 372.425 2.585 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC001154623229 1028382501 /nfs/dbraw/zinc/38/25/01/1028382501.db2.gz ICMOVHOVVLKDPE-UHFFFAOYSA-N 1 1 367.203 2.546 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2ccn(CC(F)(F)F)n2)ncc1[N+](=O)[O-] ZINC001162024746 1028401385 /nfs/dbraw/zinc/40/13/85/1028401385.db2.gz CJBZBVLEWBQPGN-HWKANZROSA-N 1 1 370.335 2.893 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[N@H+]4CCc5ccccc5[C@@H]4C3)c21 ZINC001155103501 1028581342 /nfs/dbraw/zinc/58/13/42/1028581342.db2.gz QDJUHMBTMHTQAJ-SFHVURJKSA-N 1 1 361.405 2.957 20 5 FFBDMO COc1cc2ncnc(NCC[C@@H]3CC[NH2+]CC3(F)F)c2cc1[N+](=O)[O-] ZINC001162812519 1028666724 /nfs/dbraw/zinc/66/67/24/1028666724.db2.gz MEJDXZZSFDJFFM-JTQLQIEISA-N 1 1 367.356 2.593 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1cccc(Br)c1[N+](=O)[O-] ZINC001163437020 1028926524 /nfs/dbraw/zinc/92/65/24/1028926524.db2.gz IACQDSSYGABIBC-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO CN(CCCNc1cccc(Br)c1[N+](=O)[O-])CC[NH+](C)C ZINC001163437020 1028926532 /nfs/dbraw/zinc/92/65/32/1028926532.db2.gz IACQDSSYGABIBC-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001155894206 1028962743 /nfs/dbraw/zinc/96/27/43/1028962743.db2.gz SHDSLIHJCBPEPE-QSJFSLAZSA-N 1 1 374.485 2.900 20 5 FFBDMO COc1nc(N(C)[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)ncc1[N+](=O)[O-] ZINC001156333221 1029151904 /nfs/dbraw/zinc/15/19/04/1029151904.db2.gz XQFHDLZIBPQBPZ-YOEHRIQHSA-N 1 1 371.441 2.740 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])cc1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164492477 1029298042 /nfs/dbraw/zinc/29/80/42/1029298042.db2.gz LOXPPCYMPOCDBD-GVDBMIGSSA-N 1 1 354.410 2.551 20 5 FFBDMO O=C(NCCC[NH2+]Cc1cccc(Oc2ccccc2)c1)[C@@H]1CC1[N+](=O)[O-] ZINC001157767878 1029658797 /nfs/dbraw/zinc/65/87/97/1029658797.db2.gz ZPOUWARQMVGJIL-RTBURBONSA-N 1 1 369.421 2.740 20 5 FFBDMO O=C(NCCC[NH2+]Cc1ccc(C2CCCCC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001157767450 1029659247 /nfs/dbraw/zinc/65/92/47/1029659247.db2.gz NFGMCRAWHJOQSH-RTBURBONSA-N 1 1 359.470 2.995 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)CC2 ZINC000782357134 1029670174 /nfs/dbraw/zinc/67/01/74/1029670174.db2.gz HRUTWPFGOAXDKS-UHFFFAOYSA-N 1 1 358.442 2.552 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(N2CC[NH+](Cc3cccc(N)c3)CC2)nc1Cl ZINC001158480747 1029838364 /nfs/dbraw/zinc/83/83/64/1029838364.db2.gz NRCARQCEOODURM-UHFFFAOYSA-N 1 1 361.833 2.856 20 5 FFBDMO C/C(=C\C(=O)OC[C@H]1C[N@@H+](CC(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000784870966 1030855031 /nfs/dbraw/zinc/85/50/31/1030855031.db2.gz JUGTWXMKMUZMFO-SPQRHKFCSA-N 1 1 362.426 2.898 20 5 FFBDMO O=C(CCN1CCC[C@H]([C@H]2CCC[NH2+]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000843363262 1031356732 /nfs/dbraw/zinc/35/67/32/1031356732.db2.gz UVFASRNUZDALMQ-XJKSGUPXSA-N 1 1 364.421 2.527 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCCCc2ccccc2)CC1 ZINC001205223473 1031607902 /nfs/dbraw/zinc/60/79/02/1031607902.db2.gz BTCVSMNXTYJOAX-RTBURBONSA-N 1 1 359.470 2.503 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799191997 1031686988 /nfs/dbraw/zinc/68/69/88/1031686988.db2.gz WKWLTYFWOVSWAE-KGLIPLIRSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799191997 1031686996 /nfs/dbraw/zinc/68/69/96/1031686996.db2.gz WKWLTYFWOVSWAE-KGLIPLIRSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193832 1031688665 /nfs/dbraw/zinc/68/86/65/1031688665.db2.gz BDYQYXUQVWWYOZ-CQSZACIVSA-N 1 1 370.409 2.817 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196599 1031694762 /nfs/dbraw/zinc/69/47/62/1031694762.db2.gz UHTKJMFHXMEGPV-KDOFPFPSSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196599 1031694765 /nfs/dbraw/zinc/69/47/65/1031694765.db2.gz UHTKJMFHXMEGPV-KDOFPFPSSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(F)cc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530891 1031789139 /nfs/dbraw/zinc/78/91/39/1031789139.db2.gz XBKIKJOTSZUNJO-GDBMZVCRSA-N 1 1 367.396 2.539 20 5 FFBDMO COC(=O)c1cccc2nc([C@@](F)(Cl)O[C@H](C)C[N+](C)(C)C)[nH]c21 ZINC001223402739 1033430055 /nfs/dbraw/zinc/43/00/55/1033430055.db2.gz HDPKBOWWQBHCAB-HWPZZCPQSA-O 1 1 358.821 2.779 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@H](O)CNC(=O)OC(C)(C)C ZINC000830456880 1033622230 /nfs/dbraw/zinc/62/22/30/1033622230.db2.gz MWQPOFULZMFYPN-UKRRQHHQSA-N 1 1 367.446 2.782 20 5 FFBDMO CN1CCN(CCO[C@H](c2ccccc2)c2ccccc2[N+](=O)[O-])CC1 ZINC001224548563 1033925920 /nfs/dbraw/zinc/92/59/20/1033925920.db2.gz CQTHFNZIFYVKOW-HXUWFJFHSA-N 1 1 355.438 2.948 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1ccc3c(c1)oc1cc(=O)ccc-1[n+]3[O-])C2 ZINC001227449081 1035557582 /nfs/dbraw/zinc/55/75/82/1035557582.db2.gz KSBCUYTZUOBMJM-YWVIFJGQSA-N 1 1 352.390 2.535 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ccc2c(c1)oc1cc(=O)ccc-1[n+]2[O-] ZINC001227454161 1035560946 /nfs/dbraw/zinc/56/09/46/1035560946.db2.gz YFRYHZBPTBGCIR-JORQVXCQSA-N 1 1 366.417 2.640 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1 ZINC001227452892 1035561423 /nfs/dbraw/zinc/56/14/23/1035561423.db2.gz SDGWGWRQYPBOFC-INIZCTEOSA-N 1 1 354.406 2.783 20 5 FFBDMO COC(=O)C1=C[C@@H](Oc2ccc([N+](=O)[O-])cc2)C[N@@H+](Cc2ccccc2)C1 ZINC001227524009 1035594814 /nfs/dbraw/zinc/59/48/14/1035594814.db2.gz VYCBCSKHNOIOCW-LJQANCHMSA-N 1 1 368.389 2.957 20 5 FFBDMO O=c1[nH]cnc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC001228141717 1035958544 /nfs/dbraw/zinc/95/85/44/1035958544.db2.gz TUWDNAIYTVLFEX-QDMKHBRRSA-N 1 1 356.382 2.665 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377405 1036640584 /nfs/dbraw/zinc/64/05/84/1036640584.db2.gz CWKRXDGMDPPCOQ-ARFHVFGLSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377405 1036640598 /nfs/dbraw/zinc/64/05/98/1036640598.db2.gz CWKRXDGMDPPCOQ-ARFHVFGLSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377405 1036640605 /nfs/dbraw/zinc/64/06/05/1036640605.db2.gz CWKRXDGMDPPCOQ-ARFHVFGLSA-N 1 1 370.409 2.688 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H](CO)CC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256092909 1038377046 /nfs/dbraw/zinc/37/70/46/1038377046.db2.gz AYVRLHZUKFRARH-HUUCEWRRSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](O)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093263 1038379422 /nfs/dbraw/zinc/37/94/22/1038379422.db2.gz JAFGXVLEWZGMHG-KSSFIOAISA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@]4(CCCO4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093554 1038379914 /nfs/dbraw/zinc/37/99/14/1038379914.db2.gz NKITWMIHABUWSX-LJQANCHMSA-N 1 1 361.442 2.827 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CC[C@@]4(CCN(C)C4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101474 1038386708 /nfs/dbraw/zinc/38/67/08/1038386708.db2.gz JTUJNEQQVTXINC-HXUWFJFHSA-N 1 1 374.485 2.600 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@]4(CCN(C)C4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101474 1038386720 /nfs/dbraw/zinc/38/67/20/1038386720.db2.gz JTUJNEQQVTXINC-HXUWFJFHSA-N 1 1 374.485 2.600 20 5 FFBDMO CCN1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)[C@H](C)C1 ZINC001256102770 1038387091 /nfs/dbraw/zinc/38/70/91/1038387091.db2.gz HURGNYPFEXTUGO-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO CC[N@@H+]1CCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)[C@H](C)C1 ZINC001256102770 1038387106 /nfs/dbraw/zinc/38/71/06/1038387106.db2.gz HURGNYPFEXTUGO-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO CC[N@H+]1CCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)[C@H](C)C1 ZINC001256102770 1038387120 /nfs/dbraw/zinc/38/71/20/1038387120.db2.gz HURGNYPFEXTUGO-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO C[C@H](c1nnc(CC[NH+]2C[C@@H](C)O[C@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013858 1039113342 /nfs/dbraw/zinc/11/33/42/1039113342.db2.gz ZCNRFNPRWDITMY-MCIONIFRSA-N 1 1 360.414 2.781 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc([N+](=O)[O-])ccc3Cl)o2)C[C@H](C)O1 ZINC001258146637 1039225613 /nfs/dbraw/zinc/22/56/13/1039225613.db2.gz QAMRUINBCSQSKN-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO N[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246475294 1039365666 /nfs/dbraw/zinc/36/56/66/1039365666.db2.gz CZLQPOJYVJSTBO-CVEARBPZSA-N 1 1 354.401 2.701 20 5 FFBDMO C[C@@H]1CNC[C@H](C)[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246584583 1039406114 /nfs/dbraw/zinc/40/61/14/1039406114.db2.gz AZWSMDGDQLVHAH-TXEJJXNPSA-N 1 1 354.401 2.524 20 5 FFBDMO C[C@@H]1CNC[C@H](C)[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246584583 1039406120 /nfs/dbraw/zinc/40/61/20/1039406120.db2.gz AZWSMDGDQLVHAH-TXEJJXNPSA-N 1 1 354.401 2.524 20 5 FFBDMO CCOC(=O)c1cc(Nc2cnc3c(c2)C[N@H+](C)CC3)cc([N+](=O)[O-])c1 ZINC001211367483 1040107719 /nfs/dbraw/zinc/10/77/19/1040107719.db2.gz MMNQVUFOGHYHTR-UHFFFAOYSA-N 1 1 356.382 2.898 20 5 FFBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccc3nccnc3c2)no1 ZINC001248207493 1040173208 /nfs/dbraw/zinc/17/32/08/1040173208.db2.gz FKHIPQGMURJLGI-CQSZACIVSA-N 1 1 362.349 2.831 20 5 FFBDMO O=C1N[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c2ccccc21 ZINC001254467729 1040735267 /nfs/dbraw/zinc/73/52/67/1040735267.db2.gz DBTYLRAERZTRPZ-SFHVURJKSA-N 1 1 352.394 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@@H]4OCC(F)(F)[C@@H]4C3)CC2)cc1 ZINC001254473330 1040738855 /nfs/dbraw/zinc/73/88/55/1040738855.db2.gz AQJGWTNRHBYRSJ-CVEARBPZSA-N 1 1 353.369 2.530 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(CCN2c2ncccn2)C1 ZINC001254562718 1040799705 /nfs/dbraw/zinc/79/97/05/1040799705.db2.gz SYPSZJTYARKWOI-HNAYVOBHSA-N 1 1 353.426 2.671 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C[C@@H]2COC ZINC001254563398 1040802173 /nfs/dbraw/zinc/80/21/73/1040802173.db2.gz ZTFBPUOIJFQFPR-GOEBONIOSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C[C@@H]2COC ZINC001254563398 1040802184 /nfs/dbraw/zinc/80/21/84/1040802184.db2.gz ZTFBPUOIJFQFPR-GOEBONIOSA-N 1 1 358.442 2.988 20 5 FFBDMO COc1cc(C)nc(O[C@H]2CC[N@H+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254568510 1040804724 /nfs/dbraw/zinc/80/47/24/1040804724.db2.gz GKHPSJPTXJXPQF-HOCLYGCPSA-N 1 1 372.425 2.786 20 5 FFBDMO CN1CCN(c2cccc(C[NH2+][C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)c2)CC1 ZINC001254573055 1040810472 /nfs/dbraw/zinc/81/04/72/1040810472.db2.gz WCJJZOMZQBZVNW-LJQANCHMSA-N 1 1 366.465 2.604 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)C[NH+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594730 1040821739 /nfs/dbraw/zinc/82/17/39/1040821739.db2.gz SPVCYTXPFAHBBR-INIZCTEOSA-N 1 1 359.426 2.615 20 5 FFBDMO Cc1cccnc1N1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254597412 1040826970 /nfs/dbraw/zinc/82/69/70/1040826970.db2.gz DGZZNVPALZPWRN-LJQANCHMSA-N 1 1 352.438 2.978 20 5 FFBDMO C[N@@H+]([C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254611738 1040842259 /nfs/dbraw/zinc/84/22/59/1040842259.db2.gz SDHIHPKQAOVXAL-WNRNVDISSA-N 1 1 373.453 2.859 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@H](C)C1 ZINC001310159359 1043645528 /nfs/dbraw/zinc/64/55/28/1043645528.db2.gz HLVZZYZFWHSXCH-SNVBAGLBSA-N 1 1 358.345 2.754 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703780 1045246174 /nfs/dbraw/zinc/24/61/74/1045246174.db2.gz DCYIXODJUVTEPJ-YJBOKZPZSA-N 1 1 372.400 2.800 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703780 1045246180 /nfs/dbraw/zinc/24/61/80/1045246180.db2.gz DCYIXODJUVTEPJ-YJBOKZPZSA-N 1 1 372.400 2.800 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC001322002080 1045910905 /nfs/dbraw/zinc/91/09/05/1045910905.db2.gz TZCGODUWEIGQPK-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC001322002080 1045910915 /nfs/dbraw/zinc/91/09/15/1045910915.db2.gz TZCGODUWEIGQPK-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO Cc1cc(NC(=O)c2ccn(-c3cc[nH+]cc3)n2)c2cc([N+](=O)[O-])ccc2n1 ZINC001322008338 1045911771 /nfs/dbraw/zinc/91/17/71/1045911771.db2.gz WPFPDMVZMDTNSO-UHFFFAOYSA-N 1 1 374.360 2.706 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001325525619 1046540096 /nfs/dbraw/zinc/54/00/96/1046540096.db2.gz JFXMDOWZYGPKRY-CYBMUJFWSA-N 1 1 354.838 2.603 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(Cc1cccc(C[NH+]3CCOCC3)c1)C2 ZINC001325761560 1046633388 /nfs/dbraw/zinc/63/33/88/1046633388.db2.gz NNUPRUUTXDYJMC-UHFFFAOYSA-N 1 1 353.422 2.943 20 5 FFBDMO CCOC(=O)C[C@@H]1CCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC001326795207 1047090666 /nfs/dbraw/zinc/09/06/66/1047090666.db2.gz APMUVYGYPMPKCF-HNNXBMFYSA-N 1 1 358.398 2.833 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001331535494 1047989539 /nfs/dbraw/zinc/98/95/39/1047989539.db2.gz GWATXKDHEQRAOB-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@@H](O)CC2(CCOCC2)C1 ZINC001331564103 1048007248 /nfs/dbraw/zinc/00/72/48/1048007248.db2.gz BXHLYWQPYFCDLL-AWEZNQCLSA-N 1 1 374.359 2.977 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CCN(C[C@H]2CCCO2)CC1 ZINC001333680209 1049050198 /nfs/dbraw/zinc/05/01/98/1049050198.db2.gz NDXYMZZMPGJMQL-MRXNPFEDSA-N 1 1 353.850 2.981 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001303545158 1051381279 /nfs/dbraw/zinc/38/12/79/1051381279.db2.gz XYKBQGSBIQTNFM-LLVKDONJSA-N 1 1 366.849 2.919 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCc2[nH]c(C)[nH+]c2C)cc1SC ZINC001303891855 1051467295 /nfs/dbraw/zinc/46/72/95/1051467295.db2.gz KXYDDQCTMMQPSA-UHFFFAOYSA-N 1 1 350.400 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](O)[C@@H]4CCCC[C@@H]43)n2)cc1 ZINC001308025786 1052386528 /nfs/dbraw/zinc/38/65/28/1052386528.db2.gz RDBQAIUMVZKSNR-PMPSAXMXSA-N 1 1 358.398 2.770 20 5 FFBDMO COC/C(C)=C\C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001335786919 1053565717 /nfs/dbraw/zinc/56/57/17/1053565717.db2.gz SWYICBCMUWTPMN-NSIKDUERSA-N 1 1 359.430 2.576 20 5 FFBDMO CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001347610073 1054153220 /nfs/dbraw/zinc/15/32/20/1054153220.db2.gz BHIVUDHBCUJJDH-CQSZACIVSA-N 1 1 352.483 2.582 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1 ZINC001337457493 1054768771 /nfs/dbraw/zinc/76/87/71/1054768771.db2.gz GCHRFJKKFFLDFH-UHFFFAOYSA-N 1 1 369.425 2.605 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000847445705 1055791258 /nfs/dbraw/zinc/79/12/58/1055791258.db2.gz DMJNCSPGKWHZEB-WMZOPIPTSA-N 1 1 358.442 2.679 20 5 FFBDMO C[C@H]1CC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(C)C ZINC001473365745 1056253594 /nfs/dbraw/zinc/25/35/94/1056253594.db2.gz UCFDWPHQFDSRMP-INIZCTEOSA-N 1 1 374.485 2.611 20 5 FFBDMO C[C@@H](c1nnc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)n1C)[N+](=O)[O-] ZINC001339541938 1056565050 /nfs/dbraw/zinc/56/50/50/1056565050.db2.gz NGULZRXXTDXTFV-GJZGRUSLSA-N 1 1 364.494 2.634 20 5 FFBDMO C[N@@H+]1C[C@@H](O)C[C@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874968 1058253348 /nfs/dbraw/zinc/25/33/48/1058253348.db2.gz QMLXMYFLTHJZLS-HNAYVOBHSA-N 1 1 371.393 2.781 20 5 FFBDMO C[N@H+]1C[C@@H](O)C[C@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874968 1058253369 /nfs/dbraw/zinc/25/33/69/1058253369.db2.gz QMLXMYFLTHJZLS-HNAYVOBHSA-N 1 1 371.393 2.781 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C(C)(C)C1 ZINC001472058974 1058335644 /nfs/dbraw/zinc/33/56/44/1058335644.db2.gz RHQWUAHBVGMCKY-LBPRGKRZSA-N 1 1 370.247 2.817 20 5 FFBDMO CCC1([NH2+]CC2CCCCCC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001502494316 1058861480 /nfs/dbraw/zinc/86/14/80/1058861480.db2.gz CXEWLFOBPXBAPE-IAGOWNOFSA-N 1 1 351.491 2.983 20 5 FFBDMO C[N@@H+]1CCCC[C@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC001355068627 1059851965 /nfs/dbraw/zinc/85/19/65/1059851965.db2.gz KOBDCUANLPTHOG-QMMMGPOBSA-N 1 1 362.249 2.633 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC001355068627 1059851987 /nfs/dbraw/zinc/85/19/87/1059851987.db2.gz KOBDCUANLPTHOG-QMMMGPOBSA-N 1 1 362.249 2.633 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCC[C@H](n3ccnc3)C2)c1 ZINC000848478555 1060110450 /nfs/dbraw/zinc/11/04/50/1060110450.db2.gz JZSTZRNCYRESQA-INIZCTEOSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@H](n3ccnc3)C2)c1 ZINC000848478555 1060110458 /nfs/dbraw/zinc/11/04/58/1060110458.db2.gz JZSTZRNCYRESQA-INIZCTEOSA-N 1 1 352.398 2.949 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848481983 1060116245 /nfs/dbraw/zinc/11/62/45/1060116245.db2.gz IZRLGRVAOKMKNG-SFHVURJKSA-N 1 1 361.442 2.617 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001521138571 1060423950 /nfs/dbraw/zinc/42/39/50/1060423950.db2.gz MCCAWDRYWKIPFY-INIZCTEOSA-N 1 1 372.473 2.694 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)[C@H]2[NH2+]CCOc3ccccc32)cc1[N+](=O)[O-] ZINC001521402546 1060576798 /nfs/dbraw/zinc/57/67/98/1060576798.db2.gz STWOGSFLDUMBFU-UGSOOPFHSA-N 1 1 355.394 2.804 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](Nc2cccc(Br)c2[N+](=O)[O-])C1 ZINC001458528599 1060613343 /nfs/dbraw/zinc/61/33/43/1060613343.db2.gz MCDRPOGIYUJCPH-JTQLQIEISA-N 1 1 358.236 2.614 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001521536973 1060945988 /nfs/dbraw/zinc/94/59/88/1060945988.db2.gz HYXPSAORKYGXII-KRWDZBQOSA-N 1 1 357.385 2.969 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001521536973 1060946010 /nfs/dbraw/zinc/94/60/10/1060946010.db2.gz HYXPSAORKYGXII-KRWDZBQOSA-N 1 1 357.385 2.969 20 5 FFBDMO Cc1csc(C[C@@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)n1 ZINC001460796719 1061106418 /nfs/dbraw/zinc/10/64/18/1061106418.db2.gz UEEPBGYZGMHUBK-ZDUSSCGKSA-N 1 1 374.466 2.913 20 5 FFBDMO C[C@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC001460890159 1061140290 /nfs/dbraw/zinc/14/02/90/1061140290.db2.gz NESILOLCTSASSK-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC001460890159 1061140294 /nfs/dbraw/zinc/14/02/94/1061140294.db2.gz NESILOLCTSASSK-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO O=C1[C@H]([N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460925362 1061152881 /nfs/dbraw/zinc/15/28/81/1061152881.db2.gz SUKCCOSTYJWICJ-JTDSTZFVSA-N 1 1 373.453 2.839 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC001526656348 1061206512 /nfs/dbraw/zinc/20/65/12/1061206512.db2.gz PZENGRXWGLQVCU-MOPGFXCFSA-N 1 1 353.422 2.947 20 5 FFBDMO O=C(Oc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001528364761 1061879594 /nfs/dbraw/zinc/87/95/94/1061879594.db2.gz ODYLSMDVPIEMTC-CQSZACIVSA-N 1 1 371.349 2.931 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001464326720 1062549249 /nfs/dbraw/zinc/54/92/49/1062549249.db2.gz CICLAZLYUIUERU-LLVKDONJSA-N 1 1 350.806 2.748 20 5 FFBDMO Cc1cc(NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)cc(C)[nH+]1 ZINC001435794709 1062562657 /nfs/dbraw/zinc/56/26/57/1062562657.db2.gz YECWAUALXXNUFF-UHFFFAOYSA-N 1 1 351.366 2.526 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001465065131 1062961088 /nfs/dbraw/zinc/96/10/88/1062961088.db2.gz FYZQBMHZHMAQPK-SECBINFHSA-N 1 1 358.801 2.574 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@H]1CC(C)C ZINC001465160358 1062993659 /nfs/dbraw/zinc/99/36/59/1062993659.db2.gz WEHDTQCKYCSPOB-CQSZACIVSA-N 1 1 350.419 2.797 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)c1ccco1 ZINC001440558297 1063314814 /nfs/dbraw/zinc/31/48/14/1063314814.db2.gz PLGKDIHRNIFHBR-SNVBAGLBSA-N 1 1 370.768 2.595 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001470711033 1064420592 /nfs/dbraw/zinc/42/05/92/1064420592.db2.gz JOWRZBRWIGQHOH-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[C@@H](C)Oc1cccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001577001986 1078293454 /nfs/dbraw/zinc/29/34/54/1078293454.db2.gz ASISXALJNXJZTJ-KZULUSFZSA-N 1 1 358.398 2.980 20 5 FFBDMO COc1ccccc1[C@@H]([NH3+])C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001579302505 1078614400 /nfs/dbraw/zinc/61/44/00/1078614400.db2.gz XXYLIUUDJWAJSS-MRXNPFEDSA-N 1 1 352.350 2.790 20 5 FFBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC001582804885 1079111602 /nfs/dbraw/zinc/11/16/02/1079111602.db2.gz QDIWDQKTINPBSV-LLVKDONJSA-N 1 1 363.447 2.655 20 5 FFBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001582804885 1079111603 /nfs/dbraw/zinc/11/16/03/1079111603.db2.gz QDIWDQKTINPBSV-LLVKDONJSA-N 1 1 363.447 2.655 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)n1 ZINC001556897480 1075786806 /nfs/dbraw/zinc/78/68/06/1075786806.db2.gz LYDAPZQLQGEOOV-RHSMWYFYSA-N 1 1 354.410 2.691 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)cccc1[N+](=O)[O-] ZINC001557757257 1075884696 /nfs/dbraw/zinc/88/46/96/1075884696.db2.gz AQYOIWQJOWBDFR-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@H]21 ZINC001559259892 1076140865 /nfs/dbraw/zinc/14/08/65/1076140865.db2.gz PXGCUOFWFBYLTH-XHDPSFHLSA-N 1 1 357.370 2.582 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N[C@H]3CCC[N@H+]4CCSC[C@@H]34)c2c1 ZINC001559277868 1076144772 /nfs/dbraw/zinc/14/47/72/1076144772.db2.gz FTONSZGELDINQS-RDJZCZTQSA-N 1 1 374.466 2.565 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1cnc(C)s1 ZINC001560057444 1076219594 /nfs/dbraw/zinc/21/95/94/1076219594.db2.gz RUGILWOPUXKBLQ-VIFPVBQESA-N 1 1 350.400 2.658 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@H]1C(C)(C)C ZINC001570914705 1077242609 /nfs/dbraw/zinc/24/26/09/1077242609.db2.gz JWABNSWNUJGRIJ-KRWDZBQOSA-N 1 1 358.442 2.738 20 5 FFBDMO O=C(NCc1ccc(Nc2cc[nH+]cc2)cc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001585995419 1079522619 /nfs/dbraw/zinc/52/26/19/1079522619.db2.gz FNVLVUNKANDCRM-UHFFFAOYSA-N 1 1 364.361 2.791 20 5 FFBDMO CC(C)([NH2+]Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1ccccc1F ZINC001589321484 1080482288 /nfs/dbraw/zinc/48/22/88/1080482288.db2.gz FISLJJHQDIGUSY-UHFFFAOYSA-N 1 1 356.361 2.939 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1)[N@@H+](C)Cc1ccccc1 ZINC001589877124 1080826008 /nfs/dbraw/zinc/82/60/08/1080826008.db2.gz MBNSDAZKQTZRHF-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO CC[N@@H+]1CCc2[nH]c(=NC(=O)c3ccc(NC)c([N+](=O)[O-])c3)sc2C1 ZINC000021294640 539682060 /nfs/dbraw/zinc/68/20/60/539682060.db2.gz JQLRYUHFEDHEGA-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO CC[N@H+]1CCc2[nH]c(=NC(=O)c3ccc(NC)c([N+](=O)[O-])c3)sc2C1 ZINC000021294640 539682064 /nfs/dbraw/zinc/68/20/64/539682064.db2.gz JQLRYUHFEDHEGA-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccco1 ZINC000021903051 249329566 /nfs/dbraw/zinc/32/95/66/249329566.db2.gz SONUIFGABQUIRO-INIZCTEOSA-N 1 1 358.398 2.795 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CO)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000092764795 250000442 /nfs/dbraw/zinc/00/04/42/250000442.db2.gz LSVBOGYFPZYKIF-QGZVFWFLSA-N 1 1 372.421 2.997 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCO)Cc1ccccc1 ZINC000103140587 250135964 /nfs/dbraw/zinc/13/59/64/250135964.db2.gz YSEAIARABHDEHT-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO CC[N@H+]1CC[C@H](CNCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441804 252038947 /nfs/dbraw/zinc/03/89/47/252038947.db2.gz OPTUVVRBJAMCQN-GFCCVEGCSA-N 1 1 373.400 2.679 20 5 FFBDMO Cc1noc(C)c1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272474391 252047249 /nfs/dbraw/zinc/04/72/49/252047249.db2.gz AZXZGFLSUCOMNJ-QGZVFWFLSA-N 1 1 355.398 2.855 20 5 FFBDMO CCN(CC)C(=O)CCC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272543223 252064707 /nfs/dbraw/zinc/06/47/07/252064707.db2.gz PLWUDPLKVRLCCN-GOSISDBHSA-N 1 1 373.457 2.656 20 5 FFBDMO C[C@@H](NC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000272668363 252095175 /nfs/dbraw/zinc/09/51/75/252095175.db2.gz IGPRLCWYOWBAGN-SNVBAGLBSA-N 1 1 368.231 2.738 20 5 FFBDMO COc1ccc(NC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000272839427 252145240 /nfs/dbraw/zinc/14/52/40/252145240.db2.gz OFYRIOAQWSGLCD-CQSZACIVSA-N 1 1 350.419 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC000273067440 252207799 /nfs/dbraw/zinc/20/77/99/252207799.db2.gz FBCOBHXGVIMFAZ-OAHLLOKOSA-N 1 1 362.817 2.822 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)nc1 ZINC000273419816 252302709 /nfs/dbraw/zinc/30/27/09/252302709.db2.gz JCQLVXRCJJEQHF-LLVKDONJSA-N 1 1 369.830 2.768 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000275484508 256014103 /nfs/dbraw/zinc/01/41/03/256014103.db2.gz ORLPVTQEKRJNFG-CQSZACIVSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000275484508 256014105 /nfs/dbraw/zinc/01/41/05/256014105.db2.gz ORLPVTQEKRJNFG-CQSZACIVSA-N 1 1 360.357 2.798 20 5 FFBDMO Cc1nnc([C@@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)s1 ZINC000275635001 256033196 /nfs/dbraw/zinc/03/31/96/256033196.db2.gz RDOOCQDKMRODNL-MRVPVSSYSA-N 1 1 353.379 2.573 20 5 FFBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)s1 ZINC000285310248 256978947 /nfs/dbraw/zinc/97/89/47/256978947.db2.gz SMFJPBDXVGQZTI-SNVBAGLBSA-N 1 1 369.468 2.883 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCCC[C@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000285942685 257012580 /nfs/dbraw/zinc/01/25/80/257012580.db2.gz MFEDGTZHQDNFEK-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)N2CCCC2)C1 ZINC000287623138 257099155 /nfs/dbraw/zinc/09/91/55/257099155.db2.gz ZXADYMZIWGLOPK-OAHLLOKOSA-N 1 1 361.442 2.826 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(F)(c3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC000289401858 257279175 /nfs/dbraw/zinc/27/91/75/257279175.db2.gz SDPFUINCJNNWNA-UHFFFAOYSA-N 1 1 358.373 2.550 20 5 FFBDMO CC(C)S(=O)(=O)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000289225758 257267568 /nfs/dbraw/zinc/26/75/68/257267568.db2.gz ALTFVKNUDGNBFD-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO CCS(=O)(=O)C[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290799865 257358303 /nfs/dbraw/zinc/35/83/03/257358303.db2.gz DYOUNCDSXPWVDL-QMMMGPOBSA-N 1 1 355.243 2.814 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293601847 257553747 /nfs/dbraw/zinc/55/37/47/257553747.db2.gz VBXMPEWWCOEUHF-UONOGXRCSA-N 1 1 357.332 2.970 20 5 FFBDMO CC[NH+](CC)[C@@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000294844571 257604955 /nfs/dbraw/zinc/60/49/55/257604955.db2.gz FDIZFDVOQVNQFU-OAHLLOKOSA-N 1 1 357.414 2.541 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)C1 ZINC000301304008 258041458 /nfs/dbraw/zinc/04/14/58/258041458.db2.gz SQMASNPNQUIOJF-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO COc1cc(NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000301382160 258046452 /nfs/dbraw/zinc/04/64/52/258046452.db2.gz ZTJKUFLIMSHCRZ-QGZVFWFLSA-N 1 1 357.410 2.916 20 5 FFBDMO COc1cc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000301382160 258046454 /nfs/dbraw/zinc/04/64/54/258046454.db2.gz ZTJKUFLIMSHCRZ-QGZVFWFLSA-N 1 1 357.410 2.916 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(C)[nH+]c1N1CCCC1 ZINC000302060580 258085519 /nfs/dbraw/zinc/08/55/19/258085519.db2.gz SQMSNAAUURBGRO-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO Cc1ccnc(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)c1[N+](=O)[O-] ZINC000302069138 258085950 /nfs/dbraw/zinc/08/59/50/258085950.db2.gz XKQQDAAASWNQGZ-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO Cc1nn(C)c(Nc2cccc3c2CC[N@@H+](CC(C)(C)O)C3)c1[N+](=O)[O-] ZINC000302182692 258093323 /nfs/dbraw/zinc/09/33/23/258093323.db2.gz SFJKQRIPBUIPLM-UHFFFAOYSA-N 1 1 359.430 2.509 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NCCc1cn2c([nH+]1)CCCC2 ZINC000302713533 258108561 /nfs/dbraw/zinc/10/85/61/258108561.db2.gz ZZBGEWOOSLSDNY-UHFFFAOYSA-N 1 1 366.219 2.940 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1)CCN2 ZINC000302882845 258113831 /nfs/dbraw/zinc/11/38/31/258113831.db2.gz KGOXRUGFHDRWFC-HOTGVXAUSA-N 1 1 368.437 2.610 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2ncc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000301578372 258056796 /nfs/dbraw/zinc/05/67/96/258056796.db2.gz ZLROTUNCPGZIMM-GXFFZTMASA-N 1 1 357.252 2.919 20 5 FFBDMO O=c1[nH]cnc2cc(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c([N+](=O)[O-])cc21 ZINC000301795546 258067837 /nfs/dbraw/zinc/06/78/37/258067837.db2.gz SVPORBXAIBOZTG-LRDDRELGSA-N 1 1 369.425 2.697 20 5 FFBDMO COc1cc(NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000301871892 258072313 /nfs/dbraw/zinc/07/23/13/258072313.db2.gz DBDNXTJIPYMXLV-CHWSQXEVSA-N 1 1 367.446 2.912 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330691301 258168345 /nfs/dbraw/zinc/16/83/45/258168345.db2.gz BCWRWYNUVGNVTC-DOTOQJQBSA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000330836932 258171671 /nfs/dbraw/zinc/17/16/71/258171671.db2.gz TWHIDYZCBKOKAP-CMPLNLGQSA-N 1 1 357.863 2.939 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000332065470 258212096 /nfs/dbraw/zinc/21/20/96/258212096.db2.gz SINFGDVXIGKJKM-YPMHNXCESA-N 1 1 370.356 2.945 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2ccc(Br)cc2[N+](=O)[O-])n1C ZINC000070143489 507609469 /nfs/dbraw/zinc/60/94/69/507609469.db2.gz ZATCTSYFLVKULH-UHFFFAOYSA-N 1 1 354.208 2.769 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NCCC[N@H+]1CCc2ccccc2C1 ZINC000032399026 506247702 /nfs/dbraw/zinc/24/77/02/506247702.db2.gz RQXVPIUSHRJQAM-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000032723307 506284035 /nfs/dbraw/zinc/28/40/35/506284035.db2.gz BWVSDRUOPBXPNT-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000065586744 506328729 /nfs/dbraw/zinc/32/87/29/506328729.db2.gz RPNVWZZJBIHVHB-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000065586744 506328733 /nfs/dbraw/zinc/32/87/33/506328733.db2.gz RPNVWZZJBIHVHB-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000053303785 506351444 /nfs/dbraw/zinc/35/14/44/506351444.db2.gz SPJZKVXEAVORIX-GASCZTMLSA-N 1 1 363.458 2.846 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](C2CCOCC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000371065211 512201851 /nfs/dbraw/zinc/20/18/51/512201851.db2.gz OFRAJXPQSDHLDC-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](C2CCOCC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000371065211 512201853 /nfs/dbraw/zinc/20/18/53/512201853.db2.gz OFRAJXPQSDHLDC-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000371068127 512203044 /nfs/dbraw/zinc/20/30/44/512203044.db2.gz ZABQEUZKQRCXBD-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000366834646 512208684 /nfs/dbraw/zinc/20/86/84/512208684.db2.gz VHIRZLBOCGQHAQ-NSHDSACASA-N 1 1 362.361 2.638 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)CC1 ZINC000369080007 512218069 /nfs/dbraw/zinc/21/80/69/512218069.db2.gz ZZFVFNFYXRKCEM-UHFFFAOYSA-N 1 1 373.369 2.794 20 5 FFBDMO CC(C)C[C@H](C)C[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000410304235 512236904 /nfs/dbraw/zinc/23/69/04/512236904.db2.gz BWTDNIMZAWXYHH-HNNXBMFYSA-N 1 1 369.487 2.583 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000065892027 506387192 /nfs/dbraw/zinc/38/71/92/506387192.db2.gz XFZSNUSJUBUSDO-HUUCEWRRSA-N 1 1 358.442 2.786 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000054392699 506551334 /nfs/dbraw/zinc/55/13/34/506551334.db2.gz ICKCEEYJHBXXMG-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000054392699 506551341 /nfs/dbraw/zinc/55/13/41/506551341.db2.gz ICKCEEYJHBXXMG-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(F)c1 ZINC000041888251 506564885 /nfs/dbraw/zinc/56/48/85/506564885.db2.gz PACBRQDDQYWSPX-UHFFFAOYSA-N 1 1 374.372 2.633 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(F)c1 ZINC000041888251 506564893 /nfs/dbraw/zinc/56/48/93/506564893.db2.gz PACBRQDDQYWSPX-UHFFFAOYSA-N 1 1 374.372 2.633 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066920176 506693686 /nfs/dbraw/zinc/69/36/86/506693686.db2.gz OILDRRMLQTWFIJ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066920176 506693691 /nfs/dbraw/zinc/69/36/91/506693691.db2.gz OILDRRMLQTWFIJ-KRXQYRFLSA-N 1 1 363.458 2.906 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCOCC1 ZINC000067386624 506856264 /nfs/dbraw/zinc/85/62/64/506856264.db2.gz XAXDSNGQFBLWOL-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO CNC(=O)c1ccc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000055899919 506880378 /nfs/dbraw/zinc/88/03/78/506880378.db2.gz ULUAMGXJIMDHIL-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000056039404 506916768 /nfs/dbraw/zinc/91/67/68/506916768.db2.gz MWCQQKYLLGBOQH-UHFFFAOYSA-N 1 1 355.394 2.722 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000056067405 506923045 /nfs/dbraw/zinc/92/30/45/506923045.db2.gz MMWVVKOPOKWJSB-GASCZTMLSA-N 1 1 369.487 2.631 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000067724890 506990755 /nfs/dbraw/zinc/99/07/55/506990755.db2.gz JJUMZTHXQRLZRU-SFHVURJKSA-N 1 1 354.410 2.793 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000067724890 506990757 /nfs/dbraw/zinc/99/07/57/506990757.db2.gz JJUMZTHXQRLZRU-SFHVURJKSA-N 1 1 354.410 2.793 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2sccc2C1 ZINC000057004180 507143494 /nfs/dbraw/zinc/14/34/94/507143494.db2.gz NQLHXNDWLAZFEF-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2sccc2C1 ZINC000057004180 507143498 /nfs/dbraw/zinc/14/34/98/507143498.db2.gz NQLHXNDWLAZFEF-ZDUSSCGKSA-N 1 1 374.466 2.902 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000057005682 507144790 /nfs/dbraw/zinc/14/47/90/507144790.db2.gz HLUPPYXBJWJWRR-UHFFFAOYSA-N 1 1 356.426 2.916 20 5 FFBDMO C[N@H+]1CCCC12CCN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC2 ZINC000373425371 512324417 /nfs/dbraw/zinc/32/44/17/512324417.db2.gz CRYLZLUDYYNKBB-UHFFFAOYSA-N 1 1 364.421 2.623 20 5 FFBDMO C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[N@H+]1CCC[C@H](C)C1 ZINC000058256560 507394632 /nfs/dbraw/zinc/39/46/32/507394632.db2.gz DZEOGBAEUHENHF-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCN(C)c2ccccc2C1 ZINC000069090980 507406053 /nfs/dbraw/zinc/40/60/53/507406053.db2.gz IAUUIEYLAPXZLY-AWEZNQCLSA-N 1 1 354.410 2.874 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCN(C)c2ccccc2C1 ZINC000069090980 507406064 /nfs/dbraw/zinc/40/60/64/507406064.db2.gz IAUUIEYLAPXZLY-AWEZNQCLSA-N 1 1 354.410 2.874 20 5 FFBDMO CC(C)[NH+]1CCN([C@H]2CCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000371335376 512339185 /nfs/dbraw/zinc/33/91/85/512339185.db2.gz JVUMXUPXUYEJOG-XZXOBPBMSA-N 1 1 358.486 2.708 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@@H](C)O1 ZINC000048317214 507501185 /nfs/dbraw/zinc/50/11/85/507501185.db2.gz SUDFZIOHDBNYTM-CHWSQXEVSA-N 1 1 374.441 2.694 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](CCOC)C2CCCC2)c([N+](=O)[O-])c1 ZINC000026447323 507587013 /nfs/dbraw/zinc/58/70/13/507587013.db2.gz SRTHIJIFHFIEHF-UHFFFAOYSA-N 1 1 365.430 2.823 20 5 FFBDMO Cc1ccc(OCC[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000027373676 507653478 /nfs/dbraw/zinc/65/34/78/507653478.db2.gz ZOOIPTQWAZYWOR-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000027373676 507653485 /nfs/dbraw/zinc/65/34/85/507653485.db2.gz ZOOIPTQWAZYWOR-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000063865383 507777187 /nfs/dbraw/zinc/77/71/87/507777187.db2.gz IATKUDAOPCSLDR-INIZCTEOSA-N 1 1 374.485 2.659 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000064245269 507787310 /nfs/dbraw/zinc/78/73/10/507787310.db2.gz RXKJQOOAHIDRMB-UHFFFAOYSA-N 1 1 361.489 2.589 20 5 FFBDMO Cc1ccnc(N(C)CC[NH+]2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000077995449 507825405 /nfs/dbraw/zinc/82/54/05/507825405.db2.gz NOFAIMFWUSRNOH-UHFFFAOYSA-N 1 1 355.442 2.557 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](CCO)c1ccccc1 ZINC000072773163 507852342 /nfs/dbraw/zinc/85/23/42/507852342.db2.gz XUYGZLVHJQGVEP-SFHVURJKSA-N 1 1 369.421 2.539 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](CCO)c1ccccc1 ZINC000072773163 507852345 /nfs/dbraw/zinc/85/23/45/507852345.db2.gz XUYGZLVHJQGVEP-SFHVURJKSA-N 1 1 369.421 2.539 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072932682 507874055 /nfs/dbraw/zinc/87/40/55/507874055.db2.gz NTDPKEMSZKHQLS-UHFFFAOYSA-N 1 1 357.370 2.739 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000089926079 507885033 /nfs/dbraw/zinc/88/50/33/507885033.db2.gz ZHLLVVMVBZOZNC-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO Cc1cc(C)cc(C2=CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000092427357 508070730 /nfs/dbraw/zinc/07/07/30/508070730.db2.gz QLEIYLLKAQLDDC-IBGZPJMESA-N 1 1 356.426 2.558 20 5 FFBDMO CCOc1cc(NC[C@H](C)CN2CC[NH+](CC)CC2)ccc1[N+](=O)[O-] ZINC000092612734 508086624 /nfs/dbraw/zinc/08/66/24/508086624.db2.gz UHPAJISVBKMPFO-HNNXBMFYSA-N 1 1 350.463 2.679 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)C1 ZINC000080640993 508090965 /nfs/dbraw/zinc/09/09/65/508090965.db2.gz AMPFPOQBDYQXMC-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000080960253 508117871 /nfs/dbraw/zinc/11/78/71/508117871.db2.gz KMNMWNZZBNVSGB-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO COc1ccc([C@H](CO)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083172716 508238925 /nfs/dbraw/zinc/23/89/25/508238925.db2.gz LAHULAGNRPZMCR-INIZCTEOSA-N 1 1 357.366 2.910 20 5 FFBDMO COc1ccc([C@H](CO)[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083172716 508238927 /nfs/dbraw/zinc/23/89/27/508238927.db2.gz LAHULAGNRPZMCR-INIZCTEOSA-N 1 1 357.366 2.910 20 5 FFBDMO COc1cc(N2CCC(N3CC[NH+](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000114003360 508289954 /nfs/dbraw/zinc/28/99/54/508289954.db2.gz XCUMKUBUEPWBMH-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087116224 508337504 /nfs/dbraw/zinc/33/75/04/508337504.db2.gz HEJRTMZIJQEMFA-INIZCTEOSA-N 1 1 358.442 2.679 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115274218 508380369 /nfs/dbraw/zinc/38/03/69/508380369.db2.gz IPNVHXXLZHDRDH-NVXWUHKLSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1ccc(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000133626130 508426234 /nfs/dbraw/zinc/42/62/34/508426234.db2.gz CUGBOWGFRQZWKX-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)ccc1O ZINC000156893218 508492934 /nfs/dbraw/zinc/49/29/34/508492934.db2.gz VJDMYSCZFFWQNA-MRXNPFEDSA-N 1 1 371.393 2.546 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)ccc1O ZINC000156893218 508492938 /nfs/dbraw/zinc/49/29/38/508492938.db2.gz VJDMYSCZFFWQNA-MRXNPFEDSA-N 1 1 371.393 2.546 20 5 FFBDMO O=C(CCN1CCC[C@H]([NH+]2CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000157289196 508547566 /nfs/dbraw/zinc/54/75/66/508547566.db2.gz YXQNRIWIENUYGN-KRWDZBQOSA-N 1 1 360.458 2.874 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000153410594 508580977 /nfs/dbraw/zinc/58/09/77/508580977.db2.gz PGAASCZHSOQAEH-DGCLKSJQSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000153634898 508612993 /nfs/dbraw/zinc/61/29/93/508612993.db2.gz QCFHETIVNBSFEC-CQSZACIVSA-N 1 1 370.400 2.585 20 5 FFBDMO Cc1cccc2[nH+]c(Cn3nc(-c4cccc([N+](=O)[O-])c4)ccc3=O)cn21 ZINC000118176224 508638224 /nfs/dbraw/zinc/63/82/24/508638224.db2.gz RNBYQBVHGXHATN-UHFFFAOYSA-N 1 1 361.361 2.823 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](c2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000123408351 508682260 /nfs/dbraw/zinc/68/22/60/508682260.db2.gz GJBOIUFRPABKMG-QGZVFWFLSA-N 1 1 351.406 2.973 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000153986325 508693065 /nfs/dbraw/zinc/69/30/65/508693065.db2.gz FNRGESWEXNJCAR-NVXWUHKLSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@@H+](CCO)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000158678651 508738355 /nfs/dbraw/zinc/73/83/55/508738355.db2.gz ALXCGTQOARLAET-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123943256 508760981 /nfs/dbraw/zinc/76/09/81/508760981.db2.gz WMKQORYTWWGCSF-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124068520 508779104 /nfs/dbraw/zinc/77/91/04/508779104.db2.gz ABLFHMQMMMCBHJ-XJKSGUPXSA-N 1 1 371.441 2.550 20 5 FFBDMO COc1cc(C[N@@H+]2CCOC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000369450745 512417546 /nfs/dbraw/zinc/41/75/46/512417546.db2.gz GAPUVNAAJGKELN-LLVKDONJSA-N 1 1 360.357 2.716 20 5 FFBDMO COc1cc(C[N@H+]2CCOC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000369450745 512417548 /nfs/dbraw/zinc/41/75/48/512417548.db2.gz GAPUVNAAJGKELN-LLVKDONJSA-N 1 1 360.357 2.716 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cn1 ZINC000371464076 512417913 /nfs/dbraw/zinc/41/79/13/512417913.db2.gz OEDCMBAJGZXRLT-CZUORRHYSA-N 1 1 371.397 2.558 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000154574765 508812726 /nfs/dbraw/zinc/81/27/26/508812726.db2.gz DYOJUHHFNBENTC-UHFFFAOYSA-N 1 1 359.342 2.787 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000159274208 508817612 /nfs/dbraw/zinc/81/76/12/508817612.db2.gz FPVKRYMPYWCFOU-UHFFFAOYSA-N 1 1 354.410 2.580 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](CCO)CCCO)cc1[N+](=O)[O-] ZINC000124422994 508829155 /nfs/dbraw/zinc/82/91/55/508829155.db2.gz UGONAHCVBJHVTP-UHFFFAOYSA-N 1 1 359.426 2.539 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCc3ccccc3[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000130702210 508833227 /nfs/dbraw/zinc/83/32/27/508833227.db2.gz HKQPLLWKJWNEDT-SFHVURJKSA-N 1 1 358.394 2.574 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159452223 508843922 /nfs/dbraw/zinc/84/39/22/508843922.db2.gz LBXJJXJFPFEYRV-ZETOZRRWSA-N 1 1 355.822 2.668 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OC(F)F ZINC000159869169 508903293 /nfs/dbraw/zinc/90/32/93/508903293.db2.gz ZSFNGCBDQBEYJN-GWCFXTLKSA-N 1 1 360.357 2.798 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000369473332 512426390 /nfs/dbraw/zinc/42/63/90/512426390.db2.gz WDUYUQRWUQUCBG-CQSZACIVSA-N 1 1 373.413 2.535 20 5 FFBDMO Cc1c(Br)cc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000125224557 508951221 /nfs/dbraw/zinc/95/12/21/508951221.db2.gz AHNNDDWCSFRIRY-GFCCVEGCSA-N 1 1 370.247 2.832 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000125271979 508957911 /nfs/dbraw/zinc/95/79/11/508957911.db2.gz LQPTZMHGJSUKKZ-JTQLQIEISA-N 1 1 357.332 2.828 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000120328229 508974264 /nfs/dbraw/zinc/97/42/64/508974264.db2.gz JWGUWOPUOKOALV-OAHLLOKOSA-N 1 1 364.446 2.570 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125574459 509001523 /nfs/dbraw/zinc/00/15/23/509001523.db2.gz IASBJYOYKRJEOA-YJBOKZPZSA-N 1 1 358.442 2.753 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000132411322 509027870 /nfs/dbraw/zinc/02/78/70/509027870.db2.gz WBDWXGKMYFMZCD-CTNGQTDRSA-N 1 1 374.529 2.778 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000120927844 509090345 /nfs/dbraw/zinc/09/03/45/509090345.db2.gz BEMANMQPGXHJIF-YGRLFVJLSA-N 1 1 370.247 2.770 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000133307597 509145173 /nfs/dbraw/zinc/14/51/73/509145173.db2.gz RHIAYAPWMHKQTF-UHFFFAOYSA-N 1 1 370.409 2.637 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000248039351 509222906 /nfs/dbraw/zinc/22/29/06/509222906.db2.gz LRXDHDZXNHMAQX-CRAIPNDOSA-N 1 1 355.394 2.779 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000248164933 509253641 /nfs/dbraw/zinc/25/36/41/509253641.db2.gz SUNBLNHTUSFDNZ-MAUKXSAKSA-N 1 1 360.458 2.730 20 5 FFBDMO Cc1c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000172832809 509262666 /nfs/dbraw/zinc/26/26/66/509262666.db2.gz RTPNCYUHZBEHHT-ZDUSSCGKSA-N 1 1 364.402 2.758 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000248404511 509299152 /nfs/dbraw/zinc/29/91/52/509299152.db2.gz QFPVJHRRYQUSMB-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000248404511 509299158 /nfs/dbraw/zinc/29/91/58/509299158.db2.gz QFPVJHRRYQUSMB-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC000248405831 509300368 /nfs/dbraw/zinc/30/03/68/509300368.db2.gz RTVOSMSRZOJJHM-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC000248405831 509300377 /nfs/dbraw/zinc/30/03/77/509300377.db2.gz RTVOSMSRZOJJHM-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO C[C@@H](C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1nccs1 ZINC000248439529 509319511 /nfs/dbraw/zinc/31/95/11/509319511.db2.gz CMNRERSHIQYUIH-QWHCGFSZSA-N 1 1 351.428 2.527 20 5 FFBDMO COc1cccc([C@@H](C)[NH+]2CCN(c3c([N+](=O)[O-])c(C)nn3C)CC2)c1 ZINC000264088616 509324480 /nfs/dbraw/zinc/32/44/80/509324480.db2.gz AXPFLXZOYROEKB-CQSZACIVSA-N 1 1 359.430 2.529 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000176197674 509373191 /nfs/dbraw/zinc/37/31/91/509373191.db2.gz NREZETPFZMAFTO-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000176197674 509373193 /nfs/dbraw/zinc/37/31/93/509373193.db2.gz NREZETPFZMAFTO-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185879978 509403443 /nfs/dbraw/zinc/40/34/43/509403443.db2.gz QKTJFRLFXVORCM-MRXNPFEDSA-N 1 1 372.469 2.970 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc(C(=O)NC)cc1[N+](=O)[O-] ZINC000192236081 509418784 /nfs/dbraw/zinc/41/87/84/509418784.db2.gz JFYSKYCSAJGXTF-UHFFFAOYSA-N 1 1 359.430 2.630 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](CCC(N)=O)C1 ZINC000229178672 509424290 /nfs/dbraw/zinc/42/42/90/509424290.db2.gz UACJYQOQOGUXQF-OLZOCXBDSA-N 1 1 373.413 2.683 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC[N@@H+]1CCOC ZINC000179585601 509523997 /nfs/dbraw/zinc/52/39/97/509523997.db2.gz LIJNVFVZGBKPFK-MRXNPFEDSA-N 1 1 363.458 2.703 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000179585601 509523999 /nfs/dbraw/zinc/52/39/99/509523999.db2.gz LIJNVFVZGBKPFK-MRXNPFEDSA-N 1 1 363.458 2.703 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000186159844 509552022 /nfs/dbraw/zinc/55/20/22/509552022.db2.gz IAKZODLQKASUHY-INIZCTEOSA-N 1 1 354.406 2.882 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)[C@@H](C)C1 ZINC000249030622 509575839 /nfs/dbraw/zinc/57/58/39/509575839.db2.gz LYCWYXDUBRLMPV-LSDHHAIUSA-N 1 1 369.487 2.562 20 5 FFBDMO CCN(C(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000173464481 509618073 /nfs/dbraw/zinc/61/80/73/509618073.db2.gz DQIRJINIGIHRQE-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO CCN(C(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000173464481 509618077 /nfs/dbraw/zinc/61/80/77/509618077.db2.gz DQIRJINIGIHRQE-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000179887391 509660562 /nfs/dbraw/zinc/66/05/62/509660562.db2.gz URLHYLKECNVCJA-MRXNPFEDSA-N 1 1 358.398 2.523 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000192946028 509711406 /nfs/dbraw/zinc/71/14/06/509711406.db2.gz NSBVVGGKLMDYLO-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CCN1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1=O ZINC000186591373 509789881 /nfs/dbraw/zinc/78/98/81/509789881.db2.gz WHXBFHIDHXWFKY-UHFFFAOYSA-N 1 1 372.425 2.735 20 5 FFBDMO CCN1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1=O ZINC000186591373 509789886 /nfs/dbraw/zinc/78/98/86/509789886.db2.gz WHXBFHIDHXWFKY-UHFFFAOYSA-N 1 1 372.425 2.735 20 5 FFBDMO C[C@@H](CCNC(=O)c1cccc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000177023669 509824620 /nfs/dbraw/zinc/82/46/20/509824620.db2.gz GJWWSKOHIABTSF-AWEZNQCLSA-N 1 1 356.426 2.817 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000183585838 509872782 /nfs/dbraw/zinc/87/27/82/509872782.db2.gz GBURDIOQKXCHKJ-UKRRQHHQSA-N 1 1 355.398 2.774 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[N@H+]1C1CC1 ZINC000177179069 509921465 /nfs/dbraw/zinc/92/14/65/509921465.db2.gz PAJMQTLKAIDHIC-UONOGXRCSA-N 1 1 358.442 2.550 20 5 FFBDMO C[C@H](CN1CCN(C)CC1)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180497681 509955830 /nfs/dbraw/zinc/95/58/30/509955830.db2.gz TZPSKPPEJSMHOR-UTKZUKDTSA-N 1 1 368.481 2.910 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)CC2 ZINC000245483682 509962028 /nfs/dbraw/zinc/96/20/28/509962028.db2.gz FYNMVUBPWWHCEZ-LESCRADOSA-N 1 1 360.458 2.869 20 5 FFBDMO C[C@]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)(C(N)=O)c1cccc(Cl)c1 ZINC000177414117 510044848 /nfs/dbraw/zinc/04/48/48/510044848.db2.gz ZGFVNTYJAWBWIZ-QGZVFWFLSA-N 1 1 363.801 2.617 20 5 FFBDMO C[C@H](C[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000183940185 510048345 /nfs/dbraw/zinc/04/83/45/510048345.db2.gz IGZQIJAJQRFAFA-GFCCVEGCSA-N 1 1 360.439 2.676 20 5 FFBDMO C[C@H](C[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000183940185 510048348 /nfs/dbraw/zinc/04/83/48/510048348.db2.gz IGZQIJAJQRFAFA-GFCCVEGCSA-N 1 1 360.439 2.676 20 5 FFBDMO Cc1cnc(C(C)(C)[NH2+][C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000183968083 510063360 /nfs/dbraw/zinc/06/33/60/510063360.db2.gz RXTDZFRTKKXCAP-AWEZNQCLSA-N 1 1 360.439 2.990 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000245675454 510077412 /nfs/dbraw/zinc/07/74/12/510077412.db2.gz HCPPXYHMOGMXAA-QMTHXVAHSA-N 1 1 370.247 2.816 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCSC[C@H](C)C1 ZINC000190415545 510117935 /nfs/dbraw/zinc/11/79/35/510117935.db2.gz SAIYHWDWRQGPRL-NEPJUHHUSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000190415545 510117939 /nfs/dbraw/zinc/11/79/39/510117939.db2.gz SAIYHWDWRQGPRL-NEPJUHHUSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1C ZINC000262076226 510168047 /nfs/dbraw/zinc/16/80/47/510168047.db2.gz XFWPEUVVRKFPFH-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184195286 510185768 /nfs/dbraw/zinc/18/57/68/510185768.db2.gz CODCYHPTMMWWMK-CYBMUJFWSA-N 1 1 367.421 2.727 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184195286 510185775 /nfs/dbraw/zinc/18/57/75/510185775.db2.gz CODCYHPTMMWWMK-CYBMUJFWSA-N 1 1 367.421 2.727 20 5 FFBDMO C[N@@H+](CC1(O)CCCCCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000187334798 510203847 /nfs/dbraw/zinc/20/38/47/510203847.db2.gz GMBOROZRGHIBRZ-KRWDZBQOSA-N 1 1 361.442 2.717 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2C[C@H](C)[NH2+]Cc3ccccc32)cc1[N+](=O)[O-] ZINC000262282639 510231533 /nfs/dbraw/zinc/23/15/33/510231533.db2.gz UUBRJCYQWVBNGH-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279327 510321748 /nfs/dbraw/zinc/32/17/48/510321748.db2.gz OBEMGRMNQIMBLR-LRDDRELGSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000269279327 510321754 /nfs/dbraw/zinc/32/17/54/510321754.db2.gz OBEMGRMNQIMBLR-LRDDRELGSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184435954 510323762 /nfs/dbraw/zinc/32/37/62/510323762.db2.gz LWLXHEQJVJKRPU-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000184453417 510331702 /nfs/dbraw/zinc/33/17/02/510331702.db2.gz LOFKRJIEKNSBLV-PBHICJAKSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000266009058 510356263 /nfs/dbraw/zinc/35/62/63/510356263.db2.gz RZTUZWHSDQDPKR-ABAIWWIYSA-N 1 1 364.402 2.614 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000171805891 510380637 /nfs/dbraw/zinc/38/06/37/510380637.db2.gz DYMHCVIVQDQURA-HNNXBMFYSA-N 1 1 371.441 2.665 20 5 FFBDMO CN(CC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000246338775 510435670 /nfs/dbraw/zinc/43/56/70/510435670.db2.gz LQQNTLQXGWRPDS-DOTOQJQBSA-N 1 1 372.469 2.506 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](CO)c1ccccc1 ZINC000269641271 510495224 /nfs/dbraw/zinc/49/52/24/510495224.db2.gz XTIZVEQXLPVNGK-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[NH+](C2CCC2)CC1 ZINC000266296196 510505232 /nfs/dbraw/zinc/50/52/32/510505232.db2.gz JTORPADDMKTRPM-UHFFFAOYSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503802 510525410 /nfs/dbraw/zinc/52/54/10/510525410.db2.gz HWCVXQRWTPCDGW-HNAYVOBHSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503802 510525431 /nfs/dbraw/zinc/52/54/31/510525431.db2.gz HWCVXQRWTPCDGW-HNAYVOBHSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503802 510525438 /nfs/dbraw/zinc/52/54/38/510525438.db2.gz HWCVXQRWTPCDGW-HNAYVOBHSA-N 1 1 372.469 2.872 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC000194784072 510525667 /nfs/dbraw/zinc/52/56/67/510525667.db2.gz JHMYMKZQTQLBDJ-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ncc(-c2ccccc2)o1 ZINC000184905707 510574345 /nfs/dbraw/zinc/57/43/45/510574345.db2.gz YRHOCMKRBRWKHG-CYBMUJFWSA-N 1 1 354.366 2.762 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000194927853 510595345 /nfs/dbraw/zinc/59/53/45/510595345.db2.gz YEONQQICJSZRAO-IBGZPJMESA-N 1 1 361.442 2.765 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000181862874 510630843 /nfs/dbraw/zinc/63/08/43/510630843.db2.gz KMJBRXNBKHOJHO-HOTGVXAUSA-N 1 1 352.431 2.616 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000246713271 510631515 /nfs/dbraw/zinc/63/15/15/510631515.db2.gz FUXHSHZKBUDKAW-DOTOQJQBSA-N 1 1 363.458 2.770 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)nc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181953435 510676644 /nfs/dbraw/zinc/67/66/44/510676644.db2.gz ZCZPTRFUAJUHME-ZDUSSCGKSA-N 1 1 351.790 2.515 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000270357900 510776470 /nfs/dbraw/zinc/77/64/70/510776470.db2.gz JLMMAEPZLFMTHA-LLVKDONJSA-N 1 1 357.252 2.920 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182296484 510845869 /nfs/dbraw/zinc/84/58/69/510845869.db2.gz QRMLLJIYZBAMSG-GOEBONIOSA-N 1 1 360.414 2.512 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000247181815 510849705 /nfs/dbraw/zinc/84/97/05/510849705.db2.gz PPTVIXQMGCUHAG-SJORKVTESA-N 1 1 352.431 2.616 20 5 FFBDMO Cc1cccc([C@@H]2CCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1C ZINC000247204682 510851493 /nfs/dbraw/zinc/85/14/93/510851493.db2.gz CDZSQJOJSNPEKF-MJGOQNOKSA-N 1 1 358.442 2.996 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000247504409 510863527 /nfs/dbraw/zinc/86/35/27/510863527.db2.gz XVFITMASNUQPND-QMTHXVAHSA-N 1 1 370.247 2.816 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)C2)C1 ZINC000293913833 510897466 /nfs/dbraw/zinc/89/74/66/510897466.db2.gz HZVQOUHGRAVCQN-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](N2CCCC2)C[C@H]1C ZINC000285415687 510897706 /nfs/dbraw/zinc/89/77/06/510897706.db2.gz DIMAHPCRGTWKSC-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](N2CCCC2)C[C@H]1C ZINC000285415687 510897711 /nfs/dbraw/zinc/89/77/11/510897711.db2.gz DIMAHPCRGTWKSC-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCOc3cc(O)ccc3C2)cccc1[N+](=O)[O-] ZINC000285441827 510908155 /nfs/dbraw/zinc/90/81/55/510908155.db2.gz IJKGYTZPIQDBFQ-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCOc3cc(O)ccc3C2)cccc1[N+](=O)[O-] ZINC000285441827 510908157 /nfs/dbraw/zinc/90/81/57/510908157.db2.gz IJKGYTZPIQDBFQ-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](C2CCOCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364607291 510967565 /nfs/dbraw/zinc/96/75/65/510967565.db2.gz MOYPNZCCZQULQW-CQSZACIVSA-N 1 1 365.405 2.811 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000279288569 511032212 /nfs/dbraw/zinc/03/22/12/511032212.db2.gz MDFOMBQMZIJHLJ-ZIAGYGMSSA-N 1 1 355.797 2.673 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1c(Br)cncc1[N+](=O)[O-] ZINC000271024401 511060953 /nfs/dbraw/zinc/06/09/53/511060953.db2.gz ZRTXKQUGAWCTKY-UHFFFAOYSA-N 1 1 354.208 2.784 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2ccncn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000361652486 511074982 /nfs/dbraw/zinc/07/49/82/511074982.db2.gz MHVUQRXZZQGWRM-CQSZACIVSA-N 1 1 355.398 2.593 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](C3OCCO3)C2)ccc1Br ZINC000271138883 511094091 /nfs/dbraw/zinc/09/40/91/511094091.db2.gz BLGWJYCBDHNFNK-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](C3OCCO3)C2)ccc1Br ZINC000271138883 511094094 /nfs/dbraw/zinc/09/40/94/511094094.db2.gz BLGWJYCBDHNFNK-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2 ZINC000291406171 511184351 /nfs/dbraw/zinc/18/43/51/511184351.db2.gz XMFHKGLXNOHZBJ-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO COCc1ccc(CNC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000271694560 511290305 /nfs/dbraw/zinc/29/03/05/511290305.db2.gz FZCLJHCTXSSRGJ-CQSZACIVSA-N 1 1 357.410 2.708 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000280257424 511395985 /nfs/dbraw/zinc/39/59/85/511395985.db2.gz TXSFNSYXBIRWLQ-SNVBAGLBSA-N 1 1 368.796 2.887 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000292026535 511436278 /nfs/dbraw/zinc/43/62/78/511436278.db2.gz YQSDMCYUZVXMOC-IUODEOHRSA-N 1 1 354.370 2.849 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000292026535 511436281 /nfs/dbraw/zinc/43/62/81/511436281.db2.gz YQSDMCYUZVXMOC-IUODEOHRSA-N 1 1 354.370 2.849 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000283723533 511476321 /nfs/dbraw/zinc/47/63/21/511476321.db2.gz VYVCKTZXFKDDES-CQSZACIVSA-N 1 1 359.430 2.620 20 5 FFBDMO CC(C)([NH2+]CC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000292249583 511521801 /nfs/dbraw/zinc/52/18/01/511521801.db2.gz XNWBSFOGSXQPGT-IRXDYDNUSA-N 1 1 361.442 2.590 20 5 FFBDMO C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+](C2CCC2)C1 ZINC000292258540 511525856 /nfs/dbraw/zinc/52/58/56/511525856.db2.gz KQMRIAJAAJAVIT-ZDUSSCGKSA-N 1 1 358.442 2.790 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)CC[C@@H]21 ZINC000273851124 511632024 /nfs/dbraw/zinc/63/20/24/511632024.db2.gz LUCDHSZCBDYIBY-DYVFJYSZSA-N 1 1 363.433 2.954 20 5 FFBDMO C[C@H](C(=O)Nc1cccc(F)c1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365845324 511683789 /nfs/dbraw/zinc/68/37/89/511683789.db2.gz IPULAKQVOAPSGW-GFCCVEGCSA-N 1 1 361.377 2.595 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000281021869 511691433 /nfs/dbraw/zinc/69/14/33/511691433.db2.gz OLUZARIJFNLIGP-LESCRADOSA-N 1 1 361.442 2.939 20 5 FFBDMO Cc1nn(C)c(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)c1[N+](=O)[O-] ZINC000281177179 511747788 /nfs/dbraw/zinc/74/77/88/511747788.db2.gz CAJPNUJEHKUJET-UHFFFAOYSA-N 1 1 351.794 2.604 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)c1 ZINC000350338569 511782197 /nfs/dbraw/zinc/78/21/97/511782197.db2.gz JQMHROLUCRMZET-QAPCUYQASA-N 1 1 374.397 2.969 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000366141310 511863503 /nfs/dbraw/zinc/86/35/03/511863503.db2.gz BHVPSNVEHBNFQX-MLGOLLRUSA-N 1 1 360.439 2.864 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000274689675 511910979 /nfs/dbraw/zinc/91/09/79/511910979.db2.gz ZRDCXKPQWQXGID-UHFFFAOYSA-N 1 1 357.292 2.940 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875404 511972746 /nfs/dbraw/zinc/97/27/46/511972746.db2.gz XIUYKPQCHWLSHB-IRXDYDNUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875404 511972753 /nfs/dbraw/zinc/97/27/53/511972753.db2.gz XIUYKPQCHWLSHB-IRXDYDNUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875404 511972757 /nfs/dbraw/zinc/97/27/57/511972757.db2.gz XIUYKPQCHWLSHB-IRXDYDNUSA-N 1 1 365.474 2.700 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)C2)C1 ZINC000293648799 512038084 /nfs/dbraw/zinc/03/80/84/512038084.db2.gz GTIAXIAGGCELGB-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000364434815 512108930 /nfs/dbraw/zinc/10/89/30/512108930.db2.gz OXUPGPCHRCQNAY-LJQANCHMSA-N 1 1 353.378 2.569 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H](O)c2ncc[nH]2)CC1 ZINC000375695077 512459437 /nfs/dbraw/zinc/45/94/37/512459437.db2.gz ZDPNXCSEBQIXPO-KRWDZBQOSA-N 1 1 360.414 2.662 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCC[N@@H+](C)C2CCCCC2)c1F ZINC000411436217 512636117 /nfs/dbraw/zinc/63/61/17/512636117.db2.gz DXVJZQDOJWJGQZ-UHFFFAOYSA-N 1 1 367.421 2.666 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000378300604 512684149 /nfs/dbraw/zinc/68/41/49/512684149.db2.gz BDAKVZOSJKOPOX-UHFFFAOYSA-N 1 1 369.469 2.816 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000378300604 512684154 /nfs/dbraw/zinc/68/41/54/512684154.db2.gz BDAKVZOSJKOPOX-UHFFFAOYSA-N 1 1 369.469 2.816 20 5 FFBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000374169849 512690279 /nfs/dbraw/zinc/69/02/79/512690279.db2.gz GURCWZVDKSGFST-OAOQPFQOSA-N 1 1 361.442 2.795 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000378540252 512814477 /nfs/dbraw/zinc/81/44/77/512814477.db2.gz KBRCJKDKXUCWIR-INIZCTEOSA-N 1 1 368.437 2.819 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949954 512885819 /nfs/dbraw/zinc/88/58/19/512885819.db2.gz QSXAMSSDQKCRDS-ROUUACIJSA-N 1 1 356.378 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949954 512885822 /nfs/dbraw/zinc/88/58/22/512885822.db2.gz QSXAMSSDQKCRDS-ROUUACIJSA-N 1 1 356.378 2.769 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000370366817 512896730 /nfs/dbraw/zinc/89/67/30/512896730.db2.gz MKDVIDLHLWMJJA-UHFFFAOYSA-N 1 1 353.369 2.773 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000396464037 512942201 /nfs/dbraw/zinc/94/22/01/512942201.db2.gz VWKOLDNLSZIUDS-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000396464037 512942206 /nfs/dbraw/zinc/94/22/06/512942206.db2.gz VWKOLDNLSZIUDS-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C(C)(C)CN1CCOCC1 ZINC000412073794 512944172 /nfs/dbraw/zinc/94/41/72/512944172.db2.gz AMUXAHYIDZJGPF-UHFFFAOYSA-N 1 1 365.474 2.925 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000412192646 512992819 /nfs/dbraw/zinc/99/28/19/512992819.db2.gz KMIKDVQIROZJOE-HZPDHXFCSA-N 1 1 361.442 2.938 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000408167672 513013270 /nfs/dbraw/zinc/01/32/70/513013270.db2.gz FMZUGLYHOMIOJN-HRCADAONSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C ZINC000408167672 513013274 /nfs/dbraw/zinc/01/32/74/513013274.db2.gz FMZUGLYHOMIOJN-HRCADAONSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374873675 513049154 /nfs/dbraw/zinc/04/91/54/513049154.db2.gz DPKFPQUHKVTALC-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374873675 513049156 /nfs/dbraw/zinc/04/91/56/513049156.db2.gz DPKFPQUHKVTALC-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H]2C[C@H](O)c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000372810111 513053838 /nfs/dbraw/zinc/05/38/38/513053838.db2.gz NIZGUZCUQBUEIL-WMZOPIPTSA-N 1 1 374.441 2.815 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412369427 513055935 /nfs/dbraw/zinc/05/59/35/513055935.db2.gz PGZMPCQAVWWHCX-AWEZNQCLSA-N 1 1 361.442 2.938 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000428794041 513193939 /nfs/dbraw/zinc/19/39/39/513193939.db2.gz LXJCUGCRVMUSPK-FQEVSTJZSA-N 1 1 370.405 2.920 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000428793991 513194495 /nfs/dbraw/zinc/19/44/95/513194495.db2.gz MBYOZFIZVIKJTK-HXUWFJFHSA-N 1 1 370.405 2.920 20 5 FFBDMO Cn1ccnc1[C@H](NC1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000421367508 513237487 /nfs/dbraw/zinc/23/74/87/513237487.db2.gz DXWQLNRCLLABAJ-LEOMRAHMSA-N 1 1 357.458 2.880 20 5 FFBDMO Cn1ccnc1[C@@H](NC1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000421367275 513237994 /nfs/dbraw/zinc/23/79/94/513237994.db2.gz DKIIBXXTBLCPDO-HTWSVDAQSA-N 1 1 357.458 2.880 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1CCC[N@@H+]1CCCO ZINC000450598765 513266942 /nfs/dbraw/zinc/26/69/42/513266942.db2.gz RBSHVTVFDUFXDQ-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000429140474 513289946 /nfs/dbraw/zinc/28/99/46/513289946.db2.gz ZLRRLQCJKISWIF-GDBMZVCRSA-N 1 1 358.394 2.618 20 5 FFBDMO C[C@H](C(=O)N(C)c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440481394 513329765 /nfs/dbraw/zinc/32/97/65/513329765.db2.gz ARZVMLDUYWHVNQ-HUUCEWRRSA-N 1 1 369.425 2.528 20 5 FFBDMO C[C@H](C(=O)N(C)c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440481394 513329776 /nfs/dbraw/zinc/32/97/76/513329776.db2.gz ARZVMLDUYWHVNQ-HUUCEWRRSA-N 1 1 369.425 2.528 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000450786654 513340624 /nfs/dbraw/zinc/34/06/24/513340624.db2.gz DJZGZQLXFUSTDT-TXEJJXNPSA-N 1 1 356.220 2.632 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000424998087 513359609 /nfs/dbraw/zinc/35/96/09/513359609.db2.gz HLBORQMUCPUPDJ-UHFFFAOYSA-N 1 1 361.398 2.524 20 5 FFBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434622512 513370665 /nfs/dbraw/zinc/37/06/65/513370665.db2.gz FLGCVAHFCWFMNS-DLBZAZTESA-N 1 1 350.394 2.620 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCSC(C)(C)CC2)c([N+](=O)[O-])c1 ZINC000434677459 513393037 /nfs/dbraw/zinc/39/30/37/513393037.db2.gz WTYTVXNLPXNPJC-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCSC(C)(C)CC2)c([N+](=O)[O-])c1 ZINC000434677459 513393042 /nfs/dbraw/zinc/39/30/42/513393042.db2.gz WTYTVXNLPXNPJC-UHFFFAOYSA-N 1 1 353.444 2.759 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425058826 513395463 /nfs/dbraw/zinc/39/54/63/513395463.db2.gz PRZYOCNULSHGGO-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000425285961 513491616 /nfs/dbraw/zinc/49/16/16/513491616.db2.gz XSKKCSCAPBWIPP-UHFFFAOYSA-N 1 1 358.442 2.998 20 5 FFBDMO COCC[N@@H+](C)CCNc1cc(C(F)(F)C(F)(F)F)ncc1[N+](=O)[O-] ZINC000447679727 513540064 /nfs/dbraw/zinc/54/00/64/513540064.db2.gz LNCSJFJXHCHLTI-UHFFFAOYSA-N 1 1 372.294 2.634 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(NCCc3[nH+]ccn3Cc3ccccc3)nc2c1 ZINC000447684786 513542352 /nfs/dbraw/zinc/54/23/52/513542352.db2.gz DSDBSRGAWQTEAH-UHFFFAOYSA-N 1 1 362.393 2.792 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000447809384 513576098 /nfs/dbraw/zinc/57/60/98/513576098.db2.gz YOTUYXXVCMDMAL-UHFFFAOYSA-N 1 1 373.457 2.824 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000430211263 513588352 /nfs/dbraw/zinc/58/83/52/513588352.db2.gz XHOPTXFDWRHADD-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000430211263 513588359 /nfs/dbraw/zinc/58/83/59/513588359.db2.gz XHOPTXFDWRHADD-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000430211263 513588368 /nfs/dbraw/zinc/58/83/68/513588368.db2.gz XHOPTXFDWRHADD-RVKKMQEKSA-N 1 1 363.458 2.677 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000451295872 513659269 /nfs/dbraw/zinc/65/92/69/513659269.db2.gz NVVCKUUEWAAYRI-QGZVFWFLSA-N 1 1 361.442 2.794 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](CCO)c1cccc(C(F)(F)F)c1 ZINC000451301020 513662674 /nfs/dbraw/zinc/66/26/74/513662674.db2.gz BFGAGYUHULWQEB-LBPRGKRZSA-N 1 1 358.320 2.560 20 5 FFBDMO C[N@@H+]1CCCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000435834918 513694659 /nfs/dbraw/zinc/69/46/59/513694659.db2.gz KSVGQIMELCXMPS-UHFFFAOYSA-N 1 1 371.387 2.737 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000435834918 513694668 /nfs/dbraw/zinc/69/46/68/513694668.db2.gz KSVGQIMELCXMPS-UHFFFAOYSA-N 1 1 371.387 2.737 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[C@@H](C)C[N@H+]1CCO ZINC000419007407 513714224 /nfs/dbraw/zinc/71/42/24/513714224.db2.gz RMTYSHRCJLIIKA-CABCVRRESA-N 1 1 356.426 2.548 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)n2)cc1 ZINC000451426690 513743117 /nfs/dbraw/zinc/74/31/17/513743117.db2.gz VWTLGOUEYAYGRX-XHSDSOJGSA-N 1 1 358.398 2.770 20 5 FFBDMO COc1cc(CN2CCC3(CC[NH2+]C3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000430915655 513780571 /nfs/dbraw/zinc/78/05/71/513780571.db2.gz QSKWPHKIYWHAJR-UHFFFAOYSA-N 1 1 371.384 2.780 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H](CO)c1ccccc1 ZINC000436250124 513805923 /nfs/dbraw/zinc/80/59/23/513805923.db2.gz BNQAXNKPEBSULP-QGZVFWFLSA-N 1 1 371.393 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cc1 ZINC000436264579 513811394 /nfs/dbraw/zinc/81/13/94/513811394.db2.gz VLKPFSYDSJCGAA-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cc1 ZINC000436264579 513811407 /nfs/dbraw/zinc/81/14/07/513811407.db2.gz VLKPFSYDSJCGAA-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC[N@H+]1C ZINC000426209179 513872255 /nfs/dbraw/zinc/87/22/55/513872255.db2.gz HNBBBWYXCAPQAC-YGRLFVJLSA-N 1 1 374.363 2.896 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CCC[N@H+](C)CCN(C)C ZINC000436506992 513876861 /nfs/dbraw/zinc/87/68/61/513876861.db2.gz DWJKZUWJMRWGTN-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CCCN(C)CC[NH+](C)C ZINC000436506992 513876867 /nfs/dbraw/zinc/87/68/67/513876867.db2.gz DWJKZUWJMRWGTN-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO C[N@@H+](CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000448803003 513905592 /nfs/dbraw/zinc/90/55/92/513905592.db2.gz BONASGXONLRGNI-UHFFFAOYSA-N 1 1 361.442 2.938 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000451690950 513912855 /nfs/dbraw/zinc/91/28/55/513912855.db2.gz ARPFUZJBYWCGBP-ZJIFWQFVSA-N 1 1 361.442 2.713 20 5 FFBDMO C[C@H]1CC[N@H+](C)CCN1C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444041578 514107459 /nfs/dbraw/zinc/10/74/59/514107459.db2.gz CAHQFFFCYZPJTO-ZDUSSCGKSA-N 1 1 367.424 2.987 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444041578 514107466 /nfs/dbraw/zinc/10/74/66/514107466.db2.gz CAHQFFFCYZPJTO-ZDUSSCGKSA-N 1 1 367.424 2.987 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000451984736 514110451 /nfs/dbraw/zinc/11/04/51/514110451.db2.gz VZLMQGBGVMBCEB-QGZVFWFLSA-N 1 1 365.455 2.761 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000451984736 514110462 /nfs/dbraw/zinc/11/04/62/514110462.db2.gz VZLMQGBGVMBCEB-QGZVFWFLSA-N 1 1 365.455 2.761 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601935 514196792 /nfs/dbraw/zinc/19/67/92/514196792.db2.gz AKIBCHRISHFJPG-CZUORRHYSA-N 1 1 354.410 2.626 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)[N@@H+]1CCO ZINC000449540789 514246984 /nfs/dbraw/zinc/24/69/84/514246984.db2.gz YIKIQTABZHHADH-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)N1CCO ZINC000449540789 514246993 /nfs/dbraw/zinc/24/69/93/514246993.db2.gz YIKIQTABZHHADH-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)N1CCO ZINC000449540789 514247000 /nfs/dbraw/zinc/24/70/00/514247000.db2.gz YIKIQTABZHHADH-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO CO[C@@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000449569486 514257355 /nfs/dbraw/zinc/25/73/55/514257355.db2.gz BYKHVHYZOWUWTJ-SJLPKXTDSA-N 1 1 362.357 2.718 20 5 FFBDMO CO[C@@H]1C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000449569486 514257365 /nfs/dbraw/zinc/25/73/65/514257365.db2.gz BYKHVHYZOWUWTJ-SJLPKXTDSA-N 1 1 362.357 2.718 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000437873586 514257550 /nfs/dbraw/zinc/25/75/50/514257550.db2.gz IRVZBNKTYQKBLG-AWEZNQCLSA-N 1 1 363.462 2.797 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000438022929 514290031 /nfs/dbraw/zinc/29/00/31/514290031.db2.gz ZCODOCYHLWJOGL-WMZOPIPTSA-N 1 1 358.442 2.896 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000420831237 514326422 /nfs/dbraw/zinc/32/64/22/514326422.db2.gz YXEQNLISXNHKMM-CQSZACIVSA-N 1 1 354.838 2.526 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C ZINC000444896556 514363545 /nfs/dbraw/zinc/36/35/45/514363545.db2.gz MMDNJTKMWZUHCW-STQMWFEESA-N 1 1 350.419 2.940 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000424110714 514385200 /nfs/dbraw/zinc/38/52/00/514385200.db2.gz ZLVYOIPACWIGHJ-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2C[C@]2(F)c2ccccc2)cc1[N+](=O)[O-] ZINC000424187283 514409889 /nfs/dbraw/zinc/40/98/89/514409889.db2.gz AQJGNEYCJVOVQA-MJGOQNOKSA-N 1 1 374.368 2.874 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000428489112 514483953 /nfs/dbraw/zinc/48/39/53/514483953.db2.gz WJEVSIWTMMXQBD-HSBHDXMMSA-N 1 1 357.332 2.608 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)c1 ZINC000428531929 514489926 /nfs/dbraw/zinc/48/99/26/514489926.db2.gz AXJLRSCBVGQFQT-MRXNPFEDSA-N 1 1 355.394 2.722 20 5 FFBDMO C[NH+](C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1cccc(F)c1 ZINC000439129516 514498043 /nfs/dbraw/zinc/49/80/43/514498043.db2.gz IKBSZMXUVAODAS-MRXNPFEDSA-N 1 1 371.372 2.519 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000439474914 514560685 /nfs/dbraw/zinc/56/06/85/514560685.db2.gz XVLOCNLZUAEBPU-KDOFPFPSSA-N 1 1 350.415 2.948 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000470675938 514568977 /nfs/dbraw/zinc/56/89/77/514568977.db2.gz VVPICTIVNRTSAV-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ncc(C(F)(F)F)cn2)n1 ZINC000453310376 514596280 /nfs/dbraw/zinc/59/62/80/514596280.db2.gz PXHHELFFFJXKAY-VXGBXAGGSA-N 1 1 370.335 2.874 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000479472497 514596790 /nfs/dbraw/zinc/59/67/90/514596790.db2.gz IFWGGFXNXWTGLM-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO CCc1ccc([C@H]([NH2+]CCN2CCC(O)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453387647 514618010 /nfs/dbraw/zinc/61/80/10/514618010.db2.gz WMPUKUAMWFUVKT-HXUWFJFHSA-N 1 1 373.453 2.886 20 5 FFBDMO CCc1ccc([C@H](NCC[NH+]2CCC(O)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453387647 514618018 /nfs/dbraw/zinc/61/80/18/514618018.db2.gz WMPUKUAMWFUVKT-HXUWFJFHSA-N 1 1 373.453 2.886 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)[C@H]1CC[N@H+](C(C)C)C1 ZINC000453473001 514662659 /nfs/dbraw/zinc/66/26/59/514662659.db2.gz WLTYJENMWVKQIO-INIZCTEOSA-N 1 1 358.446 2.792 20 5 FFBDMO C[C@H](C(=O)c1c[nH]c2ncccc12)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000489004465 514670262 /nfs/dbraw/zinc/67/02/62/514670262.db2.gz DHFXOOJIEKKUFP-GFCCVEGCSA-N 1 1 368.397 2.576 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000489155898 514732352 /nfs/dbraw/zinc/73/23/52/514732352.db2.gz SFBHYTQLJCWRKH-UHFFFAOYSA-N 1 1 371.437 2.930 20 5 FFBDMO CC[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCc2ccccc2C1 ZINC000498038085 514732946 /nfs/dbraw/zinc/73/29/46/514732946.db2.gz JKNYNFLUWVKWQL-MRXNPFEDSA-N 1 1 356.426 2.500 20 5 FFBDMO COc1cccc(N2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2=O)c1 ZINC000480050771 514824941 /nfs/dbraw/zinc/82/49/41/514824941.db2.gz ZDPKFEUPGLJQQN-CYBMUJFWSA-N 1 1 359.357 2.638 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000466923249 514829715 /nfs/dbraw/zinc/82/97/15/514829715.db2.gz JFNHNDHENWGVBG-KBXCAEBGSA-N 1 1 360.458 2.998 20 5 FFBDMO Nc1c(F)c(NCc2ccc(C[NH+]3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC000476100464 514917071 /nfs/dbraw/zinc/91/70/71/514917071.db2.gz QHFGLFUTQGXPJG-UHFFFAOYSA-N 1 1 360.389 2.760 20 5 FFBDMO CN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000498496439 514931911 /nfs/dbraw/zinc/93/19/11/514931911.db2.gz RMUOKPKWOJXXDJ-HNNXBMFYSA-N 1 1 366.849 2.669 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000471576293 514936788 /nfs/dbraw/zinc/93/67/88/514936788.db2.gz BAXBGMGKNYPVKL-UOIKSKOESA-N 1 1 356.426 2.809 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000485348542 515004872 /nfs/dbraw/zinc/00/48/72/515004872.db2.gz LPGCGDDFLAVHEF-OLZOCXBDSA-N 1 1 367.471 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)nc1-c1ccc(F)cc1 ZINC000485417424 515033594 /nfs/dbraw/zinc/03/35/94/515033594.db2.gz MQXNOTWDOJIXKN-CQSZACIVSA-N 1 1 353.357 2.841 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000462481510 515075507 /nfs/dbraw/zinc/07/55/07/515075507.db2.gz ASAQLWNEUWVSHD-INIZCTEOSA-N 1 1 356.426 2.885 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000503702941 515125082 /nfs/dbraw/zinc/12/50/82/515125082.db2.gz RSFSGNRUTIFDBE-GDBMZVCRSA-N 1 1 360.385 2.963 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c1 ZINC000485878587 515230891 /nfs/dbraw/zinc/23/08/91/515230891.db2.gz YBLSXIIAQALGEU-WTGUMLROSA-N 1 1 370.453 2.810 20 5 FFBDMO CC(C)OCCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000481203955 515246170 /nfs/dbraw/zinc/24/61/70/515246170.db2.gz MESWXRDPINEXBU-UHFFFAOYSA-N 1 1 361.446 2.798 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](c2ccccc2OC)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000462904512 515292027 /nfs/dbraw/zinc/29/20/27/515292027.db2.gz GJCHEXQKSCYCPA-INIZCTEOSA-N 1 1 372.425 2.678 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H](O)C[NH+]1CCCC1 ZINC000504896550 515404019 /nfs/dbraw/zinc/40/40/19/515404019.db2.gz YMRWMTRLLPOJOR-LSDHHAIUSA-N 1 1 353.488 2.512 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCC1 ZINC000504896550 515404030 /nfs/dbraw/zinc/40/40/30/515404030.db2.gz YMRWMTRLLPOJOR-LSDHHAIUSA-N 1 1 353.488 2.512 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000491351796 515416770 /nfs/dbraw/zinc/41/67/70/515416770.db2.gz ZULCXJUNBPDJMT-HXUWFJFHSA-N 1 1 370.453 2.680 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481714294 515435198 /nfs/dbraw/zinc/43/51/98/515435198.db2.gz NQZGTSPIJBFFKK-IAGOWNOFSA-N 1 1 369.421 2.821 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736175 515447274 /nfs/dbraw/zinc/44/72/74/515447274.db2.gz MYFBBDAKYXLZOL-JKSUJKDBSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736175 515447285 /nfs/dbraw/zinc/44/72/85/515447285.db2.gz MYFBBDAKYXLZOL-JKSUJKDBSA-N 1 1 366.414 2.536 20 5 FFBDMO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468702398 515478223 /nfs/dbraw/zinc/47/82/23/515478223.db2.gz ARPKIUZQFUVYOA-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468702396 515478862 /nfs/dbraw/zinc/47/88/62/515478862.db2.gz ARPKIUZQFUVYOA-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468702396 515478869 /nfs/dbraw/zinc/47/88/69/515478869.db2.gz ARPKIUZQFUVYOA-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000463426786 515491642 /nfs/dbraw/zinc/49/16/42/515491642.db2.gz QIQJZROMALORFV-MRXNPFEDSA-N 1 1 370.405 2.588 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000473167952 515524495 /nfs/dbraw/zinc/52/44/95/515524495.db2.gz HKFWJINZNGJLIC-GFCCVEGCSA-N 1 1 355.803 2.571 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000505505046 515562686 /nfs/dbraw/zinc/56/26/86/515562686.db2.gz HQTVMZWIXXVTOT-LJQANCHMSA-N 1 1 353.422 2.873 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500068216 515577794 /nfs/dbraw/zinc/57/77/94/515577794.db2.gz AHRZNYGSUFRLCZ-HNNXBMFYSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500068216 515577804 /nfs/dbraw/zinc/57/78/04/515577804.db2.gz AHRZNYGSUFRLCZ-HNNXBMFYSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1ccccc1OCCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000459495684 515593821 /nfs/dbraw/zinc/59/38/21/515593821.db2.gz MLTMDPXCQIKTLI-UHFFFAOYSA-N 1 1 356.426 2.889 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000505635133 515618719 /nfs/dbraw/zinc/61/87/19/515618719.db2.gz OBTPVCJBUAQMQJ-QGZVFWFLSA-N 1 1 369.368 2.754 20 5 FFBDMO CN(C)c1cc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc[nH+]1 ZINC000500416921 515700761 /nfs/dbraw/zinc/70/07/61/515700761.db2.gz SYXBEQDOCZXJIJ-UHFFFAOYSA-N 1 1 366.381 2.709 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494070188 515726349 /nfs/dbraw/zinc/72/63/49/515726349.db2.gz VOEDGIWECGYNNV-KXBFYZLASA-N 1 1 353.422 2.917 20 5 FFBDMO C[N@H+](Cc1cccc2[nH]ccc21)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000494104635 515734245 /nfs/dbraw/zinc/73/42/45/515734245.db2.gz DXNAGXKBYCWCBK-MRXNPFEDSA-N 1 1 355.394 2.948 20 5 FFBDMO C[C@H](C(=O)NCCc1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071803 515767434 /nfs/dbraw/zinc/76/74/34/515767434.db2.gz IBCGKOYFQGIUHL-MRXNPFEDSA-N 1 1 355.438 2.817 20 5 FFBDMO C[C@H](C(=O)NCCc1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511071803 515767442 /nfs/dbraw/zinc/76/74/42/515767442.db2.gz IBCGKOYFQGIUHL-MRXNPFEDSA-N 1 1 355.438 2.817 20 5 FFBDMO CCCC[C@@H](C(=O)Nc1cc(C)on1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122167 515791409 /nfs/dbraw/zinc/79/14/09/515791409.db2.gz HUSZJLYMFBDNCP-KRWDZBQOSA-N 1 1 374.441 2.985 20 5 FFBDMO CCCC[C@@H](C(=O)Nc1cc(C)on1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122167 515791419 /nfs/dbraw/zinc/79/14/19/515791419.db2.gz HUSZJLYMFBDNCP-KRWDZBQOSA-N 1 1 374.441 2.985 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000487819717 515991100 /nfs/dbraw/zinc/99/11/00/515991100.db2.gz QCAGYOWAQVDGCG-RISCZKNCSA-N 1 1 366.849 2.715 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000487948455 516045874 /nfs/dbraw/zinc/04/58/74/516045874.db2.gz DLRNHBAWPQCVHH-CQSZACIVSA-N 1 1 373.400 2.977 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCC[C@@H]1C ZINC000488075549 516107692 /nfs/dbraw/zinc/10/76/92/516107692.db2.gz ORWNDZLMNVGGEE-WMLDXEAASA-N 1 1 361.442 2.621 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000470114483 516125508 /nfs/dbraw/zinc/12/55/08/516125508.db2.gz LESBSXBXWCTOAS-VXGBXAGGSA-N 1 1 368.409 2.743 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131419 516134604 /nfs/dbraw/zinc/13/46/04/516134604.db2.gz GMQKFBJZWNDWAU-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131419 516134611 /nfs/dbraw/zinc/13/46/11/516134611.db2.gz GMQKFBJZWNDWAU-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131419 516134621 /nfs/dbraw/zinc/13/46/21/516134621.db2.gz GMQKFBJZWNDWAU-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO CCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000470176076 516162328 /nfs/dbraw/zinc/16/23/28/516162328.db2.gz UJTDVWRUPZGNQE-IDKBZEPQSA-N 1 1 352.456 2.897 20 5 FFBDMO CCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000470176076 516162333 /nfs/dbraw/zinc/16/23/33/516162333.db2.gz UJTDVWRUPZGNQE-IDKBZEPQSA-N 1 1 352.456 2.897 20 5 FFBDMO CCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000470176081 516162561 /nfs/dbraw/zinc/16/25/61/516162561.db2.gz UJTDVWRUPZGNQE-SHRNQRGKSA-N 1 1 352.456 2.897 20 5 FFBDMO CCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1 ZINC000470176081 516162570 /nfs/dbraw/zinc/16/25/70/516162570.db2.gz UJTDVWRUPZGNQE-SHRNQRGKSA-N 1 1 352.456 2.897 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000512165850 516180096 /nfs/dbraw/zinc/18/00/96/516180096.db2.gz REUCWANGEYQTGB-LBPRGKRZSA-N 1 1 359.213 2.848 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000470237255 516180981 /nfs/dbraw/zinc/18/09/81/516180981.db2.gz MBGSEIXGSWTCRP-MRXNPFEDSA-N 1 1 361.442 2.554 20 5 FFBDMO CNC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000474786227 516195374 /nfs/dbraw/zinc/19/53/74/516195374.db2.gz QNJHPJAKTRQTAR-KRWDZBQOSA-N 1 1 368.437 2.665 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000488715894 516293265 /nfs/dbraw/zinc/29/32/65/516293265.db2.gz BRBPHCLHAMHVMF-HEHGZKQESA-N 1 1 357.414 2.811 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000488748218 516299927 /nfs/dbraw/zinc/29/99/27/516299927.db2.gz KAQGBVBDNNWCTE-DVOMOZLQSA-N 1 1 361.442 2.856 20 5 FFBDMO Cc1n[nH]c(C(=O)NCC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000512570890 516307558 /nfs/dbraw/zinc/30/75/58/516307558.db2.gz WQMZFVWBSZUBJN-CZUORRHYSA-N 1 1 371.441 2.657 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000523532477 516498733 /nfs/dbraw/zinc/49/87/33/516498733.db2.gz NYITXQWEYIYDDY-NSHDSACASA-N 1 1 370.247 2.817 20 5 FFBDMO COc1cc(C[NH+]2CCC3(CCO3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000554564175 516511830 /nfs/dbraw/zinc/51/18/30/516511830.db2.gz HIUYVPLZPHPBHB-UHFFFAOYSA-N 1 1 358.341 2.960 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000558025802 516555359 /nfs/dbraw/zinc/55/53/59/516555359.db2.gz PJABPCLXYPXXEH-UXLLHSPISA-N 1 1 361.442 2.552 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120676 516598332 /nfs/dbraw/zinc/59/83/32/516598332.db2.gz VYMCLPVTPJTHKJ-RHSMWYFYSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120676 516598338 /nfs/dbraw/zinc/59/83/38/516598338.db2.gz VYMCLPVTPJTHKJ-RHSMWYFYSA-N 1 1 352.456 2.881 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000536193840 516670863 /nfs/dbraw/zinc/67/08/63/516670863.db2.gz ULNOVEBZFLGNOY-RTBURBONSA-N 1 1 368.437 2.882 20 5 FFBDMO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760308 516762350 /nfs/dbraw/zinc/76/23/50/516762350.db2.gz RPIFADDBMHLFRI-CRAIPNDOSA-N 1 1 373.457 2.952 20 5 FFBDMO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760308 516762358 /nfs/dbraw/zinc/76/23/58/516762358.db2.gz RPIFADDBMHLFRI-CRAIPNDOSA-N 1 1 373.457 2.952 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000558479741 516766780 /nfs/dbraw/zinc/76/67/80/516766780.db2.gz QTOCFGDPKKUOJC-CYBMUJFWSA-N 1 1 357.476 2.610 20 5 FFBDMO COc1cc(C[N@@H+](C)C2CCOCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000540914222 516770321 /nfs/dbraw/zinc/77/03/21/516770321.db2.gz LSAUOBQAXMYFQX-UHFFFAOYSA-N 1 1 360.357 2.858 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000524721347 516803414 /nfs/dbraw/zinc/80/34/14/516803414.db2.gz QPSOOTMGPGGGCO-JKSUJKDBSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@H+]([C@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000540977321 516812885 /nfs/dbraw/zinc/81/28/85/516812885.db2.gz HQKVGPVGTWTIJX-AZOIQLNYSA-N 1 1 357.410 2.739 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000541035871 516839909 /nfs/dbraw/zinc/83/99/09/516839909.db2.gz GOKPNXKBKJJDBF-YPMHNXCESA-N 1 1 371.384 2.999 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000532169963 516840243 /nfs/dbraw/zinc/84/02/43/516840243.db2.gz YZQACRUNJQWGCD-DOTOQJQBSA-N 1 1 362.430 2.668 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000524881121 516859415 /nfs/dbraw/zinc/85/94/15/516859415.db2.gz UTVCOVPJZIOBRY-RHSMWYFYSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000541205530 516927949 /nfs/dbraw/zinc/92/79/49/516927949.db2.gz FMDYUHVWUYFUPI-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCC[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000525193895 516954240 /nfs/dbraw/zinc/95/42/40/516954240.db2.gz UYLORYRKYPDGRY-UHFFFAOYSA-N 1 1 356.426 2.838 20 5 FFBDMO Cc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000532424057 516970022 /nfs/dbraw/zinc/97/00/22/516970022.db2.gz NLRMJRFAOLNMCN-CVEARBPZSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(C[NH+](C)C)CC1 ZINC000532476978 516995018 /nfs/dbraw/zinc/99/50/18/516995018.db2.gz XEBUBBSOKXOBRF-CYBMUJFWSA-N 1 1 359.430 2.979 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@H+]1CCCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000514747417 517036323 /nfs/dbraw/zinc/03/63/23/517036323.db2.gz TVIJXDOCSIYOFS-NSHDSACASA-N 1 1 361.229 2.653 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)C[C@H](C)O ZINC000532587592 517049004 /nfs/dbraw/zinc/04/90/04/517049004.db2.gz XKIAMROTIKCBDV-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C[C@H](C)O ZINC000532587592 517049016 /nfs/dbraw/zinc/04/90/16/517049016.db2.gz XKIAMROTIKCBDV-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000541524588 517093309 /nfs/dbraw/zinc/09/33/09/517093309.db2.gz LIFUVTFXNYJVNS-UHFFFAOYSA-N 1 1 364.446 2.667 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970508 517228189 /nfs/dbraw/zinc/22/81/89/517228189.db2.gz OBGQSELNUJHOEK-SJORKVTESA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000532970508 517228193 /nfs/dbraw/zinc/22/81/93/517228193.db2.gz OBGQSELNUJHOEK-SJORKVTESA-N 1 1 361.442 2.619 20 5 FFBDMO COc1ccc(CC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000532991012 517241365 /nfs/dbraw/zinc/24/13/65/517241365.db2.gz CVSQWZHDWXAWST-WBVHZDCISA-N 1 1 373.453 2.621 20 5 FFBDMO Cc1c(CC(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cccc1[N+](=O)[O-] ZINC000552518252 517293255 /nfs/dbraw/zinc/29/32/55/517293255.db2.gz XRFYAHLLARCDMM-GOSISDBHSA-N 1 1 369.421 2.651 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)n1 ZINC000541935032 517299325 /nfs/dbraw/zinc/29/93/25/517299325.db2.gz HKEODWNFEOMPIZ-ZWKOTPCHSA-N 1 1 370.453 2.902 20 5 FFBDMO CN(CC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000533282250 517381556 /nfs/dbraw/zinc/38/15/56/517381556.db2.gz DONLVXAUXNDEMV-UHFFFAOYSA-N 1 1 356.426 2.992 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000552803431 517397957 /nfs/dbraw/zinc/39/79/57/517397957.db2.gz GEBHNSRBECHOTP-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000552803431 517397963 /nfs/dbraw/zinc/39/79/63/517397963.db2.gz GEBHNSRBECHOTP-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO CCC[C@@H]1CN(c2cccc(OCC)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000545872691 517407387 /nfs/dbraw/zinc/40/73/87/517407387.db2.gz OWOSVVCHFWEUHG-OAHLLOKOSA-N 1 1 351.447 2.931 20 5 FFBDMO Cc1nc2ccccn2c(=O)c1CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000559778407 517423841 /nfs/dbraw/zinc/42/38/41/517423841.db2.gz RNDPVXXNHPNLJK-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc2nsnc21 ZINC000549170417 517435019 /nfs/dbraw/zinc/43/50/19/517435019.db2.gz HTCWWHCUSZNILD-UHFFFAOYSA-N 1 1 371.422 2.713 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccc2nsnc21 ZINC000549170417 517435022 /nfs/dbraw/zinc/43/50/22/517435022.db2.gz HTCWWHCUSZNILD-UHFFFAOYSA-N 1 1 371.422 2.713 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CCc1ccccc1O ZINC000542320985 517504432 /nfs/dbraw/zinc/50/44/32/517504432.db2.gz UWSWSQJNQGPZMK-UHFFFAOYSA-N 1 1 371.393 2.773 20 5 FFBDMO O=C(NC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1)c1ccc(F)cc1 ZINC000549342677 517520210 /nfs/dbraw/zinc/52/02/10/517520210.db2.gz QSYUHMCOHRZAGS-UHFFFAOYSA-N 1 1 373.384 2.834 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000520975356 517565552 /nfs/dbraw/zinc/56/55/52/517565552.db2.gz RYRWOCMEBHRTCE-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO Cc1cc(N[C@H](C)C[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549488612 517586576 /nfs/dbraw/zinc/58/65/76/517586576.db2.gz AHGFDDGQTYARRY-GFCCVEGCSA-N 1 1 360.380 2.970 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000553317217 517641019 /nfs/dbraw/zinc/64/10/19/517641019.db2.gz PZSZXHVAFVJYES-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000553317217 517641027 /nfs/dbraw/zinc/64/10/27/517641027.db2.gz PZSZXHVAFVJYES-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)s1 ZINC000553482554 517739516 /nfs/dbraw/zinc/73/95/16/517739516.db2.gz GTEKNXXCCHYLSZ-QWHCGFSZSA-N 1 1 363.443 2.655 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000542852639 517783015 /nfs/dbraw/zinc/78/30/15/517783015.db2.gz OBYWXDDGLPDZIY-KOLCDFICSA-N 1 1 355.341 2.551 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1 ZINC000557025567 517811163 /nfs/dbraw/zinc/81/11/63/517811163.db2.gz QEFXOKMEBYVMOB-IBGZPJMESA-N 1 1 369.421 2.733 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2COc3ccc(C)cc32)cc1[N+](=O)[O-] ZINC000530547282 517844113 /nfs/dbraw/zinc/84/41/13/517844113.db2.gz FSTAZOZKTSRSPF-HNNXBMFYSA-N 1 1 372.377 2.678 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000538920915 517846023 /nfs/dbraw/zinc/84/60/23/517846023.db2.gz ZPBUZUKKNPTTHY-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000538920915 517846031 /nfs/dbraw/zinc/84/60/31/517846031.db2.gz ZPBUZUKKNPTTHY-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000553783339 517901371 /nfs/dbraw/zinc/90/13/71/517901371.db2.gz OZMWPIGUTHHVIB-NJSLBKSFSA-N 1 1 370.453 2.807 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1 ZINC000553812828 517918117 /nfs/dbraw/zinc/91/81/17/517918117.db2.gz AKTOAQGFNKMENA-CVEARBPZSA-N 1 1 363.458 2.909 20 5 FFBDMO CC[N@@H+](CCc1cccs1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543131971 517923506 /nfs/dbraw/zinc/92/35/06/517923506.db2.gz IJZAQXCSVYPLSI-AWEZNQCLSA-N 1 1 350.440 2.961 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543136559 517926756 /nfs/dbraw/zinc/92/67/56/517926756.db2.gz HNVZZXQKYIOJIL-PTSWNOGYSA-N 1 1 372.421 2.659 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000563544003 517973170 /nfs/dbraw/zinc/97/31/70/517973170.db2.gz YITITXJUKTWCFH-KRWDZBQOSA-N 1 1 370.453 2.950 20 5 FFBDMO Cn1c(C(=O)N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)ccc1[N+](=O)[O-] ZINC000560768730 518015718 /nfs/dbraw/zinc/01/57/18/518015718.db2.gz MACZYZKRFKYZBS-HXUWFJFHSA-N 1 1 368.437 2.672 20 5 FFBDMO Cc1ccc(NCCCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)[nH+]c1 ZINC000547268556 518044846 /nfs/dbraw/zinc/04/48/46/518044846.db2.gz NBMQENKQGDJKPY-UHFFFAOYSA-N 1 1 374.416 2.755 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000539502770 518079789 /nfs/dbraw/zinc/07/97/89/518079789.db2.gz VYMOUFKAFWQTIQ-HZPDHXFCSA-N 1 1 363.458 2.909 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042402 518134610 /nfs/dbraw/zinc/13/46/10/518134610.db2.gz GJSXODSGSCKGIR-HUUCEWRRSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042402 518134612 /nfs/dbraw/zinc/13/46/12/518134612.db2.gz GJSXODSGSCKGIR-HUUCEWRRSA-N 1 1 356.426 2.668 20 5 FFBDMO Cc1ccc(-c2n[nH]cc2C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)o1 ZINC000535072197 518146208 /nfs/dbraw/zinc/14/62/08/518146208.db2.gz FNINFCZMKYACFY-UHFFFAOYSA-N 1 1 368.397 2.604 20 5 FFBDMO O=C(NC1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000567371401 518490440 /nfs/dbraw/zinc/49/04/40/518490440.db2.gz WZMQWGVULCHBGQ-UHFFFAOYSA-N 1 1 355.394 2.695 20 5 FFBDMO C[C@H](C(=O)N[C@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000573158583 518531700 /nfs/dbraw/zinc/53/17/00/518531700.db2.gz DTYWGWKNYPLSDT-JVPBZIDWSA-N 1 1 353.422 2.912 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1 ZINC000585718544 518574416 /nfs/dbraw/zinc/57/44/16/518574416.db2.gz KUTUSPJIHIWYPO-FQEVSTJZSA-N 1 1 356.422 2.791 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)[C@H]2C1 ZINC000585783610 518596157 /nfs/dbraw/zinc/59/61/57/518596157.db2.gz KQEBSEGZCLRTHT-IRXDYDNUSA-N 1 1 372.400 2.705 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000564754287 518597890 /nfs/dbraw/zinc/59/78/90/518597890.db2.gz KKADDFZGFWDQTE-JTDSTZFVSA-N 1 1 374.485 2.895 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000579300749 518612763 /nfs/dbraw/zinc/61/27/63/518612763.db2.gz XZOOCDVGTQKKIU-INIZCTEOSA-N 1 1 364.490 2.959 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000579394919 518659380 /nfs/dbraw/zinc/65/93/80/518659380.db2.gz YFXMRVDEUGJASW-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000579394919 518659386 /nfs/dbraw/zinc/65/93/86/518659386.db2.gz YFXMRVDEUGJASW-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000587991278 518693791 /nfs/dbraw/zinc/69/37/91/518693791.db2.gz RHUCGQYJLFOJDC-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000576957811 518847408 /nfs/dbraw/zinc/84/74/08/518847408.db2.gz SWCNXSNQQLGBST-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1 ZINC000576957811 518847413 /nfs/dbraw/zinc/84/74/13/518847413.db2.gz SWCNXSNQQLGBST-KRWDZBQOSA-N 1 1 363.458 2.680 20 5 FFBDMO CC(C)c1ccc(C(=O)N(C)CCC[N@@H+](C)CCN(C)C)cc1[N+](=O)[O-] ZINC000565388278 518929176 /nfs/dbraw/zinc/92/91/76/518929176.db2.gz ZUWILRXKRNUJRV-UHFFFAOYSA-N 1 1 364.490 2.674 20 5 FFBDMO CC(C)c1ccc(C(=O)N(C)CCCN(C)CC[NH+](C)C)cc1[N+](=O)[O-] ZINC000565388278 518929180 /nfs/dbraw/zinc/92/91/80/518929180.db2.gz ZUWILRXKRNUJRV-UHFFFAOYSA-N 1 1 364.490 2.674 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000582807919 518932256 /nfs/dbraw/zinc/93/22/56/518932256.db2.gz MGJINXAHSZODNP-ZBEGNZNMSA-N 1 1 355.385 2.604 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(NS(C)(=O)=O)c1 ZINC000589183886 518944969 /nfs/dbraw/zinc/94/49/69/518944969.db2.gz VKCGNPKDMXDBIF-UHFFFAOYSA-N 1 1 363.439 2.641 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+](C(C)C)C1 ZINC000571385218 519069352 /nfs/dbraw/zinc/06/93/52/519069352.db2.gz HYHJBOHAUZGFPM-ZDUSSCGKSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680773 519198883 /nfs/dbraw/zinc/19/88/83/519198883.db2.gz SVNIBFLAHZULNZ-MAUKXSAKSA-N 1 1 358.398 2.689 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@@H](c1noc(CCc3cccc([N+](=O)[O-])c3)n1)OC2 ZINC000577680773 519198890 /nfs/dbraw/zinc/19/88/90/519198890.db2.gz SVNIBFLAHZULNZ-MAUKXSAKSA-N 1 1 358.398 2.689 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000590456710 519238358 /nfs/dbraw/zinc/23/83/58/519238358.db2.gz GLTOGPWGMNMRGS-HDMKZQKVSA-N 1 1 360.458 2.586 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862263 519255851 /nfs/dbraw/zinc/25/58/51/519255851.db2.gz JASLCQHYTUTCAX-QAPCUYQASA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000568862263 519255860 /nfs/dbraw/zinc/25/58/60/519255860.db2.gz JASLCQHYTUTCAX-QAPCUYQASA-N 1 1 352.394 2.585 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590599090 519283677 /nfs/dbraw/zinc/28/36/77/519283677.db2.gz AAJCNIQSDXBRAU-HZPDHXFCSA-N 1 1 357.410 2.609 20 5 FFBDMO CC(C)[N@H+](C)C[C@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000568939556 519292153 /nfs/dbraw/zinc/29/21/53/519292153.db2.gz MAKLFGNFGBJDBX-ZDUSSCGKSA-N 1 1 359.430 2.700 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000574725597 519301870 /nfs/dbraw/zinc/30/18/70/519301870.db2.gz GTQFKJZYHVDINF-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000574725597 519301878 /nfs/dbraw/zinc/30/18/78/519301878.db2.gz GTQFKJZYHVDINF-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1 ZINC000590656887 519304776 /nfs/dbraw/zinc/30/47/76/519304776.db2.gz FSEXDIZUDBNOHP-JQHSSLGASA-N 1 1 362.426 2.897 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc([NH2+]CC3CCCC3)cc2)c1 ZINC000571910465 519342244 /nfs/dbraw/zinc/34/22/44/519342244.db2.gz ZBEWGGGTTYHXNW-GOSISDBHSA-N 1 1 359.430 2.866 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1ccc(C)cn1 ZINC000590754408 519351407 /nfs/dbraw/zinc/35/14/07/519351407.db2.gz FVUMULVKTVIBBF-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213713 519371756 /nfs/dbraw/zinc/37/17/56/519371756.db2.gz BZBIQCMSNKNVSG-FZMZJTMJSA-N 1 1 364.427 2.770 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213713 519371766 /nfs/dbraw/zinc/37/17/66/519371766.db2.gz BZBIQCMSNKNVSG-FZMZJTMJSA-N 1 1 364.427 2.770 20 5 FFBDMO C[C@H](SC[C@H]1C[N@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213715 519371825 /nfs/dbraw/zinc/37/18/25/519371825.db2.gz BZBIQCMSNKNVSG-SMDDNHRTSA-N 1 1 364.427 2.770 20 5 FFBDMO C[C@H](SC[C@H]1C[N@@H+](C)CCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000566213715 519371831 /nfs/dbraw/zinc/37/18/31/519371831.db2.gz BZBIQCMSNKNVSG-SMDDNHRTSA-N 1 1 364.427 2.770 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590926383 519437779 /nfs/dbraw/zinc/43/77/79/519437779.db2.gz OGIPBPXYRCMRHV-SJLPKXTDSA-N 1 1 360.458 2.968 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000569582707 519620359 /nfs/dbraw/zinc/62/03/59/519620359.db2.gz ZFAWMKNTLHHLNO-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO C[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C(C)(C)C ZINC000602874175 519941683 /nfs/dbraw/zinc/94/16/83/519941683.db2.gz OWWOYYNVLXZICZ-OAHLLOKOSA-N 1 1 359.430 2.807 20 5 FFBDMO CCn1nc(C)c(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000602924068 519974019 /nfs/dbraw/zinc/97/40/19/519974019.db2.gz BLYRTPFATWPYER-UHFFFAOYSA-N 1 1 359.430 2.889 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000600087952 520038824 /nfs/dbraw/zinc/03/88/24/520038824.db2.gz PEWMARWZNDQMRQ-JTQLQIEISA-N 1 1 370.247 2.960 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597576361 520113439 /nfs/dbraw/zinc/11/34/39/520113439.db2.gz BSDWHQLVJNLGHM-BPQIPLTHSA-N 1 1 363.433 2.808 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC000608963384 520169108 /nfs/dbraw/zinc/16/91/08/520169108.db2.gz CAKFFHNYGSHIJF-UHFFFAOYSA-N 1 1 370.453 2.918 20 5 FFBDMO C[C@H](CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000594817901 520171601 /nfs/dbraw/zinc/17/16/01/520171601.db2.gz VKIGLCVLGGSEGF-MRVPVSSYSA-N 1 1 370.258 2.520 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C2 ZINC000597715538 520193485 /nfs/dbraw/zinc/19/34/85/520193485.db2.gz LSYVMCDNOBWZDZ-IBGZPJMESA-N 1 1 360.458 2.731 20 5 FFBDMO CC(C)NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130368 520205014 /nfs/dbraw/zinc/20/50/14/520205014.db2.gz FOGBQULZCXOBFG-QAQDUYKDSA-N 1 1 363.458 2.615 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155529 520232124 /nfs/dbraw/zinc/23/21/24/520232124.db2.gz OFPBNIIRDSPVEK-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600470114 520278322 /nfs/dbraw/zinc/27/83/22/520278322.db2.gz FWDZYYFLWVVQFO-HNNXBMFYSA-N 1 1 351.834 2.924 20 5 FFBDMO CCOc1cc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])cc1OC ZINC000597859020 520287216 /nfs/dbraw/zinc/28/72/16/520287216.db2.gz QAQXLZDICNFYBI-LBPRGKRZSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000597860967 520288794 /nfs/dbraw/zinc/28/87/94/520288794.db2.gz QMCVPEPNWTVAEC-CYBMUJFWSA-N 1 1 371.441 2.835 20 5 FFBDMO CCc1cc(N[C@H]2CC[N@@H+](CC3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000609384287 520300379 /nfs/dbraw/zinc/30/03/79/520300379.db2.gz FACDWBIEFFUHTI-KRWDZBQOSA-N 1 1 367.453 2.932 20 5 FFBDMO CCOc1cc(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000597922969 520324035 /nfs/dbraw/zinc/32/40/35/520324035.db2.gz HQWAZXQGLGSCCD-LBPRGKRZSA-N 1 1 365.430 2.605 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000609489454 520330700 /nfs/dbraw/zinc/33/07/00/520330700.db2.gz NWFSIEQLNBMCGE-OAHLLOKOSA-N 1 1 363.458 2.990 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000609522540 520342618 /nfs/dbraw/zinc/34/26/18/520342618.db2.gz XWTGUOLRQNFQRN-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@@H+](CC)C1 ZINC000598038254 520387421 /nfs/dbraw/zinc/38/74/21/520387421.db2.gz BOJCAYBNGNGQOW-GFCCVEGCSA-N 1 1 370.247 2.914 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[C@H]1CC[N@@H+](CC)C1 ZINC000598039080 520389559 /nfs/dbraw/zinc/38/95/59/520389559.db2.gz IHSCCKLZEXCTMQ-HNNXBMFYSA-N 1 1 357.414 2.541 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)[C@H]1CC[N@H+](CC)C1 ZINC000598039080 520389565 /nfs/dbraw/zinc/38/95/65/520389565.db2.gz IHSCCKLZEXCTMQ-HNNXBMFYSA-N 1 1 357.414 2.541 20 5 FFBDMO CCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)[C@H]1CC[N@@H+](CC)C1 ZINC000598039080 520389571 /nfs/dbraw/zinc/38/95/71/520389571.db2.gz IHSCCKLZEXCTMQ-HNNXBMFYSA-N 1 1 357.414 2.541 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000609664481 520399558 /nfs/dbraw/zinc/39/95/58/520399558.db2.gz JJOQGSMHQCKCTC-MRXNPFEDSA-N 1 1 374.485 2.611 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CCC(C[N@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000609674649 520402678 /nfs/dbraw/zinc/40/26/78/520402678.db2.gz IPZSSSKCDHSNIQ-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592494027 520416089 /nfs/dbraw/zinc/41/60/89/520416089.db2.gz ZMKSBISBKOTHSI-HZPDHXFCSA-N 1 1 360.458 2.553 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492967 520416391 /nfs/dbraw/zinc/41/63/91/520416391.db2.gz JVAUFIOWCXKHLM-CVEARBPZSA-N 1 1 360.458 2.553 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000603982293 520423147 /nfs/dbraw/zinc/42/31/47/520423147.db2.gz DPDOQVNAFRKDST-OKILXGFUSA-N 1 1 369.487 2.550 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000595411774 520453049 /nfs/dbraw/zinc/45/30/49/520453049.db2.gz UEMRXFALVANTLY-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO CO[C@@H](C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)C1CCC1 ZINC000595434170 520468489 /nfs/dbraw/zinc/46/84/89/520468489.db2.gz YYIJFSQWDLHFKG-SFHVURJKSA-N 1 1 373.457 2.798 20 5 FFBDMO Cc1noc(C[N@@H+]2CCCN(c3ccc(F)c(F)c3)CC2)c1[N+](=O)[O-] ZINC000595479372 520496078 /nfs/dbraw/zinc/49/60/78/520496078.db2.gz ZJSIISBJPIEKSM-UHFFFAOYSA-N 1 1 352.341 2.882 20 5 FFBDMO Cc1noc(C[N@H+]2CCCN(c3ccc(F)c(F)c3)CC2)c1[N+](=O)[O-] ZINC000595479372 520496090 /nfs/dbraw/zinc/49/60/90/520496090.db2.gz ZJSIISBJPIEKSM-UHFFFAOYSA-N 1 1 352.341 2.882 20 5 FFBDMO COc1ccc(CC(=O)N2CCC[N@H+](C3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000609997407 520499222 /nfs/dbraw/zinc/49/92/22/520499222.db2.gz ODXOCBKMRGBSLV-UHFFFAOYSA-N 1 1 361.442 2.623 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218937 520501254 /nfs/dbraw/zinc/50/12/54/520501254.db2.gz JTCZIZDOIIHERB-OAHLLOKOSA-N 1 1 361.442 2.887 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](c1cccnc1)C(C)(C)CO ZINC000595498949 520510713 /nfs/dbraw/zinc/51/07/13/520510713.db2.gz ICHMGUMLIAACGJ-GOSISDBHSA-N 1 1 372.425 2.586 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000604437763 520563810 /nfs/dbraw/zinc/56/38/10/520563810.db2.gz RDYRDTDQBLKMNI-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000604472370 520570679 /nfs/dbraw/zinc/57/06/79/520570679.db2.gz UZQNWGNAUNJTOD-INIZCTEOSA-N 1 1 356.426 2.575 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)N(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105607 520637924 /nfs/dbraw/zinc/63/79/24/520637924.db2.gz DVCUZLAUNBHDDK-UONOGXRCSA-N 1 1 372.425 2.511 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC3(CCC3)OC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000595684051 520645915 /nfs/dbraw/zinc/64/59/15/520645915.db2.gz ZJWZIMPALUIOCM-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cncc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000601148564 520658917 /nfs/dbraw/zinc/65/89/17/520658917.db2.gz CWDNNVJXBRFLBX-HNNXBMFYSA-N 1 1 366.215 2.750 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000610392187 520663632 /nfs/dbraw/zinc/66/36/32/520663632.db2.gz ALPZMZZSBXXEMV-WBVHZDCISA-N 1 1 369.425 2.513 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507439 520665132 /nfs/dbraw/zinc/66/51/32/520665132.db2.gz BAJWWSAHCJVFDB-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507439 520665140 /nfs/dbraw/zinc/66/51/40/520665140.db2.gz BAJWWSAHCJVFDB-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])sc2C1 ZINC000592998010 520676353 /nfs/dbraw/zinc/67/63/53/520676353.db2.gz MWOOVVOBXISWCK-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])sc2C1 ZINC000592998010 520676357 /nfs/dbraw/zinc/67/63/57/520676357.db2.gz MWOOVVOBXISWCK-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C[C@H]2c2ccccc2)c1 ZINC000593034659 520696647 /nfs/dbraw/zinc/69/66/47/520696647.db2.gz QTPIPGGLFRSXQI-AEFFLSMTSA-N 1 1 356.378 2.689 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c1 ZINC000593034659 520696658 /nfs/dbraw/zinc/69/66/58/520696658.db2.gz QTPIPGGLFRSXQI-AEFFLSMTSA-N 1 1 356.378 2.689 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595756246 520701184 /nfs/dbraw/zinc/70/11/84/520701184.db2.gz FRMFUYJNALOUCD-YVEFUNNKSA-N 1 1 372.368 2.716 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598560451 520705035 /nfs/dbraw/zinc/70/50/35/520705035.db2.gz MGMZWRDRQQIHGL-OAHLLOKOSA-N 1 1 370.453 2.857 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000593054495 520711391 /nfs/dbraw/zinc/71/13/91/520711391.db2.gz FADJHBWHWBDOON-OAHLLOKOSA-N 1 1 363.414 2.782 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](OC(C)C)C2)c([N+](=O)[O-])c1 ZINC000593055719 520713702 /nfs/dbraw/zinc/71/37/02/520713702.db2.gz NIWVESMEGBUCFD-OAHLLOKOSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@H](CC)CO1 ZINC000593058106 520715513 /nfs/dbraw/zinc/71/55/13/520715513.db2.gz JIBYWNBKBGRJBM-UKRRQHHQSA-N 1 1 365.430 2.821 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000593080202 520730298 /nfs/dbraw/zinc/73/02/98/520730298.db2.gz KDSAXNWCURHMKI-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO Cc1c2cccc(C)c2oc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000593088235 520734915 /nfs/dbraw/zinc/73/49/15/520734915.db2.gz YMYXUUKJHNCTHE-HNNXBMFYSA-N 1 1 358.398 2.647 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598620472 520747696 /nfs/dbraw/zinc/74/76/96/520747696.db2.gz AYBVJCPUGSIXCJ-HNNXBMFYSA-N 1 1 370.409 2.710 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](O)C2)cc1OC ZINC000593115089 520755667 /nfs/dbraw/zinc/75/56/67/520755667.db2.gz HEMYBACJDJOIPN-UKRRQHHQSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](O)C2)cc1OC ZINC000593115089 520755672 /nfs/dbraw/zinc/75/56/72/520755672.db2.gz HEMYBACJDJOIPN-UKRRQHHQSA-N 1 1 352.431 2.985 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(F)cc2C(N)=O)CC1 ZINC000598647289 520760483 /nfs/dbraw/zinc/76/04/83/520760483.db2.gz IKBHBGLNXYOXOT-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CC1=CCSC1 ZINC000595887923 520795077 /nfs/dbraw/zinc/79/50/77/520795077.db2.gz HXVVVCGCDNUHBO-UHFFFAOYSA-N 1 1 351.428 2.537 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595900728 520805792 /nfs/dbraw/zinc/80/57/92/520805792.db2.gz JIJDNWLLSDOAFS-DOTOQJQBSA-N 1 1 374.485 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901511 520807202 /nfs/dbraw/zinc/80/72/02/520807202.db2.gz XRLDAXUXZCMLIQ-MRXNPFEDSA-N 1 1 360.458 2.553 20 5 FFBDMO CCC1([NH+]2CCCC2)CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000601743956 520930767 /nfs/dbraw/zinc/93/07/67/520930767.db2.gz FZMPNPZEJQHHAZ-UHFFFAOYSA-N 1 1 371.441 2.952 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596176214 520953433 /nfs/dbraw/zinc/95/34/33/520953433.db2.gz BBYSXHJNSPSKBM-LSDHHAIUSA-N 1 1 368.437 2.793 20 5 FFBDMO Cc1ccc(CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)c(N2CCCC2)[nH+]1 ZINC000596186966 520959540 /nfs/dbraw/zinc/95/95/40/520959540.db2.gz OECOJJVXODVPPF-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CC[N@@H+]2C(C)(C)C)ncc1[N+](=O)[O-] ZINC000596309355 521020759 /nfs/dbraw/zinc/02/07/59/521020759.db2.gz ZIKAXZYBQYSJDY-SNVBAGLBSA-N 1 1 357.252 2.767 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CC[N@H+]2C(C)(C)C)ncc1[N+](=O)[O-] ZINC000596309355 521020769 /nfs/dbraw/zinc/02/07/69/521020769.db2.gz ZIKAXZYBQYSJDY-SNVBAGLBSA-N 1 1 357.252 2.767 20 5 FFBDMO COc1cc(N[C@@H](C)C[N@H+](C)CCCN(C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596362789 521040116 /nfs/dbraw/zinc/04/01/16/521040116.db2.gz OGCIHDMTROUJNO-LBPRGKRZSA-N 1 1 358.870 2.941 20 5 FFBDMO COc1cc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596362789 521040124 /nfs/dbraw/zinc/04/01/24/521040124.db2.gz OGCIHDMTROUJNO-LBPRGKRZSA-N 1 1 358.870 2.941 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@H](C(F)F)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601969431 521047283 /nfs/dbraw/zinc/04/72/83/521047283.db2.gz DCCLENCUFKYQGW-HNNXBMFYSA-N 1 1 366.368 2.851 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000601973577 521048740 /nfs/dbraw/zinc/04/87/40/521048740.db2.gz QGYFQBSIUAWRQS-GJZGRUSLSA-N 1 1 352.337 2.774 20 5 FFBDMO CC(=O)c1cc(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccc1[N+](=O)[O-] ZINC000596422593 521063551 /nfs/dbraw/zinc/06/35/51/521063551.db2.gz FVYADGPVTRKTEF-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c2ncccc12 ZINC000611296542 521086577 /nfs/dbraw/zinc/08/65/77/521086577.db2.gz UJHGSGIJEATIRY-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000596480940 521092980 /nfs/dbraw/zinc/09/29/80/521092980.db2.gz VBXGFWLMOLZNMB-CYBMUJFWSA-N 1 1 367.471 2.817 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000596480940 521092986 /nfs/dbraw/zinc/09/29/86/521092986.db2.gz VBXGFWLMOLZNMB-CYBMUJFWSA-N 1 1 367.471 2.817 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)nc1 ZINC000596526634 521117566 /nfs/dbraw/zinc/11/75/66/521117566.db2.gz RUAIGINEZDAVCR-MRXNPFEDSA-N 1 1 353.426 2.521 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000611400587 521137326 /nfs/dbraw/zinc/13/73/26/521137326.db2.gz SBCPKEVXXQRDEQ-WFASDCNBSA-N 1 1 367.471 2.544 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000611400587 521137335 /nfs/dbraw/zinc/13/73/35/521137335.db2.gz SBCPKEVXXQRDEQ-WFASDCNBSA-N 1 1 367.471 2.544 20 5 FFBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])c1 ZINC000611560285 521219810 /nfs/dbraw/zinc/21/98/10/521219810.db2.gz MSRSJFVBNGMFAH-MRXNPFEDSA-N 1 1 360.414 2.954 20 5 FFBDMO CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CC[N@@H+](C)C1 ZINC000596694855 521227862 /nfs/dbraw/zinc/22/78/62/521227862.db2.gz PDNYRSMBBVDKGZ-LLVKDONJSA-N 1 1 358.345 2.754 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000611573824 521228248 /nfs/dbraw/zinc/22/82/48/521228248.db2.gz JRRGZOCSEUYMOV-UHFFFAOYSA-N 1 1 374.441 2.955 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000611573824 521228264 /nfs/dbraw/zinc/22/82/64/521228264.db2.gz JRRGZOCSEUYMOV-UHFFFAOYSA-N 1 1 374.441 2.955 20 5 FFBDMO COc1ccc(C[NH+]2CCC(Oc3ncc(C)cn3)CC2)cc1[N+](=O)[O-] ZINC000594018971 521353009 /nfs/dbraw/zinc/35/30/09/521353009.db2.gz AVDAGLGAANQXDU-UHFFFAOYSA-N 1 1 358.398 2.745 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@@H]1CC[N@@H+](CC)C1 ZINC000596890184 521358613 /nfs/dbraw/zinc/35/86/13/521358613.db2.gz LDIGDGKZGDWQME-CQSZACIVSA-N 1 1 350.419 2.942 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632104 521447112 /nfs/dbraw/zinc/44/71/12/521447112.db2.gz VOPBXQDGMXXZJO-IUPBHXKESA-N 1 1 357.332 2.699 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632104 521447115 /nfs/dbraw/zinc/44/71/15/521447115.db2.gz VOPBXQDGMXXZJO-IUPBHXKESA-N 1 1 357.332 2.699 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000594200284 521466647 /nfs/dbraw/zinc/46/66/47/521466647.db2.gz KMSQHOWGEBEMOB-HOTGVXAUSA-N 1 1 369.425 2.527 20 5 FFBDMO CSC1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CC[NH+](C)CC1 ZINC000602666780 521468930 /nfs/dbraw/zinc/46/89/30/521468930.db2.gz KBXBKLGVDMFVIC-UHFFFAOYSA-N 1 1 350.444 2.653 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597095334 521502082 /nfs/dbraw/zinc/50/20/82/521502082.db2.gz SUUWQCYKAWPCFA-JTQLQIEISA-N 1 1 355.826 2.684 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C[C@H]1C ZINC000597100979 521506520 /nfs/dbraw/zinc/50/65/20/521506520.db2.gz NPBKMRPNJSWBLI-ZJUUUORDSA-N 1 1 355.826 2.777 20 5 FFBDMO C[C@H](NC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1 ZINC000597101834 521507378 /nfs/dbraw/zinc/50/73/78/521507378.db2.gz UXCAWBJXQJAYIZ-VIFPVBQESA-N 1 1 353.810 2.602 20 5 FFBDMO COc1ccc([C@@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cc1Br ZINC000602802053 521539797 /nfs/dbraw/zinc/53/97/97/521539797.db2.gz OMKYWAZBUBMCEW-SECBINFHSA-N 1 1 369.219 2.950 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062102 521613555 /nfs/dbraw/zinc/61/35/55/521613555.db2.gz CIILWMXJJHPWRE-IINYFYTJSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062102 521613560 /nfs/dbraw/zinc/61/35/60/521613560.db2.gz CIILWMXJJHPWRE-IINYFYTJSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[nH+]c1 ZINC000486590212 561351661 /nfs/dbraw/zinc/35/16/61/561351661.db2.gz XICLYJYLZSWHEI-UHFFFAOYSA-N 1 1 364.352 2.737 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2-c2nn[nH]n2)C2CC2)cc1 ZINC000826497949 608173184 /nfs/dbraw/zinc/17/31/84/608173184.db2.gz AEWNWHQDKCNWKG-UHFFFAOYSA-N 1 1 350.382 2.940 20 5 FFBDMO Nc1cc(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)ncc1[N+](=O)[O-] ZINC001164997330 722203014 /nfs/dbraw/zinc/20/30/14/722203014.db2.gz ZOISBROKBCEKJJ-LJQANCHMSA-N 1 1 371.416 2.956 20 5 FFBDMO O=C(CN1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746453389 735484917 /nfs/dbraw/zinc/48/49/17/735484917.db2.gz JHLBUDWDLPNLDB-NSHDSACASA-N 1 1 363.805 2.789 20 5 FFBDMO O=C(C[N@@H+](CCO)Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070927044 728206681 /nfs/dbraw/zinc/20/66/81/728206681.db2.gz QICORCKQWQLXEL-UHFFFAOYSA-N 1 1 363.801 2.681 20 5 FFBDMO O=C(C[N@H+](CCO)Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000070927044 728206684 /nfs/dbraw/zinc/20/66/84/728206684.db2.gz QICORCKQWQLXEL-UHFFFAOYSA-N 1 1 363.801 2.681 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)C(C)C ZINC000102479220 728491114 /nfs/dbraw/zinc/49/11/14/728491114.db2.gz SLJWSUOFTQWMFM-UHFFFAOYSA-N 1 1 352.391 2.580 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1NCCc1cn2c([nH+]1)CCCC2 ZINC000129683319 728712727 /nfs/dbraw/zinc/71/27/27/728712727.db2.gz XIIUGLGPTYUZRW-UHFFFAOYSA-N 1 1 366.219 2.940 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000171956423 729016739 /nfs/dbraw/zinc/01/67/39/729016739.db2.gz KDPTXGNDQMIFEQ-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000857062389 730376893 /nfs/dbraw/zinc/37/68/93/730376893.db2.gz KTAHISKUPPSVSX-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1NC1CC([NH+]2CCOCC2)C1 ZINC000858600696 730429628 /nfs/dbraw/zinc/42/96/28/730429628.db2.gz YNENVPLSXURFCQ-UHFFFAOYSA-N 1 1 356.220 2.632 20 5 FFBDMO C[C@@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000859567883 730459265 /nfs/dbraw/zinc/45/92/65/730459265.db2.gz WCEXGPNAKKHBCK-TUAOUCFPSA-N 1 1 352.362 2.721 20 5 FFBDMO C[C@@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000859567883 730459266 /nfs/dbraw/zinc/45/92/66/730459266.db2.gz WCEXGPNAKKHBCK-TUAOUCFPSA-N 1 1 352.362 2.721 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861984378 730658821 /nfs/dbraw/zinc/65/88/21/730658821.db2.gz DOLWVIYYQJSTQM-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO C[C@H]([NH2+]C[C@@H](N1CCOCC1)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872071523 731726791 /nfs/dbraw/zinc/72/67/91/731726791.db2.gz QQKPBNKPKGSILT-GXFFZTMASA-N 1 1 365.327 2.648 20 5 FFBDMO O=C1CCC2=C(CC[N@@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)N1 ZINC000877620902 732399698 /nfs/dbraw/zinc/39/96/98/732399698.db2.gz ZRUNKURFAZDRPZ-UHFFFAOYSA-N 1 1 355.316 2.983 20 5 FFBDMO O=C1CCC2=C(CC[N@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)N1 ZINC000877620902 732399706 /nfs/dbraw/zinc/39/97/06/732399706.db2.gz ZRUNKURFAZDRPZ-UHFFFAOYSA-N 1 1 355.316 2.983 20 5 FFBDMO COC(=O)NC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000877643442 732404364 /nfs/dbraw/zinc/40/43/64/732404364.db2.gz DVWAAIDNKHQBAF-UHFFFAOYSA-N 1 1 361.320 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880144356 732854823 /nfs/dbraw/zinc/85/48/23/732854823.db2.gz CULUTMXKMIRCRC-GHMZBOCLSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880144356 732854825 /nfs/dbraw/zinc/85/48/25/732854825.db2.gz CULUTMXKMIRCRC-GHMZBOCLSA-N 1 1 355.822 2.668 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]2C1 ZINC000880311827 732885619 /nfs/dbraw/zinc/88/56/19/732885619.db2.gz HEFZWCDICSCCGX-BETUJISGSA-N 1 1 357.332 2.524 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]2C1 ZINC000880311827 732885623 /nfs/dbraw/zinc/88/56/23/732885623.db2.gz HEFZWCDICSCCGX-BETUJISGSA-N 1 1 357.332 2.524 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccc(F)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782063565 738685133 /nfs/dbraw/zinc/68/51/33/738685133.db2.gz NGVIYSMUWXXRGC-AWEZNQCLSA-N 1 1 367.764 2.649 20 5 FFBDMO O=[N+]([O-])c1c(Br)cc(F)cc1N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000882269381 733201048 /nfs/dbraw/zinc/20/10/48/733201048.db2.gz LHQXLBBZMHHOFE-UHFFFAOYSA-N 1 1 370.182 2.546 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000729545243 734583325 /nfs/dbraw/zinc/58/33/25/734583325.db2.gz CMNVIBSTZLAIRV-ZDUSSCGKSA-N 1 1 368.821 2.577 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804732 734766676 /nfs/dbraw/zinc/76/66/76/734766676.db2.gz DLOMMKCXDSOQNH-LBPRGKRZSA-N 1 1 361.471 2.785 20 5 FFBDMO C[NH+]1CCC(N2CC[C@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804732 734766686 /nfs/dbraw/zinc/76/66/86/734766686.db2.gz DLOMMKCXDSOQNH-LBPRGKRZSA-N 1 1 361.471 2.785 20 5 FFBDMO Cc1ccc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1Br ZINC000895246307 734980335 /nfs/dbraw/zinc/98/03/35/734980335.db2.gz MWCVBCVQPKMANI-DGCLKSJQSA-N 1 1 371.279 2.712 20 5 FFBDMO Cc1ccc(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1Br ZINC000895246308 734980651 /nfs/dbraw/zinc/98/06/51/734980651.db2.gz MWCVBCVQPKMANI-WCQYABFASA-N 1 1 371.279 2.712 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)COC(=O)N1 ZINC000896394752 735152476 /nfs/dbraw/zinc/15/24/76/735152476.db2.gz FSJLNRIASNBVPG-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO COc1cc([C@H](C)NCCC[N@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160467 736045037 /nfs/dbraw/zinc/04/50/37/736045037.db2.gz MMOYSLOTQZGUPN-GJZGRUSLSA-N 1 1 351.447 2.755 20 5 FFBDMO COc1cc([C@H](C)[NH2+]CCCN2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160467 736045042 /nfs/dbraw/zinc/04/50/42/736045042.db2.gz MMOYSLOTQZGUPN-GJZGRUSLSA-N 1 1 351.447 2.755 20 5 FFBDMO CC[N@H+]1CCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000754389003 736155174 /nfs/dbraw/zinc/15/51/74/736155174.db2.gz XOPULNIVZMGOGF-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000756902169 736371680 /nfs/dbraw/zinc/37/16/80/736371680.db2.gz QMQHQNMSBBBVJB-SMDDNHRTSA-N 1 1 353.806 2.688 20 5 FFBDMO CN(C(=O)CCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@H+](C2CC2)C1 ZINC000906649790 736529297 /nfs/dbraw/zinc/52/92/97/736529297.db2.gz CWAXHJSYWKJVAC-HNNXBMFYSA-N 1 1 351.834 2.876 20 5 FFBDMO CSc1ccc(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000759964399 736607075 /nfs/dbraw/zinc/60/70/75/736607075.db2.gz XZSDRZPTMQKBKD-AWEZNQCLSA-N 1 1 368.455 2.830 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OCC[NH+]1CCSCC1 ZINC000764675833 737040588 /nfs/dbraw/zinc/04/05/88/737040588.db2.gz JHQLOXJGMOAJKC-UHFFFAOYSA-N 1 1 356.469 2.912 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000912810578 737342764 /nfs/dbraw/zinc/34/27/64/737342764.db2.gz WIUBJKPXKKSNNK-STQMWFEESA-N 1 1 351.451 2.634 20 5 FFBDMO COC[C@@H]1CCCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767951952 737385581 /nfs/dbraw/zinc/38/55/81/737385581.db2.gz ZSPSRFPBCOACFD-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767951952 737385585 /nfs/dbraw/zinc/38/55/85/737385585.db2.gz ZSPSRFPBCOACFD-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939788 737585476 /nfs/dbraw/zinc/58/54/76/737585476.db2.gz AUFWLFFEEXTKDO-XJKSGUPXSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939788 737585480 /nfs/dbraw/zinc/58/54/80/737585480.db2.gz AUFWLFFEEXTKDO-XJKSGUPXSA-N 1 1 364.833 2.927 20 5 FFBDMO CC[C@H](CSC)[N@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000773255736 737885682 /nfs/dbraw/zinc/88/56/82/737885682.db2.gz OKUZMDKAIBIMJF-CQSZACIVSA-N 1 1 364.471 2.887 20 5 FFBDMO CC[C@H](CSC)[N@@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000773255736 737885685 /nfs/dbraw/zinc/88/56/85/737885685.db2.gz OKUZMDKAIBIMJF-CQSZACIVSA-N 1 1 364.471 2.887 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[NH3+])[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000923501768 738292637 /nfs/dbraw/zinc/29/26/37/738292637.db2.gz VHNXNQQJDDPSSP-MNOVXSKESA-N 1 1 359.373 2.622 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C[C@@H]1C ZINC000778287212 738369565 /nfs/dbraw/zinc/36/95/65/738369565.db2.gz IGQJZEXAKMGWCH-JQWIXIFHSA-N 1 1 363.443 2.544 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000787962817 739191895 /nfs/dbraw/zinc/19/18/95/739191895.db2.gz RHHYVHIFPRAKPH-HZMBPMFUSA-N 1 1 371.821 2.705 20 5 FFBDMO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Br)C1CCOCC1 ZINC000931566611 739288552 /nfs/dbraw/zinc/28/85/52/739288552.db2.gz ZYOPLPCSXXVMPP-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Br)C1CCOCC1 ZINC000931566611 739288555 /nfs/dbraw/zinc/28/85/55/739288555.db2.gz ZYOPLPCSXXVMPP-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)COC(=O)N1 ZINC000932020672 739374483 /nfs/dbraw/zinc/37/44/83/739374483.db2.gz KJFLLGVDUBFLBL-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)COC(=O)N1 ZINC000932027452 739376405 /nfs/dbraw/zinc/37/64/05/739376405.db2.gz YYNMYTAULGCCFM-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC000932188049 739400844 /nfs/dbraw/zinc/40/08/44/739400844.db2.gz IKHFQGBEWJKCHE-CYBMUJFWSA-N 1 1 361.471 2.925 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000933437236 739625153 /nfs/dbraw/zinc/62/51/53/739625153.db2.gz BIVJOAIZXUVJAY-CJNGLKHVSA-N 1 1 351.422 2.855 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000934547898 739802867 /nfs/dbraw/zinc/80/28/67/739802867.db2.gz JUFLACOLDFETPE-CQSZACIVSA-N 1 1 351.422 2.761 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934773125 739837804 /nfs/dbraw/zinc/83/78/04/739837804.db2.gz FBZMWMHGHIRBOJ-JKDFXYPNSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934773125 739837811 /nfs/dbraw/zinc/83/78/11/739837811.db2.gz FBZMWMHGHIRBOJ-JKDFXYPNSA-N 1 1 365.455 2.615 20 5 FFBDMO C[C@H]1CC[N@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C1 ZINC000795423396 740019516 /nfs/dbraw/zinc/01/95/16/740019516.db2.gz PIAHZJKLVUSUDK-VIFPVBQESA-N 1 1 354.204 2.612 20 5 FFBDMO C[C@H]1CC[N@@H+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C1 ZINC000795423396 740019520 /nfs/dbraw/zinc/01/95/20/740019520.db2.gz PIAHZJKLVUSUDK-VIFPVBQESA-N 1 1 354.204 2.612 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@](O)(C(F)(F)F)CC3)c2c1 ZINC000795721290 740056470 /nfs/dbraw/zinc/05/64/70/740056470.db2.gz YSQXDGZKEPTRKV-CQSZACIVSA-N 1 1 358.320 2.681 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@](O)(C(F)(F)F)CC3)c2c1 ZINC000795721290 740056474 /nfs/dbraw/zinc/05/64/74/740056474.db2.gz YSQXDGZKEPTRKV-CQSZACIVSA-N 1 1 358.320 2.681 20 5 FFBDMO COCC[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000798388695 740327914 /nfs/dbraw/zinc/32/79/14/740327914.db2.gz RHXFXWASCFSDNR-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000798388695 740327917 /nfs/dbraw/zinc/32/79/17/740327917.db2.gz RHXFXWASCFSDNR-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1cccc(Cl)c1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963789496 740656141 /nfs/dbraw/zinc/65/61/41/740656141.db2.gz ZXWZKBRJOLNPBY-YVXVDGILSA-N 1 1 363.845 2.522 20 5 FFBDMO CC(C)(C)SCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000801933232 740665469 /nfs/dbraw/zinc/66/54/69/740665469.db2.gz LMTBPFQURKZGBB-UHFFFAOYSA-N 1 1 351.472 2.884 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000802136909 740677013 /nfs/dbraw/zinc/67/70/13/740677013.db2.gz KWQCGNZEWCIZFO-MRXNPFEDSA-N 1 1 350.415 2.525 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H](C)C1 ZINC000804381438 740867571 /nfs/dbraw/zinc/86/75/71/740867571.db2.gz MQLOFVAGRNEBDO-VIFPVBQESA-N 1 1 374.210 2.663 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H](C)C1 ZINC000804381438 740867573 /nfs/dbraw/zinc/86/75/73/740867573.db2.gz MQLOFVAGRNEBDO-VIFPVBQESA-N 1 1 374.210 2.663 20 5 FFBDMO CC(C)S(=O)(=O)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000809789708 741344207 /nfs/dbraw/zinc/34/42/07/741344207.db2.gz AHBDTOORKUJKGM-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO C[N@@H+](CC1CCC(C)(C)CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985425767 741394518 /nfs/dbraw/zinc/39/45/18/741394518.db2.gz IIDWIEDSQBWKMC-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO C[N@H+](CC1CCC(C)(C)CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425767 741394523 /nfs/dbraw/zinc/39/45/23/741394523.db2.gz IIDWIEDSQBWKMC-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO C[N@@H+](CC1CCC(C)(C)CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425767 741394527 /nfs/dbraw/zinc/39/45/27/741394527.db2.gz IIDWIEDSQBWKMC-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCCCS1(=O)=O ZINC000811488577 741528831 /nfs/dbraw/zinc/52/88/31/741528831.db2.gz CNPMWOBXFRCBDQ-LLVKDONJSA-N 1 1 367.254 2.959 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]2C1 ZINC000816778362 742060966 /nfs/dbraw/zinc/06/09/66/742060966.db2.gz WZUOAVRQLIJDES-MNOVXSKESA-N 1 1 357.332 2.637 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CC2CCC(C)(C)CC2)CC1 ZINC001005381498 742253357 /nfs/dbraw/zinc/25/33/57/742253357.db2.gz MARGSXKTGJHQLK-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000818972176 742318114 /nfs/dbraw/zinc/31/81/14/742318114.db2.gz TUQRNICFYIVJRP-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000818972176 742318116 /nfs/dbraw/zinc/31/81/16/742318116.db2.gz TUQRNICFYIVJRP-JTQLQIEISA-N 1 1 374.210 2.663 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+](C2CC2)C1 ZINC000820875001 742561820 /nfs/dbraw/zinc/56/18/20/742561820.db2.gz VXDVTOJUQUOQJE-SECBINFHSA-N 1 1 370.812 2.526 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000828958859 745146461 /nfs/dbraw/zinc/14/64/61/745146461.db2.gz JIMTZECDEUAYGJ-HOTGVXAUSA-N 1 1 351.834 2.876 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000830589549 745389201 /nfs/dbraw/zinc/38/92/01/745389201.db2.gz LQIJTUXGAKFVQJ-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-] ZINC000830589549 745389203 /nfs/dbraw/zinc/38/92/03/745389203.db2.gz LQIJTUXGAKFVQJ-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000834595328 745864466 /nfs/dbraw/zinc/86/44/66/745864466.db2.gz XICGOTWODWZJOB-KBPBESRZSA-N 1 1 373.787 2.575 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000834595321 745864471 /nfs/dbraw/zinc/86/44/71/745864471.db2.gz XHEOFQACJZSHOC-KBPBESRZSA-N 1 1 355.797 2.815 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000837188416 746389044 /nfs/dbraw/zinc/38/90/44/746389044.db2.gz FEVOIVXNFRUUOD-GFCCVEGCSA-N 1 1 357.813 2.871 20 5 FFBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839568215 746858106 /nfs/dbraw/zinc/85/81/06/746858106.db2.gz KTZVYFWGNFEBTG-BZNIZROVSA-N 1 1 355.822 2.670 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@H]1C ZINC000839580946 746861412 /nfs/dbraw/zinc/86/14/12/746861412.db2.gz OVMIDZVRKGFZLE-ONGXEEELSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@H]1C ZINC000839580946 746861414 /nfs/dbraw/zinc/86/14/14/746861414.db2.gz OVMIDZVRKGFZLE-ONGXEEELSA-N 1 1 357.204 2.741 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000842163621 747536866 /nfs/dbraw/zinc/53/68/66/747536866.db2.gz QNUDVEZYRRAZIE-GHMZBOCLSA-N 1 1 362.257 2.789 20 5 FFBDMO CCCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@H]1CC[N@@H+](C)C1 ZINC000844146466 747978495 /nfs/dbraw/zinc/97/84/95/747978495.db2.gz OFFQXTBPNCCDEB-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000844903346 748133206 /nfs/dbraw/zinc/13/32/06/748133206.db2.gz XQEUCXROZXHCAV-VMGRFDJRSA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[N@@H+](C)C(C)(C)C1 ZINC000846891744 748567471 /nfs/dbraw/zinc/56/74/71/748567471.db2.gz KRUBFSYOZHSADQ-NSHDSACASA-N 1 1 354.838 2.601 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CC[N@@H+](C)C2)cc1SC ZINC000847827799 748791627 /nfs/dbraw/zinc/79/16/27/748791627.db2.gz XURURYPDXRTOOU-NSHDSACASA-N 1 1 354.428 2.824 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481178 748937300 /nfs/dbraw/zinc/93/73/00/748937300.db2.gz WGPRPBAMUSDAFB-IRXDYDNUSA-N 1 1 363.483 2.942 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481178 748937305 /nfs/dbraw/zinc/93/73/05/748937305.db2.gz WGPRPBAMUSDAFB-IRXDYDNUSA-N 1 1 363.483 2.942 20 5 FFBDMO CC[C@@H](CSC)[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483500 748937780 /nfs/dbraw/zinc/93/77/80/748937780.db2.gz IIOYSEWZTACRQG-GOEBONIOSA-N 1 1 351.472 2.942 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000852345309 749840580 /nfs/dbraw/zinc/84/05/80/749840580.db2.gz LQSDTJFYCBGPLY-FMSGJZPZSA-N 1 1 367.833 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000852345309 749840583 /nfs/dbraw/zinc/84/05/83/749840583.db2.gz LQSDTJFYCBGPLY-FMSGJZPZSA-N 1 1 367.833 2.668 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3C[C@]3(O)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000895645900 970814118 /nfs/dbraw/zinc/81/41/18/970814118.db2.gz FEFZTLCRHXZVGR-JXFKEZNVSA-N 1 1 370.405 2.749 20 5 FFBDMO Cc1nn(CN(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000173514175 971162443 /nfs/dbraw/zinc/16/24/43/971162443.db2.gz WCDZVPNSPZYERJ-GOSISDBHSA-N 1 1 357.458 2.820 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190509 1013078064 /nfs/dbraw/zinc/07/80/64/1013078064.db2.gz VKPXWBYETPIZFF-KUHUBIRLSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190509 1013078082 /nfs/dbraw/zinc/07/80/82/1013078082.db2.gz VKPXWBYETPIZFF-KUHUBIRLSA-N 1 1 359.401 2.978 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC001174841805 1013315184 /nfs/dbraw/zinc/31/51/84/1013315184.db2.gz DVFOLHWHNBRLQG-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001175004741 1013360653 /nfs/dbraw/zinc/36/06/53/1013360653.db2.gz XCWSRLGAYPZJBV-QMTHXVAHSA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001175004741 1013360662 /nfs/dbraw/zinc/36/06/62/1013360662.db2.gz XCWSRLGAYPZJBV-QMTHXVAHSA-N 1 1 366.805 2.891 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000124428856 1013413971 /nfs/dbraw/zinc/41/39/71/1013413971.db2.gz RSTJVXCWRLOEDJ-HNNXBMFYSA-N 1 1 362.474 2.759 20 5 FFBDMO CC(C)n1ncc2cc(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)cnc21 ZINC001175322754 1013444856 /nfs/dbraw/zinc/44/48/56/1013444856.db2.gz FLTHAAQKFGZJRX-LJQANCHMSA-N 1 1 369.425 2.918 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCN1C(=O)OC(C)(C)C ZINC000933467411 964426381 /nfs/dbraw/zinc/42/63/81/964426381.db2.gz KVUWJYYEPFEWFX-JKSUJKDBSA-N 1 1 365.430 2.569 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2CCCc2ccccc2)c1 ZINC000135361196 965010304 /nfs/dbraw/zinc/01/03/04/965010304.db2.gz XPQLDRBKMVNVKR-MJGOQNOKSA-N 1 1 358.442 2.640 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000176231278 965637603 /nfs/dbraw/zinc/63/76/03/965637603.db2.gz LPCYHWALKCTNAU-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2cnccn2)C1 ZINC001176525151 1013722647 /nfs/dbraw/zinc/72/26/47/1013722647.db2.gz WKNIKHFQHGJJRX-OCCSQVGLSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2cnccn2)C1 ZINC001176525151 1013722648 /nfs/dbraw/zinc/72/26/48/1013722648.db2.gz WKNIKHFQHGJJRX-OCCSQVGLSA-N 1 1 366.381 2.985 20 5 FFBDMO COc1c(O)ccc(CNc2cccc(C[NH+]3CCOCC3)c2)c1[N+](=O)[O-] ZINC000892346338 967627126 /nfs/dbraw/zinc/62/71/26/967627126.db2.gz IGOUQDZWNDQILL-UHFFFAOYSA-N 1 1 373.409 2.753 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135538966 968079651 /nfs/dbraw/zinc/07/96/51/968079651.db2.gz OFOHJSSEKWTHGW-OAHLLOKOSA-N 1 1 363.462 2.515 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000892721385 970249185 /nfs/dbraw/zinc/24/91/85/970249185.db2.gz MGWXZGKLWZIVRJ-AWEZNQCLSA-N 1 1 358.442 2.615 20 5 FFBDMO C[C@H]1CCC[C@H](CC[NH+](C)C)N1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000893011140 970495824 /nfs/dbraw/zinc/49/58/24/970495824.db2.gz CCLNHBAURYZXJZ-QWHCGFSZSA-N 1 1 359.430 2.806 20 5 FFBDMO C[C@@H](CNC(=O)N1CC[C@]2(C1)CCC[N@@H+](C)C2)c1ccccc1[N+](=O)[O-] ZINC000897059248 973205188 /nfs/dbraw/zinc/20/51/88/973205188.db2.gz BGQIRQMUGXXNFE-HNAYVOBHSA-N 1 1 360.458 2.826 20 5 FFBDMO C[C@@H]1CCC[N@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237465794 973467538 /nfs/dbraw/zinc/46/75/38/973467538.db2.gz LYBPNILWYICGRJ-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237465794 973467546 /nfs/dbraw/zinc/46/75/46/973467546.db2.gz LYBPNILWYICGRJ-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876466365 1014278192 /nfs/dbraw/zinc/27/81/92/1014278192.db2.gz BCITYVLUSRUNCJ-JQFCIGGWSA-N 1 1 372.425 2.668 20 5 FFBDMO Cc1ncccc1OC[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000842173445 976715237 /nfs/dbraw/zinc/71/52/37/976715237.db2.gz PSEPUHRJAQKREQ-ZWKOTPCHSA-N 1 1 357.410 2.875 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CCCc2ccccc2)CC1 ZINC001481998163 977905586 /nfs/dbraw/zinc/90/55/86/977905586.db2.gz MHYWVSZSYKEYIF-RTBURBONSA-N 1 1 359.470 2.503 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000249107222 979413935 /nfs/dbraw/zinc/41/39/35/979413935.db2.gz QPNIVJNVDXWCPE-LALPHHSUSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000249107222 979413937 /nfs/dbraw/zinc/41/39/37/979413937.db2.gz QPNIVJNVDXWCPE-LALPHHSUSA-N 1 1 374.397 2.837 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCC(=O)OC(C)(C)C ZINC000128896581 980145973 /nfs/dbraw/zinc/14/59/73/980145973.db2.gz VMRCICFMYGTEDD-UHFFFAOYSA-N 1 1 369.393 2.726 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@]2(C)CCC[N@H+]2Cc2ccccc2)n1 ZINC000780396829 981291314 /nfs/dbraw/zinc/29/13/14/981291314.db2.gz DPBPYQAFNXKJGO-SFHVURJKSA-N 1 1 358.398 2.540 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000877822953 1014740690 /nfs/dbraw/zinc/74/06/90/1014740690.db2.gz VMRQIVDOJUJEQS-CYBMUJFWSA-N 1 1 364.398 2.627 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1cc3ccccc3o1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963788841 1014763677 /nfs/dbraw/zinc/76/36/77/1014763677.db2.gz SYVSORSFWFQEKD-DYWMREIESA-N 1 1 369.421 2.615 20 5 FFBDMO Cc1cc(C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)c(N)c([N+](=O)[O-])c1 ZINC000171450743 985286039 /nfs/dbraw/zinc/28/60/39/985286039.db2.gz NGASCZJZGGDOEU-LBPRGKRZSA-N 1 1 374.466 2.724 20 5 FFBDMO Cc1cc(C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)c(N)c([N+](=O)[O-])c1 ZINC000171450743 985286044 /nfs/dbraw/zinc/28/60/44/985286044.db2.gz NGASCZJZGGDOEU-LBPRGKRZSA-N 1 1 374.466 2.724 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)NC(=O)OC(C)(C)C ZINC000785439482 985490520 /nfs/dbraw/zinc/49/05/20/985490520.db2.gz OOMXHFDTZUWIMT-CQSZACIVSA-N 1 1 364.446 2.630 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000063758210 986056989 /nfs/dbraw/zinc/05/69/89/986056989.db2.gz KLVUSSPKYIKZOX-ZDUSSCGKSA-N 1 1 364.402 2.887 20 5 FFBDMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913684809 986836869 /nfs/dbraw/zinc/83/68/69/986836869.db2.gz MUNFJYAINLUSPZ-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913684809 986836881 /nfs/dbraw/zinc/83/68/81/986836881.db2.gz MUNFJYAINLUSPZ-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO COc1ccc(CC(=O)OC[C@H]2CCC[N@H+]2Cc2ccco2)cc1[N+](=O)[O-] ZINC000765966479 987488233 /nfs/dbraw/zinc/48/82/33/987488233.db2.gz GAKPPYGVROJQNV-OAHLLOKOSA-N 1 1 374.393 2.947 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2[nH+]ccn2C)C1 ZINC000370061884 987984592 /nfs/dbraw/zinc/98/45/92/987984592.db2.gz IACAHHQJSKOHJR-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO CC1([NH+]2CCC2)CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000922169046 988001911 /nfs/dbraw/zinc/00/19/11/988001911.db2.gz GRWBKAPOBQWGMW-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCC[N@H+]2CCc3ccccc3C2)c2nonc21 ZINC000914863591 988002895 /nfs/dbraw/zinc/00/28/95/988002895.db2.gz UYIQYWXDPRHYEG-UHFFFAOYSA-N 1 1 353.382 2.991 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c(C)c(F)ccc3[N+](=O)[O-])CC2)c1 ZINC000843827778 988128976 /nfs/dbraw/zinc/12/89/76/988128976.db2.gz OAGCAIBKTXAEKX-UHFFFAOYSA-N 1 1 358.373 2.708 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000125361376 988941273 /nfs/dbraw/zinc/94/12/73/988941273.db2.gz KMXJCQLRMZSQEF-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000125361376 988941290 /nfs/dbraw/zinc/94/12/90/988941290.db2.gz KMXJCQLRMZSQEF-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)c1 ZINC000154429147 990238025 /nfs/dbraw/zinc/23/80/25/990238025.db2.gz BEFQZYZZWWFTNH-UXHICEINSA-N 1 1 356.422 2.962 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267454 991728747 /nfs/dbraw/zinc/72/87/47/991728747.db2.gz PKBXXNBFBQHASF-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267454 991728755 /nfs/dbraw/zinc/72/87/55/991728755.db2.gz PKBXXNBFBQHASF-LSDHHAIUSA-N 1 1 371.441 2.843 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[NH+](CCCNc2ccccc2[N+](=O)[O-])CC1 ZINC000071955422 992704321 /nfs/dbraw/zinc/70/43/21/992704321.db2.gz FSLGAWHSFODLOS-UHFFFAOYSA-N 1 1 364.446 2.950 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)CC[C@H]21 ZINC000880164946 1015771047 /nfs/dbraw/zinc/77/10/47/1015771047.db2.gz HIQPWPPHTVNWFA-MLGOLLRUSA-N 1 1 355.398 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@@H](O)CC3(CCOCC3)C2)c1 ZINC000880584304 1015878186 /nfs/dbraw/zinc/87/81/86/1015878186.db2.gz HVRGKHBDRMWHHL-AWEZNQCLSA-N 1 1 374.359 2.977 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2C[C@@H](O)CC3(CCOCC3)C2)c1 ZINC000880584304 1015878196 /nfs/dbraw/zinc/87/81/96/1015878196.db2.gz HVRGKHBDRMWHHL-AWEZNQCLSA-N 1 1 374.359 2.977 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCC[C@@H]2COC(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000810037881 994683144 /nfs/dbraw/zinc/68/31/44/994683144.db2.gz GRCIHUUOMPOHPY-OAHLLOKOSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2COC(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000810037881 994683152 /nfs/dbraw/zinc/68/31/52/994683152.db2.gz GRCIHUUOMPOHPY-OAHLLOKOSA-N 1 1 363.414 2.847 20 5 FFBDMO CCCC[C@H](C)[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000810125049 994708132 /nfs/dbraw/zinc/70/81/32/994708132.db2.gz MXSXRUNIDAKLAJ-INIZCTEOSA-N 1 1 362.474 2.754 20 5 FFBDMO Cn1cc(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810848501 994954630 /nfs/dbraw/zinc/95/46/30/994954630.db2.gz VSJLCJMOPDGURP-CVEARBPZSA-N 1 1 370.409 2.779 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000747828594 995573225 /nfs/dbraw/zinc/57/32/25/995573225.db2.gz GVNYXLPGNJUNNK-HOTGVXAUSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000823981541 996772045 /nfs/dbraw/zinc/77/20/45/996772045.db2.gz ZLFFQTLOWCSMEM-CZUORRHYSA-N 1 1 369.425 2.962 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC000844948764 998269348 /nfs/dbraw/zinc/26/93/48/998269348.db2.gz GZIVRFMILJVJCD-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO Cc1ccc(CC[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cc1 ZINC001000152297 1016247852 /nfs/dbraw/zinc/24/78/52/1016247852.db2.gz CPDBMLCZPAOYLW-RTBURBONSA-N 1 1 371.481 2.564 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C ZINC000741024619 999704101 /nfs/dbraw/zinc/70/41/01/999704101.db2.gz XOWZMIJNYZWACU-MCIONIFRSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1nn(CN2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000766376525 999989907 /nfs/dbraw/zinc/98/99/07/999989907.db2.gz NZJJPPXONHQCEJ-LSDHHAIUSA-N 1 1 357.458 2.960 20 5 FFBDMO CCOC(=O)[C@H]([NH3+])Cc1cn([C@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168969120 1000013488 /nfs/dbraw/zinc/01/34/88/1000013488.db2.gz CLIKJUZWJFSCSJ-JLJPHGGASA-N 1 1 359.426 2.692 20 5 FFBDMO CCOC(=O)[C@H]([NH3+])Cc1cn([C@@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168969122 1000013572 /nfs/dbraw/zinc/01/35/72/1000013572.db2.gz CLIKJUZWJFSCSJ-YSVLISHTSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC[C@@H]21 ZINC001169010724 1000015248 /nfs/dbraw/zinc/01/52/48/1000015248.db2.gz FUIAMHHSKRWEKK-JJXSEGSLSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011034 1000015449 /nfs/dbraw/zinc/01/54/49/1000015449.db2.gz HLXXRBZEVGUMBL-ZXFNITATSA-N 1 1 353.463 2.811 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169036015 1000016566 /nfs/dbraw/zinc/01/65/66/1000016566.db2.gz FCQMIMYBBKZDQW-QMHWVQJVSA-N 1 1 353.463 2.667 20 5 FFBDMO CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169037965 1000016632 /nfs/dbraw/zinc/01/66/32/1000016632.db2.gz ULJUQMQQOIPVBR-WBAXXEDZSA-N 1 1 359.470 2.773 20 5 FFBDMO CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169037963 1000016663 /nfs/dbraw/zinc/01/66/63/1000016663.db2.gz ULJUQMQQOIPVBR-OLMNPRSZSA-N 1 1 359.470 2.773 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2C[C@@H]3COC[C@]3(COCC3CCCC3)C2)C1 ZINC001169025797 1000018278 /nfs/dbraw/zinc/01/82/78/1000018278.db2.gz VJGAENBQOIRTFY-AKHDSKFASA-N 1 1 352.475 2.587 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)c([N+](=O)[O-])c1 ZINC001147330726 1000872634 /nfs/dbraw/zinc/87/26/34/1000872634.db2.gz CJAOBOIGJWJMTN-RDJZCZTQSA-N 1 1 360.458 2.838 20 5 FFBDMO C/C(=C\C(=O)NC(C)(C)CCN1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000771663333 1001171977 /nfs/dbraw/zinc/17/19/77/1001171977.db2.gz MGZRWMQPFSSGET-FOCLMDBBSA-N 1 1 374.485 2.530 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000786787011 1001626866 /nfs/dbraw/zinc/62/68/66/1001626866.db2.gz JMYQMUCYPCWWCM-AWEZNQCLSA-N 1 1 373.409 2.939 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000790128268 1002286213 /nfs/dbraw/zinc/28/62/13/1002286213.db2.gz SWEIAEARTRCTCW-REJXWNQVSA-N 1 1 361.442 2.566 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000790128268 1002286218 /nfs/dbraw/zinc/28/62/18/1002286218.db2.gz SWEIAEARTRCTCW-REJXWNQVSA-N 1 1 361.442 2.566 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345428 1003131908 /nfs/dbraw/zinc/13/19/08/1003131908.db2.gz KIIIUASYEWWOGH-VNHYZAJKSA-N 1 1 350.415 2.665 20 5 FFBDMO CC1(C)CC(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])c(F)c2)C1 ZINC001001525147 1016829505 /nfs/dbraw/zinc/82/95/05/1016829505.db2.gz TWXWMWYLMDFIOP-NVXWUHKLSA-N 1 1 363.433 2.633 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1C ZINC001191896785 1003993468 /nfs/dbraw/zinc/99/34/68/1003993468.db2.gz SPBXFBYRGGMJNH-JKSUJKDBSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@](CO)([NH2+]CC(=O)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001196909323 1004010807 /nfs/dbraw/zinc/01/08/07/1004010807.db2.gz URBBFPIYXCVOPG-QGZVFWFLSA-N 1 1 363.801 2.684 20 5 FFBDMO CCN(C)C(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000805763464 1004139128 /nfs/dbraw/zinc/13/91/28/1004139128.db2.gz ZXZJYKFEWQVUDC-HNNXBMFYSA-N 1 1 365.430 2.916 20 5 FFBDMO C[N@@H+](CCCC[NH+]1CCCCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001197283512 1004162453 /nfs/dbraw/zinc/16/24/53/1004162453.db2.gz CBRGHNDREMBEQU-IBGZPJMESA-N 1 1 374.485 2.898 20 5 FFBDMO CN(CCCC[NH+]1CCCCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001197283512 1004162462 /nfs/dbraw/zinc/16/24/62/1004162462.db2.gz CBRGHNDREMBEQU-IBGZPJMESA-N 1 1 374.485 2.898 20 5 FFBDMO COCC[N@@H+](CCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC001198526124 1004647981 /nfs/dbraw/zinc/64/79/81/1004647981.db2.gz PVQPLGMDLHSXTM-UHFFFAOYSA-N 1 1 356.394 2.914 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCN(C[C@H]2CCCO2)CC1 ZINC000850434498 1005815350 /nfs/dbraw/zinc/81/53/50/1005815350.db2.gz UKQYXDDELKCIGT-WMLDXEAASA-N 1 1 363.458 2.897 20 5 FFBDMO Cn1ncc(C2CC2)c1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035400 1005858068 /nfs/dbraw/zinc/85/80/68/1005858068.db2.gz KZRQAVFZSRHHSP-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO Cn1ncc(C2CC2)c1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035400 1005858070 /nfs/dbraw/zinc/85/80/70/1005858070.db2.gz KZRQAVFZSRHHSP-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO Cn1c(C(=O)O[C@@H]2CC[N@@H+](Cc3ccc4c(c3)CCC4)C2)ccc1[N+](=O)[O-] ZINC000776557940 1005928884 /nfs/dbraw/zinc/92/88/84/1005928884.db2.gz LDLFNPCFXQENBE-QGZVFWFLSA-N 1 1 369.421 2.853 20 5 FFBDMO O=C(CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)OCc1ccccc1 ZINC000776574088 1005953277 /nfs/dbraw/zinc/95/32/77/1005953277.db2.gz BXQIVACPUVTYIB-UHFFFAOYSA-N 1 1 369.421 2.850 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776583031 1005954414 /nfs/dbraw/zinc/95/44/14/1005954414.db2.gz YQCPWEIBFLBEKX-KXBFYZLASA-N 1 1 372.421 2.940 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000776585681 1005976215 /nfs/dbraw/zinc/97/62/15/1005976215.db2.gz ZEAUOYGFPNSRPY-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000776585681 1005976223 /nfs/dbraw/zinc/97/62/23/1005976223.db2.gz ZEAUOYGFPNSRPY-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000776590286 1006002983 /nfs/dbraw/zinc/00/29/83/1006002983.db2.gz FUFDGSFEUKPJCR-INIZCTEOSA-N 1 1 365.430 2.569 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000776590286 1006002991 /nfs/dbraw/zinc/00/29/91/1006002991.db2.gz FUFDGSFEUKPJCR-INIZCTEOSA-N 1 1 365.430 2.569 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000852514277 1006061574 /nfs/dbraw/zinc/06/15/74/1006061574.db2.gz DWGUQWLZYQUOCP-RTWAWAEBSA-N 1 1 369.465 2.877 20 5 FFBDMO COc1cc(N2CCN(C[C@H]3CCCC[N@H+]3C)CC2)c([N+](=O)[O-])cc1C ZINC000853296609 1006360688 /nfs/dbraw/zinc/36/06/88/1006360688.db2.gz OEYHTXDHSXCKLU-MRXNPFEDSA-N 1 1 362.474 2.518 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000853569742 1006449939 /nfs/dbraw/zinc/44/99/39/1006449939.db2.gz ARSSUAKCBWTVRW-UKRRQHHQSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000853569742 1006449952 /nfs/dbraw/zinc/44/99/52/1006449952.db2.gz ARSSUAKCBWTVRW-UKRRQHHQSA-N 1 1 361.398 2.741 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@H](C3CCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000853590793 1006463791 /nfs/dbraw/zinc/46/37/91/1006463791.db2.gz UYSKQWJOEOFCFO-HNNXBMFYSA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979961 1006585556 /nfs/dbraw/zinc/58/55/56/1006585556.db2.gz UNPWHQAFWPLAQZ-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979961 1006585563 /nfs/dbraw/zinc/58/55/63/1006585563.db2.gz UNPWHQAFWPLAQZ-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO CC(C)[C@@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000132523768 1006946270 /nfs/dbraw/zinc/94/62/70/1006946270.db2.gz NLHMQIRKGVXYBI-KRWDZBQOSA-N 1 1 363.414 2.587 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000855160980 1007142131 /nfs/dbraw/zinc/14/21/31/1007142131.db2.gz IEUGSOFFHXAYIE-GFCCVEGCSA-N 1 1 366.437 2.650 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000113438174 1007405964 /nfs/dbraw/zinc/40/59/64/1007405964.db2.gz RJFHZUVNQBPQBU-AWEZNQCLSA-N 1 1 364.402 2.806 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C ZINC000818165190 1007874910 /nfs/dbraw/zinc/87/49/10/1007874910.db2.gz QITKQRYFMXIDFF-XJKSGUPXSA-N 1 1 367.446 2.815 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000858780383 1008422760 /nfs/dbraw/zinc/42/27/60/1008422760.db2.gz OMPNTRDZAFDGFM-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000822088785 1008518387 /nfs/dbraw/zinc/51/83/87/1008518387.db2.gz GBRVKLPPMBCUSP-IPMKNSEASA-N 1 1 351.406 2.871 20 5 FFBDMO Cc1nn(CCC(=O)O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000117093820 1008757325 /nfs/dbraw/zinc/75/73/25/1008757325.db2.gz YFJISXPQTJBCSE-QGZVFWFLSA-N 1 1 372.425 2.616 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000886592842 1008763220 /nfs/dbraw/zinc/76/32/20/1008763220.db2.gz CIWNFSGPYYOWNM-CQSZACIVSA-N 1 1 372.425 2.651 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccccc1C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464230 1008998567 /nfs/dbraw/zinc/99/85/67/1008998567.db2.gz RFQDJWDEACIIPJ-RTBURBONSA-N 1 1 359.470 2.995 20 5 FFBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860751904 1009137216 /nfs/dbraw/zinc/13/72/16/1009137216.db2.gz JJBOOSVXABCACZ-FZNQNYSPSA-N 1 1 356.378 2.768 20 5 FFBDMO Nc1ccc(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000824008625 1009291176 /nfs/dbraw/zinc/29/11/76/1009291176.db2.gz RVEQCEHWIDXWPG-OAHLLOKOSA-N 1 1 355.398 2.573 20 5 FFBDMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861825785 1009573497 /nfs/dbraw/zinc/57/34/97/1009573497.db2.gz YLUHYBVXRWERTG-MOPGFXCFSA-N 1 1 369.421 2.683 20 5 FFBDMO Cc1cc(F)cc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)c1[N+](=O)[O-] ZINC000794562718 1010334783 /nfs/dbraw/zinc/33/47/83/1010334783.db2.gz ADWQKRIHKHBTHG-MRXNPFEDSA-N 1 1 373.384 2.861 20 5 FFBDMO Cn1cc([C@@H](O)C[C@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000865650286 1010835787 /nfs/dbraw/zinc/83/57/87/1010835787.db2.gz BDCCKEMGXVAXHG-KUHUBIRLSA-N 1 1 367.409 2.969 20 5 FFBDMO C[C@@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000865697264 1010844599 /nfs/dbraw/zinc/84/45/99/1010844599.db2.gz VKDXAVVWARTBJL-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCc2c(F)ccc(F)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000867946398 1011127825 /nfs/dbraw/zinc/12/78/25/1011127825.db2.gz QBTSCJLUEJPGOX-GOSISDBHSA-N 1 1 361.348 2.632 20 5 FFBDMO COc1ccc(CCCN(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867954395 1011130591 /nfs/dbraw/zinc/13/05/91/1011130591.db2.gz MROGNEKWCFSRPA-FQEVSTJZSA-N 1 1 371.437 2.869 20 5 FFBDMO Cc1ccc(CNC(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000869055867 1011590110 /nfs/dbraw/zinc/59/01/10/1011590110.db2.gz XPMLSFBZPRIFTM-QGZVFWFLSA-N 1 1 360.458 2.824 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@]1(C)O ZINC001173009260 1012176406 /nfs/dbraw/zinc/17/64/06/1012176406.db2.gz ANYPJDBSCVRIHW-KZULUSFZSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC[C@@H]1O ZINC001173009936 1012179039 /nfs/dbraw/zinc/17/90/39/1012179039.db2.gz KHCVIHFETVZBEJ-SJCJKPOMSA-N 1 1 369.412 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@]34CCOC4)CC2)c(F)c1 ZINC001173017429 1012189270 /nfs/dbraw/zinc/18/92/70/1012189270.db2.gz DWFPVDDGIMWCGP-KRWDZBQOSA-N 1 1 353.369 2.707 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000018091342 1012245289 /nfs/dbraw/zinc/24/52/89/1012245289.db2.gz AWSGVDYCADLKQS-UHFFFAOYSA-N 1 1 372.381 2.755 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@@](O)(CF)C2)c1F ZINC001173180366 1012325114 /nfs/dbraw/zinc/32/51/14/1012325114.db2.gz KDXKJIGCXIUXKB-SJKOYZFVSA-N 1 1 358.385 2.860 20 5 FFBDMO CCn1ncc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C ZINC000870376530 1012341388 /nfs/dbraw/zinc/34/13/88/1012341388.db2.gz AZWKMZKSRWCVIY-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO CCn1ncc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C ZINC000870376530 1012341414 /nfs/dbraw/zinc/34/14/14/1012341414.db2.gz AZWKMZKSRWCVIY-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173220752 1012350778 /nfs/dbraw/zinc/35/07/78/1012350778.db2.gz CDCGTHDLOJNRSX-FFZOFVMBSA-N 1 1 366.465 2.985 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173227231 1012361635 /nfs/dbraw/zinc/36/16/35/1012361635.db2.gz UELNFKBLEMRCFA-RHSMWYFYSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1ncc2c1[C@@H](COC)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173227233 1012362351 /nfs/dbraw/zinc/36/23/51/1012362351.db2.gz UELNFKBLEMRCFA-WMLDXEAASA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2ccccn2)C1 ZINC001173237414 1012381662 /nfs/dbraw/zinc/38/16/62/1012381662.db2.gz JEWBJWPZLKOBFC-DOTOQJQBSA-N 1 1 368.437 2.815 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000871283973 1012823434 /nfs/dbraw/zinc/82/34/34/1012823434.db2.gz JOCYHFMFICWPOX-KRWDZBQOSA-N 1 1 369.421 2.534 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000871283973 1012823452 /nfs/dbraw/zinc/82/34/52/1012823452.db2.gz JOCYHFMFICWPOX-KRWDZBQOSA-N 1 1 369.421 2.534 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000748349977 1017120677 /nfs/dbraw/zinc/12/06/77/1017120677.db2.gz MEJDPQAIMQAECL-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000748349977 1017120684 /nfs/dbraw/zinc/12/06/84/1017120684.db2.gz MEJDPQAIMQAECL-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CCCC1CCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291114 1017270169 /nfs/dbraw/zinc/27/01/69/1017270169.db2.gz KKEADMVLUQNXBK-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](CCCC1CCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291114 1017270175 /nfs/dbraw/zinc/27/01/75/1017270175.db2.gz KKEADMVLUQNXBK-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CCCC1CCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291114 1017270185 /nfs/dbraw/zinc/27/01/85/1017270185.db2.gz KKEADMVLUQNXBK-WOJBJXKFSA-N 1 1 371.481 2.906 20 5 FFBDMO CCC(CC)C[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001051291051 1017270794 /nfs/dbraw/zinc/27/07/94/1017270794.db2.gz IUPCWFILXZMEHE-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CCC(CC)C[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291051 1017270809 /nfs/dbraw/zinc/27/08/09/1017270809.db2.gz IUPCWFILXZMEHE-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CCC(CC)C[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291051 1017270826 /nfs/dbraw/zinc/27/08/26/1017270826.db2.gz IUPCWFILXZMEHE-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106423 1018368047 /nfs/dbraw/zinc/36/80/47/1018368047.db2.gz ZYQXAIWJOWYFMI-PBHICJAKSA-N 1 1 363.458 2.897 20 5 FFBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000927106423 1018368062 /nfs/dbraw/zinc/36/80/62/1018368062.db2.gz ZYQXAIWJOWYFMI-PBHICJAKSA-N 1 1 363.458 2.897 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)CC[C@@H](O)c1ccccc1 ZINC000930353089 1019992309 /nfs/dbraw/zinc/99/23/09/1019992309.db2.gz GUUZMJKYGOZIGJ-WOJBJXKFSA-N 1 1 358.438 2.944 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C[C@@H](C(C)C)N2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC000903064941 1020659992 /nfs/dbraw/zinc/65/99/92/1020659992.db2.gz CBIGZESDGKLCQW-KXBFYZLASA-N 1 1 364.490 2.526 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H]([C@@]3(C)COC(=O)N3)C2)ccc1[N+](=O)[O-] ZINC000932018126 1020668897 /nfs/dbraw/zinc/66/88/97/1020668897.db2.gz ACKAJDCFKUINGD-KBXCAEBGSA-N 1 1 363.414 2.704 20 5 FFBDMO O=C([C@@H]1CC[C@H]2CCCC[N@H+]21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000900880323 1020696842 /nfs/dbraw/zinc/69/68/42/1020696842.db2.gz HMIUTHGGCCPKSK-BEFAXECRSA-N 1 1 373.453 2.982 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000778300982 1021559356 /nfs/dbraw/zinc/55/93/56/1021559356.db2.gz ZRPXAYYXCIJXBA-AWEZNQCLSA-N 1 1 367.396 2.877 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000156013618 1022314080 /nfs/dbraw/zinc/31/40/80/1022314080.db2.gz NCYMTMWQFOQITJ-ZDUSSCGKSA-N 1 1 364.402 2.662 20 5 FFBDMO CCc1cccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c1 ZINC001040700573 1022954524 /nfs/dbraw/zinc/95/45/24/1022954524.db2.gz NFTLRUDPHQTIRD-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO COCC[N@@H+](CN1CCN(c2ccccc2[N+](=O)[O-])C1=O)C1CCCC1 ZINC000752788276 1023203821 /nfs/dbraw/zinc/20/38/21/1023203821.db2.gz GDCQOICKEMOBAM-UHFFFAOYSA-N 1 1 362.430 2.685 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@@]3(CCCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752790721 1023205625 /nfs/dbraw/zinc/20/56/25/1023205625.db2.gz BUJNAXSYFSRDJU-LJQANCHMSA-N 1 1 374.441 2.687 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@]3(CCCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752790721 1023205632 /nfs/dbraw/zinc/20/56/32/1023205632.db2.gz BUJNAXSYFSRDJU-LJQANCHMSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351110 1033114363 /nfs/dbraw/zinc/11/43/63/1033114363.db2.gz TZBSJMTUJHLVIZ-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351110 1033114372 /nfs/dbraw/zinc/11/43/72/1033114372.db2.gz TZBSJMTUJHLVIZ-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC(C)=O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000753191668 1023284648 /nfs/dbraw/zinc/28/46/48/1023284648.db2.gz QHLHWQRRPAODMV-UHFFFAOYSA-N 1 1 374.340 2.732 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]CC/C=C\c1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001121087629 1023598806 /nfs/dbraw/zinc/59/88/06/1023598806.db2.gz QRMICJWJSRSQKB-RIXWUPICSA-N 1 1 369.465 2.772 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000757732724 1023853788 /nfs/dbraw/zinc/85/37/88/1023853788.db2.gz KILGTARVSSKENH-UHFFFAOYSA-N 1 1 357.370 2.529 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)[C@@H]2C1 ZINC001123705342 1023949924 /nfs/dbraw/zinc/94/99/24/1023949924.db2.gz MLSLFPTUOFHCQX-QGTPRVQTSA-N 1 1 358.442 2.609 20 5 FFBDMO CC[C@H]1CN(Cn2nc(C)c([N+](=O)[O-])c2C)CC[N@H+]1Cc1ccccc1 ZINC000758969482 1024401730 /nfs/dbraw/zinc/40/17/30/1024401730.db2.gz BMXDVQVULOKVDP-SFHVURJKSA-N 1 1 357.458 2.962 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000079945142 1024422308 /nfs/dbraw/zinc/42/23/08/1024422308.db2.gz BXUXZKUKBQEZPH-RHSMWYFYSA-N 1 1 368.437 2.960 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000838139391 1026224515 /nfs/dbraw/zinc/22/45/15/1026224515.db2.gz PNSFCBUBRXUIFJ-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000246999955 1026608833 /nfs/dbraw/zinc/60/88/33/1026608833.db2.gz KQBAMIQRLUYGQL-ZWKOTPCHSA-N 1 1 355.442 2.735 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C12CCC2 ZINC000840140141 1026980480 /nfs/dbraw/zinc/98/04/80/1026980480.db2.gz MFGKZCZRBIYKIO-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840159739 1026992090 /nfs/dbraw/zinc/99/20/90/1026992090.db2.gz KYDAZKBWFVRVGN-SFHVURJKSA-N 1 1 360.414 2.956 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000840159739 1026992096 /nfs/dbraw/zinc/99/20/96/1026992096.db2.gz KYDAZKBWFVRVGN-SFHVURJKSA-N 1 1 360.414 2.956 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@@H]2CCc3ccccc3[C@@H]2O)ncc1[N+](=O)[O-] ZINC001158684174 1027093964 /nfs/dbraw/zinc/09/39/64/1027093964.db2.gz NGSBZRDIKPFMPX-HBTVWZBFSA-N 1 1 354.410 2.982 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)nn1 ZINC001160732625 1027840184 /nfs/dbraw/zinc/84/01/84/1027840184.db2.gz QYJMHNDMPCUOBY-WMZOPIPTSA-N 1 1 369.425 2.717 20 5 FFBDMO COc1c([N+](=O)[O-])cc(Cl)c(C)c1NCCC[NH+]1CCN(C)CC1 ZINC001161709717 1028291575 /nfs/dbraw/zinc/29/15/75/1028291575.db2.gz FRWRFRMWTGMXET-UHFFFAOYSA-N 1 1 356.854 2.615 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CC1=CCCCC1)CC2 ZINC000957547551 1028324939 /nfs/dbraw/zinc/32/49/39/1028324939.db2.gz ILQBFGGUSSJVRH-QZTJIDSGSA-N 1 1 361.486 2.857 20 5 FFBDMO CCCCCC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162810837 1028664694 /nfs/dbraw/zinc/66/46/94/1028664694.db2.gz RMFWAAFCQLPRKU-RTBURBONSA-N 1 1 361.486 2.893 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCC[C@H]2CCNCC2(F)F)ncc1[N+](=O)[O-] ZINC001162812552 1028667008 /nfs/dbraw/zinc/66/70/08/1028667008.db2.gz MTYAYRFRKAQUCT-OQHXTRMZSA-N 1 1 355.389 2.569 20 5 FFBDMO Cc1cc(N2CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C2)nc2ccc([N+](=O)[O-])cc12 ZINC001163117097 1028806112 /nfs/dbraw/zinc/80/61/12/1028806112.db2.gz BJJZBYFIFKFDLH-QGZVFWFLSA-N 1 1 372.425 2.557 20 5 FFBDMO COc1nc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001156314327 1029139631 /nfs/dbraw/zinc/13/96/31/1029139631.db2.gz FWWKPOVBHCCGQM-ARFHVFGLSA-N 1 1 369.425 2.716 20 5 FFBDMO COc1ncc([N+](=O)[O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164486406 1029293674 /nfs/dbraw/zinc/29/36/74/1029293674.db2.gz NXIBBNPFEFKSLE-HRCADAONSA-N 1 1 369.425 2.716 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(C(F)F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494551 1029297235 /nfs/dbraw/zinc/29/72/35/1029297235.db2.gz LTZHYBCLHIHSMV-HUUCEWRRSA-N 1 1 367.396 2.666 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ccc3[nH]cc([N+](=O)[O-])c3n2)CC1 ZINC001165112357 1029400154 /nfs/dbraw/zinc/40/01/54/1029400154.db2.gz ZNEFNPZTLFQFIQ-AWEZNQCLSA-N 1 1 359.430 2.551 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001156965346 1029424673 /nfs/dbraw/zinc/42/46/73/1029424673.db2.gz VCOAFXKLXHVHDV-INIZCTEOSA-N 1 1 369.425 2.732 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001142303916 1030289040 /nfs/dbraw/zinc/28/90/40/1030289040.db2.gz WQFDCPSJKCYXSA-PWSUYJOCSA-N 1 1 363.805 2.537 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000799153844 1031669434 /nfs/dbraw/zinc/66/94/34/1031669434.db2.gz AXONWFPFLWTVEB-QRVDHSFSSA-N 1 1 373.457 2.867 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(F)c(F)c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530624 1031787768 /nfs/dbraw/zinc/78/77/68/1031787768.db2.gz HVTRENWHCPEADH-CZUORRHYSA-N 1 1 367.396 2.539 20 5 FFBDMO Cc1nn(CN2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c(C)c1[N+](=O)[O-] ZINC000799941734 1031929843 /nfs/dbraw/zinc/92/98/43/1031929843.db2.gz CSSQNRYGNWLLNU-HNNXBMFYSA-N 1 1 358.446 2.778 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001151431145 1031953275 /nfs/dbraw/zinc/95/32/75/1031953275.db2.gz UZEWEWCPRNCFNS-UHFFFAOYSA-N 1 1 367.409 2.997 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC001151458912 1031960611 /nfs/dbraw/zinc/96/06/11/1031960611.db2.gz PAVLPLGIERSXRK-UHFFFAOYSA-N 1 1 351.406 2.861 20 5 FFBDMO COC(=O)Nc1cccc(C[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])c1 ZINC001205745261 1031969846 /nfs/dbraw/zinc/96/98/46/1031969846.db2.gz YCQUABOMOFDWLI-UHFFFAOYSA-N 1 1 361.354 2.777 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001219317467 1033597012 /nfs/dbraw/zinc/59/70/12/1033597012.db2.gz BOBYUWMAALBCJQ-CYBMUJFWSA-N 1 1 350.419 2.988 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c([N+](=O)[O-])c1 ZINC001219572201 1033697145 /nfs/dbraw/zinc/69/71/45/1033697145.db2.gz GNTRKNGYIJMQKI-CYBMUJFWSA-N 1 1 350.419 2.797 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccccc12)N[C@H]1CCC[N@H+](CCCO)C1 ZINC001220437514 1034177217 /nfs/dbraw/zinc/17/72/17/1034177217.db2.gz DIPRONZYWOAIMA-AWEZNQCLSA-N 1 1 372.425 2.716 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225658308 1034353652 /nfs/dbraw/zinc/35/36/52/1034353652.db2.gz FAEIKPCBFNXATJ-DRCTWCGVSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3ccc(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225658308 1034353663 /nfs/dbraw/zinc/35/36/63/1034353663.db2.gz FAEIKPCBFNXATJ-DRCTWCGVSA-N 1 1 355.188 2.540 20 5 FFBDMO CC[N@@H+]1CC[C@H](Oc2ccc([N+](=O)[O-])cc2I)C1 ZINC001226034394 1034499173 /nfs/dbraw/zinc/49/91/73/1034499173.db2.gz UAZAONURWFOJHB-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2ccc([N+](=O)[O-])cc2I)C1 ZINC001226034394 1034499174 /nfs/dbraw/zinc/49/91/74/1034499174.db2.gz UAZAONURWFOJHB-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C2 ZINC001226061011 1034509033 /nfs/dbraw/zinc/50/90/33/1034509033.db2.gz CSLIBGHIGTXZTE-NHAGDIPZSA-N 1 1 368.455 2.781 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001221093093 1034542505 /nfs/dbraw/zinc/54/25/05/1034542505.db2.gz PCAYTMYQTPBSFS-SFHVURJKSA-N 1 1 368.437 2.977 20 5 FFBDMO C[C@@H](c1ccccn1)[N@@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111660 1034938909 /nfs/dbraw/zinc/93/89/09/1034938909.db2.gz PUWPBLMGGHSKQI-JSGCOSHPSA-N 1 1 373.369 2.897 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111660 1034938922 /nfs/dbraw/zinc/93/89/22/1034938922.db2.gz PUWPBLMGGHSKQI-JSGCOSHPSA-N 1 1 373.369 2.897 20 5 FFBDMO CCOCOc1ccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000835057727 1035494384 /nfs/dbraw/zinc/49/43/84/1035494384.db2.gz FLYOMFWNXJEYHA-UHFFFAOYSA-N 1 1 372.425 2.685 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc(OC(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001227603823 1035633352 /nfs/dbraw/zinc/63/33/52/1035633352.db2.gz LLFDQOGFZNYMCT-LLVKDONJSA-N 1 1 350.293 2.593 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001203067777 1036175139 /nfs/dbraw/zinc/17/51/39/1036175139.db2.gz NKQWQZWPUKKNRV-HNNXBMFYSA-N 1 1 361.446 2.639 20 5 FFBDMO Cc1nc(O[C@@H]2CCc3[nH+]ccn3C2)c(Br)cc1[N+](=O)[O-] ZINC001228623357 1036213870 /nfs/dbraw/zinc/21/38/70/1036213870.db2.gz OTJQMXBRCZWBME-SECBINFHSA-N 1 1 353.176 2.651 20 5 FFBDMO COC(=O)c1c(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC001229050062 1036473201 /nfs/dbraw/zinc/47/32/01/1036473201.db2.gz SLMLKCQKPCXLAX-ZIAGYGMSSA-N 1 1 371.393 2.991 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229375860 1036637978 /nfs/dbraw/zinc/63/79/78/1036637978.db2.gz OOFZGKKGKNISQG-SWLSCSKDSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375860 1036637984 /nfs/dbraw/zinc/63/79/84/1036637984.db2.gz OOFZGKKGKNISQG-SWLSCSKDSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375860 1036637992 /nfs/dbraw/zinc/63/79/92/1036637992.db2.gz OOFZGKKGKNISQG-SWLSCSKDSA-N 1 1 358.398 2.688 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC001536675927 1070034411 /nfs/dbraw/zinc/03/44/11/1070034411.db2.gz MMOSIVGRVNGIJV-MRXNPFEDSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3cc(N4CCCCC4)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001234364960 1037007337 /nfs/dbraw/zinc/00/73/37/1037007337.db2.gz YNLMMKHKSUFHHL-YJLNNSPDSA-N 1 1 359.426 2.768 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cc(N4CCCCC4)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001234364960 1037007356 /nfs/dbraw/zinc/00/73/56/1037007356.db2.gz YNLMMKHKSUFHHL-YJLNNSPDSA-N 1 1 359.426 2.768 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3nccc4c3cccc4[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001234677285 1037137362 /nfs/dbraw/zinc/13/73/62/1037137362.db2.gz TYTHWVLGTKQLOL-UHIXZJCNSA-N 1 1 371.393 2.689 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2nc3c(s2)C[N@H+](C(C)C)CC3)n1 ZINC001536972791 1070094481 /nfs/dbraw/zinc/09/44/81/1070094481.db2.gz UPVVPVOZHNQFTR-UHFFFAOYSA-N 1 1 361.427 2.774 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2nc3c(s2)C[N@@H+](C(C)C)CC3)n1 ZINC001536972791 1070094493 /nfs/dbraw/zinc/09/44/93/1070094493.db2.gz UPVVPVOZHNQFTR-UHFFFAOYSA-N 1 1 361.427 2.774 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H]4OC[C@@H](C)[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100885 1038384272 /nfs/dbraw/zinc/38/42/72/1038384272.db2.gz SKTNJTPYVZLHES-VVFCZOMOSA-N 1 1 361.442 2.539 20 5 FFBDMO CC[N@@H+](CCn1ccnc1)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256101640 1038387050 /nfs/dbraw/zinc/38/70/50/1038387050.db2.gz QFSVQIQEQAIWLO-UHFFFAOYSA-N 1 1 373.457 2.791 20 5 FFBDMO CCN1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)C[C@H]1C ZINC001256102759 1038387861 /nfs/dbraw/zinc/38/78/61/1038387861.db2.gz HOURZDULTOYCJY-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO CC[N@@H+]1CCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)C[C@H]1C ZINC001256102759 1038387873 /nfs/dbraw/zinc/38/78/73/1038387873.db2.gz HOURZDULTOYCJY-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO CC[N@H+]1CCN(C2CCN(c3ccc([N+](=O)[O-])c(OC)c3)CC2)C[C@H]1C ZINC001256102759 1038387884 /nfs/dbraw/zinc/38/78/84/1038387884.db2.gz HOURZDULTOYCJY-OAHLLOKOSA-N 1 1 362.474 2.598 20 5 FFBDMO C[C@H]1CC[C@@H](C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)NC1 ZINC001246108303 1039245785 /nfs/dbraw/zinc/24/57/85/1039245785.db2.gz UVYGIGRMYHQSQD-JSGCOSHPSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@H]1CC[C@@H](CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[NH2+]C1 ZINC001246108303 1039245799 /nfs/dbraw/zinc/24/57/99/1039245799.db2.gz UVYGIGRMYHQSQD-JSGCOSHPSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@@H]1CC[C@H](CN)[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569324 1039401643 /nfs/dbraw/zinc/40/16/43/1039401643.db2.gz OTIWZJASLGSYQN-TZMCWYRMSA-N 1 1 368.428 2.901 20 5 FFBDMO C[C@@H]1CC[C@H](CN)[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569324 1039401646 /nfs/dbraw/zinc/40/16/46/1039401646.db2.gz OTIWZJASLGSYQN-TZMCWYRMSA-N 1 1 368.428 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H](N1CCOC[C@]3(CCC[NH2+]C3)C1)CC2 ZINC001246633200 1039421846 /nfs/dbraw/zinc/42/18/46/1039421846.db2.gz FBRQXYUKSPNGEI-ICSRJNTNSA-N 1 1 359.470 2.544 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001246898303 1039525138 /nfs/dbraw/zinc/52/51/38/1039525138.db2.gz YIVGWNOLHRKMLZ-GVDBMIGSSA-N 1 1 357.571 2.798 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001246898303 1039525148 /nfs/dbraw/zinc/52/51/48/1039525148.db2.gz YIVGWNOLHRKMLZ-GVDBMIGSSA-N 1 1 357.571 2.798 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(Nc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001253419402 1040166771 /nfs/dbraw/zinc/16/67/71/1040166771.db2.gz WPXOLJKTTBSZNF-UHFFFAOYSA-N 1 1 354.410 2.770 20 5 FFBDMO CC(=O)N1CCC([N@H+](C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254479527 1040745239 /nfs/dbraw/zinc/74/52/39/1040745239.db2.gz DKOMVRSWNVMULZ-UHFFFAOYSA-N 1 1 360.458 2.506 20 5 FFBDMO COC(=O)[C@@H]1C[C@H]2C[C@@H](C1)[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254481667 1040748315 /nfs/dbraw/zinc/74/83/15/1040748315.db2.gz YDRXKBPOQRXLNV-KHYOSLBOSA-N 1 1 373.453 2.837 20 5 FFBDMO CCn1ncc2c1[C@H](COC)C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254562211 1040800461 /nfs/dbraw/zinc/80/04/61/1040800461.db2.gz PKEIBMREPOFLGQ-PBHICJAKSA-N 1 1 358.442 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1C[C@H]3CN(Cc4nccs4)C[C@H]3C1)C2 ZINC001254594307 1040821765 /nfs/dbraw/zinc/82/17/65/1040821765.db2.gz DGCVBYUSYZJILB-SOLBZPMBSA-N 1 1 370.478 2.582 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cnn(CC)c21 ZINC001254594261 1040822584 /nfs/dbraw/zinc/82/25/84/1040822584.db2.gz CQTRVZGFUAQVAC-IEBWSBKVSA-N 1 1 370.453 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(CCc3cccs3)CC1)C2 ZINC001254601205 1040832385 /nfs/dbraw/zinc/83/23/85/1040832385.db2.gz VSZUGJQZDYQEOS-SFHVURJKSA-N 1 1 357.479 2.984 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254610636 1040839114 /nfs/dbraw/zinc/83/91/14/1040839114.db2.gz LWUUXAVMBHRENC-DJIMGWMZSA-N 1 1 359.426 2.613 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3c(F)ccc([N+](=O)[O-])c3F)c2C(N)=O)C1 ZINC001215285751 1041725575 /nfs/dbraw/zinc/72/55/75/1041725575.db2.gz XXYNRFKZSVFIRV-UHFFFAOYSA-N 1 1 368.365 2.765 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3c(F)ccc([N+](=O)[O-])c3F)c2C(N)=O)C1 ZINC001215285751 1041725582 /nfs/dbraw/zinc/72/55/82/1041725582.db2.gz XXYNRFKZSVFIRV-UHFFFAOYSA-N 1 1 368.365 2.765 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC001318694617 1044812162 /nfs/dbraw/zinc/81/21/62/1044812162.db2.gz MLKBDPAJOYEWOV-KRWDZBQOSA-N 1 1 354.410 2.944 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC001318786156 1044877230 /nfs/dbraw/zinc/87/72/30/1044877230.db2.gz ZLQQKPFIQURQHX-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC001318786156 1044877251 /nfs/dbraw/zinc/87/72/51/1044877251.db2.gz ZLQQKPFIQURQHX-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC001319315927 1045107534 /nfs/dbraw/zinc/10/75/34/1045107534.db2.gz SIISTEIJNOOBJV-CYBMUJFWSA-N 1 1 357.410 2.765 20 5 FFBDMO Cc1nc(NCc2cccc(C[NH+]3CCN(C)CC3)c2)ccc1[N+](=O)[O-] ZINC001319654035 1045228788 /nfs/dbraw/zinc/22/87/88/1045228788.db2.gz CGGWNYYKWISDPW-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)cc1 ZINC001320887276 1045488352 /nfs/dbraw/zinc/48/83/52/1045488352.db2.gz BOPSFMMYMNNIRX-GJZGRUSLSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@@H]3CCCC[C@H]3C2)cc1 ZINC001320887276 1045488355 /nfs/dbraw/zinc/48/83/55/1045488355.db2.gz BOPSFMMYMNNIRX-GJZGRUSLSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1cnn(CCSCc2ccc(C[NH+]3CCOCC3)cc2)c1 ZINC001325419054 1046501913 /nfs/dbraw/zinc/50/19/13/1046501913.db2.gz GVNNLNJTKFBGQD-UHFFFAOYSA-N 1 1 362.455 2.557 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC001325874430 1046670854 /nfs/dbraw/zinc/67/08/54/1046670854.db2.gz PSSGMDGXGFYNIE-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC001333317010 1048832487 /nfs/dbraw/zinc/83/24/87/1048832487.db2.gz QWBYEKFENOPYGO-ZBFHGGJFSA-N 1 1 372.450 2.814 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2nccs2)C1 ZINC001333317010 1048832512 /nfs/dbraw/zinc/83/25/12/1048832512.db2.gz QWBYEKFENOPYGO-ZBFHGGJFSA-N 1 1 372.450 2.814 20 5 FFBDMO CCc1nnc(N(C)CCc2ccccc2[N+](=O)[O-])n1CC[N@@H+](C)C(C)C ZINC001292860783 1049419701 /nfs/dbraw/zinc/41/97/01/1049419701.db2.gz RIDQTZFZPRJIAI-UHFFFAOYSA-N 1 1 374.489 2.768 20 5 FFBDMO Cn1c(Cc2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001339750864 1050171802 /nfs/dbraw/zinc/17/18/02/1050171802.db2.gz SJHVGWZJXVSKTC-UHFFFAOYSA-N 1 1 372.473 2.625 20 5 FFBDMO CC(C)n1ccc(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC001343371727 1052189601 /nfs/dbraw/zinc/18/96/01/1052189601.db2.gz PQJZTVSZKBDAMQ-SFHVURJKSA-N 1 1 372.425 2.732 20 5 FFBDMO CC(C)n1ccc(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC001343371727 1052189606 /nfs/dbraw/zinc/18/96/06/1052189606.db2.gz PQJZTVSZKBDAMQ-SFHVURJKSA-N 1 1 372.425 2.732 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)OCCO1 ZINC001307600442 1052325441 /nfs/dbraw/zinc/32/54/41/1052325441.db2.gz BRTLBKBUTFIUCU-CYBMUJFWSA-N 1 1 374.397 2.620 20 5 FFBDMO CCOC(=O)c1cnn2cc(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])cnc12 ZINC001308928269 1052521064 /nfs/dbraw/zinc/52/10/64/1052521064.db2.gz GGLZQKRGRKYNFU-LBPRGKRZSA-N 1 1 369.381 2.665 20 5 FFBDMO Nc1c(NC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC001347391923 1053927043 /nfs/dbraw/zinc/92/70/43/1053927043.db2.gz PHIPKYDRLJRHLV-LLVKDONJSA-N 1 1 353.810 2.532 20 5 FFBDMO Cc1c(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cnn1-c1cc[nH+]cc1 ZINC001337239083 1054588571 /nfs/dbraw/zinc/58/85/71/1054588571.db2.gz LLSGIGWZEDBKQC-UHFFFAOYSA-N 1 1 366.333 2.524 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@@H]1C ZINC001300086832 1055722083 /nfs/dbraw/zinc/72/20/83/1055722083.db2.gz LQKGWPFGWQAFNH-DTORHVGOSA-N 1 1 358.801 2.524 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3csc([N+](=O)[O-])c3)n2C)[C@@H](C)C1 ZINC001339521495 1056545126 /nfs/dbraw/zinc/54/51/26/1056545126.db2.gz LTBFBADJWVICDT-WCQYABFASA-N 1 1 364.475 2.618 20 5 FFBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC001339549717 1056573283 /nfs/dbraw/zinc/57/32/83/1056573283.db2.gz OVXYLYOMXYTRFU-CYBMUJFWSA-N 1 1 373.461 2.512 20 5 FFBDMO O=C(c1[nH]nc([N+](=O)[O-])c1Cl)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001545062680 1071728957 /nfs/dbraw/zinc/72/89/57/1071728957.db2.gz NHBYURHBXGDUMU-UHFFFAOYSA-N 1 1 369.853 2.700 20 5 FFBDMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc21)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001451468547 1059118450 /nfs/dbraw/zinc/11/84/50/1059118450.db2.gz GWSIMFLSMVBCDM-GOSISDBHSA-N 1 1 350.378 2.863 20 5 FFBDMO CNc1c(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001454293108 1059489425 /nfs/dbraw/zinc/48/94/25/1059489425.db2.gz NEDGTDDHRLLZHG-HOTGVXAUSA-N 1 1 366.421 2.735 20 5 FFBDMO CNc1c(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001454293108 1059489435 /nfs/dbraw/zinc/48/94/35/1059489435.db2.gz NEDGTDDHRLLZHG-HOTGVXAUSA-N 1 1 366.421 2.735 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C[C@@H]1C ZINC001520580858 1059828725 /nfs/dbraw/zinc/82/87/25/1059828725.db2.gz QZNSHTIHZBWFSC-STQMWFEESA-N 1 1 356.426 2.885 20 5 FFBDMO CCCNC(=O)C1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848476306 1060096637 /nfs/dbraw/zinc/09/66/37/1060096637.db2.gz ZGTBAVFOAJHJLI-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO CC[N@H+](CCc1nccs1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848482272 1060116372 /nfs/dbraw/zinc/11/63/72/1060116372.db2.gz KXFASTQGMFVSSQ-MRXNPFEDSA-N 1 1 374.466 2.889 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848482272 1060116380 /nfs/dbraw/zinc/11/63/80/1060116380.db2.gz KXFASTQGMFVSSQ-MRXNPFEDSA-N 1 1 374.466 2.889 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000848481748 1060116894 /nfs/dbraw/zinc/11/68/94/1060116894.db2.gz CQRJQHWOQYASOZ-HKUYNNGSSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000848487868 1060139040 /nfs/dbraw/zinc/13/90/40/1060139040.db2.gz ZOZDAFMXQXSFDM-KSZLIROESA-N 1 1 359.426 2.512 20 5 FFBDMO C[C@]12CC[N@H+](CN3CC[C@@H](c4ccc([N+](=O)[O-])cc4)C3=O)C[C@H]1C2(F)F ZINC000848491874 1060150723 /nfs/dbraw/zinc/15/07/23/1060150723.db2.gz ZLVZZKBFMIAAOL-UXLLHSPISA-N 1 1 365.380 2.845 20 5 FFBDMO C[C@]12CC[N@@H+](CN3CC[C@@H](c4ccc([N+](=O)[O-])cc4)C3=O)C[C@H]1C2(F)F ZINC000848491874 1060150729 /nfs/dbraw/zinc/15/07/29/1060150729.db2.gz ZLVZZKBFMIAAOL-UXLLHSPISA-N 1 1 365.380 2.845 20 5 FFBDMO CCOC(=O)CC[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460247470 1060931061 /nfs/dbraw/zinc/93/10/61/1060931061.db2.gz XYPPEAMBPHHAGP-UHFFFAOYSA-N 1 1 368.777 2.683 20 5 FFBDMO CCOC(=O)CC[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460247470 1060931080 /nfs/dbraw/zinc/93/10/80/1060931080.db2.gz XYPPEAMBPHHAGP-UHFFFAOYSA-N 1 1 368.777 2.683 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C ZINC001546421694 1061132879 /nfs/dbraw/zinc/13/28/79/1061132879.db2.gz OWXLWSNIFPEMBC-HNNXBMFYSA-N 1 1 372.473 2.869 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001546208134 1061309987 /nfs/dbraw/zinc/30/99/87/1061309987.db2.gz GMCQQGRNPUGWEX-ZBFHGGJFSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001462123325 1061509715 /nfs/dbraw/zinc/50/97/15/1061509715.db2.gz OFZXLWWROVHHNW-PBHICJAKSA-N 1 1 368.437 2.796 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1 ZINC001462174076 1061527293 /nfs/dbraw/zinc/52/72/93/1061527293.db2.gz MTXNBXZGPLPQHU-SFHVURJKSA-N 1 1 366.414 2.720 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)OCc1ccc([N+](=O)[O-])cc1Br ZINC001360522826 1061978119 /nfs/dbraw/zinc/97/81/19/1061978119.db2.gz MQFDTDOGOACIRT-UHFFFAOYSA-N 1 1 354.160 2.606 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001465900087 1063256481 /nfs/dbraw/zinc/25/64/81/1063256481.db2.gz NFOFCXZTVPPUMS-BZNIZROVSA-N 1 1 354.410 2.543 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001533530528 1063329683 /nfs/dbraw/zinc/32/96/83/1063329683.db2.gz FJVDKWSMTDXKLN-MRXNPFEDSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC001466389165 1063420375 /nfs/dbraw/zinc/42/03/75/1063420375.db2.gz QGYUZBMVUBEFFF-KOLCDFICSA-N 1 1 371.235 2.880 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC001466676405 1063517251 /nfs/dbraw/zinc/51/72/51/1063517251.db2.gz FSQGWQXMRQFHRD-AWEZNQCLSA-N 1 1 368.409 2.699 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001471030882 1064530528 /nfs/dbraw/zinc/53/05/28/1064530528.db2.gz OBGMUKUVZNQCOQ-ZBFHGGJFSA-N 1 1 368.437 2.675 20 5 FFBDMO C[N@H+](CCOCCNC(=O)OC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001473705262 1065326080 /nfs/dbraw/zinc/32/60/80/1065326080.db2.gz XSOXDGZKILBRST-UHFFFAOYSA-N 1 1 353.419 2.568 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001473705262 1065326085 /nfs/dbraw/zinc/32/60/85/1065326085.db2.gz XSOXDGZKILBRST-UHFFFAOYSA-N 1 1 353.419 2.568 20 5 FFBDMO CCC1(CC)CCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001473769553 1065352457 /nfs/dbraw/zinc/35/24/57/1065352457.db2.gz JSDLFEXLJOQEGS-UHFFFAOYSA-N 1 1 374.485 2.898 20 5 FFBDMO COc1cc(C[NH2+][C@H]2CCN(C(C)=O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC001474073974 1065452200 /nfs/dbraw/zinc/45/22/00/1065452200.db2.gz UXHLBZZONMKKAS-HNNXBMFYSA-N 1 1 371.393 2.897 20 5 FFBDMO CCOc1cc(NC(=O)[C@H]2[NH2+]CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC001578168538 1078446176 /nfs/dbraw/zinc/44/61/76/1078446176.db2.gz UKFDSOLDQKHNTD-KRWDZBQOSA-N 1 1 357.366 2.655 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)n1 ZINC001556897482 1075786839 /nfs/dbraw/zinc/78/68/39/1075786839.db2.gz LYDAPZQLQGEOOV-YOEHRIQHSA-N 1 1 354.410 2.691 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC001558399134 1075998360 /nfs/dbraw/zinc/99/83/60/1075998360.db2.gz KTPLGMHNCPNVBY-UHFFFAOYSA-N 1 1 358.398 2.963 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)Nc1cc(C)cc([N+](=O)[O-])c1 ZINC001558807976 1076080223 /nfs/dbraw/zinc/08/02/23/1076080223.db2.gz ZOVFETWYAYYCOB-UHFFFAOYSA-N 1 1 354.370 2.692 20 5 FFBDMO CCc1cc(N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559199995 1076134249 /nfs/dbraw/zinc/13/42/49/1076134249.db2.gz JGYRDIFVZMNFSN-PBHICJAKSA-N 1 1 353.426 2.755 20 5 FFBDMO CC(C)Oc1nc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001559223648 1076136628 /nfs/dbraw/zinc/13/66/28/1076136628.db2.gz IQVYGKFLQKMTII-MELADBBJSA-N 1 1 352.435 2.687 20 5 FFBDMO CC(C)Oc1nc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001559223648 1076136630 /nfs/dbraw/zinc/13/66/30/1076136630.db2.gz IQVYGKFLQKMTII-MELADBBJSA-N 1 1 352.435 2.687 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC001559616892 1076177623 /nfs/dbraw/zinc/17/76/23/1076177623.db2.gz SLMJSNPGLTWXIK-LBPRGKRZSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC001559616892 1076177626 /nfs/dbraw/zinc/17/76/26/1076177626.db2.gz SLMJSNPGLTWXIK-LBPRGKRZSA-N 1 1 354.370 2.748 20 5 FFBDMO COc1cc(C[NH2+]C2(C(=O)NCC(C)C)CCCC2)c([N+](=O)[O-])cc1F ZINC001559619351 1076177666 /nfs/dbraw/zinc/17/76/66/1076177666.db2.gz AZKRCSGSVHVSCQ-UHFFFAOYSA-N 1 1 367.421 2.917 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001560144985 1076234982 /nfs/dbraw/zinc/23/49/82/1076234982.db2.gz VZLPJXAZKFDTNE-HNNXBMFYSA-N 1 1 363.458 2.931 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(c2c[nH+]cn2C)CC1 ZINC001560232658 1076252852 /nfs/dbraw/zinc/25/28/52/1076252852.db2.gz CWPCQPKWLDCLNH-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001566364206 1076951206 /nfs/dbraw/zinc/95/12/06/1076951206.db2.gz IAQZXTFIVKSVRL-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ccc1[N+](=O)[O-] ZINC001569503339 1077150251 /nfs/dbraw/zinc/15/02/51/1077150251.db2.gz KRFCJNDUVOUGEE-DZFIZOCASA-N 1 1 351.406 2.763 20 5 FFBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589199159 1080413598 /nfs/dbraw/zinc/41/35/98/1080413598.db2.gz XNNKCTYSUVZHNX-LBPRGKRZSA-N 1 1 360.418 2.554 20 5 FFBDMO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001589277044 1080460442 /nfs/dbraw/zinc/46/04/42/1080460442.db2.gz PTWIIPGFABPDRF-CYBMUJFWSA-N 1 1 370.247 2.848 20 5 FFBDMO C[C@@H](Cc1cccs1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001589903151 1080852197 /nfs/dbraw/zinc/85/21/97/1080852197.db2.gz RVBQLPAAYQDZPV-NSHDSACASA-N 1 1 358.427 2.899 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC001590189951 1081078871 /nfs/dbraw/zinc/07/88/71/1081078871.db2.gz YAGNRZJZGSDGTN-BETUJISGSA-N 1 1 359.434 2.555 20 5 FFBDMO C[N@@H+]1CCc2[nH]c(=NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])sc2C1 ZINC000024152277 539726727 /nfs/dbraw/zinc/72/67/27/539726727.db2.gz PPFUWTHMTSVBDH-UHFFFAOYSA-N 1 1 352.803 2.945 20 5 FFBDMO C[N@H+]1CCc2[nH]c(=NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])sc2C1 ZINC000024152277 539726730 /nfs/dbraw/zinc/72/67/30/539726730.db2.gz PPFUWTHMTSVBDH-UHFFFAOYSA-N 1 1 352.803 2.945 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CSCC[N@@H+]2Cc2ccccc2)s1 ZINC000409651325 512116866 /nfs/dbraw/zinc/11/68/66/512116866.db2.gz KDHPSVFKYQGFQI-CYBMUJFWSA-N 1 1 350.469 2.503 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)s1 ZINC000409651325 512116869 /nfs/dbraw/zinc/11/68/69/512116869.db2.gz KDHPSVFKYQGFQI-CYBMUJFWSA-N 1 1 350.469 2.503 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](Cc2ccccc2C)CC1 ZINC000018110648 220223027 /nfs/dbraw/zinc/22/30/27/220223027.db2.gz XSJCJPVULKLAGR-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000026218833 249341107 /nfs/dbraw/zinc/34/11/07/249341107.db2.gz OLMJRTMSNPKHKT-AWEZNQCLSA-N 1 1 363.414 2.507 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[NH+]1CCCC1 ZINC000023982254 249335303 /nfs/dbraw/zinc/33/53/03/249335303.db2.gz SXFPXWPHSAFJDT-AWEZNQCLSA-N 1 1 359.382 2.763 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000093910858 250049873 /nfs/dbraw/zinc/04/98/73/250049873.db2.gz BXSWPSMBKSBMJC-INIZCTEOSA-N 1 1 363.458 2.607 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106891574 250296816 /nfs/dbraw/zinc/29/68/16/250296816.db2.gz DABJBDNIDGFLBM-GFCCVEGCSA-N 1 1 373.862 2.543 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000153326392 251125569 /nfs/dbraw/zinc/12/55/69/251125569.db2.gz UGCUCPJIVDHMLR-ZBFHGGJFSA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186839851 251272940 /nfs/dbraw/zinc/27/29/40/251272940.db2.gz QXIGGTSWCQTNML-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186839851 251272943 /nfs/dbraw/zinc/27/29/43/251272943.db2.gz QXIGGTSWCQTNML-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000267370873 251336493 /nfs/dbraw/zinc/33/64/93/251336493.db2.gz RTWQFHZLWGWJNU-OAHLLOKOSA-N 1 1 361.442 2.874 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N1CCN(C)CC1 ZINC000271135026 251712194 /nfs/dbraw/zinc/71/21/94/251712194.db2.gz MSXQGCZLWXDQID-JKSUJKDBSA-N 1 1 366.531 2.691 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@H]2C1 ZINC000272415049 252032257 /nfs/dbraw/zinc/03/22/57/252032257.db2.gz GAXDPHAGXPFEKE-HZMBPMFUSA-N 1 1 357.332 2.780 20 5 FFBDMO COc1cc(C[NH2+]CC(C)(C)N(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000272523952 252059885 /nfs/dbraw/zinc/05/98/85/252059885.db2.gz YONYNKRPNMEWOC-UHFFFAOYSA-N 1 1 361.389 2.677 20 5 FFBDMO CCc1ccc(-c2noc([C@@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)cc1 ZINC000273271912 252269904 /nfs/dbraw/zinc/26/99/04/252269904.db2.gz DXZSXCIUBFUPEI-GFCCVEGCSA-N 1 1 356.386 2.755 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2cnn(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000273439770 252307626 /nfs/dbraw/zinc/30/76/26/252307626.db2.gz ZGRXIFOVVWTMHW-SECBINFHSA-N 1 1 356.329 2.789 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275877061 256056128 /nfs/dbraw/zinc/05/61/28/256056128.db2.gz OOHXECGVWJDBFD-JOCQHMNTSA-N 1 1 374.384 2.983 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000276484010 256103893 /nfs/dbraw/zinc/10/38/93/256103893.db2.gz GKJLWXVMANCVKM-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278444845 256313505 /nfs/dbraw/zinc/31/35/05/256313505.db2.gz MGVNOFDRCSJHBT-UHFFFAOYSA-N 1 1 371.319 2.618 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279091002 256380360 /nfs/dbraw/zinc/38/03/60/256380360.db2.gz TVHDCXBDAGRJPU-UHFFFAOYSA-N 1 1 374.363 2.849 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1[C@@H]1CCCO1)Nc1cc([N+](=O)[O-])ccc1F ZINC000284656772 256941618 /nfs/dbraw/zinc/94/16/18/256941618.db2.gz GGFNXNNIDIKCNZ-HOTGVXAUSA-N 1 1 351.378 2.706 20 5 FFBDMO O=c1[nH]c(N2CCC[N@H+](C3CCCC3)CC2)nc2ccc([N+](=O)[O-])cc21 ZINC000287506776 257093020 /nfs/dbraw/zinc/09/30/20/257093020.db2.gz ZCFUEOZAMGZKBM-UHFFFAOYSA-N 1 1 357.414 2.698 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)CO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000289379033 257277702 /nfs/dbraw/zinc/27/77/02/257277702.db2.gz CDAFRQKZCITAFZ-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1cccc(F)c1[N+](=O)[O-] ZINC000301299650 258040580 /nfs/dbraw/zinc/04/05/80/258040580.db2.gz UHTLQJRNAJCPDW-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000301405508 258047956 /nfs/dbraw/zinc/04/79/56/258047956.db2.gz UHXAXXCVXJJYHP-UHFFFAOYSA-N 1 1 372.263 2.640 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@@H]1C[N@H+](C)CCO1 ZINC000302155650 258091450 /nfs/dbraw/zinc/09/14/50/258091450.db2.gz DYJRXTADKFBQJB-PBHICJAKSA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@@H]1C[N@@H+](C)CCO1 ZINC000302155650 258091453 /nfs/dbraw/zinc/09/14/53/258091453.db2.gz DYJRXTADKFBQJB-PBHICJAKSA-N 1 1 372.425 2.700 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000302754111 258109692 /nfs/dbraw/zinc/10/96/92/258109692.db2.gz IANAVANBXGVGQX-BBRMVZONSA-N 1 1 370.409 2.709 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000301871482 258072133 /nfs/dbraw/zinc/07/21/33/258072133.db2.gz KLDXLFRYXUQKOJ-GJZGRUSLSA-N 1 1 362.817 2.691 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[NH+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000330665764 258167772 /nfs/dbraw/zinc/16/77/72/258167772.db2.gz AETVVFHLPKEPHC-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330703742 258168811 /nfs/dbraw/zinc/16/88/11/258168811.db2.gz JIRFKMQMQMCWJK-WBVHZDCISA-N 1 1 363.458 2.961 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000332295279 258223796 /nfs/dbraw/zinc/22/37/96/258223796.db2.gz LYSFUHOOKXORCL-QWHCGFSZSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1C ZINC000332608923 258237153 /nfs/dbraw/zinc/23/71/53/258237153.db2.gz BEIAPZKVXFXAJR-DGCLKSJQSA-N 1 1 360.439 2.931 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(S(C)(=O)=O)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000409868800 512157965 /nfs/dbraw/zinc/15/79/65/512157965.db2.gz FVBHHDPKHRBURY-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000032254695 506237748 /nfs/dbraw/zinc/23/77/48/506237748.db2.gz ONRVRCBUKKZGNW-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000032254693 506238631 /nfs/dbraw/zinc/23/86/31/506238631.db2.gz ONRVRCBUKKZGNW-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000065142455 506263745 /nfs/dbraw/zinc/26/37/45/506263745.db2.gz RMFSSKJEIRHARO-GASCZTMLSA-N 1 1 363.458 2.846 20 5 FFBDMO Cc1noc(C)c1CN1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065544702 506321132 /nfs/dbraw/zinc/32/11/32/506321132.db2.gz CJILEPKLCBZQDN-UHFFFAOYSA-N 1 1 374.441 2.786 20 5 FFBDMO COC[C@@H]1CCCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000375115009 512169643 /nfs/dbraw/zinc/16/96/43/512169643.db2.gz ORWBDVOITXAUEA-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000375115009 512169646 /nfs/dbraw/zinc/16/96/46/512169646.db2.gz ORWBDVOITXAUEA-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373100475 512171527 /nfs/dbraw/zinc/17/15/27/512171527.db2.gz RYONZTFONJYHKN-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cc1 ZINC000053722100 506435465 /nfs/dbraw/zinc/43/54/65/506435465.db2.gz PCBBQPUOAXAQPO-CQSZACIVSA-N 1 1 357.414 2.804 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000041423107 506516305 /nfs/dbraw/zinc/51/63/05/506516305.db2.gz KLLKDYNJHCWRDM-UHFFFAOYSA-N 1 1 351.428 2.508 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000054394925 506551925 /nfs/dbraw/zinc/55/19/25/506551925.db2.gz UGRBKWALRZVELT-ZDUSSCGKSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000054394925 506551933 /nfs/dbraw/zinc/55/19/33/506551933.db2.gz UGRBKWALRZVELT-ZDUSSCGKSA-N 1 1 360.370 2.562 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[NH+](Cc2cccs2)CC1 ZINC000007615329 506574681 /nfs/dbraw/zinc/57/46/81/506574681.db2.gz GRIYVRLJNBIIPZ-UHFFFAOYSA-N 1 1 374.466 2.721 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(F)(c3cccnc3)CC2)c([N+](=O)[O-])c1 ZINC000375364483 512286909 /nfs/dbraw/zinc/28/69/09/512286909.db2.gz XJKUNCBWDPKOAP-UHFFFAOYSA-N 1 1 358.373 2.550 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000054646896 506595114 /nfs/dbraw/zinc/59/51/14/506595114.db2.gz QZSZKNZDBDYUJE-IYBDPMFKSA-N 1 1 362.474 2.805 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000055401648 506742958 /nfs/dbraw/zinc/74/29/58/506742958.db2.gz JTCSABFOQZVDNW-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)NCc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000045624577 506994092 /nfs/dbraw/zinc/99/40/92/506994092.db2.gz CVUJIXAYPUHACX-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000369260156 512314854 /nfs/dbraw/zinc/31/48/54/512314854.db2.gz SRKUNMOOSRNELI-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000369260156 512314857 /nfs/dbraw/zinc/31/48/57/512314857.db2.gz SRKUNMOOSRNELI-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO COc1ccc(CC(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000067907169 507048581 /nfs/dbraw/zinc/04/85/81/507048581.db2.gz WHVQODRMZFQEAK-GASCZTMLSA-N 1 1 363.458 2.630 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068084907 507104707 /nfs/dbraw/zinc/10/47/07/507104707.db2.gz UKZCCYDXNMMXHO-ZDUSSCGKSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@H]1CCCC[N@@H+]1CCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068084907 507104713 /nfs/dbraw/zinc/10/47/13/507104713.db2.gz UKZCCYDXNMMXHO-ZDUSSCGKSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068084907 507104719 /nfs/dbraw/zinc/10/47/19/507104719.db2.gz UKZCCYDXNMMXHO-ZDUSSCGKSA-N 1 1 359.430 2.856 20 5 FFBDMO Cc1cccc(C)c1OCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000046874055 507215065 /nfs/dbraw/zinc/21/50/65/507215065.db2.gz RPHSWTRHIOKSGN-UHFFFAOYSA-N 1 1 356.426 2.808 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)cc2)C1 ZINC000046934143 507225111 /nfs/dbraw/zinc/22/51/11/507225111.db2.gz SSBQBRYAJAYZAB-CQSZACIVSA-N 1 1 357.414 2.662 20 5 FFBDMO Cc1cccc(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)c1[N+](=O)[O-] ZINC000047218412 507285327 /nfs/dbraw/zinc/28/53/27/507285327.db2.gz ITZRMROILUKNFX-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C(C)C)CC2)cc1OC ZINC000068782619 507321349 /nfs/dbraw/zinc/32/13/49/507321349.db2.gz CCIBRTHXFGDRHV-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000371327187 512332130 /nfs/dbraw/zinc/33/21/30/512332130.db2.gz MGSZVBQOKHVJKA-UHFFFAOYSA-N 1 1 356.426 2.853 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CC2 ZINC000371327187 512332135 /nfs/dbraw/zinc/33/21/35/512332135.db2.gz MGSZVBQOKHVJKA-UHFFFAOYSA-N 1 1 356.426 2.853 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000057830396 507338408 /nfs/dbraw/zinc/33/84/08/507338408.db2.gz IRQWEVKWFCUSEA-SFHVURJKSA-N 1 1 356.426 2.816 20 5 FFBDMO COC(=O)c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000047743400 507387761 /nfs/dbraw/zinc/38/77/61/507387761.db2.gz FYZJFHHRRKMRRC-UHFFFAOYSA-N 1 1 355.394 2.704 20 5 FFBDMO CC(C)[NH+]1CCN([C@@H]2CCN(C/C=C/c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000371335375 512338200 /nfs/dbraw/zinc/33/82/00/512338200.db2.gz JVUMXUPXUYEJOG-WSSFADSRSA-N 1 1 358.486 2.708 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000050561443 507693039 /nfs/dbraw/zinc/69/30/39/507693039.db2.gz GFCGRLCLFJNIBO-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO Cc1cccc(OCC[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000029121614 507761997 /nfs/dbraw/zinc/76/19/97/507761997.db2.gz XVCUAUQFZSXURS-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000029121614 507762001 /nfs/dbraw/zinc/76/20/01/507762001.db2.gz XVCUAUQFZSXURS-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000063711037 507762784 /nfs/dbraw/zinc/76/27/84/507762784.db2.gz SDJVLGONZLSQCL-HNNXBMFYSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)[N@H+](CC(=O)NC(=O)NC1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350389 507791488 /nfs/dbraw/zinc/79/14/88/507791488.db2.gz AFUPDWHJDUIXEL-UHFFFAOYSA-N 1 1 362.430 2.574 20 5 FFBDMO CC(C)[N@@H+](CC(=O)NC(=O)NC1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350389 507791492 /nfs/dbraw/zinc/79/14/92/507791492.db2.gz AFUPDWHJDUIXEL-UHFFFAOYSA-N 1 1 362.430 2.574 20 5 FFBDMO COc1cc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089644763 507853265 /nfs/dbraw/zinc/85/32/65/507853265.db2.gz XBUAPUCIIBYBSQ-IAGOWNOFSA-N 1 1 357.410 2.651 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1C[C@@](C)(OC)C1(C)C ZINC000072897865 507870677 /nfs/dbraw/zinc/87/06/77/507870677.db2.gz QEWWTXXQSOTRQH-MAUKXSAKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1C[C@@](C)(OC)C1(C)C ZINC000072897865 507870679 /nfs/dbraw/zinc/87/06/79/507870679.db2.gz QEWWTXXQSOTRQH-MAUKXSAKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1SC ZINC000108305805 507885921 /nfs/dbraw/zinc/88/59/21/507885921.db2.gz NPVDBJPOUVGOTL-LBPRGKRZSA-N 1 1 365.455 2.539 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000109102083 507939531 /nfs/dbraw/zinc/93/95/31/507939531.db2.gz NQWLUQRSVUIXJR-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000109102083 507939533 /nfs/dbraw/zinc/93/95/33/507939533.db2.gz NQWLUQRSVUIXJR-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079803760 508002659 /nfs/dbraw/zinc/00/26/59/508002659.db2.gz LCFQDPHQPKFPIJ-JTQLQIEISA-N 1 1 358.236 2.817 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000110264326 508016815 /nfs/dbraw/zinc/01/68/15/508016815.db2.gz RTDSUUKWUZJMAZ-INIZCTEOSA-N 1 1 369.487 2.836 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000110966081 508061382 /nfs/dbraw/zinc/06/13/82/508061382.db2.gz OGUHNGQPNYKDSS-LBPRGKRZSA-N 1 1 360.389 2.566 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000075108503 508083539 /nfs/dbraw/zinc/08/35/39/508083539.db2.gz YMEDEDXDBFPUOK-KRWDZBQOSA-N 1 1 360.458 2.701 20 5 FFBDMO COc1ccc(OC)c(C[N@H+](CCO)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000111271184 508083801 /nfs/dbraw/zinc/08/38/01/508083801.db2.gz PJICQJYLRXJCAH-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(OC)c(C[N@@H+](CCO)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000111271184 508083804 /nfs/dbraw/zinc/08/38/04/508083804.db2.gz PJICQJYLRXJCAH-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000075323728 508097392 /nfs/dbraw/zinc/09/73/92/508097392.db2.gz BIOGCIAWQDVYCU-MRXNPFEDSA-N 1 1 371.441 2.611 20 5 FFBDMO CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000075323728 508097394 /nfs/dbraw/zinc/09/73/94/508097394.db2.gz BIOGCIAWQDVYCU-MRXNPFEDSA-N 1 1 371.441 2.611 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000075323728 508097396 /nfs/dbraw/zinc/09/73/96/508097396.db2.gz BIOGCIAWQDVYCU-MRXNPFEDSA-N 1 1 371.441 2.611 20 5 FFBDMO NC(=O)N1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000092754009 508099759 /nfs/dbraw/zinc/09/97/59/508099759.db2.gz QRGHJNISGGEFHE-UHFFFAOYSA-N 1 1 360.439 2.910 20 5 FFBDMO CCCC[N@H+](Cc1ccccc1F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075674750 508127000 /nfs/dbraw/zinc/12/70/00/508127000.db2.gz XJVXNWDWHVTEAQ-INIZCTEOSA-N 1 1 350.394 2.594 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)C1 ZINC000081363249 508167959 /nfs/dbraw/zinc/16/79/59/508167959.db2.gz CNWSKBVYIMHNOD-ZDUSSCGKSA-N 1 1 364.402 2.615 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000114193971 508298973 /nfs/dbraw/zinc/29/89/73/508298973.db2.gz NTFBAXYEUBAMTJ-SFHVURJKSA-N 1 1 369.421 2.566 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088546075 508375875 /nfs/dbraw/zinc/37/58/75/508375875.db2.gz NQQOSWKNJGWQQL-ZDUSSCGKSA-N 1 1 357.414 2.504 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088607656 508378670 /nfs/dbraw/zinc/37/86/70/508378670.db2.gz DBVIZJHRYANUJO-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000115270098 508379840 /nfs/dbraw/zinc/37/98/40/508379840.db2.gz TYBFDUPMYZJKEF-CZUORRHYSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNc2nc3sccn3c2[N+](=O)[O-])C[C@@H](C)O1 ZINC000115415179 508392696 /nfs/dbraw/zinc/39/26/96/508392696.db2.gz KHNNQCPDGFBAON-GHMZBOCLSA-N 1 1 353.448 2.604 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000156388160 508412629 /nfs/dbraw/zinc/41/26/29/508412629.db2.gz BFMKIDBNXZOSRQ-QGZVFWFLSA-N 1 1 369.487 2.525 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000156477400 508426294 /nfs/dbraw/zinc/42/62/94/508426294.db2.gz OQFHSYQTYHQBBW-PBHICJAKSA-N 1 1 357.414 2.703 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3ccccc3[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000133846143 508458064 /nfs/dbraw/zinc/45/80/64/508458064.db2.gz NLXNNHQJMYFSJJ-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cccn2cc(Cn3cc([N+](=O)[O-])cc(Br)c3=O)[nH+]c12 ZINC000127569635 508469810 /nfs/dbraw/zinc/46/98/10/508469810.db2.gz OOLQCAWBQZGKFL-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)ccc1O ZINC000156893370 508493186 /nfs/dbraw/zinc/49/31/86/508493186.db2.gz VJDMYSCZFFWQNA-INIZCTEOSA-N 1 1 371.393 2.546 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)ccc1O ZINC000156893370 508493188 /nfs/dbraw/zinc/49/31/88/508493188.db2.gz VJDMYSCZFFWQNA-INIZCTEOSA-N 1 1 371.393 2.546 20 5 FFBDMO C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)(F)F ZINC000127885754 508516331 /nfs/dbraw/zinc/51/63/31/508516331.db2.gz TUUAGYFVBYQDHO-CYBMUJFWSA-N 1 1 361.364 2.932 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)(F)F ZINC000127885754 508516336 /nfs/dbraw/zinc/51/63/36/508516336.db2.gz TUUAGYFVBYQDHO-CYBMUJFWSA-N 1 1 361.364 2.932 20 5 FFBDMO COc1ccc(COC[C@@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153242483 508562861 /nfs/dbraw/zinc/56/28/61/508562861.db2.gz HYEHAXMKESUGJO-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccc(COC[C@@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153242483 508562863 /nfs/dbraw/zinc/56/28/63/508562863.db2.gz HYEHAXMKESUGJO-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccc(COC[C@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153242355 508562916 /nfs/dbraw/zinc/56/29/16/508562916.db2.gz HYEHAXMKESUGJO-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccc(COC[C@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153242355 508562918 /nfs/dbraw/zinc/56/29/18/508562918.db2.gz HYEHAXMKESUGJO-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000122861323 508597578 /nfs/dbraw/zinc/59/75/78/508597578.db2.gz JUCQJPLVUUECLW-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO CCCc1[nH+]ccn1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000158113265 508658454 /nfs/dbraw/zinc/65/84/54/508658454.db2.gz FZIWQNCAQFXHSE-UHFFFAOYSA-N 1 1 360.370 2.544 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC[N@H+]1CCOC ZINC000153866350 508666092 /nfs/dbraw/zinc/66/60/92/508666092.db2.gz HZGJZYCLIZDYPQ-INIZCTEOSA-N 1 1 364.446 2.868 20 5 FFBDMO COC(=O)c1cc(NC(=O)[C@@H](c2ccccc2)[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000136152645 508674671 /nfs/dbraw/zinc/67/46/71/508674671.db2.gz PIDUBBNAZZTXIT-MRXNPFEDSA-N 1 1 357.366 2.623 20 5 FFBDMO C[NH+](C)[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000129071644 508678550 /nfs/dbraw/zinc/67/85/50/508678550.db2.gz QXGYSUNLTYCXMZ-CYBMUJFWSA-N 1 1 369.468 2.775 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000154100015 508717318 /nfs/dbraw/zinc/71/73/18/508717318.db2.gz PMKRVMUJCUCJMA-CXAGYDPISA-N 1 1 359.426 2.692 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000123897850 508754698 /nfs/dbraw/zinc/75/46/98/508754698.db2.gz WUGIBFBYAQTXEI-BXKDBHETSA-N 1 1 368.231 2.712 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(c4ncccn4)CC3)o2)c1 ZINC000158820115 508756095 /nfs/dbraw/zinc/75/60/95/508756095.db2.gz RFLOZBZTUBZQGX-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123943476 508760850 /nfs/dbraw/zinc/76/08/50/508760850.db2.gz WMKQORYTWWGCSF-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000123989699 508767866 /nfs/dbraw/zinc/76/78/66/508767866.db2.gz MRVBPNKCPXVUCW-UHFFFAOYSA-N 1 1 351.366 2.974 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129818722 508769543 /nfs/dbraw/zinc/76/95/43/508769543.db2.gz KIQGLILGSILGQY-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)C(=O)OC(C)C ZINC000129818722 508769548 /nfs/dbraw/zinc/76/95/48/508769548.db2.gz KIQGLILGSILGQY-ZDUSSCGKSA-N 1 1 351.403 2.504 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)CC[C@@H]21 ZINC000154394321 508775545 /nfs/dbraw/zinc/77/55/45/508775545.db2.gz FGSCAKJDNZSOCI-YJBOKZPZSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCC[C@@H](C)C1 ZINC000124119190 508785418 /nfs/dbraw/zinc/78/54/18/508785418.db2.gz CKCFWNCEUNXKAI-CABCVRRESA-N 1 1 360.458 2.783 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124188579 508794690 /nfs/dbraw/zinc/79/46/90/508794690.db2.gz HEOHYKIAKFFWAO-JQWIXIFHSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000139914239 508796866 /nfs/dbraw/zinc/79/68/66/508796866.db2.gz FFFILKRZSWGHFJ-IIDMSEBBSA-N 1 1 360.458 2.646 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1Cc2ccccc2C1 ZINC000141171901 508813174 /nfs/dbraw/zinc/81/31/74/508813174.db2.gz OUDWCQLTHBXJQS-UHFFFAOYSA-N 1 1 351.406 2.583 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCn1ccnc1 ZINC000124382915 508823811 /nfs/dbraw/zinc/82/38/11/508823811.db2.gz TVZPMYLCKUCDQK-GFCCVEGCSA-N 1 1 365.821 2.794 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000119619828 508830497 /nfs/dbraw/zinc/83/04/97/508830497.db2.gz SXODRSZEHVVRLM-PBHICJAKSA-N 1 1 369.421 2.854 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC[N@H+]1CCOC ZINC000154872153 508873496 /nfs/dbraw/zinc/87/34/96/508873496.db2.gz WKZRNDVCTWQWPT-MRXNPFEDSA-N 1 1 364.446 2.868 20 5 FFBDMO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000131002256 508875357 /nfs/dbraw/zinc/87/53/57/508875357.db2.gz UAOLCSKTGNPCAS-JTQLQIEISA-N 1 1 362.777 2.846 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](OCC(C)C)C1 ZINC000120054128 508918014 /nfs/dbraw/zinc/91/80/14/508918014.db2.gz AHOOFBDXDJXUKM-HNNXBMFYSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000131405507 508927456 /nfs/dbraw/zinc/92/74/56/508927456.db2.gz RVIYSRHEMZPQIZ-ZDUSSCGKSA-N 1 1 357.414 2.562 20 5 FFBDMO Cc1ccc(OCc2nc(C[NH2+]CCn3cc([N+](=O)[O-])cn3)cs2)cc1 ZINC000151243336 508984916 /nfs/dbraw/zinc/98/49/16/508984916.db2.gz PAUPYECRCZGPRU-UHFFFAOYSA-N 1 1 373.438 2.925 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125574128 509001237 /nfs/dbraw/zinc/00/12/37/509001237.db2.gz IASBJYOYKRJEOA-QAPCUYQASA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000155527056 509019850 /nfs/dbraw/zinc/01/98/50/509019850.db2.gz QPSCETIOLMNWTA-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000155536315 509021567 /nfs/dbraw/zinc/02/15/67/509021567.db2.gz YXWBKGMHMVBVIS-KRWDZBQOSA-N 1 1 359.426 2.533 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155554343 509025364 /nfs/dbraw/zinc/02/53/64/509025364.db2.gz YPBMZGXFZJVRFX-TXEJJXNPSA-N 1 1 355.822 2.568 20 5 FFBDMO CCN1CCN([C@H](C)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000155573257 509030086 /nfs/dbraw/zinc/03/00/86/509030086.db2.gz PADGXTXDQNEGQA-APWZRJJASA-N 1 1 360.502 2.532 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000125843218 509036104 /nfs/dbraw/zinc/03/61/04/509036104.db2.gz RJBXXRSHKJVDQL-OAHLLOKOSA-N 1 1 360.458 2.783 20 5 FFBDMO Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)c[nH+]1 ZINC000160879371 509042993 /nfs/dbraw/zinc/04/29/93/509042993.db2.gz SKGYAQPCHUPROO-UHFFFAOYSA-N 1 1 367.331 2.917 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000120918982 509089238 /nfs/dbraw/zinc/08/92/38/509089238.db2.gz HBMUIVKYJVSING-HIFRSBDPSA-N 1 1 369.487 2.562 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126672728 509111233 /nfs/dbraw/zinc/11/12/33/509111233.db2.gz JMAQVGOSVLKZEB-GFCCVEGCSA-N 1 1 372.450 2.932 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000126685223 509113994 /nfs/dbraw/zinc/11/39/94/509113994.db2.gz AJVKVTYPWSTOOQ-CQSZACIVSA-N 1 1 358.442 2.713 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000121063589 509120729 /nfs/dbraw/zinc/12/07/29/509120729.db2.gz HLKBCJFEBOYTGU-HZMBPMFUSA-N 1 1 370.247 2.770 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126741086 509120828 /nfs/dbraw/zinc/12/08/28/509120828.db2.gz WKSZFBPPBYIQKQ-KDOFPFPSSA-N 1 1 372.469 2.750 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCc2ccncc2)c([N+](=O)[O-])c1 ZINC000121564724 509178593 /nfs/dbraw/zinc/17/85/93/509178593.db2.gz ACLDIKFTNGKQCI-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182378936 509202814 /nfs/dbraw/zinc/20/28/14/509202814.db2.gz UDQOIRWJLIDZDC-GFCCVEGCSA-N 1 1 371.384 2.904 20 5 FFBDMO CCC[C@H]1CN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000162489961 509235436 /nfs/dbraw/zinc/23/54/36/509235436.db2.gz OXYKRDJEGJBOGJ-ZDUSSCGKSA-N 1 1 355.410 2.680 20 5 FFBDMO CCC[C@@H]1CN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000162489859 509235639 /nfs/dbraw/zinc/23/56/39/509235639.db2.gz OXYKRDJEGJBOGJ-CYBMUJFWSA-N 1 1 355.410 2.680 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1 ZINC000248122460 509239533 /nfs/dbraw/zinc/23/95/33/509239533.db2.gz FWXBQMVUJQFKKJ-RLFYNMQTSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1 ZINC000248122460 509239539 /nfs/dbraw/zinc/23/95/39/509239539.db2.gz FWXBQMVUJQFKKJ-RLFYNMQTSA-N 1 1 363.458 2.677 20 5 FFBDMO Cc1c(CC(=O)NCC[N@@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000162618775 509265868 /nfs/dbraw/zinc/26/58/68/509265868.db2.gz XYEVHAWDFHDXGM-UHFFFAOYSA-N 1 1 359.451 2.682 20 5 FFBDMO Cc1c(CC(=O)NCC[N@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000162618775 509265874 /nfs/dbraw/zinc/26/58/74/509265874.db2.gz XYEVHAWDFHDXGM-UHFFFAOYSA-N 1 1 359.451 2.682 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000179111162 509269633 /nfs/dbraw/zinc/26/96/33/509269633.db2.gz GEVKTJXBAXACDR-AEFFLSMTSA-N 1 1 354.410 2.839 20 5 FFBDMO C[N@@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccccc2)C1 ZINC000248409905 509303150 /nfs/dbraw/zinc/30/31/50/509303150.db2.gz XHJSQFSICXSLNS-LJQANCHMSA-N 1 1 369.421 2.950 20 5 FFBDMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccccc2)C1 ZINC000248409905 509303154 /nfs/dbraw/zinc/30/31/54/509303154.db2.gz XHJSQFSICXSLNS-LJQANCHMSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCCCn2cc[nH+]c2C)cc1SC ZINC000264071420 509316650 /nfs/dbraw/zinc/31/66/50/509316650.db2.gz DYPWVRMHSQMXPL-UHFFFAOYSA-N 1 1 364.427 2.650 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000248444401 509324132 /nfs/dbraw/zinc/32/41/32/509324132.db2.gz FXGFONYBAOFZBN-IAGOWNOFSA-N 1 1 372.421 2.833 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CN1CCOCC1)c1ccccc1 ZINC000172977124 509331832 /nfs/dbraw/zinc/33/18/32/509331832.db2.gz DRCHAAZPAIZBQN-LJQANCHMSA-N 1 1 371.437 2.767 20 5 FFBDMO C[C@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000182620523 509336297 /nfs/dbraw/zinc/33/62/97/509336297.db2.gz XTLCNVATAJGISJ-SNVBAGLBSA-N 1 1 357.863 2.939 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173018837 509353525 /nfs/dbraw/zinc/35/35/25/509353525.db2.gz BPVBECBWZPVTNU-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000173018837 509353532 /nfs/dbraw/zinc/35/35/32/509353532.db2.gz BPVBECBWZPVTNU-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(c2ccnn2CCO)CC1 ZINC000163521577 509388732 /nfs/dbraw/zinc/38/87/32/509388732.db2.gz JOXRHURJURBICU-UHFFFAOYSA-N 1 1 364.833 2.817 20 5 FFBDMO CCCN1CCC([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236794180 509505451 /nfs/dbraw/zinc/50/54/51/509505451.db2.gz KDNJXPBUSDXMBQ-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183014993 509549232 /nfs/dbraw/zinc/54/92/32/509549232.db2.gz LQRMGJATSBQXRF-ZIAGYGMSSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183210713 509659800 /nfs/dbraw/zinc/65/98/00/509659800.db2.gz BVAFZRNWQJWYKF-GHMZBOCLSA-N 1 1 357.863 2.891 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000249414171 509676522 /nfs/dbraw/zinc/67/65/22/509676522.db2.gz GCQYBJXYJDXULF-BMFZPTHFSA-N 1 1 364.446 2.766 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000249414171 509676528 /nfs/dbraw/zinc/67/65/28/509676528.db2.gz GCQYBJXYJDXULF-BMFZPTHFSA-N 1 1 364.446 2.766 20 5 FFBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657698 509687634 /nfs/dbraw/zinc/68/76/34/509687634.db2.gz ABYNXKHOKKJAJM-SJKOYZFVSA-N 1 1 353.394 2.545 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O ZINC000249575450 509716128 /nfs/dbraw/zinc/71/61/28/509716128.db2.gz ACMBOHICQJGXAA-GOEBONIOSA-N 1 1 363.458 2.635 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000180159413 509785113 /nfs/dbraw/zinc/78/51/13/509785113.db2.gz GSUYHCFTRNZADW-AEFFLSMTSA-N 1 1 355.394 2.779 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000268231961 509827349 /nfs/dbraw/zinc/82/73/49/509827349.db2.gz SIUUPBGPXHSAJX-RNCFNFMXSA-N 1 1 368.231 2.570 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O ZINC000189936618 509839409 /nfs/dbraw/zinc/83/94/09/509839409.db2.gz ACMBOHICQJGXAA-GDBMZVCRSA-N 1 1 363.458 2.635 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@H](C)C1[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000189952181 509850434 /nfs/dbraw/zinc/85/04/34/509850434.db2.gz LREYSRGJQDMBAE-MCPYQZEQSA-N 1 1 357.458 2.538 20 5 FFBDMO Cc1nnc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)[nH]1 ZINC000268416315 509916939 /nfs/dbraw/zinc/91/69/39/509916939.db2.gz BSRVRBXASVRRLZ-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000268416315 509916949 /nfs/dbraw/zinc/91/69/49/509916949.db2.gz BSRVRBXASVRRLZ-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000268416315 509916959 /nfs/dbraw/zinc/91/69/59/509916959.db2.gz BSRVRBXASVRRLZ-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n[nH]1 ZINC000268416315 509916968 /nfs/dbraw/zinc/91/69/68/509916968.db2.gz BSRVRBXASVRRLZ-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n[nH]1 ZINC000268416315 509916981 /nfs/dbraw/zinc/91/69/81/509916981.db2.gz BSRVRBXASVRRLZ-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cn1cc(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180452261 509931868 /nfs/dbraw/zinc/93/18/68/509931868.db2.gz IPCRNUDDRXXLIL-DLBZAZTESA-N 1 1 374.466 2.702 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438036 509932936 /nfs/dbraw/zinc/93/29/36/509932936.db2.gz RYRGAODWMDIWLJ-BBRMVZONSA-N 1 1 359.430 2.807 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC000245441588 509935142 /nfs/dbraw/zinc/93/51/42/509935142.db2.gz VNNONRMTHGRSFG-DNVCBOLYSA-N 1 1 369.421 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC000245441588 509935148 /nfs/dbraw/zinc/93/51/48/509935148.db2.gz VNNONRMTHGRSFG-DNVCBOLYSA-N 1 1 369.421 2.897 20 5 FFBDMO C[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000180465130 509938577 /nfs/dbraw/zinc/93/85/77/509938577.db2.gz HCRZXFQSOQIXQZ-DYESRHJHSA-N 1 1 368.481 2.910 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177279605 509975764 /nfs/dbraw/zinc/97/57/64/509975764.db2.gz IAEYUEQUJBXOGC-LBPRGKRZSA-N 1 1 370.247 2.962 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000193584323 509976488 /nfs/dbraw/zinc/97/64/88/509976488.db2.gz XAXORVKZAROZCN-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000193584323 509976493 /nfs/dbraw/zinc/97/64/93/509976493.db2.gz XAXORVKZAROZCN-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1C[C@H](C)O ZINC000245577555 510019136 /nfs/dbraw/zinc/01/91/36/510019136.db2.gz GTESIBBZRWAMNC-DZGCQCFKSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@H](C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000184013118 510087458 /nfs/dbraw/zinc/08/74/58/510087458.db2.gz SMGDPOUMUPCBHZ-OCCSQVGLSA-N 1 1 351.428 2.527 20 5 FFBDMO COC(=O)c1ccccc1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000187262245 510156882 /nfs/dbraw/zinc/15/68/82/510156882.db2.gz QQQHGDKVLJWNOU-OAHLLOKOSA-N 1 1 370.409 2.505 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1 ZINC000174542564 510168496 /nfs/dbraw/zinc/16/84/96/510168496.db2.gz YUBUIWWWBSQZTB-CYBMUJFWSA-N 1 1 364.402 2.534 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000269091040 510230616 /nfs/dbraw/zinc/23/06/16/510230616.db2.gz LAHYQIPGLPIXIU-GWCFXTLKSA-N 1 1 355.236 2.673 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000177782137 510251050 /nfs/dbraw/zinc/25/10/50/510251050.db2.gz RDCYWXGJJXQTDD-SJORKVTESA-N 1 1 372.469 2.894 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000269274492 510319588 /nfs/dbraw/zinc/31/95/88/510319588.db2.gz NERJNLAGSRWFNI-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO C[NH+]1CCC(N(Cc2ccco2)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000269276119 510319486 /nfs/dbraw/zinc/31/94/86/510319486.db2.gz IRONCMOKXNEIBW-UHFFFAOYSA-N 1 1 359.382 2.630 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000194351419 510324200 /nfs/dbraw/zinc/32/42/00/510324200.db2.gz ULYRXURHXAHXKK-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269365560 510364976 /nfs/dbraw/zinc/36/49/76/510364976.db2.gz VKFZTWSXKWUKKC-FZKQIMNGSA-N 1 1 358.442 2.752 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000174953660 510404107 /nfs/dbraw/zinc/40/41/07/510404107.db2.gz YOTIBZCYEWAWFF-KRWDZBQOSA-N 1 1 368.437 2.892 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000181555048 510471042 /nfs/dbraw/zinc/47/10/42/510471042.db2.gz GNIRKFPEMINFSO-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](Cc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000181555048 510471051 /nfs/dbraw/zinc/47/10/51/510471051.db2.gz GNIRKFPEMINFSO-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000181621007 510504990 /nfs/dbraw/zinc/50/49/90/510504990.db2.gz QFPVJHRRYQUSMB-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000181621007 510504999 /nfs/dbraw/zinc/50/49/99/510504999.db2.gz QFPVJHRRYQUSMB-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO C[C@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000187946583 510515647 /nfs/dbraw/zinc/51/56/47/510515647.db2.gz RYDXEYOZGMSSGM-ZBEGNZNMSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000269710091 510520505 /nfs/dbraw/zinc/52/05/05/510520505.db2.gz RJHNWZPOBVKQOY-UHFFFAOYSA-N 1 1 371.441 2.588 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000246544584 510546792 /nfs/dbraw/zinc/54/67/92/510546792.db2.gz GNXDJCMMWUPCKO-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000246544584 510546799 /nfs/dbraw/zinc/54/67/99/510546799.db2.gz GNXDJCMMWUPCKO-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1ccnc1 ZINC000246656362 510603947 /nfs/dbraw/zinc/60/39/47/510603947.db2.gz CUWYJEIZQZVJPM-XJKSGUPXSA-N 1 1 368.397 2.924 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@@H](C)C1 ZINC000246722444 510636979 /nfs/dbraw/zinc/63/69/79/510636979.db2.gz GQPBEQCVSDLOQQ-QWHCGFSZSA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000181974361 510686539 /nfs/dbraw/zinc/68/65/39/510686539.db2.gz QPSDLRLZWZIVCD-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000181974361 510686544 /nfs/dbraw/zinc/68/65/44/510686544.db2.gz QPSDLRLZWZIVCD-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000246818032 510691247 /nfs/dbraw/zinc/69/12/47/510691247.db2.gz SDOWGENASWGSCC-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000246818032 510691254 /nfs/dbraw/zinc/69/12/54/510691254.db2.gz SDOWGENASWGSCC-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188297419 510696627 /nfs/dbraw/zinc/69/66/27/510696627.db2.gz JIRSTRYJKCQDMI-FQEVSTJZSA-N 1 1 355.438 2.664 20 5 FFBDMO COc1ccc2c(c1)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000178728512 510741130 /nfs/dbraw/zinc/74/11/30/510741130.db2.gz JRKXGBYBNFPYEF-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000263680960 510785973 /nfs/dbraw/zinc/78/59/73/510785973.db2.gz OTPIWDCVCMXZKF-TZMCWYRMSA-N 1 1 374.397 2.791 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000263680954 510786515 /nfs/dbraw/zinc/78/65/15/510786515.db2.gz OTPIWDCVCMXZKF-GXTWGEPZSA-N 1 1 374.397 2.791 20 5 FFBDMO CN(C(=O)CN1CCC[N@H+](C2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000172581092 510804550 /nfs/dbraw/zinc/80/45/50/510804550.db2.gz DCBUCRFEYBEDBC-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247181720 510849310 /nfs/dbraw/zinc/84/93/10/510849310.db2.gz BJEGOCFXEXRLHY-PKOBYXMFSA-N 1 1 360.458 2.804 20 5 FFBDMO Cc1cccc([C@H]2CCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1C ZINC000247204670 510851667 /nfs/dbraw/zinc/85/16/67/510851667.db2.gz CDZSQJOJSNPEKF-IEBWSBKVSA-N 1 1 358.442 2.996 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511432 510863870 /nfs/dbraw/zinc/86/38/70/510863870.db2.gz VSCBCKWICVFMOP-HOCLYGCPSA-N 1 1 371.441 2.583 20 5 FFBDMO CCOC(=O)C1CCC(O)(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000285453574 510912983 /nfs/dbraw/zinc/91/29/83/510912983.db2.gz YRNHIHKYFZYHER-UHFFFAOYSA-N 1 1 364.442 2.554 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(N)=O)c1ccccn1 ZINC000297428733 510942805 /nfs/dbraw/zinc/94/28/05/510942805.db2.gz VDPXSLBLIFRBOX-MLGOLLRUSA-N 1 1 360.439 2.677 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H](C2CC2)O1 ZINC000279366749 511058354 /nfs/dbraw/zinc/05/83/54/511058354.db2.gz RLZXPHZVDIUSFW-BZNIZROVSA-N 1 1 351.378 2.562 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3ccncn3)C2)cccc1[N+](=O)[O-] ZINC000361652380 511074960 /nfs/dbraw/zinc/07/49/60/511074960.db2.gz LRHVKCNGMVBKEC-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO CCOC1(C)CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000298188748 511203481 /nfs/dbraw/zinc/20/34/81/511203481.db2.gz AYJCSOCJTLIPID-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000279809186 511222640 /nfs/dbraw/zinc/22/26/40/511222640.db2.gz XDFLUUUBCQJXCL-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO CC(C)S(=O)(=O)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291516478 511228827 /nfs/dbraw/zinc/22/88/27/511228827.db2.gz ITDXKFVVAARDBT-UHFFFAOYSA-N 1 1 355.243 2.814 20 5 FFBDMO CCN(Cc1c([N+](=O)[O-])ncn1C)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000362852292 511252126 /nfs/dbraw/zinc/25/21/26/511252126.db2.gz PTQMKMVZWUNDKC-RDJZCZTQSA-N 1 1 357.458 2.986 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271713272 511298104 /nfs/dbraw/zinc/29/81/04/511298104.db2.gz JKDYPOXMWKJPEW-LLVKDONJSA-N 1 1 363.443 2.934 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295237874 511332679 /nfs/dbraw/zinc/33/26/79/511332679.db2.gz ZXCGTEABBPGYAX-ZANVPECISA-N 1 1 357.332 2.826 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000271883014 511358758 /nfs/dbraw/zinc/35/87/58/511358758.db2.gz CKPAUHFMQSJRMO-UHFFFAOYSA-N 1 1 361.445 2.533 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000295417377 511397969 /nfs/dbraw/zinc/39/79/69/511397969.db2.gz DSEFHSLKLZPAKZ-MAUKXSAKSA-N 1 1 373.384 2.918 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291938248 511399037 /nfs/dbraw/zinc/39/90/37/511399037.db2.gz TYEAEBXHLBFENQ-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291938248 511399043 /nfs/dbraw/zinc/39/90/43/511399043.db2.gz TYEAEBXHLBFENQ-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CC2)C1 ZINC000295510356 511430091 /nfs/dbraw/zinc/43/00/91/511430091.db2.gz HMOHSEWKQWIZRT-LBPRGKRZSA-N 1 1 351.834 2.733 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000280349713 511431874 /nfs/dbraw/zinc/43/18/74/511431874.db2.gz IWKZVPXITLVMID-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO COC[C@H]1CC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272215633 511468353 /nfs/dbraw/zinc/46/83/53/511468353.db2.gz BCBRASPHFNXFEQ-NSHDSACASA-N 1 1 360.357 2.716 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCOC[C@H](C4CCC4)C3)n2)cc1 ZINC000292173257 511493328 /nfs/dbraw/zinc/49/33/28/511493328.db2.gz PUJGKEIMCAWWJI-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCOC[C@H](C4CCC4)C3)n2)cc1 ZINC000292173257 511493332 /nfs/dbraw/zinc/49/33/32/511493332.db2.gz PUJGKEIMCAWWJI-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO Cc1cc(N2CC[C@@]3(CC[N@H+](C)C3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000292225690 511512562 /nfs/dbraw/zinc/51/25/62/511512562.db2.gz IMSIZWPVKTUNHC-LJQANCHMSA-N 1 1 353.426 2.892 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292352542 511563997 /nfs/dbraw/zinc/56/39/97/511563997.db2.gz PVJLRUUBTMIGRR-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000365738129 511629418 /nfs/dbraw/zinc/62/94/18/511629418.db2.gz GSIQZPFMMMFERD-DLBZAZTESA-N 1 1 366.421 2.584 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)CC[C@H]21 ZINC000273851121 511631644 /nfs/dbraw/zinc/63/16/44/511631644.db2.gz LUCDHSZCBDYIBY-CXAGYDPISA-N 1 1 363.433 2.954 20 5 FFBDMO Cn1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(-c2ccncc2)n1 ZINC000365841863 511680506 /nfs/dbraw/zinc/68/05/06/511680506.db2.gz VPNXWFGVWSJSRT-UHFFFAOYSA-N 1 1 363.381 2.556 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000301225020 511690354 /nfs/dbraw/zinc/69/03/54/511690354.db2.gz BEYOYBLCCJXFCP-AWEZNQCLSA-N 1 1 371.441 2.703 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000281064353 511706846 /nfs/dbraw/zinc/70/68/46/511706846.db2.gz SHAWSGCGRRAHLW-KDOFPFPSSA-N 1 1 370.409 2.608 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000281064353 511706851 /nfs/dbraw/zinc/70/68/51/511706851.db2.gz SHAWSGCGRRAHLW-KDOFPFPSSA-N 1 1 370.409 2.608 20 5 FFBDMO COc1cc(Cc2noc(Cn3c[nH+]c4c3CCCC4)n2)ccc1[N+](=O)[O-] ZINC000350163198 511733187 /nfs/dbraw/zinc/73/31/87/511733187.db2.gz CWTVDWNSJXDNKW-UHFFFAOYSA-N 1 1 369.381 2.701 20 5 FFBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(OC)c(O)cc1[N+](=O)[O-])CCO2 ZINC000274287965 511781605 /nfs/dbraw/zinc/78/16/05/511781605.db2.gz XIJXODAKBHFWRZ-AWEZNQCLSA-N 1 1 360.366 2.931 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000292973386 511792091 /nfs/dbraw/zinc/79/20/91/511792091.db2.gz ATKYWZFMINSWFR-NSHDSACASA-N 1 1 360.357 2.799 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000366123152 511852471 /nfs/dbraw/zinc/85/24/71/511852471.db2.gz GQVWYQRGBISGTO-KRWDZBQOSA-N 1 1 354.410 2.726 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+](C[C@@H](C)OC)C(C)C)c([N+](=O)[O-])c1 ZINC000411285347 512562506 /nfs/dbraw/zinc/56/25/06/512562506.db2.gz RFCZYYUCNBOVEI-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2C[C@@H]2c2ccccc2)CC1 ZINC000411396002 512615441 /nfs/dbraw/zinc/61/54/41/512615441.db2.gz WMQZZPMDXUCRBE-RTBURBONSA-N 1 1 351.406 2.909 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411410422 512622668 /nfs/dbraw/zinc/62/26/68/512622668.db2.gz DCMMMWDIKXFRHM-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378192617 512631449 /nfs/dbraw/zinc/63/14/49/512631449.db2.gz UGJVYPACLFYAHK-QWHCGFSZSA-N 1 1 368.231 2.714 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000379688638 512871719 /nfs/dbraw/zinc/87/17/19/512871719.db2.gz ZLCOWPNXOOLBAG-MRXNPFEDSA-N 1 1 368.437 2.962 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000374553070 512888629 /nfs/dbraw/zinc/88/86/29/512888629.db2.gz VPCVIMMRBFIXLX-CYBMUJFWSA-N 1 1 357.414 2.576 20 5 FFBDMO CC(C)[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CCC(=O)N1 ZINC000412061414 512938624 /nfs/dbraw/zinc/93/86/24/512938624.db2.gz ABWQAUSWBCWQTF-CQSZACIVSA-N 1 1 358.398 2.739 20 5 FFBDMO CC(C)[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CCC(=O)N1 ZINC000412061414 512938627 /nfs/dbraw/zinc/93/86/27/512938627.db2.gz ABWQAUSWBCWQTF-CQSZACIVSA-N 1 1 358.398 2.739 20 5 FFBDMO CNc1c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000396456968 512942191 /nfs/dbraw/zinc/94/21/91/512942191.db2.gz UGYKAVXEOCZQLK-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO CNc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000396456968 512942194 /nfs/dbraw/zinc/94/21/94/512942194.db2.gz UGYKAVXEOCZQLK-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](Cc3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368486961 512970606 /nfs/dbraw/zinc/97/06/06/512970606.db2.gz QQBVPLKRRPHBGG-LPHOPBHVSA-N 1 1 366.421 2.660 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000408167673 513012768 /nfs/dbraw/zinc/01/27/68/513012768.db2.gz FMZUGLYHOMIOJN-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000408167673 513012772 /nfs/dbraw/zinc/01/27/72/513012772.db2.gz FMZUGLYHOMIOJN-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[nH+]1 ZINC000374829977 513025410 /nfs/dbraw/zinc/02/54/10/513025410.db2.gz QBJGSJNCYWNUEC-LBPRGKRZSA-N 1 1 373.388 2.736 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374881059 513052965 /nfs/dbraw/zinc/05/29/65/513052965.db2.gz VYDIYBQKKOSPFG-ZBFHGGJFSA-N 1 1 354.410 2.630 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC2(CCC[N@@H+]2C)CC1 ZINC000374975158 513094711 /nfs/dbraw/zinc/09/47/11/513094711.db2.gz BPZCMUQHZIQDNO-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)cc1C ZINC000440077456 513241252 /nfs/dbraw/zinc/24/12/52/513241252.db2.gz LFWFUPGXMAVFSJ-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1c(Br)c(N2CC[N@@H+](C3CC3)C[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000450550356 513246748 /nfs/dbraw/zinc/24/67/48/513246748.db2.gz XIWCBZUBUXEGPJ-JTQLQIEISA-N 1 1 369.263 2.981 20 5 FFBDMO Cc1c(Br)c(N2CC[N@H+](C3CC3)C[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000450550356 513246751 /nfs/dbraw/zinc/24/67/51/513246751.db2.gz XIWCBZUBUXEGPJ-JTQLQIEISA-N 1 1 369.263 2.981 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020143 513258071 /nfs/dbraw/zinc/25/80/71/513258071.db2.gz MQHBXDXHCUTVDK-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@@H]1N1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020143 513258078 /nfs/dbraw/zinc/25/80/78/513258078.db2.gz MQHBXDXHCUTVDK-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@@H]1N1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020143 513258084 /nfs/dbraw/zinc/25/80/84/513258084.db2.gz MQHBXDXHCUTVDK-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429040831 513264395 /nfs/dbraw/zinc/26/43/95/513264395.db2.gz NGGQSHMYLVKPGJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429040831 513264400 /nfs/dbraw/zinc/26/44/00/513264400.db2.gz NGGQSHMYLVKPGJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429040831 513264409 /nfs/dbraw/zinc/26/44/09/513264409.db2.gz NGGQSHMYLVKPGJ-IDHHARJASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429041007 513266758 /nfs/dbraw/zinc/26/67/58/513266758.db2.gz NTDWPAFPWWLPCP-IWKLRQMXSA-N 1 1 374.485 2.892 20 5 FFBDMO COC(=O)c1cccc(NC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429254623 513317808 /nfs/dbraw/zinc/31/78/08/513317808.db2.gz LHNGQAUKFKMTHA-UHFFFAOYSA-N 1 1 371.393 2.845 20 5 FFBDMO C[C@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+](C2CCC2)C1 ZINC000429392000 513362562 /nfs/dbraw/zinc/36/25/62/513362562.db2.gz DCYKWQJNRPYRHI-AWEZNQCLSA-N 1 1 361.442 2.768 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC[N@@H+]1CCOC ZINC000421795951 513432457 /nfs/dbraw/zinc/43/24/57/513432457.db2.gz LEXUTAIPVRDUEH-INIZCTEOSA-N 1 1 363.458 2.785 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1CCOC ZINC000421795951 513432461 /nfs/dbraw/zinc/43/24/61/513432461.db2.gz LEXUTAIPVRDUEH-INIZCTEOSA-N 1 1 363.458 2.785 20 5 FFBDMO C[C@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000447666380 513534815 /nfs/dbraw/zinc/53/48/15/513534815.db2.gz ASSZYQKAGXKSLO-CYBMUJFWSA-N 1 1 351.410 2.752 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000441438330 513567971 /nfs/dbraw/zinc/56/79/71/513567971.db2.gz JMKKKFVKAHQLBA-MJGOQNOKSA-N 1 1 364.442 2.758 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC(OCC[NH+]2CCCC2)CC1 ZINC000430238335 513595531 /nfs/dbraw/zinc/59/55/31/513595531.db2.gz LDCBPJHAASOVDW-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279259 513609193 /nfs/dbraw/zinc/60/91/93/513609193.db2.gz SODXYYMSIBFDDX-SUNYJGFJSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279259 513609202 /nfs/dbraw/zinc/60/92/02/513609202.db2.gz SODXYYMSIBFDDX-SUNYJGFJSA-N 1 1 350.415 2.762 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451277125 513645679 /nfs/dbraw/zinc/64/56/79/513645679.db2.gz ZZRKPGASKGVHQI-RBUKOAKNSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451277125 513645686 /nfs/dbraw/zinc/64/56/86/513645686.db2.gz ZZRKPGASKGVHQI-RBUKOAKNSA-N 1 1 360.385 2.774 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451344437 513690569 /nfs/dbraw/zinc/69/05/69/513690569.db2.gz PQQCJBRYMRLTFB-BFYDXBDKSA-N 1 1 361.442 2.857 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000419007338 513714928 /nfs/dbraw/zinc/71/49/28/513714928.db2.gz RKRAMHWRQYQKQS-ZIAGYGMSSA-N 1 1 351.447 2.663 20 5 FFBDMO CNC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000430765503 513742593 /nfs/dbraw/zinc/74/25/93/513742593.db2.gz RPTQJMMEOGLGBE-LJQANCHMSA-N 1 1 373.409 2.821 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c(C)cc1[N+](=O)[O-] ZINC000416405061 513753450 /nfs/dbraw/zinc/75/34/50/513753450.db2.gz AZYRDPYYICJJCY-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000419310435 513770676 /nfs/dbraw/zinc/77/06/76/513770676.db2.gz HNIBVJXEQAMQGU-QGZVFWFLSA-N 1 1 355.394 2.737 20 5 FFBDMO O=C(C[NH+]1CCC(OC2CCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000419310826 513771956 /nfs/dbraw/zinc/77/19/56/513771956.db2.gz XNENXFLRLCOXIB-UHFFFAOYSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@@H+]1CCSC[C@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000419373813 513791953 /nfs/dbraw/zinc/79/19/53/513791953.db2.gz NPBNSCKTLXJIEO-KRWDZBQOSA-N 1 1 361.467 2.701 20 5 FFBDMO O=C(C[N@H+]1CCSC[C@H]1C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000419373813 513791959 /nfs/dbraw/zinc/79/19/59/513791959.db2.gz NPBNSCKTLXJIEO-KRWDZBQOSA-N 1 1 361.467 2.701 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000448593310 513798940 /nfs/dbraw/zinc/79/89/40/513798940.db2.gz YMTBYWNVNYAFGH-GFCCVEGCSA-N 1 1 353.394 2.737 20 5 FFBDMO COc1cc(CN2CCC[C@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000442926737 513816542 /nfs/dbraw/zinc/81/65/42/513816542.db2.gz ZYUMTMIUVGOBCH-GFCCVEGCSA-N 1 1 373.400 2.808 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@H](O)COCc3ccco3)C2)cc1 ZINC000451543139 513821183 /nfs/dbraw/zinc/82/11/83/513821183.db2.gz AZHMUNSRNNWGQS-WMZOPIPTSA-N 1 1 360.410 2.945 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451548227 513826262 /nfs/dbraw/zinc/82/62/62/513826262.db2.gz UVELROSRFPTZKX-WOSRLPQWSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451548227 513826267 /nfs/dbraw/zinc/82/62/67/513826267.db2.gz UVELROSRFPTZKX-WOSRLPQWSA-N 1 1 365.430 2.677 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2nccnc2C)CC1 ZINC000443060555 513859261 /nfs/dbraw/zinc/85/92/61/513859261.db2.gz GLYDTPARDYLBLI-QINSGFPZSA-N 1 1 353.426 2.919 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000431493216 513911268 /nfs/dbraw/zinc/91/12/68/513911268.db2.gz AYTZPEXLFDBALX-BXKDBHETSA-N 1 1 356.220 2.570 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCOc2ccccc21 ZINC000451728911 513941774 /nfs/dbraw/zinc/94/17/74/513941774.db2.gz UJIXHTLVFLGRAX-KRWDZBQOSA-N 1 1 355.394 2.796 20 5 FFBDMO CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000414495857 514147938 /nfs/dbraw/zinc/14/79/38/514147938.db2.gz HSIWFSUAXRPPQB-CYBMUJFWSA-N 1 1 360.439 2.628 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000452106138 514194219 /nfs/dbraw/zinc/19/42/19/514194219.db2.gz QEDWFYWJWAPDEY-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420602875 514197145 /nfs/dbraw/zinc/19/71/45/514197145.db2.gz OWQXDYKJQUIUHL-LSDHHAIUSA-N 1 1 360.458 2.785 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCc2ccccc2C1 ZINC000444601139 514269053 /nfs/dbraw/zinc/26/90/53/514269053.db2.gz VLLOJEYTULMMIS-UHFFFAOYSA-N 1 1 365.433 2.928 20 5 FFBDMO CN(C)C(=O)C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444674740 514288697 /nfs/dbraw/zinc/28/86/97/514288697.db2.gz LFJUCRDJWOOYLO-MRXNPFEDSA-N 1 1 367.409 2.780 20 5 FFBDMO C[C@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000417315668 514290029 /nfs/dbraw/zinc/29/00/29/514290029.db2.gz SQQYJHKYNACWGX-UZLBHIALSA-N 1 1 360.502 2.835 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1cc2ccccc2c2cccnc12 ZINC000452343042 514293508 /nfs/dbraw/zinc/29/35/08/514293508.db2.gz ANGWZCRUPJGFFJ-QGZVFWFLSA-N 1 1 363.461 2.965 20 5 FFBDMO COC(=O)c1cc(NCCC[N@H+]2CCCO[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000432850910 514301115 /nfs/dbraw/zinc/30/11/15/514301115.db2.gz IGZATRAPCFSQNO-AWEZNQCLSA-N 1 1 365.430 2.603 20 5 FFBDMO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ncc(Br)cn1 ZINC000432981367 514341760 /nfs/dbraw/zinc/34/17/60/514341760.db2.gz CDLBKKRBRSQBCN-JTQLQIEISA-N 1 1 367.203 2.877 20 5 FFBDMO O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000427913743 514345318 /nfs/dbraw/zinc/34/53/18/514345318.db2.gz LSNOLXPPTAPSAJ-HNNXBMFYSA-N 1 1 361.423 2.929 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2cccc(F)c2)C2CCCC2)c1 ZINC000438875794 514456485 /nfs/dbraw/zinc/45/64/85/514456485.db2.gz KRNQFGVWPAIGNA-SFHVURJKSA-N 1 1 362.405 2.736 20 5 FFBDMO C[C@H](C(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[NH+]1CCSCC1 ZINC000452836893 514511429 /nfs/dbraw/zinc/51/14/29/514511429.db2.gz DKBUJRMIWZDHBF-GDBMZVCRSA-N 1 1 363.483 2.738 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000461115394 514518989 /nfs/dbraw/zinc/51/89/89/514518989.db2.gz XDNCNQUNYSJNDX-QGZVFWFLSA-N 1 1 356.382 2.805 20 5 FFBDMO COC(=O)Cc1ccc(NCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000450273528 514575198 /nfs/dbraw/zinc/57/51/98/514575198.db2.gz HBEQGGHFGUAIFN-UHFFFAOYSA-N 1 1 357.410 2.854 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000466557841 514690179 /nfs/dbraw/zinc/69/01/79/514690179.db2.gz YOPRYVOXVJZJPB-KDOFPFPSSA-N 1 1 360.458 2.699 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470955780 514691398 /nfs/dbraw/zinc/69/13/98/514691398.db2.gz OOLVCLYVRHIBBZ-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470955780 514691406 /nfs/dbraw/zinc/69/14/06/514691406.db2.gz OOLVCLYVRHIBBZ-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000470972875 514701628 /nfs/dbraw/zinc/70/16/28/514701628.db2.gz BBLAXIRDIYIFJR-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470972875 514701639 /nfs/dbraw/zinc/70/16/39/514701639.db2.gz BBLAXIRDIYIFJR-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2cc(-n3ccnc3)cs2)CC1 ZINC000453582793 514702275 /nfs/dbraw/zinc/70/22/75/514702275.db2.gz XGOFBBSQGURAPI-UHFFFAOYSA-N 1 1 370.438 2.559 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCCC[C@@H]1C ZINC000479858256 514746679 /nfs/dbraw/zinc/74/66/79/514746679.db2.gz AUXVGQIPCCVPKS-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000502711811 514748937 /nfs/dbraw/zinc/74/89/37/514748937.db2.gz MIJZIHRUXOYSDH-HNNXBMFYSA-N 1 1 369.487 2.836 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cccc(C)n1 ZINC000471204476 514796172 /nfs/dbraw/zinc/79/61/72/514796172.db2.gz PVSGXOOKHATLFU-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000489336274 514803735 /nfs/dbraw/zinc/80/37/35/514803735.db2.gz UELLFSYSKHNBER-GFCCVEGCSA-N 1 1 355.341 2.505 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000467047271 514876931 /nfs/dbraw/zinc/87/69/31/514876931.db2.gz RKLRRIRYOIAUQV-NHYWBVRUSA-N 1 1 372.450 2.931 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(c3ccc([N+](=O)[O-])c(N)c3F)CC2)C[C@H](C)O1 ZINC000476095114 514913252 /nfs/dbraw/zinc/91/32/52/514913252.db2.gz JWTHNKSJKXOCEH-BETUJISGSA-N 1 1 366.437 2.642 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000480419970 514951106 /nfs/dbraw/zinc/95/11/06/514951106.db2.gz NEOGYFYPIYRDDW-CQSZACIVSA-N 1 1 371.441 2.703 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000489946953 515043200 /nfs/dbraw/zinc/04/32/00/515043200.db2.gz RGJWHKVRAFUAGL-DAYGRLMNSA-N 1 1 360.458 2.509 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681684 515287029 /nfs/dbraw/zinc/28/70/29/515287029.db2.gz NFBXQLQUAACKGV-JKSUJKDBSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681684 515287038 /nfs/dbraw/zinc/28/70/38/515287038.db2.gz NFBXQLQUAACKGV-JKSUJKDBSA-N 1 1 363.461 2.706 20 5 FFBDMO CN1CCC(CCO)([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000472612487 515337241 /nfs/dbraw/zinc/33/72/41/515337241.db2.gz MKJWBQMDARFSMG-UHFFFAOYSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000477174454 515357764 /nfs/dbraw/zinc/35/77/64/515357764.db2.gz HTUBDXDOFACDQK-IBGZPJMESA-N 1 1 370.405 2.829 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000468459452 515368906 /nfs/dbraw/zinc/36/89/06/515368906.db2.gz ILKYCMVTPBKMBI-MRXNPFEDSA-N 1 1 372.425 2.699 20 5 FFBDMO COc1cc(CNc2cc[nH+]cc2Br)c([N+](=O)[O-])cc1O ZINC000486363159 515452581 /nfs/dbraw/zinc/45/25/81/515452581.db2.gz FVDSOOMAIIZYSA-UHFFFAOYSA-N 1 1 354.160 2.501 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC(CCC[NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000505292618 515497773 /nfs/dbraw/zinc/49/77/73/515497773.db2.gz XFIRQEMTNNKCFG-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO CC[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1N1CCOCC1 ZINC000493365547 515625824 /nfs/dbraw/zinc/62/58/24/515625824.db2.gz QUNSEXUJHGFBHA-DYVFJYSZSA-N 1 1 353.850 2.791 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000459538522 515631971 /nfs/dbraw/zinc/63/19/71/515631971.db2.gz OCNXSDNHRQFNKT-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000459538522 515631979 /nfs/dbraw/zinc/63/19/79/515631979.db2.gz OCNXSDNHRQFNKT-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO Cc1cc(N2CCC[N@@H+]([C@@H](C)CO)CC2)c(Br)cc1[N+](=O)[O-] ZINC000473515279 515644444 /nfs/dbraw/zinc/64/44/44/515644444.db2.gz WUDXXZHYSJATLO-LBPRGKRZSA-N 1 1 372.263 2.559 20 5 FFBDMO Cc1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)c(Br)cc1[N+](=O)[O-] ZINC000473515279 515644453 /nfs/dbraw/zinc/64/44/53/515644453.db2.gz WUDXXZHYSJATLO-LBPRGKRZSA-N 1 1 372.263 2.559 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000493707245 515658141 /nfs/dbraw/zinc/65/81/41/515658141.db2.gz OACIBGFAHWKVOP-WCQYABFASA-N 1 1 373.400 2.820 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487294883 515819140 /nfs/dbraw/zinc/81/91/40/515819140.db2.gz DIVWMEMFYSOYHX-ZBFHGGJFSA-N 1 1 356.426 2.574 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511531531 515936353 /nfs/dbraw/zinc/93/63/53/515936353.db2.gz ZCBCDKMMHDRFFJ-CVEARBPZSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H](CO)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000483143799 515949265 /nfs/dbraw/zinc/94/92/65/515949265.db2.gz AYITVGQAVLIIOA-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CC[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1 ZINC000483168861 515964847 /nfs/dbraw/zinc/96/48/47/515964847.db2.gz NHVPDLSXSDLTAS-FUHWJXTLSA-N 1 1 350.415 2.634 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000511901075 516073967 /nfs/dbraw/zinc/07/39/67/516073967.db2.gz FZDSUKWQMMFINP-GOSISDBHSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)[C@H]1CN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000488083090 516111013 /nfs/dbraw/zinc/11/10/13/516111013.db2.gz YVZUBHVWHNWPAX-MLGOLLRUSA-N 1 1 368.865 2.847 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131421 516133936 /nfs/dbraw/zinc/13/39/36/516133936.db2.gz GMQKFBJZWNDWAU-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131421 516133945 /nfs/dbraw/zinc/13/39/45/516133945.db2.gz GMQKFBJZWNDWAU-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CO)N1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000470131421 516133953 /nfs/dbraw/zinc/13/39/53/516133953.db2.gz GMQKFBJZWNDWAU-OAHLLOKOSA-N 1 1 359.426 2.743 20 5 FFBDMO CC(C)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1nnc2ccccn21 ZINC000495369361 516149073 /nfs/dbraw/zinc/14/90/73/516149073.db2.gz QNXSRABTWWWRMF-KRWDZBQOSA-N 1 1 368.397 2.563 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@H](C)c1ccccc1 ZINC000488390883 516212898 /nfs/dbraw/zinc/21/28/98/516212898.db2.gz NCKFLHNXHSGLLO-UKRRQHHQSA-N 1 1 359.430 2.813 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@@H](c2ccccc2)C1 ZINC000497402525 516320081 /nfs/dbraw/zinc/32/00/81/516320081.db2.gz UOBZKZQLIIBBQW-WBVHZDCISA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](c2ccccc2)C1 ZINC000497401298 516320089 /nfs/dbraw/zinc/32/00/89/516320089.db2.gz ZBLNGMAUZWOIOI-IEBWSBKVSA-N 1 1 364.405 2.904 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000497428002 516322137 /nfs/dbraw/zinc/32/21/37/516322137.db2.gz HRUCCMQVDSJMKU-ROUUACIJSA-N 1 1 371.462 2.901 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000517536753 516353107 /nfs/dbraw/zinc/35/31/07/516353107.db2.gz PLYAZYKZAGPPLJ-QGZVFWFLSA-N 1 1 369.849 2.917 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000517536753 516353115 /nfs/dbraw/zinc/35/31/15/516353115.db2.gz PLYAZYKZAGPPLJ-QGZVFWFLSA-N 1 1 369.849 2.917 20 5 FFBDMO COc1cc(CNC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705693 516378339 /nfs/dbraw/zinc/37/83/39/516378339.db2.gz USQIYJDINMMJMV-LBPRGKRZSA-N 1 1 373.400 2.679 20 5 FFBDMO Cn1c(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572615 516404949 /nfs/dbraw/zinc/40/49/49/516404949.db2.gz IEGPBFWAANQUCS-XJKSGUPXSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572615 516404958 /nfs/dbraw/zinc/40/49/58/516404958.db2.gz IEGPBFWAANQUCS-XJKSGUPXSA-N 1 1 362.817 2.762 20 5 FFBDMO COc1ccc(NC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000543887969 516481713 /nfs/dbraw/zinc/48/17/13/516481713.db2.gz QGKMRVSPPHDOLG-BETUJISGSA-N 1 1 350.419 2.988 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](CC(C)C)[NH+]2CCOCC2)c1 ZINC000543899223 516487009 /nfs/dbraw/zinc/48/70/09/516487009.db2.gz WBYMHRTWVHSHJN-HNNXBMFYSA-N 1 1 365.430 2.540 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccnc(N)c3[N+](=O)[O-])cc2)C1 ZINC000547730558 516524320 /nfs/dbraw/zinc/52/43/20/516524320.db2.gz ZOHSRBBGNAZIJB-CYBMUJFWSA-N 1 1 369.425 2.887 20 5 FFBDMO C[N@@H+](CCC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000547736596 516529090 /nfs/dbraw/zinc/52/90/90/516529090.db2.gz OYPWAKQXUOFNSM-UHFFFAOYSA-N 1 1 359.430 2.742 20 5 FFBDMO Cc1nc(N[C@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599582 516547073 /nfs/dbraw/zinc/54/70/73/516547073.db2.gz WVXZVIZQGXZJDT-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1nc(N[C@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599582 516547076 /nfs/dbraw/zinc/54/70/76/516547076.db2.gz WVXZVIZQGXZJDT-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120675 516597839 /nfs/dbraw/zinc/59/78/39/516597839.db2.gz VYMCLPVTPJTHKJ-PBHICJAKSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120675 516597852 /nfs/dbraw/zinc/59/78/52/516597852.db2.gz VYMCLPVTPJTHKJ-PBHICJAKSA-N 1 1 352.456 2.881 20 5 FFBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544147276 516613694 /nfs/dbraw/zinc/61/36/94/516613694.db2.gz YSRSHCDXRVZLEY-WBVHZDCISA-N 1 1 374.437 2.906 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C ZINC000558145448 516615527 /nfs/dbraw/zinc/61/55/27/516615527.db2.gz AJWKZVBSXMSQCM-ZWKOTPCHSA-N 1 1 371.437 2.934 20 5 FFBDMO COc1ccccc1N1CC[C@@H]([N@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O ZINC000554835218 516657757 /nfs/dbraw/zinc/65/77/57/516657757.db2.gz QFEPGNZBCSHIHG-GOSISDBHSA-N 1 1 369.421 2.883 20 5 FFBDMO COc1ccccc1N1CC[C@@H]([N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O ZINC000554835218 516657763 /nfs/dbraw/zinc/65/77/63/516657763.db2.gz QFEPGNZBCSHIHG-GOSISDBHSA-N 1 1 369.421 2.883 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC000544393102 516739781 /nfs/dbraw/zinc/73/97/81/516739781.db2.gz TWCDRXYRCCUTIC-AWEZNQCLSA-N 1 1 364.409 2.816 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000548094719 516759546 /nfs/dbraw/zinc/75/95/46/516759546.db2.gz OJWUUYCITFPYDK-HKUYNNGSSA-N 1 1 368.437 2.882 20 5 FFBDMO C[C@H]1C[NH+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000532139249 516821497 /nfs/dbraw/zinc/82/14/97/516821497.db2.gz YIUHIKDHRICZKJ-KBPBESRZSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCCC[C@H]1C ZINC000519098924 516883954 /nfs/dbraw/zinc/88/39/54/516883954.db2.gz AMUZZHSQNJOKRY-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(C[NH+](C)C)CC1 ZINC000532476979 516993342 /nfs/dbraw/zinc/99/33/42/516993342.db2.gz XEBUBBSOKXOBRF-ZDUSSCGKSA-N 1 1 359.430 2.979 20 5 FFBDMO C[N@@H+](CCc1cccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1)C1CC1 ZINC000537129967 517049225 /nfs/dbraw/zinc/04/92/25/517049225.db2.gz PWRKJPWXLAHTAU-UHFFFAOYSA-N 1 1 371.441 2.802 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1 ZINC000562399489 517082009 /nfs/dbraw/zinc/08/20/09/517082009.db2.gz VNOGPJVLRHMQFD-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1[C@H]1C[C@H]1c1ccccc1 ZINC000537315850 517141090 /nfs/dbraw/zinc/14/10/90/517141090.db2.gz YAJXXHYKKQTXOA-JYJNAYRXSA-N 1 1 357.435 2.903 20 5 FFBDMO CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000548692511 517148202 /nfs/dbraw/zinc/14/82/02/517148202.db2.gz PFQWEZQHMPMGQW-MRXNPFEDSA-N 1 1 361.445 2.990 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000552274510 517173205 /nfs/dbraw/zinc/17/32/05/517173205.db2.gz XRICHCTYSYLOPL-SCZPIIQISA-N 1 1 352.456 2.755 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000552274510 517173209 /nfs/dbraw/zinc/17/32/09/517173209.db2.gz XRICHCTYSYLOPL-SCZPIIQISA-N 1 1 352.456 2.755 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000541872920 517265925 /nfs/dbraw/zinc/26/59/25/517265925.db2.gz IENBFACPVKVBML-NEPJUHHUSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000541872921 517266282 /nfs/dbraw/zinc/26/62/82/517266282.db2.gz IENBFACPVKVBML-NWDGAFQWSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1ccc(CNCC(C)(C)[NH+]2CCC(OC)CC2)cc1[N+](=O)[O-] ZINC000520231057 517311306 /nfs/dbraw/zinc/31/13/06/517311306.db2.gz VISDLVANLVCWRP-UHFFFAOYSA-N 1 1 351.447 2.582 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000552758100 517382868 /nfs/dbraw/zinc/38/28/68/517382868.db2.gz SVPRWVBYPWQEMN-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000533375912 517432408 /nfs/dbraw/zinc/43/24/08/517432408.db2.gz LQXFJNDPMQBMST-VBQJREDUSA-N 1 1 360.458 2.531 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCc4[nH+]ccn4C3)n2)c2c1NCCC2 ZINC000556450500 517436558 /nfs/dbraw/zinc/43/65/58/517436558.db2.gz VHTJBLYEHGJLDG-NSHDSACASA-N 1 1 366.381 2.929 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000546036099 517505470 /nfs/dbraw/zinc/50/54/70/517505470.db2.gz YGSLIDRAXMOMRA-DOTOQJQBSA-N 1 1 362.430 2.668 20 5 FFBDMO Cn1ccnc1[C@@H](NCc1c[nH+]c2n1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000556619294 517523441 /nfs/dbraw/zinc/52/34/41/517523441.db2.gz RVIXAXSYHDYYSH-SFHVURJKSA-N 1 1 366.425 2.740 20 5 FFBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NC1CCCCC1 ZINC000538281014 517538022 /nfs/dbraw/zinc/53/80/22/517538022.db2.gz YPXYLJAJEGKXHN-STQMWFEESA-N 1 1 362.430 2.792 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCC[C@@H](C)C1 ZINC000533823973 517629403 /nfs/dbraw/zinc/62/94/03/517629403.db2.gz CKCFWNCEUNXKAI-HUUCEWRRSA-N 1 1 360.458 2.783 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000533830646 517631782 /nfs/dbraw/zinc/63/17/82/517631782.db2.gz AXALLWSUAUHOGY-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000533830646 517631788 /nfs/dbraw/zinc/63/17/88/517631788.db2.gz AXALLWSUAUHOGY-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[NH+](C)C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000549621817 517640691 /nfs/dbraw/zinc/64/06/91/517640691.db2.gz GQXRESFSDOIALU-INIZCTEOSA-N 1 1 363.801 2.987 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516826135 517858417 /nfs/dbraw/zinc/85/84/17/517858417.db2.gz OROYAWHIIAEYGA-SCLBCKFNSA-N 1 1 373.457 2.600 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCCn1ccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000560514372 517864862 /nfs/dbraw/zinc/86/48/62/517864862.db2.gz KLFRRYRJTKYNHZ-KRWDZBQOSA-N 1 1 354.414 2.684 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000530709896 517933571 /nfs/dbraw/zinc/93/35/71/517933571.db2.gz KJSDWHRIPIZBGT-GOEBONIOSA-N 1 1 356.426 2.716 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000534722127 518011686 /nfs/dbraw/zinc/01/16/86/518011686.db2.gz OYRNAOGJJXENFK-QGZVFWFLSA-N 1 1 360.458 2.511 20 5 FFBDMO COC(=O)c1cc(C)nc(NCCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000557492703 518036229 /nfs/dbraw/zinc/03/62/29/518036229.db2.gz SHLROMKAOSLWDY-AWEZNQCLSA-N 1 1 364.446 2.573 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000534797002 518036533 /nfs/dbraw/zinc/03/65/33/518036533.db2.gz IWCBICILMYULKM-HZPDHXFCSA-N 1 1 357.410 2.651 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000534858658 518060349 /nfs/dbraw/zinc/06/03/49/518060349.db2.gz ISGMLUYABZYGNS-GOEBONIOSA-N 1 1 360.801 2.818 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000534858658 518060357 /nfs/dbraw/zinc/06/03/57/518060357.db2.gz ISGMLUYABZYGNS-GOEBONIOSA-N 1 1 360.801 2.818 20 5 FFBDMO Cc1cccc2ncc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)n21 ZINC000539836389 518170710 /nfs/dbraw/zinc/17/07/10/518170710.db2.gz ASRWQPKJPBSBEY-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000584331052 518284616 /nfs/dbraw/zinc/28/46/16/518284616.db2.gz AOTCZYHJOLPYCO-KRWDZBQOSA-N 1 1 362.474 2.569 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CN(c2ccccc2)CCO1 ZINC000569821836 518311784 /nfs/dbraw/zinc/31/17/84/518311784.db2.gz DNGVAXWVQJEGKR-HXUWFJFHSA-N 1 1 355.438 2.975 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584677003 518424260 /nfs/dbraw/zinc/42/42/60/518424260.db2.gz HHRXONDGPLHDDQ-ZDUSSCGKSA-N 1 1 361.446 2.648 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2ccc3cn[nH]c3c2)n1 ZINC000585765415 518589904 /nfs/dbraw/zinc/58/99/04/518589904.db2.gz BRHHNNBAWBSKIS-DOTOQJQBSA-N 1 1 354.414 2.984 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]21 ZINC000585767607 518591359 /nfs/dbraw/zinc/59/13/59/518591359.db2.gz LSACHTBDMXOVIG-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO CO[C@@]1(C)CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000579488744 518706433 /nfs/dbraw/zinc/70/64/33/518706433.db2.gz ARIFUHLARYPFDM-SFHVURJKSA-N 1 1 363.414 2.784 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579608258 518763385 /nfs/dbraw/zinc/76/33/85/518763385.db2.gz MZXNEGPIINCPLX-QGZVFWFLSA-N 1 1 368.437 2.645 20 5 FFBDMO C[C@@H]1C[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000571019502 518887708 /nfs/dbraw/zinc/88/77/08/518887708.db2.gz GJLREGDKHUZYLS-HUUCEWRRSA-N 1 1 373.457 2.798 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)C1CC1 ZINC000573941242 518911530 /nfs/dbraw/zinc/91/15/30/518911530.db2.gz YDNABWXHPYOIKL-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC=C(c3cccnc3)C2)c1 ZINC000589163605 518935898 /nfs/dbraw/zinc/93/58/98/518935898.db2.gz YXVOYFXRJRMEFZ-GOSISDBHSA-N 1 1 355.394 2.519 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH+](CC2Cc3ccccc3C2)CC1 ZINC000589496079 519018713 /nfs/dbraw/zinc/01/87/13/519018713.db2.gz OUTNRNDBYXBISN-UHFFFAOYSA-N 1 1 371.462 2.829 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCOc2ccc(OC)cc2)c1 ZINC000589495236 519018760 /nfs/dbraw/zinc/01/87/60/519018760.db2.gz KGDWLTCBNMHIGU-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCOc2ccc(OC)cc2)c1 ZINC000589495236 519018765 /nfs/dbraw/zinc/01/87/65/519018765.db2.gz KGDWLTCBNMHIGU-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCO)Cc2ccc(C)cc2)c1 ZINC000589510574 519021797 /nfs/dbraw/zinc/02/17/97/519021797.db2.gz LJPSINGPSLUNIC-UHFFFAOYSA-N 1 1 358.394 2.684 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)Cc2ccc(C)cc2)c1 ZINC000589510574 519021804 /nfs/dbraw/zinc/02/18/04/519021804.db2.gz LJPSINGPSLUNIC-UHFFFAOYSA-N 1 1 358.394 2.684 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000580204334 519057629 /nfs/dbraw/zinc/05/76/29/519057629.db2.gz CLPCCPIMZIWPGH-KRWDZBQOSA-N 1 1 364.446 2.636 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000568572043 519105483 /nfs/dbraw/zinc/10/54/83/519105483.db2.gz VDVBEPLBHKUPOV-NSHDSACASA-N 1 1 351.378 2.807 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565788102 519134187 /nfs/dbraw/zinc/13/41/87/519134187.db2.gz ZMMYZBQXCLMEMF-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565788102 519134191 /nfs/dbraw/zinc/13/41/91/519134191.db2.gz ZMMYZBQXCLMEMF-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000568683902 519161661 /nfs/dbraw/zinc/16/16/61/519161661.db2.gz SYTZBJRHSORTSC-CYBMUJFWSA-N 1 1 355.822 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(OCCCO)CC2)c1 ZINC000590162417 519165025 /nfs/dbraw/zinc/16/50/25/519165025.db2.gz RTWFSRNWROSGPV-UHFFFAOYSA-N 1 1 362.348 2.977 20 5 FFBDMO C[N@@H+](CCNc1ncnc2cccc([N+](=O)[O-])c21)Cc1ccc(F)cc1 ZINC000568696327 519167072 /nfs/dbraw/zinc/16/70/72/519167072.db2.gz YLRFQTJXCIUGSZ-UHFFFAOYSA-N 1 1 355.373 2.643 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000580673164 519295204 /nfs/dbraw/zinc/29/52/04/519295204.db2.gz VVIUQTNELSABFT-UHFFFAOYSA-N 1 1 356.426 2.513 20 5 FFBDMO C[C@@H]1CSCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000571854743 519308992 /nfs/dbraw/zinc/30/89/92/519308992.db2.gz HPNMAMRKNWNPGF-LBPRGKRZSA-N 1 1 351.428 2.578 20 5 FFBDMO CC[C@H](C)[NH2+][C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000580793377 519362007 /nfs/dbraw/zinc/36/20/07/519362007.db2.gz DXCGASLDEZDDQD-XHDPSFHLSA-N 1 1 371.397 2.923 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](OC(F)F)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000578250029 519496368 /nfs/dbraw/zinc/49/63/68/519496368.db2.gz NCZCYYKAICVLNV-AWEZNQCLSA-N 1 1 352.341 2.809 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC=C(c3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000602886089 519948314 /nfs/dbraw/zinc/94/83/14/519948314.db2.gz GLORKKFVJKAUBI-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599933824 519958570 /nfs/dbraw/zinc/95/85/70/519958570.db2.gz LSSQQIJWRQUFNO-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594482973 519992467 /nfs/dbraw/zinc/99/24/67/519992467.db2.gz GSLZUZDGZIDMNJ-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2CC2CC2)C[C@H]1C ZINC000597408010 520008085 /nfs/dbraw/zinc/00/80/85/520008085.db2.gz IOTCSFWQPWEVRW-CQSZACIVSA-N 1 1 370.457 2.794 20 5 FFBDMO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000591723147 520009853 /nfs/dbraw/zinc/00/98/53/520009853.db2.gz ILVCPQDELQTHHJ-ZDUSSCGKSA-N 1 1 372.429 2.592 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21 ZINC000602997286 520012824 /nfs/dbraw/zinc/01/28/24/520012824.db2.gz HBIBDXLGRJJDST-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600092836 520040527 /nfs/dbraw/zinc/04/05/27/520040527.db2.gz JTPFQBKTVXBOAF-JTQLQIEISA-N 1 1 370.247 2.960 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597576364 520113317 /nfs/dbraw/zinc/11/33/17/520113317.db2.gz BSDWHQLVJNLGHM-NXHRZFHOSA-N 1 1 363.433 2.808 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000600252611 520159966 /nfs/dbraw/zinc/15/99/66/520159966.db2.gz KKVTXLKOMDCGBS-SFHVURJKSA-N 1 1 370.453 2.916 20 5 FFBDMO C[C@@H](CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000594817902 520171726 /nfs/dbraw/zinc/17/17/26/520171726.db2.gz VKIGLCVLGGSEGF-QMMMGPOBSA-N 1 1 370.258 2.520 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131048 520206581 /nfs/dbraw/zinc/20/65/81/520206581.db2.gz RWCGONLZYQVKMI-WKILWMFISA-N 1 1 350.415 2.654 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](n4ccnc4)C3)n2)cc1 ZINC000609157408 520214186 /nfs/dbraw/zinc/21/41/86/520214186.db2.gz KJYWXYPRTMNBHZ-HNNXBMFYSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](n4ccnc4)C3)n2)cc1 ZINC000609157408 520214195 /nfs/dbraw/zinc/21/41/95/520214195.db2.gz KJYWXYPRTMNBHZ-HNNXBMFYSA-N 1 1 354.370 2.678 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1[C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)CCOCC2 ZINC000592183923 520249415 /nfs/dbraw/zinc/24/94/15/520249415.db2.gz LFJILTUSDNKZTN-YOEHRIQHSA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000603402186 520250006 /nfs/dbraw/zinc/25/00/06/520250006.db2.gz OFPOSSXGKWNDQZ-AWEZNQCLSA-N 1 1 360.458 2.558 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)N(C)C ZINC000595015380 520257404 /nfs/dbraw/zinc/25/74/04/520257404.db2.gz DEXNOHVNCOFEHD-KBXCAEBGSA-N 1 1 371.437 2.954 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000600469380 520278863 /nfs/dbraw/zinc/27/88/63/520278863.db2.gz AJYGPZUIJFJJJC-AWEZNQCLSA-N 1 1 370.409 2.595 20 5 FFBDMO C[C@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[N@H+]1CCCC[C@@H]1C ZINC000603743034 520352749 /nfs/dbraw/zinc/35/27/49/520352749.db2.gz RHYXEHMYWZMXIX-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000603854332 520379328 /nfs/dbraw/zinc/37/93/28/520379328.db2.gz WACWAVKHZJNGQC-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000603854332 520379334 /nfs/dbraw/zinc/37/93/34/520379334.db2.gz WACWAVKHZJNGQC-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000598040547 520388802 /nfs/dbraw/zinc/38/88/02/520388802.db2.gz HTNPBLQEPSNTMB-TZMCWYRMSA-N 1 1 369.849 2.958 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609758131 520422787 /nfs/dbraw/zinc/42/27/87/520422787.db2.gz LBPIPTADTRSQFF-BBRMVZONSA-N 1 1 358.442 2.868 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000592525607 520440068 /nfs/dbraw/zinc/44/00/68/520440068.db2.gz AUBDQKHSCBLPBM-OQRGYWNNSA-N 1 1 371.359 2.999 20 5 FFBDMO COc1ccc(CC(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000598220049 520501767 /nfs/dbraw/zinc/50/17/67/520501767.db2.gz OMBHTAIGIYBMGZ-HNNXBMFYSA-N 1 1 361.442 2.669 20 5 FFBDMO COCC[C@H]1CCCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000613503381 520533900 /nfs/dbraw/zinc/53/39/00/520533900.db2.gz QZYJAJBHOCHWDB-QAPCUYQASA-N 1 1 361.442 2.839 20 5 FFBDMO Cc1noc(C[N@H+](CCC(=O)OC(C)(C)C)C2CCOCC2)c1[N+](=O)[O-] ZINC000595559385 520553490 /nfs/dbraw/zinc/55/34/90/520553490.db2.gz OBMNUBAVHCVLSC-UHFFFAOYSA-N 1 1 369.418 2.604 20 5 FFBDMO Cc1noc(C[N@@H+](CCC(=O)OC(C)(C)C)C2CCOCC2)c1[N+](=O)[O-] ZINC000595559385 520553497 /nfs/dbraw/zinc/55/34/97/520553497.db2.gz OBMNUBAVHCVLSC-UHFFFAOYSA-N 1 1 369.418 2.604 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000604427091 520559654 /nfs/dbraw/zinc/55/96/54/520559654.db2.gz KLGQXODUEZMVFY-ZDUSSCGKSA-N 1 1 368.821 2.577 20 5 FFBDMO CCCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000592830161 520606503 /nfs/dbraw/zinc/60/65/03/520606503.db2.gz COLRQHFXJKYWED-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO CCCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[C@@H]1CC[N@@H+](C)C1 ZINC000592828868 520607254 /nfs/dbraw/zinc/60/72/54/520607254.db2.gz KIKGJJUTUZZCRD-OAHLLOKOSA-N 1 1 357.414 2.541 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000598466960 520630674 /nfs/dbraw/zinc/63/06/74/520630674.db2.gz XVTQEKUIBFSMBY-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000601132597 520652237 /nfs/dbraw/zinc/65/22/37/520652237.db2.gz KHESSUQUQOAREJ-ZYHUDNBSSA-N 1 1 373.379 2.800 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCO ZINC000595694708 520655460 /nfs/dbraw/zinc/65/54/60/520655460.db2.gz FHZLSRMHFJOYHQ-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCO ZINC000595694708 520655463 /nfs/dbraw/zinc/65/54/63/520655463.db2.gz FHZLSRMHFJOYHQ-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO O=C(C[NH2+][C@@H](Cn1cccn1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610432834 520682489 /nfs/dbraw/zinc/68/24/89/520682489.db2.gz BTZKTFYGIGSJDV-KRWDZBQOSA-N 1 1 365.393 2.761 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3cc(C)[nH]n3)CC2)c1 ZINC000593021324 520690076 /nfs/dbraw/zinc/69/00/76/520690076.db2.gz VHXDKZBTTQWXLL-UHFFFAOYSA-N 1 1 358.398 2.793 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3cc(C)n[nH]3)CC2)c1 ZINC000593021324 520690087 /nfs/dbraw/zinc/69/00/87/520690087.db2.gz VHXDKZBTTQWXLL-UHFFFAOYSA-N 1 1 358.398 2.793 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000610446090 520691057 /nfs/dbraw/zinc/69/10/57/520691057.db2.gz PHMWBNBEKBTTFT-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](OCc3ccncc3)C2)c1 ZINC000593029421 520693724 /nfs/dbraw/zinc/69/37/24/520693724.db2.gz UETOIWLNVSZRDG-QGZVFWFLSA-N 1 1 371.393 2.568 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](OCc3ccncc3)C2)c1 ZINC000593029421 520693733 /nfs/dbraw/zinc/69/37/33/520693733.db2.gz UETOIWLNVSZRDG-QGZVFWFLSA-N 1 1 371.393 2.568 20 5 FFBDMO COc1cc(C[N@H+](C)CC2=CCCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000595754582 520701617 /nfs/dbraw/zinc/70/16/17/520701617.db2.gz YBVHWPJYEIRPLG-UHFFFAOYSA-N 1 1 358.341 2.983 20 5 FFBDMO COc1cc(C[N@@H+](C)CC2=CCCOC2)c([N+](=O)[O-])cc1OC(F)F ZINC000595754582 520701629 /nfs/dbraw/zinc/70/16/29/520701629.db2.gz YBVHWPJYEIRPLG-UHFFFAOYSA-N 1 1 358.341 2.983 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000598557364 520704059 /nfs/dbraw/zinc/70/40/59/520704059.db2.gz FSVVIFAFCZTFGV-MRXNPFEDSA-N 1 1 361.442 2.520 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595761039 520705944 /nfs/dbraw/zinc/70/59/44/520705944.db2.gz WDTMZBLQVKFLSJ-ZBEGNZNMSA-N 1 1 358.341 2.673 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOc2ccc(O)cc2C1 ZINC000595844332 520762436 /nfs/dbraw/zinc/76/24/36/520762436.db2.gz HENXRDYLJABQHC-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOc2ccc(O)cc2C1 ZINC000595844332 520762445 /nfs/dbraw/zinc/76/24/45/520762445.db2.gz HENXRDYLJABQHC-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000595881547 520789584 /nfs/dbraw/zinc/78/95/84/520789584.db2.gz UAKQICNTEXQEFZ-SJORKVTESA-N 1 1 356.422 2.996 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1ccccc1Br ZINC000610675233 520790604 /nfs/dbraw/zinc/79/06/04/520790604.db2.gz PQQPPTSALFZMFM-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccccc1Br ZINC000610675233 520790612 /nfs/dbraw/zinc/79/06/12/520790612.db2.gz PQQPPTSALFZMFM-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595900730 520804866 /nfs/dbraw/zinc/80/48/66/520804866.db2.gz JIJDNWLLSDOAFS-RDJZCZTQSA-N 1 1 374.485 2.942 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)cc1OC ZINC000593188158 520811774 /nfs/dbraw/zinc/81/17/74/520811774.db2.gz WWZMRGRAPJDZFP-FRRDWIJNSA-N 1 1 365.430 2.555 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000593188804 520813891 /nfs/dbraw/zinc/81/38/91/520813891.db2.gz QBULVCHSGGLTMK-HBNTYKKESA-N 1 1 370.247 2.910 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC000595920972 520825822 /nfs/dbraw/zinc/82/58/22/520825822.db2.gz VYQNTPONUOBEER-PXAZEXFGSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC000595920972 520825828 /nfs/dbraw/zinc/82/58/28/520825828.db2.gz VYQNTPONUOBEER-PXAZEXFGSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccc(Br)cc1 ZINC000610782750 520841734 /nfs/dbraw/zinc/84/17/34/520841734.db2.gz YPRZTOBZLNIBTB-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C2)C1 ZINC000601602030 520862402 /nfs/dbraw/zinc/86/24/02/520862402.db2.gz FVZZVMICUVYFJE-LJQANCHMSA-N 1 1 357.454 2.961 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1 ZINC000596039686 520872559 /nfs/dbraw/zinc/87/25/59/520872559.db2.gz RZXGQVCDWCCLEX-HKUYNNGSSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1 ZINC000596039686 520872564 /nfs/dbraw/zinc/87/25/64/520872564.db2.gz RZXGQVCDWCCLEX-HKUYNNGSSA-N 1 1 369.421 2.957 20 5 FFBDMO CC1CCC(O)(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000596094005 520907432 /nfs/dbraw/zinc/90/74/32/520907432.db2.gz GDQJKZBUEULSHS-KGYZHSKHSA-N 1 1 358.442 2.949 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593323656 520909686 /nfs/dbraw/zinc/90/96/86/520909686.db2.gz SKNVZTFGVXKQIT-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593323656 520909696 /nfs/dbraw/zinc/90/96/96/520909696.db2.gz SKNVZTFGVXKQIT-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)c1 ZINC000593324020 520911273 /nfs/dbraw/zinc/91/12/73/520911273.db2.gz VRCOHTKTARGFRT-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)c1 ZINC000593324020 520911278 /nfs/dbraw/zinc/91/12/78/520911278.db2.gz VRCOHTKTARGFRT-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO C[C@H](c1cccc(Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)c1)[NH+]1CCOCC1 ZINC000596113060 520919193 /nfs/dbraw/zinc/91/91/93/520919193.db2.gz KHRRGMKYGBJHJF-CYBMUJFWSA-N 1 1 370.409 2.831 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000601726304 520921237 /nfs/dbraw/zinc/92/12/37/520921237.db2.gz HTRCKZYBDHPGQG-INIZCTEOSA-N 1 1 371.441 2.503 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596160218 520944942 /nfs/dbraw/zinc/94/49/42/520944942.db2.gz BEXFBBZZSRQGTP-BXKDBHETSA-N 1 1 353.806 2.929 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611087875 520978162 /nfs/dbraw/zinc/97/81/62/520978162.db2.gz PHOXBORYBLETBT-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611087875 520978168 /nfs/dbraw/zinc/97/81/68/520978168.db2.gz PHOXBORYBLETBT-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596269023 521002892 /nfs/dbraw/zinc/00/28/92/521002892.db2.gz QWVJGNFCHNWPLQ-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000611182176 521027351 /nfs/dbraw/zinc/02/73/51/521027351.db2.gz XMDKSGFZKXTCGR-INIZCTEOSA-N 1 1 356.426 2.601 20 5 FFBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000611185150 521029433 /nfs/dbraw/zinc/02/94/33/521029433.db2.gz LZEMHSSFJQKBBZ-KRWDZBQOSA-N 1 1 357.410 2.992 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@@H](C(F)F)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601969433 521046030 /nfs/dbraw/zinc/04/60/30/521046030.db2.gz DCCLENCUFKYQGW-OAHLLOKOSA-N 1 1 366.368 2.851 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000596477867 521090673 /nfs/dbraw/zinc/09/06/73/521090673.db2.gz LCVHDQRFZKLGDI-ZDUSSCGKSA-N 1 1 362.430 2.985 20 5 FFBDMO COc1ccc(OCC[N@H+]2Cc3cnn(C)c3CC(C)(C)C2)c([N+](=O)[O-])c1 ZINC000596599675 521158760 /nfs/dbraw/zinc/15/87/60/521158760.db2.gz VZWSRJOLNIMEHT-UHFFFAOYSA-N 1 1 374.441 2.800 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](N[C@@H]2CCC[N@@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712890 521169205 /nfs/dbraw/zinc/16/92/05/521169205.db2.gz QQIIJHZOXVHRKO-HIFRSBDPSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](N[C@@H]2CCC[N@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712890 521169216 /nfs/dbraw/zinc/16/92/16/521169216.db2.gz QQIIJHZOXVHRKO-HIFRSBDPSA-N 1 1 361.364 2.635 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599399716 521199756 /nfs/dbraw/zinc/19/97/56/521199756.db2.gz XMCRIXFOZODBJR-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO Cc1ccc(CNC(=O)Cc2ccccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611572187 521226117 /nfs/dbraw/zinc/22/61/17/521226117.db2.gz LEEZYVJFCDVLIK-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c(Cl)c1 ZINC000599464862 521240954 /nfs/dbraw/zinc/24/09/54/521240954.db2.gz VDUVBBRDLVFPMG-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c(C)c1[N+](=O)[O-] ZINC000599464170 521241105 /nfs/dbraw/zinc/24/11/05/521241105.db2.gz JQPMYYDJDXKWRE-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1C[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H](C)C1(F)F ZINC000599512319 521268541 /nfs/dbraw/zinc/26/85/41/521268541.db2.gz ICTZAWRPYWBJCV-VXGBXAGGSA-N 1 1 353.369 2.707 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553109 521292933 /nfs/dbraw/zinc/29/29/33/521292933.db2.gz NLZUWULWNPFDOH-KGLIPLIRSA-N 1 1 363.439 2.863 20 5 FFBDMO C[NH+](C)C[C@H](NCCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c(Cl)c1 ZINC000599628988 521342766 /nfs/dbraw/zinc/34/27/66/521342766.db2.gz WKYKXLUZOSUFMX-HNNXBMFYSA-N 1 1 372.256 2.991 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000599670203 521383666 /nfs/dbraw/zinc/38/36/66/521383666.db2.gz SIUJUHSNGSKENJ-SFHVURJKSA-N 1 1 356.378 2.746 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000599688712 521403539 /nfs/dbraw/zinc/40/35/39/521403539.db2.gz LSFYRHSTRQEFJR-BTTYYORXSA-N 1 1 366.414 2.644 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000599697171 521408488 /nfs/dbraw/zinc/40/84/88/521408488.db2.gz WGADGKYMJHECGR-QGZVFWFLSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000599697171 521408494 /nfs/dbraw/zinc/40/84/94/521408494.db2.gz WGADGKYMJHECGR-QGZVFWFLSA-N 1 1 370.409 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]CCOCC(F)(F)C(F)F)nc2c1 ZINC000602632364 521447550 /nfs/dbraw/zinc/44/75/50/521447550.db2.gz IFXIEGLJYYFXTA-UHFFFAOYSA-N 1 1 351.256 2.743 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000594198964 521464590 /nfs/dbraw/zinc/46/45/90/521464590.db2.gz WQICGJKXWJUHKM-KBPBESRZSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000594198699 521465440 /nfs/dbraw/zinc/46/54/40/521465440.db2.gz VCPGVBPGRAHVAS-CVEARBPZSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNCC3CC[NH+](C4CCOCC4)CC3)nc2c1 ZINC000602704076 521487419 /nfs/dbraw/zinc/48/74/19/521487419.db2.gz BXFOXDWVJJOYOP-UHFFFAOYSA-N 1 1 374.441 2.717 20 5 FFBDMO CN(C)C(=O)N(C)[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602719609 521495060 /nfs/dbraw/zinc/49/50/60/521495060.db2.gz ZTCFLEPMNMTNGL-CYBMUJFWSA-N 1 1 374.363 2.801 20 5 FFBDMO CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602719609 521495067 /nfs/dbraw/zinc/49/50/67/521495067.db2.gz ZTCFLEPMNMTNGL-CYBMUJFWSA-N 1 1 374.363 2.801 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597091139 521496213 /nfs/dbraw/zinc/49/62/13/521496213.db2.gz VSZGUZWDBRZKNH-SNVBAGLBSA-N 1 1 355.826 2.825 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597093932 521499578 /nfs/dbraw/zinc/49/95/78/521499578.db2.gz CYBVNAUCLLCZOB-CMPLNLGQSA-N 1 1 353.810 2.579 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599832238 521500162 /nfs/dbraw/zinc/50/01/62/521500162.db2.gz TWQVNJLAWYSYLK-ZDUSSCGKSA-N 1 1 357.414 2.949 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CCC[N@@H+](Cc2ccccc2C)CC1 ZINC000602758986 521517883 /nfs/dbraw/zinc/51/78/83/521517883.db2.gz ITIDNALLQQKWKK-UHFFFAOYSA-N 1 1 357.458 2.616 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CCC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000602780797 521528634 /nfs/dbraw/zinc/52/86/34/521528634.db2.gz SAGKIMRKFKBXAZ-MRXNPFEDSA-N 1 1 357.458 2.696 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CN3CC[NH+]([C@@H]4CCOC4)CC3)cs2)c1 ZINC000597203840 521573458 /nfs/dbraw/zinc/57/34/58/521573458.db2.gz YELOMAYIHPJLAS-QGZVFWFLSA-N 1 1 374.466 2.625 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]2N1 ZINC000597205844 521573752 /nfs/dbraw/zinc/57/37/52/521573752.db2.gz LICKEDIRTPREGB-CZUORRHYSA-N 1 1 372.450 2.819 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]2N1 ZINC000597205844 521573761 /nfs/dbraw/zinc/57/37/61/521573761.db2.gz LICKEDIRTPREGB-CZUORRHYSA-N 1 1 372.450 2.819 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCC(=O)N(C)CC3)o2)c([N+](=O)[O-])c1 ZINC000597213418 521579724 /nfs/dbraw/zinc/57/97/24/521579724.db2.gz CEXLWRVXRMBTRF-UHFFFAOYSA-N 1 1 359.382 2.528 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000619537112 521757311 /nfs/dbraw/zinc/75/73/11/521757311.db2.gz VKGVQBQTUPSNBJ-DNVCBOLYSA-N 1 1 373.453 2.757 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000619864426 521909712 /nfs/dbraw/zinc/90/97/12/521909712.db2.gz OZJKWYBURAEOJN-APWZRJJASA-N 1 1 374.441 2.625 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000619866844 521910556 /nfs/dbraw/zinc/91/05/56/521910556.db2.gz DSJVNSURQHJXBX-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000619866844 521910571 /nfs/dbraw/zinc/91/05/71/521910571.db2.gz DSJVNSURQHJXBX-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000619867251 521911069 /nfs/dbraw/zinc/91/10/69/521911069.db2.gz NIROOUPEMCSMTF-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000619867251 521911076 /nfs/dbraw/zinc/91/10/76/521911076.db2.gz NIROOUPEMCSMTF-UHFFFAOYSA-N 1 1 363.801 2.925 20 5 FFBDMO Cc1[nH+]c2cc(Nc3ccc(-c4nn[nH]n4)cc3[N+](=O)[O-])ccc2n1C ZINC000822459884 599108379 /nfs/dbraw/zinc/10/83/79/599108379.db2.gz ZXNJXACBCCNQPE-UHFFFAOYSA-N 1 1 350.342 2.714 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2-c2nn[nH]n2)C2CC2)c1 ZINC000823648606 607176850 /nfs/dbraw/zinc/17/68/50/607176850.db2.gz YNRVPTCJOJXPRT-UHFFFAOYSA-N 1 1 350.382 2.940 20 5 FFBDMO Cc1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC001164896266 721511774 /nfs/dbraw/zinc/51/17/74/721511774.db2.gz AESSGNGEUAHDJU-RDJZCZTQSA-N 1 1 372.400 2.779 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932511 721855167 /nfs/dbraw/zinc/85/51/67/721855167.db2.gz YNOSJQLJNVGIQI-OALUTQOASA-N 1 1 369.469 2.666 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932511 721855168 /nfs/dbraw/zinc/85/51/68/721855168.db2.gz YNOSJQLJNVGIQI-OALUTQOASA-N 1 1 369.469 2.666 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000154023532 728794335 /nfs/dbraw/zinc/79/43/35/728794335.db2.gz OCWKNYBHFMZISM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000154023532 728794339 /nfs/dbraw/zinc/79/43/39/728794339.db2.gz OCWKNYBHFMZISM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000081096039 728393960 /nfs/dbraw/zinc/39/39/60/728393960.db2.gz JRAVLPFOIBHNAA-DOMZBBRYSA-N 1 1 368.865 2.849 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000092627073 728469621 /nfs/dbraw/zinc/46/96/21/728469621.db2.gz OUHWDJZKYJNHDY-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188168 728559097 /nfs/dbraw/zinc/55/90/97/728559097.db2.gz BZTHEOWJCCDCKK-HIFRSBDPSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188168 728559100 /nfs/dbraw/zinc/55/91/00/728559100.db2.gz BZTHEOWJCCDCKK-HIFRSBDPSA-N 1 1 355.822 2.812 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O ZINC000779206841 738442966 /nfs/dbraw/zinc/44/29/66/738442966.db2.gz REVZJVZBTIOKHP-SWLSCSKDSA-N 1 1 369.849 2.916 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O ZINC000779206841 738442969 /nfs/dbraw/zinc/44/29/69/738442969.db2.gz REVZJVZBTIOKHP-SWLSCSKDSA-N 1 1 369.849 2.916 20 5 FFBDMO C[C@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000859567881 730459192 /nfs/dbraw/zinc/45/91/92/730459192.db2.gz WCEXGPNAKKHBCK-GRYCIOLGSA-N 1 1 352.362 2.721 20 5 FFBDMO C[C@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000859567881 730459193 /nfs/dbraw/zinc/45/91/93/730459193.db2.gz WCEXGPNAKKHBCK-GRYCIOLGSA-N 1 1 352.362 2.721 20 5 FFBDMO COCCCOCC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000779604237 738471862 /nfs/dbraw/zinc/47/18/62/738471862.db2.gz SPVFKONDIMYREU-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C ZINC000860099213 730476263 /nfs/dbraw/zinc/47/62/63/730476263.db2.gz AJEWQBUKGQBCID-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C ZINC000860099213 730476264 /nfs/dbraw/zinc/47/62/64/730476264.db2.gz AJEWQBUKGQBCID-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000861035126 730569442 /nfs/dbraw/zinc/56/94/42/730569442.db2.gz UAYYQIVFFCUMQM-INIZCTEOSA-N 1 1 350.415 2.526 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000861340145 730600567 /nfs/dbraw/zinc/60/05/67/730600567.db2.gz FFZMUYULNXRSIX-RVSPLBMKSA-N 1 1 368.455 2.728 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000861352739 730603334 /nfs/dbraw/zinc/60/33/34/730603334.db2.gz KBLBWDUJCDIMMU-FZKQIMNGSA-N 1 1 350.415 2.525 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1Cl)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861986738 730658844 /nfs/dbraw/zinc/65/88/44/730658844.db2.gz XTSXMHMYGAYHKO-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1F ZINC000863031912 730744352 /nfs/dbraw/zinc/74/43/52/730744352.db2.gz KFQRFIALFMFYKP-LBPRGKRZSA-N 1 1 353.369 2.928 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2CC[NH+](Cc3ccsc3)CC2)cc1F ZINC000865418018 730952442 /nfs/dbraw/zinc/95/24/42/730952442.db2.gz GLEHHTNRKZKAFZ-UHFFFAOYSA-N 1 1 351.403 2.610 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNc2cc(F)c([N+](=O)[O-])cc2CO)C[C@H](C)O1 ZINC000865426047 730953223 /nfs/dbraw/zinc/95/32/23/730953223.db2.gz ZNGDRJPVDBMGPP-RYUDHWBXSA-N 1 1 355.410 2.526 20 5 FFBDMO CC1(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)OCCCO1 ZINC000877475327 732368174 /nfs/dbraw/zinc/36/81/74/732368174.db2.gz OXODGHJEWDATME-UHFFFAOYSA-N 1 1 351.222 2.662 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878336202 732516411 /nfs/dbraw/zinc/51/64/11/732516411.db2.gz UXEIFBFBNYIOGV-GHMZBOCLSA-N 1 1 365.821 2.823 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419272 732699624 /nfs/dbraw/zinc/69/96/24/732699624.db2.gz LCELFTSNRKJPLC-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419272 732699628 /nfs/dbraw/zinc/69/96/28/732699628.db2.gz LCELFTSNRKJPLC-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2CSC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560072 732723064 /nfs/dbraw/zinc/72/30/64/732723064.db2.gz FBLCDMGVUDYBIW-GHMZBOCLSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2CSC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560072 732723066 /nfs/dbraw/zinc/72/30/66/732723066.db2.gz FBLCDMGVUDYBIW-GHMZBOCLSA-N 1 1 355.847 2.872 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000879709526 732756224 /nfs/dbraw/zinc/75/62/24/732756224.db2.gz MAGCYQPOGSMALN-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008762 732818836 /nfs/dbraw/zinc/81/88/36/732818836.db2.gz HDKAYOSQULOXOA-UONOGXRCSA-N 1 1 363.439 2.589 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCO[C@H](C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000880047658 732830493 /nfs/dbraw/zinc/83/04/93/732830493.db2.gz WCLKKKOMWDKBRS-AWEZNQCLSA-N 1 1 364.320 2.635 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCO[C@H](C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000880047658 732830500 /nfs/dbraw/zinc/83/05/00/732830500.db2.gz WCLKKKOMWDKBRS-AWEZNQCLSA-N 1 1 364.320 2.635 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000883609032 733411264 /nfs/dbraw/zinc/41/12/64/733411264.db2.gz MRBTWRUJURRCTD-GFCCVEGCSA-N 1 1 360.336 2.507 20 5 FFBDMO CC(C)(C)OC(=O)NCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886057861 733744287 /nfs/dbraw/zinc/74/42/87/733744287.db2.gz ZPULDTPHSHZQOL-UHFFFAOYSA-N 1 1 350.419 2.727 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886118834 733751737 /nfs/dbraw/zinc/75/17/37/733751737.db2.gz QMLUNAXISUUWEY-CHWSQXEVSA-N 1 1 350.419 2.725 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000887925045 733993791 /nfs/dbraw/zinc/99/37/91/733993791.db2.gz BUYOYVFEDWOIAB-ABAIWWIYSA-N 1 1 357.332 2.637 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000888834673 734103875 /nfs/dbraw/zinc/10/38/75/734103875.db2.gz NIEWIYQRLGJVBB-GXTWGEPZSA-N 1 1 350.419 2.940 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c1 ZINC000928093968 738820931 /nfs/dbraw/zinc/82/09/31/738820931.db2.gz FJOYNNLWZKETII-ZFWWWQNUSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c1 ZINC000928093968 738820934 /nfs/dbraw/zinc/82/09/34/738820934.db2.gz FJOYNNLWZKETII-ZFWWWQNUSA-N 1 1 367.496 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[NH+]3CCC(C4OCCO4)CC3)c2c1 ZINC000738138180 735022808 /nfs/dbraw/zinc/02/28/08/735022808.db2.gz KMOSJGVUMUSHHQ-UHFFFAOYSA-N 1 1 365.411 2.914 20 5 FFBDMO C[N@H+]1CCCC12CCN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC2 ZINC000784256477 738872850 /nfs/dbraw/zinc/87/28/50/738872850.db2.gz CTOVBJLRHPISDA-UHFFFAOYSA-N 1 1 366.849 2.747 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000740886550 735095452 /nfs/dbraw/zinc/09/54/52/735095452.db2.gz UEZPBVNWESJBRW-GXTWGEPZSA-N 1 1 368.865 2.991 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c(OC(F)F)c1 ZINC000896522030 735172388 /nfs/dbraw/zinc/17/23/88/735172388.db2.gz MYESOGNDOLVHAK-ZDUSSCGKSA-N 1 1 357.357 2.861 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cccc1C(F)(F)F ZINC000897216015 735207195 /nfs/dbraw/zinc/20/71/95/735207195.db2.gz GRBYLLJFFFBNES-STQMWFEESA-N 1 1 359.348 2.649 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H](C3CCOCC3)C2)c1[N+](=O)[O-] ZINC000897269747 735213340 /nfs/dbraw/zinc/21/33/40/735213340.db2.gz OLFZLWKGGAVDRC-CQSZACIVSA-N 1 1 350.415 2.948 20 5 FFBDMO O=[N+]([O-])c1sc(C[NH2+]Cc2cnn(CCF)c2)cc1Br ZINC000897731583 735270529 /nfs/dbraw/zinc/27/05/29/735270529.db2.gz AYRDNYIBBCGALT-UHFFFAOYSA-N 1 1 363.212 2.875 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000906240751 736475307 /nfs/dbraw/zinc/47/53/07/736475307.db2.gz OZROIAPYEXCWGC-KBPBESRZSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000907795538 736668413 /nfs/dbraw/zinc/66/84/13/736668413.db2.gz YNAKFWSRQCSOGV-NWDGAFQWSA-N 1 1 359.760 2.646 20 5 FFBDMO O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000907795537 736668500 /nfs/dbraw/zinc/66/85/00/736668500.db2.gz YNAKFWSRQCSOGV-NEPJUHHUSA-N 1 1 359.760 2.646 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C2 ZINC000908534302 736790976 /nfs/dbraw/zinc/79/09/76/736790976.db2.gz BCBPXTKGBXRJSM-INIZCTEOSA-N 1 1 355.797 2.945 20 5 FFBDMO CN(C)c1cc[nH+]c(NCc2ccc(Br)c([N+](=O)[O-])c2)n1 ZINC000766109186 737195787 /nfs/dbraw/zinc/19/57/87/737195787.db2.gz SYGJOGWCSRXCQF-UHFFFAOYSA-N 1 1 352.192 2.825 20 5 FFBDMO COc1cc(C[NH+]2CCC(N(C)CC(F)F)CC2)c([N+](=O)[O-])cc1F ZINC000766825783 737266174 /nfs/dbraw/zinc/26/61/74/737266174.db2.gz CEOBZTPFKOFEFN-UHFFFAOYSA-N 1 1 361.364 2.904 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000768542220 737431134 /nfs/dbraw/zinc/43/11/34/737431134.db2.gz QNLSJWGYQISEGJ-GXTWGEPZSA-N 1 1 369.849 2.611 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769484965 737534380 /nfs/dbraw/zinc/53/43/80/737534380.db2.gz YADFYGVFHUYSLQ-JTQLQIEISA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC000769484965 737534386 /nfs/dbraw/zinc/53/43/86/737534386.db2.gz YADFYGVFHUYSLQ-JTQLQIEISA-N 1 1 357.204 2.885 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000914240142 737536727 /nfs/dbraw/zinc/53/67/27/737536727.db2.gz ZMEQQCZUFHMMIA-RCBQFDQVSA-N 1 1 364.471 2.535 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3F)sc2C1 ZINC000919678308 737871405 /nfs/dbraw/zinc/87/14/05/737871405.db2.gz UEAHSPNGTIHJFD-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3F)sc2C1 ZINC000919678308 737871409 /nfs/dbraw/zinc/87/14/09/737871409.db2.gz UEAHSPNGTIHJFD-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cnc3n2CCOC3)cc(C(F)(F)F)c1 ZINC000922069073 738086406 /nfs/dbraw/zinc/08/64/06/738086406.db2.gz QMZKADQRLQXROY-UHFFFAOYSA-N 1 1 356.304 2.630 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778247726 738366427 /nfs/dbraw/zinc/36/64/27/738366427.db2.gz OCHOVOWCBJAOKI-CHWSQXEVSA-N 1 1 355.385 2.923 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[NH+]2CCC(C3OCCO3)CC2)c1 ZINC000929480651 738990841 /nfs/dbraw/zinc/99/08/41/738990841.db2.gz UIWWTDGEDNXDPH-UHFFFAOYSA-N 1 1 371.231 2.942 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000785726334 738991165 /nfs/dbraw/zinc/99/11/65/738991165.db2.gz CKUBAVHBKMVGNZ-QWRGUYRKSA-N 1 1 369.805 2.603 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000787336092 739128851 /nfs/dbraw/zinc/12/88/51/739128851.db2.gz YFIUKMSOQOBIRB-GFCCVEGCSA-N 1 1 359.220 2.595 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000787336092 739128854 /nfs/dbraw/zinc/12/88/54/739128854.db2.gz YFIUKMSOQOBIRB-GFCCVEGCSA-N 1 1 359.220 2.595 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)COC(=O)N1 ZINC000932020610 739374718 /nfs/dbraw/zinc/37/47/18/739374718.db2.gz IJRGEPFFXPYHCJ-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000933976762 739713498 /nfs/dbraw/zinc/71/34/98/739713498.db2.gz UTIIHEBBAAVLTO-SJORKVTESA-N 1 1 362.455 2.542 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CC[C@@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119237 739732849 /nfs/dbraw/zinc/73/28/49/739732849.db2.gz WZXROGVBHCSWHZ-YPMHNXCESA-N 1 1 360.357 2.857 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H]2CC[C@@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119237 739732852 /nfs/dbraw/zinc/73/28/52/739732852.db2.gz WZXROGVBHCSWHZ-YPMHNXCESA-N 1 1 360.357 2.857 20 5 FFBDMO CC(C)[N@H+]1CCCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000794345460 739880212 /nfs/dbraw/zinc/88/02/12/739880212.db2.gz DSNNEBXYCFZOIA-UHFFFAOYSA-N 1 1 354.838 2.603 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796165547 740110681 /nfs/dbraw/zinc/11/06/81/740110681.db2.gz VQWHUDLARDRJRP-OAHLLOKOSA-N 1 1 351.403 2.574 20 5 FFBDMO Cc1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1Br ZINC000808050028 741180135 /nfs/dbraw/zinc/18/01/35/741180135.db2.gz PHSATPALSQGTIN-UHFFFAOYSA-N 1 1 366.219 2.715 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000809741473 741338846 /nfs/dbraw/zinc/33/88/46/741338846.db2.gz OKNSKTODEVTERV-MRXNPFEDSA-N 1 1 366.893 2.849 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000811478311 741527491 /nfs/dbraw/zinc/52/74/91/741527491.db2.gz FYXKGPCHZQTVMT-QWHCGFSZSA-N 1 1 360.241 2.854 20 5 FFBDMO CC(C)(C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])S(C)(=O)=O ZINC000811481929 741528136 /nfs/dbraw/zinc/52/81/36/741528136.db2.gz BPCNXPZATLOVDU-UHFFFAOYSA-N 1 1 355.243 2.814 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]2C1 ZINC000812342714 741611574 /nfs/dbraw/zinc/61/15/74/741611574.db2.gz MHHXZGBKANDMNU-MNOVXSKESA-N 1 1 357.332 2.637 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000812394444 741616320 /nfs/dbraw/zinc/61/63/20/741616320.db2.gz REWDPHGOCRDDFF-NSHDSACASA-N 1 1 352.391 2.662 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000997772239 742024496 /nfs/dbraw/zinc/02/44/96/742024496.db2.gz MRHRTQUCGIUMBW-RHSMWYFYSA-N 1 1 365.861 2.642 20 5 FFBDMO O=C(NC1CC[NH+](Cc2cc3ccccc3s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002787414 742173826 /nfs/dbraw/zinc/17/38/26/742173826.db2.gz JVEQLDOSSQCVRK-HZPDHXFCSA-N 1 1 359.451 2.647 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(Cl)c([N+](=O)[O-])cc1NC(C)=O)C(C)C ZINC000823315868 742880422 /nfs/dbraw/zinc/88/04/22/742880422.db2.gz VTSKEOOBIQXHEG-UHFFFAOYSA-N 1 1 370.837 2.667 20 5 FFBDMO CC1(C)CCC(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001034643818 742927286 /nfs/dbraw/zinc/92/72/86/742927286.db2.gz TWRANTABWBYUIE-QBPKDAKJSA-N 1 1 351.491 2.885 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643922 742927584 /nfs/dbraw/zinc/92/75/84/742927584.db2.gz UVPKIBZNUBBJOW-IXYNUQLISA-N 1 1 351.834 2.522 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827311622 743553714 /nfs/dbraw/zinc/55/37/14/743553714.db2.gz QJMKOMBBXAGOKU-ZWNOBZJWSA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827321129 743554394 /nfs/dbraw/zinc/55/43/94/743554394.db2.gz UNAYYXCVPCNWAK-JSGCOSHPSA-N 1 1 367.833 2.570 20 5 FFBDMO C[C@H]1C[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000839502979 746841874 /nfs/dbraw/zinc/84/18/74/746841874.db2.gz IPAACYYQYLAQAY-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC([N@@H+]2CC[C@@H](O)C2)C1 ZINC000845724505 748314451 /nfs/dbraw/zinc/31/44/51/748314451.db2.gz VVLGWCFGXYRZLR-SECBINFHSA-N 1 1 365.739 2.522 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC([N@H+]2CC[C@@H](O)C2)C1 ZINC000845724505 748314456 /nfs/dbraw/zinc/31/44/56/748314456.db2.gz VVLGWCFGXYRZLR-SECBINFHSA-N 1 1 365.739 2.522 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847099430 748621692 /nfs/dbraw/zinc/62/16/92/748621692.db2.gz GJYRYJONCUPHQS-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847099430 748621693 /nfs/dbraw/zinc/62/16/93/748621693.db2.gz GJYRYJONCUPHQS-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO COc1ccc(CSCC(=O)OCC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000847826317 748790879 /nfs/dbraw/zinc/79/08/79/748790879.db2.gz VVJNZBMAMMPUOT-ZDUSSCGKSA-N 1 1 368.455 2.722 20 5 FFBDMO CC[C@H](CSC)[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483502 748937850 /nfs/dbraw/zinc/93/78/50/748937850.db2.gz IIOYSEWZTACRQG-ZBFHGGJFSA-N 1 1 351.472 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848510495 748946691 /nfs/dbraw/zinc/94/66/91/748946691.db2.gz TXEPIJRAFUUAEN-QWHCGFSZSA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(NS(C)(=O)=O)c1 ZINC000851921462 749727185 /nfs/dbraw/zinc/72/71/85/749727185.db2.gz ROPXCPUEHCPDAU-NSHDSACASA-N 1 1 367.402 2.956 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000852108932 749775666 /nfs/dbraw/zinc/77/56/66/749775666.db2.gz PZVKGMZOAFHHMJ-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000852203492 749801758 /nfs/dbraw/zinc/80/17/58/749801758.db2.gz BXTUINBNMCENNP-NSNWQYSKSA-N 1 1 350.415 2.680 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1CCO ZINC000852463428 749867485 /nfs/dbraw/zinc/86/74/85/749867485.db2.gz VXGXOPGPQGRJQD-LRDDRELGSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@]1(C2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)COC(=O)N1 ZINC000895615838 970790027 /nfs/dbraw/zinc/79/00/27/970790027.db2.gz GWKHOZIQGDPGQY-SFHVURJKSA-N 1 1 356.382 2.858 20 5 FFBDMO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@@H]1C[N@@H+](C)CCN1C ZINC000896569858 971594861 /nfs/dbraw/zinc/59/48/61/971594861.db2.gz JESHXHYSVYJZLD-YWZLYKJASA-N 1 1 362.477 2.752 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]CCCCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001267923604 971638403 /nfs/dbraw/zinc/63/84/03/971638403.db2.gz ABYWJMAQKYXBLY-NCXUSEDFSA-N 1 1 359.470 2.692 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2cccc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001267943626 971692460 /nfs/dbraw/zinc/69/24/60/971692460.db2.gz VVVMNFZXPRTCFL-IAGOWNOFSA-N 1 1 365.861 2.724 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCCCNC3=O)o2)c([N+](=O)[O-])c1 ZINC000123917823 971807809 /nfs/dbraw/zinc/80/78/09/971807809.db2.gz WYKMVFPRTLGREV-INIZCTEOSA-N 1 1 373.409 2.964 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCCCNC3=O)o2)c([N+](=O)[O-])c1 ZINC000123917823 971807819 /nfs/dbraw/zinc/80/78/19/971807819.db2.gz WYKMVFPRTLGREV-INIZCTEOSA-N 1 1 373.409 2.964 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@@H]2C2CCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000728195242 959392908 /nfs/dbraw/zinc/39/29/08/959392908.db2.gz DLZVTOFELMWEMJ-MRXNPFEDSA-N 1 1 358.398 2.585 20 5 FFBDMO COCCC[N@H+](CCOC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001167116884 960166777 /nfs/dbraw/zinc/16/67/77/960166777.db2.gz XPVOVJLNZNRTDD-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COCCC[N@@H+](CCOC)Cc1cc([N+](=O)[O-])ccc1Br ZINC001167116884 960166784 /nfs/dbraw/zinc/16/67/84/960166784.db2.gz XPVOVJLNZNRTDD-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)cc1 ZINC001174833728 1013310174 /nfs/dbraw/zinc/31/01/74/1013310174.db2.gz WBLOPWMXWGLARK-MRXNPFEDSA-N 1 1 355.394 2.613 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)cc1 ZINC001174833728 1013310163 /nfs/dbraw/zinc/31/01/63/1013310163.db2.gz WBLOPWMXWGLARK-MRXNPFEDSA-N 1 1 355.394 2.613 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1C1CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000728288912 962468100 /nfs/dbraw/zinc/46/81/00/962468100.db2.gz KBBGKUYTLPBOCE-LJQANCHMSA-N 1 1 372.469 2.508 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]([C@@H]2CCCO2)C1 ZINC000933181441 963675838 /nfs/dbraw/zinc/67/58/38/963675838.db2.gz QUJQXMHEDBSXKE-NJAFHUGGSA-N 1 1 362.426 2.570 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000135134329 963738338 /nfs/dbraw/zinc/73/83/38/963738338.db2.gz XXGIURMSBABVNU-AWEZNQCLSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000135134329 963738345 /nfs/dbraw/zinc/73/83/45/963738345.db2.gz XXGIURMSBABVNU-AWEZNQCLSA-N 1 1 354.410 2.645 20 5 FFBDMO CCn1cnc2c1CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C2 ZINC000933260254 963766388 /nfs/dbraw/zinc/76/63/88/963766388.db2.gz SOMUNINBLJOUHK-UHFFFAOYSA-N 1 1 357.414 2.507 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(N2CCC(c3[nH]cc[nH+]3)CC2)c2ccccc21 ZINC000892152894 966087166 /nfs/dbraw/zinc/08/71/66/966087166.db2.gz ZESPJUOJMJGMGR-UHFFFAOYSA-N 1 1 353.382 2.554 20 5 FFBDMO Nc1ccc(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000108578094 967362572 /nfs/dbraw/zinc/36/25/72/967362572.db2.gz BWMXKDTZPZCLMO-UHFFFAOYSA-N 1 1 360.458 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(c2c[nH+]cn2C)CC1 ZINC001176977993 1013819812 /nfs/dbraw/zinc/81/98/12/1013819812.db2.gz PMITUYSGQQZENH-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1C[N@@H+](C)CCN1C ZINC000895247764 968761508 /nfs/dbraw/zinc/76/15/08/968761508.db2.gz WFFKBKSARSTFMK-RHSMWYFYSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1CN(C)CC[N@@H+]1C ZINC000895247764 968761514 /nfs/dbraw/zinc/76/15/14/968761514.db2.gz WFFKBKSARSTFMK-RHSMWYFYSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1CN(C)CC[N@H+]1C ZINC000895247764 968761527 /nfs/dbraw/zinc/76/15/27/968761527.db2.gz WFFKBKSARSTFMK-RHSMWYFYSA-N 1 1 355.442 2.703 20 5 FFBDMO COc1c(O)ccc(CN[C@H](Cc2ccccc2)C[NH+](C)C)c1[N+](=O)[O-] ZINC000892649484 969699128 /nfs/dbraw/zinc/69/91/28/969699128.db2.gz PODWDVZWOJXRIO-MRXNPFEDSA-N 1 1 359.426 2.572 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000874845396 1013916559 /nfs/dbraw/zinc/91/65/59/1013916559.db2.gz GGJZLLIUHJJPMO-FUHWJXTLSA-N 1 1 372.469 2.506 20 5 FFBDMO C[N@@H+](Cc1ccc2ccccc2c1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985434865 974072238 /nfs/dbraw/zinc/07/22/38/974072238.db2.gz VURXSYCIVMMRJO-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO C[N@H+](Cc1ccc2ccccc2c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985434865 974072247 /nfs/dbraw/zinc/07/22/47/974072247.db2.gz VURXSYCIVMMRJO-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO C[N@@H+](Cc1ccc2ccccc2c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985434865 974072252 /nfs/dbraw/zinc/07/22/52/974072252.db2.gz VURXSYCIVMMRJO-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1ccc(C3CC3)cc1)C2 ZINC000981763771 976764116 /nfs/dbraw/zinc/76/41/16/976764116.db2.gz KLVQVBKGZDMSRN-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](Cc1ccc(C3CC3)cc1)C2 ZINC000981763771 976764128 /nfs/dbraw/zinc/76/41/28/976764128.db2.gz KLVQVBKGZDMSRN-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1ccc(C3CC3)cc1)C2 ZINC000981763771 976764140 /nfs/dbraw/zinc/76/41/40/976764140.db2.gz KLVQVBKGZDMSRN-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000843802943 976843571 /nfs/dbraw/zinc/84/35/71/976843571.db2.gz FQTVCTTYZMLAIH-SMDDNHRTSA-N 1 1 364.402 2.756 20 5 FFBDMO CCc1ccccc1C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278856 977375529 /nfs/dbraw/zinc/37/55/29/977375529.db2.gz TUFLUECSSFFWCV-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccccc1C[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278856 977375535 /nfs/dbraw/zinc/37/55/35/977375535.db2.gz TUFLUECSSFFWCV-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1ccccc1C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278856 977375542 /nfs/dbraw/zinc/37/55/42/977375542.db2.gz TUFLUECSSFFWCV-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(F)c1 ZINC000876873085 1014407722 /nfs/dbraw/zinc/40/77/22/1014407722.db2.gz VLWMPLVHEHGFEQ-VMBOVVBDSA-N 1 1 370.388 2.747 20 5 FFBDMO Cc1cc(C[NH+]2CCC(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001482043260 977955160 /nfs/dbraw/zinc/95/51/60/977955160.db2.gz QMKIGVNNAOMBOP-IAGOWNOFSA-N 1 1 365.499 2.748 20 5 FFBDMO Cc1c(C)c(C)c(C[NH2+]C/C=C/CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001268543292 977956632 /nfs/dbraw/zinc/95/66/32/977956632.db2.gz VMBGGHPIHKXEJQ-WAQVGJNASA-N 1 1 359.470 2.656 20 5 FFBDMO CCc1ccccc1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964480 980155466 /nfs/dbraw/zinc/15/54/66/980155466.db2.gz LBPVTWWORZSAAI-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1ccccc1C[N@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964480 980155469 /nfs/dbraw/zinc/15/54/69/980155469.db2.gz LBPVTWWORZSAAI-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1ccccc1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964480 980155473 /nfs/dbraw/zinc/15/54/73/980155473.db2.gz LBPVTWWORZSAAI-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@H]1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877665870 1014668397 /nfs/dbraw/zinc/66/83/97/1014668397.db2.gz MLCJIHVSHAORBM-BJMVHTGZSA-N 1 1 369.469 2.853 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687087 1014677991 /nfs/dbraw/zinc/67/79/91/1014677991.db2.gz DBINMQBFJGUUFV-QZTJIDSGSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687087 1014677994 /nfs/dbraw/zinc/67/79/94/1014677994.db2.gz DBINMQBFJGUUFV-QZTJIDSGSA-N 1 1 354.410 2.599 20 5 FFBDMO COc1cc(CN2CC[C@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877743309 1014704568 /nfs/dbraw/zinc/70/45/68/1014704568.db2.gz JNIOJSKHEXBNCV-YPMHNXCESA-N 1 1 371.384 2.731 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000908249039 981399861 /nfs/dbraw/zinc/39/98/61/981399861.db2.gz JVEDGUKYRDHJTM-KBXCAEBGSA-N 1 1 356.426 2.752 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCc3cccs3)CC2)c(N)c([N+](=O)[O-])c1 ZINC000729526121 982207774 /nfs/dbraw/zinc/20/77/74/982207774.db2.gz SVICYKICISERCE-UHFFFAOYSA-N 1 1 374.466 2.547 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC[C@@H](c3[nH+]ccn3C)C2)c([N+](=O)[O-])c1 ZINC000826010375 1014842389 /nfs/dbraw/zinc/84/23/89/1014842389.db2.gz PDGMGSAOEYGAIB-OAHLLOKOSA-N 1 1 372.425 2.818 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000763852938 983863546 /nfs/dbraw/zinc/86/35/46/983863546.db2.gz FYSCSXVCNQZCBW-AWEZNQCLSA-N 1 1 358.398 2.812 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccc3ccccc3c2)CC1 ZINC000996441889 984346848 /nfs/dbraw/zinc/34/68/48/984346848.db2.gz RXXNUCYTEJMSEP-RTBURBONSA-N 1 1 353.422 2.586 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000055748205 984379790 /nfs/dbraw/zinc/37/97/90/984379790.db2.gz MTJDFOGZYXHWPN-FRRDWIJNSA-N 1 1 364.402 2.599 20 5 FFBDMO C[C@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+](C2CC2)C1 ZINC000878658206 1015155317 /nfs/dbraw/zinc/15/53/17/1015155317.db2.gz VCTWGSDXYFYEIC-ZDUSSCGKSA-N 1 1 357.414 2.561 20 5 FFBDMO O=C(NC12CC[NH+](CC1)C2)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000913632919 986774599 /nfs/dbraw/zinc/77/45/99/986774599.db2.gz DPYFBGABKODWIV-UHFFFAOYSA-N 1 1 369.371 2.538 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)COc1cccc3[nH]ccc31)CC2 ZINC000152244168 987096034 /nfs/dbraw/zinc/09/60/34/987096034.db2.gz CCRYLSHSNDDWOC-KRWDZBQOSA-N 1 1 367.405 2.874 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)COc1cccc3[nH]ccc31)CC2 ZINC000152244168 987096055 /nfs/dbraw/zinc/09/60/55/987096055.db2.gz CCRYLSHSNDDWOC-KRWDZBQOSA-N 1 1 367.405 2.874 20 5 FFBDMO Cn1cc(C2=CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)cn1 ZINC000878908224 1015277302 /nfs/dbraw/zinc/27/73/02/1015277302.db2.gz KJYTZPNZFFKRHS-UHFFFAOYSA-N 1 1 373.388 2.585 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000917463000 990220539 /nfs/dbraw/zinc/22/05/39/990220539.db2.gz UTKBLGPASFNWKR-SFHVURJKSA-N 1 1 360.414 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1 ZINC000918021444 990318573 /nfs/dbraw/zinc/31/85/73/990318573.db2.gz ILVNYUHHVFBZMW-IBGZPJMESA-N 1 1 363.458 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCN(C[C@@H]3CCCO3)CC2)cc1 ZINC000918021444 990318576 /nfs/dbraw/zinc/31/85/76/990318576.db2.gz ILVNYUHHVFBZMW-IBGZPJMESA-N 1 1 363.458 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCN(C[C@@H]3CCCO3)CC2)cc1 ZINC000918021444 990318580 /nfs/dbraw/zinc/31/85/80/990318580.db2.gz ILVNYUHHVFBZMW-IBGZPJMESA-N 1 1 363.458 2.550 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000154871800 990550016 /nfs/dbraw/zinc/55/00/16/990550016.db2.gz FFNHPDJTXJWYQP-CQSZACIVSA-N 1 1 360.414 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)o1 ZINC001212570298 991319493 /nfs/dbraw/zinc/31/94/93/991319493.db2.gz XNKYXGBGJNZFFV-UHFFFAOYSA-N 1 1 356.338 2.737 20 5 FFBDMO O=C(NC1CC1)OC[C@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000810039274 994687510 /nfs/dbraw/zinc/68/75/10/994687510.db2.gz USBFIOUZBNRKIR-MRXNPFEDSA-N 1 1 363.414 2.717 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810615239 994853556 /nfs/dbraw/zinc/85/35/56/994853556.db2.gz IHJYZOYVVBBMBX-GFCCVEGCSA-N 1 1 355.354 2.531 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847384 995550634 /nfs/dbraw/zinc/55/06/34/995550634.db2.gz ATDZCURPJMQKSE-LIRRHRJNSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847384 995550643 /nfs/dbraw/zinc/55/06/43/995550643.db2.gz ATDZCURPJMQKSE-LIRRHRJNSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849846 995551572 /nfs/dbraw/zinc/55/15/72/995551572.db2.gz KGPVLYBURVXODE-FZKQIMNGSA-N 1 1 357.410 2.638 20 5 FFBDMO COc1ccc(CC(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000825182270 997242410 /nfs/dbraw/zinc/24/24/10/997242410.db2.gz ZOZVPLWKRSAFOO-QGZVFWFLSA-N 1 1 369.421 2.627 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCCC[C@H]1C ZINC000825460549 997386766 /nfs/dbraw/zinc/38/67/66/997386766.db2.gz AHPAKNJVZGSREG-CHWSQXEVSA-N 1 1 366.437 2.793 20 5 FFBDMO Nc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)cc1[N+](=O)[O-] ZINC000731476114 997941722 /nfs/dbraw/zinc/94/17/22/997941722.db2.gz VDBSTSSCRHWRJD-INIZCTEOSA-N 1 1 360.458 2.952 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741017038 999702492 /nfs/dbraw/zinc/70/24/92/999702492.db2.gz LTXKLUMLVIPVRP-JHJVBQTASA-N 1 1 374.397 2.949 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001086082842 999754801 /nfs/dbraw/zinc/75/48/01/999754801.db2.gz FSGMNHPEGVAKHR-IHMNZUQTSA-N 1 1 367.449 2.798 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000742241816 999765894 /nfs/dbraw/zinc/76/58/94/999765894.db2.gz XKIOTIQFGTXVPJ-MRXNPFEDSA-N 1 1 363.461 2.755 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000766558004 1000012921 /nfs/dbraw/zinc/01/29/21/1000012921.db2.gz YEFJWXFUIXNQFO-QWRGUYRKSA-N 1 1 364.402 2.675 20 5 FFBDMO CCOC(=O)[C@H]([NH3+])Cc1cn([C@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168969121 1000013555 /nfs/dbraw/zinc/01/35/55/1000013555.db2.gz CLIKJUZWJFSCSJ-UKPHBRMFSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011811 1000015699 /nfs/dbraw/zinc/01/56/99/1000015699.db2.gz MLGMBZGUDFVQEU-HDMKZQKVSA-N 1 1 353.463 2.907 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169030279 1000016229 /nfs/dbraw/zinc/01/62/29/1000016229.db2.gz XWLBPDBIYOJUJE-ILZDJORESA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169026220 1000018254 /nfs/dbraw/zinc/01/82/54/1000018254.db2.gz VYDZSLOGBDCAFH-PBWTXFEYSA-N 1 1 361.442 2.529 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]12 ZINC001169052556 1000018917 /nfs/dbraw/zinc/01/89/17/1000018917.db2.gz HFSXODWPLMEOLV-UYJHQMFVSA-N 1 1 353.463 2.667 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000767458358 1000116311 /nfs/dbraw/zinc/11/63/11/1000116311.db2.gz BQKSXXJBKVVMQZ-ZDUSSCGKSA-N 1 1 371.397 2.669 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000767619426 1000131551 /nfs/dbraw/zinc/13/15/51/1000131551.db2.gz QTPYZGYHPOSYPO-UHFFFAOYSA-N 1 1 362.342 2.872 20 5 FFBDMO CC[N@H+](CC(=O)NC)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000768302693 1000203276 /nfs/dbraw/zinc/20/32/76/1000203276.db2.gz PEBRWOGJUGFNKG-UHFFFAOYSA-N 1 1 356.426 2.931 20 5 FFBDMO CC[N@@H+](CC(=O)NC)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000768302693 1000203280 /nfs/dbraw/zinc/20/32/80/1000203280.db2.gz PEBRWOGJUGFNKG-UHFFFAOYSA-N 1 1 356.426 2.931 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000785733133 1001473129 /nfs/dbraw/zinc/47/31/29/1001473129.db2.gz PNMJAQCNPCETMQ-RYUDHWBXSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000786821102 1001632814 /nfs/dbraw/zinc/63/28/14/1001632814.db2.gz YIIUXHYSDUTOCI-HIFRSBDPSA-N 1 1 354.410 2.742 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000746635137 1001663672 /nfs/dbraw/zinc/66/36/72/1001663672.db2.gz CRWFVLLZTYVUKU-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000791331931 1002656052 /nfs/dbraw/zinc/65/60/52/1002656052.db2.gz JEECTIBAXMMGDE-TXEJJXNPSA-N 1 1 366.437 2.802 20 5 FFBDMO CCCNC(=O)[C@H]1CCCC[N@@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344666 1003132342 /nfs/dbraw/zinc/13/23/42/1003132342.db2.gz DUFBDLXZKYZBTR-WMLDXEAASA-N 1 1 363.458 2.915 20 5 FFBDMO CCCNC(=O)[C@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344666 1003132348 /nfs/dbraw/zinc/13/23/48/1003132348.db2.gz DUFBDLXZKYZBTR-WMLDXEAASA-N 1 1 363.458 2.915 20 5 FFBDMO COc1cc(C[NH+]2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)cc(OC)c1 ZINC000804531133 1003712163 /nfs/dbraw/zinc/71/21/63/1003712163.db2.gz RVHQVLURCGVOJZ-UHFFFAOYSA-N 1 1 372.425 2.516 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805777056 1004129265 /nfs/dbraw/zinc/12/92/65/1004129265.db2.gz YQGLURAAPUWPQQ-IAGOWNOFSA-N 1 1 365.430 2.619 20 5 FFBDMO CCN(C)C(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805762636 1004137112 /nfs/dbraw/zinc/13/71/12/1004137112.db2.gz LSFOMMDFRVXPJJ-SJORKVTESA-N 1 1 365.430 2.571 20 5 FFBDMO CC[C@@]1([NH2+]Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CCOC1 ZINC001194083883 1004647889 /nfs/dbraw/zinc/64/78/89/1004647889.db2.gz XXBGCZQRTBGLFF-OAHLLOKOSA-N 1 1 352.778 2.957 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000747423196 1004684532 /nfs/dbraw/zinc/68/45/32/1004684532.db2.gz QHEJWFYYTCIDMW-WCGJLGJJSA-N 1 1 373.453 2.708 20 5 FFBDMO CCCn1nccc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035540 1005857879 /nfs/dbraw/zinc/85/78/79/1005857879.db2.gz QEDHCILLVVLQRS-INIZCTEOSA-N 1 1 358.398 2.633 20 5 FFBDMO CCCn1nccc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035540 1005857883 /nfs/dbraw/zinc/85/78/83/1005857883.db2.gz QEDHCILLVVLQRS-INIZCTEOSA-N 1 1 358.398 2.633 20 5 FFBDMO CC[C@H](C)C[N@@H+](CC)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748263748 1017004840 /nfs/dbraw/zinc/00/48/40/1017004840.db2.gz XPSWQEBPCFPYAY-UGSOOPFHSA-N 1 1 362.430 2.687 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CN(C(=O)OC(C)(C)C)CCO1 ZINC000851714541 1005908715 /nfs/dbraw/zinc/90/87/15/1005908715.db2.gz HKMMVSQZXRNDJD-HNNXBMFYSA-N 1 1 365.430 2.663 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CN(C(=O)OC(C)(C)C)CCO1 ZINC000851714541 1005908717 /nfs/dbraw/zinc/90/87/17/1005908717.db2.gz HKMMVSQZXRNDJD-HNNXBMFYSA-N 1 1 365.430 2.663 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153208 1005946166 /nfs/dbraw/zinc/94/61/66/1005946166.db2.gz CRQXKYNCNJWBSX-AAEUAGOBSA-N 1 1 368.434 2.874 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153208 1005946167 /nfs/dbraw/zinc/94/61/67/1005946167.db2.gz CRQXKYNCNJWBSX-AAEUAGOBSA-N 1 1 368.434 2.874 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000776582194 1005962094 /nfs/dbraw/zinc/96/20/94/1005962094.db2.gz LRBNXZHVDJXGOY-ZWKOTPCHSA-N 1 1 373.384 2.505 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000776582194 1005962097 /nfs/dbraw/zinc/96/20/97/1005962097.db2.gz LRBNXZHVDJXGOY-ZWKOTPCHSA-N 1 1 373.384 2.505 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776581574 1005962966 /nfs/dbraw/zinc/96/29/66/1005962966.db2.gz KJQRDQXORUSEAA-MRXNPFEDSA-N 1 1 365.430 2.571 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776581574 1005962972 /nfs/dbraw/zinc/96/29/72/1005962972.db2.gz KJQRDQXORUSEAA-MRXNPFEDSA-N 1 1 365.430 2.571 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591188 1005987774 /nfs/dbraw/zinc/98/77/74/1005987774.db2.gz HLOSTYMWISFEJB-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO CN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000776592653 1006009674 /nfs/dbraw/zinc/00/96/74/1006009674.db2.gz WWXJIJYCXOXDBF-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000776592653 1006009685 /nfs/dbraw/zinc/00/96/85/1006009685.db2.gz WWXJIJYCXOXDBF-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000776592653 1006009698 /nfs/dbraw/zinc/00/96/98/1006009698.db2.gz WWXJIJYCXOXDBF-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccc([N+](=O)[O-])nc3)C2)O1 ZINC000882980384 1006585320 /nfs/dbraw/zinc/58/53/20/1006585320.db2.gz IGULZHSCFKCICZ-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H](C)C(C)C ZINC000112657207 1006989043 /nfs/dbraw/zinc/98/90/43/1006989043.db2.gz IJMGEDSRHZMMBU-INIZCTEOSA-N 1 1 362.474 2.610 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)c1C ZINC000885424393 1007708843 /nfs/dbraw/zinc/70/88/43/1007708843.db2.gz PDRZGULCYSPVJS-UHFFFAOYSA-N 1 1 363.458 2.785 20 5 FFBDMO Cc1cc(NC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cn2cc[nH+]c12 ZINC000818057677 1007869916 /nfs/dbraw/zinc/86/99/16/1007869916.db2.gz XAQJOEPLQJTBMY-MRXNPFEDSA-N 1 1 365.349 2.683 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)CN(C)C(=O)OC(C)(C)C ZINC000818165188 1007874742 /nfs/dbraw/zinc/87/47/42/1007874742.db2.gz QITKQRYFMXIDFF-CJNGLKHVSA-N 1 1 367.446 2.815 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000819015667 1008023685 /nfs/dbraw/zinc/02/36/85/1008023685.db2.gz MZCXRZIISUKCMA-RXVVDRJESA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000819015667 1008023696 /nfs/dbraw/zinc/02/36/96/1008023696.db2.gz MZCXRZIISUKCMA-RXVVDRJESA-N 1 1 369.465 2.782 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000819410697 1008140964 /nfs/dbraw/zinc/14/09/64/1008140964.db2.gz KAKUEFVNOGFFGM-HXUWFJFHSA-N 1 1 370.453 2.882 20 5 FFBDMO Cc1ccc(O[C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)nc1 ZINC000858012099 1008276554 /nfs/dbraw/zinc/27/65/54/1008276554.db2.gz WTZDESBSQOUVPC-KRWDZBQOSA-N 1 1 371.393 2.818 20 5 FFBDMO Cc1ccc(O[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)nc1 ZINC000858012099 1008276556 /nfs/dbraw/zinc/27/65/56/1008276556.db2.gz WTZDESBSQOUVPC-KRWDZBQOSA-N 1 1 371.393 2.818 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000820100066 1008285909 /nfs/dbraw/zinc/28/59/09/1008285909.db2.gz JQBBZJNSCVXURO-QWHZDKJVSA-N 1 1 369.396 2.903 20 5 FFBDMO CCN(C)C(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805763144 1008450907 /nfs/dbraw/zinc/45/09/07/1008450907.db2.gz PUFOHAUYELQHDV-DLBZAZTESA-N 1 1 365.430 2.571 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CCC(F)(F)F)CC1CCCC1 ZINC001177313875 1008559520 /nfs/dbraw/zinc/55/95/20/1008559520.db2.gz VABRBUYBQWFXIM-ZIAGYGMSSA-N 1 1 365.396 2.603 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000137513005 1008616212 /nfs/dbraw/zinc/61/62/12/1008616212.db2.gz LBFADFHJRCWQJZ-ZBFHGGJFSA-N 1 1 368.437 2.878 20 5 FFBDMO C[C@@H]1C[C@@H]1c1noc(CC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)n1 ZINC000886267428 1008617310 /nfs/dbraw/zinc/61/73/10/1008617310.db2.gz MRHBDMRNAODJTJ-DOMZBBRYSA-N 1 1 357.414 2.951 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000886617310 1008774647 /nfs/dbraw/zinc/77/46/47/1008774647.db2.gz KIWVXEGMVAUAQL-ZENOOKHLSA-N 1 1 374.359 2.999 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3C[C@H](C)CC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823147153 1008920096 /nfs/dbraw/zinc/92/00/96/1008920096.db2.gz WRRHSOVUIBCHIA-MFKMUULPSA-N 1 1 362.386 2.646 20 5 FFBDMO CN1CCN(c2ccc(CC[NH2+]Cc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC001179829302 1009475512 /nfs/dbraw/zinc/47/55/12/1009475512.db2.gz BOSNDWSZJYBWJA-UHFFFAOYSA-N 1 1 354.454 2.679 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@](O)(c3ccccc3)C1)OCCO2 ZINC000862482869 1009854328 /nfs/dbraw/zinc/85/43/28/1009854328.db2.gz MILFWVZTQDTUGB-HXUWFJFHSA-N 1 1 370.405 2.850 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000889623033 1010032690 /nfs/dbraw/zinc/03/26/90/1010032690.db2.gz RPFFDCBIXOTFLZ-YOEHRIQHSA-N 1 1 368.437 2.887 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H](O)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000866639857 1011029033 /nfs/dbraw/zinc/02/90/33/1011029033.db2.gz XWCVKPILKYKLAX-MSOLQXFVSA-N 1 1 358.442 2.949 20 5 FFBDMO COc1ccc2c(c1)CCCN2C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867944610 1011126725 /nfs/dbraw/zinc/12/67/25/1011126725.db2.gz YIPKETNJPPXELX-IBGZPJMESA-N 1 1 355.394 2.757 20 5 FFBDMO CCOC(=O)[C@@H]1CSCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921349 1012102345 /nfs/dbraw/zinc/10/23/45/1012102345.db2.gz PAIFPNQHMCQBHI-WBVHZDCISA-N 1 1 364.467 2.823 20 5 FFBDMO CCOC(=O)[C@@H]1CSCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921349 1012102354 /nfs/dbraw/zinc/10/23/54/1012102354.db2.gz PAIFPNQHMCQBHI-WBVHZDCISA-N 1 1 364.467 2.823 20 5 FFBDMO C/C(=C/C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870087820 1012119756 /nfs/dbraw/zinc/11/97/56/1012119756.db2.gz ULRAFMXSIWGZQH-IFMUVIIVSA-N 1 1 367.405 2.877 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000870124253 1012171110 /nfs/dbraw/zinc/17/11/10/1012171110.db2.gz YJQNUYSWROWAIF-AWEZNQCLSA-N 1 1 354.410 2.696 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@H]4COC[C@@H]4C3)CC2)c(F)c1 ZINC001173015096 1012185896 /nfs/dbraw/zinc/18/58/96/1012185896.db2.gz HKJAFMBNYOVVKQ-STQMWFEESA-N 1 1 367.396 2.810 20 5 FFBDMO CC(=O)[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018826 1012189565 /nfs/dbraw/zinc/18/95/65/1012189565.db2.gz FVKDKGXHBOEIAH-GFCCVEGCSA-N 1 1 353.369 2.753 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1CCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291527 1017269978 /nfs/dbraw/zinc/26/99/78/1017269978.db2.gz SEIJIUPOZRIVIV-RTBURBONSA-N 1 1 357.454 2.516 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](CC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291527 1017269988 /nfs/dbraw/zinc/26/99/88/1017269988.db2.gz SEIJIUPOZRIVIV-RTBURBONSA-N 1 1 357.454 2.516 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](CC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291527 1017269993 /nfs/dbraw/zinc/26/99/93/1017269993.db2.gz SEIJIUPOZRIVIV-RTBURBONSA-N 1 1 357.454 2.516 20 5 FFBDMO C[N@@H+](CCCON1C(=O)c2ccccc2C1=O)Cc1ccccc1[N+](=O)[O-] ZINC000827322804 1017616109 /nfs/dbraw/zinc/61/61/09/1017616109.db2.gz ACLJMFOCGMMVLB-UHFFFAOYSA-N 1 1 369.377 2.645 20 5 FFBDMO Nc1ccc2c(c1)C[N@@H+]([C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CCO2 ZINC000925755797 1017840143 /nfs/dbraw/zinc/84/01/43/1017840143.db2.gz YMVREPUAXFRCSZ-HOTGVXAUSA-N 1 1 357.414 2.752 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CNCC2(CCOCC2)C1)C1CC1 ZINC000925798142 1017852674 /nfs/dbraw/zinc/85/26/74/1017852674.db2.gz QRILWMIIILJEPR-ROUUACIJSA-N 1 1 359.470 2.664 20 5 FFBDMO C[N@@H+]1CCC[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000681997540 1018663795 /nfs/dbraw/zinc/66/37/95/1018663795.db2.gz VZTRNIZSAQRMBV-CYBMUJFWSA-N 1 1 371.387 2.784 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000681997540 1018663800 /nfs/dbraw/zinc/66/38/00/1018663800.db2.gz VZTRNIZSAQRMBV-CYBMUJFWSA-N 1 1 371.387 2.784 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC[N@H+]1C ZINC000928440785 1018977954 /nfs/dbraw/zinc/97/79/54/1018977954.db2.gz KXNOHNBDRMBGSA-QLJPJBMISA-N 1 1 371.387 2.782 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000827925799 1019003904 /nfs/dbraw/zinc/00/39/04/1019003904.db2.gz CQJPKRPYDXLBSR-OTWHNJEPSA-N 1 1 367.405 2.577 20 5 FFBDMO Cc1ccccc1CCC[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045437272 1019964717 /nfs/dbraw/zinc/96/47/17/1019964717.db2.gz KWRZRLZIRJKKCZ-QZTJIDSGSA-N 1 1 359.470 2.564 20 5 FFBDMO COCC[C@@H]1CCN(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288654 1020057028 /nfs/dbraw/zinc/05/70/28/1020057028.db2.gz FDNPTEYBCLQZIB-IRXDYDNUSA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[C@@H]1CCN(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288654 1020057040 /nfs/dbraw/zinc/05/70/40/1020057040.db2.gz FDNPTEYBCLQZIB-IRXDYDNUSA-N 1 1 361.442 2.617 20 5 FFBDMO CCc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)cc1 ZINC001048525011 1020275995 /nfs/dbraw/zinc/27/59/95/1020275995.db2.gz FXZATBDGOUDTDE-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525011 1020276001 /nfs/dbraw/zinc/27/60/01/1020276001.db2.gz FXZATBDGOUDTDE-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO CCc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525011 1020276013 /nfs/dbraw/zinc/27/60/13/1020276013.db2.gz FXZATBDGOUDTDE-USYVTKNRSA-N 1 1 371.481 2.773 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4COC[C@]4(c4ccccc4)C3)nc2c1 ZINC000931908570 1020629746 /nfs/dbraw/zinc/62/97/46/1020629746.db2.gz ZFEOTKFARQJJEL-QRWLVFNGSA-N 1 1 364.405 2.871 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1c(F)cc([N+](=O)[O-])cc1F ZINC000803374913 1020788977 /nfs/dbraw/zinc/78/89/77/1020788977.db2.gz QAVGPCHWPCWSLM-MRXNPFEDSA-N 1 1 372.368 2.709 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(O)(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000932818527 1020907636 /nfs/dbraw/zinc/90/76/36/1020907636.db2.gz VNINFWCUIRMLHG-CQSZACIVSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000749674188 1021018618 /nfs/dbraw/zinc/01/86/18/1021018618.db2.gz GDWFLNDCXPTGNS-HXUWFJFHSA-N 1 1 364.405 2.872 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)c1 ZINC000749674188 1021018623 /nfs/dbraw/zinc/01/86/23/1021018623.db2.gz GDWFLNDCXPTGNS-HXUWFJFHSA-N 1 1 364.405 2.872 20 5 FFBDMO CNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2Br)CCCC1 ZINC001116650815 1021329680 /nfs/dbraw/zinc/32/96/80/1021329680.db2.gz GQVZPRTWZASUFO-UHFFFAOYSA-N 1 1 356.220 2.506 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000750095456 1021338341 /nfs/dbraw/zinc/33/83/41/1021338341.db2.gz YUKCXNWHXKVDQT-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934841626 1021426551 /nfs/dbraw/zinc/42/65/51/1021426551.db2.gz NBCALIFUCPDXJQ-DLBZAZTESA-N 1 1 373.453 2.623 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC2)cc1 ZINC001117245269 1021620737 /nfs/dbraw/zinc/62/07/37/1021620737.db2.gz SSHWHDSSVDZSDJ-UHFFFAOYSA-N 1 1 370.453 2.690 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)CCN1 ZINC001119269118 1022646388 /nfs/dbraw/zinc/64/63/88/1022646388.db2.gz QCLFCEWLUHUIOE-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CCN1 ZINC001119269118 1022646393 /nfs/dbraw/zinc/64/63/93/1022646393.db2.gz QCLFCEWLUHUIOE-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO COC(=O)Cc1ccccc1C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000751954225 1022994692 /nfs/dbraw/zinc/99/46/92/1022994692.db2.gz IUQJRIFFVQHYLC-UHFFFAOYSA-N 1 1 369.421 2.633 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752796900 1023205478 /nfs/dbraw/zinc/20/54/78/1023205478.db2.gz MSTLHQHSGDQVIK-CVEARBPZSA-N 1 1 374.441 2.543 20 5 FFBDMO COC(=O)C[C@H]([NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000754515857 1023481152 /nfs/dbraw/zinc/48/11/52/1023481152.db2.gz BSBPCXAGMGBBSU-YGRLFVJLSA-N 1 1 360.370 2.637 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC001123007410 1023592880 /nfs/dbraw/zinc/59/28/80/1023592880.db2.gz HVWSZKMXSRHAMN-BETUJISGSA-N 1 1 368.817 2.587 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@]2(C)CCCC[N@H+]2Cc2ccccc2)n1 ZINC000755908027 1023649130 /nfs/dbraw/zinc/64/91/30/1023649130.db2.gz FYGISANWOUFCNG-LJQANCHMSA-N 1 1 372.425 2.930 20 5 FFBDMO O=C(OC[C@H]1CC[N@H+]1C1CCOCC1)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001123346934 1023755248 /nfs/dbraw/zinc/75/52/48/1023755248.db2.gz PSDFOLMGGXRDTE-CQSZACIVSA-N 1 1 354.790 2.658 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000757511888 1023825399 /nfs/dbraw/zinc/82/53/99/1023825399.db2.gz TVQXUWJHGBDUGR-VEGGFIAOSA-N 1 1 351.406 2.999 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000757604189 1023835296 /nfs/dbraw/zinc/83/52/96/1023835296.db2.gz VJTKTJSETJRGAF-QGZVFWFLSA-N 1 1 354.410 2.577 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000757604189 1023835301 /nfs/dbraw/zinc/83/53/01/1023835301.db2.gz VJTKTJSETJRGAF-QGZVFWFLSA-N 1 1 354.410 2.577 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000757790937 1023860168 /nfs/dbraw/zinc/86/01/68/1023860168.db2.gz SVCVSRODCJIYGX-ZANVPECISA-N 1 1 370.356 2.800 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001124639915 1024354905 /nfs/dbraw/zinc/35/49/05/1024354905.db2.gz NJZYGBXAEWODKL-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001124639915 1024354923 /nfs/dbraw/zinc/35/49/23/1024354923.db2.gz NJZYGBXAEWODKL-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001124639916 1024355336 /nfs/dbraw/zinc/35/53/36/1024355336.db2.gz NJZYGBXAEWODKL-CHWSQXEVSA-N 1 1 367.421 2.660 20 5 FFBDMO CC[C@@H]1CN(Cn2nc(C)c([N+](=O)[O-])c2C)CC[N@H+]1Cc1ccccc1 ZINC000758969480 1024401107 /nfs/dbraw/zinc/40/11/07/1024401107.db2.gz BMXDVQVULOKVDP-GOSISDBHSA-N 1 1 357.458 2.962 20 5 FFBDMO C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000246334520 1026023619 /nfs/dbraw/zinc/02/36/19/1026023619.db2.gz TUPNRGCUVIFZGM-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000246334520 1026023636 /nfs/dbraw/zinc/02/36/36/1026023636.db2.gz TUPNRGCUVIFZGM-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO COCC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCCC1 ZINC000838964910 1026554343 /nfs/dbraw/zinc/55/43/43/1026554343.db2.gz LUWLQZLGQTXHQE-KRWDZBQOSA-N 1 1 362.426 2.919 20 5 FFBDMO COCC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCCC1 ZINC000838964910 1026554348 /nfs/dbraw/zinc/55/43/48/1026554348.db2.gz LUWLQZLGQTXHQE-KRWDZBQOSA-N 1 1 362.426 2.919 20 5 FFBDMO O=C1C[C@@]2(CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644078 1026771117 /nfs/dbraw/zinc/77/11/17/1026771117.db2.gz NTSPQZITMYPWFF-AZUAARDMSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@@]2(CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)Oc2ccccc21 ZINC000839644078 1026771124 /nfs/dbraw/zinc/77/11/24/1026771124.db2.gz NTSPQZITMYPWFF-AZUAARDMSA-N 1 1 368.389 2.738 20 5 FFBDMO Cc1cc2ncn(C[NH+]3CCN(c4ncccc4[N+](=O)[O-])CC3)c2cc1C ZINC000840152848 1026986398 /nfs/dbraw/zinc/98/63/98/1026986398.db2.gz IGGDBEZEWTZVKR-UHFFFAOYSA-N 1 1 366.425 2.736 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000840224247 1027011248 /nfs/dbraw/zinc/01/12/48/1027011248.db2.gz DFQURLBPYWNJMG-AWEZNQCLSA-N 1 1 358.398 2.812 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC/C=C/c2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160107656 1027595166 /nfs/dbraw/zinc/59/51/66/1027595166.db2.gz QRNKEZXZFMOKMM-HNJWQCIISA-N 1 1 369.465 2.894 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CC/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107656 1027595178 /nfs/dbraw/zinc/59/51/78/1027595178.db2.gz QRNKEZXZFMOKMM-HNJWQCIISA-N 1 1 369.465 2.894 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160107656 1027595187 /nfs/dbraw/zinc/59/51/87/1027595187.db2.gz QRNKEZXZFMOKMM-HNJWQCIISA-N 1 1 369.465 2.894 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)nn1 ZINC001160732618 1027839674 /nfs/dbraw/zinc/83/96/74/1027839674.db2.gz QYJMHNDMPCUOBY-AEFFLSMTSA-N 1 1 369.425 2.717 20 5 FFBDMO COc1ccc(C(=O)CC[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000795854143 1028205176 /nfs/dbraw/zinc/20/51/76/1028205176.db2.gz KJYQPXXHQUGBOU-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2nccn2CC(F)(F)F)ncc1[N+](=O)[O-] ZINC001161539812 1028222583 /nfs/dbraw/zinc/22/25/83/1028222583.db2.gz IMXBLMMMROTCRK-HWKANZROSA-N 1 1 370.335 2.893 20 5 FFBDMO [NH3+]Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2/C=C/[N+](=O)[O-])cc1 ZINC001161751199 1028305406 /nfs/dbraw/zinc/30/54/06/1028305406.db2.gz CVVYNSHHWCSQPZ-BQYQJAHWSA-N 1 1 367.814 2.847 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249943417 1028406358 /nfs/dbraw/zinc/40/63/58/1028406358.db2.gz XHWFCKSHZXPAKH-NEPJUHHUSA-N 1 1 364.402 2.662 20 5 FFBDMO COc1cc(C)nc(N2CC[N@@H+]3CCc4ccccc4[C@@H]3C2)c1[N+](=O)[O-] ZINC001155091090 1028575193 /nfs/dbraw/zinc/57/51/93/1028575193.db2.gz JHZWFCMEKDTREN-INIZCTEOSA-N 1 1 354.410 2.726 20 5 FFBDMO COc1cc(C)nc(N2CC[N@H+]3CCc4ccccc4[C@@H]3C2)c1[N+](=O)[O-] ZINC001155091090 1028575208 /nfs/dbraw/zinc/57/52/08/1028575208.db2.gz JHZWFCMEKDTREN-INIZCTEOSA-N 1 1 354.410 2.726 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC[C@H]2C(=O)Nc3ccccc32)ncc1[N+](=O)[O-] ZINC001162614365 1028599304 /nfs/dbraw/zinc/59/93/04/1028599304.db2.gz MCVKOUMQMCXOGM-HSBSLETESA-N 1 1 353.382 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)NCC[C@@H]2CC[NH2+]CC2(F)F)nc1Cl ZINC001162809832 1028663730 /nfs/dbraw/zinc/66/37/30/1028663730.db2.gz FOWORRHCTNNNEL-QMMMGPOBSA-N 1 1 370.734 2.917 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1=CCCCC1)CCc1ccccc1 ZINC001162810145 1028664078 /nfs/dbraw/zinc/66/40/78/1028664078.db2.gz FVBRPUGMSYLKIE-WOJBJXKFSA-N 1 1 371.481 2.813 20 5 FFBDMO Cc1ccc2c(ccnc2NCC2(N(C)C)CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC001164207020 1029200588 /nfs/dbraw/zinc/20/05/88/1029200588.db2.gz PYVGIHXAWUVNFI-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC2([NH+]3CCCC3)COC2)nc1-c1ccccc1 ZINC001157654306 1029638593 /nfs/dbraw/zinc/63/85/93/1029638593.db2.gz HJZHFRMFKYQKCO-UHFFFAOYSA-N 1 1 354.410 2.934 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](Cc4ccncc4)C3)n2)cc1 ZINC000782293100 1029645624 /nfs/dbraw/zinc/64/56/24/1029645624.db2.gz XEUHRJVIVZVRNJ-MRXNPFEDSA-N 1 1 364.409 2.770 20 5 FFBDMO COC(=O)[C@H]1C[N@H+](C)CCN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001157772397 1029660272 /nfs/dbraw/zinc/66/02/72/1029660272.db2.gz FBCRDWHPGSSFJY-CQSZACIVSA-N 1 1 370.840 2.730 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](C)CCN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001157772397 1029660274 /nfs/dbraw/zinc/66/02/74/1029660274.db2.gz FBCRDWHPGSSFJY-CQSZACIVSA-N 1 1 370.840 2.730 20 5 FFBDMO CCOC(=O)CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C1CCCC1 ZINC001157883169 1029680201 /nfs/dbraw/zinc/68/02/01/1029680201.db2.gz XPBSFEUDYFBHCU-MDZDMXLPSA-N 1 1 362.430 2.834 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H]3C[C@]3(CO)C2)cc1OC ZINC000782619276 1029765755 /nfs/dbraw/zinc/76/57/55/1029765755.db2.gz ISYXLUHURJTARR-ZUEVXXBESA-N 1 1 364.442 2.843 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3C[C@]3(CO)C2)cc1OC ZINC000782619276 1029765761 /nfs/dbraw/zinc/76/57/61/1029765761.db2.gz ISYXLUHURJTARR-ZUEVXXBESA-N 1 1 364.442 2.843 20 5 FFBDMO Cc1[nH+]cc2n1CCN(c1ccc(-c3ccc(C)c([N+](=O)[O-])c3)nn1)C2 ZINC001165385800 1029962096 /nfs/dbraw/zinc/96/20/96/1029962096.db2.gz WVGBBERXPRVSCU-UHFFFAOYSA-N 1 1 350.382 2.885 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1ccc3cccc([N+](=O)[O-])c3n1)CC2 ZINC001166032602 1030214609 /nfs/dbraw/zinc/21/46/09/1030214609.db2.gz JYMAZYBSNZKDQR-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO C/C(=C/C(=O)N1CCCC[C@@H]1C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784027120 1030426390 /nfs/dbraw/zinc/42/63/90/1030426390.db2.gz RSIDFSCDDZVJHH-WLGQOEQESA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C)c1 ZINC000842366195 1030689835 /nfs/dbraw/zinc/68/98/35/1030689835.db2.gz DMYZHSRJTCOPRV-KSSFIOAISA-N 1 1 372.425 2.640 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C)c1 ZINC000842366195 1030689847 /nfs/dbraw/zinc/68/98/47/1030689847.db2.gz DMYZHSRJTCOPRV-KSSFIOAISA-N 1 1 372.425 2.640 20 5 FFBDMO C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@](C)(O)c1ccccc1 ZINC000842626297 1030846158 /nfs/dbraw/zinc/84/61/58/1030846158.db2.gz OCSJZNHNBKPKBC-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001150780201 1031783033 /nfs/dbraw/zinc/78/30/33/1031783033.db2.gz BIELIBQOGYBYJP-GFCCVEGCSA-N 1 1 352.822 2.577 20 5 FFBDMO O=C(NCC1([NH2+]C/C=C\c2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115529415 1031787747 /nfs/dbraw/zinc/78/77/47/1031787747.db2.gz RAXUOBLKIGOENF-HJPCAMOWSA-N 1 1 357.454 2.774 20 5 FFBDMO Cc1ccc(CC[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1 ZINC001115530834 1031789199 /nfs/dbraw/zinc/78/91/99/1031789199.db2.gz UJSPBCVZOFEPTD-QZTJIDSGSA-N 1 1 359.470 2.611 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c([N+](=O)[O-])c1 ZINC001219572202 1033696849 /nfs/dbraw/zinc/69/68/49/1033696849.db2.gz GNTRKNGYIJMQKI-ZDUSSCGKSA-N 1 1 350.419 2.797 20 5 FFBDMO COc1ncnc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-] ZINC000312976079 1033704834 /nfs/dbraw/zinc/70/48/34/1033704834.db2.gz KWCKSZVYKIQZBA-HRCADAONSA-N 1 1 369.425 2.716 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1 ZINC001226171623 1034558838 /nfs/dbraw/zinc/55/88/38/1034558838.db2.gz DPLJFUHAKADGJU-UKRRQHHQSA-N 1 1 370.409 2.693 20 5 FFBDMO COC(=O)c1cc(OC)c(O[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC001226433744 1034683170 /nfs/dbraw/zinc/68/31/70/1034683170.db2.gz JSIOHQNDNAVJGA-LBPRGKRZSA-N 1 1 352.387 2.642 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(Br)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001226790503 1034842521 /nfs/dbraw/zinc/84/25/21/1034842521.db2.gz RXFRYKIPHXMRCV-MRCXROJRSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cc(Br)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001226790503 1034842532 /nfs/dbraw/zinc/84/25/32/1034842532.db2.gz RXFRYKIPHXMRCV-MRCXROJRSA-N 1 1 355.188 2.540 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@H]2CCN3Cc4ccccc4[NH+]=C23)c2[nH]cnc21 ZINC001227689686 1035675851 /nfs/dbraw/zinc/67/58/51/1035675851.db2.gz BQTUEHUAEWJKDN-ZDUSSCGKSA-N 1 1 350.338 2.563 20 5 FFBDMO COC(=O)c1cc(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)cc([N+](=O)[O-])c1 ZINC001228772456 1036315716 /nfs/dbraw/zinc/31/57/16/1036315716.db2.gz WXKKDVXBHQWISL-CZUORRHYSA-N 1 1 371.393 2.991 20 5 FFBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1[N+](=O)[O-] ZINC001229876333 1036954003 /nfs/dbraw/zinc/95/40/03/1036954003.db2.gz UTODGLDKSWGTOS-ATCWAGBWSA-N 1 1 365.386 2.929 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001234881088 1037221662 /nfs/dbraw/zinc/22/16/62/1037221662.db2.gz LWWJWORCRLFULJ-INIZCTEOSA-N 1 1 373.409 2.668 20 5 FFBDMO Cc1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C ZINC001230937969 1037413839 /nfs/dbraw/zinc/41/38/39/1037413839.db2.gz KUGMSQMQJCOKTL-ZKYQVNSYSA-N 1 1 369.215 2.849 20 5 FFBDMO Cc1cc(Br)cc([N+](=O)[O-])c1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C ZINC001230937969 1037413846 /nfs/dbraw/zinc/41/38/46/1037413846.db2.gz KUGMSQMQJCOKTL-ZKYQVNSYSA-N 1 1 369.215 2.849 20 5 FFBDMO CCCC(=O)Nc1c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)cccc1[N+](=O)[O-] ZINC001231360202 1037547521 /nfs/dbraw/zinc/54/75/21/1037547521.db2.gz YKKZREYZJKWUAA-SGIREYDYSA-N 1 1 361.398 2.516 20 5 FFBDMO CCCC(=O)Nc1c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)cccc1[N+](=O)[O-] ZINC001231360202 1037547537 /nfs/dbraw/zinc/54/75/37/1037547537.db2.gz YKKZREYZJKWUAA-SGIREYDYSA-N 1 1 361.398 2.516 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](O)[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093265 1038380617 /nfs/dbraw/zinc/38/06/17/1038380617.db2.gz JAFGXVLEWZGMHG-RDTXWAMCSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@]34CCOC4)CC2)ccc1[N+](=O)[O-] ZINC001256100974 1038383513 /nfs/dbraw/zinc/38/35/13/1038383513.db2.gz WTVPKZSOJVMRQI-LJQANCHMSA-N 1 1 361.442 2.827 20 5 FFBDMO CCC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1)C(=O)OC ZINC001256100150 1038384993 /nfs/dbraw/zinc/38/49/93/1038384993.db2.gz FUJLDKNSGXLELX-HNNXBMFYSA-N 1 1 365.430 2.504 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@]34CCC[NH2+]C4)CC2)ccc1[N+](=O)[O-] ZINC001246607642 1039412558 /nfs/dbraw/zinc/41/25/58/1039412558.db2.gz HCILMXCHDBYXQX-FQEVSTJZSA-N 1 1 374.485 2.790 20 5 FFBDMO COCCC[N@H+]([C@H]1CCCNC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807341 1039486811 /nfs/dbraw/zinc/48/68/11/1039486811.db2.gz JISSIVKFZKXFHD-QUCCMNQESA-N 1 1 361.486 2.933 20 5 FFBDMO COCCC[N@@H+]([C@H]1CCCNC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807341 1039486819 /nfs/dbraw/zinc/48/68/19/1039486819.db2.gz JISSIVKFZKXFHD-QUCCMNQESA-N 1 1 361.486 2.933 20 5 FFBDMO COCCC[N@H+]([C@H]1CCCNC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807339 1039486875 /nfs/dbraw/zinc/48/68/75/1039486875.db2.gz JISSIVKFZKXFHD-ICSRJNTNSA-N 1 1 361.486 2.933 20 5 FFBDMO COCCC[N@@H+]([C@H]1CCCNC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807339 1039486882 /nfs/dbraw/zinc/48/68/82/1039486882.db2.gz JISSIVKFZKXFHD-ICSRJNTNSA-N 1 1 361.486 2.933 20 5 FFBDMO C[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@]1(C)CCCNC1 ZINC001246917006 1039532461 /nfs/dbraw/zinc/53/24/61/1039532461.db2.gz YLCKEPKDLLJLLA-GOSISDBHSA-N 1 1 368.428 2.916 20 5 FFBDMO C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@]1(C)CCCNC1 ZINC001246917006 1039532472 /nfs/dbraw/zinc/53/24/72/1039532472.db2.gz YLCKEPKDLLJLLA-GOSISDBHSA-N 1 1 368.428 2.916 20 5 FFBDMO CCC[C@@H]1CNCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001246926984 1039537315 /nfs/dbraw/zinc/53/73/15/1039537315.db2.gz MTQUMBYDVZKRKB-QGZVFWFLSA-N 1 1 362.474 2.646 20 5 FFBDMO CCC[C@@H]1C[NH2+]CCN1C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001246926984 1039537322 /nfs/dbraw/zinc/53/73/22/1039537322.db2.gz MTQUMBYDVZKRKB-QGZVFWFLSA-N 1 1 362.474 2.646 20 5 FFBDMO COc1nccc(C)c1-c1noc([C@@H]([NH3+])Cc2ccccc2[N+](=O)[O-])n1 ZINC001247671656 1039878777 /nfs/dbraw/zinc/87/87/77/1039878777.db2.gz CJFHSQPESPUGIZ-LBPRGKRZSA-N 1 1 355.354 2.599 20 5 FFBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cccn3ccnc23)no1 ZINC001248209682 1040174040 /nfs/dbraw/zinc/17/40/40/1040174040.db2.gz TYWFJPBVBUQMNP-CQSZACIVSA-N 1 1 350.338 2.535 20 5 FFBDMO COc1nc(C)ccc1-c1noc([C@@H]([NH3+])Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001248212215 1040174136 /nfs/dbraw/zinc/17/41/36/1040174136.db2.gz NURRFRRZULEEEY-AWEZNQCLSA-N 1 1 355.354 2.599 20 5 FFBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cccc3ccnn32)no1 ZINC001248211095 1040174433 /nfs/dbraw/zinc/17/44/33/1040174433.db2.gz MNVYGEVPRBKEME-CQSZACIVSA-N 1 1 350.338 2.535 20 5 FFBDMO [NH3+][C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3nccnc3c2)no1 ZINC001248210539 1040174580 /nfs/dbraw/zinc/17/45/80/1040174580.db2.gz RVUVGFDBLMEQGK-AWEZNQCLSA-N 1 1 362.349 2.831 20 5 FFBDMO CN1C(=O)CC[C@H]2C[N@@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC[C@@H]21 ZINC001254481310 1040748009 /nfs/dbraw/zinc/74/80/09/1040748009.db2.gz AQQZMDUUFJKLLF-KXBFYZLASA-N 1 1 372.469 2.506 20 5 FFBDMO CCOC(=O)c1cc2n(n1)CCC[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254553058 1040794964 /nfs/dbraw/zinc/79/49/64/1040794964.db2.gz RFYUSGXPLYRJEV-AWEZNQCLSA-N 1 1 372.425 2.805 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CCN2c2ncccn2)C1 ZINC001254562716 1040800178 /nfs/dbraw/zinc/80/01/78/1040800178.db2.gz SYPSZJTYARKWOI-BEFAXECRSA-N 1 1 353.426 2.671 20 5 FFBDMO Cc1noc([C@H]2C[C@@H]3CC[N@H+]([C@H]4Cc5ccc([N+](=O)[O-])cc5C4)C[C@H]3O2)n1 ZINC001254595961 1040824594 /nfs/dbraw/zinc/82/45/94/1040824594.db2.gz LFLMSARBWCJEAI-VIBAHUMZSA-N 1 1 370.409 2.606 20 5 FFBDMO COCC[C@@H]1CO[C@@]2(C1)CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595265 1040824633 /nfs/dbraw/zinc/82/46/33/1040824633.db2.gz HZNKYTAZIFEJHK-CWFSZBLJSA-N 1 1 360.454 2.970 20 5 FFBDMO COc1ccnc(O[C@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)c1 ZINC001254610263 1040838714 /nfs/dbraw/zinc/83/87/14/1040838714.db2.gz ISFVKYTZZQJOTJ-WMZOPIPTSA-N 1 1 355.394 2.619 20 5 FFBDMO Cc1ccnc(O[C@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610861 1040838883 /nfs/dbraw/zinc/83/88/83/1040838883.db2.gz MMJYSWPXUFCDSQ-MSOLQXFVSA-N 1 1 354.410 2.704 20 5 FFBDMO Cc1ccnc(O[C@@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610868 1040839187 /nfs/dbraw/zinc/83/91/87/1040839187.db2.gz MMJYSWPXUFCDSQ-ZWKOTPCHSA-N 1 1 354.410 2.704 20 5 FFBDMO C[N@@H+]([C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254611728 1040840288 /nfs/dbraw/zinc/84/02/88/1040840288.db2.gz SDHIHPKQAOVXAL-BDXSIMOUSA-N 1 1 373.453 2.859 20 5 FFBDMO Cc1cncnc1O[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612414 1040841142 /nfs/dbraw/zinc/84/11/42/1040841142.db2.gz WEDBVAWMABQSAQ-MSOLQXFVSA-N 1 1 354.410 2.704 20 5 FFBDMO C[C@@H](C(=O)NCc1ccco1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC001318793722 1044878460 /nfs/dbraw/zinc/87/84/60/1044878460.db2.gz YRXPHJOHSOUNQS-AWEZNQCLSA-N 1 1 373.409 2.736 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3N)CC2)cc1 ZINC001318934810 1044947774 /nfs/dbraw/zinc/94/77/74/1044947774.db2.gz FYNROMNPJRAAPF-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@@H+]1C ZINC001539396563 1070629554 /nfs/dbraw/zinc/62/95/54/1070629554.db2.gz NCXMVNNEUOGGGJ-LLVKDONJSA-N 1 1 370.247 2.880 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001747 1046303973 /nfs/dbraw/zinc/30/39/73/1046303973.db2.gz AGISPAYCDKQONJ-SJLPKXTDSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001747 1046303983 /nfs/dbraw/zinc/30/39/83/1046303983.db2.gz AGISPAYCDKQONJ-SJLPKXTDSA-N 1 1 372.400 2.951 20 5 FFBDMO C[N@@H+]1CCO[C@H](CSCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001326492119 1046954695 /nfs/dbraw/zinc/95/46/95/1046954695.db2.gz WKRVHOWYTATKIB-LBPRGKRZSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@H](CSCc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001326492119 1046954704 /nfs/dbraw/zinc/95/47/04/1046954704.db2.gz WKRVHOWYTATKIB-LBPRGKRZSA-N 1 1 361.261 2.921 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc2c(nc[nH+]c2N(C)C)n1C ZINC001540363269 1070862571 /nfs/dbraw/zinc/86/25/71/1070862571.db2.gz NSUUBLAXQVVIBW-UHFFFAOYSA-N 1 1 368.397 2.812 20 5 FFBDMO Cc1ccc(NC(=O)[C@@]2(O)CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001540600345 1070944764 /nfs/dbraw/zinc/94/47/64/1070944764.db2.gz IWVLLBHILKNKOQ-HXUWFJFHSA-N 1 1 369.421 2.869 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC001328041502 1048151209 /nfs/dbraw/zinc/15/12/09/1048151209.db2.gz MFQRIKXETGFBTG-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC001328041502 1048151214 /nfs/dbraw/zinc/15/12/14/1048151214.db2.gz MFQRIKXETGFBTG-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC001290803576 1048398609 /nfs/dbraw/zinc/39/86/09/1048398609.db2.gz NGGMYPZUXPSCSG-MRXNPFEDSA-N 1 1 354.410 2.693 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3N)cc2)CC1 ZINC001541093497 1071052091 /nfs/dbraw/zinc/05/20/91/1071052091.db2.gz JHIWUQFUGVXOEG-UHFFFAOYSA-N 1 1 369.425 2.571 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC001343020559 1051636705 /nfs/dbraw/zinc/63/67/05/1051636705.db2.gz NFNKAFXBWMYBBC-IBGZPJMESA-N 1 1 356.378 2.940 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC001343020559 1051636710 /nfs/dbraw/zinc/63/67/10/1051636710.db2.gz NFNKAFXBWMYBBC-IBGZPJMESA-N 1 1 356.378 2.940 20 5 FFBDMO CCN(c1nnc([C@H](C)[N+](=O)[O-])n1C)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001341358507 1051717983 /nfs/dbraw/zinc/71/79/83/1051717983.db2.gz HAPLULUUIGCPAP-ZOBUZTSGSA-N 1 1 372.473 2.815 20 5 FFBDMO COC[C@@H]([NH2+]Cc1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC001341427790 1051783358 /nfs/dbraw/zinc/78/33/58/1051783358.db2.gz PMVFXTRNKMQRRU-OCCSQVGLSA-N 1 1 359.220 2.641 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccnn1C1CCC1 ZINC001345008182 1052195705 /nfs/dbraw/zinc/19/57/05/1052195705.db2.gz XLQGVIJTSHOUJZ-KRWDZBQOSA-N 1 1 370.409 2.948 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccnn1C1CCC1 ZINC001345008182 1052195710 /nfs/dbraw/zinc/19/57/10/1052195710.db2.gz XLQGVIJTSHOUJZ-KRWDZBQOSA-N 1 1 370.409 2.948 20 5 FFBDMO C[N@@H+](CCN1CCN(c2c(F)cccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC001306958512 1052228484 /nfs/dbraw/zinc/22/84/84/1052228484.db2.gz BFGPAEXVCBIXOS-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@H]2C[C@H](OC)C23CCC3)c([N+](=O)[O-])c1 ZINC001307772092 1052348208 /nfs/dbraw/zinc/34/82/08/1052348208.db2.gz QOBSCICIJDJVLT-IRXDYDNUSA-N 1 1 350.415 2.872 20 5 FFBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 ZINC001308168515 1052423315 /nfs/dbraw/zinc/42/33/15/1052423315.db2.gz QNTNKVKOQYIZHX-IMRBUKKESA-N 1 1 353.444 2.953 20 5 FFBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 ZINC001308168515 1052423322 /nfs/dbraw/zinc/42/33/22/1052423322.db2.gz QNTNKVKOQYIZHX-IMRBUKKESA-N 1 1 353.444 2.953 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(S(N)(=O)=O)c(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC001308509260 1052463062 /nfs/dbraw/zinc/46/30/62/1052463062.db2.gz JUNZIDUNGSSIBY-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001345745512 1052597964 /nfs/dbraw/zinc/59/79/64/1052597964.db2.gz LDGKRACACROXLV-OAHLLOKOSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001345747828 1052599400 /nfs/dbraw/zinc/59/94/00/1052599400.db2.gz YXXYFZPPSUMILG-OAHLLOKOSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336603405 1054086086 /nfs/dbraw/zinc/08/60/86/1054086086.db2.gz YNJYHQHLORDXJD-HNNXBMFYSA-N 1 1 359.357 2.529 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000847445703 1055792013 /nfs/dbraw/zinc/79/20/13/1055792013.db2.gz DMJNCSPGKWHZEB-FUHWJXTLSA-N 1 1 358.442 2.679 20 5 FFBDMO Cc1c(C(=O)N2CCc3c2ccc([N+](=O)[O-])c3F)cnn1-c1cc[nH+]cc1 ZINC001544012420 1071581490 /nfs/dbraw/zinc/58/14/90/1071581490.db2.gz SKNVXUZIRSUXQU-UHFFFAOYSA-N 1 1 367.340 2.826 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001544849917 1071702230 /nfs/dbraw/zinc/70/22/30/1071702230.db2.gz DKAVYJWYQFJBJV-CQSZACIVSA-N 1 1 353.850 2.981 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001453494856 1059378013 /nfs/dbraw/zinc/37/80/13/1059378013.db2.gz SFYKGWCPIIQBHF-ZDUSSCGKSA-N 1 1 356.426 2.792 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C[C@H]1C ZINC001520580854 1059830547 /nfs/dbraw/zinc/83/05/47/1059830547.db2.gz QZNSHTIHZBWFSC-CHWSQXEVSA-N 1 1 356.426 2.885 20 5 FFBDMO CCn1c(C[NH+]2CCCC2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001520749712 1060031695 /nfs/dbraw/zinc/03/16/95/1060031695.db2.gz CEISLNBRCCTYSV-UHFFFAOYSA-N 1 1 370.457 2.971 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482644 1060120806 /nfs/dbraw/zinc/12/08/06/1060120806.db2.gz SHTJDKNVAGDHPO-MSOLQXFVSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482644 1060120822 /nfs/dbraw/zinc/12/08/22/1060120822.db2.gz SHTJDKNVAGDHPO-MSOLQXFVSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000848488420 1060136877 /nfs/dbraw/zinc/13/68/77/1060136877.db2.gz BLDUNDQHVCSNLH-IEBWSBKVSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000848488420 1060136892 /nfs/dbraw/zinc/13/68/92/1060136892.db2.gz BLDUNDQHVCSNLH-IEBWSBKVSA-N 1 1 366.421 2.753 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000848584806 1060314785 /nfs/dbraw/zinc/31/47/85/1060314785.db2.gz ISXIXAZOMNXWMO-IUODEOHRSA-N 1 1 369.368 2.509 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001457411561 1060371098 /nfs/dbraw/zinc/37/10/98/1060371098.db2.gz IHAZFCGMKGRZAA-CYBMUJFWSA-N 1 1 355.822 2.570 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC001458045748 1060500577 /nfs/dbraw/zinc/50/05/77/1060500577.db2.gz KKAMCCCPZKVYJS-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)n1 ZINC001521354497 1060551937 /nfs/dbraw/zinc/55/19/37/1060551937.db2.gz LWRBWLUDUGFBTO-UHFFFAOYSA-N 1 1 356.426 2.939 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[NH+]2CCN(Cc3cccc(F)c3)CC2)c1 ZINC001459880229 1060836337 /nfs/dbraw/zinc/83/63/37/1060836337.db2.gz HEMWEISMSIXXRF-UHFFFAOYSA-N 1 1 359.401 2.931 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC001460299443 1060949136 /nfs/dbraw/zinc/94/91/36/1060949136.db2.gz ZTRMEASAQBKRCJ-IYBDPMFKSA-N 1 1 365.474 2.923 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)cc1C ZINC001475703098 1061218176 /nfs/dbraw/zinc/21/81/76/1061218176.db2.gz ITJSQGMEDBPCLV-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001461267020 1061271866 /nfs/dbraw/zinc/27/18/66/1061271866.db2.gz FKZWNYNJEPOVJD-YNEHKIRRSA-N 1 1 369.849 2.957 20 5 FFBDMO COc1c(O)ccc(CN2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001462220879 1061542918 /nfs/dbraw/zinc/54/29/18/1061542918.db2.gz ZVWFRIITXOAAEG-KRWDZBQOSA-N 1 1 371.437 2.668 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1)C(C)C ZINC001464876579 1062888110 /nfs/dbraw/zinc/88/81/10/1062888110.db2.gz CZPDDMLUYOYTFP-UHFFFAOYSA-N 1 1 372.263 2.746 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)n1 ZINC001464876124 1062889580 /nfs/dbraw/zinc/88/95/80/1062889580.db2.gz YSXTXVUCBKRCQR-KRWDZBQOSA-N 1 1 368.437 2.593 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001439615587 1063185726 /nfs/dbraw/zinc/18/57/26/1063185726.db2.gz VJOJTNSNHUWDAD-CYBMUJFWSA-N 1 1 366.437 2.602 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001439615587 1063185731 /nfs/dbraw/zinc/18/57/31/1063185731.db2.gz VJOJTNSNHUWDAD-CYBMUJFWSA-N 1 1 366.437 2.602 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)c1ccco1 ZINC001440558043 1063315110 /nfs/dbraw/zinc/31/51/10/1063315110.db2.gz PLGKDIHRNIFHBR-JTQLQIEISA-N 1 1 370.768 2.595 20 5 FFBDMO C[C@H](CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC001441359649 1063429218 /nfs/dbraw/zinc/42/92/18/1063429218.db2.gz HCQVPESHTQDPFL-GHMZBOCLSA-N 1 1 354.838 2.681 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001467570744 1063787601 /nfs/dbraw/zinc/78/76/01/1063787601.db2.gz QOIJWKFXPVXJDU-ZIAGYGMSSA-N 1 1 359.430 2.839 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001468694086 1064024274 /nfs/dbraw/zinc/02/42/74/1064024274.db2.gz WDBXBGPYPLYKPO-HNNXBMFYSA-N 1 1 373.457 2.690 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001472023006 1064895549 /nfs/dbraw/zinc/89/55/49/1064895549.db2.gz TXWDWVVROKBWDH-HNNXBMFYSA-N 1 1 354.410 2.871 20 5 FFBDMO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969471 1078182865 /nfs/dbraw/zinc/18/28/65/1078182865.db2.gz KGCOSJRIBJAGFI-GMTAPVOTSA-N 1 1 365.463 2.615 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)C(=O)OCC ZINC001473442217 1065263349 /nfs/dbraw/zinc/26/33/49/1065263349.db2.gz ZCZSSSPUKFXCLJ-AWEZNQCLSA-N 1 1 365.430 2.895 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCO[C@@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC001473769554 1065351783 /nfs/dbraw/zinc/35/17/83/1065351783.db2.gz VJDJLAIFTWCTRS-IIDMSEBBSA-N 1 1 363.458 2.957 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001473879665 1065402032 /nfs/dbraw/zinc/40/20/32/1065402032.db2.gz SWKQULHVTPPQBB-OLZOCXBDSA-N 1 1 358.398 2.985 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001473879667 1065402546 /nfs/dbraw/zinc/40/25/46/1065402546.db2.gz SWKQULHVTPPQBB-QWHCGFSZSA-N 1 1 358.398 2.985 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001475069535 1065692884 /nfs/dbraw/zinc/69/28/84/1065692884.db2.gz UZSCTYDXKLLIME-VNHYZAJKSA-N 1 1 369.487 2.548 20 5 FFBDMO COc1c(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC001579134534 1078573346 /nfs/dbraw/zinc/57/33/46/1078573346.db2.gz FUPVDRAJSGGLEV-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCCCCC2)c(-c2nn[nH]n2)c1 ZINC001582804391 1079109809 /nfs/dbraw/zinc/10/98/09/1079109809.db2.gz RSIGOQGUARNNSC-HNNXBMFYSA-N 1 1 371.445 2.984 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001582804626 1079110152 /nfs/dbraw/zinc/11/01/52/1079110152.db2.gz WYYSJRMGFWMLDO-AWEZNQCLSA-N 1 1 357.418 2.594 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ncc([N+](=O)[O-])c2ccccc21 ZINC001559147988 1076129769 /nfs/dbraw/zinc/12/97/69/1076129769.db2.gz QCHPWRITNNSPOE-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO CC[C@H]1COCC[N@@H+]1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559272932 1076143447 /nfs/dbraw/zinc/14/34/47/1076143447.db2.gz SAHPQYKWUFWJJL-ZDUSSCGKSA-N 1 1 364.833 2.741 20 5 FFBDMO CC[C@H]1COCC[N@H+]1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559272932 1076143449 /nfs/dbraw/zinc/14/34/49/1076143449.db2.gz SAHPQYKWUFWJJL-ZDUSSCGKSA-N 1 1 364.833 2.741 20 5 FFBDMO C[C@]12CCCC[C@H]1C[N@H+]2CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001560046929 1076217219 /nfs/dbraw/zinc/21/72/19/1076217219.db2.gz KFHLQUZAEZFLAK-JXFKEZNVSA-N 1 1 372.469 2.508 20 5 FFBDMO C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001560135390 1076232592 /nfs/dbraw/zinc/23/25/92/1076232592.db2.gz NKSPOTDNOJYFLG-ZANVPECISA-N 1 1 352.778 2.643 20 5 FFBDMO C[C@H]1[C@@H](O)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001560135390 1076232595 /nfs/dbraw/zinc/23/25/95/1076232595.db2.gz NKSPOTDNOJYFLG-ZANVPECISA-N 1 1 352.778 2.643 20 5 FFBDMO COc1cc2c(cc1O)CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC001560149170 1076237123 /nfs/dbraw/zinc/23/71/23/1076237123.db2.gz ZSZBSRGUVNYSOB-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3ncccn3)CC2)c1 ZINC001560157515 1076238312 /nfs/dbraw/zinc/23/83/12/1076238312.db2.gz DDXAPJCLUDFETE-UHFFFAOYSA-N 1 1 356.382 2.551 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)n1 ZINC001566426213 1076959623 /nfs/dbraw/zinc/95/96/23/1076959623.db2.gz JMOALRNHUMZGAU-WBVHZDCISA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)n1 ZINC001566426213 1076959626 /nfs/dbraw/zinc/95/96/26/1076959626.db2.gz JMOALRNHUMZGAU-WBVHZDCISA-N 1 1 358.373 2.613 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCCCc1ccccc1)C2 ZINC001571036232 1077244087 /nfs/dbraw/zinc/24/40/87/1077244087.db2.gz UJXUHRGAVORJFZ-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CCCCc1ccccc1)C2 ZINC001571036232 1077244090 /nfs/dbraw/zinc/24/40/90/1077244090.db2.gz UJXUHRGAVORJFZ-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCCCc1ccccc1)C2 ZINC001571036232 1077244092 /nfs/dbraw/zinc/24/40/92/1077244092.db2.gz UJXUHRGAVORJFZ-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001586938699 1079708997 /nfs/dbraw/zinc/70/89/97/1079708997.db2.gz RDIUSPJTJBEUQT-MRXNPFEDSA-N 1 1 368.437 2.771 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)cc1 ZINC001587796436 1079866401 /nfs/dbraw/zinc/86/64/01/1079866401.db2.gz LNJWRZBFDMAZCU-AWEZNQCLSA-N 1 1 372.400 2.629 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001590153612 1081055130 /nfs/dbraw/zinc/05/51/30/1081055130.db2.gz MNVYZQYJRIYJMW-IBGZPJMESA-N 1 1 364.409 2.939 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590226596 1081106908 /nfs/dbraw/zinc/10/69/08/1081106908.db2.gz DMHWNHPAEUULGD-GUTXKFCHSA-N 1 1 371.445 2.617 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3nnc4n3CCC4)C2)cc1[N+](=O)[O-] ZINC000103466712 250151474 /nfs/dbraw/zinc/15/14/74/250151474.db2.gz WYEMHWLDLYYJPL-CQSZACIVSA-N 1 1 357.414 2.521 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084489 /nfs/dbraw/zinc/08/44/89/252084489.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@@H]3CCN(C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084494 /nfs/dbraw/zinc/08/44/94/252084494.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3CCN(C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625520 252084498 /nfs/dbraw/zinc/08/44/98/252084498.db2.gz MKHXDKGSVHEZJN-KBXCAEBGSA-N 1 1 355.442 2.521 20 5 FFBDMO C[C@@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272926881 252166504 /nfs/dbraw/zinc/16/65/04/252166504.db2.gz KSRFHBGAOMAEBW-GFCCVEGCSA-N 1 1 367.833 2.784 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000272776988 252129268 /nfs/dbraw/zinc/12/92/68/252129268.db2.gz DEFDGSBTESFVAH-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3N)sc2C1 ZINC000273072462 252207814 /nfs/dbraw/zinc/20/78/14/252207814.db2.gz AAHXEOOBDNWIFD-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3N)sc2C1 ZINC000273072462 252207817 /nfs/dbraw/zinc/20/78/17/252207817.db2.gz AAHXEOOBDNWIFD-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CCc1ccc(-c2noc([C@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)cc1 ZINC000273271914 252269731 /nfs/dbraw/zinc/26/97/31/252269731.db2.gz DXZSXCIUBFUPEI-LBPRGKRZSA-N 1 1 356.386 2.755 20 5 FFBDMO COCC[C@@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1ccco1 ZINC000273237469 252261784 /nfs/dbraw/zinc/26/17/84/252261784.db2.gz GYQIDHUERQIKLS-CQSZACIVSA-N 1 1 363.370 2.502 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275435375 256006148 /nfs/dbraw/zinc/00/61/48/256006148.db2.gz JPGFKEVISIJXDA-HNNXBMFYSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275435375 256006150 /nfs/dbraw/zinc/00/61/50/256006150.db2.gz JPGFKEVISIJXDA-HNNXBMFYSA-N 1 1 374.384 2.840 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCC[C@H](C)C1 ZINC000276125750 256074224 /nfs/dbraw/zinc/07/42/24/256074224.db2.gz ZQFDCJFJUMTMNU-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCC[C@H](C)C1 ZINC000276125750 256074226 /nfs/dbraw/zinc/07/42/26/256074226.db2.gz ZQFDCJFJUMTMNU-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCO1 ZINC000277185201 256170057 /nfs/dbraw/zinc/17/00/57/256170057.db2.gz HOEHUWRJMCMTFI-GFCCVEGCSA-N 1 1 370.837 2.871 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000286693314 257049841 /nfs/dbraw/zinc/04/98/41/257049841.db2.gz LCTAIOMRJHPFEM-UHFFFAOYSA-N 1 1 374.441 2.894 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](c3ccncc3)C2)c1 ZINC000289358052 257276604 /nfs/dbraw/zinc/27/66/04/257276604.db2.gz NVOMIBKVQJTHOR-SJLPKXTDSA-N 1 1 357.410 2.609 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC(F)(F)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000289368234 257277291 /nfs/dbraw/zinc/27/72/91/257277291.db2.gz AZEOLWDTGFUMKQ-LLVKDONJSA-N 1 1 357.357 2.909 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000288944910 257240422 /nfs/dbraw/zinc/24/04/22/257240422.db2.gz RWDNZFWRHVANGV-UHFFFAOYSA-N 1 1 359.434 2.607 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@H]1CO)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289683974 257293857 /nfs/dbraw/zinc/29/38/57/257293857.db2.gz NMVOTNXEQRCZAA-LBPRGKRZSA-N 1 1 370.837 2.607 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ncccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000301093973 258024498 /nfs/dbraw/zinc/02/44/98/258024498.db2.gz NFBASQOVWGZHCP-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO CN1CC[N@H+](CCCNc2ncccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000301093973 258024499 /nfs/dbraw/zinc/02/44/99/258024499.db2.gz NFBASQOVWGZHCP-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ncccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000301093973 258024501 /nfs/dbraw/zinc/02/45/01/258024501.db2.gz NFBASQOVWGZHCP-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000301107927 258026328 /nfs/dbraw/zinc/02/63/28/258026328.db2.gz MWCXGJRYGIEQBZ-CQSZACIVSA-N 1 1 368.437 2.813 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ccc(F)cc1[N+](=O)[O-] ZINC000301306580 258041605 /nfs/dbraw/zinc/04/16/05/258041605.db2.gz YYIJJCJFECNROO-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOCC23CCCC3)c([N+](=O)[O-])c1 ZINC000299559415 258005828 /nfs/dbraw/zinc/00/58/28/258005828.db2.gz GOKHKTPWXRCVOA-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@@H]1C[N@H+](C)CCO1 ZINC000302155655 258091421 /nfs/dbraw/zinc/09/14/21/258091421.db2.gz DYJRXTADKFBQJB-YOEHRIQHSA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@@H]1C[N@@H+](C)CCO1 ZINC000302155655 258091423 /nfs/dbraw/zinc/09/14/23/258091423.db2.gz DYJRXTADKFBQJB-YOEHRIQHSA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@H]1C[N@H+](C)CCO1 ZINC000302155653 258091657 /nfs/dbraw/zinc/09/16/57/258091657.db2.gz DYJRXTADKFBQJB-WMLDXEAASA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@H]1C[N@@H+](C)CCO1 ZINC000302155653 258091659 /nfs/dbraw/zinc/09/16/59/258091659.db2.gz DYJRXTADKFBQJB-WMLDXEAASA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1CCO ZINC000302345026 258099490 /nfs/dbraw/zinc/09/94/90/258099490.db2.gz ASUFLWHLFYCZRA-VIFPVBQESA-N 1 1 367.755 2.770 20 5 FFBDMO C[C@H]1CN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1CCO ZINC000302345026 258099491 /nfs/dbraw/zinc/09/94/91/258099491.db2.gz ASUFLWHLFYCZRA-VIFPVBQESA-N 1 1 367.755 2.770 20 5 FFBDMO Cc1cc(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000302431317 258102114 /nfs/dbraw/zinc/10/21/14/258102114.db2.gz LFRSWXXMLZNRHW-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000332520037 258233436 /nfs/dbraw/zinc/23/34/36/258233436.db2.gz LVGMIYZVOSQESX-DGCLKSJQSA-N 1 1 369.368 2.895 20 5 FFBDMO C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccccc2)CC1 ZINC000032723311 506284207 /nfs/dbraw/zinc/28/42/07/506284207.db2.gz NLLMDKXJWHZMPQ-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(C1)C(=O)Nc1ccccc12 ZINC000377213101 512168894 /nfs/dbraw/zinc/16/88/94/512168894.db2.gz FVVXUWWWXODCHV-IBGZPJMESA-N 1 1 353.378 2.699 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c1 ZINC000371065723 512201473 /nfs/dbraw/zinc/20/14/73/512201473.db2.gz XNFVAUQEFNCSAM-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c1 ZINC000371065723 512201476 /nfs/dbraw/zinc/20/14/76/512201476.db2.gz XNFVAUQEFNCSAM-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)o2)cc1 ZINC000371072566 512205595 /nfs/dbraw/zinc/20/55/95/512205595.db2.gz CIRAAZYPOUKXLU-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO COc1ccc(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)cc1[N+](=O)[O-] ZINC000053545661 506402499 /nfs/dbraw/zinc/40/24/99/506402499.db2.gz MSMGJQBRLSVQPT-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000371231545 512280313 /nfs/dbraw/zinc/28/03/13/512280313.db2.gz PIARUMCMEGJTNI-RHSMWYFYSA-N 1 1 366.368 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000371231545 512280319 /nfs/dbraw/zinc/28/03/19/512280319.db2.gz PIARUMCMEGJTNI-RHSMWYFYSA-N 1 1 366.368 2.658 20 5 FFBDMO Cc1ccc(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1[N+](=O)[O-] ZINC000041577144 506532850 /nfs/dbraw/zinc/53/28/50/506532850.db2.gz DQNGQEJKONJJPF-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000375350572 512280847 /nfs/dbraw/zinc/28/08/47/512280847.db2.gz XFIPMKVRAYPXBJ-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO C[N@H+](CCc1ccc(F)cc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000055024596 506663098 /nfs/dbraw/zinc/66/30/98/506663098.db2.gz YAYOLNVMERMRBR-UHFFFAOYSA-N 1 1 357.385 2.798 20 5 FFBDMO C[N@@H+](CCc1ccc(F)cc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000055024596 506663102 /nfs/dbraw/zinc/66/31/02/506663102.db2.gz YAYOLNVMERMRBR-UHFFFAOYSA-N 1 1 357.385 2.798 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000056039789 506916717 /nfs/dbraw/zinc/91/67/17/506916717.db2.gz IJDBFFMTSORMDJ-UHFFFAOYSA-N 1 1 355.394 2.722 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NCCC[N@H+]1CCc2ccccc2C1 ZINC000067709226 506985629 /nfs/dbraw/zinc/98/56/29/506985629.db2.gz ZGQYUPYUQNTWBL-UHFFFAOYSA-N 1 1 368.437 2.571 20 5 FFBDMO Nc1ccc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000045650752 506996904 /nfs/dbraw/zinc/99/69/04/506996904.db2.gz MBEYOABNHWXUDA-UHFFFAOYSA-N 1 1 354.410 2.525 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC1)OCCO2 ZINC000045749534 507012065 /nfs/dbraw/zinc/01/20/65/507012065.db2.gz MWVKMYFIHSYBBT-GFCCVEGCSA-N 1 1 360.370 2.545 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085599 507104843 /nfs/dbraw/zinc/10/48/43/507104843.db2.gz JMTGWQXZZOXZGI-STQMWFEESA-N 1 1 359.430 2.569 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000021322169 507250549 /nfs/dbraw/zinc/25/05/49/507250549.db2.gz CVIACFRGFCGFSY-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047676755 507378248 /nfs/dbraw/zinc/37/82/48/507378248.db2.gz YTXSRANAJHWIBC-UHFFFAOYSA-N 1 1 371.441 2.523 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000069045970 507391527 /nfs/dbraw/zinc/39/15/27/507391527.db2.gz SDJVLGONZLSQCL-OAHLLOKOSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)[N@H+]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000069084088 507401548 /nfs/dbraw/zinc/40/15/48/507401548.db2.gz ZIQDMTXIWVNEQK-UHFFFAOYSA-N 1 1 354.838 2.603 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000069138292 507417928 /nfs/dbraw/zinc/41/79/28/507417928.db2.gz NSZHHTLZMQUUIP-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1F)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000025252347 507478882 /nfs/dbraw/zinc/47/88/82/507478882.db2.gz GGHHCBCHVAJLJS-OAHLLOKOSA-N 1 1 352.337 2.745 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1F)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000025252347 507478886 /nfs/dbraw/zinc/47/88/86/507478886.db2.gz GGHHCBCHVAJLJS-OAHLLOKOSA-N 1 1 352.337 2.745 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000048216700 507480883 /nfs/dbraw/zinc/48/08/83/507480883.db2.gz LSVNDQGAKXMBGB-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000048216700 507480890 /nfs/dbraw/zinc/48/08/90/507480890.db2.gz LSVNDQGAKXMBGB-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000069470337 507495456 /nfs/dbraw/zinc/49/54/56/507495456.db2.gz XEIBEGVECRJMBI-OLZOCXBDSA-N 1 1 369.849 2.864 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000025631972 507517657 /nfs/dbraw/zinc/51/76/57/507517657.db2.gz CYDBIUVONSJBPL-CQSZACIVSA-N 1 1 368.437 2.813 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000025634187 507517948 /nfs/dbraw/zinc/51/79/48/507517948.db2.gz PIKVUANGLSAJLL-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 ZINC000026257820 507573112 /nfs/dbraw/zinc/57/31/12/507573112.db2.gz CQQVNKQACFGRAU-UHFFFAOYSA-N 1 1 357.366 2.784 20 5 FFBDMO COc1ccc(C[NH+]2CCC(CC(=O)N3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000061048105 507593354 /nfs/dbraw/zinc/59/33/54/507593354.db2.gz JTQYTLQWCIIJSI-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051380777 507767073 /nfs/dbraw/zinc/76/70/73/507767073.db2.gz WRRJTWMYYLAZNR-LBPRGKRZSA-N 1 1 358.423 2.685 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000052160059 507799660 /nfs/dbraw/zinc/79/96/60/507799660.db2.gz SMDAVRFULWOKMB-NWDGAFQWSA-N 1 1 366.418 2.836 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000052241559 507803722 /nfs/dbraw/zinc/80/37/22/507803722.db2.gz PQGOZJFHAOUKQT-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000052305822 507805980 /nfs/dbraw/zinc/80/59/80/507805980.db2.gz SFPCRGXIYKTGND-OKILXGFUSA-N 1 1 369.487 2.778 20 5 FFBDMO Cc1cc(NC[C@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000077995480 507825264 /nfs/dbraw/zinc/82/52/64/507825264.db2.gz UHSSZQOLBYHSJU-AWEZNQCLSA-N 1 1 371.441 2.740 20 5 FFBDMO O=C(CCN1CC[C@@H](C[NH+]2CCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000072718497 507846344 /nfs/dbraw/zinc/84/63/44/507846344.db2.gz NZYHBHOXTFNXSC-INIZCTEOSA-N 1 1 360.458 2.731 20 5 FFBDMO CC[NH+](CC)C[C@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000072823350 507858032 /nfs/dbraw/zinc/85/80/32/507858032.db2.gz OGKRAVCVCIMUAU-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089935215 507887635 /nfs/dbraw/zinc/88/76/35/507887635.db2.gz QGEUOIVBPNDDHI-AWEZNQCLSA-N 1 1 358.398 2.550 20 5 FFBDMO CCCO[C@H]1CCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000108394645 507892658 /nfs/dbraw/zinc/89/26/58/507892658.db2.gz MEJSIHOWFIRYAS-HNNXBMFYSA-N 1 1 365.430 2.823 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000108394645 507892661 /nfs/dbraw/zinc/89/26/61/507892661.db2.gz MEJSIHOWFIRYAS-HNNXBMFYSA-N 1 1 365.430 2.823 20 5 FFBDMO NC(=O)c1ccc(NCCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000073587839 507935058 /nfs/dbraw/zinc/93/50/58/507935058.db2.gz BOTKZOINYBBPTB-UHFFFAOYSA-N 1 1 354.410 2.554 20 5 FFBDMO COCCCOCC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000091101850 507956186 /nfs/dbraw/zinc/95/61/86/507956186.db2.gz LWDOFIMEFRXTJP-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000091101850 507956188 /nfs/dbraw/zinc/95/61/88/507956188.db2.gz LWDOFIMEFRXTJP-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc(CCC)c1[N+](=O)[O-] ZINC000109621296 507971848 /nfs/dbraw/zinc/97/18/48/507971848.db2.gz SEDAQSDDNMSACT-CYBMUJFWSA-N 1 1 351.451 2.655 20 5 FFBDMO CCOc1ccc(C2=CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)CC2)cc1 ZINC000091813583 508015130 /nfs/dbraw/zinc/01/51/30/508015130.db2.gz XFJMJUUHRHMTDN-UHFFFAOYSA-N 1 1 369.421 2.945 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000079945118 508017514 /nfs/dbraw/zinc/01/75/14/508017514.db2.gz NHQZZPYMXFUOGZ-HOCLYGCPSA-N 1 1 368.437 2.960 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000110594729 508036099 /nfs/dbraw/zinc/03/60/99/508036099.db2.gz VCOIMBDDVOKJOO-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO CCc1nn(C)c(CC)c1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000092048345 508037744 /nfs/dbraw/zinc/03/77/44/508037744.db2.gz CUOZLGAWUAVDMY-UHFFFAOYSA-N 1 1 357.458 2.775 20 5 FFBDMO Cc1cc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000080640980 508090654 /nfs/dbraw/zinc/09/06/54/508090654.db2.gz GUILHMVEYBYWKX-CQSZACIVSA-N 1 1 352.866 2.773 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000092672220 508092794 /nfs/dbraw/zinc/09/27/94/508092794.db2.gz JGTFUSXXAAMLGP-ZVVFDCPKSA-N 1 1 361.467 2.648 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000092672220 508092796 /nfs/dbraw/zinc/09/27/96/508092796.db2.gz JGTFUSXXAAMLGP-ZVVFDCPKSA-N 1 1 361.467 2.648 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000081095210 508136963 /nfs/dbraw/zinc/13/69/63/508136963.db2.gz PAIWRGMEBYZRNU-CRAIPNDOSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000081095210 508136967 /nfs/dbraw/zinc/13/69/67/508136967.db2.gz PAIWRGMEBYZRNU-CRAIPNDOSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000081095538 508137290 /nfs/dbraw/zinc/13/72/90/508137290.db2.gz UPSVCKKXTQQYLP-RHSMWYFYSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000081095538 508137291 /nfs/dbraw/zinc/13/72/91/508137291.db2.gz UPSVCKKXTQQYLP-RHSMWYFYSA-N 1 1 362.474 2.894 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000081363825 508167680 /nfs/dbraw/zinc/16/76/80/508167680.db2.gz HYGJSYYWZOXSST-ZDUSSCGKSA-N 1 1 353.850 2.981 20 5 FFBDMO CCOC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000112357034 508177951 /nfs/dbraw/zinc/17/79/51/508177951.db2.gz RWKPJTGOAFBMHW-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000112357034 508177953 /nfs/dbraw/zinc/17/79/53/508177953.db2.gz RWKPJTGOAFBMHW-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CN(C(=O)CN1CC[N@@H+](C)CC12CCCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000081597717 508195372 /nfs/dbraw/zinc/19/53/72/508195372.db2.gz IFBOQMBIRBLETC-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000076494731 508214340 /nfs/dbraw/zinc/21/43/40/508214340.db2.gz BBLUETVNVYODQD-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000076494731 508214342 /nfs/dbraw/zinc/21/43/42/508214342.db2.gz BBLUETVNVYODQD-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000113270677 508256707 /nfs/dbraw/zinc/25/67/07/508256707.db2.gz FRRPTJMWCHDFIZ-WMLDXEAASA-N 1 1 356.426 2.961 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000087032876 508332356 /nfs/dbraw/zinc/33/23/56/508332356.db2.gz UQBOSAXWRLVRSM-GASCZTMLSA-N 1 1 363.458 2.531 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000087032876 508332358 /nfs/dbraw/zinc/33/23/58/508332358.db2.gz UQBOSAXWRLVRSM-GASCZTMLSA-N 1 1 363.458 2.531 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104685431 508341660 /nfs/dbraw/zinc/34/16/60/508341660.db2.gz SBYKQASGXRILCY-AWEZNQCLSA-N 1 1 372.425 2.770 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)CCNc2ccccc2[N+](=O)[O-])c1 ZINC000156706533 508465313 /nfs/dbraw/zinc/46/53/13/508465313.db2.gz QZWBJMHFQNLWFH-UHFFFAOYSA-N 1 1 366.381 2.925 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116279124 508494238 /nfs/dbraw/zinc/49/42/38/508494238.db2.gz DNSIEBCKOIAIML-QGZVFWFLSA-N 1 1 366.893 2.850 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+](Cc2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000116391755 508506554 /nfs/dbraw/zinc/50/65/54/508506554.db2.gz AKBUVSVXUNSICU-QGZVFWFLSA-N 1 1 366.421 2.791 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134873679 508571441 /nfs/dbraw/zinc/57/14/41/508571441.db2.gz ZHNLQPAYZDKSIC-BEFAXECRSA-N 1 1 372.469 2.790 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@H](C)C1 ZINC000153517425 508591406 /nfs/dbraw/zinc/59/14/06/508591406.db2.gz YIGWJUILVHYUKZ-KBPBESRZSA-N 1 1 358.442 2.855 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000135437216 508604201 /nfs/dbraw/zinc/60/42/01/508604201.db2.gz HGCCPZYUAMVXMG-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000135437216 508604202 /nfs/dbraw/zinc/60/42/02/508604202.db2.gz HGCCPZYUAMVXMG-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO CC(C)CO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128903018 508657742 /nfs/dbraw/zinc/65/77/42/508657742.db2.gz AZRXBZWYKMQIJU-AWEZNQCLSA-N 1 1 353.394 2.809 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000153854968 508663548 /nfs/dbraw/zinc/66/35/48/508663548.db2.gz PFUYLJJSRMAOFT-MRXNPFEDSA-N 1 1 358.341 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N[C@H](C)C(C)C)CC1 ZINC000153882978 508668849 /nfs/dbraw/zinc/66/88/49/508668849.db2.gz RSCXQXFRPFTWBF-CQSZACIVSA-N 1 1 363.458 2.976 20 5 FFBDMO COc1ccc(OCCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866017 508687260 /nfs/dbraw/zinc/68/72/60/508687260.db2.gz NYERRJDHMDISIL-OAHLLOKOSA-N 1 1 372.425 2.954 20 5 FFBDMO C[NH+](C)CCCC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000123446628 508688202 /nfs/dbraw/zinc/68/82/02/508688202.db2.gz COFQUPUCOFCFKC-IBGZPJMESA-N 1 1 374.485 2.754 20 5 FFBDMO Cc1nc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000118866935 508688823 /nfs/dbraw/zinc/68/88/23/508688823.db2.gz HVXZZRBQSBALRP-AWEZNQCLSA-N 1 1 364.409 2.928 20 5 FFBDMO Cc1nc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc12 ZINC000118866935 508688824 /nfs/dbraw/zinc/68/88/24/508688824.db2.gz HVXZZRBQSBALRP-AWEZNQCLSA-N 1 1 364.409 2.928 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968851 508688936 /nfs/dbraw/zinc/68/89/36/508688936.db2.gz OXZJUFYRMICVNM-MSOLQXFVSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968851 508688937 /nfs/dbraw/zinc/68/89/37/508688937.db2.gz OXZJUFYRMICVNM-MSOLQXFVSA-N 1 1 373.453 2.763 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866841 508689047 /nfs/dbraw/zinc/68/90/47/508689047.db2.gz UQSCORGZDRERIG-AWEZNQCLSA-N 1 1 358.398 2.564 20 5 FFBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)CCn3cc([N+](=O)[O-])cn3)c2C1 ZINC000158365701 508694353 /nfs/dbraw/zinc/69/43/53/508694353.db2.gz OMKBKUKTZNDJLU-UHFFFAOYSA-N 1 1 357.414 2.792 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123663513 508722404 /nfs/dbraw/zinc/72/24/04/508722404.db2.gz PIQFZROUNDJUOJ-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123663513 508722407 /nfs/dbraw/zinc/72/24/07/508722407.db2.gz PIQFZROUNDJUOJ-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000129416085 508724350 /nfs/dbraw/zinc/72/43/50/508724350.db2.gz SQGBPCGANAVDDV-UHFFFAOYSA-N 1 1 363.458 2.805 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000119106291 508727182 /nfs/dbraw/zinc/72/71/82/508727182.db2.gz VZXKUNSUMFBUGB-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000119106291 508727187 /nfs/dbraw/zinc/72/71/87/508727187.db2.gz VZXKUNSUMFBUGB-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123816845 508742754 /nfs/dbraw/zinc/74/27/54/508742754.db2.gz NEEZZXFPMKKXPH-HNNXBMFYSA-N 1 1 371.441 2.612 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137495436 508758053 /nfs/dbraw/zinc/75/80/53/508758053.db2.gz MRNWPIYBWQNBGX-ZFWWWQNUSA-N 1 1 354.410 2.570 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000119321977 508773206 /nfs/dbraw/zinc/77/32/06/508773206.db2.gz FAYXXJOOILRJHJ-CYBMUJFWSA-N 1 1 353.850 2.885 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000130027759 508788885 /nfs/dbraw/zinc/78/88/85/508788885.db2.gz ORVGAOQKUUBYPL-UHFFFAOYSA-N 1 1 361.358 2.527 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC2(CCCC2)C1 ZINC000139779139 508795287 /nfs/dbraw/zinc/79/52/87/508795287.db2.gz PYRLHHJDPYGFED-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139917218 508796714 /nfs/dbraw/zinc/79/67/14/508796714.db2.gz AVESPDCOWVNIJK-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139917218 508796719 /nfs/dbraw/zinc/79/67/19/508796719.db2.gz AVESPDCOWVNIJK-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000142343582 508823478 /nfs/dbraw/zinc/82/34/78/508823478.db2.gz XEPJHAOCBJZGCA-MRXNPFEDSA-N 1 1 358.442 2.505 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC(C)(C)CN1CCOCC1 ZINC000124502225 508843218 /nfs/dbraw/zinc/84/32/18/508843218.db2.gz AZAKRYITFAAYNE-UHFFFAOYSA-N 1 1 365.474 2.784 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000124502225 508843222 /nfs/dbraw/zinc/84/32/22/508843222.db2.gz AZAKRYITFAAYNE-UHFFFAOYSA-N 1 1 365.474 2.784 20 5 FFBDMO Cc1nccn1CCC[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000130766374 508843475 /nfs/dbraw/zinc/84/34/75/508843475.db2.gz XCWGLFOBKUTQOY-UHFFFAOYSA-N 1 1 359.430 2.759 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H](C[NH+]3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000150776298 508890935 /nfs/dbraw/zinc/89/09/35/508890935.db2.gz UHBCWSASHYYVLI-MRXNPFEDSA-N 1 1 360.458 2.650 20 5 FFBDMO C[C@H]1SCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1c1ccccc1 ZINC000159833893 508898396 /nfs/dbraw/zinc/89/83/96/508898396.db2.gz ZPMWIUJVEGKWOU-RDTXWAMCSA-N 1 1 359.451 2.935 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000119970698 508900734 /nfs/dbraw/zinc/90/07/34/508900734.db2.gz LAKNBZFUOFWMNE-BEFAXECRSA-N 1 1 353.422 2.774 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000160803680 509034662 /nfs/dbraw/zinc/03/46/62/509034662.db2.gz DBOLTHCNNMCXLF-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000161555518 509128881 /nfs/dbraw/zinc/12/88/81/509128881.db2.gz VVNHFVYHTOAJMJ-SNVBAGLBSA-N 1 1 368.231 2.571 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000156197466 509143396 /nfs/dbraw/zinc/14/33/96/509143396.db2.gz NLLUOUYLPCAUPZ-CQSZACIVSA-N 1 1 357.414 2.780 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CCCC1 ZINC000121423379 509173097 /nfs/dbraw/zinc/17/30/97/509173097.db2.gz WWJYRJLLURPJKM-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO Cc1c(Br)cc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000121556973 509178400 /nfs/dbraw/zinc/17/84/00/509178400.db2.gz OEKQMRIIVHWUHL-VIFPVBQESA-N 1 1 370.247 2.878 20 5 FFBDMO Cc1c(Br)cc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000121556789 509178449 /nfs/dbraw/zinc/17/84/49/509178449.db2.gz OEKQMRIIVHWUHL-SECBINFHSA-N 1 1 370.247 2.878 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1 ZINC000248068525 509228043 /nfs/dbraw/zinc/22/80/43/509228043.db2.gz QALPSCAZVBXVPE-SJLPKXTDSA-N 1 1 355.394 2.779 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]21 ZINC000248161113 509251377 /nfs/dbraw/zinc/25/13/77/509251377.db2.gz SDFZJKDHEZVBTR-GDBMZVCRSA-N 1 1 357.414 2.561 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000248454442 509329004 /nfs/dbraw/zinc/32/90/04/509329004.db2.gz KKHSEBDEYDQSSC-QZTJIDSGSA-N 1 1 371.437 2.911 20 5 FFBDMO CC[C@H](CO)[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000179419114 509433018 /nfs/dbraw/zinc/43/30/18/509433018.db2.gz KZHDDAHWWHYJKJ-QGZVFWFLSA-N 1 1 363.461 2.917 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000248719030 509451703 /nfs/dbraw/zinc/45/17/03/509451703.db2.gz CDVJBGKBCXQYCM-CJNGLKHVSA-N 1 1 371.441 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000192358121 509481731 /nfs/dbraw/zinc/48/17/31/509481731.db2.gz UXUDPMMGENUZMD-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CCCO2)cc1 ZINC000192358121 509481739 /nfs/dbraw/zinc/48/17/39/509481739.db2.gz UXUDPMMGENUZMD-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(c2ccccc2)CC1 ZINC000189287294 509502921 /nfs/dbraw/zinc/50/29/21/509502921.db2.gz QGQARLZUYKENJP-SFHVURJKSA-N 1 1 356.422 2.998 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000267551695 509537744 /nfs/dbraw/zinc/53/77/44/509537744.db2.gz CHUIIAJWQCDXIY-WBVHZDCISA-N 1 1 356.426 2.635 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000248949054 509552227 /nfs/dbraw/zinc/55/22/27/509552227.db2.gz DWFVBNFXFMBOIX-MNZLEMJZSA-N 1 1 357.458 2.538 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCS[C@@H](C)CC1 ZINC000249027596 509575536 /nfs/dbraw/zinc/57/55/36/509575536.db2.gz LQAULHMVBQHHGB-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000249027596 509575539 /nfs/dbraw/zinc/57/55/39/509575539.db2.gz LQAULHMVBQHHGB-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000267950095 509683463 /nfs/dbraw/zinc/68/34/63/509683463.db2.gz VWTGTECNYAFFGF-UHFFFAOYSA-N 1 1 374.210 2.664 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170648240 509696966 /nfs/dbraw/zinc/69/69/66/509696966.db2.gz AIXZDUCSABUFRB-CYBMUJFWSA-N 1 1 365.430 2.950 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186436823 509707980 /nfs/dbraw/zinc/70/79/80/509707980.db2.gz BPNJXOWGOMJKKJ-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO Cn1nc2c(cc1=O)C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000180013180 509709927 /nfs/dbraw/zinc/70/99/27/509709927.db2.gz MKXVRXXAYRAWNH-UHFFFAOYSA-N 1 1 366.377 2.507 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183375789 509746860 /nfs/dbraw/zinc/74/68/60/509746860.db2.gz OJUUWBOWTRDEFE-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](Oc2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183375789 509746863 /nfs/dbraw/zinc/74/68/63/509746863.db2.gz OJUUWBOWTRDEFE-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180142741 509774544 /nfs/dbraw/zinc/77/45/44/509774544.db2.gz OHISILKNUUWCOI-MJGOQNOKSA-N 1 1 355.394 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1SC ZINC000268171631 509794987 /nfs/dbraw/zinc/79/49/87/509794987.db2.gz FBNBPGSMWDDZRT-GXFFZTMASA-N 1 1 365.455 2.538 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000176987487 509801779 /nfs/dbraw/zinc/80/17/79/509801779.db2.gz BCMXWLFMFANMPG-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@]3(CCOC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180239987 509829476 /nfs/dbraw/zinc/82/94/76/509829476.db2.gz JVNFRMAMWBOIIE-KRWDZBQOSA-N 1 1 372.368 2.860 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186746605 509886655 /nfs/dbraw/zinc/88/66/55/509886655.db2.gz GJEXKNIFJQYQHA-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000186780898 509897684 /nfs/dbraw/zinc/89/76/84/509897684.db2.gz YYMNUEAFXWOSEA-AWEZNQCLSA-N 1 1 364.446 2.521 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)C[C@H](O)c2ccco2)n1 ZINC000177160242 509910179 /nfs/dbraw/zinc/91/01/79/509910179.db2.gz JQWUUMHGUVGFOF-INIZCTEOSA-N 1 1 356.382 2.620 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000180425849 509920339 /nfs/dbraw/zinc/92/03/39/509920339.db2.gz FEPRIYSOIGCFTA-LLVKDONJSA-N 1 1 363.443 2.934 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)CC2 ZINC000245492564 509961974 /nfs/dbraw/zinc/96/19/74/509961974.db2.gz JSHNOFUARYZLDS-LESCRADOSA-N 1 1 360.458 2.869 20 5 FFBDMO COc1ccc(OCCN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c([N+](=O)[O-])c1 ZINC000245494967 509963428 /nfs/dbraw/zinc/96/34/28/509963428.db2.gz OMAYGWUFZQEFQC-CVEARBPZSA-N 1 1 363.458 2.929 20 5 FFBDMO COC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193679263 510016839 /nfs/dbraw/zinc/01/68/39/510016839.db2.gz XCZXFKKQXXUFTG-HNNXBMFYSA-N 1 1 363.801 2.824 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1CCO ZINC000190241679 510021690 /nfs/dbraw/zinc/02/16/90/510021690.db2.gz IHGBHKHWGSLHNF-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@@H+]1CCO ZINC000190241679 510021710 /nfs/dbraw/zinc/02/17/10/510021710.db2.gz IHGBHKHWGSLHNF-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[N@H+]1CCO ZINC000190241679 510021718 /nfs/dbraw/zinc/02/17/18/510021718.db2.gz IHGBHKHWGSLHNF-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO COC(=O)c1ccccc1CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000187262221 510156620 /nfs/dbraw/zinc/15/66/20/510156620.db2.gz QQQHGDKVLJWNOU-HNNXBMFYSA-N 1 1 370.409 2.505 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccccc2NCc2ccccc2[N+](=O)[O-])CC1 ZINC000187535497 510319184 /nfs/dbraw/zinc/31/91/84/510319184.db2.gz LWPVNFDEPJSHLD-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000265976809 510334932 /nfs/dbraw/zinc/33/49/32/510334932.db2.gz CBLWPFRAHHJDQF-MRXNPFEDSA-N 1 1 356.426 2.747 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000171809932 510384248 /nfs/dbraw/zinc/38/42/48/510384248.db2.gz PPHNWEYLNKEIBY-UHFFFAOYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000171809932 510384254 /nfs/dbraw/zinc/38/42/54/510384254.db2.gz PPHNWEYLNKEIBY-UHFFFAOYSA-N 1 1 371.441 2.617 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000266235119 510474130 /nfs/dbraw/zinc/47/41/30/510474130.db2.gz DBEVLXTXBRYYDD-GFCCVEGCSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000266235119 510474137 /nfs/dbraw/zinc/47/41/37/510474137.db2.gz DBEVLXTXBRYYDD-GFCCVEGCSA-N 1 1 357.332 2.924 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000194723275 510496211 /nfs/dbraw/zinc/49/62/11/510496211.db2.gz LUIVBYLMIYHAPD-GFCCVEGCSA-N 1 1 374.363 2.626 20 5 FFBDMO C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181664717 510528942 /nfs/dbraw/zinc/52/89/42/510528942.db2.gz WZQCCOGTNQAXCM-HUUCEWRRSA-N 1 1 361.442 2.743 20 5 FFBDMO COc1ccc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000181675377 510534792 /nfs/dbraw/zinc/53/47/92/510534792.db2.gz KRPPUPZSWBOKND-DZGCQCFKSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181680549 510537900 /nfs/dbraw/zinc/53/79/00/510537900.db2.gz MPPLLRGRYPPENR-HUUCEWRRSA-N 1 1 361.442 2.743 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000266555099 510655523 /nfs/dbraw/zinc/65/55/23/510655523.db2.gz PMTIQNYOSXJHSY-MRXNPFEDSA-N 1 1 356.426 2.907 20 5 FFBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126149 510685865 /nfs/dbraw/zinc/68/58/65/510685865.db2.gz GJKQUNLTFUEBGZ-OAHLLOKOSA-N 1 1 354.414 2.614 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000181980077 510690233 /nfs/dbraw/zinc/69/02/33/510690233.db2.gz WRDMEHURAVYZBO-KMFMINBZSA-N 1 1 352.456 2.695 20 5 FFBDMO C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C[NH+]1CCOCC1 ZINC000172461164 510737420 /nfs/dbraw/zinc/73/74/20/510737420.db2.gz SGCKIVKMQBYAPW-LBPRGKRZSA-N 1 1 363.439 2.508 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCC1([NH+]2CCOCC2)CCCCC1 ZINC000195333477 510788887 /nfs/dbraw/zinc/78/88/87/510788887.db2.gz ORRGYZIVPYJBKW-UHFFFAOYSA-N 1 1 351.451 2.567 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000182176787 510796389 /nfs/dbraw/zinc/79/63/89/510796389.db2.gz DERNYAARKJEQHM-LLVKDONJSA-N 1 1 370.377 2.998 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000175800147 510797450 /nfs/dbraw/zinc/79/74/50/510797450.db2.gz FCYVJAQVECUCBB-KRWDZBQOSA-N 1 1 360.458 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172583099 510803510 /nfs/dbraw/zinc/80/35/10/510803510.db2.gz NQIBBQVDGCGJLY-HNNXBMFYSA-N 1 1 360.458 2.872 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000247376553 510859052 /nfs/dbraw/zinc/85/90/52/510859052.db2.gz HWBXALBKSWUOEL-CKEIUWERSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000247376553 510859053 /nfs/dbraw/zinc/85/90/53/510859053.db2.gz HWBXALBKSWUOEL-CKEIUWERSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000247556971 510865519 /nfs/dbraw/zinc/86/55/19/510865519.db2.gz ZHGBDTOATHXULD-TZMCWYRMSA-N 1 1 369.849 2.816 20 5 FFBDMO Cc1c(NC(=O)CC[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-] ZINC000285353012 510872972 /nfs/dbraw/zinc/87/29/72/510872972.db2.gz BAMYTLHCZGFAQU-XYPWUTKMSA-N 1 1 360.458 2.789 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cccc1[N+](=O)[O-] ZINC000285353012 510872974 /nfs/dbraw/zinc/87/29/74/510872974.db2.gz BAMYTLHCZGFAQU-XYPWUTKMSA-N 1 1 360.458 2.789 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)C2C[C@H]3CC[C@@H](C2)N3C)cccc1[N+](=O)[O-] ZINC000285353012 510872977 /nfs/dbraw/zinc/87/29/77/510872977.db2.gz BAMYTLHCZGFAQU-XYPWUTKMSA-N 1 1 360.458 2.789 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285383130 510884695 /nfs/dbraw/zinc/88/46/95/510884695.db2.gz RUYHPWDOPLAVJU-UHFFFAOYSA-N 1 1 372.450 2.690 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279310997 511040176 /nfs/dbraw/zinc/04/01/76/511040176.db2.gz COGARVWQZAHKEJ-IYBDPMFKSA-N 1 1 367.409 2.586 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2nn(C)cc2[N+](=O)[O-])c1 ZINC000271368984 511181042 /nfs/dbraw/zinc/18/10/42/511181042.db2.gz HMIANXRQXIXMGX-UHFFFAOYSA-N 1 1 373.457 2.880 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000362390239 511185738 /nfs/dbraw/zinc/18/57/38/511185738.db2.gz UBMSUHNAWKJXIH-IAGOWNOFSA-N 1 1 372.469 2.554 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(n4cccn4)CC3)n2)cc1 ZINC000362964225 511280239 /nfs/dbraw/zinc/28/02/39/511280239.db2.gz JULRZQFZVBXHBQ-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000363095641 511351018 /nfs/dbraw/zinc/35/10/18/511351018.db2.gz MHBNXFXIJFTHIW-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000298664899 511367764 /nfs/dbraw/zinc/36/77/64/511367764.db2.gz YFRMRTOVOMMHSS-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000291945520 511401511 /nfs/dbraw/zinc/40/15/11/511401511.db2.gz PYUVLBSXAIHDND-FUHWJXTLSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000291945520 511401514 /nfs/dbraw/zinc/40/15/14/511401514.db2.gz PYUVLBSXAIHDND-FUHWJXTLSA-N 1 1 357.410 2.813 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272030839 511406826 /nfs/dbraw/zinc/40/68/26/511406826.db2.gz PDSDUMXUPOATAZ-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@]2(C)CCCO)c([N+](=O)[O-])c1 ZINC000272030839 511406830 /nfs/dbraw/zinc/40/68/30/511406830.db2.gz PDSDUMXUPOATAZ-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000291978323 511415239 /nfs/dbraw/zinc/41/52/39/511415239.db2.gz YLRDUVIGOFGZQY-UKRRQHHQSA-N 1 1 371.441 2.834 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000298955849 511464425 /nfs/dbraw/zinc/46/44/25/511464425.db2.gz DJQYANWVLOXZCX-FUHWJXTLSA-N 1 1 358.442 2.552 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292181445 511497055 /nfs/dbraw/zinc/49/70/55/511497055.db2.gz KQRPESGLXXOXHT-KRWDZBQOSA-N 1 1 367.833 2.571 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+](C2CCC2)C1 ZINC000292235933 511516631 /nfs/dbraw/zinc/51/66/31/511516631.db2.gz CSLLFSXZPMMONB-AWEZNQCLSA-N 1 1 370.453 2.951 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1ccccc1C[N@H+](C)C(C)C ZINC000299262174 511570977 /nfs/dbraw/zinc/57/09/77/511570977.db2.gz SEWIPIYUXZFPGB-UHFFFAOYSA-N 1 1 373.457 2.646 20 5 FFBDMO CCn1cc([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000296056252 511605657 /nfs/dbraw/zinc/60/56/57/511605657.db2.gz NVOZWUXSNWUATM-SNVBAGLBSA-N 1 1 351.794 2.754 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273846510 511629942 /nfs/dbraw/zinc/62/99/42/511629942.db2.gz GTYXDUFQMOSIBD-CXAGYDPISA-N 1 1 363.433 2.954 20 5 FFBDMO COc1cc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000292699442 511690263 /nfs/dbraw/zinc/69/02/63/511690263.db2.gz CDYPFSSHCZMENS-HNNXBMFYSA-N 1 1 350.415 2.861 20 5 FFBDMO COc1cc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)c([N+](=O)[O-])cc1OC ZINC000292699442 511690269 /nfs/dbraw/zinc/69/02/69/511690269.db2.gz CDYPFSSHCZMENS-HNNXBMFYSA-N 1 1 350.415 2.861 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000296409044 511731369 /nfs/dbraw/zinc/73/13/69/511731369.db2.gz UHUOLXWVMOWHSJ-IRXDYDNUSA-N 1 1 350.802 2.947 20 5 FFBDMO COC[C@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000363829654 511793367 /nfs/dbraw/zinc/79/33/67/511793367.db2.gz WRYMKIACDNJEHK-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](CCCC2CCOCC2)CC1 ZINC000293026131 511812961 /nfs/dbraw/zinc/81/29/61/511812961.db2.gz FWZVCOMBMOTWFM-UHFFFAOYSA-N 1 1 361.442 2.559 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)nc1 ZINC000363900085 511838968 /nfs/dbraw/zinc/83/89/68/511838968.db2.gz VVDWKXZJJBKCLN-UHFFFAOYSA-N 1 1 353.426 2.877 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CCn4c[nH+]cc4C3)n2)c1 ZINC000350903321 511903425 /nfs/dbraw/zinc/90/34/25/511903425.db2.gz IVYXVYTYDIHJDP-LLVKDONJSA-N 1 1 355.354 2.504 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+](C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000296801123 511903695 /nfs/dbraw/zinc/90/36/95/511903695.db2.gz UECRVMFMPWIILU-HIFRSBDPSA-N 1 1 360.458 2.646 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](CCCCCCO)CC3)nc2c1 ZINC000274825850 511954177 /nfs/dbraw/zinc/95/41/77/511954177.db2.gz KVKLODNQUWFIFY-UHFFFAOYSA-N 1 1 361.446 2.536 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875405 511973113 /nfs/dbraw/zinc/97/31/13/511973113.db2.gz XIUYKPQCHWLSHB-SJORKVTESA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875405 511973120 /nfs/dbraw/zinc/97/31/20/511973120.db2.gz XIUYKPQCHWLSHB-SJORKVTESA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000274875405 511973124 /nfs/dbraw/zinc/97/31/24/511973124.db2.gz XIUYKPQCHWLSHB-SJORKVTESA-N 1 1 365.474 2.700 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000297071338 512008288 /nfs/dbraw/zinc/00/82/88/512008288.db2.gz AGPKMHIWWSEWIO-QGZVFWFLSA-N 1 1 366.849 2.876 20 5 FFBDMO Cc1c(-c2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])on2)cnn1C ZINC000285213612 512040307 /nfs/dbraw/zinc/04/03/07/512040307.db2.gz DUKLLGTULAFLOZ-UHFFFAOYSA-N 1 1 355.398 2.966 20 5 FFBDMO CCOc1cc(C(=O)N2CC[N@H+](CC)C[C@@H]2CC)c([N+](=O)[O-])cc1OC ZINC000411063104 512456041 /nfs/dbraw/zinc/45/60/41/512456041.db2.gz SHCZEXDPYRGXKW-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO CCOc1cc(C(=O)N2CC[N@@H+](CC)C[C@@H]2CC)c([N+](=O)[O-])cc1OC ZINC000411063104 512456043 /nfs/dbraw/zinc/45/60/43/512456043.db2.gz SHCZEXDPYRGXKW-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO Cc1ccnc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)n1 ZINC000375722393 512473016 /nfs/dbraw/zinc/47/30/16/512473016.db2.gz ZHJJQARTFNBMPT-UHFFFAOYSA-N 1 1 357.370 2.981 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(Oc3cnccn3)CC2)ccc1[N+](=O)[O-] ZINC000369723308 512573681 /nfs/dbraw/zinc/57/36/81/512573681.db2.gz PNTOBCODALPKEU-UHFFFAOYSA-N 1 1 358.398 2.827 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@@H]1CO)Nc1ccc([N+](=O)[O-])cc1 ZINC000411391526 512613216 /nfs/dbraw/zinc/61/32/16/512613216.db2.gz ORTXCJANUKAHGQ-SFHVURJKSA-N 1 1 355.394 2.515 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H](C)O2 ZINC000374028780 512630501 /nfs/dbraw/zinc/63/05/01/512630501.db2.gz STDQRVLSKWVZOQ-VKJFTORMSA-N 1 1 350.415 2.632 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccn(-c4ccc(F)cc4)n3)CC2)n1 ZINC000376476356 512835665 /nfs/dbraw/zinc/83/56/65/512835665.db2.gz HNCILOFYDUIYQW-UHFFFAOYSA-N 1 1 370.388 2.953 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCSC2(CCC2)CC1 ZINC000411871637 512852410 /nfs/dbraw/zinc/85/24/10/512852410.db2.gz SFCSAJYCTNSJEK-UHFFFAOYSA-N 1 1 365.455 2.904 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCSC2(CCC2)CC1 ZINC000411871637 512852415 /nfs/dbraw/zinc/85/24/15/512852415.db2.gz SFCSAJYCTNSJEK-UHFFFAOYSA-N 1 1 365.455 2.904 20 5 FFBDMO C[C@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000411981811 512900674 /nfs/dbraw/zinc/90/06/74/512900674.db2.gz JDDKRISUDJXDSQ-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@H](C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000411996278 512906886 /nfs/dbraw/zinc/90/68/86/512906886.db2.gz GEQJXDHFJOITQK-GRYCIOLGSA-N 1 1 358.402 2.580 20 5 FFBDMO C[N@@H+]1CC=C(CNc2ccc(I)cc2[N+](=O)[O-])CC1 ZINC000392912092 512929406 /nfs/dbraw/zinc/92/94/06/512929406.db2.gz ZGWSDAKXSIBOLT-UHFFFAOYSA-N 1 1 373.194 2.873 20 5 FFBDMO CC(C)[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H]1CCC(=O)N1 ZINC000412061412 512938647 /nfs/dbraw/zinc/93/86/47/512938647.db2.gz ABWQAUSWBCWQTF-AWEZNQCLSA-N 1 1 358.398 2.739 20 5 FFBDMO CC(C)[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H]1CCC(=O)N1 ZINC000412061412 512938649 /nfs/dbraw/zinc/93/86/49/512938649.db2.gz ABWQAUSWBCWQTF-AWEZNQCLSA-N 1 1 358.398 2.739 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060922 512938784 /nfs/dbraw/zinc/93/87/84/512938784.db2.gz HDXUECYVQUFODX-FZKQIMNGSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060922 512938788 /nfs/dbraw/zinc/93/87/88/512938788.db2.gz HDXUECYVQUFODX-FZKQIMNGSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000398001237 512951423 /nfs/dbraw/zinc/95/14/23/512951423.db2.gz NNIBHMPPZRTSJT-PBHICJAKSA-N 1 1 368.437 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1F ZINC000412143287 512976122 /nfs/dbraw/zinc/97/61/22/512976122.db2.gz IQYINYLEOBGSEW-CYBMUJFWSA-N 1 1 367.421 2.618 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000412192647 512992645 /nfs/dbraw/zinc/99/26/45/512992645.db2.gz KMIKDVQIROZJOE-JKSUJKDBSA-N 1 1 361.442 2.938 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370588032 513006242 /nfs/dbraw/zinc/00/62/42/513006242.db2.gz KCAXEJVISHCLRE-QAPCUYQASA-N 1 1 352.394 2.746 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000433695932 513129845 /nfs/dbraw/zinc/12/98/45/513129845.db2.gz ZQABFBNXWURVLL-CYBMUJFWSA-N 1 1 371.441 2.618 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000439693476 513165537 /nfs/dbraw/zinc/16/55/37/513165537.db2.gz SUACFPDALWBNGS-CYBMUJFWSA-N 1 1 351.451 2.682 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000428820954 513201879 /nfs/dbraw/zinc/20/18/79/513201879.db2.gz VVDNTLSKZZOEHF-HXUWFJFHSA-N 1 1 370.405 2.920 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000429012732 513253496 /nfs/dbraw/zinc/25/34/96/513253496.db2.gz VBJJGKZGCYJVBE-KEYYUXOJSA-N 1 1 371.441 2.807 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](C)C1 ZINC000429017069 513255708 /nfs/dbraw/zinc/25/57/08/513255708.db2.gz DSFCSUUIWBDWTF-GLJUWKHASA-N 1 1 361.442 2.623 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OCc4ccccc4)n3)C[C@@H]21 ZINC000450782523 513338975 /nfs/dbraw/zinc/33/89/75/513338975.db2.gz XXQUMHGPBFMWCU-WBVHZDCISA-N 1 1 354.410 2.709 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC000425002096 513363174 /nfs/dbraw/zinc/36/31/74/513363174.db2.gz FPBOKUPDEZHOFZ-AZUAARDMSA-N 1 1 365.433 2.870 20 5 FFBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434622515 513370698 /nfs/dbraw/zinc/37/06/98/513370698.db2.gz FLGCVAHFCWFMNS-SJORKVTESA-N 1 1 350.394 2.620 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000418103850 513373588 /nfs/dbraw/zinc/37/35/88/513373588.db2.gz JQNWRFLYYKRYDL-INIZCTEOSA-N 1 1 372.377 2.508 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421706464 513377980 /nfs/dbraw/zinc/37/79/80/513377980.db2.gz VAFCEZVPIHTTNZ-ZDUSSCGKSA-N 1 1 355.822 2.570 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CCN2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697013 513395474 /nfs/dbraw/zinc/39/54/74/513395474.db2.gz KLBSTWUOKUTIOQ-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO CCOc1cc(CN(C)CC[N@@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697013 513395485 /nfs/dbraw/zinc/39/54/85/513395485.db2.gz KLBSTWUOKUTIOQ-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO CCOc1cc(CN(C)CC[N@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697013 513395488 /nfs/dbraw/zinc/39/54/88/513395488.db2.gz KLBSTWUOKUTIOQ-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ncc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000413057953 513414034 /nfs/dbraw/zinc/41/40/34/513414034.db2.gz HHHNJMIMXHFFQX-UHFFFAOYSA-N 1 1 373.432 2.879 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194868 513510497 /nfs/dbraw/zinc/51/04/97/513510497.db2.gz JTKFSDLXOZZRIG-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194868 513510505 /nfs/dbraw/zinc/51/05/05/513510505.db2.gz JTKFSDLXOZZRIG-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1[N+](=O)[O-] ZINC000430086296 513548101 /nfs/dbraw/zinc/54/81/01/513548101.db2.gz DEYRRRAPOLIKOJ-ZBFHGGJFSA-N 1 1 370.352 2.624 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1[N+](=O)[O-] ZINC000430086296 513548106 /nfs/dbraw/zinc/54/81/06/513548106.db2.gz DEYRRRAPOLIKOJ-ZBFHGGJFSA-N 1 1 370.352 2.624 20 5 FFBDMO Cc1ccccc1CC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451165540 513563212 /nfs/dbraw/zinc/56/32/12/513563212.db2.gz DNBVHNFOXXYWDB-UHFFFAOYSA-N 1 1 353.422 2.967 20 5 FFBDMO Cc1ccccc1CC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451165540 513563214 /nfs/dbraw/zinc/56/32/14/513563214.db2.gz DNBVHNFOXXYWDB-UHFFFAOYSA-N 1 1 353.422 2.967 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000430142820 513566686 /nfs/dbraw/zinc/56/66/86/513566686.db2.gz AORRNRMGNXXOHQ-SQWLQELKSA-N 1 1 363.458 2.774 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000425483967 513591199 /nfs/dbraw/zinc/59/11/99/513591199.db2.gz RTDOCIUMFQVQQF-ZDUSSCGKSA-N 1 1 359.220 2.595 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000425483967 513591207 /nfs/dbraw/zinc/59/12/07/513591207.db2.gz RTDOCIUMFQVQQF-ZDUSSCGKSA-N 1 1 359.220 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@H]3O)n2)cc1 ZINC000451426682 513743616 /nfs/dbraw/zinc/74/36/16/513743616.db2.gz VWTLGOUEYAYGRX-BZUAXINKSA-N 1 1 358.398 2.770 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000451429463 513745749 /nfs/dbraw/zinc/74/57/49/513745749.db2.gz XJFUIENKAIMNBX-INMHGKMJSA-N 1 1 350.415 2.608 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCSC[C@@H]1C1CCC1 ZINC000419375386 513791357 /nfs/dbraw/zinc/79/13/57/513791357.db2.gz QLKWRPRVJPFHIR-GOEBONIOSA-N 1 1 352.456 2.552 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@H]1C ZINC000451522735 513805942 /nfs/dbraw/zinc/80/59/42/513805942.db2.gz BRHLXPCNNKXSNP-CJNGLKHVSA-N 1 1 363.414 2.640 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@H]4C3)n2)cc1 ZINC000451693429 513915731 /nfs/dbraw/zinc/91/57/31/513915731.db2.gz IDGSTGGVZILEOE-IJEWVQPXSA-N 1 1 358.398 2.628 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCCc3ccccc3CC2)cc1 ZINC000451708769 513928933 /nfs/dbraw/zinc/92/89/33/513928933.db2.gz IRJXQJVEAVEFNK-UHFFFAOYSA-N 1 1 374.462 2.859 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCCc3ccccc3CC2)cc1 ZINC000451708769 513928937 /nfs/dbraw/zinc/92/89/37/513928937.db2.gz IRJXQJVEAVEFNK-UHFFFAOYSA-N 1 1 374.462 2.859 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346336 514199593 /nfs/dbraw/zinc/19/95/93/514199593.db2.gz UZUWWNDFQXUMFA-KBPBESRZSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346336 514199601 /nfs/dbraw/zinc/19/96/01/514199601.db2.gz UZUWWNDFQXUMFA-KBPBESRZSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346336 514199604 /nfs/dbraw/zinc/19/96/04/514199604.db2.gz UZUWWNDFQXUMFA-KBPBESRZSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346336 514199611 /nfs/dbraw/zinc/19/96/11/514199611.db2.gz UZUWWNDFQXUMFA-KBPBESRZSA-N 1 1 371.441 2.615 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000420629142 514206780 /nfs/dbraw/zinc/20/67/80/514206780.db2.gz QSYQQTADAVEQGV-UHFFFAOYSA-N 1 1 361.490 2.603 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(c3nc(C)cc(C)c3[N+](=O)[O-])CC2)CC1 ZINC000420629142 514206787 /nfs/dbraw/zinc/20/67/87/514206787.db2.gz QSYQQTADAVEQGV-UHFFFAOYSA-N 1 1 361.490 2.603 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]1Cc1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000437832234 514245905 /nfs/dbraw/zinc/24/59/05/514245905.db2.gz FJWCKDFVSCOINT-QGZVFWFLSA-N 1 1 351.406 2.801 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]1Cc1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000437832234 514245911 /nfs/dbraw/zinc/24/59/11/514245911.db2.gz FJWCKDFVSCOINT-QGZVFWFLSA-N 1 1 351.406 2.801 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C[C@@H]3CCCO3)[C@H]3CCSC3)nc2c1 ZINC000444664107 514287026 /nfs/dbraw/zinc/28/70/26/514287026.db2.gz PYDVNIYIGHQZCV-KBPBESRZSA-N 1 1 362.455 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C[C@@H]3CCCO3)[C@H]3CCSC3)nc2c1 ZINC000444664107 514287031 /nfs/dbraw/zinc/28/70/31/514287031.db2.gz PYDVNIYIGHQZCV-KBPBESRZSA-N 1 1 362.455 2.958 20 5 FFBDMO C[C@@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000417315658 514290294 /nfs/dbraw/zinc/29/02/94/514290294.db2.gz SQQYJHKYNACWGX-OXJNMPFZSA-N 1 1 360.502 2.835 20 5 FFBDMO C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677697 514298300 /nfs/dbraw/zinc/29/83/00/514298300.db2.gz NKYLZBUTRPWCKW-MLGOLLRUSA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677697 514298309 /nfs/dbraw/zinc/29/83/09/514298309.db2.gz NKYLZBUTRPWCKW-MLGOLLRUSA-N 1 1 363.439 2.690 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000449964770 514444963 /nfs/dbraw/zinc/44/49/63/514444963.db2.gz KANRDJBFLGIYGZ-INIZCTEOSA-N 1 1 361.442 2.891 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@@H](C)C1 ZINC000449990728 514455674 /nfs/dbraw/zinc/45/56/74/514455674.db2.gz XCZKLNOJLSTKLW-HOCLYGCPSA-N 1 1 371.441 2.583 20 5 FFBDMO Cn1c(C(=O)NCC2([N@@H+](C)Cc3ccccc3)CCC2)ccc1[N+](=O)[O-] ZINC000452724052 514475764 /nfs/dbraw/zinc/47/57/64/514475764.db2.gz XNMUCRWDSPKHKJ-UHFFFAOYSA-N 1 1 356.426 2.718 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@H](C)C[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462013 514480043 /nfs/dbraw/zinc/48/00/43/514480043.db2.gz PNVASOYCUOYZHE-YVEFUNNKSA-N 1 1 373.409 2.949 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](C)C[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462013 514480049 /nfs/dbraw/zinc/48/00/49/514480049.db2.gz PNVASOYCUOYZHE-YVEFUNNKSA-N 1 1 373.409 2.949 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000479493772 514605399 /nfs/dbraw/zinc/60/53/99/514605399.db2.gz BJFAOKJUNQVWCE-KRWDZBQOSA-N 1 1 360.435 2.851 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000458227434 514644299 /nfs/dbraw/zinc/64/42/99/514644299.db2.gz UECDUAWCRXQCMG-CYBMUJFWSA-N 1 1 351.422 2.860 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000461619485 514671394 /nfs/dbraw/zinc/67/13/94/514671394.db2.gz RKRNHUAPUBYZMP-CQSZACIVSA-N 1 1 374.441 2.758 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(S(C)(=O)=O)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000502549972 514689767 /nfs/dbraw/zinc/68/97/67/514689767.db2.gz FKQRMUSGJAHLQW-LLVKDONJSA-N 1 1 352.387 2.988 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000502711812 514750070 /nfs/dbraw/zinc/75/00/70/514750070.db2.gz MIJZIHRUXOYSDH-OAHLLOKOSA-N 1 1 369.487 2.836 20 5 FFBDMO CN(CC(=O)N1CC[N@@H+](C)CC12CCCCC2)c1ccccc1[N+](=O)[O-] ZINC000480043405 514821130 /nfs/dbraw/zinc/82/11/30/514821130.db2.gz NPZGBPMZLYYERT-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC000484884020 514829420 /nfs/dbraw/zinc/82/94/20/514829420.db2.gz MFKGSIKYFNHTIO-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(CNC(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000480071679 514831575 /nfs/dbraw/zinc/83/15/75/514831575.db2.gz WOCQDLSBYBNESL-INIZCTEOSA-N 1 1 360.458 2.777 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C)C1 ZINC000484893146 514832922 /nfs/dbraw/zinc/83/29/22/514832922.db2.gz HBGKDZTTYAIKRQ-ZBFHGGJFSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C)C1 ZINC000484893146 514832932 /nfs/dbraw/zinc/83/29/32/514832932.db2.gz HBGKDZTTYAIKRQ-ZBFHGGJFSA-N 1 1 370.471 2.506 20 5 FFBDMO COc1c(C(=O)NC2CCN(c3cccc(C)[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000476066746 514905165 /nfs/dbraw/zinc/90/51/65/514905165.db2.gz YQAKLZNTLLSJGI-UHFFFAOYSA-N 1 1 370.409 2.706 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000485148574 514936786 /nfs/dbraw/zinc/93/67/86/514936786.db2.gz FBIPPBIWZKPDRM-GFCCVEGCSA-N 1 1 369.263 2.920 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@@H]1C ZINC000498555473 514967888 /nfs/dbraw/zinc/96/78/88/514967888.db2.gz QTCVJEMRQKOVCQ-JKSUJKDBSA-N 1 1 374.485 2.752 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000498566549 514971960 /nfs/dbraw/zinc/97/19/60/514971960.db2.gz LIQZVJFBCGBESP-FRRDWIJNSA-N 1 1 369.849 2.957 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490085390 515097161 /nfs/dbraw/zinc/09/71/61/515097161.db2.gz ZQERWOZQKMZJFZ-OAHLLOKOSA-N 1 1 359.430 2.839 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C[C@H]1C ZINC000480985835 515163102 /nfs/dbraw/zinc/16/31/02/515163102.db2.gz WEWGXMOYPHHDIX-UKRRQHHQSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1noc([C@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000499005974 515163115 /nfs/dbraw/zinc/16/31/15/515163115.db2.gz NRSFJHMZBWRPFG-AWEZNQCLSA-N 1 1 369.381 2.973 20 5 FFBDMO CNc1c(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000462778345 515238638 /nfs/dbraw/zinc/23/86/38/515238638.db2.gz NVUQPAAYPOZQJL-UHFFFAOYSA-N 1 1 360.389 2.637 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000509638082 515266549 /nfs/dbraw/zinc/26/65/49/515266549.db2.gz BGKJWXXFFZREBG-WOPDTQHZSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C ZINC000509638082 515266557 /nfs/dbraw/zinc/26/65/57/515266557.db2.gz BGKJWXXFFZREBG-WOPDTQHZSA-N 1 1 355.822 2.567 20 5 FFBDMO CCN(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000472440708 515271748 /nfs/dbraw/zinc/27/17/48/515271748.db2.gz RXUJBCSFGWFXKA-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000472440708 515271756 /nfs/dbraw/zinc/27/17/56/515271756.db2.gz RXUJBCSFGWFXKA-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000472440708 515271764 /nfs/dbraw/zinc/27/17/64/515271764.db2.gz RXUJBCSFGWFXKA-FUHWJXTLSA-N 1 1 357.458 2.949 20 5 FFBDMO CC(C)(C)C1=CC[N@H+](CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000477119041 515336794 /nfs/dbraw/zinc/33/67/94/515336794.db2.gz LMGFDNLLDKMXDK-UHFFFAOYSA-N 1 1 367.471 2.551 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000477119041 515336801 /nfs/dbraw/zinc/33/68/01/515336801.db2.gz LMGFDNLLDKMXDK-UHFFFAOYSA-N 1 1 367.471 2.551 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000481475772 515340332 /nfs/dbraw/zinc/34/03/32/515340332.db2.gz SJVLMKPRKKGFSN-HNNXBMFYSA-N 1 1 353.422 2.966 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000481475772 515340342 /nfs/dbraw/zinc/34/03/42/515340342.db2.gz SJVLMKPRKKGFSN-HNNXBMFYSA-N 1 1 353.422 2.966 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000486269621 515410078 /nfs/dbraw/zinc/41/00/78/515410078.db2.gz NAVSUVJIOIHQLH-CYBMUJFWSA-N 1 1 368.865 2.822 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713380 515435511 /nfs/dbraw/zinc/43/55/11/515435511.db2.gz CHGBPTXREABMAM-UONOGXRCSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713380 515435522 /nfs/dbraw/zinc/43/55/22/515435522.db2.gz CHGBPTXREABMAM-UONOGXRCSA-N 1 1 356.806 2.791 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468626819 515442883 /nfs/dbraw/zinc/44/28/83/515442883.db2.gz JKVLOQNSLDDQLW-WQJNHMDYSA-N 1 1 360.502 2.861 20 5 FFBDMO C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000492175428 515510531 /nfs/dbraw/zinc/51/05/31/515510531.db2.gz JGDXMRNZDPNPHQ-AWEZNQCLSA-N 1 1 366.893 2.849 20 5 FFBDMO C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000492175428 515510539 /nfs/dbraw/zinc/51/05/39/515510539.db2.gz JGDXMRNZDPNPHQ-AWEZNQCLSA-N 1 1 366.893 2.849 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871924 515571019 /nfs/dbraw/zinc/57/10/19/515571019.db2.gz JYTYAIRHGOPEFE-HUUCEWRRSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871924 515571027 /nfs/dbraw/zinc/57/10/27/515571027.db2.gz JYTYAIRHGOPEFE-HUUCEWRRSA-N 1 1 366.414 2.536 20 5 FFBDMO NC(=O)c1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cn1 ZINC000493148519 515602572 /nfs/dbraw/zinc/60/25/72/515602572.db2.gz MNXCOMUJWCEIAJ-IBGZPJMESA-N 1 1 362.389 2.968 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000457083581 515635693 /nfs/dbraw/zinc/63/56/93/515635693.db2.gz FNWVPDHPZLJSIU-ZDUSSCGKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000463843283 515637254 /nfs/dbraw/zinc/63/72/54/515637254.db2.gz CKMNNFOKMRMJFS-INIZCTEOSA-N 1 1 370.453 2.668 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@H]21 ZINC000493507336 515638629 /nfs/dbraw/zinc/63/86/29/515638629.db2.gz UQEMXWJKXGWXAU-YWPYICTPSA-N 1 1 367.833 2.568 20 5 FFBDMO C[C@@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc2c(s1)CCC2 ZINC000459628890 515707326 /nfs/dbraw/zinc/70/73/26/515707326.db2.gz FSRPAVUZJXUBGZ-ABAIWWIYSA-N 1 1 372.450 2.996 20 5 FFBDMO CNc1nc(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000454752206 515716859 /nfs/dbraw/zinc/71/68/59/515716859.db2.gz LJALXEXUFVBAAF-OKILXGFUSA-N 1 1 363.462 2.519 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)c(F)c1 ZINC000478387040 515802637 /nfs/dbraw/zinc/80/26/37/515802637.db2.gz QXFLKTQZQMAGTI-YLJYHZDGSA-N 1 1 373.428 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)c(F)c1 ZINC000478387040 515802641 /nfs/dbraw/zinc/80/26/41/515802641.db2.gz QXFLKTQZQMAGTI-YLJYHZDGSA-N 1 1 373.428 2.707 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459807574 515819527 /nfs/dbraw/zinc/81/95/27/515819527.db2.gz RENCNBLVZBADBZ-QIIPPGSGSA-N 1 1 361.442 2.795 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459807574 515819539 /nfs/dbraw/zinc/81/95/39/515819539.db2.gz RENCNBLVZBADBZ-QIIPPGSGSA-N 1 1 361.442 2.795 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H]2COC[C@@H]2OC)cc1OC ZINC000459825762 515831302 /nfs/dbraw/zinc/83/13/02/515831302.db2.gz LNDCYSDTRLFXAP-WRSAYESZSA-N 1 1 368.430 2.532 20 5 FFBDMO CNc1nc(C(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000454958053 515857547 /nfs/dbraw/zinc/85/75/47/515857547.db2.gz VHHNTFBPTUDSBS-ZFWWWQNUSA-N 1 1 369.425 2.597 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cnccc1C ZINC000482980023 515870301 /nfs/dbraw/zinc/87/03/01/515870301.db2.gz JEINGSKISLVYON-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000474168363 515914464 /nfs/dbraw/zinc/91/44/64/515914464.db2.gz JPHKWWLBTNWWOC-LJQANCHMSA-N 1 1 355.442 2.821 20 5 FFBDMO COC1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCCCC1 ZINC000483284585 516018981 /nfs/dbraw/zinc/01/89/81/516018981.db2.gz VFFLFCMSBVIWQM-UHFFFAOYSA-N 1 1 367.471 2.763 20 5 FFBDMO C[C@H](CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000487895219 516023082 /nfs/dbraw/zinc/02/30/82/516023082.db2.gz JXRWGBTUAAIPBI-LLVKDONJSA-N 1 1 354.838 2.573 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000501234354 516024951 /nfs/dbraw/zinc/02/49/51/516024951.db2.gz OJGRFUAPHZESPR-ZBFHGGJFSA-N 1 1 354.410 2.864 20 5 FFBDMO CC[C@@H]1C(=O)N(CC)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000495226551 516109543 /nfs/dbraw/zinc/10/95/43/516109543.db2.gz DBXSCZYJRBQXDO-MRXNPFEDSA-N 1 1 372.425 2.735 20 5 FFBDMO CC[C@@H]1C(=O)N(CC)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000495226551 516109554 /nfs/dbraw/zinc/10/95/54/516109554.db2.gz DBXSCZYJRBQXDO-MRXNPFEDSA-N 1 1 372.425 2.735 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])n2C)cc1 ZINC000465468694 516163136 /nfs/dbraw/zinc/16/31/36/516163136.db2.gz RQJVRWBKTCACDZ-LBPRGKRZSA-N 1 1 353.382 2.918 20 5 FFBDMO C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507299785 516164736 /nfs/dbraw/zinc/16/47/36/516164736.db2.gz CPRIAQAMVYEQOH-UHFFFAOYSA-N 1 1 361.373 2.644 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000470281309 516193179 /nfs/dbraw/zinc/19/31/79/516193179.db2.gz WQYGXOFXRRLGME-UHFFFAOYSA-N 1 1 358.442 2.857 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000465603955 516208518 /nfs/dbraw/zinc/20/85/18/516208518.db2.gz PWWCXPCRJIYKBX-INIZCTEOSA-N 1 1 362.474 2.949 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000470352897 516216641 /nfs/dbraw/zinc/21/66/41/516216641.db2.gz FVUMLMAPKBLBAV-NSHDSACASA-N 1 1 363.805 2.507 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000465744991 516246624 /nfs/dbraw/zinc/24/66/24/516246624.db2.gz DJFOUJPOMQMDGX-HNNXBMFYSA-N 1 1 362.474 2.947 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488714509 516292128 /nfs/dbraw/zinc/29/21/28/516292128.db2.gz NCEXXZOOIOFYEJ-GLJUWKHASA-N 1 1 372.469 2.654 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CCc3cccs3)CC2)c1 ZINC000460969316 516294145 /nfs/dbraw/zinc/29/41/45/516294145.db2.gz MIZHEXYSFIFAGH-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO CC(C)c1ccc(C[C@H]2CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000460984257 516297162 /nfs/dbraw/zinc/29/71/62/516297162.db2.gz VNBDAOQICXQLJM-XLIONFOSSA-N 1 1 372.469 2.840 20 5 FFBDMO Cc1nc(N[C@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599569 516546928 /nfs/dbraw/zinc/54/69/28/516546928.db2.gz WVXZVIZQGXZJDT-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1nc(N[C@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599569 516546939 /nfs/dbraw/zinc/54/69/39/516546939.db2.gz WVXZVIZQGXZJDT-CRAIPNDOSA-N 1 1 356.426 3.000 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cn1 ZINC000531627418 516562454 /nfs/dbraw/zinc/56/24/54/516562454.db2.gz IIJMAXDTBALTIW-INIZCTEOSA-N 1 1 354.410 2.774 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NCc1ccccc1 ZINC000540479726 516575110 /nfs/dbraw/zinc/57/51/10/516575110.db2.gz WIGXQUITRVIYAQ-UONOGXRCSA-N 1 1 370.409 2.660 20 5 FFBDMO Cc1nn(C)c(C)c1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000513656352 516708745 /nfs/dbraw/zinc/70/87/45/516708745.db2.gz RLPYANQEXKJCAU-SFHVURJKSA-N 1 1 368.441 2.600 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000513673360 516715643 /nfs/dbraw/zinc/71/56/43/516715643.db2.gz PUOKRVARJQLPHZ-SFHVURJKSA-N 1 1 352.394 2.956 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(CC)CC ZINC000536426734 516758468 /nfs/dbraw/zinc/75/84/68/516758468.db2.gz OYUBRDZAQUSDQY-HOTGVXAUSA-N 1 1 351.447 2.672 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(CC)CC ZINC000536426737 516759725 /nfs/dbraw/zinc/75/97/25/516759725.db2.gz OYUBRDZAQUSDQY-JKSUJKDBSA-N 1 1 351.447 2.672 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000532144074 516823662 /nfs/dbraw/zinc/82/36/62/516823662.db2.gz SWHYDEPFIHBCKT-CQSZACIVSA-N 1 1 370.409 2.963 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000544626675 516844335 /nfs/dbraw/zinc/84/43/35/516844335.db2.gz RFPWCSMGKCVKDI-UHFFFAOYSA-N 1 1 358.373 2.914 20 5 FFBDMO CCc1ccc([C@H](CO)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000514076547 516852213 /nfs/dbraw/zinc/85/22/13/516852213.db2.gz ZWHWGFVBWWXOFQ-SFHVURJKSA-N 1 1 358.394 2.847 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000544655990 516856580 /nfs/dbraw/zinc/85/65/80/516856580.db2.gz VGEJWRDABHVNSO-DZGCQCFKSA-N 1 1 369.487 2.705 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000551791799 516872445 /nfs/dbraw/zinc/87/24/45/516872445.db2.gz UTWIDAIRUGDGRJ-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000551791799 516872452 /nfs/dbraw/zinc/87/24/52/516872452.db2.gz UTWIDAIRUGDGRJ-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO CCOC(=O)Cn1nc(C)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1C ZINC000555341338 516891038 /nfs/dbraw/zinc/89/10/38/516891038.db2.gz ACVXPXTUSHVIKZ-UHFFFAOYSA-N 1 1 374.441 2.646 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514225791 516912804 /nfs/dbraw/zinc/91/28/04/516912804.db2.gz DTPAVOAUVFGVIT-SNVBAGLBSA-N 1 1 368.340 2.767 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000514696845 517010351 /nfs/dbraw/zinc/01/03/51/517010351.db2.gz LFCIQQSHVPZGKJ-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)O1 ZINC000548508507 517024247 /nfs/dbraw/zinc/02/42/47/517024247.db2.gz JHNDNOVRXYFPCX-IJEWVQPXSA-N 1 1 373.457 2.545 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@@H+](C)C(C)(C)C1 ZINC000519543762 517035984 /nfs/dbraw/zinc/03/59/84/517035984.db2.gz HIIXASNHEHAPFC-NSHDSACASA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525466492 517051142 /nfs/dbraw/zinc/05/11/42/517051142.db2.gz ZYJSMZVFMJIZIX-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525466492 517051152 /nfs/dbraw/zinc/05/11/52/517051152.db2.gz ZYJSMZVFMJIZIX-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525466490 517051614 /nfs/dbraw/zinc/05/16/14/517051614.db2.gz ZYJSMZVFMJIZIX-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525466490 517051621 /nfs/dbraw/zinc/05/16/21/517051621.db2.gz ZYJSMZVFMJIZIX-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCN(C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000552068739 517062880 /nfs/dbraw/zinc/06/28/80/517062880.db2.gz JPSKPWIXDSRUOZ-OAHLLOKOSA-N 1 1 359.382 2.526 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCN(C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000552068739 517062887 /nfs/dbraw/zinc/06/28/87/517062887.db2.gz JPSKPWIXDSRUOZ-OAHLLOKOSA-N 1 1 359.382 2.526 20 5 FFBDMO COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000537170760 517065952 /nfs/dbraw/zinc/06/59/52/517065952.db2.gz UKJMYDXVDOISKR-ZDUSSCGKSA-N 1 1 367.471 2.546 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000525544408 517071269 /nfs/dbraw/zinc/07/12/69/517071269.db2.gz BZUZIZVFVOFGNC-OBJOEFQTSA-N 1 1 369.849 2.957 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000532717191 517110911 /nfs/dbraw/zinc/11/09/11/517110911.db2.gz ALJYFWKPSHFJAV-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000532717191 517110923 /nfs/dbraw/zinc/11/09/23/517110923.db2.gz ALJYFWKPSHFJAV-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)CCC[N@@H+](C)Cc1ccco1 ZINC000552268252 517170228 /nfs/dbraw/zinc/17/02/28/517170228.db2.gz BSANPOWASLNALS-UHFFFAOYSA-N 1 1 374.441 2.889 20 5 FFBDMO Cc1ccc(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000552269775 517171715 /nfs/dbraw/zinc/17/17/15/517171715.db2.gz QBGUZGHDFDNYRV-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO Cc1ccc(-c2noc([C@@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)cc1F ZINC000541685987 517172595 /nfs/dbraw/zinc/17/25/95/517172595.db2.gz CLYNMWMGBPLFIU-LLVKDONJSA-N 1 1 360.349 2.640 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2NCc1c[nH+]c2n1CCCC2 ZINC000562536398 517175059 /nfs/dbraw/zinc/17/50/59/517175059.db2.gz CMKRTIWOXIGXHD-UHFFFAOYSA-N 1 1 353.382 2.718 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000545365088 517200648 /nfs/dbraw/zinc/20/06/48/517200648.db2.gz GNTPLBJQRRSANL-MRXNPFEDSA-N 1 1 369.487 2.525 20 5 FFBDMO CC(C)C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)[NH+]1CCOCC1 ZINC000541785713 517215741 /nfs/dbraw/zinc/21/57/41/517215741.db2.gz FPXCBXQMJIAVQD-CQSZACIVSA-N 1 1 368.409 2.602 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000537616435 517261903 /nfs/dbraw/zinc/26/19/03/517261903.db2.gz PRFOSDVTSNRKQV-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCS(=O)(=O)C1 ZINC000537616435 517261913 /nfs/dbraw/zinc/26/19/13/517261913.db2.gz PRFOSDVTSNRKQV-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO Cc1c(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cnn1C ZINC000556106098 517270402 /nfs/dbraw/zinc/27/04/02/517270402.db2.gz HJWWSDBHKCFRLQ-UHFFFAOYSA-N 1 1 354.414 2.669 20 5 FFBDMO Cc1c(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cnn1C ZINC000556106098 517270411 /nfs/dbraw/zinc/27/04/11/517270411.db2.gz HJWWSDBHKCFRLQ-UHFFFAOYSA-N 1 1 354.414 2.669 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@@H+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C2 ZINC000537635333 517272705 /nfs/dbraw/zinc/27/27/05/517272705.db2.gz NRUJZJVYSQVRLS-SFHVURJKSA-N 1 1 372.450 2.820 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@H+](Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)C2 ZINC000537635333 517272716 /nfs/dbraw/zinc/27/27/16/517272716.db2.gz NRUJZJVYSQVRLS-SFHVURJKSA-N 1 1 372.450 2.820 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000537810963 517354626 /nfs/dbraw/zinc/35/46/26/517354626.db2.gz MMKVRHYBZGJQMQ-WDEREUQCSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000537810963 517354634 /nfs/dbraw/zinc/35/46/34/517354634.db2.gz MMKVRHYBZGJQMQ-WDEREUQCSA-N 1 1 370.247 2.830 20 5 FFBDMO O=C(C[NH2+]C1(c2ccc(F)cc2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000533390660 517438146 /nfs/dbraw/zinc/43/81/46/517438146.db2.gz PBTIDYTUTGYSKD-UHFFFAOYSA-N 1 1 373.340 2.680 20 5 FFBDMO NC(=O)c1cccc(NCCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000552973386 517460595 /nfs/dbraw/zinc/46/05/95/517460595.db2.gz VKJHDVYWZSLONS-UHFFFAOYSA-N 1 1 354.410 2.554 20 5 FFBDMO CC(C)(C)c1cn2c([nH+]1)CC[C@@H](Nc1cccc(C(N)=O)c1[N+](=O)[O-])C2 ZINC000552998284 517472556 /nfs/dbraw/zinc/47/25/56/517472556.db2.gz ZPKAYXDBNYKSOB-LLVKDONJSA-N 1 1 357.414 2.615 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2n[nH]cc2Br)n1 ZINC000520720106 517489096 /nfs/dbraw/zinc/48/90/96/517489096.db2.gz NEJCNZKZSDWYNK-ZYHUDNBSSA-N 1 1 369.223 2.550 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2CC(O)C2)cc1OC ZINC000546095202 517541353 /nfs/dbraw/zinc/54/13/53/517541353.db2.gz WIKGWICGXOCRDD-GRTSSRMGSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CC(O)C2)cc1OC ZINC000546095202 517541362 /nfs/dbraw/zinc/54/13/62/517541362.db2.gz WIKGWICGXOCRDD-GRTSSRMGSA-N 1 1 352.431 2.983 20 5 FFBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000521290155 517682795 /nfs/dbraw/zinc/68/27/95/517682795.db2.gz WYLSTOGFSTTXOC-DOTOQJQBSA-N 1 1 368.437 2.956 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000542852640 517782748 /nfs/dbraw/zinc/78/27/48/517782748.db2.gz OBYWXDDGLPDZIY-MWLCHTKSSA-N 1 1 355.341 2.551 20 5 FFBDMO CCOc1cc(N2CCN(c3cc(C)[nH+]c(CC)n3)CC2)ccc1[N+](=O)[O-] ZINC000553559389 517782879 /nfs/dbraw/zinc/78/28/79/517782879.db2.gz LBOHFXAJWWSLOR-UHFFFAOYSA-N 1 1 371.441 2.981 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@H](NC(N)=O)C2)cc1[N+](=O)[O-] ZINC000538796723 517784281 /nfs/dbraw/zinc/78/42/81/517784281.db2.gz RFXAKKSANCZZTQ-HNNXBMFYSA-N 1 1 369.425 2.605 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](NC(N)=O)C2)cc1[N+](=O)[O-] ZINC000538796723 517784286 /nfs/dbraw/zinc/78/42/86/517784286.db2.gz RFXAKKSANCZZTQ-HNNXBMFYSA-N 1 1 369.425 2.605 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](NC(N)=O)C2)cc1[N+](=O)[O-] ZINC000538796724 517784372 /nfs/dbraw/zinc/78/43/72/517784372.db2.gz RFXAKKSANCZZTQ-OAHLLOKOSA-N 1 1 369.425 2.605 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](NC(N)=O)C2)cc1[N+](=O)[O-] ZINC000538796724 517784377 /nfs/dbraw/zinc/78/43/77/517784377.db2.gz RFXAKKSANCZZTQ-OAHLLOKOSA-N 1 1 369.425 2.605 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@H]1C ZINC000542889140 517800944 /nfs/dbraw/zinc/80/09/44/517800944.db2.gz OPHFZPWGFABZEV-GHMZBOCLSA-N 1 1 357.357 2.751 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCNc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000560524465 517870685 /nfs/dbraw/zinc/87/06/85/517870685.db2.gz BJLDVTUZXCYKPB-GOSISDBHSA-N 1 1 366.425 2.905 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3ccc([N+](=O)[O-])c(OC(C)C)n3)CC2)c1 ZINC000563428666 517900484 /nfs/dbraw/zinc/90/04/84/517900484.db2.gz ZYPQWELWSYIHRO-UHFFFAOYSA-N 1 1 357.414 2.807 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000557526747 518056297 /nfs/dbraw/zinc/05/62/97/518056297.db2.gz KKZJTLCLUCQWAL-NSHDSACASA-N 1 1 357.863 2.893 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000557526747 518056307 /nfs/dbraw/zinc/05/63/07/518056307.db2.gz KKZJTLCLUCQWAL-NSHDSACASA-N 1 1 357.863 2.893 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000584562101 518398096 /nfs/dbraw/zinc/39/80/96/518398096.db2.gz RKNSBGCRMIRDJD-HOTGVXAUSA-N 1 1 354.410 2.517 20 5 FFBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000584869447 518516779 /nfs/dbraw/zinc/51/67/79/518516779.db2.gz HVSACGIIUOEUJR-OIISXLGYSA-N 1 1 361.442 2.719 20 5 FFBDMO COCC[N@@H+]1CCC[C@H]1CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483366 518703898 /nfs/dbraw/zinc/70/38/98/518703898.db2.gz MTSIFRQFFIEUEC-GJZGRUSLSA-N 1 1 361.364 2.899 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483366 518703902 /nfs/dbraw/zinc/70/39/02/518703902.db2.gz MTSIFRQFFIEUEC-GJZGRUSLSA-N 1 1 361.364 2.899 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000570868011 518817872 /nfs/dbraw/zinc/81/78/72/518817872.db2.gz NFVFNFAOSSZTCP-CYBMUJFWSA-N 1 1 352.435 2.523 20 5 FFBDMO CN(C(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000571050107 518903871 /nfs/dbraw/zinc/90/38/71/518903871.db2.gz MZBVJIOPADZGGS-OAHLLOKOSA-N 1 1 354.410 2.524 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000580056081 518985261 /nfs/dbraw/zinc/98/52/61/518985261.db2.gz QNOGEVNOEVRCHB-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000580056081 518985265 /nfs/dbraw/zinc/98/52/65/518985265.db2.gz QNOGEVNOEVRCHB-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000589634572 519049444 /nfs/dbraw/zinc/04/94/44/519049444.db2.gz HBZHWONMHYAJBG-LSDHHAIUSA-N 1 1 371.441 2.545 20 5 FFBDMO COc1ccc(-c2ccc(CN3CC[C@H]4C[N@@H+](C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052744 519137487 /nfs/dbraw/zinc/13/74/87/519137487.db2.gz KENXLDSQUBEHBK-UGSOOPFHSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@H]4CN(C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052744 519137493 /nfs/dbraw/zinc/13/74/93/519137493.db2.gz KENXLDSQUBEHBK-UGSOOPFHSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H]4CN(C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052744 519137502 /nfs/dbraw/zinc/13/75/02/519137502.db2.gz KENXLDSQUBEHBK-UGSOOPFHSA-N 1 1 357.410 2.999 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000590582897 519274079 /nfs/dbraw/zinc/27/40/79/519274079.db2.gz WDWXPXBNLYVCQQ-GWCFXTLKSA-N 1 1 353.806 2.565 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)nc1 ZINC000590754695 519352367 /nfs/dbraw/zinc/35/23/67/519352367.db2.gz OUHOVMCRJHXYCA-UHFFFAOYSA-N 1 1 356.382 2.728 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1ccc(C)cn1 ZINC000590754976 519353455 /nfs/dbraw/zinc/35/34/55/519353455.db2.gz XLPAOOLMEGYHCA-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@@H]2C)cc1OC ZINC000590759196 519354958 /nfs/dbraw/zinc/35/49/58/519354958.db2.gz WIQXFXLIXQKYTB-DVOMOZLQSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@@H]2C)cc1OC ZINC000590759196 519354962 /nfs/dbraw/zinc/35/49/62/519354962.db2.gz WIQXFXLIXQKYTB-DVOMOZLQSA-N 1 1 352.431 2.983 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000574946929 519416229 /nfs/dbraw/zinc/41/62/29/519416229.db2.gz GHACBOHOZRWEFN-AWEZNQCLSA-N 1 1 364.446 2.780 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238689 519450284 /nfs/dbraw/zinc/45/02/84/519450284.db2.gz PIIWAZPZXFFRSC-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238689 519450296 /nfs/dbraw/zinc/45/02/96/519450296.db2.gz PIIWAZPZXFFRSC-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCOC[C@H]2CC2CCC2)c([N+](=O)[O-])c1 ZINC000583825715 519454092 /nfs/dbraw/zinc/45/40/92/519454092.db2.gz AFLUFMAPYVJFQY-OAHLLOKOSA-N 1 1 350.415 2.873 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOC[C@H]2CC2CCC2)c([N+](=O)[O-])c1 ZINC000583825715 519454094 /nfs/dbraw/zinc/45/40/94/519454094.db2.gz AFLUFMAPYVJFQY-OAHLLOKOSA-N 1 1 350.415 2.873 20 5 FFBDMO CO[C@@H](CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000569249009 519454934 /nfs/dbraw/zinc/45/49/34/519454934.db2.gz FXGIAPOCGGPFBA-KBPBESRZSA-N 1 1 372.347 2.975 20 5 FFBDMO CC(C)(C)c1csc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000569351220 519507533 /nfs/dbraw/zinc/50/75/33/519507533.db2.gz UJFUNYDYNWZJNV-LBPRGKRZSA-N 1 1 365.455 2.878 20 5 FFBDMO COC(=O)c1cccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000569424008 519540109 /nfs/dbraw/zinc/54/01/09/519540109.db2.gz FMHAKMFCMHJVSU-UHFFFAOYSA-N 1 1 371.393 2.820 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C(C)(C)C1 ZINC000575217686 519558913 /nfs/dbraw/zinc/55/89/13/519558913.db2.gz YNOATSKARQQFMY-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C(C)(C)C1 ZINC000575217686 519558917 /nfs/dbraw/zinc/55/89/17/519558917.db2.gz YNOATSKARQQFMY-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681533 519609909 /nfs/dbraw/zinc/60/99/09/519609909.db2.gz IISCPLDTHITDOV-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@H](C[N@H+](C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681533 519609932 /nfs/dbraw/zinc/60/99/32/519609932.db2.gz IISCPLDTHITDOV-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ccc(CN2CC[C@H](C[N@@H+](C)CCn3cc([N+](=O)[O-])cn3)C2)s1 ZINC000566681533 519609940 /nfs/dbraw/zinc/60/99/40/519609940.db2.gz IISCPLDTHITDOV-OAHLLOKOSA-N 1 1 363.487 2.615 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602881311 519945480 /nfs/dbraw/zinc/94/54/80/519945480.db2.gz GKALNNQSFROIFG-HNNXBMFYSA-N 1 1 352.398 2.532 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(Oc3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC000602946604 519987324 /nfs/dbraw/zinc/98/73/24/519987324.db2.gz MVAUXUGFGPNUOW-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594482974 519992351 /nfs/dbraw/zinc/99/23/51/519992351.db2.gz GSLZUZDGZIDMNJ-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600008111 519999506 /nfs/dbraw/zinc/99/95/06/519999506.db2.gz KZJQRCWXZILCEA-UHFFFAOYSA-N 1 1 361.442 2.539 20 5 FFBDMO COC(=O)c1cc(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)no1 ZINC000603001536 520016675 /nfs/dbraw/zinc/01/66/75/520016675.db2.gz LITCFBPNTVJDJY-UHFFFAOYSA-N 1 1 363.345 2.888 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600092837 520040801 /nfs/dbraw/zinc/04/08/01/520040801.db2.gz JTPFQBKTVXBOAF-SNVBAGLBSA-N 1 1 370.247 2.960 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1OCC(=O)NC ZINC000608781916 520125955 /nfs/dbraw/zinc/12/59/55/520125955.db2.gz DORAEWHVVNKGPJ-INIZCTEOSA-N 1 1 357.410 2.961 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000597606086 520131702 /nfs/dbraw/zinc/13/17/02/520131702.db2.gz ULSLRAGZARHXKS-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600229409 520139988 /nfs/dbraw/zinc/13/99/88/520139988.db2.gz ROFTXYCIJYHAAF-MRXNPFEDSA-N 1 1 360.458 2.920 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866657 520149611 /nfs/dbraw/zinc/14/96/11/520149611.db2.gz MWJJQWGJYGGQIP-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866657 520149617 /nfs/dbraw/zinc/14/96/17/520149617.db2.gz MWJJQWGJYGGQIP-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO CCc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000592138995 520214987 /nfs/dbraw/zinc/21/49/87/520214987.db2.gz UMAMMIKKXZOMQN-LJQANCHMSA-N 1 1 360.458 2.873 20 5 FFBDMO Cc1ccc(C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592146889 520224713 /nfs/dbraw/zinc/22/47/13/520224713.db2.gz VARDFTQJHRZKFF-UHFFFAOYSA-N 1 1 354.410 2.809 20 5 FFBDMO Cc1ccc(C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592146889 520224722 /nfs/dbraw/zinc/22/47/22/520224722.db2.gz VARDFTQJHRZKFF-UHFFFAOYSA-N 1 1 354.410 2.809 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000592155286 520232680 /nfs/dbraw/zinc/23/26/80/520232680.db2.gz NLCYFXADZRJBTO-OAHLLOKOSA-N 1 1 357.385 2.872 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000592155286 520232688 /nfs/dbraw/zinc/23/26/88/520232688.db2.gz NLCYFXADZRJBTO-OAHLLOKOSA-N 1 1 357.385 2.872 20 5 FFBDMO CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000603408391 520252895 /nfs/dbraw/zinc/25/28/95/520252895.db2.gz WZGXXCLGHILQDW-NWDGAFQWSA-N 1 1 363.443 2.511 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000592184600 520253213 /nfs/dbraw/zinc/25/32/13/520253213.db2.gz KVZPFVZRHKCCAJ-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000592184600 520253221 /nfs/dbraw/zinc/25/32/21/520253221.db2.gz KVZPFVZRHKCCAJ-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C(C)C)N1CCN(C)CC1 ZINC000595007479 520254400 /nfs/dbraw/zinc/25/44/00/520254400.db2.gz OEVJQLGTRDBTIL-CRAIPNDOSA-N 1 1 364.490 2.526 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000595050610 520269986 /nfs/dbraw/zinc/26/99/86/520269986.db2.gz SREDMIIONOYHMM-IAGOWNOFSA-N 1 1 357.458 2.880 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000600469790 520278533 /nfs/dbraw/zinc/27/85/33/520278533.db2.gz KFQSEJDOZJAHIA-MRXNPFEDSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000600469381 520279732 /nfs/dbraw/zinc/27/97/32/520279732.db2.gz AJYGPZUIJFJJJC-CQSZACIVSA-N 1 1 370.409 2.595 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000597858493 520287408 /nfs/dbraw/zinc/28/74/08/520287408.db2.gz MDGXNYDSTQMDQS-NSHDSACASA-N 1 1 357.357 2.799 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])s3)c2)C1 ZINC000609384201 520300053 /nfs/dbraw/zinc/30/00/53/520300053.db2.gz UYQJFMUPPOPZJA-HNNXBMFYSA-N 1 1 374.466 2.966 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000597922616 520325095 /nfs/dbraw/zinc/32/50/95/520325095.db2.gz JJOROEVSNABDLX-LBPRGKRZSA-N 1 1 370.247 2.960 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 ZINC000609560453 520358994 /nfs/dbraw/zinc/35/89/94/520358994.db2.gz YNAMLEKVRFJNPS-UHFFFAOYSA-N 1 1 359.430 2.800 20 5 FFBDMO CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598039032 520389962 /nfs/dbraw/zinc/38/99/62/520389962.db2.gz HOZKSWQBVJYHMD-GFCCVEGCSA-N 1 1 357.357 2.753 20 5 FFBDMO CNc1c(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000613234403 520402498 /nfs/dbraw/zinc/40/24/98/520402498.db2.gz HHTMCIOVMBAAKX-INIZCTEOSA-N 1 1 368.437 2.983 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598218574 520501210 /nfs/dbraw/zinc/50/12/10/520501210.db2.gz IIXIFWQNIPYJFP-HNNXBMFYSA-N 1 1 360.458 2.920 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000610003953 520503641 /nfs/dbraw/zinc/50/36/41/520503641.db2.gz SOOCSIDCGIBEKS-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO COCC[C@@H]1CCCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000613503382 520532543 /nfs/dbraw/zinc/53/25/43/520532543.db2.gz QZYJAJBHOCHWDB-YJBOKZPZSA-N 1 1 361.442 2.839 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000592752262 520558536 /nfs/dbraw/zinc/55/85/36/520558536.db2.gz CMNBARVQBNXSHH-OAHLLOKOSA-N 1 1 371.441 2.654 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000598343170 520567075 /nfs/dbraw/zinc/56/70/75/520567075.db2.gz TXAWPDLCWFZPTC-GFCCVEGCSA-N 1 1 370.247 2.500 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595584472 520570566 /nfs/dbraw/zinc/57/05/66/520570566.db2.gz GLQLXVSSJLMBIU-CQSZACIVSA-N 1 1 368.865 2.963 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604474449 520571889 /nfs/dbraw/zinc/57/18/89/520571889.db2.gz UOJJGRIHUIJPDG-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000610208563 520580186 /nfs/dbraw/zinc/58/01/86/520580186.db2.gz DQOOPSABZHCSHF-YPMHNXCESA-N 1 1 355.822 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c1 ZINC000610298511 520627592 /nfs/dbraw/zinc/62/75/92/520627592.db2.gz WYDHZXGSHSQAEN-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000610297750 520628036 /nfs/dbraw/zinc/62/80/36/520628036.db2.gz PUPUABSRTINNGV-OAHLLOKOSA-N 1 1 372.400 2.663 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000592883152 520632626 /nfs/dbraw/zinc/63/26/26/520632626.db2.gz XXUAVQBMSFKDJT-MSOLQXFVSA-N 1 1 353.422 2.599 20 5 FFBDMO Cc1nsc(N2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000601121660 520647408 /nfs/dbraw/zinc/64/74/08/520647408.db2.gz PMHAJBMYVXJJAL-UHFFFAOYSA-N 1 1 356.411 2.630 20 5 FFBDMO COc1cc2c(c(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)c1)O[C@H](C)C2 ZINC000601149304 520661465 /nfs/dbraw/zinc/66/14/65/520661465.db2.gz KSEPKZUDXDZNBM-ZUOKHONESA-N 1 1 372.421 2.924 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601149296 520661553 /nfs/dbraw/zinc/66/15/53/520661553.db2.gz JSIYJXMYUIKZCC-SNVBAGLBSA-N 1 1 368.315 2.648 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601149999 520661599 /nfs/dbraw/zinc/66/15/99/520661599.db2.gz RRNLUZOBESUSNN-DOTOQJQBSA-N 1 1 363.439 2.900 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598508863 520668879 /nfs/dbraw/zinc/66/88/79/520668879.db2.gz IVHTYAATKRFCGY-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508863 520668883 /nfs/dbraw/zinc/66/88/83/520668883.db2.gz IVHTYAATKRFCGY-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO Cn1nccc1[C@H]1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601171170 520670346 /nfs/dbraw/zinc/67/03/46/520670346.db2.gz HGZGUWHGCYJHED-KPZWWZAWSA-N 1 1 353.382 2.631 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1 ZINC000593029621 520692900 /nfs/dbraw/zinc/69/29/00/520692900.db2.gz JCWWMDIQQXQSMZ-AWEZNQCLSA-N 1 1 361.442 2.688 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598563073 520707953 /nfs/dbraw/zinc/70/79/53/520707953.db2.gz ZYKIENNTZXUVKL-MRXNPFEDSA-N 1 1 361.442 2.602 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@@H](CC)CO1 ZINC000593059996 520715095 /nfs/dbraw/zinc/71/50/95/520715095.db2.gz VAWQTONCGXKLJK-KBPBESRZSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000593059751 520715367 /nfs/dbraw/zinc/71/53/67/520715367.db2.gz TWSGEXDKMJPDQE-HIFRSBDPSA-N 1 1 363.414 2.782 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593132429 520769923 /nfs/dbraw/zinc/76/99/23/520769923.db2.gz QSDHCNMSKKMSJC-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593132429 520769927 /nfs/dbraw/zinc/76/99/27/520769927.db2.gz QSDHCNMSKKMSJC-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO CCOc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000593187406 520811540 /nfs/dbraw/zinc/81/15/40/520811540.db2.gz KCGOVPXLLHNWAQ-JHJVBQTASA-N 1 1 365.430 2.555 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910753 520815023 /nfs/dbraw/zinc/81/50/23/520815023.db2.gz RFAICJXZRABDOH-ZMYBRWDISA-N 1 1 359.426 2.814 20 5 FFBDMO O=C1[C@H]([N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595909278 520815152 /nfs/dbraw/zinc/81/51/52/520815152.db2.gz LDMOJZSHHDKQKT-RLLQIKCJSA-N 1 1 371.437 2.593 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596088645 520906067 /nfs/dbraw/zinc/90/60/67/520906067.db2.gz MUMLGSQUTRKNOV-BBRMVZONSA-N 1 1 354.410 2.941 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945210 520912528 /nfs/dbraw/zinc/91/25/28/520912528.db2.gz SQLPIECGDSEDIQ-HUUCEWRRSA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945210 520912536 /nfs/dbraw/zinc/91/25/36/520912536.db2.gz SQLPIECGDSEDIQ-HUUCEWRRSA-N 1 1 357.414 2.764 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C[N@H+]1Cc1ccccc1 ZINC000596163477 520947436 /nfs/dbraw/zinc/94/74/36/520947436.db2.gz VMFJCWQTRWNBFJ-XJKSGUPXSA-N 1 1 354.410 2.769 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000596168164 520948302 /nfs/dbraw/zinc/94/83/02/520948302.db2.gz LVELVCSLTTZFKY-NEPJUHHUSA-N 1 1 367.833 2.955 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000596177767 520953218 /nfs/dbraw/zinc/95/32/18/520953218.db2.gz GDGVQPHNUZSEPT-UHFFFAOYSA-N 1 1 352.435 2.523 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000618288439 520983591 /nfs/dbraw/zinc/98/35/91/520983591.db2.gz PURCUXIFKJLTOG-FZKQIMNGSA-N 1 1 355.442 2.920 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000611104576 520986182 /nfs/dbraw/zinc/98/61/82/520986182.db2.gz OXWYCNCHRJSWJY-OLZOCXBDSA-N 1 1 353.785 2.978 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)c(F)c1 ZINC000611104576 520986190 /nfs/dbraw/zinc/98/61/90/520986190.db2.gz OXWYCNCHRJSWJY-OLZOCXBDSA-N 1 1 353.785 2.978 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000601884404 521005955 /nfs/dbraw/zinc/00/59/55/521005955.db2.gz YBFZGUBEALGMIV-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@]3(C2)C(=O)Nc2ccccc23)ccc1[N+](=O)[O-] ZINC000614584054 521035405 /nfs/dbraw/zinc/03/54/05/521035405.db2.gz VKYXLBCDBIUNIF-IBGZPJMESA-N 1 1 353.378 2.699 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000599126986 521043324 /nfs/dbraw/zinc/04/33/24/521043324.db2.gz KTPDVFMWKLGPIR-AWEZNQCLSA-N 1 1 362.430 2.985 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCc3ccc(O)cc3CC1)OCCO2 ZINC000611266629 521066327 /nfs/dbraw/zinc/06/63/27/521066327.db2.gz ZMAPWAUVVSJMPR-UHFFFAOYSA-N 1 1 356.378 2.672 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1ccnc1 ZINC000611286003 521080820 /nfs/dbraw/zinc/08/08/20/521080820.db2.gz QJANZDUEWRHXPM-XJKSGUPXSA-N 1 1 358.398 2.646 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1ccnc1 ZINC000611286003 521080824 /nfs/dbraw/zinc/08/08/24/521080824.db2.gz QJANZDUEWRHXPM-XJKSGUPXSA-N 1 1 358.398 2.646 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596569610 521137030 /nfs/dbraw/zinc/13/70/30/521137030.db2.gz ACCFMCGFSUUTGX-CQSZACIVSA-N 1 1 362.430 2.700 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)CCO)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000593694492 521162826 /nfs/dbraw/zinc/16/28/26/521162826.db2.gz NJKNAMHSPOLNFU-SNVBAGLBSA-N 1 1 366.336 2.747 20 5 FFBDMO COc1cc(C[N@H+](Cc2ccccc2)[C@]2(CO)CCOC2)ccc1[N+](=O)[O-] ZINC000599396256 521198147 /nfs/dbraw/zinc/19/81/47/521198147.db2.gz SJIHPLUEYBKFBP-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO COc1cc(C[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)ccc1[N+](=O)[O-] ZINC000599396256 521198157 /nfs/dbraw/zinc/19/81/57/521198157.db2.gz SJIHPLUEYBKFBP-FQEVSTJZSA-N 1 1 372.421 2.757 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000611554932 521217886 /nfs/dbraw/zinc/21/78/86/521217886.db2.gz CJWKJWYKDQNEHI-DYEKYZERSA-N 1 1 362.348 2.997 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000611583184 521235915 /nfs/dbraw/zinc/23/59/15/521235915.db2.gz LWRPCQVLPSZLNQ-QWHCGFSZSA-N 1 1 363.462 2.824 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593848569 521246758 /nfs/dbraw/zinc/24/67/58/521246758.db2.gz KSJIYFQOWHLZRJ-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593848569 521246765 /nfs/dbraw/zinc/24/67/65/521246765.db2.gz KSJIYFQOWHLZRJ-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[NH+](Cc4ccsc4)CC3)c2c1 ZINC000611700371 521287296 /nfs/dbraw/zinc/28/72/96/521287296.db2.gz QHVMYFWTGRMTLZ-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N[C@H]3CCCC[C@@H]3[NH+]3CCOCC3)c2c1 ZINC000611711370 521292237 /nfs/dbraw/zinc/29/22/37/521292237.db2.gz LCTYZJQHXCKTJQ-IRXDYDNUSA-N 1 1 357.414 2.593 20 5 FFBDMO CCN(Cc1cn(C)nc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000602448273 521352315 /nfs/dbraw/zinc/35/23/15/521352315.db2.gz ICMYMDCATPMEAJ-CRAIPNDOSA-N 1 1 357.458 2.986 20 5 FFBDMO CCN(Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000602448278 521352381 /nfs/dbraw/zinc/35/23/81/521352381.db2.gz ICMYMDCATPMEAJ-QAPCUYQASA-N 1 1 357.458 2.986 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1F ZINC000599677127 521392366 /nfs/dbraw/zinc/39/23/66/521392366.db2.gz HCXPCWCIFHSSSL-AWEZNQCLSA-N 1 1 373.384 2.831 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594099874 521403323 /nfs/dbraw/zinc/40/33/23/521403323.db2.gz WTCBAIQXUVGWIL-KFWWJZLASA-N 1 1 363.458 2.748 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594099874 521403330 /nfs/dbraw/zinc/40/33/30/521403330.db2.gz WTCBAIQXUVGWIL-KFWWJZLASA-N 1 1 363.458 2.748 20 5 FFBDMO COC(=O)C1C[C@@H](C)[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000599693760 521407922 /nfs/dbraw/zinc/40/79/22/521407922.db2.gz GCYLYDYJJBJKOZ-VXGBXAGGSA-N 1 1 374.397 2.807 20 5 FFBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612030188 521447505 /nfs/dbraw/zinc/44/75/05/521447505.db2.gz ABLFUYVACQPYNO-CABCVRRESA-N 1 1 358.394 2.790 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000594198651 521464463 /nfs/dbraw/zinc/46/44/63/521464463.db2.gz UIHDLABNHTWJSU-CHWSQXEVSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594204005 521469090 /nfs/dbraw/zinc/46/90/90/521469090.db2.gz WJHNFRMIFVCGLA-FUHWJXTLSA-N 1 1 356.426 2.683 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619252169 521472215 /nfs/dbraw/zinc/47/22/15/521472215.db2.gz FSSZCBBRBKFPHF-VBNZEHGJSA-N 1 1 367.446 2.720 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)c1 ZINC000619254078 521473015 /nfs/dbraw/zinc/47/30/15/521473015.db2.gz HTDHOQWOFLLHGD-HIFRSBDPSA-N 1 1 353.419 2.575 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CC[NH+]([C@@H]4CCOC4)CC3)o2)c1 ZINC000597202545 521570672 /nfs/dbraw/zinc/57/06/72/521570672.db2.gz DWZIFSMYGNGXEL-QGZVFWFLSA-N 1 1 357.410 2.761 20 5 FFBDMO COc1c(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000619442455 521570535 /nfs/dbraw/zinc/57/05/35/521570535.db2.gz VNIXBDCAZMXSLA-UONOGXRCSA-N 1 1 361.442 2.986 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]2N1 ZINC000597205842 521573406 /nfs/dbraw/zinc/57/34/06/521573406.db2.gz LICKEDIRTPREGB-BBRMVZONSA-N 1 1 372.450 2.819 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]2N1 ZINC000597205842 521573408 /nfs/dbraw/zinc/57/34/08/521573408.db2.gz LICKEDIRTPREGB-BBRMVZONSA-N 1 1 372.450 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CCC([N@H+]4CC[C@H](O)C4)CC3)o2)cc1 ZINC000597234452 521588506 /nfs/dbraw/zinc/58/85/06/521588506.db2.gz AERYGFQZENEDDZ-SFHVURJKSA-N 1 1 371.437 2.886 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H](C)c2c(C)noc2C)cc1[N+](=O)[O-] ZINC000616089306 521619763 /nfs/dbraw/zinc/61/97/63/521619763.db2.gz IWWFXIXBIFEOQM-JTQLQIEISA-N 1 1 363.370 2.602 20 5 FFBDMO CCOc1cccc(CNC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000619785170 521871964 /nfs/dbraw/zinc/87/19/64/521871964.db2.gz JZPYFWVNAOEJNW-UHFFFAOYSA-N 1 1 371.437 2.784 20 5 FFBDMO CCOc1cccc(CNC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000619785170 521871969 /nfs/dbraw/zinc/87/19/69/521871969.db2.gz JZPYFWVNAOEJNW-UHFFFAOYSA-N 1 1 371.437 2.784 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000619820165 521891072 /nfs/dbraw/zinc/89/10/72/521891072.db2.gz QYPXGWFXIAABEP-IBGZPJMESA-N 1 1 368.437 2.965 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000619820165 521891079 /nfs/dbraw/zinc/89/10/79/521891079.db2.gz QYPXGWFXIAABEP-IBGZPJMESA-N 1 1 368.437 2.965 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723565 720350165 /nfs/dbraw/zinc/35/01/65/720350165.db2.gz HYBPQQIBCATRMQ-ZIAGYGMSSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1C[C@H]2C[NH+](Cc3nccs3)C[C@@H]2C1 ZINC001164790785 721397447 /nfs/dbraw/zinc/39/74/47/721397447.db2.gz YFGVXCKIDQXABY-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164790787 721397711 /nfs/dbraw/zinc/39/77/11/721397711.db2.gz YFGVXCKIDQXABY-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)COCc1ccco1 ZINC000120764892 728615062 /nfs/dbraw/zinc/61/50/62/728615062.db2.gz CTWGCJVNRMFIBV-CQSZACIVSA-N 1 1 354.790 2.851 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)COCc1ccco1 ZINC000120764892 728615064 /nfs/dbraw/zinc/61/50/64/728615064.db2.gz CTWGCJVNRMFIBV-CQSZACIVSA-N 1 1 354.790 2.851 20 5 FFBDMO CC(C)[N@H+](CCc1nccs1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000151571841 728745962 /nfs/dbraw/zinc/74/59/62/728745962.db2.gz RGPDJEIURNICAX-UHFFFAOYSA-N 1 1 362.411 2.870 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000151571841 728745963 /nfs/dbraw/zinc/74/59/63/728745963.db2.gz RGPDJEIURNICAX-UHFFFAOYSA-N 1 1 362.411 2.870 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000857677528 730406030 /nfs/dbraw/zinc/40/60/30/730406030.db2.gz OVDGVWUPQAFMID-UHFFFAOYSA-N 1 1 352.391 2.662 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](CCO)CCOCC(F)(F)F ZINC000876721660 732272252 /nfs/dbraw/zinc/27/22/52/732272252.db2.gz KZTSSLAWGVPFIZ-UHFFFAOYSA-N 1 1 350.337 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]CCOC(F)(F)C(F)(F)F)nc2c1 ZINC000877807930 732437770 /nfs/dbraw/zinc/43/77/70/732437770.db2.gz VCAICVXFXNYLMX-UHFFFAOYSA-N 1 1 355.219 2.997 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC000879575732 732727261 /nfs/dbraw/zinc/72/72/61/732727261.db2.gz MYBKEAHCKURVSS-HSMVNMDESA-N 1 1 366.849 2.601 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880005886 732817313 /nfs/dbraw/zinc/81/73/13/732817313.db2.gz DSSVFENLICQCFG-DZGCQCFKSA-N 1 1 363.439 2.589 20 5 FFBDMO CO[C@@]1(C(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000880304951 732883689 /nfs/dbraw/zinc/88/36/89/732883689.db2.gz UKWFVAUJDDFKNJ-AWEZNQCLSA-N 1 1 361.320 2.577 20 5 FFBDMO O=C(NCc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1C1CC1 ZINC000881865511 733123066 /nfs/dbraw/zinc/12/30/66/733123066.db2.gz XPEAEZVUYUFVLQ-ZDUSSCGKSA-N 1 1 368.231 2.600 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CC(C)(C)O ZINC000782031806 738681736 /nfs/dbraw/zinc/68/17/36/738681736.db2.gz MBGRYHWJULIUBJ-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@H](O)c1ccccc1Br ZINC000886239372 733764964 /nfs/dbraw/zinc/76/49/64/733764964.db2.gz VKUKOPWFJNZENH-AWEZNQCLSA-N 1 1 366.215 2.918 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@H](O)c1ccccc1Br ZINC000886239372 733764967 /nfs/dbraw/zinc/76/49/67/733764967.db2.gz VKUKOPWFJNZENH-AWEZNQCLSA-N 1 1 366.215 2.918 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269583 733768026 /nfs/dbraw/zinc/76/80/26/733768026.db2.gz ZMPFJTBNDAPFKV-GXTWGEPZSA-N 1 1 350.419 2.867 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269583 733768028 /nfs/dbraw/zinc/76/80/28/733768028.db2.gz ZMPFJTBNDAPFKV-GXTWGEPZSA-N 1 1 350.419 2.867 20 5 FFBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000886411505 733786169 /nfs/dbraw/zinc/78/61/69/733786169.db2.gz WPOBVUGTPIZPIN-CQSZACIVSA-N 1 1 350.419 2.821 20 5 FFBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000886411505 733786171 /nfs/dbraw/zinc/78/61/71/733786171.db2.gz WPOBVUGTPIZPIN-CQSZACIVSA-N 1 1 350.419 2.821 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827424 733845168 /nfs/dbraw/zinc/84/51/68/733845168.db2.gz KSVGEOFTWPFUNJ-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000886827424 733845170 /nfs/dbraw/zinc/84/51/70/733845170.db2.gz KSVGEOFTWPFUNJ-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@]2(C)C1 ZINC000887925700 733993634 /nfs/dbraw/zinc/99/36/34/733993634.db2.gz QGPACUUBNUISFF-BMIGLBTASA-N 1 1 357.332 2.637 20 5 FFBDMO CCCN(C(=O)Nc1ccc([N+](=O)[O-])c(OCC)c1)[C@H]1CC[N@@H+](C)C1 ZINC000888831332 734103503 /nfs/dbraw/zinc/10/35/03/734103503.db2.gz JCGFAXFGKMWVCM-AWEZNQCLSA-N 1 1 350.419 2.942 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)c1 ZINC000928093966 738821204 /nfs/dbraw/zinc/82/12/04/738821204.db2.gz FJOYNNLWZKETII-UKRRQHHQSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c1 ZINC000928093966 738821208 /nfs/dbraw/zinc/82/12/08/738821208.db2.gz FJOYNNLWZKETII-UKRRQHHQSA-N 1 1 367.496 2.626 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098212 738823248 /nfs/dbraw/zinc/82/32/48/738823248.db2.gz HFYZFNMFWFTMRM-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098212 738823252 /nfs/dbraw/zinc/82/32/52/738823252.db2.gz HFYZFNMFWFTMRM-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO COc1ccc(C[NH2+]CC(=O)Nc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000730106881 734616129 /nfs/dbraw/zinc/61/61/29/734616129.db2.gz OGSFGCKOYWZCNY-UHFFFAOYSA-N 1 1 351.309 2.610 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894417824 734854176 /nfs/dbraw/zinc/85/41/76/734854176.db2.gz BKLBGRPOATZTDL-AWEZNQCLSA-N 1 1 364.320 2.588 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894417824 734854181 /nfs/dbraw/zinc/85/41/81/734854181.db2.gz BKLBGRPOATZTDL-AWEZNQCLSA-N 1 1 364.320 2.588 20 5 FFBDMO C[C@@H](C[N@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1)c1nccs1 ZINC000784044925 738858039 /nfs/dbraw/zinc/85/80/39/738858039.db2.gz URTALMQZMFIHTR-QMMMGPOBSA-N 1 1 360.237 2.703 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1)c1nccs1 ZINC000784044925 738858043 /nfs/dbraw/zinc/85/80/43/738858043.db2.gz URTALMQZMFIHTR-QMMMGPOBSA-N 1 1 360.237 2.703 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)C1 ZINC000895835053 735061469 /nfs/dbraw/zinc/06/14/69/735061469.db2.gz XOJYPLCPRGOFGL-ZETCQYMHSA-N 1 1 350.177 2.865 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000741242683 735126753 /nfs/dbraw/zinc/12/67/53/735126753.db2.gz RKYACTZMJFMAGQ-LBPRGKRZSA-N 1 1 353.394 2.689 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558411 735730934 /nfs/dbraw/zinc/73/09/34/735730934.db2.gz JAQWYGMYISJDEA-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558411 735730938 /nfs/dbraw/zinc/73/09/38/735730938.db2.gz JAQWYGMYISJDEA-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]C[C@H](n2cncn2)C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000903210500 736055731 /nfs/dbraw/zinc/05/57/31/736055731.db2.gz YOQVSZAZUWWPMN-RNCFNFMXSA-N 1 1 359.308 2.649 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC1 ZINC000754996039 736224693 /nfs/dbraw/zinc/22/46/93/736224693.db2.gz IETLOYCWNLOXGB-UHFFFAOYSA-N 1 1 374.210 2.664 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756919321 736373362 /nfs/dbraw/zinc/37/33/62/736373362.db2.gz ADRMRXQIABYIDE-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000758905891 736530961 /nfs/dbraw/zinc/53/09/61/736530961.db2.gz XSWFEOQEBHEQQW-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906969756 736566655 /nfs/dbraw/zinc/56/66/55/736566655.db2.gz BETJTCRYMZUSDD-MEDUHNTESA-N 1 1 351.834 2.780 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910282082 737052611 /nfs/dbraw/zinc/05/26/11/737052611.db2.gz RSAJGDAMTYSWFD-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC000911302543 737191381 /nfs/dbraw/zinc/19/13/81/737191381.db2.gz POYFLTUTGMYVHZ-XJKSGUPXSA-N 1 1 351.834 2.733 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCCC[C@H]2[C@H](C)C[NH+](C)C)c1[N+](=O)[O-] ZINC000912810576 737342754 /nfs/dbraw/zinc/34/27/54/737342754.db2.gz WIUBJKPXKKSNNK-OLZOCXBDSA-N 1 1 351.451 2.634 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)S(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000768808553 737460594 /nfs/dbraw/zinc/46/05/94/737460594.db2.gz FHSJKPGHRUFZFT-UHFFFAOYSA-N 1 1 361.489 2.541 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@H](C2OCCO2)C1 ZINC000769305117 737515895 /nfs/dbraw/zinc/51/58/95/737515895.db2.gz IDDSWLFAKIWALK-NSHDSACASA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000769305117 737515897 /nfs/dbraw/zinc/51/58/97/737515897.db2.gz IDDSWLFAKIWALK-NSHDSACASA-N 1 1 371.231 2.942 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939782 737585663 /nfs/dbraw/zinc/58/56/63/737585663.db2.gz AUFWLFFEEXTKDO-CJNGLKHVSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939782 737585665 /nfs/dbraw/zinc/58/56/65/737585665.db2.gz AUFWLFFEEXTKDO-CJNGLKHVSA-N 1 1 364.833 2.927 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001879 737588743 /nfs/dbraw/zinc/58/87/43/737588743.db2.gz MQTAYPIYWVVYJP-AEFFLSMTSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001879 737588745 /nfs/dbraw/zinc/58/87/45/737588745.db2.gz MQTAYPIYWVVYJP-AEFFLSMTSA-N 1 1 350.415 2.826 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000916022618 737672714 /nfs/dbraw/zinc/67/27/14/737672714.db2.gz MFPZNPOMVCACAO-LLVKDONJSA-N 1 1 357.867 2.524 20 5 FFBDMO CN(CC1CC[NH+](C)CC1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774628584 738007089 /nfs/dbraw/zinc/00/70/89/738007089.db2.gz XSDKBICVTGCLRS-UHFFFAOYSA-N 1 1 351.838 2.829 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639565 738008225 /nfs/dbraw/zinc/00/82/25/738008225.db2.gz LVKWPAHTVXCFTA-WBMJQRKESA-N 1 1 363.849 2.972 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1 ZINC000778253696 738367086 /nfs/dbraw/zinc/36/70/86/738367086.db2.gz SEVJQERLRIUYJS-UHFFFAOYSA-N 1 1 363.443 2.546 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000785985097 739016781 /nfs/dbraw/zinc/01/67/81/739016781.db2.gz UMXWQNUBEVVIDX-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000930882468 739177340 /nfs/dbraw/zinc/17/73/40/739177340.db2.gz LIWPNZKIHOQQQN-CABCVRRESA-N 1 1 350.444 2.605 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000931610744 739297421 /nfs/dbraw/zinc/29/74/21/739297421.db2.gz QLRXDUGWLDVMPV-ZDUSSCGKSA-N 1 1 350.394 2.930 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000791335176 739549036 /nfs/dbraw/zinc/54/90/36/739549036.db2.gz CTJRHDPTBADDBP-LLVKDONJSA-N 1 1 352.410 2.556 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@H]1C ZINC000933368812 739611156 /nfs/dbraw/zinc/61/11/56/739611156.db2.gz LFUONBXSXPSPMP-CZUORRHYSA-N 1 1 351.422 2.998 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@@H]3CSC[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000934775461 739838971 /nfs/dbraw/zinc/83/89/71/739838971.db2.gz ZQJLQGXIILKWDE-JKDFXYPNSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@@H]3CSC[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000934775461 739838975 /nfs/dbraw/zinc/83/89/75/739838975.db2.gz ZQJLQGXIILKWDE-JKDFXYPNSA-N 1 1 365.455 2.615 20 5 FFBDMO Cc1cc(N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(Cl)c2F)cc[nH+]1 ZINC000795928586 740081331 /nfs/dbraw/zinc/08/13/31/740081331.db2.gz TZPHPBDTCYVPSR-UHFFFAOYSA-N 1 1 359.766 2.916 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[NH+](Cc3cccc4cccnc43)CC2)s1 ZINC000799927669 740464988 /nfs/dbraw/zinc/46/49/88/740464988.db2.gz DPAVBDZCYRLQFW-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO CC(C)OC[C@H](CO)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000801551591 740629668 /nfs/dbraw/zinc/62/96/68/740629668.db2.gz OVNZKMYTYHMACL-LBPRGKRZSA-N 1 1 361.236 2.575 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000804775277 740903444 /nfs/dbraw/zinc/90/34/44/740903444.db2.gz BIRHWTUBVXTEMV-LBPRGKRZSA-N 1 1 357.813 2.920 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(N)=NOCCOc1ccccc1[N+](=O)[O-] ZINC000809374318 741302831 /nfs/dbraw/zinc/30/28/31/741302831.db2.gz IKMGJQMNKIECMC-OKILXGFUSA-N 1 1 350.419 2.735 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000809916073 741360496 /nfs/dbraw/zinc/36/04/96/741360496.db2.gz GAMCGHLKTNJBOL-TXEJJXNPSA-N 1 1 370.837 2.869 20 5 FFBDMO CC(C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[NH+]1CCOCC1 ZINC000809920571 741361008 /nfs/dbraw/zinc/36/10/08/741361008.db2.gz WHEVWEHLQQBYIQ-CQSZACIVSA-N 1 1 370.837 2.727 20 5 FFBDMO CCOc1cc(CON=C(N)C[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000809996147 741371378 /nfs/dbraw/zinc/37/13/78/741371378.db2.gz UTWRFFGQQABZRA-CYBMUJFWSA-N 1 1 350.419 2.866 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)C[N@H+](C)C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000811601142 741542076 /nfs/dbraw/zinc/54/20/76/741542076.db2.gz RATHBQGIWAVFAF-JTQLQIEISA-N 1 1 352.391 2.578 20 5 FFBDMO COC[C@@H](C)[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174061 741685090 /nfs/dbraw/zinc/68/50/90/741685090.db2.gz OYBCONBTXWTWKG-KEYYUXOJSA-N 1 1 350.415 2.631 20 5 FFBDMO COC[C@@H](C)[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174061 741685093 /nfs/dbraw/zinc/68/50/93/741685093.db2.gz OYBCONBTXWTWKG-KEYYUXOJSA-N 1 1 350.415 2.631 20 5 FFBDMO Cc1nc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1Br ZINC000819338964 742377885 /nfs/dbraw/zinc/37/78/85/742377885.db2.gz FJGDUDAXKPIGQV-LLVKDONJSA-N 1 1 372.244 2.945 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])cc2OC(F)F)C[C@@H]1C ZINC000826633631 743411411 /nfs/dbraw/zinc/41/14/11/743411411.db2.gz SWJNHRNWMMYPSG-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(NC[C@@H]3C[N@H+]4CCC[C@H]4CO3)n2)cc1 ZINC000827497335 743589998 /nfs/dbraw/zinc/58/99/98/743589998.db2.gz UMPHOOYDKAPDKA-LSDHHAIUSA-N 1 1 360.439 2.993 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000831159552 745492528 /nfs/dbraw/zinc/49/25/28/745492528.db2.gz WTGLYMFSMYURSH-XNRPHZJLSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1F ZINC000831624224 745556017 /nfs/dbraw/zinc/55/60/17/745556017.db2.gz RFPVVDGZHMWSOD-UHFFFAOYSA-N 1 1 353.369 2.882 20 5 FFBDMO C[C@@H]1CN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000832949904 745767191 /nfs/dbraw/zinc/76/71/91/745767191.db2.gz QVBZVBBLKUZDRR-LBPRGKRZSA-N 1 1 353.369 2.629 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1Cl ZINC000836784907 746305491 /nfs/dbraw/zinc/30/54/91/746305491.db2.gz JUHWPYGKSNYEAQ-ZDUSSCGKSA-N 1 1 369.849 2.787 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502360 746841662 /nfs/dbraw/zinc/84/16/62/746841662.db2.gz HWBFEIVNZFLRTC-RISCZKNCSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502360 746841668 /nfs/dbraw/zinc/84/16/68/746841668.db2.gz HWBFEIVNZFLRTC-RISCZKNCSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577698 746860853 /nfs/dbraw/zinc/86/08/53/746860853.db2.gz VJQFZAIMRAGMAF-JRPNMDOOSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577698 746860858 /nfs/dbraw/zinc/86/08/58/746860858.db2.gz VJQFZAIMRAGMAF-JRPNMDOOSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577699 746860942 /nfs/dbraw/zinc/86/09/42/746860942.db2.gz VJQFZAIMRAGMAF-UEKVPHQBSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577699 746860948 /nfs/dbraw/zinc/86/09/48/746860948.db2.gz VJQFZAIMRAGMAF-UEKVPHQBSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](C[NH+]1CCOCC1)N(C)Cc1cccc([N+](=O)[O-])c1Br ZINC000839591354 746865283 /nfs/dbraw/zinc/86/52/83/746865283.db2.gz XFUVRVLFNHQFEJ-GFCCVEGCSA-N 1 1 372.263 2.510 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](NCCC[NH+]2CCOCC2)C(F)(F)F)c1F ZINC000839651434 746882128 /nfs/dbraw/zinc/88/21/28/746882128.db2.gz FOJPQYXGLLYPJE-CQSZACIVSA-N 1 1 365.327 2.649 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCS(=O)(=O)C2CC2)o1 ZINC000840963638 747244538 /nfs/dbraw/zinc/24/45/38/747244538.db2.gz BRNWXLOZVNISON-UHFFFAOYSA-N 1 1 350.396 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)c1 ZINC000848929866 749037563 /nfs/dbraw/zinc/03/75/63/749037563.db2.gz KPZICXJDWCNZAM-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)c1 ZINC000848929866 749037565 /nfs/dbraw/zinc/03/75/65/749037565.db2.gz KPZICXJDWCNZAM-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO Cc1noc(C[NH2+][C@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1[N+](=O)[O-] ZINC000851844164 749701005 /nfs/dbraw/zinc/70/10/05/749701005.db2.gz QFNOGOHHRYNOKS-MRXNPFEDSA-N 1 1 356.423 2.920 20 5 FFBDMO C[C@@]12COC[C@]1(C)C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000852462672 749867336 /nfs/dbraw/zinc/86/73/36/749867336.db2.gz JBIFEQKBRYVTIB-IYBDPMFKSA-N 1 1 353.806 2.545 20 5 FFBDMO C[C@@]12COC[C@]1(C)C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000852462672 749867344 /nfs/dbraw/zinc/86/73/44/749867344.db2.gz JBIFEQKBRYVTIB-IYBDPMFKSA-N 1 1 353.806 2.545 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000795186693 1013048142 /nfs/dbraw/zinc/04/81/42/1013048142.db2.gz BLRLFXSKRJDIIL-IFXJQAMLSA-N 1 1 359.401 2.978 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)c1C ZINC000896004806 971142653 /nfs/dbraw/zinc/14/26/53/971142653.db2.gz PHNQDPLEBBECJP-UHFFFAOYSA-N 1 1 374.485 2.500 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H]1CN(Cc2ccncc2)CCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090225 1013142059 /nfs/dbraw/zinc/14/20/59/1013142059.db2.gz NYSMEUVJDHUWHE-GDBMZVCRSA-N 1 1 374.416 2.681 20 5 FFBDMO C[N@@H+]1CCc2c(NCC3(c4ccccc4)COC3)ccc([N+](=O)[O-])c2C1 ZINC001167297806 961275103 /nfs/dbraw/zinc/27/51/03/961275103.db2.gz QXGAMTXDTSXQLL-UHFFFAOYSA-N 1 1 353.422 2.963 20 5 FFBDMO C[N@H+]1CCc2c(NCC3(c4ccccc4)COC3)ccc([N+](=O)[O-])c2C1 ZINC001167297806 961275117 /nfs/dbraw/zinc/27/51/17/961275117.db2.gz QXGAMTXDTSXQLL-UHFFFAOYSA-N 1 1 353.422 2.963 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873262396 1013450833 /nfs/dbraw/zinc/45/08/33/1013450833.db2.gz YNAJRNFCDQQYDT-NOVWEMISSA-N 1 1 355.442 2.538 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(CNc3c([N+](=O)[O-])cnn3C)cc2)C[C@H](C)O1 ZINC000891772592 965048075 /nfs/dbraw/zinc/04/80/75/965048075.db2.gz OYPSMYIGLHHDTH-OKILXGFUSA-N 1 1 359.430 2.550 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cc[nH+]cc2)c1 ZINC001270537545 965214979 /nfs/dbraw/zinc/21/49/79/965214979.db2.gz ZABWSRMNUKCCKE-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO CC(C)(CCC(=O)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1)[N+](=O)[O-] ZINC000894431699 965365600 /nfs/dbraw/zinc/36/56/00/965365600.db2.gz SAHNNGZSFUUUJZ-ZWKOTPCHSA-N 1 1 359.470 2.802 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC000983654637 965663721 /nfs/dbraw/zinc/66/37/21/965663721.db2.gz PCSRPBPPROOVDD-QSFMABPGSA-N 1 1 367.449 2.798 20 5 FFBDMO Cc1nn(CN2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c(C)c1[N+](=O)[O-] ZINC000729471422 965827703 /nfs/dbraw/zinc/82/77/03/965827703.db2.gz XOYUXMGQSMAFNN-UHFFFAOYSA-N 1 1 357.458 2.962 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000895005967 967150870 /nfs/dbraw/zinc/15/08/70/967150870.db2.gz CIFUTSJEVHRMFE-FWOBMTDDSA-N 1 1 351.406 2.809 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@]1(CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC001176958879 1013811937 /nfs/dbraw/zinc/81/19/37/1013811937.db2.gz JPJHULZDZGBROR-FQEVSTJZSA-N 1 1 369.421 2.541 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@]1(CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC001176958879 1013811944 /nfs/dbraw/zinc/81/19/44/1013811944.db2.gz JPJHULZDZGBROR-FQEVSTJZSA-N 1 1 369.421 2.541 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179548467 968973578 /nfs/dbraw/zinc/97/35/78/968973578.db2.gz XHKFFOLFVDAMEW-ZDUSSCGKSA-N 1 1 360.414 2.874 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179548467 968973584 /nfs/dbraw/zinc/97/35/84/968973584.db2.gz XHKFFOLFVDAMEW-ZDUSSCGKSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)C[C@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1 ZINC000782859798 969768741 /nfs/dbraw/zinc/76/87/41/969768741.db2.gz DFLZDOSXSOUARY-CQSZACIVSA-N 1 1 363.462 2.670 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000042095079 976743750 /nfs/dbraw/zinc/74/37/50/976743750.db2.gz NIFMWXHOPNSTCK-UHFFFAOYSA-N 1 1 359.430 2.530 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 ZINC000981764565 976763956 /nfs/dbraw/zinc/76/39/56/976763956.db2.gz SPOSOUHOIHBRAI-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981764565 976763962 /nfs/dbraw/zinc/76/39/62/976763962.db2.gz SPOSOUHOIHBRAI-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981764565 976763970 /nfs/dbraw/zinc/76/39/70/976763970.db2.gz SPOSOUHOIHBRAI-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO O=C(Nc1ccc(N2CC[N@H+]3CCC[C@H]3C2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000893845155 977564901 /nfs/dbraw/zinc/56/49/01/977564901.db2.gz ILZFODRAQSUCJB-HNNXBMFYSA-N 1 1 356.382 2.725 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001152053965 1032093151 /nfs/dbraw/zinc/09/31/51/1032093151.db2.gz ZFOQYQDNKLGNIW-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001152053965 1032093164 /nfs/dbraw/zinc/09/31/64/1032093164.db2.gz ZFOQYQDNKLGNIW-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2o1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964450 980154153 /nfs/dbraw/zinc/15/41/53/980154153.db2.gz JHESZHYZKALPMN-QZTJIDSGSA-N 1 1 371.437 2.768 20 5 FFBDMO C[N@@H+](Cc1cc2ccccc2o1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964450 980154157 /nfs/dbraw/zinc/15/41/57/980154157.db2.gz JHESZHYZKALPMN-QZTJIDSGSA-N 1 1 371.437 2.768 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2o1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964450 980154161 /nfs/dbraw/zinc/15/41/61/980154161.db2.gz JHESZHYZKALPMN-QZTJIDSGSA-N 1 1 371.437 2.768 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000905715941 980496229 /nfs/dbraw/zinc/49/62/29/980496229.db2.gz MDZXNVDIJMJFLP-CQSZACIVSA-N 1 1 354.414 2.824 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000054569322 982985706 /nfs/dbraw/zinc/98/57/06/982985706.db2.gz AYSAJFQRTIZLSN-UHFFFAOYSA-N 1 1 356.382 2.921 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000054569322 982985708 /nfs/dbraw/zinc/98/57/08/982985708.db2.gz AYSAJFQRTIZLSN-UHFFFAOYSA-N 1 1 356.382 2.921 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC1 ZINC000764150341 984324187 /nfs/dbraw/zinc/32/41/87/984324187.db2.gz RHKUELQCRDFKAP-UHFFFAOYSA-N 1 1 359.430 2.832 20 5 FFBDMO Cc1nn(CN2CCC[N@H+](Cc3ccccc3)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000156493926 984341292 /nfs/dbraw/zinc/34/12/92/984341292.db2.gz OTKFRWHUQOGDHF-HNNXBMFYSA-N 1 1 357.458 2.962 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761293174 985133392 /nfs/dbraw/zinc/13/33/92/985133392.db2.gz SBPTYXHZYHQBQQ-OAHLLOKOSA-N 1 1 371.441 2.545 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cccc(F)c3)CC2)c2nonc21 ZINC000765574883 985203012 /nfs/dbraw/zinc/20/30/12/985203012.db2.gz MXWNEPFSNNKOIL-UHFFFAOYSA-N 1 1 357.345 2.592 20 5 FFBDMO CC(C)CCC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001272917416 986887111 /nfs/dbraw/zinc/88/71/11/986887111.db2.gz XJADTGAWGKIEMM-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CC(C)CCC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001272917416 986887117 /nfs/dbraw/zinc/88/71/17/986887117.db2.gz XJADTGAWGKIEMM-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CC(C)CCC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001272917416 986887126 /nfs/dbraw/zinc/88/71/26/986887126.db2.gz XJADTGAWGKIEMM-RTBURBONSA-N 1 1 359.470 2.762 20 5 FFBDMO CCOC(=O)CC1CC[NH+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000130256890 987478944 /nfs/dbraw/zinc/47/89/44/987478944.db2.gz RLCVHKMRPXIUMP-UHFFFAOYSA-N 1 1 363.414 2.507 20 5 FFBDMO CCCC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000914789002 987911172 /nfs/dbraw/zinc/91/11/72/987911172.db2.gz VDMLDEDCRVXDOH-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO C/C(=C\C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000762612343 988512317 /nfs/dbraw/zinc/51/23/17/988512317.db2.gz KSQLXDAWSVRMPA-MDJJKAFGSA-N 1 1 361.442 2.615 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000915469772 988589050 /nfs/dbraw/zinc/58/90/50/988589050.db2.gz SZANSESFTGEWJL-AWEZNQCLSA-N 1 1 358.398 2.812 20 5 FFBDMO O=C(NC[C@H]1C[N@H+]2CCN1CCC2)c1cc2ccccc2c2cccnc12 ZINC000670409948 988698090 /nfs/dbraw/zinc/69/80/90/988698090.db2.gz XSXANHMJORZBCM-KRWDZBQOSA-N 1 1 360.461 2.508 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccc(C3CC3)cc2)CC1 ZINC001005383759 989741695 /nfs/dbraw/zinc/74/16/95/989741695.db2.gz VYMYRKUGHIXNFQ-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO CCCc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001034642623 990147599 /nfs/dbraw/zinc/14/75/99/990147599.db2.gz FEJJPMCDNYUFSG-NCXUSEDFSA-N 1 1 359.470 2.821 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)c1 ZINC001035186965 990409208 /nfs/dbraw/zinc/40/92/08/990409208.db2.gz NVJNBGZNOWGOJT-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035186965 990409216 /nfs/dbraw/zinc/40/92/16/990409216.db2.gz NVJNBGZNOWGOJT-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035186965 990409219 /nfs/dbraw/zinc/40/92/19/990409219.db2.gz NVJNBGZNOWGOJT-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)cc1 ZINC000879500096 1015563837 /nfs/dbraw/zinc/56/38/37/1015563837.db2.gz OOAYYCKZDCNQRJ-QZTJIDSGSA-N 1 1 354.410 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@H](Cn4ccnn4)C3)c2c1 ZINC000154921020 990591046 /nfs/dbraw/zinc/59/10/46/990591046.db2.gz KBHKLHQQERVALJ-LBPRGKRZSA-N 1 1 374.426 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@H](Cn4ccnn4)C3)c2c1 ZINC000154921020 990591049 /nfs/dbraw/zinc/59/10/49/990591049.db2.gz KBHKLHQQERVALJ-LBPRGKRZSA-N 1 1 374.426 2.833 20 5 FFBDMO Cc1noc(COC(=O)[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000923851166 990841771 /nfs/dbraw/zinc/84/17/71/990841771.db2.gz QJWGWUGKVSQISP-SWLSCSKDSA-N 1 1 359.382 2.703 20 5 FFBDMO CC1(C)[C@@H](c2ccccc2F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000879638863 1015621219 /nfs/dbraw/zinc/62/12/19/1015621219.db2.gz GHEKIKRNSSAKRJ-GOEBONIOSA-N 1 1 362.405 2.559 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)c1 ZINC000879690596 1015641521 /nfs/dbraw/zinc/64/15/21/1015641521.db2.gz AKUMZQADNZFROG-ROUUACIJSA-N 1 1 354.410 2.508 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C(N)=O)(N2CCCCC2)CC1 ZINC000880252592 1015790693 /nfs/dbraw/zinc/79/06/93/1015790693.db2.gz ARNXKAUGRBHJMA-MRXNPFEDSA-N 1 1 374.485 2.770 20 5 FFBDMO CN(C)c1ccc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000810670660 994870792 /nfs/dbraw/zinc/87/07/92/994870792.db2.gz IOVGSQKCAWWLLG-SFHVURJKSA-N 1 1 367.421 2.917 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810844485 994952646 /nfs/dbraw/zinc/95/26/46/994952646.db2.gz NWXKAYNKIOHPBR-JKSUJKDBSA-N 1 1 356.382 2.564 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2C1 ZINC000812338819 995417899 /nfs/dbraw/zinc/41/78/99/995417899.db2.gz QUFAUOGFXXRENT-KGLIPLIRSA-N 1 1 372.450 2.742 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847379 995550930 /nfs/dbraw/zinc/55/09/30/995550930.db2.gz ATDZCURPJMQKSE-IFXJQAMLSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847379 995550939 /nfs/dbraw/zinc/55/09/39/995550939.db2.gz ATDZCURPJMQKSE-IFXJQAMLSA-N 1 1 357.410 2.977 20 5 FFBDMO CCc1cncc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813173345 995635239 /nfs/dbraw/zinc/63/52/39/995635239.db2.gz ZTTMCIZODUPXRT-SFHVURJKSA-N 1 1 355.394 2.984 20 5 FFBDMO CCc1cncc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813173345 995635246 /nfs/dbraw/zinc/63/52/46/995635246.db2.gz ZTTMCIZODUPXRT-SFHVURJKSA-N 1 1 355.394 2.984 20 5 FFBDMO Nc1ccc(C(=O)NC[C@H]2CCC[N@H+]2CC2CCCCC2)cc1[N+](=O)[O-] ZINC000731476115 997941334 /nfs/dbraw/zinc/94/13/34/997941334.db2.gz VDBSTSSCRHWRJD-MRXNPFEDSA-N 1 1 360.458 2.952 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H](Cc2ccccc2)C1 ZINC000844739449 998135544 /nfs/dbraw/zinc/13/55/44/998135544.db2.gz DTRYTLMJLRKHSY-LJQANCHMSA-N 1 1 365.437 2.761 20 5 FFBDMO C[C@@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000803856272 1016245520 /nfs/dbraw/zinc/24/55/20/1016245520.db2.gz OCICYLSQOLAGDK-UKRRQHHQSA-N 1 1 363.414 2.730 20 5 FFBDMO COc1cc(CCNc2nc(N3CCCC3)cc[nH+]2)c([N+](=O)[O-])cc1OC ZINC000733183883 998913889 /nfs/dbraw/zinc/91/38/89/998913889.db2.gz GAQYKJMNZKHPGO-UHFFFAOYSA-N 1 1 373.413 2.657 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000733301987 998951357 /nfs/dbraw/zinc/95/13/57/998951357.db2.gz FYEQBDLHSHKHFI-AWEZNQCLSA-N 1 1 366.418 2.980 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738091167 999616338 /nfs/dbraw/zinc/61/63/38/999616338.db2.gz WJMFDDNKXQJBDV-UHFFFAOYSA-N 1 1 372.473 2.863 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741023029 999704299 /nfs/dbraw/zinc/70/42/99/999704299.db2.gz YBNYSOLAQGSEPO-MQYQWHSLSA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000742154156 999762467 /nfs/dbraw/zinc/76/24/67/999762467.db2.gz DPVQCVYVAPIDBY-KGLIPLIRSA-N 1 1 360.414 2.831 20 5 FFBDMO COCC[N@H+](CCc1ccccc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000746050964 999942829 /nfs/dbraw/zinc/94/28/29/999942829.db2.gz DCEYXASYGBSHGY-UHFFFAOYSA-N 1 1 371.393 2.651 20 5 FFBDMO COCC[N@@H+](CCc1ccccc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000746050964 999942830 /nfs/dbraw/zinc/94/28/30/999942830.db2.gz DCEYXASYGBSHGY-UHFFFAOYSA-N 1 1 371.393 2.651 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169035897 1000016582 /nfs/dbraw/zinc/01/65/82/1000016582.db2.gz MFILNIGVFBKUHA-CABCVRRESA-N 1 1 353.463 2.765 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCN(Cc3ccncc3)c3ncccc3C2)C1 ZINC001169019624 1000017634 /nfs/dbraw/zinc/01/76/34/1000017634.db2.gz GYPXVDAEUCDBIS-HKUYNNGSSA-N 1 1 367.453 2.744 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCn3cnc(COCc4ccco4)c3C2)C1 ZINC001169026238 1000018132 /nfs/dbraw/zinc/01/81/32/1000018132.db2.gz WJYYQCINDARRHS-CVEARBPZSA-N 1 1 374.441 2.844 20 5 FFBDMO CC[N@@H+](C[C@@H]1CN(Cc2ccccc2)CCO1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169053548 1000018982 /nfs/dbraw/zinc/01/89/82/1000018982.db2.gz ILKDBAONGHNECZ-ZCNNSNEGSA-N 1 1 361.486 2.655 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@H](Nc2cccnc2[N+](=O)[O-])C1 ZINC001169519136 1000056141 /nfs/dbraw/zinc/05/61/41/1000056141.db2.gz MZRANCIAKAWZJJ-NVXWUHKLSA-N 1 1 370.409 2.861 20 5 FFBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770038685 1000661270 /nfs/dbraw/zinc/66/12/70/1000661270.db2.gz DHTXGNQTYIEXOM-QUCCMNQESA-N 1 1 374.437 2.779 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](F)C1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170514 1000838200 /nfs/dbraw/zinc/83/82/00/1000838200.db2.gz AKSHHPVAFBACPF-CJNGLKHVSA-N 1 1 353.419 2.603 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](F)C1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170514 1000838206 /nfs/dbraw/zinc/83/82/06/1000838206.db2.gz AKSHHPVAFBACPF-CJNGLKHVSA-N 1 1 353.419 2.603 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)OC(=O)C[NH+]2[C@H](C)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000785742830 1001474540 /nfs/dbraw/zinc/47/45/40/1001474540.db2.gz OYJYXBURUDWRHP-BZPMIXESSA-N 1 1 363.414 2.646 20 5 FFBDMO COc1ccc(CO[NH+]=C(N)CCNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000789644770 1002148094 /nfs/dbraw/zinc/14/80/94/1002148094.db2.gz LRKLBYGJYUZCQB-UHFFFAOYSA-N 1 1 368.390 2.517 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCOCC4(CCCC4)C3)n2)cc1 ZINC000774659301 1002339995 /nfs/dbraw/zinc/33/99/95/1002339995.db2.gz SNGIBMCJSBLXOU-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCOCC4(CCCC4)C3)n2)cc1 ZINC000774659301 1002340005 /nfs/dbraw/zinc/34/00/05/1002340005.db2.gz SNGIBMCJSBLXOU-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CC[C@H](C)C1 ZINC000790476742 1002387227 /nfs/dbraw/zinc/38/72/27/1002387227.db2.gz CWGYHTKALOGZIR-WMLDXEAASA-N 1 1 359.430 2.948 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1cc(N(C)C)cc[nH+]1 ZINC001183847221 1002409929 /nfs/dbraw/zinc/40/99/29/1002409929.db2.gz XZXXBZDWWBPLJJ-ZDUSSCGKSA-N 1 1 357.414 2.563 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791395356 1002689594 /nfs/dbraw/zinc/68/95/94/1002689594.db2.gz RQTYWCKWLFZGDE-YVEFUNNKSA-N 1 1 372.400 2.566 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(c3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC001170329947 1003115886 /nfs/dbraw/zinc/11/58/86/1003115886.db2.gz XDLWTKRGVFKDIO-OAHLLOKOSA-N 1 1 356.426 2.752 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@](CO)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334071 1003117871 /nfs/dbraw/zinc/11/78/71/1003117871.db2.gz AQDHMWNORGSYOC-ABAIWWIYSA-N 1 1 362.348 2.781 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](Oc3ncccn3)C2)c([N+](=O)[O-])c1 ZINC001170354848 1003123000 /nfs/dbraw/zinc/12/30/00/1003123000.db2.gz QGXXZYUAXYJQSO-PBHICJAKSA-N 1 1 372.425 2.868 20 5 FFBDMO CCCNC(=O)[C@@H]1CCCC[N@@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344668 1003131632 /nfs/dbraw/zinc/13/16/32/1003131632.db2.gz DUFBDLXZKYZBTR-YOEHRIQHSA-N 1 1 363.458 2.915 20 5 FFBDMO CCCNC(=O)[C@@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344668 1003131639 /nfs/dbraw/zinc/13/16/39/1003131639.db2.gz DUFBDLXZKYZBTR-YOEHRIQHSA-N 1 1 363.458 2.915 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2cccc(C(F)F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001399704 1016782207 /nfs/dbraw/zinc/78/22/07/1016782207.db2.gz MXWIKBSOHPZZHH-HZPDHXFCSA-N 1 1 367.396 2.618 20 5 FFBDMO O=[N+]([O-])c1cc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)cs1 ZINC001193800397 1004585861 /nfs/dbraw/zinc/58/58/61/1004585861.db2.gz PSLPRAMKSYYUMX-ZDUSSCGKSA-N 1 1 373.500 2.732 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000108335499 1005654436 /nfs/dbraw/zinc/65/44/36/1005654436.db2.gz BGWBEWHZTFCZBH-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCO1 ZINC000851035710 1005857862 /nfs/dbraw/zinc/85/78/62/1005857862.db2.gz WILNYIBUWIKHOO-WBAXXEDZSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1CCCO1 ZINC000851035710 1005857864 /nfs/dbraw/zinc/85/78/64/1005857864.db2.gz WILNYIBUWIKHOO-WBAXXEDZSA-N 1 1 362.426 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC(O[C@@H]4CCOC4)CC3)c2)cc1 ZINC000748263885 1017004878 /nfs/dbraw/zinc/00/48/78/1017004878.db2.gz FGFOAADZEJADCV-LJQANCHMSA-N 1 1 372.425 2.686 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000110349687 1005931253 /nfs/dbraw/zinc/93/12/53/1005931253.db2.gz IPZGDPYAGZHPIJ-CYBMUJFWSA-N 1 1 372.381 2.753 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077110 1005939644 /nfs/dbraw/zinc/93/96/44/1005939644.db2.gz OMMLBKFFGQGWMP-STQMWFEESA-N 1 1 366.418 2.723 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077110 1005939645 /nfs/dbraw/zinc/93/96/45/1005939645.db2.gz OMMLBKFFGQGWMP-STQMWFEESA-N 1 1 366.418 2.723 20 5 FFBDMO CC(C)n1cc(C2=CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)nn1 ZINC000852133685 1005944133 /nfs/dbraw/zinc/94/41/33/1005944133.db2.gz AMMOVHHRPGPSRV-LJQANCHMSA-N 1 1 371.441 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000776594197 1006009779 /nfs/dbraw/zinc/00/97/79/1006009779.db2.gz YIVGBAOCERKHGZ-UXHICEINSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000776594197 1006009786 /nfs/dbraw/zinc/00/97/86/1006009786.db2.gz YIVGBAOCERKHGZ-UXHICEINSA-N 1 1 354.406 2.802 20 5 FFBDMO COc1cc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c([N+](=O)[O-])cc1OC ZINC001187593676 1006147942 /nfs/dbraw/zinc/14/79/42/1006147942.db2.gz NNNVXHCWWTWFTK-RISCZKNCSA-N 1 1 353.444 2.604 20 5 FFBDMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC(CC[NH+]2CCOCC2)CC1 ZINC000881868779 1006247761 /nfs/dbraw/zinc/24/77/61/1006247761.db2.gz NVLQTYVUMJPWPN-UHFFFAOYSA-N 1 1 361.442 2.736 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000110998307 1006249495 /nfs/dbraw/zinc/24/94/95/1006249495.db2.gz ZZBALOBNTHOAHP-MRXNPFEDSA-N 1 1 360.458 2.799 20 5 FFBDMO CC(=O)c1c(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000882171849 1006311695 /nfs/dbraw/zinc/31/16/95/1006311695.db2.gz MBMQHHCYZVNCJE-KRWDZBQOSA-N 1 1 369.421 2.976 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@H]1CC[C@H](C)C1 ZINC000853507863 1006421511 /nfs/dbraw/zinc/42/15/11/1006421511.db2.gz CHSCVPGGFXIYEQ-GJZGRUSLSA-N 1 1 359.430 2.948 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000853601563 1006469157 /nfs/dbraw/zinc/46/91/57/1006469157.db2.gz JVIBRBFLOYBQCJ-HNNXBMFYSA-N 1 1 371.441 2.652 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000853812275 1006542985 /nfs/dbraw/zinc/54/29/85/1006542985.db2.gz XXMMIHZVYNLCRG-GFCCVEGCSA-N 1 1 371.384 2.803 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1cc([N+](=O)[O-])ccc1F ZINC000854572773 1006897866 /nfs/dbraw/zinc/89/78/66/1006897866.db2.gz GPDLQGHYHYCRCO-OAHLLOKOSA-N 1 1 359.357 2.553 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H]2C2CCOCC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000776768838 1007058685 /nfs/dbraw/zinc/05/86/85/1007058685.db2.gz NWOXVJUMCMEHMB-INIZCTEOSA-N 1 1 374.441 2.685 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000855160111 1007139663 /nfs/dbraw/zinc/13/96/63/1007139663.db2.gz NVYZIEUGKIQPAU-LBPRGKRZSA-N 1 1 364.402 2.662 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000113438170 1007406522 /nfs/dbraw/zinc/40/65/22/1007406522.db2.gz RJFHZUVNQBPQBU-CQSZACIVSA-N 1 1 364.402 2.806 20 5 FFBDMO O=[N+]([O-])c1ccc(N(CCC[NH+]2CCOCC2)Cc2ccncc2)c(F)c1 ZINC000135453874 1007514378 /nfs/dbraw/zinc/51/43/78/1007514378.db2.gz POGZODNXWMPXBS-UHFFFAOYSA-N 1 1 374.416 2.858 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856555827 1007884283 /nfs/dbraw/zinc/88/42/83/1007884283.db2.gz HKODBHJCJHUMNZ-JCGIZDLHSA-N 1 1 368.437 2.815 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856555827 1007884288 /nfs/dbraw/zinc/88/42/88/1007884288.db2.gz HKODBHJCJHUMNZ-JCGIZDLHSA-N 1 1 368.437 2.815 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)n1 ZINC000858019974 1008278852 /nfs/dbraw/zinc/27/88/52/1008278852.db2.gz NMUMUGVSBFNZOD-INIZCTEOSA-N 1 1 357.414 2.607 20 5 FFBDMO O=C([C@@H]1CC12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2)N1CCCCC1 ZINC000886102628 1008561777 /nfs/dbraw/zinc/56/17/77/1008561777.db2.gz LRSBQSGVXQKSPH-INIZCTEOSA-N 1 1 358.442 2.604 20 5 FFBDMO CC(C)(C)OC(=O)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCOCC1 ZINC000886264244 1008616169 /nfs/dbraw/zinc/61/61/69/1008616169.db2.gz TXLIOKYCVBQNKU-UHFFFAOYSA-N 1 1 365.430 2.703 20 5 FFBDMO O=C(CCN1CCCC[C@@]2(CC[NH2+]C2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886874717 1008910517 /nfs/dbraw/zinc/91/05/17/1008910517.db2.gz UYOIQJYQXIWEQR-SFHVURJKSA-N 1 1 364.421 2.528 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@@H]1CC1(O)CCCCC1 ZINC000887035089 1008988128 /nfs/dbraw/zinc/98/81/28/1008988128.db2.gz GGIUQFXPBQPWNZ-MRXNPFEDSA-N 1 1 363.458 2.696 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)[C@@H](c2ccccc2)C1 ZINC000860437507 1009002115 /nfs/dbraw/zinc/00/21/15/1009002115.db2.gz WRKPRSSKODMCDK-MOPGFXCFSA-N 1 1 365.433 2.825 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)OCCOc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000860502146 1009035283 /nfs/dbraw/zinc/03/52/83/1009035283.db2.gz SBMRJLYLCACGFK-UHFFFAOYSA-N 1 1 373.287 2.741 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c1 ZINC000823481618 1009085543 /nfs/dbraw/zinc/08/55/43/1009085543.db2.gz KMJIAHZTLLHAGP-TYPHKJRUSA-N 1 1 367.449 2.835 20 5 FFBDMO C[C@H](C[N+](=O)[O-])OC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1c1ccncc1 ZINC000860787421 1009150756 /nfs/dbraw/zinc/15/07/56/1009150756.db2.gz LYPFLUVREZXIJX-AYOQOUSVSA-N 1 1 369.421 2.506 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000862631376 1009907712 /nfs/dbraw/zinc/90/77/12/1009907712.db2.gz OPHPGMQNPYKBMB-AWEZNQCLSA-N 1 1 365.405 2.636 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000866226188 1010955549 /nfs/dbraw/zinc/95/55/49/1010955549.db2.gz HCLLTTOKXJVHMZ-HNAYVOBHSA-N 1 1 366.481 2.527 20 5 FFBDMO C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001171598183 1011396814 /nfs/dbraw/zinc/39/68/14/1011396814.db2.gz CIHNGXZTLHVDGV-FOGDFJRCSA-N 1 1 370.247 2.832 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001171836231 1011498568 /nfs/dbraw/zinc/49/85/68/1011498568.db2.gz SGWQRRWYLGGZPW-KRWDZBQOSA-N 1 1 368.437 2.962 20 5 FFBDMO O=C1CCC[C@@]2(CCC[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)N1 ZINC001172910549 1012123723 /nfs/dbraw/zinc/12/37/23/1012123723.db2.gz YWRLWKLMWMCXQE-XLIONFOSSA-N 1 1 357.454 2.977 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1=O ZINC001173010301 1012178887 /nfs/dbraw/zinc/17/88/87/1012178887.db2.gz PZOJBCYYABARDD-LLVKDONJSA-N 1 1 353.369 2.753 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1=O ZINC001173010301 1012178896 /nfs/dbraw/zinc/17/88/96/1012178896.db2.gz PZOJBCYYABARDD-LLVKDONJSA-N 1 1 353.369 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@](F)(CO)CC2)c1F ZINC001173180033 1012324965 /nfs/dbraw/zinc/32/49/65/1012324965.db2.gz ICRAJDFRILJDPH-YVEFUNNKSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[N@H+]3CCC[C@H]3C2)c1F ZINC001173190521 1012331317 /nfs/dbraw/zinc/33/13/17/1012331317.db2.gz UUFJUGKNZLRXQW-KGLIPLIRSA-N 1 1 351.422 2.844 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCN(C(=O)c3ccco3)[C@@H]2C1 ZINC001173223250 1012355369 /nfs/dbraw/zinc/35/53/69/1012355369.db2.gz AMBURFQUUOITPN-QILLFSRXSA-N 1 1 369.421 2.965 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001173235399 1012366416 /nfs/dbraw/zinc/36/64/16/1012366416.db2.gz WQDQRSIWNHIMFM-OAHLLOKOSA-N 1 1 357.410 2.967 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CCC1(C)C ZINC000871157663 1012757612 /nfs/dbraw/zinc/75/76/12/1012757612.db2.gz CQPLVRVWWAYEMK-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CCC1(C)C ZINC000871157663 1012757622 /nfs/dbraw/zinc/75/76/22/1012757622.db2.gz CQPLVRVWWAYEMK-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CCC1(C)C ZINC000871157663 1012757634 /nfs/dbraw/zinc/75/76/34/1012757634.db2.gz CQPLVRVWWAYEMK-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000930861692 1020215578 /nfs/dbraw/zinc/21/55/78/1020215578.db2.gz FWZVRIYCSIDRJM-OAHLLOKOSA-N 1 1 362.430 2.586 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000725800566 1020261766 /nfs/dbraw/zinc/26/17/66/1020261766.db2.gz CHSVRUONKATOKJ-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO CC(C)COC(=O)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000725800566 1020261773 /nfs/dbraw/zinc/26/17/73/1020261773.db2.gz CHSVRUONKATOKJ-UHFFFAOYSA-N 1 1 365.430 2.774 20 5 FFBDMO Cc1noc(C2CC[NH+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC2)n1 ZINC000777954034 1020311439 /nfs/dbraw/zinc/31/14/39/1020311439.db2.gz PDEMSHPVSHMJQE-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1 ZINC000931490944 1020488792 /nfs/dbraw/zinc/48/87/92/1020488792.db2.gz IJMKQIHAHCUBEE-SLFFLAALSA-N 1 1 353.422 2.587 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000932104990 1020707826 /nfs/dbraw/zinc/70/78/26/1020707826.db2.gz PEMWEOHGXPBHBV-TZMCWYRMSA-N 1 1 359.382 2.881 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000932104990 1020707834 /nfs/dbraw/zinc/70/78/34/1020707834.db2.gz PEMWEOHGXPBHBV-TZMCWYRMSA-N 1 1 359.382 2.881 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932133624 1020714505 /nfs/dbraw/zinc/71/45/05/1020714505.db2.gz FBJPOJAXTHJSFU-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)C[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248916 1020984595 /nfs/dbraw/zinc/98/45/95/1020984595.db2.gz OHORNNWZQDJNRU-MRXNPFEDSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@@H+](C)C[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248916 1020984598 /nfs/dbraw/zinc/98/45/98/1020984598.db2.gz OHORNNWZQDJNRU-MRXNPFEDSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)C[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000933248916 1020984601 /nfs/dbraw/zinc/98/46/01/1020984601.db2.gz OHORNNWZQDJNRU-MRXNPFEDSA-N 1 1 362.474 2.894 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000749801185 1021037582 /nfs/dbraw/zinc/03/75/82/1021037582.db2.gz BUEZBOGHUVNSGY-UHFFFAOYSA-N 1 1 367.450 2.559 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1 ZINC000933944549 1021118419 /nfs/dbraw/zinc/11/84/19/1021118419.db2.gz HWNPLBRVASAECB-IPELMVKDSA-N 1 1 357.454 2.889 20 5 FFBDMO Cc1cc(N2CCC(Nc3nc4ccccn4c3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000750030042 1021247236 /nfs/dbraw/zinc/24/72/36/1021247236.db2.gz HPKKOPAMHRRSIX-UHFFFAOYSA-N 1 1 367.413 2.730 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1ccn(-c2cc[nH+]cc2)n1 ZINC001116798399 1021422149 /nfs/dbraw/zinc/42/21/49/1021422149.db2.gz YNCKRSIPPBOZBT-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1[N+](=O)[O-] ZINC000778951273 1022574884 /nfs/dbraw/zinc/57/48/84/1022574884.db2.gz JLQIPOJZIYRLLA-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1[N+](=O)[O-] ZINC000778951273 1022574889 /nfs/dbraw/zinc/57/48/89/1022574889.db2.gz JLQIPOJZIYRLLA-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@H](c4nccs4)C3)n2)c1 ZINC001119331723 1022693732 /nfs/dbraw/zinc/69/37/32/1022693732.db2.gz QWLSMXIJBDEWGL-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](c4nccs4)C3)n2)c1 ZINC001119331723 1022693738 /nfs/dbraw/zinc/69/37/38/1022693738.db2.gz QWLSMXIJBDEWGL-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO O=C(OCc1cccnc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001119396144 1022738368 /nfs/dbraw/zinc/73/83/68/1022738368.db2.gz DIXHEQGUARBXFP-INIZCTEOSA-N 1 1 355.394 2.945 20 5 FFBDMO CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@@H+]1Cc1ccccc1 ZINC000188426321 1023080757 /nfs/dbraw/zinc/08/07/57/1023080757.db2.gz DPXAIFHFMFMZMN-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC1(C)CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000188426321 1023080763 /nfs/dbraw/zinc/08/07/63/1023080763.db2.gz DPXAIFHFMFMZMN-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC001120545605 1023354844 /nfs/dbraw/zinc/35/48/44/1023354844.db2.gz FNSNQYGIMXQDRX-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2c3ccc(C)cc3[C@@H]3C[N@H+](C)CC[C@@H]32)n1 ZINC000756624642 1023736533 /nfs/dbraw/zinc/73/65/33/1023736533.db2.gz BMSIWOMFRRLRQT-HOCLYGCPSA-N 1 1 369.425 2.568 20 5 FFBDMO O=C([C@H]1CCC[N@@H+]1Cc1ccccn1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000757638224 1023841014 /nfs/dbraw/zinc/84/10/14/1023841014.db2.gz IXVWPQPKEPOFTN-LJQANCHMSA-N 1 1 366.421 2.539 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1Cc1ccccn1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000757638224 1023841021 /nfs/dbraw/zinc/84/10/21/1023841021.db2.gz IXVWPQPKEPOFTN-LJQANCHMSA-N 1 1 366.421 2.539 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@H]2C1 ZINC001124004202 1024217960 /nfs/dbraw/zinc/21/79/60/1024217960.db2.gz UWAMOBIPLHOQMG-BHYGNILZSA-N 1 1 366.421 2.727 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000195625033 1025037273 /nfs/dbraw/zinc/03/72/73/1025037273.db2.gz MTJDFOGZYXHWPN-XQQFMLRXSA-N 1 1 364.402 2.599 20 5 FFBDMO Cc1c(C(=O)NCCCC[N@H+](C)C2CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000837225357 1025666281 /nfs/dbraw/zinc/66/62/81/1025666281.db2.gz QSXCSSDOUAUGPU-UHFFFAOYSA-N 1 1 364.402 2.724 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001141339953 1025950691 /nfs/dbraw/zinc/95/06/91/1025950691.db2.gz XUJYUPCMROCSJQ-BWTSREIZSA-N 1 1 351.406 2.763 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000839854333 1026848889 /nfs/dbraw/zinc/84/88/89/1026848889.db2.gz PEJGSMLDPMGHCL-HNNXBMFYSA-N 1 1 368.437 2.832 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000839854333 1026848896 /nfs/dbraw/zinc/84/88/96/1026848896.db2.gz PEJGSMLDPMGHCL-HNNXBMFYSA-N 1 1 368.437 2.832 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@H]2CCC[N@@H+]2C)[nH]n1 ZINC001141720566 1026860311 /nfs/dbraw/zinc/86/03/11/1026860311.db2.gz OURSFORTZUQYAF-OAHLLOKOSA-N 1 1 359.386 2.736 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@H]2CCC[N@H+]2C)[nH]n1 ZINC001141720566 1026860316 /nfs/dbraw/zinc/86/03/16/1026860316.db2.gz OURSFORTZUQYAF-OAHLLOKOSA-N 1 1 359.386 2.736 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000840130501 1026973039 /nfs/dbraw/zinc/97/30/39/1026973039.db2.gz OZNJTNZDEHCZOF-CABCVRRESA-N 1 1 373.409 2.741 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000795718704 1027981179 /nfs/dbraw/zinc/98/11/79/1027981179.db2.gz MQISQWPOSNOVMY-OAHLLOKOSA-N 1 1 372.347 2.990 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000795718704 1027981194 /nfs/dbraw/zinc/98/11/94/1027981194.db2.gz MQISQWPOSNOVMY-OAHLLOKOSA-N 1 1 372.347 2.990 20 5 FFBDMO COc1ncnc(N[C@H]2CC[N@H+](Cc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC001161182273 1028054849 /nfs/dbraw/zinc/05/48/49/1028054849.db2.gz QQRNXYMXIHCVKG-ZDUSSCGKSA-N 1 1 363.805 2.733 20 5 FFBDMO COc1ncnc(N[C@H]2CC[N@@H+](Cc3cccc(Cl)c3)C2)c1[N+](=O)[O-] ZINC001161182273 1028054870 /nfs/dbraw/zinc/05/48/70/1028054870.db2.gz QQRNXYMXIHCVKG-ZDUSSCGKSA-N 1 1 363.805 2.733 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)NCC[C@H]2CC[NH2+]CC2(F)F)cnc1Cl ZINC001162808362 1028662893 /nfs/dbraw/zinc/66/28/93/1028662893.db2.gz QMQHJUOOPPSPEH-MRVPVSSYSA-N 1 1 370.734 2.917 20 5 FFBDMO O=C(c1cc(=S)cc2[nH]c3ccccc3nc1-2)N1CC[N@H+]2CC[C@@H]2C1 ZINC001155996103 1029006037 /nfs/dbraw/zinc/00/60/37/1029006037.db2.gz KOUAPZVUHSARBX-GFCCVEGCSA-N 1 1 350.447 2.927 20 5 FFBDMO Cc1cc(NCC2(N(C)C)CC[NH+](C)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC001156175815 1029076653 /nfs/dbraw/zinc/07/66/53/1029076653.db2.gz GEBWLGDGDTXXMB-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001163882133 1029103695 /nfs/dbraw/zinc/10/36/95/1029103695.db2.gz NQLQFYWHZXCBMD-JTQLQIEISA-N 1 1 358.236 2.614 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NCC[C@@H]1CCC[N@@H+](C)C1 ZINC001156381592 1029172413 /nfs/dbraw/zinc/17/24/13/1029172413.db2.gz SILFTAUGCNOTRM-NSHDSACASA-N 1 1 370.837 2.964 20 5 FFBDMO CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000782095949 1029567906 /nfs/dbraw/zinc/56/79/06/1029567906.db2.gz PBYNOCNNPLAKOZ-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000782095949 1029567909 /nfs/dbraw/zinc/56/79/09/1029567909.db2.gz PBYNOCNNPLAKOZ-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO C[C@@H]1C[N@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@H]2CCCC[C@@H]12 ZINC000782278097 1029637763 /nfs/dbraw/zinc/63/77/63/1029637763.db2.gz TWJJDWQQKIFWBA-KCXAZCMYSA-N 1 1 358.398 2.880 20 5 FFBDMO C[C@@H]1C[N@@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@H]2CCCC[C@@H]12 ZINC000782278097 1029637768 /nfs/dbraw/zinc/63/77/68/1029637768.db2.gz TWJJDWQQKIFWBA-KCXAZCMYSA-N 1 1 358.398 2.880 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(C(F)(F)c3cc([N+](=O)[O-])cnc3Cl)C[C@H]2C1 ZINC001157692925 1029646578 /nfs/dbraw/zinc/64/65/78/1029646578.db2.gz ZLRYGFRHAWKIRD-PHIMTYICSA-N 1 1 360.792 2.966 20 5 FFBDMO C[C@@H]1C[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007727 1030411944 /nfs/dbraw/zinc/41/19/44/1030411944.db2.gz LCJVZDCRVVHQRX-ORAYPTAESA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007727 1030411955 /nfs/dbraw/zinc/41/19/55/1030411955.db2.gz LCJVZDCRVVHQRX-ORAYPTAESA-N 1 1 374.441 2.687 20 5 FFBDMO COC(=O)C1([NH3+])CCN(c2ccc3ccc4ccc(Cl)nc4c3n2)CC1 ZINC001166797439 1030521121 /nfs/dbraw/zinc/52/11/21/1030521121.db2.gz NQPYTCMQAMOFOT-UHFFFAOYSA-N 1 1 370.840 2.907 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001534856215 1069693064 /nfs/dbraw/zinc/69/30/64/1069693064.db2.gz AJBRGQFJWFFFCJ-YOEHRIQHSA-N 1 1 368.437 2.796 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842620099 1030835812 /nfs/dbraw/zinc/83/58/12/1030835812.db2.gz YRTATGJDMZCBII-CVEARBPZSA-N 1 1 374.441 2.685 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)Cn1ccc([N+](=O)[O-])n1 ZINC000797338983 1031074298 /nfs/dbraw/zinc/07/42/98/1031074298.db2.gz GUAFQNPSOBSALF-MRXNPFEDSA-N 1 1 372.425 2.635 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)Nc2ccccn2)C1 ZINC000797518478 1031143772 /nfs/dbraw/zinc/14/37/72/1031143772.db2.gz GICQPQZNHRYRCV-HNNXBMFYSA-N 1 1 370.409 2.849 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1 ZINC001204640316 1031397056 /nfs/dbraw/zinc/39/70/56/1031397056.db2.gz HORXICALXPDIKY-ZDUSSCGKSA-N 1 1 366.414 2.864 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Cl)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001149932973 1031621572 /nfs/dbraw/zinc/62/15/72/1031621572.db2.gz UHUAVHMJRBZEGO-AWEZNQCLSA-N 1 1 361.785 2.741 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196600 1031694648 /nfs/dbraw/zinc/69/46/48/1031694648.db2.gz UHTKJMFHXMEGPV-KSSFIOAISA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196600 1031694653 /nfs/dbraw/zinc/69/46/53/1031694653.db2.gz UHTKJMFHXMEGPV-KSSFIOAISA-N 1 1 352.394 2.585 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](CC(C)(C)O)C1 ZINC001218713956 1033296926 /nfs/dbraw/zinc/29/69/26/1033296926.db2.gz RPPVSFKTJCQIHR-NSHDSACASA-N 1 1 370.837 2.523 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830189217 1033501741 /nfs/dbraw/zinc/50/17/41/1033501741.db2.gz BZTABLROWSTWDL-MELADBBJSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](C)CN1C(=O)OC(C)(C)C ZINC000830189217 1033501746 /nfs/dbraw/zinc/50/17/46/1033501746.db2.gz BZTABLROWSTWDL-MELADBBJSA-N 1 1 367.450 2.510 20 5 FFBDMO COc1cc(CO[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])cc1OC ZINC001223907638 1033639678 /nfs/dbraw/zinc/63/96/78/1033639678.db2.gz ULAMXUKDXLRTFV-MCBXIFIFSA-N 1 1 350.415 2.859 20 5 FFBDMO CC[N@@H+]1CC[C@@H](Oc2ccc([N+](=O)[O-])cc2I)C1 ZINC001226034396 1034499688 /nfs/dbraw/zinc/49/96/88/1034499688.db2.gz UAZAONURWFOJHB-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2ccc([N+](=O)[O-])cc2I)C1 ZINC001226034396 1034499697 /nfs/dbraw/zinc/49/96/97/1034499697.db2.gz UAZAONURWFOJHB-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO CC(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc4ccc5cccnc5c4n3)C[C@H]21 ZINC001232222781 1035503566 /nfs/dbraw/zinc/50/35/66/1035503566.db2.gz QNMHWZGOLFPJOG-WGMWDUQUSA-N 1 1 360.461 2.985 20 5 FFBDMO COC(=O)C1=C[C@H](Oc2ccccc2[N+](=O)[O-])C[N@H+](Cc2ccccc2)C1 ZINC001227483949 1035576255 /nfs/dbraw/zinc/57/62/55/1035576255.db2.gz FVMYHMRQWRCPGN-KRWDZBQOSA-N 1 1 368.389 2.957 20 5 FFBDMO COC(=O)C1=C[C@H](Oc2ccccc2[N+](=O)[O-])C[N@@H+](Cc2ccccc2)C1 ZINC001227483949 1035576261 /nfs/dbraw/zinc/57/62/61/1035576261.db2.gz FVMYHMRQWRCPGN-KRWDZBQOSA-N 1 1 368.389 2.957 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227515534 1035593254 /nfs/dbraw/zinc/59/32/54/1035593254.db2.gz LSGDOUXCTDDICN-LLVKDONJSA-N 1 1 362.411 2.777 20 5 FFBDMO COC(=O)c1cccc(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227896014 1035792756 /nfs/dbraw/zinc/79/27/56/1035792756.db2.gz DVALRZJQGJAYER-UONOGXRCSA-N 1 1 371.393 2.991 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2ccc([N+](=O)[O-])c(I)c2)C1 ZINC001227992476 1035856730 /nfs/dbraw/zinc/85/67/30/1035856730.db2.gz RJMRFJFPPDPGIC-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO C[N@@H+]1CCO[C@H](COc2c3ccccc3c(O)c3c(O)ccc(O)c23)C1 ZINC001228169703 1035971501 /nfs/dbraw/zinc/97/15/01/1035971501.db2.gz BLYMIXDQNKJENH-LBPRGKRZSA-N 1 1 355.390 2.819 20 5 FFBDMO C[N@H+]1CCO[C@H](COc2c3ccccc3c(O)c3c(O)ccc(O)c23)C1 ZINC001228169703 1035971524 /nfs/dbraw/zinc/97/15/24/1035971524.db2.gz BLYMIXDQNKJENH-LBPRGKRZSA-N 1 1 355.390 2.819 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1cc(Br)cnc1[N+](=O)[O-] ZINC001229562318 1036746131 /nfs/dbraw/zinc/74/61/31/1036746131.db2.gz FNGDOTWLUIOQIO-DDFAGTSDSA-N 1 1 356.220 2.861 20 5 FFBDMO O=[N+]([O-])c1c[nH]cc2nc(O[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)nc1-2 ZINC001230230187 1037163015 /nfs/dbraw/zinc/16/30/15/1037163015.db2.gz MCJMFANLDJRMSU-CQSZACIVSA-N 1 1 353.382 2.910 20 5 FFBDMO COc1cc(N2CCC([N@H+]3Cc4ccncc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099748 1038385018 /nfs/dbraw/zinc/38/50/18/1038385018.db2.gz WGIRVZGTDSKAED-UHFFFAOYSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H](N4CCCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256099901 1038385430 /nfs/dbraw/zinc/38/54/30/1038385430.db2.gz ZKJYLUZFTWCAOI-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@H]([NH+]4CCCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256099901 1038385440 /nfs/dbraw/zinc/38/54/40/1038385440.db2.gz ZKJYLUZFTWCAOI-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO Cc1ccc(Cc2nnc(CC[NH+]3C[C@@H](C)O[C@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258092020 1039165933 /nfs/dbraw/zinc/16/59/33/1039165933.db2.gz PXFKHZGOPQSVIF-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO COc1ncc(Nc2ccc(N3CC[NH+](C)CC3)c(F)c2)cc1[N+](=O)[O-] ZINC001210138918 1039402540 /nfs/dbraw/zinc/40/25/40/1039402540.db2.gz RUCOOCLEMUXREM-UHFFFAOYSA-N 1 1 361.377 2.633 20 5 FFBDMO C[NH+]1CCN(Cc2nc(-c3ccc4ccc5cccnc5c4n3)no2)CC1 ZINC001247792839 1039953647 /nfs/dbraw/zinc/95/36/47/1039953647.db2.gz XYJJWVFCFZSBEZ-UHFFFAOYSA-N 1 1 360.421 2.580 20 5 FFBDMO Cc1c(Nc2c[nH+]ccc2N2CCN(C)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001211291519 1040063454 /nfs/dbraw/zinc/06/34/54/1040063454.db2.gz HEMYMUHAWYXRQX-UHFFFAOYSA-N 1 1 372.385 2.702 20 5 FFBDMO CN(C)c1ccc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC001248210520 1040173866 /nfs/dbraw/zinc/17/38/66/1040173866.db2.gz QKYZPZJBAPOXSF-INIZCTEOSA-N 1 1 353.382 2.953 20 5 FFBDMO COc1ncc(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)cc1C ZINC001248212529 1040174530 /nfs/dbraw/zinc/17/45/30/1040174530.db2.gz TTWUUWCDLQBJHP-AWEZNQCLSA-N 1 1 355.354 2.599 20 5 FFBDMO C[N@@H+](CCc1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)Cc1ccccc1 ZINC001248346131 1040239782 /nfs/dbraw/zinc/23/97/82/1040239782.db2.gz JSTNXDPQVOUKFV-UHFFFAOYSA-N 1 1 357.345 2.853 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479890 1040744757 /nfs/dbraw/zinc/74/47/57/1040744757.db2.gz PFXNHPWZAAPREY-HUUCEWRRSA-N 1 1 361.442 2.695 20 5 FFBDMO Cc1noc(C[C@@H]2C[C@H]3C[N@H+]([C@@H](C)Cc4ccccc4[N+](=O)[O-])C[C@H]3O2)n1 ZINC001254559479 1040798065 /nfs/dbraw/zinc/79/80/65/1040798065.db2.gz YCZIQSSZCPURCD-VYSRMENRSA-N 1 1 372.425 2.549 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(CCc2ccncc2)CC1 ZINC001254562143 1040798822 /nfs/dbraw/zinc/79/88/22/1040798822.db2.gz JXXRADFWCOODQA-KRWDZBQOSA-N 1 1 354.454 2.781 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(Cl)nn2)CC1 ZINC001254563644 1040799871 /nfs/dbraw/zinc/79/98/71/1040799871.db2.gz ACPAUFGPZACRIH-CYBMUJFWSA-N 1 1 361.833 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH2+]Cc1nccc(OCC(F)(F)F)n1)C2 ZINC001254596389 1040824511 /nfs/dbraw/zinc/82/45/11/1040824511.db2.gz CXNVAAMPEOFQTA-LBPRGKRZSA-N 1 1 368.315 2.583 20 5 FFBDMO O=C(c1ccco1)N1C[C@H]2C[C@@H](C1)[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597389 1040827380 /nfs/dbraw/zinc/82/73/80/1040827380.db2.gz DBOVDLIWQNRZGG-XWIAVFTESA-N 1 1 367.405 2.502 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)N1CCCCC1 ZINC001254601382 1040832279 /nfs/dbraw/zinc/83/22/79/1040832279.db2.gz ZATBEAMGWYOION-APWZRJJASA-N 1 1 357.454 2.787 20 5 FFBDMO CCOC(=O)c1nc2c(s1)C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254607582 1040834890 /nfs/dbraw/zinc/83/48/90/1040834890.db2.gz LESKUDLNHKNACP-AWEZNQCLSA-N 1 1 373.434 2.754 20 5 FFBDMO CCOC(=O)c1nc2c(s1)C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254607582 1040834896 /nfs/dbraw/zinc/83/48/96/1040834896.db2.gz LESKUDLNHKNACP-AWEZNQCLSA-N 1 1 373.434 2.754 20 5 FFBDMO Cc1cncnc1O[C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612417 1040842067 /nfs/dbraw/zinc/84/20/67/1040842067.db2.gz WEDBVAWMABQSAQ-QZTJIDSGSA-N 1 1 354.410 2.704 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)[C@H]2C1 ZINC001262826960 1041880624 /nfs/dbraw/zinc/88/06/24/1041880624.db2.gz UFBXPGHMMCGYMV-JBLDHEPKSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@H+](C2CCCC2)[C@@H](C)C1 ZINC001309860262 1043561090 /nfs/dbraw/zinc/56/10/90/1043561090.db2.gz QHYRLGCZHYCKIG-AWEZNQCLSA-N 1 1 367.471 2.541 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@@H+](C2CCCC2)[C@@H](C)C1 ZINC001309860262 1043561097 /nfs/dbraw/zinc/56/10/97/1043561097.db2.gz QHYRLGCZHYCKIG-AWEZNQCLSA-N 1 1 367.471 2.541 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]Cc2ccccc2Cl)CC1 ZINC001318885074 1044923921 /nfs/dbraw/zinc/92/39/21/1044923921.db2.gz GBMLHZONVAAAKO-NVXWUHKLSA-N 1 1 365.861 2.724 20 5 FFBDMO O=C(NC1CC1)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001319559280 1045194766 /nfs/dbraw/zinc/19/47/66/1045194766.db2.gz ZRDDNMXHWNXBMV-AWEZNQCLSA-N 1 1 370.409 2.740 20 5 FFBDMO O=C(NC1CC1)[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001319559280 1045194771 /nfs/dbraw/zinc/19/47/71/1045194771.db2.gz ZRDDNMXHWNXBMV-AWEZNQCLSA-N 1 1 370.409 2.740 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC001319572170 1045199170 /nfs/dbraw/zinc/19/91/70/1045199170.db2.gz LQPYDBACRGDYRR-SJLPKXTDSA-N 1 1 372.400 2.979 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NC2CC2)C1 ZINC001318293171 1045264451 /nfs/dbraw/zinc/26/44/51/1045264451.db2.gz DZXZZLVIXWYXJG-CQSZACIVSA-N 1 1 361.442 2.873 20 5 FFBDMO C[N@@H+](CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1)CC1CC(C)(C)C1 ZINC001319876062 1045290988 /nfs/dbraw/zinc/29/09/88/1045290988.db2.gz FTGPJUZQWKKHAP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO C[N@H+](CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CC(C)(C)C1 ZINC001319876062 1045290991 /nfs/dbraw/zinc/29/09/91/1045290991.db2.gz FTGPJUZQWKKHAP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO C[N@@H+](CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CC(C)(C)C1 ZINC001319876062 1045290996 /nfs/dbraw/zinc/29/09/96/1045290996.db2.gz FTGPJUZQWKKHAP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC001322269699 1046021766 /nfs/dbraw/zinc/02/17/66/1046021766.db2.gz LWJJOXFZYWVMCN-UHFFFAOYSA-N 1 1 353.378 2.989 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC001327616176 1047969854 /nfs/dbraw/zinc/96/98/54/1047969854.db2.gz LDXRVPZGHORAEE-KRWDZBQOSA-N 1 1 362.474 2.571 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001291679078 1048813591 /nfs/dbraw/zinc/81/35/91/1048813591.db2.gz WTSHNMZJZMZXET-UHFFFAOYSA-N 1 1 372.772 2.972 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC001333311235 1048828476 /nfs/dbraw/zinc/82/84/76/1048828476.db2.gz GITLHQGWESPQCH-GDBMZVCRSA-N 1 1 351.834 2.924 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ncc([N+](=O)[O-])c3ccccc23)CC1 ZINC001331140061 1049484995 /nfs/dbraw/zinc/48/49/95/1049484995.db2.gz JUTBYPDRVOLIBU-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001341035325 1051372628 /nfs/dbraw/zinc/37/26/28/1051372628.db2.gz IWEIDFQNHAAFLT-MRXNPFEDSA-N 1 1 356.430 2.536 20 5 FFBDMO CCn1c([C@H]2CCC[N@H+]2C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001341035325 1051372631 /nfs/dbraw/zinc/37/26/31/1051372631.db2.gz IWEIDFQNHAAFLT-MRXNPFEDSA-N 1 1 356.430 2.536 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+](CCO)CC2CC2)o1 ZINC001307748809 1052344192 /nfs/dbraw/zinc/34/41/92/1052344192.db2.gz QJIFRFDTWQQOHB-UHFFFAOYSA-N 1 1 352.778 2.503 20 5 FFBDMO C[C@H]1CCC[C@@H](C[N@@H+](C)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001307851206 1052357295 /nfs/dbraw/zinc/35/72/95/1052357295.db2.gz MKCMRTSWOQVGEZ-LSDHHAIUSA-N 1 1 369.487 2.631 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001307986406 1052376778 /nfs/dbraw/zinc/37/67/78/1052376778.db2.gz GGPADQXMNNINOX-KGLIPLIRSA-N 1 1 365.430 2.961 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001308081440 1052402386 /nfs/dbraw/zinc/40/23/86/1052402386.db2.gz KVWCYUWSVFYLAN-ZYHUDNBSSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001308081440 1052402387 /nfs/dbraw/zinc/40/23/87/1052402387.db2.gz KVWCYUWSVFYLAN-ZYHUDNBSSA-N 1 1 371.231 2.988 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO ZINC001308140013 1052415622 /nfs/dbraw/zinc/41/56/22/1052415622.db2.gz IXTRLTFLSGXLDB-HUUCEWRRSA-N 1 1 374.268 2.933 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001308152612 1052418815 /nfs/dbraw/zinc/41/88/15/1052418815.db2.gz GHSSKWBBLFJQMN-ZDUSSCGKSA-N 1 1 358.398 2.986 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3cc(O)ccc3C2)c([N+](=O)[O-])c1 ZINC001308171080 1052425122 /nfs/dbraw/zinc/42/51/22/1052425122.db2.gz PPFRCNOKVXVVQJ-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cn2c(n1)CCCC2 ZINC001345775391 1052608280 /nfs/dbraw/zinc/60/82/80/1052608280.db2.gz IBNBWSYHJKFIMQ-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cn2c(n1)CCCC2 ZINC001345775391 1052608283 /nfs/dbraw/zinc/60/82/83/1052608283.db2.gz IBNBWSYHJKFIMQ-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001345925566 1052673518 /nfs/dbraw/zinc/67/35/18/1052673518.db2.gz UGOXXYGAUGYNAB-OLZOCXBDSA-N 1 1 362.382 2.540 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c1F ZINC001336519735 1054040318 /nfs/dbraw/zinc/04/03/18/1054040318.db2.gz LFKVPSFEWFSJDB-CYBMUJFWSA-N 1 1 361.348 2.968 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(C[C@]1(O)CC[N@@H+](Cc3ccccc3)C1)C2 ZINC001336769830 1054210321 /nfs/dbraw/zinc/21/03/21/1054210321.db2.gz DWQRLDUAHFDQJP-FQEVSTJZSA-N 1 1 353.422 2.547 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@@H]2C1 ZINC001337834524 1055047511 /nfs/dbraw/zinc/04/75/11/1055047511.db2.gz PPBQMVYJPSBEAS-KDDOJWQBSA-N 1 1 358.225 2.972 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC4(CCCCO4)CC3)n2)cc1 ZINC001349936678 1055548863 /nfs/dbraw/zinc/54/88/63/1055548863.db2.gz AVRGJVANFDEQCL-UHFFFAOYSA-N 1 1 357.414 2.846 20 5 FFBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCCO1 ZINC001339476545 1056492552 /nfs/dbraw/zinc/49/25/52/1056492552.db2.gz YZOAATGQRPDKSE-UONOGXRCSA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@H](CCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)[N@@H+](C)Cc1ccccc1 ZINC001545281173 1071757425 /nfs/dbraw/zinc/75/74/25/1071757425.db2.gz LAEUOANFDIZWGP-LLVKDONJSA-N 1 1 365.821 2.612 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175129 1058487906 /nfs/dbraw/zinc/48/79/06/1058487906.db2.gz MGWDXLNTBBRXBT-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001446175129 1058487916 /nfs/dbraw/zinc/48/79/16/1058487916.db2.gz MGWDXLNTBBRXBT-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC001446876523 1058567235 /nfs/dbraw/zinc/56/72/35/1058567235.db2.gz ASZMQHQSRFOHSX-GJZGRUSLSA-N 1 1 351.834 2.924 20 5 FFBDMO C[C@H](C(=O)OC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC001520069485 1059374438 /nfs/dbraw/zinc/37/44/38/1059374438.db2.gz RAYRNTCJXCILSU-SWLSCSKDSA-N 1 1 366.389 2.634 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C[C@@H]1C ZINC001515904464 1059872482 /nfs/dbraw/zinc/87/24/82/1059872482.db2.gz IYSNAADYBAFZJJ-ZDUSSCGKSA-N 1 1 356.430 2.719 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000848488180 1060136085 /nfs/dbraw/zinc/13/60/85/1060136085.db2.gz CCYFLEWDXXQJRW-IEBWSBKVSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOC[C@H](C2CCC2)C1 ZINC000848488180 1060136095 /nfs/dbraw/zinc/13/60/95/1060136095.db2.gz CCYFLEWDXXQJRW-IEBWSBKVSA-N 1 1 373.453 2.617 20 5 FFBDMO Nc1nc(N[C@H]2CCCCC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001458536589 1060615731 /nfs/dbraw/zinc/61/57/31/1060615731.db2.gz PBBJGTOEDRAMDF-HNNXBMFYSA-N 1 1 356.430 2.824 20 5 FFBDMO CC[N@H+]1[C@H](C)CN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C[C@@H]1C ZINC001458555809 1060623849 /nfs/dbraw/zinc/62/38/49/1060623849.db2.gz JNKHZWIIIKLKSG-PHIMTYICSA-N 1 1 355.822 2.954 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C[C@@H]1C ZINC001458555809 1060623857 /nfs/dbraw/zinc/62/38/57/1060623857.db2.gz JNKHZWIIIKLKSG-PHIMTYICSA-N 1 1 355.822 2.954 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1C[C@@H](C)OC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001459353116 1060749117 /nfs/dbraw/zinc/74/91/17/1060749117.db2.gz GGMWJKVGTUXTJQ-OAHLLOKOSA-N 1 1 363.458 2.831 20 5 FFBDMO CC(C)[N@@H+](CC(=O)N1C[C@@H](C)OC(C)(C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001459353116 1060749128 /nfs/dbraw/zinc/74/91/28/1060749128.db2.gz GGMWJKVGTUXTJQ-OAHLLOKOSA-N 1 1 363.458 2.831 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C(C)(C)CC1 ZINC001460652644 1061049012 /nfs/dbraw/zinc/04/90/12/1061049012.db2.gz VENOACZFSKZKQA-UHFFFAOYSA-N 1 1 367.450 2.513 20 5 FFBDMO Cc1cc(NC(=O)NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001477213261 1061628784 /nfs/dbraw/zinc/62/87/84/1061628784.db2.gz ZZZUHDAKMVZCGM-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc(NC(=O)NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001477213261 1061628795 /nfs/dbraw/zinc/62/87/95/1061628795.db2.gz ZZZUHDAKMVZCGM-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO C[C@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000774596803 1062076569 /nfs/dbraw/zinc/07/65/69/1062076569.db2.gz LNUYQQDDYIUSCK-LRDDRELGSA-N 1 1 370.365 2.959 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC001522551167 1062208531 /nfs/dbraw/zinc/20/85/31/1062208531.db2.gz PHWQDWQERHOZRK-BJJXKVORSA-N 1 1 351.834 2.637 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC001464147772 1062449409 /nfs/dbraw/zinc/44/94/09/1062449409.db2.gz PFFCRKJYMHUVTG-UHFFFAOYSA-N 1 1 357.476 2.610 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)no1 ZINC001435685459 1062540152 /nfs/dbraw/zinc/54/01/52/1062540152.db2.gz PUGJBLUKKQESBZ-UHFFFAOYSA-N 1 1 358.276 2.916 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001439109913 1063093704 /nfs/dbraw/zinc/09/37/04/1063093704.db2.gz HCGFRKRJFSLQFC-UZLBHIALSA-N 1 1 368.437 2.527 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc(C)n1)[N@H+]1CCc2ccccc2C1 ZINC001441242269 1063414484 /nfs/dbraw/zinc/41/44/84/1063414484.db2.gz PWKDELZYQYSKFY-KRWDZBQOSA-N 1 1 368.437 2.865 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001496114235 1063585356 /nfs/dbraw/zinc/58/53/56/1063585356.db2.gz AICOUIAREKEDSP-HNNXBMFYSA-N 1 1 374.489 2.904 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@H]2C1 ZINC001467070990 1063629446 /nfs/dbraw/zinc/62/94/46/1063629446.db2.gz ZURZCCPDJRVEFR-HZUKXOBISA-N 1 1 355.398 2.605 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777727 1064449324 /nfs/dbraw/zinc/44/93/24/1064449324.db2.gz MANFZIOZHUQHMR-LIRRHRJNSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777727 1064449335 /nfs/dbraw/zinc/44/93/35/1064449335.db2.gz MANFZIOZHUQHMR-LIRRHRJNSA-N 1 1 369.421 2.941 20 5 FFBDMO C[N@@H+](CCNc1c2ccc(Br)cc2ncc1[N+](=O)[O-])C1CC1 ZINC001472670627 1065124419 /nfs/dbraw/zinc/12/44/19/1065124419.db2.gz IGAUFHLDNMOYOR-UHFFFAOYSA-N 1 1 365.231 2.834 20 5 FFBDMO CC(=O)NC1CCC([N@@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001473372972 1065250819 /nfs/dbraw/zinc/25/08/19/1065250819.db2.gz LIDMQMPYJZTOSB-UHFFFAOYSA-N 1 1 373.413 2.524 20 5 FFBDMO C[C@](CO)([NH2+]CC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC001473714625 1065330019 /nfs/dbraw/zinc/33/00/19/1065330019.db2.gz VUHWHJSRWLEGTL-QGZVFWFLSA-N 1 1 363.801 2.684 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CN1CC1CC1 ZINC001474684116 1065579243 /nfs/dbraw/zinc/57/92/43/1065579243.db2.gz SOLZNLQEBZOQRQ-CYBMUJFWSA-N 1 1 357.332 2.714 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2N)cc1F ZINC001583162923 1079172712 /nfs/dbraw/zinc/17/27/12/1079172712.db2.gz MCRDRWKDTBRVEP-UHFFFAOYSA-N 1 1 369.356 2.740 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC001558018202 1075929153 /nfs/dbraw/zinc/92/91/53/1075929153.db2.gz ATPFKTLZMOSSJH-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@@H](O)C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@@H](C)C1 ZINC001563396349 1076550627 /nfs/dbraw/zinc/55/06/27/1076550627.db2.gz UMXGCKZEIZTPPA-UONOGXRCSA-N 1 1 372.425 2.667 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@@H](C)C1 ZINC001563396349 1076550630 /nfs/dbraw/zinc/55/06/30/1076550630.db2.gz UMXGCKZEIZTPPA-UONOGXRCSA-N 1 1 372.425 2.667 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccccc2Cl)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001568235541 1077079559 /nfs/dbraw/zinc/07/95/59/1077079559.db2.gz QKNPUEKBNFQKET-UKRRQHHQSA-N 1 1 351.834 2.524 20 5 FFBDMO CC1([NH2+]CCC2CCCCCC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570373024 1077202238 /nfs/dbraw/zinc/20/22/38/1077202238.db2.gz HFTPLGPXZJRRMD-IAGOWNOFSA-N 1 1 351.491 2.983 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590226602 1081106851 /nfs/dbraw/zinc/10/68/51/1081106851.db2.gz DMHWNHPAEUULGD-VNHYZAJKSA-N 1 1 371.445 2.617 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C(N)=O)CCCC1 ZINC000093211629 250024577 /nfs/dbraw/zinc/02/45/77/250024577.db2.gz OLOCMHLVIVWDTO-UHFFFAOYSA-N 1 1 358.398 2.522 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000106891575 250297436 /nfs/dbraw/zinc/29/74/36/250297436.db2.gz DABJBDNIDGFLBM-LBPRGKRZSA-N 1 1 373.862 2.543 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@H](O)c2nccn2C)C1 ZINC000131949664 251032191 /nfs/dbraw/zinc/03/21/91/251032191.db2.gz SJOKRMKIXGNPJR-KSSFIOAISA-N 1 1 374.441 2.673 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000132097218 251044735 /nfs/dbraw/zinc/04/47/35/251044735.db2.gz MAMZGKLOWLGENO-NSHDSACASA-N 1 1 364.320 2.765 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000132097218 251044740 /nfs/dbraw/zinc/04/47/40/251044740.db2.gz MAMZGKLOWLGENO-NSHDSACASA-N 1 1 364.320 2.765 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)C2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000192571676 251290297 /nfs/dbraw/zinc/29/02/97/251290297.db2.gz CMEBEWVNHQQVEP-UHFFFAOYSA-N 1 1 371.441 2.617 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000272465976 252045691 /nfs/dbraw/zinc/04/56/91/252045691.db2.gz HPGXGZIUZJQBKJ-IUODEOHRSA-N 1 1 368.865 2.915 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272493740 252051750 /nfs/dbraw/zinc/05/17/50/252051750.db2.gz FINBPQBHNFXJQE-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272697277 252106874 /nfs/dbraw/zinc/10/68/74/252106874.db2.gz YATUKULQLRCZTN-YGRLFVJLSA-N 1 1 368.231 2.524 20 5 FFBDMO COc1ccccc1[C@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000272978422 252180947 /nfs/dbraw/zinc/18/09/47/252180947.db2.gz XMARACWZIFLFIJ-ZDUSSCGKSA-N 1 1 364.423 2.728 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000272987484 252183525 /nfs/dbraw/zinc/18/35/25/252183525.db2.gz FANYNWQPBAEGOE-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000272987484 252183527 /nfs/dbraw/zinc/18/35/27/252183527.db2.gz FANYNWQPBAEGOE-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO COc1cc(C[N@@H+](CCO)C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275907104 256058190 /nfs/dbraw/zinc/05/81/90/256058190.db2.gz WFPFXWJPZMZAHJ-UHFFFAOYSA-N 1 1 360.357 2.594 20 5 FFBDMO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@]1=O ZINC000277305708 256182508 /nfs/dbraw/zinc/18/25/08/256182508.db2.gz UKXJSCDRORFKEX-YMXBGEKHSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@]1=O ZINC000277305708 256182509 /nfs/dbraw/zinc/18/25/09/256182509.db2.gz UKXJSCDRORFKEX-YMXBGEKHSA-N 1 1 363.439 2.635 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000278503161 256320055 /nfs/dbraw/zinc/32/00/55/256320055.db2.gz DFSFJWKYBRMDRU-UHFFFAOYSA-N 1 1 355.394 2.911 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000278322109 256299389 /nfs/dbraw/zinc/29/93/89/256299389.db2.gz AIDRXABLIJKQFZ-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000279227657 256395219 /nfs/dbraw/zinc/39/52/19/256395219.db2.gz ONKJXKJYHCCGIP-UHFFFAOYSA-N 1 1 372.400 2.583 20 5 FFBDMO NC(=O)c1ccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])c1 ZINC000281780923 256663795 /nfs/dbraw/zinc/66/37/95/256663795.db2.gz DVDSLFHWSMLRKJ-AWEZNQCLSA-N 1 1 369.425 2.611 20 5 FFBDMO COc1cc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000285876398 257009016 /nfs/dbraw/zinc/00/90/16/257009016.db2.gz QYSRBBISUSKTCZ-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)N2CCCC2)C1 ZINC000287623134 257099316 /nfs/dbraw/zinc/09/93/16/257099316.db2.gz ZXADYMZIWGLOPK-HNNXBMFYSA-N 1 1 361.442 2.826 20 5 FFBDMO CCc1nn(C)c(NCc2cccc(C[N@@H+]3CCO[C@H](C)C3)c2)c1[N+](=O)[O-] ZINC000288278944 257169557 /nfs/dbraw/zinc/16/95/57/257169557.db2.gz ZVMKFKCQAXKQEU-CQSZACIVSA-N 1 1 373.457 2.724 20 5 FFBDMO CCc1nn(C)c(NCc2cccc(C[N@H+]3CCO[C@H](C)C3)c2)c1[N+](=O)[O-] ZINC000288278944 257169559 /nfs/dbraw/zinc/16/95/59/257169559.db2.gz ZVMKFKCQAXKQEU-CQSZACIVSA-N 1 1 373.457 2.724 20 5 FFBDMO CC[NH+](CC)[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000294844564 257605189 /nfs/dbraw/zinc/60/51/89/257605189.db2.gz FDIZFDVOQVNQFU-HNNXBMFYSA-N 1 1 357.414 2.541 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000298698222 257933991 /nfs/dbraw/zinc/93/39/91/257933991.db2.gz ZSKUUYKHUGMLKW-HZPDHXFCSA-N 1 1 363.414 2.575 20 5 FFBDMO O=c1[nH]cnc2cc(NCC[N@H+]3CCc4ccccc4C3)c([N+](=O)[O-])cc21 ZINC000301059606 258022369 /nfs/dbraw/zinc/02/23/69/258022369.db2.gz DDQMVPZOADXGOI-UHFFFAOYSA-N 1 1 365.393 2.714 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000301075350 258023164 /nfs/dbraw/zinc/02/31/64/258023164.db2.gz GDEXBDKDABDXTP-NSHDSACASA-N 1 1 352.391 2.590 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000301121336 258026797 /nfs/dbraw/zinc/02/67/97/258026797.db2.gz WUTCWOYMYFXZFH-HNNXBMFYSA-N 1 1 369.425 2.555 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ccc(F)cc1[N+](=O)[O-] ZINC000301306579 258041586 /nfs/dbraw/zinc/04/15/86/258041586.db2.gz YYIJJCJFECNROO-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])C[C@H]2C1 ZINC000302861024 258112806 /nfs/dbraw/zinc/11/28/06/258112806.db2.gz PHZINMPTCGOYFZ-CALCHBBNSA-N 1 1 351.406 2.824 20 5 FFBDMO Cc1nn(C)c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)c1[N+](=O)[O-] ZINC000312058467 258115670 /nfs/dbraw/zinc/11/56/70/258115670.db2.gz GSQSCKPGJXWNCR-IRXDYDNUSA-N 1 1 355.442 2.595 20 5 FFBDMO C[C@@H](CNc1cc(Br)ccc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000301678290 258062789 /nfs/dbraw/zinc/06/27/89/258062789.db2.gz QWOSABPKEHVHRG-NSHDSACASA-N 1 1 358.236 2.738 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301891178 258072881 /nfs/dbraw/zinc/07/28/81/258072881.db2.gz ODDXHMQAIXQSFB-ZDUSSCGKSA-N 1 1 369.487 2.921 20 5 FFBDMO C[C@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)[N@H+]1CCc2sccc2C1 ZINC000301914045 258074788 /nfs/dbraw/zinc/07/47/88/258074788.db2.gz HYBMZSHEUKHPHW-LLVKDONJSA-N 1 1 358.427 2.558 20 5 FFBDMO C[NH+](C)[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])c1ccccc1 ZINC000301921138 258075442 /nfs/dbraw/zinc/07/54/42/258075442.db2.gz XICYJJFVWOJGMQ-OAHLLOKOSA-N 1 1 363.439 2.713 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000331119958 258177608 /nfs/dbraw/zinc/17/76/08/258177608.db2.gz FXCVEMBEAGVJDX-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000332656356 258239458 /nfs/dbraw/zinc/23/94/58/258239458.db2.gz JQUOXJYLIIKZTB-AAEUAGOBSA-N 1 1 360.439 2.931 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1C ZINC000032441111 506253740 /nfs/dbraw/zinc/25/37/40/506253740.db2.gz WIKCTBIRGHGPAG-KBPBESRZSA-N 1 1 369.487 2.753 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000052862429 506268410 /nfs/dbraw/zinc/26/84/10/506268410.db2.gz KXIHUJZNKMGKKU-AWEZNQCLSA-N 1 1 373.413 2.803 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000065535855 506318559 /nfs/dbraw/zinc/31/85/59/506318559.db2.gz ALVGQXDJZXTTAF-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1 ZINC000053245455 506340558 /nfs/dbraw/zinc/34/05/58/506340558.db2.gz YABRTVCBZSCUJG-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO COC[C@H]1CCCC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000375115010 512169469 /nfs/dbraw/zinc/16/94/69/512169469.db2.gz ORWBDVOITXAUEA-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000375115010 512169474 /nfs/dbraw/zinc/16/94/74/512169474.db2.gz ORWBDVOITXAUEA-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602690553 521481319 /nfs/dbraw/zinc/48/13/19/521481319.db2.gz ODQQOELMMHBIPG-UHFFFAOYSA-N 1 1 364.265 2.876 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000366841466 512212631 /nfs/dbraw/zinc/21/26/31/512212631.db2.gz ALJQJDZQXBKYPO-KXBFYZLASA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000366841466 512212634 /nfs/dbraw/zinc/21/26/34/512212634.db2.gz ALJQJDZQXBKYPO-KXBFYZLASA-N 1 1 373.384 2.674 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000375311671 512262229 /nfs/dbraw/zinc/26/22/29/512262229.db2.gz XSFCIVVFESZROD-IBGZPJMESA-N 1 1 353.378 2.569 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000053550757 506402439 /nfs/dbraw/zinc/40/24/39/506402439.db2.gz RSVIBEFCSXLUEG-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](c1cccs1)[NH+](C)C ZINC000038629161 506440149 /nfs/dbraw/zinc/44/01/49/506440149.db2.gz BUBWQCSCFYOWLX-CYBMUJFWSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@@H](CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000041488274 506525964 /nfs/dbraw/zinc/52/59/64/506525964.db2.gz GENIVHUUFMKSFQ-CABCVRRESA-N 1 1 363.462 2.569 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000041576927 506533231 /nfs/dbraw/zinc/53/32/31/506533231.db2.gz MNVZEXMPVDPXAW-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1CCOCC1 ZINC000054328471 506538883 /nfs/dbraw/zinc/53/88/83/506538883.db2.gz BSDOGYMITUCEMO-KRWDZBQOSA-N 1 1 367.421 2.601 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000054394927 506551999 /nfs/dbraw/zinc/55/19/99/506551999.db2.gz UGRBKWALRZVELT-CYBMUJFWSA-N 1 1 360.370 2.562 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000054394927 506552004 /nfs/dbraw/zinc/55/20/04/506552004.db2.gz UGRBKWALRZVELT-CYBMUJFWSA-N 1 1 360.370 2.562 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000066868535 506673282 /nfs/dbraw/zinc/67/32/82/506673282.db2.gz VTZZFFXBXFAWFT-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000043149517 506708971 /nfs/dbraw/zinc/70/89/71/506708971.db2.gz PLUROWDBGPXVNL-KBPBESRZSA-N 1 1 364.446 2.913 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1 ZINC000067547281 506920076 /nfs/dbraw/zinc/92/00/76/506920076.db2.gz FNXVGMWESHSAIL-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000067725043 506991000 /nfs/dbraw/zinc/99/10/00/506991000.db2.gz BXRKXMDRVXILBB-KRWDZBQOSA-N 1 1 372.425 2.706 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000014920840 507004716 /nfs/dbraw/zinc/00/47/16/507004716.db2.gz FUIFIZZCLVRNKF-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000014920840 507004725 /nfs/dbraw/zinc/00/47/25/507004725.db2.gz FUIFIZZCLVRNKF-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000017479334 507125040 /nfs/dbraw/zinc/12/50/40/507125040.db2.gz SIRWSSBHYNRPNK-UHFFFAOYSA-N 1 1 355.741 2.654 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941831 507153848 /nfs/dbraw/zinc/15/38/48/507153848.db2.gz VHYVBNYIZWBSIK-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941831 507153858 /nfs/dbraw/zinc/15/38/58/507153858.db2.gz VHYVBNYIZWBSIK-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822304 507268557 /nfs/dbraw/zinc/26/85/57/507268557.db2.gz QSTXFQWUSPPZNZ-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2cc[nH+]c2C)nc1 ZINC000047385521 507318997 /nfs/dbraw/zinc/31/89/97/507318997.db2.gz ONZXURCQRLTZAF-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000068776208 507319297 /nfs/dbraw/zinc/31/92/97/507319297.db2.gz SYBJZSARKRQJRM-UHFFFAOYSA-N 1 1 371.441 2.552 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000371328813 512333749 /nfs/dbraw/zinc/33/37/49/512333749.db2.gz ZGRFKVMFUPHXBK-HZPDHXFCSA-N 1 1 356.426 2.854 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000047676918 507377323 /nfs/dbraw/zinc/37/73/23/507377323.db2.gz CHJULMWLNJDAIC-UHFFFAOYSA-N 1 1 374.444 2.866 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000058304071 507403259 /nfs/dbraw/zinc/40/32/59/507403259.db2.gz SGGJURXQQMUUJJ-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000058560553 507437176 /nfs/dbraw/zinc/43/71/76/507437176.db2.gz YPNACQFRNJBSAS-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[NH+]1CCOCC1 ZINC000048316794 507500135 /nfs/dbraw/zinc/50/01/35/507500135.db2.gz KSCGAXKZMWRLKY-OAHLLOKOSA-N 1 1 374.441 2.553 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC[N@H+](C)Cc2ccccc2)c1 ZINC000063697782 507760606 /nfs/dbraw/zinc/76/06/06/507760606.db2.gz QCNORZBGPADBSR-UHFFFAOYSA-N 1 1 371.437 2.920 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000089307124 507828252 /nfs/dbraw/zinc/82/82/52/507828252.db2.gz HWNQONKBUFVCRY-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000072632201 507833784 /nfs/dbraw/zinc/83/37/84/507833784.db2.gz ZYEBKORRBKXEGB-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000072632201 507833787 /nfs/dbraw/zinc/83/37/87/507833787.db2.gz ZYEBKORRBKXEGB-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCc3ccc4c(c3)CCO4)C2)nc1 ZINC000072665289 507840491 /nfs/dbraw/zinc/84/04/91/507840491.db2.gz NKDZEGWFHSGXHX-MRXNPFEDSA-N 1 1 354.410 2.654 20 5 FFBDMO O=C(CCN1CC[C@H](C[NH+]2CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000072720094 507847288 /nfs/dbraw/zinc/84/72/88/507847288.db2.gz CLODKSJNMAWUAP-MRXNPFEDSA-N 1 1 360.458 2.731 20 5 FFBDMO C[C@@H](NCc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000090038819 507903852 /nfs/dbraw/zinc/90/38/52/507903852.db2.gz NJNPKBNXGPKTOR-OAHLLOKOSA-N 1 1 370.453 2.737 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000091081331 507951962 /nfs/dbraw/zinc/95/19/62/507951962.db2.gz YDKMGPCGOCHWJB-INIZCTEOSA-N 1 1 369.425 2.661 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000091081331 507951964 /nfs/dbraw/zinc/95/19/64/507951964.db2.gz YDKMGPCGOCHWJB-INIZCTEOSA-N 1 1 369.425 2.661 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCN(CC(F)F)CC1 ZINC000091084216 507953099 /nfs/dbraw/zinc/95/30/99/507953099.db2.gz XRCGGVHBAXDIQE-UHFFFAOYSA-N 1 1 370.400 2.505 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000091479508 507989001 /nfs/dbraw/zinc/98/90/01/507989001.db2.gz DNQXFDSKFLVGHB-CQSZACIVSA-N 1 1 357.414 2.840 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000074326959 508012903 /nfs/dbraw/zinc/01/29/03/508012903.db2.gz GKFTWYLRNGWFQU-QGZVFWFLSA-N 1 1 374.485 2.977 20 5 FFBDMO O=C1NC[C@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000091864623 508020492 /nfs/dbraw/zinc/02/04/92/508020492.db2.gz BKEHHVQEKWCKPF-LBPRGKRZSA-N 1 1 358.423 2.533 20 5 FFBDMO O=C1NC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000091864623 508020494 /nfs/dbraw/zinc/02/04/94/508020494.db2.gz BKEHHVQEKWCKPF-LBPRGKRZSA-N 1 1 358.423 2.533 20 5 FFBDMO Cc1cc(C)cc(C2=CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)c1 ZINC000092427360 508070339 /nfs/dbraw/zinc/07/03/39/508070339.db2.gz QLEIYLLKAQLDDC-LJQANCHMSA-N 1 1 356.426 2.558 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)C1 ZINC000080641000 508091240 /nfs/dbraw/zinc/09/12/40/508091240.db2.gz AMPFPOQBDYQXMC-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO C[C@@H](c1cccnc1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000093226768 508129418 /nfs/dbraw/zinc/12/94/18/508129418.db2.gz XSPPZFCKFPRJLT-ZDUSSCGKSA-N 1 1 356.382 2.981 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000081128605 508141298 /nfs/dbraw/zinc/14/12/98/508141298.db2.gz AHDARXLHQWNPLE-KRWDZBQOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCN1C(=O)c2ccccc2C1=O ZINC000093837773 508157156 /nfs/dbraw/zinc/15/71/56/508157156.db2.gz ASFVNRFSKGLDTH-SOFGYWHQSA-N 1 1 365.389 2.836 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081631509 508199528 /nfs/dbraw/zinc/19/95/28/508199528.db2.gz HRUBWGCKETZPAX-GDBMZVCRSA-N 1 1 360.458 2.586 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000112699746 508210431 /nfs/dbraw/zinc/21/04/31/508210431.db2.gz ZMTREGAVZRIVTI-HNNXBMFYSA-N 1 1 363.458 2.848 20 5 FFBDMO Cc1nn(Cc2ccc(C(=O)NCC[N@H+](C)C(C)C)cc2)c(C)c1[N+](=O)[O-] ZINC000101955091 508261823 /nfs/dbraw/zinc/26/18/23/508261823.db2.gz FFRIGPGDRUMPFB-UHFFFAOYSA-N 1 1 373.457 2.526 20 5 FFBDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000084131913 508266089 /nfs/dbraw/zinc/26/60/89/508266089.db2.gz YFGLDJJDNFEKDC-KRWDZBQOSA-N 1 1 354.414 2.998 20 5 FFBDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000084131913 508266093 /nfs/dbraw/zinc/26/60/93/508266093.db2.gz YFGLDJJDNFEKDC-KRWDZBQOSA-N 1 1 354.414 2.998 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000077905413 508390835 /nfs/dbraw/zinc/39/08/35/508390835.db2.gz SWIHHEMBYOMPGL-MRXNPFEDSA-N 1 1 370.409 2.660 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000077905413 508390836 /nfs/dbraw/zinc/39/08/36/508390836.db2.gz SWIHHEMBYOMPGL-MRXNPFEDSA-N 1 1 370.409 2.660 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115640205 508420362 /nfs/dbraw/zinc/42/03/62/508420362.db2.gz OQWYIBLHSJJRCO-PBHICJAKSA-N 1 1 364.446 2.853 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC2)c1 ZINC000153017216 508540330 /nfs/dbraw/zinc/54/03/30/508540330.db2.gz GGWIVIAXTXUXMI-UHFFFAOYSA-N 1 1 366.381 2.675 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116718077 508550318 /nfs/dbraw/zinc/55/03/18/508550318.db2.gz SQCOIQMAZGQZAK-ZDUSSCGKSA-N 1 1 355.822 2.618 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000135651905 508636976 /nfs/dbraw/zinc/63/69/76/508636976.db2.gz LVWCPBBCODDADC-QGZVFWFLSA-N 1 1 371.441 2.975 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000153761402 508643850 /nfs/dbraw/zinc/64/38/50/508643850.db2.gz CMQABHQBRSROBL-CYBMUJFWSA-N 1 1 363.414 2.505 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@H](C)[C@H]1C ZINC000118415716 508650349 /nfs/dbraw/zinc/65/03/49/508650349.db2.gz DAXZMQJOJIKWGS-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO CC(C)CO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128902782 508657436 /nfs/dbraw/zinc/65/74/36/508657436.db2.gz AZRXBZWYKMQIJU-CQSZACIVSA-N 1 1 353.394 2.809 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841525 508683411 /nfs/dbraw/zinc/68/34/11/508683411.db2.gz PVZGBFMRTKXPRU-UONOGXRCSA-N 1 1 359.430 2.979 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000118984037 508700948 /nfs/dbraw/zinc/70/09/48/508700948.db2.gz JTPMBMGBIIHEQD-UHFFFAOYSA-N 1 1 370.453 2.694 20 5 FFBDMO CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000118984037 508700950 /nfs/dbraw/zinc/70/09/50/508700950.db2.gz JTPMBMGBIIHEQD-UHFFFAOYSA-N 1 1 370.453 2.694 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123663744 508722240 /nfs/dbraw/zinc/72/22/40/508722240.db2.gz PIQFZROUNDJUOJ-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000123663744 508722242 /nfs/dbraw/zinc/72/22/42/508722242.db2.gz PIQFZROUNDJUOJ-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000158644607 508733629 /nfs/dbraw/zinc/73/36/29/508733629.db2.gz QGNKLDZPEUEMFJ-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137431755 508756189 /nfs/dbraw/zinc/75/61/89/508756189.db2.gz YVMAOMFZVKPBQA-SWLSCSKDSA-N 1 1 372.400 2.709 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)C1 ZINC000137564573 508760121 /nfs/dbraw/zinc/76/01/21/508760121.db2.gz QLSHYUZFZHMNIZ-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000119403554 508789668 /nfs/dbraw/zinc/78/96/68/508789668.db2.gz UAXQOBSNXIIFFA-MRXNPFEDSA-N 1 1 360.458 2.701 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000139916096 508797094 /nfs/dbraw/zinc/79/70/94/508797094.db2.gz XBOHXWFQSDKPJU-WBMJQRKESA-N 1 1 366.849 2.603 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000140049957 508798993 /nfs/dbraw/zinc/79/89/93/508798993.db2.gz DXPAQWSPXZTRNV-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000140049957 508798997 /nfs/dbraw/zinc/79/89/97/508798997.db2.gz DXPAQWSPXZTRNV-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000119479632 508804272 /nfs/dbraw/zinc/80/42/72/508804272.db2.gz VYZQURLNMYVNKO-LBPRGKRZSA-N 1 1 370.247 2.880 20 5 FFBDMO CCOc1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159702383 508877374 /nfs/dbraw/zinc/87/73/74/508877374.db2.gz QXVGRGKPMWFGAS-GOSISDBHSA-N 1 1 357.410 2.992 20 5 FFBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)s1 ZINC000159848395 508899987 /nfs/dbraw/zinc/89/99/87/508899987.db2.gz GNPGRUXZOCKSKR-GFCCVEGCSA-N 1 1 350.444 2.777 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000367285857 512425163 /nfs/dbraw/zinc/42/51/63/512425163.db2.gz GSZQGFZKHWYAFO-BYICEURKSA-N 1 1 372.469 2.545 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000159902395 508909237 /nfs/dbraw/zinc/90/92/37/508909237.db2.gz ODKSCWUKCGEVHN-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000155239045 508955870 /nfs/dbraw/zinc/95/58/70/508955870.db2.gz UFZISRMOIQPULF-WMZOPIPTSA-N 1 1 372.421 2.833 20 5 FFBDMO Cc1nc2ccccn2c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000160491377 508994021 /nfs/dbraw/zinc/99/40/21/508994021.db2.gz AXKFGELEDJTTDS-CQSZACIVSA-N 1 1 352.398 2.632 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000120474640 509004063 /nfs/dbraw/zinc/00/40/63/509004063.db2.gz YFWYCUVAAHLJTM-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO C[C@@H](c1cccnc1)N1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120576867 509025107 /nfs/dbraw/zinc/02/51/07/509025107.db2.gz JZEZRJOCQMUETE-INIZCTEOSA-N 1 1 356.426 2.747 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000120576867 509025111 /nfs/dbraw/zinc/02/51/11/509025111.db2.gz JZEZRJOCQMUETE-INIZCTEOSA-N 1 1 356.426 2.747 20 5 FFBDMO Cc1c([C@H](C)NC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788244 509083531 /nfs/dbraw/zinc/08/35/31/509083531.db2.gz COTLWQBJUWKGRR-QFBILLFUSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1c([C@H](C)NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788244 509083536 /nfs/dbraw/zinc/08/35/36/509083536.db2.gz COTLWQBJUWKGRR-QFBILLFUSA-N 1 1 369.465 2.973 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2N1 ZINC000161899035 509163140 /nfs/dbraw/zinc/16/31/40/509163140.db2.gz QPWWKOWRRFKPAL-RHSMWYFYSA-N 1 1 370.453 2.933 20 5 FFBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000247922319 509191847 /nfs/dbraw/zinc/19/18/47/509191847.db2.gz BHKXMOHPAVYXME-VQIMIIECSA-N 1 1 357.410 2.875 20 5 FFBDMO CC(C)(C)OC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000162422057 509220504 /nfs/dbraw/zinc/22/05/04/509220504.db2.gz IFQVUCRNSAVPHA-UHFFFAOYSA-N 1 1 361.442 2.763 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])C2 ZINC000176053361 509298452 /nfs/dbraw/zinc/29/84/52/509298452.db2.gz IPGHZMZOVKDYFP-NWDGAFQWSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697416 509310278 /nfs/dbraw/zinc/31/02/78/509310278.db2.gz ZUKWNLUWLYRZKR-GJZGRUSLSA-N 1 1 360.458 2.776 20 5 FFBDMO CCS[C@@H]1CCCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248450150 509325809 /nfs/dbraw/zinc/32/58/09/509325809.db2.gz ILYHZCRRLAXEQV-HUUCEWRRSA-N 1 1 354.472 2.942 20 5 FFBDMO C[C@@H](C[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000248461069 509332675 /nfs/dbraw/zinc/33/26/75/509332675.db2.gz OUYCLKPUDCHDFI-WFASDCNBSA-N 1 1 360.439 2.892 20 5 FFBDMO C[C@@H](C[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000248461069 509332679 /nfs/dbraw/zinc/33/26/79/509332679.db2.gz OUYCLKPUDCHDFI-WFASDCNBSA-N 1 1 360.439 2.892 20 5 FFBDMO CCOC(=O)C[C@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000182663134 509357974 /nfs/dbraw/zinc/35/79/74/509357974.db2.gz MMMVEAXQFIAACK-ZDUSSCGKSA-N 1 1 351.403 2.505 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1SC ZINC000264221700 509392124 /nfs/dbraw/zinc/39/21/24/509392124.db2.gz WBQCHZBPDASGRZ-OLZOCXBDSA-N 1 1 365.455 2.682 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185867057 509395019 /nfs/dbraw/zinc/39/50/19/509395019.db2.gz ZJKUZQHDPDTWDC-MRXNPFEDSA-N 1 1 372.469 2.970 20 5 FFBDMO Cc1c(C(=O)Nc2cc[nH+]c(N(C)C)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000267271237 509420431 /nfs/dbraw/zinc/42/04/31/509420431.db2.gz SJLAMBGGHOXJQP-UHFFFAOYSA-N 1 1 359.342 2.833 20 5 FFBDMO Cc1ccc(C(=O)N[C@@H](C)C2([NH+]3CCOCC3)CCCC2)cc1[N+](=O)[O-] ZINC000173181663 509442287 /nfs/dbraw/zinc/44/22/87/509442287.db2.gz GMNNAQGQLKVZJB-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000182841629 509454960 /nfs/dbraw/zinc/45/49/60/509454960.db2.gz VNFJQGBDRFUPQC-NEPJUHHUSA-N 1 1 364.421 2.699 20 5 FFBDMO CC(C)C[C@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000236623742 509466217 /nfs/dbraw/zinc/46/62/17/509466217.db2.gz LCKCANAYLVHFNB-SECBINFHSA-N 1 1 370.258 2.553 20 5 FFBDMO C[C@H](NS(=O)(=O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000186075000 509511267 /nfs/dbraw/zinc/51/12/67/509511267.db2.gz GDURXNYYXWUVHB-UONOGXRCSA-N 1 1 367.471 2.526 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000237430598 509645729 /nfs/dbraw/zinc/64/57/29/509645729.db2.gz BVADFHMRPSCHPW-UHFFFAOYSA-N 1 1 354.815 2.942 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000179887407 509660775 /nfs/dbraw/zinc/66/07/75/509660775.db2.gz URLHYLKECNVCJA-INIZCTEOSA-N 1 1 358.398 2.523 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000186436809 509707569 /nfs/dbraw/zinc/70/75/69/509707569.db2.gz BPNJXOWGOMJKKJ-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO C[C@H](C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000249733974 509746605 /nfs/dbraw/zinc/74/66/05/509746605.db2.gz CTFCMQPENOWTST-OWCLPIDISA-N 1 1 360.458 2.505 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000268153869 509783558 /nfs/dbraw/zinc/78/35/58/509783558.db2.gz PCPLKOREEXVSMJ-LBPRGKRZSA-N 1 1 354.838 2.731 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180476318 509943493 /nfs/dbraw/zinc/94/34/93/509943493.db2.gz LTMGKYZULGHCIY-NSHDSACASA-N 1 1 357.357 2.800 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000180508003 509960396 /nfs/dbraw/zinc/96/03/96/509960396.db2.gz QFPAXDXNKXKVRC-CYBMUJFWSA-N 1 1 363.414 2.565 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265284413 509966927 /nfs/dbraw/zinc/96/69/27/509966927.db2.gz JFMLLZICXQPKNK-KBPBESRZSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000180571816 509990399 /nfs/dbraw/zinc/99/03/99/509990399.db2.gz IIQOVIONKJONOW-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)n1cnnc1[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000245548149 509997672 /nfs/dbraw/zinc/99/76/72/509997672.db2.gz YFJXPMXVGQSYPC-NVXWUHKLSA-N 1 1 359.430 2.680 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN([C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000174233782 510016049 /nfs/dbraw/zinc/01/60/49/510016049.db2.gz ZHXQLMQCFRQMBM-HRCADAONSA-N 1 1 360.458 2.869 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193825195 510088654 /nfs/dbraw/zinc/08/86/54/510088654.db2.gz SUHHIYNXLMUKNP-ZDUSSCGKSA-N 1 1 364.402 2.631 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193825195 510088656 /nfs/dbraw/zinc/08/86/56/510088656.db2.gz SUHHIYNXLMUKNP-ZDUSSCGKSA-N 1 1 364.402 2.631 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000261942548 510123235 /nfs/dbraw/zinc/12/32/35/510123235.db2.gz KRRLTYBWWJDJBX-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO CC(C)N1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000265682233 510172205 /nfs/dbraw/zinc/17/22/05/510172205.db2.gz JPAKFGIOQHINOM-ZDUSSCGKSA-N 1 1 360.439 2.817 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000184176582 510175109 /nfs/dbraw/zinc/17/51/09/510175109.db2.gz HKJAVGPMJRXDNI-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO O=C(C[N@H+](C[C@@H]1CCCO1)[C@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000245888885 510188728 /nfs/dbraw/zinc/18/87/28/510188728.db2.gz OFIRMPVLTWCFDQ-KBPBESRZSA-N 1 1 365.455 2.520 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCCO1)[C@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000245888885 510188731 /nfs/dbraw/zinc/18/87/31/510188731.db2.gz OFIRMPVLTWCFDQ-KBPBESRZSA-N 1 1 365.455 2.520 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C1 ZINC000245928886 510213463 /nfs/dbraw/zinc/21/34/63/510213463.db2.gz HZJOUWBORSDOGD-SMDDNHRTSA-N 1 1 371.384 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC000246079812 510280490 /nfs/dbraw/zinc/28/04/90/510280490.db2.gz FCCWKYZBYJTYPT-OIISXLGYSA-N 1 1 352.456 2.695 20 5 FFBDMO CC(C)[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174735682 510280586 /nfs/dbraw/zinc/28/05/86/510280586.db2.gz RIBGCXSIPQSHMR-MRXNPFEDSA-N 1 1 352.822 2.716 20 5 FFBDMO C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184463487 510336493 /nfs/dbraw/zinc/33/64/93/510336493.db2.gz VWGYXBFATYNFND-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246172487 510338401 /nfs/dbraw/zinc/33/84/01/510338401.db2.gz PVZGBFMRTKXPRU-KGLIPLIRSA-N 1 1 359.430 2.979 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@H](C)C1 ZINC000266007665 510356172 /nfs/dbraw/zinc/35/61/72/510356172.db2.gz RPEBHYPAAMJZLQ-RHSMWYFYSA-N 1 1 358.442 2.738 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246223352 510374851 /nfs/dbraw/zinc/37/48/51/510374851.db2.gz ZNLPOHWEPJHQSX-DZGCQCFKSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246223352 510374858 /nfs/dbraw/zinc/37/48/58/510374858.db2.gz ZNLPOHWEPJHQSX-DZGCQCFKSA-N 1 1 355.398 2.503 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCO1 ZINC000246319037 510422972 /nfs/dbraw/zinc/42/29/72/510422972.db2.gz HTDZOCCJFLSTMY-SJLPKXTDSA-N 1 1 352.431 2.616 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+](C)CCc2ccncc2)c([N+](=O)[O-])c1 ZINC000181486156 510434269 /nfs/dbraw/zinc/43/42/69/510434269.db2.gz OONNUJWQHSQJDL-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)CCc2ccncc2)c([N+](=O)[O-])c1 ZINC000181486156 510434276 /nfs/dbraw/zinc/43/42/76/510434276.db2.gz OONNUJWQHSQJDL-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO Cn1cc(CN[C@H]2CCC[C@@H]([NH+](C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175012954 510436346 /nfs/dbraw/zinc/43/63/46/510436346.db2.gz ZNDGVASYFSFNGK-FUHWJXTLSA-N 1 1 357.458 2.958 20 5 FFBDMO Nc1c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000178148400 510458406 /nfs/dbraw/zinc/45/84/06/510458406.db2.gz XFVMWDQFKGYFJI-OAHLLOKOSA-N 1 1 358.398 2.727 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000178224269 510497031 /nfs/dbraw/zinc/49/70/31/510497031.db2.gz YKPQEDGBNNRRSS-HNNXBMFYSA-N 1 1 355.442 2.592 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266298926 510504224 /nfs/dbraw/zinc/50/42/24/510504224.db2.gz KNZKPXSRJATNRI-JQWIXIFHSA-N 1 1 357.332 2.922 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NCC[N@H+]1CCc2ccccc2C1 ZINC000172046668 510515855 /nfs/dbraw/zinc/51/58/55/510515855.db2.gz ZKAGHUVUYPQSIZ-UHFFFAOYSA-N 1 1 373.840 2.965 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181679779 510535895 /nfs/dbraw/zinc/53/58/95/510535895.db2.gz REVOTNQRWSFJCU-KGLIPLIRSA-N 1 1 361.442 2.986 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000181730675 510563623 /nfs/dbraw/zinc/56/36/23/510563623.db2.gz UCHQYXVPGVVAQY-AWEZNQCLSA-N 1 1 366.437 2.726 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181776687 510586199 /nfs/dbraw/zinc/58/61/99/510586199.db2.gz AGFSUNVZTRENLA-MRXNPFEDSA-N 1 1 360.410 2.518 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000191320482 510605039 /nfs/dbraw/zinc/60/50/39/510605039.db2.gz HUTNOPUNUSEOKR-OAHLLOKOSA-N 1 1 364.446 2.690 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000181884010 510640491 /nfs/dbraw/zinc/64/04/91/510640491.db2.gz YHXLUNLNINXNMU-MSOLQXFVSA-N 1 1 356.422 2.824 20 5 FFBDMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000175440394 510648373 /nfs/dbraw/zinc/64/83/73/510648373.db2.gz CJCZLGBGKHJRLS-DCGLDWPTSA-N 1 1 366.849 2.930 20 5 FFBDMO Cc1[nH]nc(C(=O)Nc2ccc(OCC[N@@H+]3CC[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000266611696 510686627 /nfs/dbraw/zinc/68/66/27/510686627.db2.gz BILVYLGQXPNNDS-LBPRGKRZSA-N 1 1 373.413 2.599 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000270389078 510788507 /nfs/dbraw/zinc/78/85/07/510788507.db2.gz AHYSWJDDRBRUDA-BBRMVZONSA-N 1 1 357.414 2.617 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000247159510 510846737 /nfs/dbraw/zinc/84/67/37/510846737.db2.gz XPCJQVIKZKOTPM-GXTWGEPZSA-N 1 1 373.413 2.506 20 5 FFBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000247190381 510850205 /nfs/dbraw/zinc/85/02/05/510850205.db2.gz BQNUUJUJPRPIIS-IPELMVKDSA-N 1 1 358.442 2.934 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000247333575 510857371 /nfs/dbraw/zinc/85/73/71/510857371.db2.gz XBOHXWFQSDKPJU-MLGOLLRUSA-N 1 1 366.849 2.603 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285469976 510919851 /nfs/dbraw/zinc/91/98/51/510919851.db2.gz ZILLRMUMKWWCES-GFCCVEGCSA-N 1 1 355.385 2.558 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CN3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282362990 510946098 /nfs/dbraw/zinc/94/60/98/510946098.db2.gz WFSYNLNBYUEIDV-KRWDZBQOSA-N 1 1 363.458 2.538 20 5 FFBDMO CCOc1cc(CN2CCC[C@@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282362990 510946101 /nfs/dbraw/zinc/94/61/01/510946101.db2.gz WFSYNLNBYUEIDV-KRWDZBQOSA-N 1 1 363.458 2.538 20 5 FFBDMO CC(C)[N@@H+](C)CC(=O)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000285581841 510965154 /nfs/dbraw/zinc/96/51/54/510965154.db2.gz AETSSAUVKQJIBB-UHFFFAOYSA-N 1 1 370.247 2.582 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000282521431 511011445 /nfs/dbraw/zinc/01/14/45/511011445.db2.gz TYLWNQAWNRZDOQ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000282521431 511011448 /nfs/dbraw/zinc/01/14/48/511011448.db2.gz TYLWNQAWNRZDOQ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000270910310 511022518 /nfs/dbraw/zinc/02/25/18/511022518.db2.gz STVBXGWZEBCMNT-CQSZACIVSA-N 1 1 357.414 2.979 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)C2)C1 ZINC000294372817 511043074 /nfs/dbraw/zinc/04/30/74/511043074.db2.gz ZMWQYUFARXSWCG-LJQANCHMSA-N 1 1 358.442 2.727 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000290421923 511137818 /nfs/dbraw/zinc/13/78/18/511137818.db2.gz AXLPAPRRBAIZHM-UHFFFAOYSA-N 1 1 372.429 2.504 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@@H]3C[N@H+]4CCC[C@H]4CO3)cs2)c1 ZINC000362719296 511224687 /nfs/dbraw/zinc/22/46/87/511224687.db2.gz IGTGPQPUVQPKDS-DLBZAZTESA-N 1 1 374.466 2.671 20 5 FFBDMO CCN(Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000362852291 511251972 /nfs/dbraw/zinc/25/19/72/511251972.db2.gz PTQMKMVZWUNDKC-NVXWUHKLSA-N 1 1 357.458 2.986 20 5 FFBDMO COc1ccccc1CNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271616975 511263877 /nfs/dbraw/zinc/26/38/77/511263877.db2.gz LXLDUYXFPDOPGR-UONOGXRCSA-N 1 1 357.410 2.959 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1CN1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000283224293 511284242 /nfs/dbraw/zinc/28/42/42/511284242.db2.gz IELDAVJMGCFLES-MRXNPFEDSA-N 1 1 360.458 2.874 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1CN1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000283224293 511284245 /nfs/dbraw/zinc/28/42/45/511284245.db2.gz IELDAVJMGCFLES-MRXNPFEDSA-N 1 1 360.458 2.874 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H](O)CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000295209746 511321704 /nfs/dbraw/zinc/32/17/04/511321704.db2.gz LKWDUESDBNRPDP-QGZVFWFLSA-N 1 1 358.442 2.978 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@@H]1CO)Nc1ccccc1[N+](=O)[O-] ZINC000283457185 511373926 /nfs/dbraw/zinc/37/39/26/511373926.db2.gz YOMXRMLPRUVNOG-SFHVURJKSA-N 1 1 355.394 2.515 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000291978320 511415002 /nfs/dbraw/zinc/41/50/02/511415002.db2.gz YLRDUVIGOFGZQY-HIFRSBDPSA-N 1 1 371.441 2.834 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1 ZINC000280394618 511450275 /nfs/dbraw/zinc/45/02/75/511450275.db2.gz FWHUDVGQFBIFFS-UHFFFAOYSA-N 1 1 357.813 2.873 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCOC[C@H](C4CCC4)C3)n2)c1 ZINC000292085071 511459486 /nfs/dbraw/zinc/45/94/86/511459486.db2.gz GCUUFNVVAHCYOO-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCOC[C@H](C4CCC4)C3)n2)c1 ZINC000292085071 511459490 /nfs/dbraw/zinc/45/94/90/511459490.db2.gz GCUUFNVVAHCYOO-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000298955853 511464694 /nfs/dbraw/zinc/46/46/94/511464694.db2.gz DJQYANWVLOXZCX-WMZOPIPTSA-N 1 1 358.442 2.552 20 5 FFBDMO C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272234596 511473466 /nfs/dbraw/zinc/47/34/66/511473466.db2.gz FKJJGNRKFGTEHT-WMLDXEAASA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280558383 511511233 /nfs/dbraw/zinc/51/12/33/511511233.db2.gz UTOULCANDSLATP-NHYWBVRUSA-N 1 1 369.824 2.873 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365588063 511546064 /nfs/dbraw/zinc/54/60/64/511546064.db2.gz UENKQNZMYJPZRG-QGPMSJSTSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000299222121 511557176 /nfs/dbraw/zinc/55/71/76/511557176.db2.gz IOJFTQSEYZHURT-RDJZCZTQSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2ccncc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000295968536 511572659 /nfs/dbraw/zinc/57/26/59/511572659.db2.gz NHFDDPSWHAFTLQ-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2ccncc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000295968536 511572662 /nfs/dbraw/zinc/57/26/62/511572662.db2.gz NHFDDPSWHAFTLQ-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000363561413 511629908 /nfs/dbraw/zinc/62/99/08/511629908.db2.gz YZDUZENNIFBOLH-HUUCEWRRSA-N 1 1 371.441 2.528 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)Nc1cccc(Cl)c1 ZINC000365855138 511689807 /nfs/dbraw/zinc/68/98/07/511689807.db2.gz GWSLXVSMDWODFN-UHFFFAOYSA-N 1 1 363.805 2.720 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000303514419 511740584 /nfs/dbraw/zinc/74/05/84/511740584.db2.gz PBADEEMBKRYBAR-GFCCVEGCSA-N 1 1 366.437 2.947 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000365999259 511777051 /nfs/dbraw/zinc/77/70/51/511777051.db2.gz YKJZLMUWTGVRJD-HOTGVXAUSA-N 1 1 355.394 2.782 20 5 FFBDMO CC[N@@H+]1CCO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000284744049 511849427 /nfs/dbraw/zinc/84/94/27/511849427.db2.gz DSXMCEFRLAVYQS-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO CC[N@H+]1CCO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000284744049 511849430 /nfs/dbraw/zinc/84/94/30/511849430.db2.gz DSXMCEFRLAVYQS-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+](C2CC2)C1 ZINC000296683144 511852437 /nfs/dbraw/zinc/85/24/37/511852437.db2.gz IRLGDIIKDMJVIH-CYBMUJFWSA-N 1 1 357.414 2.561 20 5 FFBDMO COc1cccc(N2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000274696424 511912725 /nfs/dbraw/zinc/91/27/25/511912725.db2.gz NXPJXLHZIMLWAI-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](Cc4nccs4)CC3)nc2c1 ZINC000274856844 511965310 /nfs/dbraw/zinc/96/53/10/511965310.db2.gz SICBZBFUDBXOPY-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4nccs4)CC3)nc2c1 ZINC000274856844 511965315 /nfs/dbraw/zinc/96/53/15/511965315.db2.gz SICBZBFUDBXOPY-UHFFFAOYSA-N 1 1 358.427 2.640 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285140541 512014693 /nfs/dbraw/zinc/01/46/93/512014693.db2.gz LVNRDMPMENXDMS-KDOFPFPSSA-N 1 1 370.453 2.594 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000285230416 512045623 /nfs/dbraw/zinc/04/56/23/512045623.db2.gz QODRLNULZZLHQM-UHFFFAOYSA-N 1 1 358.423 2.647 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293746979 512071663 /nfs/dbraw/zinc/07/16/63/512071663.db2.gz IHLNRCVDKMKALD-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917708 512511659 /nfs/dbraw/zinc/51/16/59/512511659.db2.gz RXYCEAYCDONAJL-OLZOCXBDSA-N 1 1 373.413 2.533 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(CC[NH+]2CCOCC2)CC1 ZINC000367646817 512598341 /nfs/dbraw/zinc/59/83/41/512598341.db2.gz VPGLSAUJSQNCQC-UHFFFAOYSA-N 1 1 361.442 2.736 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000378192615 512631389 /nfs/dbraw/zinc/63/13/89/512631389.db2.gz UGJVYPACLFYAHK-CHWSQXEVSA-N 1 1 368.231 2.714 20 5 FFBDMO C[NH+]1CCC2(CCCN([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)CC1 ZINC000374075227 512650799 /nfs/dbraw/zinc/65/07/99/512650799.db2.gz RBAROOAJMQOLIW-SFHVURJKSA-N 1 1 372.469 2.508 20 5 FFBDMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCc1nc(-c3ccccc3)no1)CC2 ZINC000411476946 512653885 /nfs/dbraw/zinc/65/38/85/512653885.db2.gz HNMMSIKPSHSFRO-UHFFFAOYSA-N 1 1 351.366 2.641 20 5 FFBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCc1nc(-c3ccccc3)no1)CC2 ZINC000411476946 512653889 /nfs/dbraw/zinc/65/38/89/512653889.db2.gz HNMMSIKPSHSFRO-UHFFFAOYSA-N 1 1 351.366 2.641 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(c4c[nH]cn4)CC3)o2)cc1 ZINC000374201635 512705274 /nfs/dbraw/zinc/70/52/74/512705274.db2.gz WLVZIEMJMNFVJO-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000411957880 512889184 /nfs/dbraw/zinc/88/91/84/512889184.db2.gz BQZSNQRHYQJDLM-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO COC(=O)c1cn([C@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nn1 ZINC000368356455 512912461 /nfs/dbraw/zinc/91/24/61/512912461.db2.gz AOFWSSUYXXFJPK-ZFWWWQNUSA-N 1 1 373.413 2.679 20 5 FFBDMO Cc1nnc([C@@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)[nH]1 ZINC000412041372 512926024 /nfs/dbraw/zinc/92/60/24/512926024.db2.gz MQCSJAVKHJNDTI-CQSZACIVSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1n[nH]c([C@@H]2CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000412041372 512926027 /nfs/dbraw/zinc/92/60/27/512926027.db2.gz MQCSJAVKHJNDTI-CQSZACIVSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1n[nH]c([C@@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000412041372 512926031 /nfs/dbraw/zinc/92/60/31/512926031.db2.gz MQCSJAVKHJNDTI-CQSZACIVSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1nc([C@@H]2CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n[nH]1 ZINC000412041372 512926033 /nfs/dbraw/zinc/92/60/33/512926033.db2.gz MQCSJAVKHJNDTI-CQSZACIVSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1nc([C@@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n[nH]1 ZINC000412041372 512926037 /nfs/dbraw/zinc/92/60/37/512926037.db2.gz MQCSJAVKHJNDTI-CQSZACIVSA-N 1 1 368.397 2.708 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000408074912 512994688 /nfs/dbraw/zinc/99/46/88/512994688.db2.gz SHIWSFBZOPVKRP-LZWOXQAQSA-N 1 1 367.471 2.621 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000412357444 513052753 /nfs/dbraw/zinc/05/27/53/513052753.db2.gz DWZRCQIWUCJPRB-LJQANCHMSA-N 1 1 361.442 2.940 20 5 FFBDMO O=C(NC1CC1)c1ccc(NC[C@H]2CCCC[N@H+]2C2CC2)c([N+](=O)[O-])c1 ZINC000433799382 513153190 /nfs/dbraw/zinc/15/31/90/513153190.db2.gz QZILMJHTEDRAEV-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000428800669 513195572 /nfs/dbraw/zinc/19/55/72/513195572.db2.gz MALZOHFHMGLDQT-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000428800669 513195577 /nfs/dbraw/zinc/19/55/77/513195577.db2.gz MALZOHFHMGLDQT-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](O)CO ZINC000421410201 513253189 /nfs/dbraw/zinc/25/31/89/513253189.db2.gz OUQQRPDBTGXFLO-ZDUSSCGKSA-N 1 1 350.440 2.887 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000421426972 513259363 /nfs/dbraw/zinc/25/93/63/513259363.db2.gz KZWSKZKDAXZYKF-GASCZTMLSA-N 1 1 363.458 2.829 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000421426972 513259371 /nfs/dbraw/zinc/25/93/71/513259371.db2.gz KZWSKZKDAXZYKF-GASCZTMLSA-N 1 1 363.458 2.829 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000429039204 513263923 /nfs/dbraw/zinc/26/39/23/513263923.db2.gz HIZBCVVEPVTHON-WOSRLPQWSA-N 1 1 351.422 2.905 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429040834 513264689 /nfs/dbraw/zinc/26/46/89/513264689.db2.gz NGGQSHMYLVKPGJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429040834 513264698 /nfs/dbraw/zinc/26/46/98/513264698.db2.gz NGGQSHMYLVKPGJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429040834 513264704 /nfs/dbraw/zinc/26/47/04/513264704.db2.gz NGGQSHMYLVKPGJ-ZSZQSSIHSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[NH2+]Cc2ccccc21 ZINC000440350570 513298261 /nfs/dbraw/zinc/29/82/61/513298261.db2.gz BDTSOCAEYZUBHA-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(Br)c1 ZINC000450795668 513344681 /nfs/dbraw/zinc/34/46/81/513344681.db2.gz UPBPWIADVGBQSP-TXEJJXNPSA-N 1 1 356.220 2.632 20 5 FFBDMO C[C@@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000450808373 513351495 /nfs/dbraw/zinc/35/14/95/513351495.db2.gz IHZRKFKSUDASSV-HNNXBMFYSA-N 1 1 368.437 2.652 20 5 FFBDMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+](C2CCC2)C1 ZINC000429392001 513363441 /nfs/dbraw/zinc/36/34/41/513363441.db2.gz DCYKWQJNRPYRHI-CQSZACIVSA-N 1 1 361.442 2.768 20 5 FFBDMO Cc1cccc2c1C[N@H+](CC(=O)N1CCc3cc([N+](=O)[O-])ccc31)CC2 ZINC000429566330 513412284 /nfs/dbraw/zinc/41/22/84/513412284.db2.gz JNRYKOKNRKVMGC-UHFFFAOYSA-N 1 1 351.406 2.851 20 5 FFBDMO Cc1cccc2c1C[N@@H+](CC(=O)N1CCc3cc([N+](=O)[O-])ccc31)CC2 ZINC000429566330 513412296 /nfs/dbraw/zinc/41/22/96/513412296.db2.gz JNRYKOKNRKVMGC-UHFFFAOYSA-N 1 1 351.406 2.851 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccc2)CC1)Nc1ncc([N+](=O)[O-])cc1F ZINC000413168588 513496434 /nfs/dbraw/zinc/49/64/34/513496434.db2.gz WWTWTGNJBMCPLX-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO CN(C)C(=O)CC[NH+]1CCC(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447532209 513500888 /nfs/dbraw/zinc/50/08/88/513500888.db2.gz VBBMJKIISUERKU-IBGZPJMESA-N 1 1 374.485 2.505 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)o2)c([N+](=O)[O-])c1 ZINC000425349405 513523092 /nfs/dbraw/zinc/52/30/92/513523092.db2.gz CZKUYCSHIWTNNS-LBPRGKRZSA-N 1 1 369.381 2.971 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000425474066 513586119 /nfs/dbraw/zinc/58/61/19/513586119.db2.gz KVTXFBFDLIJWJR-CQSZACIVSA-N 1 1 352.435 2.768 20 5 FFBDMO COc1cc(CNC[C@H]2[N@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000447899970 513620651 /nfs/dbraw/zinc/62/06/51/513620651.db2.gz YPNWRUJLTJMKLJ-QGZVFWFLSA-N 1 1 351.447 2.822 20 5 FFBDMO COc1cc(CNC[C@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1OC ZINC000447899970 513620655 /nfs/dbraw/zinc/62/06/55/513620655.db2.gz YPNWRUJLTJMKLJ-QGZVFWFLSA-N 1 1 351.447 2.822 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000451375872 513709047 /nfs/dbraw/zinc/70/90/47/513709047.db2.gz NELGKIVMLXYVMD-UHFFFAOYSA-N 1 1 372.425 2.994 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425728231 513718993 /nfs/dbraw/zinc/71/89/93/513718993.db2.gz SXVFAPYBRWTNLU-XJKSGUPXSA-N 1 1 366.849 2.526 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000451429462 513746113 /nfs/dbraw/zinc/74/61/13/513746113.db2.gz XJFUIENKAIMNBX-BFYDXBDKSA-N 1 1 350.415 2.608 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436068812 513750215 /nfs/dbraw/zinc/75/02/15/513750215.db2.gz QHOAGHWLCJTKBO-LBPRGKRZSA-N 1 1 353.397 2.502 20 5 FFBDMO CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000430944329 513788787 /nfs/dbraw/zinc/78/87/87/513788787.db2.gz SQXIERZYGKQHRW-GFCCVEGCSA-N 1 1 368.231 2.666 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCSC[C@@H]1C1CCC1 ZINC000419375385 513791827 /nfs/dbraw/zinc/79/18/27/513791827.db2.gz QLKWRPRVJPFHIR-GDBMZVCRSA-N 1 1 352.456 2.552 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436255182 513808236 /nfs/dbraw/zinc/80/82/36/513808236.db2.gz WOEFZHNHZHYEKR-QGZVFWFLSA-N 1 1 361.442 2.887 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCNCC12CCCCC2 ZINC000431078561 513820025 /nfs/dbraw/zinc/82/00/25/513820025.db2.gz UTUGYCZHDRZVRA-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCNCC12CCCCC2 ZINC000431078561 513820029 /nfs/dbraw/zinc/82/00/29/513820029.db2.gz UTUGYCZHDRZVRA-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@H](O)COCc3ccco3)C2)cc1 ZINC000451543136 513820574 /nfs/dbraw/zinc/82/05/74/513820574.db2.gz AZHMUNSRNNWGQS-AEFFLSMTSA-N 1 1 360.410 2.945 20 5 FFBDMO CS(=O)(=O)CC1(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451545419 513823928 /nfs/dbraw/zinc/82/39/28/513823928.db2.gz HFPWQPXSUWEQJM-HNNXBMFYSA-N 1 1 352.456 2.599 20 5 FFBDMO CS(=O)(=O)CC1(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451545419 513823931 /nfs/dbraw/zinc/82/39/31/513823931.db2.gz HFPWQPXSUWEQJM-HNNXBMFYSA-N 1 1 352.456 2.599 20 5 FFBDMO C[C@@H](C(=O)Nc1ncccn1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548439 513825797 /nfs/dbraw/zinc/82/57/97/513825797.db2.gz NFPGBFMTLHIIGW-DZGCQCFKSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@@H](C(=O)Nc1ncccn1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548439 513825802 /nfs/dbraw/zinc/82/58/02/513825802.db2.gz NFPGBFMTLHIIGW-DZGCQCFKSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@H](C(=O)Nc1ncccn1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548440 513826302 /nfs/dbraw/zinc/82/63/02/513826302.db2.gz NFPGBFMTLHIIGW-HIFRSBDPSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@H](C(=O)Nc1ncccn1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548440 513826303 /nfs/dbraw/zinc/82/63/03/513826303.db2.gz NFPGBFMTLHIIGW-HIFRSBDPSA-N 1 1 355.398 2.591 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426269211 513891096 /nfs/dbraw/zinc/89/10/96/513891096.db2.gz FLHCNXDTAFIRQD-NSHDSACASA-N 1 1 374.363 2.849 20 5 FFBDMO COc1cc(C(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000448782571 513895569 /nfs/dbraw/zinc/89/55/69/513895569.db2.gz DZBKIESEVRJTKY-XQQFMLRXSA-N 1 1 367.421 2.839 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000451691489 513914425 /nfs/dbraw/zinc/91/44/25/513914425.db2.gz CHAPOFQEYSACFM-PMPSAXMXSA-N 1 1 361.442 2.715 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@H](C[NH+]4CCOCC4)C3)n2)cc1 ZINC000448969477 513998233 /nfs/dbraw/zinc/99/82/33/513998233.db2.gz VEWAHZHYXCVRDL-CQSZACIVSA-N 1 1 374.466 2.877 20 5 FFBDMO CC[N@@H+]1CCCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000444000976 514096238 /nfs/dbraw/zinc/09/62/38/514096238.db2.gz ASMJQGXESUWIEA-UHFFFAOYSA-N 1 1 367.424 2.988 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000444000976 514096245 /nfs/dbraw/zinc/09/62/45/514096245.db2.gz ASMJQGXESUWIEA-UHFFFAOYSA-N 1 1 367.424 2.988 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000451963705 514098674 /nfs/dbraw/zinc/09/86/74/514098674.db2.gz IURGVNBELQKNLI-RDJZCZTQSA-N 1 1 352.456 2.554 20 5 FFBDMO COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(F)c(Cl)c1 ZINC000451971059 514102301 /nfs/dbraw/zinc/10/23/01/514102301.db2.gz CRPWGMITVRDAOV-UHFFFAOYSA-N 1 1 356.785 2.732 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444034566 514103874 /nfs/dbraw/zinc/10/38/74/514103874.db2.gz HWGMBTCADKBVMK-LBPRGKRZSA-N 1 1 353.397 2.644 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc4c3OC(F)(F)O4)CC2)n1 ZINC000414446633 514122651 /nfs/dbraw/zinc/12/26/51/514122651.db2.gz ONGLDOMGZPFYDE-UHFFFAOYSA-N 1 1 366.324 2.950 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(OC)c1)CCC(F)(F)F ZINC000427275817 514169474 /nfs/dbraw/zinc/16/94/74/514169474.db2.gz UTHPWTXOMBFMPP-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)[C@@H](CO)C3)o2)c(Cl)c1 ZINC000414561205 514181036 /nfs/dbraw/zinc/18/10/36/514181036.db2.gz SBNZLUUSILYRBG-BDJLRTHQSA-N 1 1 366.801 2.683 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420581458 514190466 /nfs/dbraw/zinc/19/04/66/514190466.db2.gz GZLHVIRLYSEKAS-UKRRQHHQSA-N 1 1 354.410 2.941 20 5 FFBDMO COC(=O)[C@H]1CSCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000414580269 514192296 /nfs/dbraw/zinc/19/22/96/514192296.db2.gz JPLRHBRIYBSMRA-JEMSNHSXSA-N 1 1 350.440 2.836 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000420589078 514192964 /nfs/dbraw/zinc/19/29/64/514192964.db2.gz SPPQDEQBGPMDRF-HNNXBMFYSA-N 1 1 354.410 2.770 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000427360233 514193994 /nfs/dbraw/zinc/19/39/94/514193994.db2.gz YLFODJVQHIYHCE-KDOFPFPSSA-N 1 1 369.421 2.854 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]1Cc1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000437832232 514244908 /nfs/dbraw/zinc/24/49/08/514244908.db2.gz FJWCKDFVSCOINT-KRWDZBQOSA-N 1 1 351.406 2.801 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]1Cc1ccccc1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000437832232 514244912 /nfs/dbraw/zinc/24/49/12/514244912.db2.gz FJWCKDFVSCOINT-KRWDZBQOSA-N 1 1 351.406 2.801 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@H+](CCCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300246 514282707 /nfs/dbraw/zinc/28/27/07/514282707.db2.gz ACJRQTGEETXVIU-VQIMIIECSA-N 1 1 374.485 2.539 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300246 514282708 /nfs/dbraw/zinc/28/27/08/514282708.db2.gz ACJRQTGEETXVIU-VQIMIIECSA-N 1 1 374.485 2.539 20 5 FFBDMO C[C@@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000432944079 514332078 /nfs/dbraw/zinc/33/20/78/514332078.db2.gz KUNJENYXSUTGPV-HNNXBMFYSA-N 1 1 356.426 2.814 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000449786757 514352440 /nfs/dbraw/zinc/35/24/40/514352440.db2.gz PYQIZIIOTQTOLK-SFHVURJKSA-N 1 1 357.458 2.910 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420938482 514387693 /nfs/dbraw/zinc/38/76/93/514387693.db2.gz AWYVRSDJBZDBOM-TZMCWYRMSA-N 1 1 362.348 2.999 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@H]1CCC[N@H+]1C ZINC000420994431 514428837 /nfs/dbraw/zinc/42/88/37/514428837.db2.gz CDQFXFDDXJBCGC-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000428543458 514494310 /nfs/dbraw/zinc/49/43/10/514494310.db2.gz GDIQGTQEYLWUKU-UHFFFAOYSA-N 1 1 354.815 2.942 20 5 FFBDMO COC(=O)Cc1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000450218476 514548719 /nfs/dbraw/zinc/54/87/19/514548719.db2.gz XVGHWJZQHVZVGW-QGZVFWFLSA-N 1 1 369.421 2.997 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450262390 514570672 /nfs/dbraw/zinc/57/06/72/514570672.db2.gz MYTWWYJPKABOGK-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000470710766 514583096 /nfs/dbraw/zinc/58/30/96/514583096.db2.gz UAMAERFRLAESQP-GOSISDBHSA-N 1 1 372.400 2.661 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000453293051 514592025 /nfs/dbraw/zinc/59/20/25/514592025.db2.gz WQFOKDZDGBDQGS-HLLBOEOZSA-N 1 1 353.422 2.807 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458192864 514616895 /nfs/dbraw/zinc/61/68/95/514616895.db2.gz PGKUOJKALXYNMH-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]CCN2CCC(O)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453387646 514619448 /nfs/dbraw/zinc/61/94/48/514619448.db2.gz WMPUKUAMWFUVKT-FQEVSTJZSA-N 1 1 373.453 2.886 20 5 FFBDMO CCc1ccc([C@@H](NCC[NH+]2CCC(O)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453387646 514619450 /nfs/dbraw/zinc/61/94/50/514619450.db2.gz WMPUKUAMWFUVKT-FQEVSTJZSA-N 1 1 373.453 2.886 20 5 FFBDMO Cc1cc(NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cn2cc[nH+]c12 ZINC000455629172 514644527 /nfs/dbraw/zinc/64/45/27/514644527.db2.gz QWQKIQKLMZYTDM-UHFFFAOYSA-N 1 1 369.385 2.616 20 5 FFBDMO CC[NH+]1CCN(c2ccccc2NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000475489688 514685472 /nfs/dbraw/zinc/68/54/72/514685472.db2.gz YIVGBBMAKMBOMM-UHFFFAOYSA-N 1 1 370.409 2.695 20 5 FFBDMO Cn1c(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000502567312 514697413 /nfs/dbraw/zinc/69/74/13/514697413.db2.gz YQJDYXNYHWWZHD-UHFFFAOYSA-N 1 1 356.426 2.500 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000502713451 514750157 /nfs/dbraw/zinc/75/01/57/514750157.db2.gz XGBKJYDFFWKEPE-AWEZNQCLSA-N 1 1 355.460 2.528 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000502809316 514786883 /nfs/dbraw/zinc/78/68/83/514786883.db2.gz CFAFJQZIVKEMDS-HNNXBMFYSA-N 1 1 364.446 2.667 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000466923251 514828816 /nfs/dbraw/zinc/82/88/16/514828816.db2.gz JFNHNDHENWGVBG-KSSFIOAISA-N 1 1 360.458 2.998 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919890 514845390 /nfs/dbraw/zinc/84/53/90/514845390.db2.gz MFPHFDPDUJCQFH-CABCVRRESA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919890 514845442 /nfs/dbraw/zinc/84/54/42/514845442.db2.gz MFPHFDPDUJCQFH-CABCVRRESA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919890 514845452 /nfs/dbraw/zinc/84/54/52/514845452.db2.gz MFPHFDPDUJCQFH-CABCVRRESA-N 1 1 351.447 2.787 20 5 FFBDMO Cc1cc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cn2cc[nH+]c12 ZINC000502949433 514853954 /nfs/dbraw/zinc/85/39/54/514853954.db2.gz MYRYTWWAMLYBDF-UHFFFAOYSA-N 1 1 362.349 2.989 20 5 FFBDMO CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)cc[nH+]1 ZINC000489595151 514910478 /nfs/dbraw/zinc/91/04/78/514910478.db2.gz IABFFKIGPHPGCC-UHFFFAOYSA-N 1 1 352.297 2.910 20 5 FFBDMO CN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000498496441 514931311 /nfs/dbraw/zinc/93/13/11/514931311.db2.gz RMUOKPKWOJXXDJ-OAHLLOKOSA-N 1 1 366.849 2.669 20 5 FFBDMO COCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485404902 515027301 /nfs/dbraw/zinc/02/73/01/515027301.db2.gz LPYBXQNGJDCLHT-UHFFFAOYSA-N 1 1 362.405 2.598 20 5 FFBDMO C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462486884 515078263 /nfs/dbraw/zinc/07/82/63/515078263.db2.gz BMNYELPAILKPJL-QMMMGPOBSA-N 1 1 370.258 2.520 20 5 FFBDMO Cc1[nH+]ccn1CCSCCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000503926314 515171479 /nfs/dbraw/zinc/17/14/79/515171479.db2.gz UFHAEKRMEFQSIS-UHFFFAOYSA-N 1 1 362.411 2.831 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)CCn1cc([N+](=O)[O-])cn1 ZINC000472231860 515179230 /nfs/dbraw/zinc/17/92/30/515179230.db2.gz HPLFSHRSNDIWQH-UHFFFAOYSA-N 1 1 372.404 2.885 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@]3(CCCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000477051872 515303222 /nfs/dbraw/zinc/30/32/22/515303222.db2.gz RBZSOYHJYGJXED-HKUYNNGSSA-N 1 1 359.426 2.593 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000462950284 515313047 /nfs/dbraw/zinc/31/30/47/515313047.db2.gz ZXPKWRVULBRCIS-CQSZACIVSA-N 1 1 362.430 2.843 20 5 FFBDMO Cc1cnc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000463055259 515351484 /nfs/dbraw/zinc/35/14/84/515351484.db2.gz NRRKFYOHFYMNJN-UHFFFAOYSA-N 1 1 369.469 2.918 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000463143382 515379659 /nfs/dbraw/zinc/37/96/59/515379659.db2.gz OEQSODDHOSCARK-XHSDSOJGSA-N 1 1 362.474 2.514 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](O)C2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000463236001 515412468 /nfs/dbraw/zinc/41/24/68/515412468.db2.gz OVKUNJRWUIQRGG-AWEZNQCLSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000463236001 515412474 /nfs/dbraw/zinc/41/24/74/515412474.db2.gz OVKUNJRWUIQRGG-AWEZNQCLSA-N 1 1 360.357 2.593 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000499879356 515489989 /nfs/dbraw/zinc/48/99/89/515489989.db2.gz RZFIRMGACYIUBD-HIFRSBDPSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1cc(N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000486670464 515587816 /nfs/dbraw/zinc/58/78/16/515587816.db2.gz KLWVJWZQFLADNW-YOEHRIQHSA-N 1 1 353.426 2.891 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000505635130 515618087 /nfs/dbraw/zinc/61/80/87/515618087.db2.gz OBTPVCJBUAQMQJ-KRWDZBQOSA-N 1 1 369.368 2.754 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000505637275 515618566 /nfs/dbraw/zinc/61/85/66/515618566.db2.gz YYKCFHHAVBACIH-UHFFFAOYSA-N 1 1 367.409 2.918 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000500302986 515659546 /nfs/dbraw/zinc/65/95/46/515659546.db2.gz LYLKKHPDJITYRA-ZDUSSCGKSA-N 1 1 362.455 2.637 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457116057 515662186 /nfs/dbraw/zinc/66/21/86/515662186.db2.gz LERVPYZZXYSYLH-GXTWGEPZSA-N 1 1 369.849 2.957 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000457120090 515664864 /nfs/dbraw/zinc/66/48/64/515664864.db2.gz NQBRWMPCTLDPCB-INIZCTEOSA-N 1 1 371.441 2.550 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000486876630 515669136 /nfs/dbraw/zinc/66/91/36/515669136.db2.gz WLMFEHYEFKUERV-LLVKDONJSA-N 1 1 366.418 2.542 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cncc(F)c2)c([N+](=O)[O-])c1 ZINC000459618326 515698751 /nfs/dbraw/zinc/69/87/51/515698751.db2.gz DJYOBUPJZQEIED-QWRGUYRKSA-N 1 1 362.361 2.815 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000487026731 515726477 /nfs/dbraw/zinc/72/64/77/515726477.db2.gz KXBZBIWKQOTCRF-QGZVFWFLSA-N 1 1 353.422 2.889 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000500479730 515733285 /nfs/dbraw/zinc/73/32/85/515733285.db2.gz APTGIVPCMHALPX-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000500479730 515733287 /nfs/dbraw/zinc/73/32/87/515733287.db2.gz APTGIVPCMHALPX-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO CCOc1cccc(CNC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511103220 515781940 /nfs/dbraw/zinc/78/19/40/515781940.db2.gz BMKQDSYRDPSPTO-UHFFFAOYSA-N 1 1 371.437 2.784 20 5 FFBDMO CCOc1cccc(CNC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511103220 515781951 /nfs/dbraw/zinc/78/19/51/515781951.db2.gz BMKQDSYRDPSPTO-UHFFFAOYSA-N 1 1 371.437 2.784 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000511126469 515796872 /nfs/dbraw/zinc/79/68/72/515796872.db2.gz QHDBZFUDZGPMRS-AWEZNQCLSA-N 1 1 359.348 2.622 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000459796204 515809917 /nfs/dbraw/zinc/80/99/17/515809917.db2.gz PPESSRZYQBRGQF-IPMKNSEASA-N 1 1 373.453 2.573 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459801291 515815267 /nfs/dbraw/zinc/81/52/67/515815267.db2.gz KXQRNYWOYQVGAF-DOPJRALCSA-N 1 1 361.442 2.795 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459813856 515824934 /nfs/dbraw/zinc/82/49/34/515824934.db2.gz WOQZLJOAMKFYPA-FUHWJXTLSA-N 1 1 361.442 2.715 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459813856 515824942 /nfs/dbraw/zinc/82/49/42/515824942.db2.gz WOQZLJOAMKFYPA-FUHWJXTLSA-N 1 1 361.442 2.715 20 5 FFBDMO COc1cc(C[N@@H+](C)C2CCC(NC(C)=O)CC2)c([N+](=O)[O-])cc1F ZINC000464490308 515845173 /nfs/dbraw/zinc/84/51/73/515845173.db2.gz MAVZYWCSGFYYSO-UHFFFAOYSA-N 1 1 353.394 2.622 20 5 FFBDMO C[N@@H+]1CCO[C@@H](C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000469535690 515857179 /nfs/dbraw/zinc/85/71/79/515857179.db2.gz PAQCOMRDGIZUKS-QGZVFWFLSA-N 1 1 357.366 2.656 20 5 FFBDMO C[N@H+]1CCO[C@@H](C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000469535690 515857185 /nfs/dbraw/zinc/85/71/85/515857185.db2.gz PAQCOMRDGIZUKS-QGZVFWFLSA-N 1 1 357.366 2.656 20 5 FFBDMO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000474148868 515906610 /nfs/dbraw/zinc/90/66/10/515906610.db2.gz YCOSAJJHSDUPBV-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO CC(C)[C@@H]1CN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000488083091 516110634 /nfs/dbraw/zinc/11/06/34/516110634.db2.gz YVZUBHVWHNWPAX-WBMJQRKESA-N 1 1 368.865 2.847 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470137245 516137506 /nfs/dbraw/zinc/13/75/06/516137506.db2.gz JOJHTYCDXGUUBT-UHFFFAOYSA-N 1 1 368.409 2.556 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000470148968 516144233 /nfs/dbraw/zinc/14/42/33/516144233.db2.gz OJKRTSNVFQINCD-INIZCTEOSA-N 1 1 368.409 2.602 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000507277839 516150534 /nfs/dbraw/zinc/15/05/34/516150534.db2.gz JGGWYGGGFTXTCZ-OKILXGFUSA-N 1 1 369.487 2.630 20 5 FFBDMO CCC1CCC([N@@H+](CCO)C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000488198952 516155507 /nfs/dbraw/zinc/15/55/07/516155507.db2.gz JSZKJIAOCQKOBT-HTWSVDAQSA-N 1 1 366.458 2.598 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000470210401 516175491 /nfs/dbraw/zinc/17/54/91/516175491.db2.gz AYKLSRPNSDGKNP-HNNXBMFYSA-N 1 1 361.442 2.797 20 5 FFBDMO O=C([C@@H]1CC[N@H+](C2CCCCC2)C1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470301706 516198978 /nfs/dbraw/zinc/19/89/78/516198978.db2.gz BCWACRQXMSDVFV-OAHLLOKOSA-N 1 1 373.453 2.839 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000488409761 516217589 /nfs/dbraw/zinc/21/75/89/516217589.db2.gz HPZJXWKCPJVYJF-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO COc1cc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000512408876 516267065 /nfs/dbraw/zinc/26/70/65/516267065.db2.gz KLRCIMNIUSOGAP-UHFFFAOYSA-N 1 1 369.421 2.868 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000497532609 516325454 /nfs/dbraw/zinc/32/54/54/516325454.db2.gz KVSLPGIUFSFICB-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000497532609 516325455 /nfs/dbraw/zinc/32/54/55/516325455.db2.gz KVSLPGIUFSFICB-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)[C@@H]2CCNC2=O)cc1[N+](=O)[O-] ZINC000539896412 516342243 /nfs/dbraw/zinc/34/22/43/516342243.db2.gz ZULAYFUEVJMUPU-QGZVFWFLSA-N 1 1 354.410 2.683 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@@H]2CCNC2=O)cc1[N+](=O)[O-] ZINC000539896412 516342254 /nfs/dbraw/zinc/34/22/54/516342254.db2.gz ZULAYFUEVJMUPU-QGZVFWFLSA-N 1 1 354.410 2.683 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000561157826 516415425 /nfs/dbraw/zinc/41/54/25/516415425.db2.gz XGLZCCUOJWLWBM-AAEUAGOBSA-N 1 1 350.419 2.617 20 5 FFBDMO COc1ccc(CNC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000517738094 516433353 /nfs/dbraw/zinc/43/33/53/516433353.db2.gz WGEZANITQNMRIB-KBPBESRZSA-N 1 1 364.446 2.523 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](N2CCOCC2)C(F)(F)F)c(Cl)c1 ZINC000512983476 516433664 /nfs/dbraw/zinc/43/36/64/516433664.db2.gz RQALZMIJLJWPPP-CYBMUJFWSA-N 1 1 367.755 2.601 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000531388797 516444568 /nfs/dbraw/zinc/44/45/68/516444568.db2.gz CVOMBFKJRMAUAF-WMLDXEAASA-N 1 1 356.426 2.574 20 5 FFBDMO COc1ccccc1/C=C\C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785776 516509186 /nfs/dbraw/zinc/50/91/86/516509186.db2.gz FGHAAHKIUMZEND-XQRVVYSFSA-N 1 1 354.410 2.834 20 5 FFBDMO COc1cc(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000513467192 516636154 /nfs/dbraw/zinc/63/61/54/516636154.db2.gz RNYKMUUEESWBHY-ZDUSSCGKSA-N 1 1 371.384 2.873 20 5 FFBDMO COc1cc(CN2CCC(C[NH+](C)C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000524370327 516702902 /nfs/dbraw/zinc/70/29/02/516702902.db2.gz DSIYIDNXQSVKHN-UHFFFAOYSA-N 1 1 373.400 2.978 20 5 FFBDMO Cc1nc2ccccn2c(=O)c1CC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000554935733 516706049 /nfs/dbraw/zinc/70/60/49/516706049.db2.gz HMTKRDOWGWSTJT-UHFFFAOYSA-N 1 1 364.405 2.512 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518599715 516716830 /nfs/dbraw/zinc/71/68/30/516716830.db2.gz PIEVKOPISPVXIB-CYBMUJFWSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518599715 516716835 /nfs/dbraw/zinc/71/68/35/516716835.db2.gz PIEVKOPISPVXIB-CYBMUJFWSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514203298 516901346 /nfs/dbraw/zinc/90/13/46/516901346.db2.gz HTDKLSKJVHZYPQ-GFCCVEGCSA-N 1 1 357.357 2.800 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212109 516905404 /nfs/dbraw/zinc/90/54/04/516905404.db2.gz BFVYBZUIPCHYJY-PWSUYJOCSA-N 1 1 357.357 2.608 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000555598142 517002313 /nfs/dbraw/zinc/00/23/13/517002313.db2.gz PBWDGTYUBDKFDD-BEFAXECRSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000514683786 517002953 /nfs/dbraw/zinc/00/29/53/517002953.db2.gz IYNDFEXKKRMMAZ-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c([N+](=O)[O-])c1 ZINC000514752256 517038427 /nfs/dbraw/zinc/03/84/27/517038427.db2.gz QGEJOVSOYGFIOQ-XJKSGUPXSA-N 1 1 370.409 2.851 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H](c1ccco1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000552038049 517045593 /nfs/dbraw/zinc/04/55/93/517045593.db2.gz JKLJJGDKAVDASW-AEFFLSMTSA-N 1 1 369.425 2.903 20 5 FFBDMO CN1CC[N@H+](C)C[C@H]1c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000545089765 517048071 /nfs/dbraw/zinc/04/80/71/517048071.db2.gz KVOMMGYEPHQCRD-LBPRGKRZSA-N 1 1 371.319 2.582 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000545089765 517048072 /nfs/dbraw/zinc/04/80/72/517048072.db2.gz KVOMMGYEPHQCRD-LBPRGKRZSA-N 1 1 371.319 2.582 20 5 FFBDMO C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525468559 517050455 /nfs/dbraw/zinc/05/04/55/517050455.db2.gz AHALPUOEIGRXDI-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525468559 517050460 /nfs/dbraw/zinc/05/04/60/517050460.db2.gz AHALPUOEIGRXDI-HNAYVOBHSA-N 1 1 369.421 2.614 20 5 FFBDMO CO[C@@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000552066040 517059217 /nfs/dbraw/zinc/05/92/17/517059217.db2.gz WZXXBJMCPDSYBS-UONOGXRCSA-N 1 1 372.347 2.975 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000525554728 517074619 /nfs/dbraw/zinc/07/46/19/517074619.db2.gz PEUUTBNRAOYPTK-WBMJQRKESA-N 1 1 362.455 2.808 20 5 FFBDMO Cc1ccc(-c2noc([C@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)cc1F ZINC000541685993 517173117 /nfs/dbraw/zinc/17/31/17/517173117.db2.gz CLYNMWMGBPLFIU-NSHDSACASA-N 1 1 360.349 2.640 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](CCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000548761169 517195808 /nfs/dbraw/zinc/19/58/08/517195808.db2.gz LACALNCSLNLMCC-IYBDPMFKSA-N 1 1 362.474 2.881 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000548761169 517195813 /nfs/dbraw/zinc/19/58/13/517195813.db2.gz LACALNCSLNLMCC-IYBDPMFKSA-N 1 1 362.474 2.881 20 5 FFBDMO CC[N@@H+](CCc1cccs1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000519905519 517238864 /nfs/dbraw/zinc/23/88/64/517238864.db2.gz PIYMLXKXFZYWRD-OAHLLOKOSA-N 1 1 350.440 2.961 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CC(C)(CO)CO)cc1[N+](=O)[O-] ZINC000537625390 517266501 /nfs/dbraw/zinc/26/65/01/517266501.db2.gz DJINYCKKHJPXMF-UHFFFAOYSA-N 1 1 373.453 2.785 20 5 FFBDMO C[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000541880185 517271123 /nfs/dbraw/zinc/27/11/23/517271123.db2.gz LVWARZPLZCPYKD-LLVKDONJSA-N 1 1 361.423 2.539 20 5 FFBDMO COc1ccc(CN(C)CCC[NH3+])cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000520229353 517309091 /nfs/dbraw/zinc/30/90/91/517309091.db2.gz NGUMKOYZBHOSGL-UHFFFAOYSA-N 1 1 359.426 2.963 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC1(c2ccccc2)CC1 ZINC000548934439 517311773 /nfs/dbraw/zinc/31/17/73/517311773.db2.gz FUIVZXPDDKGRPS-UHFFFAOYSA-N 1 1 367.449 2.917 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC1(c2ccccc2)CC1 ZINC000548934439 517311782 /nfs/dbraw/zinc/31/17/82/517311782.db2.gz FUIVZXPDDKGRPS-UHFFFAOYSA-N 1 1 367.449 2.917 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@H+](C)C(C)C ZINC000559578477 517324298 /nfs/dbraw/zinc/32/42/98/517324298.db2.gz ITKCEPBCQDXREM-UHFFFAOYSA-N 1 1 358.236 2.736 20 5 FFBDMO C[C@H]1CO[C@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)C[N@@H+]1Cc1ccccc1 ZINC000545814674 517377903 /nfs/dbraw/zinc/37/79/03/517377903.db2.gz XZXQBCGLGFPTKV-LRDDRELGSA-N 1 1 369.381 2.935 20 5 FFBDMO C[C@H]1CO[C@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)C[N@H+]1Cc1ccccc1 ZINC000545814674 517377909 /nfs/dbraw/zinc/37/79/09/517377909.db2.gz XZXQBCGLGFPTKV-LRDDRELGSA-N 1 1 369.381 2.935 20 5 FFBDMO Cc1cc(C[C@@H](C)[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000520439421 517392765 /nfs/dbraw/zinc/39/27/65/517392765.db2.gz UVUDXQXYXGFWSQ-PXAZEXFGSA-N 1 1 354.414 2.670 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCOCCOc3ccccc3)CC2)c1 ZINC000515544983 517401003 /nfs/dbraw/zinc/40/10/03/517401003.db2.gz BLXWZEYFUSGYGI-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000553059408 517502871 /nfs/dbraw/zinc/50/28/71/517502871.db2.gz JSMINWVOZANALW-GJZGRUSLSA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000553059407 517503927 /nfs/dbraw/zinc/50/39/27/517503927.db2.gz JSMINWVOZANALW-CABCVRRESA-N 1 1 360.458 2.785 20 5 FFBDMO Cn1c2ccccc2nc1[C@@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000533524180 517506713 /nfs/dbraw/zinc/50/67/13/517506713.db2.gz GGSUAUDEUMOXSV-INIZCTEOSA-N 1 1 354.414 2.905 20 5 FFBDMO Cn1c2ccccc2nc1[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000533524180 517506718 /nfs/dbraw/zinc/50/67/18/517506718.db2.gz GGSUAUDEUMOXSV-INIZCTEOSA-N 1 1 354.414 2.905 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000533833746 517633272 /nfs/dbraw/zinc/63/32/72/517633272.db2.gz YXMZQICTTJRXQL-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000533833746 517633276 /nfs/dbraw/zinc/63/32/76/517633276.db2.gz YXMZQICTTJRXQL-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO CN1CCN(c2cc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])ccn2)CC1 ZINC000521272271 517677570 /nfs/dbraw/zinc/67/75/70/517677570.db2.gz WPKPDMUAWULZPC-GOSISDBHSA-N 1 1 367.453 2.519 20 5 FFBDMO Cc1cc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)ccc1[N+](=O)[O-] ZINC000556933755 517757419 /nfs/dbraw/zinc/75/74/19/517757419.db2.gz MBGZUYNIRWHQHU-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884302 517799654 /nfs/dbraw/zinc/79/96/54/517799654.db2.gz WTYKBEYIPNYXRJ-KZULUSFZSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C2)C1 ZINC000542884302 517799658 /nfs/dbraw/zinc/79/96/58/517799658.db2.gz WTYKBEYIPNYXRJ-KZULUSFZSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000521769870 517850916 /nfs/dbraw/zinc/85/09/16/517850916.db2.gz FNKCTWHSTMVGJZ-RYUDHWBXSA-N 1 1 367.833 2.616 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1OC ZINC000534336979 517858753 /nfs/dbraw/zinc/85/87/53/517858753.db2.gz QADJJLXDVWJRHL-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000521907694 517894913 /nfs/dbraw/zinc/89/49/13/517894913.db2.gz LJDGYDGQGLYNHH-ZFWWWQNUSA-N 1 1 371.441 2.836 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000521921514 517901322 /nfs/dbraw/zinc/90/13/22/517901322.db2.gz CWFSUPSELZCMCH-HNNXBMFYSA-N 1 1 363.458 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]C2(c3ccc(F)cc3)CC2)cc1 ZINC000543135234 517925794 /nfs/dbraw/zinc/92/57/94/517925794.db2.gz OCIJCDSFIMILGR-UHFFFAOYSA-N 1 1 364.398 2.787 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534559879 517942051 /nfs/dbraw/zinc/94/20/51/517942051.db2.gz QEHXTPPJUYGJPJ-GOSISDBHSA-N 1 1 366.421 2.849 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000534559879 517942061 /nfs/dbraw/zinc/94/20/61/517942061.db2.gz QEHXTPPJUYGJPJ-GOSISDBHSA-N 1 1 366.421 2.849 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000543284469 518002957 /nfs/dbraw/zinc/00/29/57/518002957.db2.gz YQKIQBNFAUFSDE-LLVKDONJSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@H+]1CC[C@](O)(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284770 518058682 /nfs/dbraw/zinc/05/86/82/518058682.db2.gz JZQLXKJXMJJXNB-KRWDZBQOSA-N 1 1 365.817 2.664 20 5 FFBDMO CN1CC[C@](O)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000547284770 518058684 /nfs/dbraw/zinc/05/86/84/518058684.db2.gz JZQLXKJXMJJXNB-KRWDZBQOSA-N 1 1 365.817 2.664 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1 ZINC000554113723 518065337 /nfs/dbraw/zinc/06/53/37/518065337.db2.gz UZBZMQFNSPGZBU-PMUMKWKESA-N 1 1 361.442 2.796 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccc(NCc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000539669858 518134679 /nfs/dbraw/zinc/13/46/79/518134679.db2.gz LKMPRDARQSZWEF-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCCC[C@H]1C ZINC000535371128 518176932 /nfs/dbraw/zinc/17/69/32/518176932.db2.gz FEGMICBIGZKLSS-ZIAGYGMSSA-N 1 1 358.442 2.998 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000572569508 518250464 /nfs/dbraw/zinc/25/04/64/518250464.db2.gz ISFDCCMODRYMAC-AWEZNQCLSA-N 1 1 374.441 2.758 20 5 FFBDMO C[N@@H+](CCNc1c(Br)cncc1[N+](=O)[O-])C1CCCCC1 ZINC000581639925 518382557 /nfs/dbraw/zinc/38/25/57/518382557.db2.gz NUPDEBMNFVADCC-UHFFFAOYSA-N 1 1 357.252 2.851 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000564314587 518393622 /nfs/dbraw/zinc/39/36/22/518393622.db2.gz KEDIWOAURJTOEG-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000564314587 518393630 /nfs/dbraw/zinc/39/36/30/518393630.db2.gz KEDIWOAURJTOEG-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000578839242 518395702 /nfs/dbraw/zinc/39/57/02/518395702.db2.gz ZNHOXMMAKWLBRT-LBPRGKRZSA-N 1 1 371.235 2.915 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C2(CCCCC2)C1 ZINC000581748472 518436966 /nfs/dbraw/zinc/43/69/66/518436966.db2.gz BEKYPBAPHYZEME-UHFFFAOYSA-N 1 1 367.396 2.892 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000570183746 518483054 /nfs/dbraw/zinc/48/30/54/518483054.db2.gz TUJOOQSJXAWHBR-HXUWFJFHSA-N 1 1 368.437 2.672 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000564587237 518514704 /nfs/dbraw/zinc/51/47/04/518514704.db2.gz XXTMKHSIQTYEBR-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCOC(C)(C)C1 ZINC000573142702 518525271 /nfs/dbraw/zinc/52/52/71/518525271.db2.gz HGFJWUSNYGVJAS-MRXNPFEDSA-N 1 1 361.442 2.763 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000579384501 518655241 /nfs/dbraw/zinc/65/52/41/518655241.db2.gz VPDQXTSKKQMMED-LJQANCHMSA-N 1 1 355.438 2.962 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000579419903 518669005 /nfs/dbraw/zinc/66/90/05/518669005.db2.gz WPRSTNTUHCPZLQ-QGZVFWFLSA-N 1 1 374.441 2.516 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000570597060 518685844 /nfs/dbraw/zinc/68/58/44/518685844.db2.gz QCYGTKNBIZMJGL-PBHICJAKSA-N 1 1 373.457 2.821 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000570597060 518685850 /nfs/dbraw/zinc/68/58/50/518685850.db2.gz QCYGTKNBIZMJGL-PBHICJAKSA-N 1 1 373.457 2.821 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164131 518935010 /nfs/dbraw/zinc/93/50/10/518935010.db2.gz FHMNGIAGYHHVBK-LPHOPBHVSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000589164131 518935017 /nfs/dbraw/zinc/93/50/17/518935017.db2.gz FHMNGIAGYHHVBK-LPHOPBHVSA-N 1 1 366.421 2.975 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCNC(=O)C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000589205617 518950749 /nfs/dbraw/zinc/95/07/49/518950749.db2.gz CHZHURLAJIVSQP-LBPRGKRZSA-N 1 1 359.382 2.574 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCNC(=O)C[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000589205617 518950753 /nfs/dbraw/zinc/95/07/53/518950753.db2.gz CHZHURLAJIVSQP-LBPRGKRZSA-N 1 1 359.382 2.574 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)n1 ZINC000582853307 518954753 /nfs/dbraw/zinc/95/47/53/518954753.db2.gz XPYWFNXZHXMRGP-XQQFMLRXSA-N 1 1 350.419 2.555 20 5 FFBDMO COc1ncccc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000589350864 518986763 /nfs/dbraw/zinc/98/67/63/518986763.db2.gz QBSIOSDBQMOTHJ-KRWDZBQOSA-N 1 1 367.409 2.654 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000565504871 518988537 /nfs/dbraw/zinc/98/85/37/518988537.db2.gz JHKRISHRRVFMFG-XQQFMLRXSA-N 1 1 369.849 2.957 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000574121646 518995435 /nfs/dbraw/zinc/99/54/35/518995435.db2.gz UNIXTYWLLKHRID-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000580090198 519003021 /nfs/dbraw/zinc/00/30/21/519003021.db2.gz NWNNUIHVWNSWFZ-INIZCTEOSA-N 1 1 366.421 2.677 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000580090198 519003028 /nfs/dbraw/zinc/00/30/28/519003028.db2.gz NWNNUIHVWNSWFZ-INIZCTEOSA-N 1 1 366.421 2.677 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@H+](C)C[C@H]2c2ccccc2)c1 ZINC000589494562 519016857 /nfs/dbraw/zinc/01/68/57/519016857.db2.gz ONUKLOJSGKBDSB-IBGZPJMESA-N 1 1 369.421 2.870 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)C[C@H]2c2ccccc2)c1 ZINC000589494562 519016865 /nfs/dbraw/zinc/01/68/65/519016865.db2.gz ONUKLOJSGKBDSB-IBGZPJMESA-N 1 1 369.421 2.870 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000589505950 519019545 /nfs/dbraw/zinc/01/95/45/519019545.db2.gz RXBUTUCJHSEMOL-GUYCJALGSA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000589505950 519019550 /nfs/dbraw/zinc/01/95/50/519019550.db2.gz RXBUTUCJHSEMOL-GUYCJALGSA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000589505949 519020023 /nfs/dbraw/zinc/02/00/23/519020023.db2.gz RXBUTUCJHSEMOL-DYVFJYSZSA-N 1 1 358.398 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000589505949 519020029 /nfs/dbraw/zinc/02/00/29/519020029.db2.gz RXBUTUCJHSEMOL-DYVFJYSZSA-N 1 1 358.398 2.661 20 5 FFBDMO C[C@@H](C(=O)NCC[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000577340005 519028672 /nfs/dbraw/zinc/02/86/72/519028672.db2.gz DLJHSVPEQWMQNA-OAHLLOKOSA-N 1 1 353.422 2.873 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000574473720 519171854 /nfs/dbraw/zinc/17/18/54/519171854.db2.gz FZTPMPAMXGDTQG-ZJNRKIDTSA-N 1 1 356.426 2.878 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[C@H]4C[N@@H+](C)C[C@@H]43)cc2[N+](=O)[O-])CC1 ZINC000590446585 519235980 /nfs/dbraw/zinc/23/59/80/519235980.db2.gz UWQQAOQUKZOFNY-LPHOPBHVSA-N 1 1 372.469 2.607 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601947 519283427 /nfs/dbraw/zinc/28/34/27/519283427.db2.gz UEMUGRPZNDPGHU-BEFAXECRSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601947 519283431 /nfs/dbraw/zinc/28/34/31/519283431.db2.gz UEMUGRPZNDPGHU-BEFAXECRSA-N 1 1 366.421 2.975 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000569164169 519408151 /nfs/dbraw/zinc/40/81/51/519408151.db2.gz XZOOCDVGTQKKIU-MRXNPFEDSA-N 1 1 364.490 2.959 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000583758020 519420318 /nfs/dbraw/zinc/42/03/18/519420318.db2.gz QGBFUDVANRMEGZ-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO CC(C)[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)CC[N@H+]1C ZINC000566383194 519465243 /nfs/dbraw/zinc/46/52/43/519465243.db2.gz ALRKKBITRPQKHY-KRWDZBQOSA-N 1 1 370.457 2.965 20 5 FFBDMO Cc1c(Cl)cc(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000581219837 519582461 /nfs/dbraw/zinc/58/24/61/519582461.db2.gz AIDPMGGDDJGDAL-SNVBAGLBSA-N 1 1 363.867 2.564 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000581243435 519595353 /nfs/dbraw/zinc/59/53/53/519595353.db2.gz BOZYFIASBSZCRK-ZWKOTPCHSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000602872301 519940905 /nfs/dbraw/zinc/94/09/05/519940905.db2.gz BTZRUEIJLNRKOQ-QGZVFWFLSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[C@@H](C)[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599995516 519992498 /nfs/dbraw/zinc/99/24/98/519992498.db2.gz DFRLIKLRVUXDSE-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599998582 519993342 /nfs/dbraw/zinc/99/33/42/519993342.db2.gz HWKVNTQRWUCPRX-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO CC(C)Oc1nc(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000594586556 520039143 /nfs/dbraw/zinc/03/91/43/520039143.db2.gz UOFNLIDIMBCHIZ-SJORKVTESA-N 1 1 370.453 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)c(Cl)c1 ZINC000594616483 520057817 /nfs/dbraw/zinc/05/78/17/520057817.db2.gz DBKDRRJGSXOLAM-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)c(Cl)c1 ZINC000594616483 520057822 /nfs/dbraw/zinc/05/78/22/520057822.db2.gz DBKDRRJGSXOLAM-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597575935 520113184 /nfs/dbraw/zinc/11/31/84/520113184.db2.gz AIKIZBPSPAOAGU-CHWSQXEVSA-N 1 1 355.797 2.815 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594791310 520159840 /nfs/dbraw/zinc/15/98/40/520159840.db2.gz NWDXKHWYGFOISE-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157478 520213335 /nfs/dbraw/zinc/21/33/35/520213335.db2.gz UVIYIEFZGKHUGZ-INIZCTEOSA-N 1 1 357.414 2.765 20 5 FFBDMO COc1cc(C[NH2+]Cc2cccnc2N2CCCC2)c([N+](=O)[O-])cc1OC ZINC000594955926 520228478 /nfs/dbraw/zinc/22/84/78/520228478.db2.gz DBVGPHYRIYEFPZ-UHFFFAOYSA-N 1 1 372.425 2.897 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN[C@H]1CC[N@H+](C3CCCCC3)C1)OCCO2 ZINC000594977630 520240002 /nfs/dbraw/zinc/24/00/02/520240002.db2.gz MACCUJOYXGXPIU-HNNXBMFYSA-N 1 1 361.442 2.863 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2ccccc2[N+](=O)[O-])C1 ZINC000594993690 520247432 /nfs/dbraw/zinc/24/74/32/520247432.db2.gz HAIXINXQIKPORF-IBGZPJMESA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2ccccc2[N+](=O)[O-])C1 ZINC000594993690 520247439 /nfs/dbraw/zinc/24/74/39/520247439.db2.gz HAIXINXQIKPORF-IBGZPJMESA-N 1 1 354.454 2.501 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000595048854 520270863 /nfs/dbraw/zinc/27/08/63/520270863.db2.gz RQAZIEOAYOASLM-LSDHHAIUSA-N 1 1 351.447 2.755 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000609310214 520271300 /nfs/dbraw/zinc/27/13/00/520271300.db2.gz XIHMFEWEPXZRJV-MRXNPFEDSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000597857340 520283703 /nfs/dbraw/zinc/28/37/03/520283703.db2.gz DUVNYXZRDXCNDY-OAHLLOKOSA-N 1 1 360.458 2.798 20 5 FFBDMO Cn1cc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597859835 520285579 /nfs/dbraw/zinc/28/55/79/520285579.db2.gz YWNRNMBXZLQLJQ-HNNXBMFYSA-N 1 1 371.441 2.598 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000609358851 520294962 /nfs/dbraw/zinc/29/49/62/520294962.db2.gz GBPRTJXAGSWZHM-GASCZTMLSA-N 1 1 363.462 2.569 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000597921876 520324696 /nfs/dbraw/zinc/32/46/96/520324696.db2.gz HFSHBUNNHKDCHN-NSHDSACASA-N 1 1 357.357 2.799 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609522432 520342203 /nfs/dbraw/zinc/34/22/03/520342203.db2.gz KYHHSACEENKCSA-GFCCVEGCSA-N 1 1 355.822 2.570 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597943955 520343053 /nfs/dbraw/zinc/34/30/53/520343053.db2.gz BDTJCIOQKKMUDW-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595342179 520417551 /nfs/dbraw/zinc/41/75/51/520417551.db2.gz LAHIOOJBRODNSS-AWEZNQCLSA-N 1 1 358.398 2.533 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595342179 520417557 /nfs/dbraw/zinc/41/75/57/520417557.db2.gz LAHIOOJBRODNSS-AWEZNQCLSA-N 1 1 358.398 2.533 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000609914129 520480397 /nfs/dbraw/zinc/48/03/97/520480397.db2.gz ZDFAEFXHXPXPKL-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000609914129 520480404 /nfs/dbraw/zinc/48/04/04/520480404.db2.gz ZDFAEFXHXPXPKL-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000598195617 520487579 /nfs/dbraw/zinc/48/75/79/520487579.db2.gz PRQWSXNOSRQUGZ-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595470076 520493463 /nfs/dbraw/zinc/49/34/63/520493463.db2.gz LYCHXGOKKRUZPT-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595470076 520493467 /nfs/dbraw/zinc/49/34/67/520493467.db2.gz LYCHXGOKKRUZPT-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CO[C@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CCCC1 ZINC000595504953 520514247 /nfs/dbraw/zinc/51/42/47/520514247.db2.gz LERPBSZTIDSIDC-GOSISDBHSA-N 1 1 361.442 2.558 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000595504255 520514274 /nfs/dbraw/zinc/51/42/74/520514274.db2.gz HIYDEAJGCBBYOG-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505023 520515269 /nfs/dbraw/zinc/51/52/69/520515269.db2.gz PKTZHOBACJDRJO-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505023 520515272 /nfs/dbraw/zinc/51/52/72/520515272.db2.gz PKTZHOBACJDRJO-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505023 520515279 /nfs/dbraw/zinc/51/52/79/520515279.db2.gz PKTZHOBACJDRJO-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505023 520515286 /nfs/dbraw/zinc/51/52/86/520515286.db2.gz PKTZHOBACJDRJO-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(CNC(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000595587590 520573730 /nfs/dbraw/zinc/57/37/30/520573730.db2.gz ISLGWUJXOXTERN-MRXNPFEDSA-N 1 1 360.458 2.824 20 5 FFBDMO CCCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000592828328 520604660 /nfs/dbraw/zinc/60/46/60/520604660.db2.gz GPQJXCWXHNAAEU-CYBMUJFWSA-N 1 1 370.247 2.914 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C(C)C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873667 520626919 /nfs/dbraw/zinc/62/69/19/520626919.db2.gz QGBMVNAQZXQKAX-INIZCTEOSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C(C)C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873667 520626923 /nfs/dbraw/zinc/62/69/23/520626923.db2.gz QGBMVNAQZXQKAX-INIZCTEOSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C(C)C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000592873667 520626927 /nfs/dbraw/zinc/62/69/27/520626927.db2.gz QGBMVNAQZXQKAX-INIZCTEOSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1ccc(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000592879658 520630344 /nfs/dbraw/zinc/63/03/44/520630344.db2.gz BCVLQJWNLTUVDM-MSOLQXFVSA-N 1 1 353.422 2.978 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)c1cscn1 ZINC000595666837 520633415 /nfs/dbraw/zinc/63/34/15/520633415.db2.gz DKYLHALIEBHVQD-SNVBAGLBSA-N 1 1 350.400 2.739 20 5 FFBDMO COc1cc2c(cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000601149196 520658849 /nfs/dbraw/zinc/65/88/49/520658849.db2.gz KPCTZQIDDKSBLL-XCLFUZPHSA-N 1 1 372.421 2.924 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H]3CCC4(CCOCC4)[C@H]3O)c2c1 ZINC000601161863 520666957 /nfs/dbraw/zinc/66/69/57/520666957.db2.gz VKQXLQKELVJWLK-UGSOOPFHSA-N 1 1 357.410 2.545 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000601183150 520675819 /nfs/dbraw/zinc/67/58/19/520675819.db2.gz AGGBSJPQMMNTLM-HIFRSBDPSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC1=CCCOC1 ZINC000595752486 520699407 /nfs/dbraw/zinc/69/94/07/520699407.db2.gz KRXLCRWDVOQZBG-LLVKDONJSA-N 1 1 353.806 2.854 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1=CCCOC1 ZINC000595752486 520699414 /nfs/dbraw/zinc/69/94/14/520699414.db2.gz KRXLCRWDVOQZBG-LLVKDONJSA-N 1 1 353.806 2.854 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[NH+]2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 ZINC000610484868 520709674 /nfs/dbraw/zinc/70/96/74/520709674.db2.gz VOWKQEAMZUZECZ-RKDXNWHRSA-N 1 1 360.258 2.854 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000595767160 520709714 /nfs/dbraw/zinc/70/97/14/520709714.db2.gz VRZFMVMECJVGES-ZYHUDNBSSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000593055571 520712671 /nfs/dbraw/zinc/71/26/71/520712671.db2.gz LYLMZCJLVFLWBY-HNNXBMFYSA-N 1 1 365.430 2.821 20 5 FFBDMO O=C1[C@H]([NH+]2CCC([C@H]3CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595785204 520721719 /nfs/dbraw/zinc/72/17/19/520721719.db2.gz WWRXAKFVMXVSEU-RTBURBONSA-N 1 1 373.453 2.981 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]([C@@H]2CCCCO2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595788325 520725403 /nfs/dbraw/zinc/72/54/03/520725403.db2.gz JCKGWSIWZNQEEC-YJBOKZPZSA-N 1 1 361.442 2.839 20 5 FFBDMO O=C(C[NH+]1CCC([C@@H]2CCCCO2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595787958 520725729 /nfs/dbraw/zinc/72/57/29/520725729.db2.gz LAHXWFFKLGHNGV-IBGZPJMESA-N 1 1 373.453 2.765 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC000593089823 520736387 /nfs/dbraw/zinc/73/63/87/520736387.db2.gz FNPKDMTXTORGOH-NVXWUHKLSA-N 1 1 356.422 2.996 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C[C@H]1C ZINC000598605308 520737673 /nfs/dbraw/zinc/73/76/73/520737673.db2.gz BDQYJAZNMZSWNV-UKRRQHHQSA-N 1 1 369.487 2.705 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H](C4CC[NH2+]CC4)C3)n2)cc1 ZINC000595900358 520804694 /nfs/dbraw/zinc/80/46/94/520804694.db2.gz DBUJNHSPUOYBEO-INIZCTEOSA-N 1 1 371.441 2.856 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000593187555 520811299 /nfs/dbraw/zinc/81/12/99/520811299.db2.gz LSZIVBFEAFPINF-BZUAXINKSA-N 1 1 374.485 2.751 20 5 FFBDMO C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@](C)(C(F)F)O1 ZINC000595918102 520823857 /nfs/dbraw/zinc/82/38/57/520823857.db2.gz ONQJNPLCEVQMHZ-BDJLRTHQSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@](C)(C(F)F)O1 ZINC000595918102 520823861 /nfs/dbraw/zinc/82/38/61/520823861.db2.gz ONQJNPLCEVQMHZ-BDJLRTHQSA-N 1 1 357.357 2.668 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCO[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595916968 520824290 /nfs/dbraw/zinc/82/42/90/520824290.db2.gz PTBSLFGOOIRQJY-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCO[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595916968 520824297 /nfs/dbraw/zinc/82/42/97/520824297.db2.gz PTBSLFGOOIRQJY-INIZCTEOSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](CC(=O)Nc1ccc(F)cc1)C(C)C ZINC000610782899 520841009 /nfs/dbraw/zinc/84/10/09/520841009.db2.gz WAAKVAIDOBFQIE-UHFFFAOYSA-N 1 1 363.393 2.588 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CC(=O)Nc1ccc(F)cc1)C(C)C ZINC000610782899 520841014 /nfs/dbraw/zinc/84/10/14/520841014.db2.gz WAAKVAIDOBFQIE-UHFFFAOYSA-N 1 1 363.393 2.588 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000601589350 520853155 /nfs/dbraw/zinc/85/31/55/520853155.db2.gz BIUMZGQQPBHXCG-CQSZACIVSA-N 1 1 359.357 2.553 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593324605 520911506 /nfs/dbraw/zinc/91/15/06/520911506.db2.gz YJDBGKWJZVPCQE-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593324605 520911510 /nfs/dbraw/zinc/91/15/10/520911510.db2.gz YJDBGKWJZVPCQE-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000596200617 520967821 /nfs/dbraw/zinc/96/78/21/520967821.db2.gz NGPYWRNTANGSKQ-SECBINFHSA-N 1 1 350.762 2.658 20 5 FFBDMO O=c1[nH]ccc(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596209488 520972257 /nfs/dbraw/zinc/97/22/57/520972257.db2.gz FTPPQHSNKYVEQU-CQSZACIVSA-N 1 1 360.439 2.725 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000593424513 520985429 /nfs/dbraw/zinc/98/54/29/520985429.db2.gz IROSTFNJZHFUJY-UHFFFAOYSA-N 1 1 350.463 2.757 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000596243052 520990146 /nfs/dbraw/zinc/99/01/46/520990146.db2.gz FONXUZCBHQCNJP-QGZVFWFLSA-N 1 1 367.833 2.957 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599042143 520995676 /nfs/dbraw/zinc/99/56/76/520995676.db2.gz KLHBYBLYIUUXCR-KRWDZBQOSA-N 1 1 369.469 2.749 20 5 FFBDMO Cc1cc(N[C@@H]2CC[N@@H+](CC3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611132472 521002223 /nfs/dbraw/zinc/00/22/23/521002223.db2.gz PAPQNGNETBUGSL-MRXNPFEDSA-N 1 1 353.426 2.678 20 5 FFBDMO CC[N@H+]1CCCN(c2ncc([N+](=O)[O-])c(C)c2Br)[C@H](C)C1 ZINC000596268490 521002303 /nfs/dbraw/zinc/00/23/03/521002303.db2.gz ITIDUJXLGWESSE-SNVBAGLBSA-N 1 1 357.252 2.981 20 5 FFBDMO CC[N@H+]1CCCN(c2ncc([N+](=O)[O-])c(C)c2Br)[C@@H](C)C1 ZINC000596268483 521002916 /nfs/dbraw/zinc/00/29/16/521002916.db2.gz ITIDUJXLGWESSE-JTQLQIEISA-N 1 1 357.252 2.981 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000614533760 521015552 /nfs/dbraw/zinc/01/55/52/521015552.db2.gz YBVUCQORRODMRE-HXUWFJFHSA-N 1 1 371.437 2.677 20 5 FFBDMO Cc1cc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC000593496677 521033829 /nfs/dbraw/zinc/03/38/29/521033829.db2.gz VRLFQICXLHGHHM-RTBURBONSA-N 1 1 368.437 2.778 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000611248098 521055732 /nfs/dbraw/zinc/05/57/32/521055732.db2.gz RYXVJDYXWIPFCG-HNNXBMFYSA-N 1 1 364.490 2.670 20 5 FFBDMO O=[N+]([O-])c1cnc(NC2(C[NH+]3CCN(c4ccccc4)CC3)CC2)s1 ZINC000596512775 521107404 /nfs/dbraw/zinc/10/74/04/521107404.db2.gz SVTPERWLQJIUQS-UHFFFAOYSA-N 1 1 359.455 2.818 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N[C@@H]3C[C@@H]([NH+]4CCOCC4)C34CCC4)ccc2c1 ZINC000596514915 521108749 /nfs/dbraw/zinc/10/87/49/521108749.db2.gz NESROQLAAPKMTE-QZTJIDSGSA-N 1 1 368.437 2.620 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CCC([N@H+]4CC[C@@H](O)C4)CC3)n2)cc1 ZINC000596539288 521122559 /nfs/dbraw/zinc/12/25/59/521122559.db2.gz OBZXUJRICGASOG-MRXNPFEDSA-N 1 1 374.466 2.754 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O ZINC000611526047 521202998 /nfs/dbraw/zinc/20/29/98/521202998.db2.gz FLPSVEIIURSWLD-DZGCQCFKSA-N 1 1 350.415 2.595 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O ZINC000611526047 521203004 /nfs/dbraw/zinc/20/30/04/521203004.db2.gz FLPSVEIIURSWLD-DZGCQCFKSA-N 1 1 350.415 2.595 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1C ZINC000599464894 521240702 /nfs/dbraw/zinc/24/07/02/521240702.db2.gz WKMOKMFIGPXKFN-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])C1 ZINC000618829905 521254616 /nfs/dbraw/zinc/25/46/16/521254616.db2.gz TWZMIRCQNHBZOS-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)C1(F)F ZINC000599512745 521270604 /nfs/dbraw/zinc/27/06/04/521270604.db2.gz MEESXMCCPWORFG-TYNCELHUSA-N 1 1 353.369 2.923 20 5 FFBDMO C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)C1(F)F ZINC000599512745 521270612 /nfs/dbraw/zinc/27/06/12/521270612.db2.gz MEESXMCCPWORFG-TYNCELHUSA-N 1 1 353.369 2.923 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC[C@H]([NH+]3CCOCC3)C2)c1 ZINC000594003035 521343205 /nfs/dbraw/zinc/34/32/05/521343205.db2.gz XXCJEUSETBHCJN-HNNXBMFYSA-N 1 1 373.375 2.910 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252167 521472117 /nfs/dbraw/zinc/47/21/17/521472117.db2.gz FSSZCBBRBKFPHF-MAZHCROVSA-N 1 1 367.446 2.720 20 5 FFBDMO CON1CCC([N@H+](C)Cc2cc(Br)c([N+](=O)[O-])s2)CC1 ZINC000602690553 521481313 /nfs/dbraw/zinc/48/13/13/521481313.db2.gz ODQQOELMMHBIPG-UHFFFAOYSA-N 1 1 364.265 2.876 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]2N1 ZINC000602711486 521491111 /nfs/dbraw/zinc/49/11/11/521491111.db2.gz ZUNYBYNPPIJPIX-GWCFXTLKSA-N 1 1 357.332 2.714 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@H]2C1 ZINC000599832686 521501659 /nfs/dbraw/zinc/50/16/59/521501659.db2.gz IGUABJJKGAPLAH-SJCJKPOMSA-N 1 1 355.398 2.701 20 5 FFBDMO C[N@@H+](CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C1CCCC1 ZINC000597105837 521510557 /nfs/dbraw/zinc/51/05/57/521510557.db2.gz YHLHMRXPZDSMOS-UHFFFAOYSA-N 1 1 355.826 2.826 20 5 FFBDMO COCCSc1ccc([C@@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC000602807509 521543912 /nfs/dbraw/zinc/54/39/12/521543912.db2.gz VHSPMLQOYOEQND-GFCCVEGCSA-N 1 1 350.444 2.918 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](Cn4ccnn4)C3)o2)c1 ZINC000597173757 521556002 /nfs/dbraw/zinc/55/60/02/521556002.db2.gz IPGBFOTUEVUHNF-AWEZNQCLSA-N 1 1 353.382 2.968 20 5 FFBDMO O=C(N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccc([N+](=O)[O-])[nH]1 ZINC000612285763 521560460 /nfs/dbraw/zinc/56/04/60/521560460.db2.gz DKJIIUWXJVTFSL-YESZJQIVSA-N 1 1 368.437 2.953 20 5 FFBDMO CO[C@]1(CO)CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597188814 521564718 /nfs/dbraw/zinc/56/47/18/521564718.db2.gz WUGDOAMAIINZMK-QGZVFWFLSA-N 1 1 363.439 2.692 20 5 FFBDMO CO[C@]1(CO)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597188814 521564723 /nfs/dbraw/zinc/56/47/23/521564723.db2.gz WUGDOAMAIINZMK-QGZVFWFLSA-N 1 1 363.439 2.692 20 5 FFBDMO COc1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000619440576 521568761 /nfs/dbraw/zinc/56/87/61/521568761.db2.gz HPWOAFFYUJKXSC-XJKSGUPXSA-N 1 1 359.426 2.692 20 5 FFBDMO Nc1cc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc(CO)c1[N+](=O)[O-] ZINC000619570506 521775344 /nfs/dbraw/zinc/77/53/44/521775344.db2.gz LIPOJXBUXCBEOY-INIZCTEOSA-N 1 1 370.453 2.646 20 5 FFBDMO C[C@@H](C[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)C(C)(C)C ZINC000619844054 521901823 /nfs/dbraw/zinc/90/18/23/521901823.db2.gz BMRRHYKGTSHAFC-AWEZNQCLSA-N 1 1 369.487 2.583 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[nH+]c1 ZINC000531489075 562447731 /nfs/dbraw/zinc/44/77/31/562447731.db2.gz ZWOSOMXSBTVAQQ-UHFFFAOYSA-N 1 1 367.409 2.871 20 5 FFBDMO CN1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000535594617 562562185 /nfs/dbraw/zinc/56/21/85/562562185.db2.gz QVAOIICPGKMJBO-UHFFFAOYSA-N 1 1 355.442 2.706 20 5 FFBDMO Cc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164631593 719108381 /nfs/dbraw/zinc/10/83/81/719108381.db2.gz YRCOQKILAOWBTJ-SJLPKXTDSA-N 1 1 353.426 2.794 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726109 720334897 /nfs/dbraw/zinc/33/48/97/720334897.db2.gz PSUQZVGVXFCUDF-JKSUJKDBSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c(Cl)c1 ZINC001164726109 720334900 /nfs/dbraw/zinc/33/49/00/720334900.db2.gz PSUQZVGVXFCUDF-JKSUJKDBSA-N 1 1 359.817 2.891 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc([N+](=O)[O-])ccn3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164837833 720509526 /nfs/dbraw/zinc/50/95/26/720509526.db2.gz PNZQHSILARIZJG-RYQLBKOJSA-N 1 1 370.457 2.564 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc([N+](=O)[O-])cc1F)[C@H]2C ZINC001164859284 720948847 /nfs/dbraw/zinc/94/88/47/720948847.db2.gz MASUJKRNPBEQDY-LBPRGKRZSA-N 1 1 362.409 2.747 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1C[C@@H]2C[NH+](Cc3nccs3)C[C@H]2C1 ZINC001164783326 721391261 /nfs/dbraw/zinc/39/12/61/721391261.db2.gz HJYXPIBKKLFFBN-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000153941716 728791996 /nfs/dbraw/zinc/79/19/96/728791996.db2.gz LFHPQTPBEBOXKM-ZDUSSCGKSA-N 1 1 356.806 2.792 20 5 FFBDMO CC(C)C[C@@H]1COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128646198 728709249 /nfs/dbraw/zinc/70/92/49/728709249.db2.gz LRXUISGRCGMSAP-CQSZACIVSA-N 1 1 353.394 2.809 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C2OCCO2)C1 ZINC000170914837 728992007 /nfs/dbraw/zinc/99/20/07/728992007.db2.gz SFGGATKKRHPTTQ-CQSZACIVSA-N 1 1 350.415 2.967 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000778947682 738423680 /nfs/dbraw/zinc/42/36/80/738423680.db2.gz YJKGTSCQTOZQBN-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000906201146 736469347 /nfs/dbraw/zinc/46/93/47/736469347.db2.gz WDHAYHSLORBKRU-HZPDHXFCSA-N 1 1 351.834 2.924 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000872020346 731721422 /nfs/dbraw/zinc/72/14/22/731721422.db2.gz GJNAAKDXYZWAGP-RHSMWYFYSA-N 1 1 352.454 2.657 20 5 FFBDMO C[C@H]([NH2+]C[C@H]1CS(=O)(=O)c2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872075890 731727305 /nfs/dbraw/zinc/72/73/05/731727305.db2.gz VJLABBMOAUMLHD-RYUDHWBXSA-N 1 1 364.398 2.956 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1c(Br)cnn1C ZINC000873150901 731881138 /nfs/dbraw/zinc/88/11/38/731881138.db2.gz RYBQEIBZRHAPTB-UHFFFAOYSA-N 1 1 353.220 2.997 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000874834508 732105549 /nfs/dbraw/zinc/10/55/49/732105549.db2.gz SFXIXUGLQUEWHR-KGLIPLIRSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1cc(Br)no1 ZINC000878566166 732555329 /nfs/dbraw/zinc/55/53/29/732555329.db2.gz UAGUEQKUUABRCZ-GFCCVEGCSA-N 1 1 370.203 2.553 20 5 FFBDMO CN(Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C[C@H]1CCC[N@H+]1C ZINC000878722348 732583184 /nfs/dbraw/zinc/58/31/84/732583184.db2.gz FABKEAWCTBGHNL-GFCCVEGCSA-N 1 1 365.821 2.824 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879560978 732723116 /nfs/dbraw/zinc/72/31/16/732723116.db2.gz JSVSCEVMOKQDBT-STQMWFEESA-N 1 1 365.455 2.617 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880005890 732817329 /nfs/dbraw/zinc/81/73/29/732817329.db2.gz DSSVFENLICQCFG-UKRRQHHQSA-N 1 1 363.439 2.589 20 5 FFBDMO CN1C(=O)C[C@@H]([NH2+]Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000886169820 733756593 /nfs/dbraw/zinc/75/65/93/733756593.db2.gz JKPFJJFCRCXUSY-GDBMZVCRSA-N 1 1 360.801 2.705 20 5 FFBDMO CCOc1cc(NC(=O)NCC[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000888831787 734103367 /nfs/dbraw/zinc/10/33/67/734103367.db2.gz PJTQVCNWQILEFM-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000894919507 734936939 /nfs/dbraw/zinc/93/69/39/734936939.db2.gz IQPAOBBOLCVZGB-KRWDZBQOSA-N 1 1 350.415 2.946 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252894 735779059 /nfs/dbraw/zinc/77/90/59/735779059.db2.gz PKUKKXYVGVXWNF-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252894 735779063 /nfs/dbraw/zinc/77/90/63/735779063.db2.gz PKUKKXYVGVXWNF-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO C[C@@H]([NH2+]Cc1cn(C)nc1Br)c1ccc(N)c([N+](=O)[O-])c1 ZINC000903188453 736051782 /nfs/dbraw/zinc/05/17/82/736051782.db2.gz REBIORAXUFUQBY-MRVPVSSYSA-N 1 1 354.208 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903508683 736103859 /nfs/dbraw/zinc/10/38/59/736103859.db2.gz QMHVNVUOJWTIFG-CALCHBBNSA-N 1 1 364.877 2.649 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000755012016 736226492 /nfs/dbraw/zinc/22/64/92/736226492.db2.gz CNLUUOPLFUWDBX-PSASIEDQSA-N 1 1 374.210 2.709 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000756967372 736378396 /nfs/dbraw/zinc/37/83/96/736378396.db2.gz WMLCUEHUXMKLDT-CHWSQXEVSA-N 1 1 352.822 2.674 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757729257 736423037 /nfs/dbraw/zinc/42/30/37/736423037.db2.gz LGXORFYFHCAQOI-MEBBXXQBSA-N 1 1 352.822 2.530 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C[C@H]1C ZINC000906781221 736542946 /nfs/dbraw/zinc/54/29/46/736542946.db2.gz RKTUBTGYCGCLJC-ZYHUDNBSSA-N 1 1 354.838 2.775 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000906781219 736543066 /nfs/dbraw/zinc/54/30/66/736543066.db2.gz RKTUBTGYCGCLJC-JQWIXIFHSA-N 1 1 354.838 2.775 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759911271 736603478 /nfs/dbraw/zinc/60/34/78/736603478.db2.gz SXHGVWYZOHYEKU-CYBMUJFWSA-N 1 1 358.423 2.689 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759911271 736603480 /nfs/dbraw/zinc/60/34/80/736603480.db2.gz SXHGVWYZOHYEKU-CYBMUJFWSA-N 1 1 358.423 2.689 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760838903 736673214 /nfs/dbraw/zinc/67/32/14/736673214.db2.gz ZUUHIEUZVJZSLZ-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@]12CC[N@@H+](C1)CCC2 ZINC000908076191 736713371 /nfs/dbraw/zinc/71/33/71/736713371.db2.gz OFXKTWMAAQJICF-AWEZNQCLSA-N 1 1 354.204 2.782 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000910268758 737050618 /nfs/dbraw/zinc/05/06/18/737050618.db2.gz GUUWYZBXBJADGW-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911472275 737202889 /nfs/dbraw/zinc/20/28/89/737202889.db2.gz HARUNCNACCBSBK-SNVBAGLBSA-N 1 1 352.341 2.899 20 5 FFBDMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000770687329 737653232 /nfs/dbraw/zinc/65/32/32/737653232.db2.gz IPKFQXRMKFNQKW-YMTOWFKASA-N 1 1 369.830 2.960 20 5 FFBDMO Cc1c(C(=O)OCC[C@H]2CCCC[N@@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000919227913 737845558 /nfs/dbraw/zinc/84/55/58/737845558.db2.gz SLSYHWOGLGAMGQ-GFCCVEGCSA-N 1 1 351.359 2.843 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000922643841 738178686 /nfs/dbraw/zinc/17/86/86/738178686.db2.gz BVYCFPQPSSROPY-MAZHCROVSA-N 1 1 364.471 2.535 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1 ZINC000786776514 739076177 /nfs/dbraw/zinc/07/61/77/739076177.db2.gz PDSWEEMYUSKQQA-UHFFFAOYSA-N 1 1 369.487 2.555 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000930767462 739159937 /nfs/dbraw/zinc/15/99/37/739159937.db2.gz GOKOQHWBMVSXDQ-ZANVPECISA-N 1 1 358.320 2.781 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC000930928110 739186652 /nfs/dbraw/zinc/18/66/52/739186652.db2.gz BSLAVDWTXKIFTA-GRYCIOLGSA-N 1 1 355.232 2.950 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000788546392 739256932 /nfs/dbraw/zinc/25/69/32/739256932.db2.gz GFCNQGKCGYCEKU-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000788546392 739256936 /nfs/dbraw/zinc/25/69/36/739256936.db2.gz GFCNQGKCGYCEKU-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000788596013 739261981 /nfs/dbraw/zinc/26/19/81/739261981.db2.gz BTOREMZSYWPKST-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000788596013 739261983 /nfs/dbraw/zinc/26/19/83/739261983.db2.gz BTOREMZSYWPKST-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC000933437409 739625161 /nfs/dbraw/zinc/62/51/61/739625161.db2.gz CJRZSJOAEAPYBI-BXKDBHETSA-N 1 1 372.828 2.772 20 5 FFBDMO Cn1cc([C@@H]2CSCCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)cn1 ZINC000933979815 739714568 /nfs/dbraw/zinc/71/45/68/739714568.db2.gz AOQJCLRZWHEPEI-KRWDZBQOSA-N 1 1 362.455 2.887 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000793309812 739765301 /nfs/dbraw/zinc/76/53/01/739765301.db2.gz RQAWTTOZGGFINA-CYBMUJFWSA-N 1 1 350.488 2.778 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934337321 739769086 /nfs/dbraw/zinc/76/90/86/739769086.db2.gz VVQBOZWHLDKCNF-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934337321 739769090 /nfs/dbraw/zinc/76/90/90/739769090.db2.gz VVQBOZWHLDKCNF-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H]1CCC[N@@H+]1CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795431405 740020880 /nfs/dbraw/zinc/02/08/80/740020880.db2.gz GIMCHOXTZFIWOG-VIFPVBQESA-N 1 1 354.204 2.755 20 5 FFBDMO C[C@H]1CCC[N@H+]1CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795431405 740020882 /nfs/dbraw/zinc/02/08/82/740020882.db2.gz GIMCHOXTZFIWOG-VIFPVBQESA-N 1 1 354.204 2.755 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000796174762 740111996 /nfs/dbraw/zinc/11/19/96/740111996.db2.gz URYVSVWLAMEQDY-HNNXBMFYSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000796174762 740112000 /nfs/dbraw/zinc/11/20/00/740112000.db2.gz URYVSVWLAMEQDY-HNNXBMFYSA-N 1 1 351.403 2.704 20 5 FFBDMO Cc1cc(C[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c(C)s1 ZINC000963791231 740656052 /nfs/dbraw/zinc/65/60/52/740656052.db2.gz PPXCGWFXIBGSIA-YVXVDGILSA-N 1 1 363.483 2.547 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000803859758 740836020 /nfs/dbraw/zinc/83/60/20/740836020.db2.gz VVZADDDMQXXGAQ-CYBMUJFWSA-N 1 1 351.359 2.811 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2cc3ccccc3s2)CC1 ZINC000981137126 741137458 /nfs/dbraw/zinc/13/74/58/741137458.db2.gz NVFRTZSFQYGECG-HZPDHXFCSA-N 1 1 359.451 2.601 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2cc3ccccc3s2)CC1 ZINC000981137126 741137461 /nfs/dbraw/zinc/13/74/61/741137461.db2.gz NVFRTZSFQYGECG-HZPDHXFCSA-N 1 1 359.451 2.601 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2cc3ccccc3s2)CC1 ZINC000981137126 741137463 /nfs/dbraw/zinc/13/74/63/741137463.db2.gz NVFRTZSFQYGECG-HZPDHXFCSA-N 1 1 359.451 2.601 20 5 FFBDMO C[C@H](COC(=O)c1ccccc1OCC[N@H+]1CCCC[C@H]1C)[N+](=O)[O-] ZINC000813109034 741677804 /nfs/dbraw/zinc/67/78/04/741677804.db2.gz NRIGLLBQWYLRPM-HUUCEWRRSA-N 1 1 350.415 2.762 20 5 FFBDMO C[C@@H](COC(=O)c1ccccc1OCC[N@H+]1CCCC[C@@H]1C)[N+](=O)[O-] ZINC000813109033 741677974 /nfs/dbraw/zinc/67/79/74/741677974.db2.gz NRIGLLBQWYLRPM-GJZGRUSLSA-N 1 1 350.415 2.762 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)OCC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000814482782 741835478 /nfs/dbraw/zinc/83/54/78/741835478.db2.gz ASAFCBILOHHICN-GFCCVEGCSA-N 1 1 353.394 2.831 20 5 FFBDMO CC[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](CC)O1 ZINC000817280322 742116410 /nfs/dbraw/zinc/11/64/10/742116410.db2.gz CQWUJKOHGYTUTN-OKILXGFUSA-N 1 1 353.394 2.952 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C2)C1 ZINC000820342968 742493353 /nfs/dbraw/zinc/49/33/53/742493353.db2.gz PEZDIYBOSFDDPO-KRWDZBQOSA-N 1 1 351.834 2.735 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000820664398 742533674 /nfs/dbraw/zinc/53/36/74/742533674.db2.gz MYTXDUSRGJEVNN-UHFFFAOYSA-N 1 1 372.263 2.640 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000822152979 742702935 /nfs/dbraw/zinc/70/29/35/742702935.db2.gz VZSGLPZKJJPSIK-VIFPVBQESA-N 1 1 358.801 2.524 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000823503509 742927709 /nfs/dbraw/zinc/92/77/09/742927709.db2.gz UGGZPJWUNDKVDP-FUHWJXTLSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC001034645245 742928647 /nfs/dbraw/zinc/92/86/47/742928647.db2.gz QDUDMOKCTLILIT-KCYZZUKISA-N 1 1 365.861 2.831 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000825275517 743239371 /nfs/dbraw/zinc/23/93/71/743239371.db2.gz REXUZMBQKZNRCH-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NCCn2cc[nH+]c2C(C)C)c1F ZINC000827436816 743576061 /nfs/dbraw/zinc/57/60/61/743576061.db2.gz XBLRZUDIYFBENF-UHFFFAOYSA-N 1 1 352.341 2.931 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H]1C1CCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000830219136 745325415 /nfs/dbraw/zinc/32/54/15/745325415.db2.gz HVXQPZBGKSZOSF-MRXNPFEDSA-N 1 1 351.378 2.563 20 5 FFBDMO COC[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000832746573 745748921 /nfs/dbraw/zinc/74/89/21/745748921.db2.gz WOJINJVMTMBIPB-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000832746573 745748926 /nfs/dbraw/zinc/74/89/26/745748926.db2.gz WOJINJVMTMBIPB-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000839502976 746842130 /nfs/dbraw/zinc/84/21/30/746842130.db2.gz IPAACYYQYLAQAY-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)[N@@H+](C[C@@H]1CCC(=O)N1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000840189966 747034150 /nfs/dbraw/zinc/03/41/50/747034150.db2.gz RYIZLMDLNYYCHV-LBPRGKRZSA-N 1 1 365.821 2.544 20 5 FFBDMO C[C@H](SC[C@H]1C[N@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652783 747650002 /nfs/dbraw/zinc/65/00/02/747650002.db2.gz YLMVYJHHMLNNJE-CMPLNLGQSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@H](SC[C@H]1C[N@@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652783 747650006 /nfs/dbraw/zinc/65/00/06/747650006.db2.gz YLMVYJHHMLNNJE-CMPLNLGQSA-N 1 1 373.862 2.639 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000844439221 748031260 /nfs/dbraw/zinc/03/12/60/748031260.db2.gz VLUQVSSZHHEXHY-MRXNPFEDSA-N 1 1 351.353 2.605 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000844439221 748031267 /nfs/dbraw/zinc/03/12/67/748031267.db2.gz VLUQVSSZHHEXHY-MRXNPFEDSA-N 1 1 351.353 2.605 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CC[N@@H+](C)C2)cc1OC ZINC000847827902 748791764 /nfs/dbraw/zinc/79/17/64/748791764.db2.gz HNMSTUYKPMHFNM-LBPRGKRZSA-N 1 1 352.387 2.501 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000848482170 748938151 /nfs/dbraw/zinc/93/81/51/748938151.db2.gz LDPIZVYBQNXNCJ-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000848482170 748938156 /nfs/dbraw/zinc/93/81/56/748938156.db2.gz LDPIZVYBQNXNCJ-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910502 749725524 /nfs/dbraw/zinc/72/55/24/749725524.db2.gz COGATNUTLLNXFQ-JQWIXIFHSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910502 749725526 /nfs/dbraw/zinc/72/55/26/749725526.db2.gz COGATNUTLLNXFQ-JQWIXIFHSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000852149667 749785841 /nfs/dbraw/zinc/78/58/41/749785841.db2.gz LDRPMURBPZOUGZ-LBPRGKRZSA-N 1 1 354.407 2.769 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](CCN1CCOCC1)CC1CC1 ZINC000852636720 749910325 /nfs/dbraw/zinc/91/03/25/749910325.db2.gz LMTZBOCNHNDEJG-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001576179860 949926535 /nfs/dbraw/zinc/92/65/35/949926535.db2.gz MHNYZMAIGGBXHL-LBPRGKRZSA-N 1 1 359.434 2.697 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001267943410 971684443 /nfs/dbraw/zinc/68/44/43/971684443.db2.gz MJUSUASMNCIKML-RTBURBONSA-N 1 1 359.470 2.687 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000134883579 960094038 /nfs/dbraw/zinc/09/40/38/960094038.db2.gz LOJGNWBUKQNTKH-QAPCUYQASA-N 1 1 353.422 2.917 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3ccc(F)cc3[N+](=O)[O-])c2C(N)=O)C1 ZINC001210950572 962606103 /nfs/dbraw/zinc/60/61/03/962606103.db2.gz YJTLNVTUGGHEGD-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3ccc(F)cc3[N+](=O)[O-])c2C(N)=O)C1 ZINC001210950572 962606117 /nfs/dbraw/zinc/60/61/17/962606117.db2.gz YJTLNVTUGGHEGD-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c2nonc21 ZINC000011380743 1013368907 /nfs/dbraw/zinc/36/89/07/1013368907.db2.gz NGSRGJPEFLKPIF-UHFFFAOYSA-N 1 1 371.372 2.982 20 5 FFBDMO C[N@@H+]1CCC12CN(C(=O)c1cc(=S)cc3[nH]c4ccccc4nc1-3)C2 ZINC001270473875 965148978 /nfs/dbraw/zinc/14/89/78/965148978.db2.gz UNTXDMALXGSJAC-UHFFFAOYSA-N 1 1 350.447 2.927 20 5 FFBDMO C[N@H+]1CCC12CN(C(=O)c1cc(=S)cc3[nH]c4ccccc4nc1-3)C2 ZINC001270473875 965148982 /nfs/dbraw/zinc/14/89/82/965148982.db2.gz UNTXDMALXGSJAC-UHFFFAOYSA-N 1 1 350.447 2.927 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843753547 965525430 /nfs/dbraw/zinc/52/54/30/965525430.db2.gz RNZCDDIUBKKMLQ-HNNXBMFYSA-N 1 1 371.441 2.654 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000895005970 967151643 /nfs/dbraw/zinc/15/16/43/967151643.db2.gz CIFUTSJEVHRMFE-MGEGMALFSA-N 1 1 351.406 2.809 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001271075542 968057872 /nfs/dbraw/zinc/05/78/72/968057872.db2.gz UIKVXMDXMBPROV-MRXNPFEDSA-N 1 1 354.410 2.550 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000874828471 1013910716 /nfs/dbraw/zinc/91/07/16/1013910716.db2.gz GZEHSYMZCCZGIV-SJORKVTESA-N 1 1 366.421 2.966 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000895587012 970762539 /nfs/dbraw/zinc/76/25/39/970762539.db2.gz FJJYNPKXUHTJBM-IBGZPJMESA-N 1 1 358.394 2.793 20 5 FFBDMO C[N@@H+](CCCC1CCC1)CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001482504863 974167416 /nfs/dbraw/zinc/16/74/16/974167416.db2.gz UHCVCSXFUDPBNH-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@H+](CCCC1CCC1)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001482504863 974167420 /nfs/dbraw/zinc/16/74/20/974167420.db2.gz UHCVCSXFUDPBNH-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@@H+](CCCC1CCC1)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001482504863 974167423 /nfs/dbraw/zinc/16/74/23/974167423.db2.gz UHCVCSXFUDPBNH-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO Cc1cc(C)c(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)c(C)c1 ZINC000981764234 976764062 /nfs/dbraw/zinc/76/40/62/976764062.db2.gz QCJRFUQTPIXLIP-IEBWSBKVSA-N 1 1 371.481 2.701 20 5 FFBDMO Cc1cc(C)c(C[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c(C)c1 ZINC000981764234 976764076 /nfs/dbraw/zinc/76/40/76/976764076.db2.gz QCJRFUQTPIXLIP-IEBWSBKVSA-N 1 1 371.481 2.701 20 5 FFBDMO Cc1cc(C)c(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c(C)c1 ZINC000981764234 976764089 /nfs/dbraw/zinc/76/40/89/976764089.db2.gz QCJRFUQTPIXLIP-IEBWSBKVSA-N 1 1 371.481 2.701 20 5 FFBDMO COC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899644 976901873 /nfs/dbraw/zinc/90/18/73/976901873.db2.gz KBFHPULGAAOZPR-QGZVFWFLSA-N 1 1 358.398 2.833 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)n1 ZINC000728899800 976998089 /nfs/dbraw/zinc/99/80/89/976998089.db2.gz QZSLOZWCPCFRQQ-OAHLLOKOSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)n1 ZINC000728899800 976998102 /nfs/dbraw/zinc/99/81/02/976998102.db2.gz QZSLOZWCPCFRQQ-OAHLLOKOSA-N 1 1 368.397 2.987 20 5 FFBDMO O=[N+]([O-])c1cnn(C2CC(N[C@H](C[NH+]3CCCC3)c3ccccc3)C2)c1 ZINC000876881070 1014409231 /nfs/dbraw/zinc/40/92/31/1014409231.db2.gz UYVUPUPMNLSPIP-FAFZWHIHSA-N 1 1 355.442 2.922 20 5 FFBDMO C[C@@H](CC[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)N(C)Cc1ccccc1 ZINC000877079674 1014470720 /nfs/dbraw/zinc/47/07/20/1014470720.db2.gz ITHJLSISUDDYOG-ZLPCBKJTSA-N 1 1 357.458 2.995 20 5 FFBDMO CCOc1ccc([C@@H](O)C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)cc1 ZINC000877541893 1014619694 /nfs/dbraw/zinc/61/96/94/1014619694.db2.gz MKVUFHQYYQWWDP-GOSISDBHSA-N 1 1 374.441 2.673 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC001029964294 980153090 /nfs/dbraw/zinc/15/30/90/980153090.db2.gz DITOAYKNXVRHDT-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001029964294 980153101 /nfs/dbraw/zinc/15/31/01/980153101.db2.gz DITOAYKNXVRHDT-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001029964294 980153107 /nfs/dbraw/zinc/15/31/07/980153107.db2.gz DITOAYKNXVRHDT-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCNCC[NH2+]CC2)ccc1Oc1ccc(F)cc1 ZINC000904396090 980264264 /nfs/dbraw/zinc/26/42/64/980264264.db2.gz DBAHXNYSCINPQM-UHFFFAOYSA-N 1 1 374.416 2.521 20 5 FFBDMO O=C(CC[NH2+][C@H]1c2ccccc2OC[C@H]1F)Nc1ccccc1[N+](=O)[O-] ZINC000905535552 980458905 /nfs/dbraw/zinc/45/89/05/980458905.db2.gz BIRKGLPPQHVPHZ-ACJLOTCBSA-N 1 1 359.357 2.985 20 5 FFBDMO NC(=O)Cc1cccc2c1CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000877679359 1014673937 /nfs/dbraw/zinc/67/39/37/1014673937.db2.gz DBXJYGJFZDLHHF-YWEYNIOJSA-N 1 1 351.406 2.694 20 5 FFBDMO CC(C)c1ccc(C[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000963791830 1014766677 /nfs/dbraw/zinc/76/66/77/1014766677.db2.gz RSUJSYIDFIZXNZ-JGQKGBITSA-N 1 1 371.481 2.992 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(N)=NOCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000842048562 982644219 /nfs/dbraw/zinc/64/42/19/982644219.db2.gz CPWLXQKHIXJMGB-TXEJJXNPSA-N 1 1 365.390 2.764 20 5 FFBDMO Cc1ncccc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000898254676 982654002 /nfs/dbraw/zinc/65/40/02/982654002.db2.gz FOHZDKZNQBNTPM-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878162039 1014892132 /nfs/dbraw/zinc/89/21/32/1014892132.db2.gz IRGQOBJBWSYSPG-CQSZACIVSA-N 1 1 359.430 2.809 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)C[C@@]2(C)C1 ZINC000913280798 984225735 /nfs/dbraw/zinc/22/57/35/984225735.db2.gz GSCXOOSSFQGTMV-CALCHBBNSA-N 1 1 369.368 2.610 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[N@@H+](C)C1CC1 ZINC000057716050 984515155 /nfs/dbraw/zinc/51/51/55/984515155.db2.gz AZAWUZBIPZNZMZ-AWEZNQCLSA-N 1 1 360.458 2.798 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000764967874 984895365 /nfs/dbraw/zinc/89/53/65/984895365.db2.gz YFOTVPCSTWMPOM-HNNXBMFYSA-N 1 1 373.457 2.839 20 5 FFBDMO O=C(OC[C@H]1CCC[N@@H+]1Cc1ccco1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000765970850 987704375 /nfs/dbraw/zinc/70/43/75/987704375.db2.gz WYRKUVOHJKEXDF-GFCCVEGCSA-N 1 1 374.349 2.738 20 5 FFBDMO O=C(OC[C@H]1CCC[N@H+]1Cc1ccco1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000765970850 987704377 /nfs/dbraw/zinc/70/43/77/987704377.db2.gz WYRKUVOHJKEXDF-GFCCVEGCSA-N 1 1 374.349 2.738 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000762500450 988415833 /nfs/dbraw/zinc/41/58/33/988415833.db2.gz CYTCEKSPLHAHDS-UHFFFAOYSA-N 1 1 355.442 2.737 20 5 FFBDMO COC(=O)Nc1cccc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])c1 ZINC000796489074 1015409621 /nfs/dbraw/zinc/40/96/21/1015409621.db2.gz AEHNIZPUBSWHTQ-UHFFFAOYSA-N 1 1 361.354 2.777 20 5 FFBDMO C[N@H+](Cc1cnn(-c2ccccc2)c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153713759 988900285 /nfs/dbraw/zinc/90/02/85/988900285.db2.gz RCWMSYIEIRUMHP-LJQANCHMSA-N 1 1 352.394 2.946 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2cccc3ccccc32)CC1 ZINC001005377212 989742704 /nfs/dbraw/zinc/74/27/04/989742704.db2.gz YKGKMGYUHCPJAB-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H]2CC[N@@H+]2C2CCOCC2)c1 ZINC000922950857 990764744 /nfs/dbraw/zinc/76/47/44/990764744.db2.gz PYZDGKNAEUWKMJ-OAHLLOKOSA-N 1 1 371.384 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(CNC[C@H]2CC[N@H+]2C2CCOCC2)c1 ZINC000922950857 990764753 /nfs/dbraw/zinc/76/47/53/990764753.db2.gz PYZDGKNAEUWKMJ-OAHLLOKOSA-N 1 1 371.384 2.539 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000068964539 991555035 /nfs/dbraw/zinc/55/50/35/991555035.db2.gz WTGMSBILBVZYGG-ZBFHGGJFSA-N 1 1 373.457 2.919 20 5 FFBDMO CCC1([NH2+]Cc2cc(C)cc(C)c2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001484812442 991759683 /nfs/dbraw/zinc/75/96/83/991759683.db2.gz YFRDVNQWYCXHPM-QZTJIDSGSA-N 1 1 359.470 2.829 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1 ZINC000808795329 994270431 /nfs/dbraw/zinc/27/04/31/994270431.db2.gz TYRQLRJHOUPSBY-PMACEKPBSA-N 1 1 374.412 2.694 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2Cc3ccccc3N3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000880556024 1015870827 /nfs/dbraw/zinc/87/08/27/1015870827.db2.gz ATAUXVWLZNVXHA-KRWDZBQOSA-N 1 1 366.421 2.678 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810845654 994951693 /nfs/dbraw/zinc/95/16/93/994951693.db2.gz FQLOMWSYEHRTMH-KBPBESRZSA-N 1 1 356.382 2.564 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494639 995559539 /nfs/dbraw/zinc/55/95/39/995559539.db2.gz PWAIMDDZUSYVDE-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494639 995559543 /nfs/dbraw/zinc/55/95/43/995559543.db2.gz PWAIMDDZUSYVDE-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@@H]1C(C)(C)C ZINC001144023932 997945679 /nfs/dbraw/zinc/94/56/79/997945679.db2.gz CZCXGJAVMMGTCL-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO O=C(NC1(C2CC[NH+](CCC3CCCCC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000152238 1016247609 /nfs/dbraw/zinc/24/76/09/1016247609.db2.gz BJRDOIHONQFZOJ-QZTJIDSGSA-N 1 1 363.502 2.983 20 5 FFBDMO C[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741017213 999702690 /nfs/dbraw/zinc/70/26/90/999702690.db2.gz MGEWFMGAZZJMTE-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741017213 999702693 /nfs/dbraw/zinc/70/26/93/999702693.db2.gz MGEWFMGAZZJMTE-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO Cc1nn(CN2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000766376524 999989799 /nfs/dbraw/zinc/98/97/99/999989799.db2.gz NZJJPPXONHQCEJ-HUUCEWRRSA-N 1 1 357.458 2.960 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010286 1000015216 /nfs/dbraw/zinc/01/52/16/1000015216.db2.gz CFLZMLIHLKPAHY-FPCVCCKLSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011966 1000015560 /nfs/dbraw/zinc/01/55/60/1000015560.db2.gz NYYQCMDXDIIWTO-WCVJEAGWSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]2(CC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169013963 1000015637 /nfs/dbraw/zinc/01/56/37/1000015637.db2.gz WYQQLNSUPPUZPK-MPGHIAIKSA-N 1 1 353.463 2.907 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)C1 ZINC001169030394 1000016211 /nfs/dbraw/zinc/01/62/11/1000016211.db2.gz ZKMNCYJJLSMMCP-YWTNHNAXSA-N 1 1 361.442 2.529 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169036022 1000016781 /nfs/dbraw/zinc/01/67/81/1000016781.db2.gz FCQMIMYBBKZDQW-RBZJEDDUSA-N 1 1 353.463 2.667 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(CC3CC3)nc21 ZINC001169021689 1000017546 /nfs/dbraw/zinc/01/75/46/1000017546.db2.gz PKYVTVNDSHDRPA-BPQIPLTHSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169026966 1000018090 /nfs/dbraw/zinc/01/80/90/1000018090.db2.gz ZKMNCYJJLSMMCP-MJQMVNBJSA-N 1 1 361.442 2.529 20 5 FFBDMO Cc1ccc(O[C@@H]2C[C@@H]3CN([C@H]4CC[C@@H](C[N+](=O)[O-])C4)CC[N@H+]3C2)cc1 ZINC001169026355 1000018179 /nfs/dbraw/zinc/01/81/79/1000018179.db2.gz LHCGIBCMNLZYTE-AJYBTWMASA-N 1 1 359.470 2.578 20 5 FFBDMO CC[N@@H+](C[C@@H]1CN(Cc2ccccc2)CCO1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169053545 1000018994 /nfs/dbraw/zinc/01/89/94/1000018994.db2.gz ILKDBAONGHNECZ-AABGKKOBSA-N 1 1 361.486 2.655 20 5 FFBDMO C[N@@H+]1CCc2c(NCCOc3ccc4c(c3)OCO4)ccc([N+](=O)[O-])c2C1 ZINC001169936428 1000087450 /nfs/dbraw/zinc/08/74/50/1000087450.db2.gz KJCHZZLATMGRGX-UHFFFAOYSA-N 1 1 371.393 2.802 20 5 FFBDMO C[N@H+]1CCc2c(NCCOc3ccc4c(c3)OCO4)ccc([N+](=O)[O-])c2C1 ZINC001169936428 1000087451 /nfs/dbraw/zinc/08/74/51/1000087451.db2.gz KJCHZZLATMGRGX-UHFFFAOYSA-N 1 1 371.393 2.802 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nc(Cl)nc1NCC[NH+]1CCC(F)(F)CC1 ZINC001160749395 1000417964 /nfs/dbraw/zinc/41/79/64/1000417964.db2.gz TVOMWGRHCCRLLG-UHFFFAOYSA-N 1 1 356.160 2.835 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)c2ncc([N+](=O)[O-])cc12 ZINC000769776802 1000593379 /nfs/dbraw/zinc/59/33/79/1000593379.db2.gz KPIAVPJNVGSEPQ-IBGZPJMESA-N 1 1 365.393 2.737 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c2ncc([N+](=O)[O-])cc12 ZINC000769776802 1000593385 /nfs/dbraw/zinc/59/33/85/1000593385.db2.gz KPIAVPJNVGSEPQ-IBGZPJMESA-N 1 1 365.393 2.737 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](F)C1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170515 1000838165 /nfs/dbraw/zinc/83/81/65/1000838165.db2.gz AKSHHPVAFBACPF-CZUORRHYSA-N 1 1 353.419 2.603 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](F)C1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170515 1000838170 /nfs/dbraw/zinc/83/81/70/1000838170.db2.gz AKSHHPVAFBACPF-CZUORRHYSA-N 1 1 353.419 2.603 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000771899116 1001241274 /nfs/dbraw/zinc/24/12/74/1001241274.db2.gz VKLDEGWCGUSBNH-UHFFFAOYSA-N 1 1 361.401 2.903 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000791756536 1002803488 /nfs/dbraw/zinc/80/34/88/1002803488.db2.gz ZAKHWIFEYIODSH-UHFFFAOYSA-N 1 1 374.441 2.649 20 5 FFBDMO CC(C)N(C)C(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774839277 1002851073 /nfs/dbraw/zinc/85/10/73/1002851073.db2.gz CXBLNUPQIRPVDY-UHFFFAOYSA-N 1 1 364.402 2.582 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355045 1003123384 /nfs/dbraw/zinc/12/33/84/1003123384.db2.gz VJUYFCPGJUAIHZ-LRDDRELGSA-N 1 1 368.455 2.515 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355045 1003123392 /nfs/dbraw/zinc/12/33/92/1003123392.db2.gz VJUYFCPGJUAIHZ-LRDDRELGSA-N 1 1 368.455 2.515 20 5 FFBDMO COc1c(C(=O)Nc2cccnc2-n2cc[nH+]c2C)cccc1[N+](=O)[O-] ZINC000793105842 1003281560 /nfs/dbraw/zinc/28/15/60/1003281560.db2.gz MKBBQEILAUQCBZ-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[NH+](CCCF)CC2)cc1C ZINC001186789961 1003426005 /nfs/dbraw/zinc/42/60/05/1003426005.db2.gz FEFNFLMEYCNLIU-UHFFFAOYSA-N 1 1 353.394 2.562 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)nc1-c1ccncc1 ZINC000793747752 1003491829 /nfs/dbraw/zinc/49/18/29/1003491829.db2.gz SWYNJULGRRXSKH-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCOC[C@@H](C3CCC3)C2)nc1-c1ccncc1 ZINC000793747752 1003491831 /nfs/dbraw/zinc/49/18/31/1003491831.db2.gz SWYNJULGRRXSKH-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO CC[C@@H](C)C[N@@H+](CC)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001191375722 1003806687 /nfs/dbraw/zinc/80/66/87/1003806687.db2.gz WZSRFZVWQMAERU-MRXNPFEDSA-N 1 1 362.474 2.611 20 5 FFBDMO CCC1([NH2+]C/C=C/c2ccccc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001273756544 1004436955 /nfs/dbraw/zinc/43/69/55/1004436955.db2.gz BDVWDAPLFVQVKP-OKMWKSJFSA-N 1 1 357.454 2.726 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC001193743035 1004558625 /nfs/dbraw/zinc/55/86/25/1004558625.db2.gz HPODHDLNKRHTPM-UHFFFAOYSA-N 1 1 367.446 2.610 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685292 1004709992 /nfs/dbraw/zinc/70/99/92/1004709992.db2.gz IRRNZLKZUHUUEW-AEFFLSMTSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685292 1004709994 /nfs/dbraw/zinc/70/99/94/1004709994.db2.gz IRRNZLKZUHUUEW-AEFFLSMTSA-N 1 1 359.426 2.517 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001050245056 1016930248 /nfs/dbraw/zinc/93/02/48/1016930248.db2.gz XUOMFOCYEKHJCQ-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245056 1016930260 /nfs/dbraw/zinc/93/02/60/1016930260.db2.gz XUOMFOCYEKHJCQ-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245056 1016930275 /nfs/dbraw/zinc/93/02/75/1016930275.db2.gz XUOMFOCYEKHJCQ-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO CCOc1ccccc1N1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776272261 1005339804 /nfs/dbraw/zinc/33/98/04/1005339804.db2.gz RQVAQPYWPXCGLR-LJQANCHMSA-N 1 1 371.437 2.849 20 5 FFBDMO O=C(OC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000851466498 1005889124 /nfs/dbraw/zinc/88/91/24/1005889124.db2.gz UIZGRFYKEMVHRX-CQSZACIVSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(OC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000851466498 1005889125 /nfs/dbraw/zinc/88/91/25/1005889125.db2.gz UIZGRFYKEMVHRX-CQSZACIVSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000851825388 1005916573 /nfs/dbraw/zinc/91/65/73/1005916573.db2.gz GRQPTDOMGFFHEA-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000851825388 1005916575 /nfs/dbraw/zinc/91/65/75/1005916575.db2.gz GRQPTDOMGFFHEA-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO CO[C@@H]1CC[C@@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000851935804 1005924314 /nfs/dbraw/zinc/92/43/14/1005924314.db2.gz SNPUZCUKLCVTRN-UKRRQHHQSA-N 1 1 359.430 2.551 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580509 1005961185 /nfs/dbraw/zinc/96/11/85/1005961185.db2.gz VYLMDUQXSLRZSW-LESCRADOSA-N 1 1 363.458 2.645 20 5 FFBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC001133923545 1006041676 /nfs/dbraw/zinc/04/16/76/1006041676.db2.gz PMMKCHDCZQGCBN-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO C[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC001133923545 1006041691 /nfs/dbraw/zinc/04/16/91/1006041691.db2.gz PMMKCHDCZQGCBN-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO O=c1[nH]ccc(Nc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)c1[N+](=O)[O-] ZINC000882943985 1006570950 /nfs/dbraw/zinc/57/09/50/1006570950.db2.gz OQSNIQSXMNQRFG-OAHLLOKOSA-N 1 1 355.398 2.723 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)Nc1cc(-c3cccc([N+](=O)[O-])c3)[nH]n1)CC2 ZINC000816911790 1007269312 /nfs/dbraw/zinc/26/93/12/1007269312.db2.gz YSUGLKAATRUNGG-CYBMUJFWSA-N 1 1 366.381 2.691 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000856476577 1007845866 /nfs/dbraw/zinc/84/58/66/1007845866.db2.gz ZWITVMRHHXXPKL-OAHLLOKOSA-N 1 1 360.458 2.513 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000819016292 1008024896 /nfs/dbraw/zinc/02/48/96/1008024896.db2.gz WUNFZMFPRUVYMT-RXVVDRJESA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000819016292 1008024899 /nfs/dbraw/zinc/02/48/99/1008024899.db2.gz WUNFZMFPRUVYMT-RXVVDRJESA-N 1 1 369.465 2.782 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000858871543 1008442873 /nfs/dbraw/zinc/44/28/73/1008442873.db2.gz IUFQSNYEEPFPIE-INIZCTEOSA-N 1 1 358.442 2.679 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]Cc1ccccc1)CC1CCCC1 ZINC001177313924 1008558857 /nfs/dbraw/zinc/55/88/57/1008558857.db2.gz WGUUKAROFQIUKO-RTBURBONSA-N 1 1 359.470 2.850 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CCCCCF)CC1CCCC1 ZINC001177313719 1008559987 /nfs/dbraw/zinc/55/99/87/1008559987.db2.gz KWMYUFQVTNKXHC-IAGOWNOFSA-N 1 1 357.470 2.790 20 5 FFBDMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 ZINC000886109397 1008566513 /nfs/dbraw/zinc/56/65/13/1008566513.db2.gz JIEZDPVWEBWKAZ-CYBMUJFWSA-N 1 1 374.416 2.941 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859613054 1008588581 /nfs/dbraw/zinc/58/85/81/1008588581.db2.gz VZKZAGFPRUOJHC-XOKHGSTOSA-N 1 1 364.442 2.928 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+](Cc3cccnc3[N+](=O)[O-])CC[C@H]21 ZINC000886215988 1008602164 /nfs/dbraw/zinc/60/21/64/1008602164.db2.gz UOLABBPTJNPJHY-UKRRQHHQSA-N 1 1 362.430 2.821 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])CC[C@H]21 ZINC000886215988 1008602169 /nfs/dbraw/zinc/60/21/69/1008602169.db2.gz UOLABBPTJNPJHY-UKRRQHHQSA-N 1 1 362.430 2.821 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+](Cc3cccnc3[N+](=O)[O-])CC[C@@H]21 ZINC000886215987 1008603431 /nfs/dbraw/zinc/60/34/31/1008603431.db2.gz UOLABBPTJNPJHY-HIFRSBDPSA-N 1 1 362.430 2.821 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])CC[C@@H]21 ZINC000886215987 1008603441 /nfs/dbraw/zinc/60/34/41/1008603441.db2.gz UOLABBPTJNPJHY-HIFRSBDPSA-N 1 1 362.430 2.821 20 5 FFBDMO C[C@@]12CN(Cc3cccnc3[N+](=O)[O-])C[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000886314238 1008634965 /nfs/dbraw/zinc/63/49/65/1008634965.db2.gz QNIRXKORIREVHN-AZUAARDMSA-N 1 1 352.438 2.944 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H]3C[N@H+]4CCC[C@@H]4CO3)o2)c1 ZINC001177749462 1008731649 /nfs/dbraw/zinc/73/16/49/1008731649.db2.gz VWRCNUQKZFQYOQ-AEFFLSMTSA-N 1 1 357.410 2.808 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])c1 ZINC000886681141 1008818934 /nfs/dbraw/zinc/81/89/34/1008818934.db2.gz SRAPOVQUEURKIU-CQSZACIVSA-N 1 1 358.398 2.652 20 5 FFBDMO Cc1cccc(CCC[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1 ZINC001178464690 1008999406 /nfs/dbraw/zinc/99/94/06/1008999406.db2.gz XWXRIBAHLOOEER-RTBURBONSA-N 1 1 361.486 2.859 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000823591436 1009128013 /nfs/dbraw/zinc/12/80/13/1009128013.db2.gz LFNISOQJVCJNAT-LJQANCHMSA-N 1 1 360.410 2.822 20 5 FFBDMO C[N@@H+](C[C@@](C)(O)c1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000823597790 1009135566 /nfs/dbraw/zinc/13/55/66/1009135566.db2.gz BLPUHQYQSWCAFB-AZUAARDMSA-N 1 1 369.421 2.540 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823939073 1009287690 /nfs/dbraw/zinc/28/76/90/1009287690.db2.gz QUEZEVZAQKGBCF-CXAGYDPISA-N 1 1 369.425 2.962 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000889164063 1009845320 /nfs/dbraw/zinc/84/53/20/1009845320.db2.gz XFSDFHNIPOHGDK-GXTWGEPZSA-N 1 1 356.426 2.885 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000863031984 1010087488 /nfs/dbraw/zinc/08/74/88/1010087488.db2.gz KOOMDEYOQKXCAI-ZDUSSCGKSA-N 1 1 364.421 2.547 20 5 FFBDMO C[C@@H](C[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)NC(=O)OC(C)(C)C ZINC000863334918 1010182060 /nfs/dbraw/zinc/18/20/60/1010182060.db2.gz DXQNSSXXYSJNNM-LBPRGKRZSA-N 1 1 363.418 2.747 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)NC(=O)OC(C)(C)C ZINC000863334918 1010182067 /nfs/dbraw/zinc/18/20/67/1010182067.db2.gz DXQNSSXXYSJNNM-LBPRGKRZSA-N 1 1 363.418 2.747 20 5 FFBDMO CC(C)(O)CC[NH+]1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172913555 1012125123 /nfs/dbraw/zinc/12/51/23/1012125123.db2.gz RTUFENCQUQZJEV-GOSISDBHSA-N 1 1 361.486 2.621 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870092394 1012126255 /nfs/dbraw/zinc/12/62/55/1012126255.db2.gz GUTMCOBWUDSCNS-OTWHNJEPSA-N 1 1 367.405 2.577 20 5 FFBDMO C[C@@H]1CC[C@H](CO)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009338 1012179655 /nfs/dbraw/zinc/17/96/55/1012179655.db2.gz BHHSUEARBCVSLM-OLZOCXBDSA-N 1 1 369.412 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3C[C@@H]4CCO[C@@H]4C3)CC2)c(F)c1 ZINC001173015239 1012186840 /nfs/dbraw/zinc/18/68/40/1012186840.db2.gz NIJQTTZBJNRHDR-MEDUHNTESA-N 1 1 353.369 2.563 20 5 FFBDMO COC(=O)C1(C)CC[NH+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173190301 1012331194 /nfs/dbraw/zinc/33/11/94/1012331194.db2.gz SIOHETCJYPTPNM-LBPRGKRZSA-N 1 1 368.405 2.949 20 5 FFBDMO O=C1O[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CCCCC1 ZINC000828197852 1032619385 /nfs/dbraw/zinc/61/93/85/1032619385.db2.gz AOHMQGWPMMQVBS-MRXNPFEDSA-N 1 1 360.414 2.501 20 5 FFBDMO O=C1O[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CCCCC1 ZINC000828197852 1032619388 /nfs/dbraw/zinc/61/93/88/1032619388.db2.gz AOHMQGWPMMQVBS-MRXNPFEDSA-N 1 1 360.414 2.501 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nn(C)cc1Br ZINC001173235442 1012367860 /nfs/dbraw/zinc/36/78/60/1012367860.db2.gz SVEQIAZFTQGJPP-JTQLQIEISA-N 1 1 353.220 2.812 20 5 FFBDMO Cc1ccccc1[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1 ZINC000870893713 1012623638 /nfs/dbraw/zinc/62/36/38/1012623638.db2.gz TWYCMWLTYQZCET-QUCCMNQESA-N 1 1 369.421 2.677 20 5 FFBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)CCC[NH+]1CCN(C(C)C)CC1)CC2 ZINC000901316351 1018947333 /nfs/dbraw/zinc/94/73/33/1018947333.db2.gz BBTSUVMHYWIJKC-UHFFFAOYSA-N 1 1 374.485 2.599 20 5 FFBDMO C[N@@H+]1CC[C@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000928558994 1019024221 /nfs/dbraw/zinc/02/42/21/1019024221.db2.gz ZYNNZWHEOVWJIM-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO C[N@H+]1CC[C@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000928558994 1019024236 /nfs/dbraw/zinc/02/42/36/1019024236.db2.gz ZYNNZWHEOVWJIM-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801836642 1019433220 /nfs/dbraw/zinc/43/32/20/1019433220.db2.gz POWUJVISLNVLMR-JSGCOSHPSA-N 1 1 372.400 2.881 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000801950970 1019535638 /nfs/dbraw/zinc/53/56/38/1019535638.db2.gz OFDHLCJKWRBHIS-NWDGAFQWSA-N 1 1 364.421 2.699 20 5 FFBDMO Cc1nn(C[NH+]2CCC(N3CCCOC3=O)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000902594782 1020324554 /nfs/dbraw/zinc/32/45/54/1020324554.db2.gz VUTLHJPNHFKWKG-UHFFFAOYSA-N 1 1 373.413 2.517 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000931308084 1020414268 /nfs/dbraw/zinc/41/42/68/1020414268.db2.gz RCMAMRDEEGNNET-ZMYBRWDISA-N 1 1 360.458 2.504 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000726186115 1020429387 /nfs/dbraw/zinc/42/93/87/1020429387.db2.gz PRIHGGBXJNLXPU-AWEZNQCLSA-N 1 1 359.430 2.530 20 5 FFBDMO CCCC(=O)NC[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000726186115 1020429396 /nfs/dbraw/zinc/42/93/96/1020429396.db2.gz PRIHGGBXJNLXPU-AWEZNQCLSA-N 1 1 359.430 2.530 20 5 FFBDMO C[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[NH+]1CCCCC1 ZINC000726607455 1020492725 /nfs/dbraw/zinc/49/27/25/1020492725.db2.gz WJVQXLYYSKEBSF-OAHLLOKOSA-N 1 1 357.458 2.959 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336379 1021200035 /nfs/dbraw/zinc/20/00/35/1021200035.db2.gz PJTQDZZEOQDPLF-CZUORRHYSA-N 1 1 372.450 2.721 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336379 1021200044 /nfs/dbraw/zinc/20/00/44/1021200044.db2.gz PJTQDZZEOQDPLF-CZUORRHYSA-N 1 1 372.450 2.721 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934844350 1021426502 /nfs/dbraw/zinc/42/65/02/1021426502.db2.gz YZIPSESVWNNVGW-HOTGVXAUSA-N 1 1 361.442 2.696 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583766 1022135082 /nfs/dbraw/zinc/13/50/82/1022135082.db2.gz PILOHPWVRJAGJD-SMDDNHRTSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583766 1022135087 /nfs/dbraw/zinc/13/50/87/1022135087.db2.gz PILOHPWVRJAGJD-SMDDNHRTSA-N 1 1 367.450 2.601 20 5 FFBDMO CCOC(=O)c1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1 ZINC001118267570 1022150763 /nfs/dbraw/zinc/15/07/63/1022150763.db2.gz KHESXFLBKAHHGN-AWEZNQCLSA-N 1 1 358.398 2.874 20 5 FFBDMO CCOC(=O)c1cc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1 ZINC001118267570 1022150775 /nfs/dbraw/zinc/15/07/75/1022150775.db2.gz KHESXFLBKAHHGN-AWEZNQCLSA-N 1 1 358.398 2.874 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000778788973 1022371492 /nfs/dbraw/zinc/37/14/92/1022371492.db2.gz SCPHBKJKTDNZTL-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C[C@@H]1C ZINC000119942254 1022619534 /nfs/dbraw/zinc/61/95/34/1022619534.db2.gz FFOFLVLWBIMOAZ-GASCZTMLSA-N 1 1 364.446 2.785 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1Cc1ccccc1 ZINC000188328620 1023056443 /nfs/dbraw/zinc/05/64/43/1023056443.db2.gz AJKOXLSZBHKRKE-ZFWWWQNUSA-N 1 1 354.410 2.570 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(CN3CCNC[C@@]4(CCCC[NH2+]4)C3)nc12 ZINC001222683725 1033111402 /nfs/dbraw/zinc/11/14/02/1033111402.db2.gz AAFVUIATHRWWNA-QFIPXVFZSA-N 1 1 361.493 2.701 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752796903 1023206015 /nfs/dbraw/zinc/20/60/15/1023206015.db2.gz MSTLHQHSGDQVIK-HZPDHXFCSA-N 1 1 374.441 2.543 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779212649 1023371672 /nfs/dbraw/zinc/37/16/72/1023371672.db2.gz XLXBUHLVXMAWNP-HNNXBMFYSA-N 1 1 370.361 2.755 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001122803272 1023483759 /nfs/dbraw/zinc/48/37/59/1023483759.db2.gz WWWUHVQWZOUNSC-YOEHRIQHSA-N 1 1 372.425 2.554 20 5 FFBDMO O=C(OC[C@@H]1CC[N@H+]1C1CCOCC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC001123248113 1023707184 /nfs/dbraw/zinc/70/71/84/1023707184.db2.gz QCYDBDUMWVGCED-HNNXBMFYSA-N 1 1 360.366 2.751 20 5 FFBDMO CC(C)CN(CC1CC[NH+](C)CC1)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000829578415 1033230389 /nfs/dbraw/zinc/23/03/89/1033230389.db2.gz GNTIQHSUHGEIDF-UHFFFAOYSA-N 1 1 365.478 2.881 20 5 FFBDMO CC(C)(C[NH2+]CCCCCF)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540254 1024885123 /nfs/dbraw/zinc/88/51/23/1024885123.db2.gz AUETZDHGQYEJIN-HZPDHXFCSA-N 1 1 357.470 2.646 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)NC(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000837135167 1025605246 /nfs/dbraw/zinc/60/52/46/1025605246.db2.gz PIVJVGIIVIXTKV-JQIJEIRASA-N 1 1 374.485 2.530 20 5 FFBDMO Cc1c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000837186312 1025641546 /nfs/dbraw/zinc/64/15/46/1025641546.db2.gz PNEZJHGPDGODAA-ZDUSSCGKSA-N 1 1 364.402 2.675 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000840095690 1026955140 /nfs/dbraw/zinc/95/51/40/1026955140.db2.gz KJDRZOFHWJKYFD-QGZVFWFLSA-N 1 1 362.430 2.541 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CCCO1 ZINC000840095690 1026955143 /nfs/dbraw/zinc/95/51/43/1026955143.db2.gz KJDRZOFHWJKYFD-QGZVFWFLSA-N 1 1 362.430 2.541 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2cc([N+](=O)[O-])ccc12 ZINC000840108114 1026959262 /nfs/dbraw/zinc/95/92/62/1026959262.db2.gz IEYZQDNTMNCIRI-AWEZNQCLSA-N 1 1 373.457 2.824 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@H](Nc2cccc([N+](=O)[O-])n2)C1 ZINC001158581233 1027065803 /nfs/dbraw/zinc/06/58/03/1027065803.db2.gz DGYQPUYMOIQSLT-DOTOQJQBSA-N 1 1 370.409 2.861 20 5 FFBDMO C/C(=C/C(=O)N(C)C(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000840567838 1027120665 /nfs/dbraw/zinc/12/06/65/1027120665.db2.gz DKQOUPUMWUILFY-SQFISAMPSA-N 1 1 361.442 2.567 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001159930966 1027538154 /nfs/dbraw/zinc/53/81/54/1027538154.db2.gz VCAANIIXMYMORQ-KDURUIRLSA-N 1 1 361.417 2.990 20 5 FFBDMO CCOC1CC2(C1)CC[N@H+](Cn1cc([N+](=O)[O-])c(-c3ccncc3)n1)C2 ZINC000795727578 1028052638 /nfs/dbraw/zinc/05/26/38/1028052638.db2.gz SMSBCCJBEVZBGF-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c3ccncc3)n1)C2 ZINC000795727578 1028052654 /nfs/dbraw/zinc/05/26/54/1028052654.db2.gz SMSBCCJBEVZBGF-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[N@H+]4CCc5ccccc5[C@H]4C3)c21 ZINC001155103500 1028580751 /nfs/dbraw/zinc/58/07/51/1028580751.db2.gz QDJUHMBTMHTQAJ-GOSISDBHSA-N 1 1 361.405 2.957 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1CCCC1)CCc1ccccc1 ZINC001162810618 1028665012 /nfs/dbraw/zinc/66/50/12/1028665012.db2.gz NSNKUCYEHPAOMR-RTBURBONSA-N 1 1 359.470 2.503 20 5 FFBDMO C[N@@H+]1CCc2c(N[C@H]3CCc4[nH]c(=O)ccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001163563449 1028973349 /nfs/dbraw/zinc/97/33/49/1028973349.db2.gz MVSYHVJVUGJRQC-ZDUSSCGKSA-N 1 1 354.410 2.653 20 5 FFBDMO C[N@H+]1CCc2c(N[C@H]3CCc4[nH]c(=O)ccc4C3)ccc([N+](=O)[O-])c2C1 ZINC001163563449 1028973360 /nfs/dbraw/zinc/97/33/60/1028973360.db2.gz MVSYHVJVUGJRQC-ZDUSSCGKSA-N 1 1 354.410 2.653 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C[C@@H]1C ZINC001163996692 1029138367 /nfs/dbraw/zinc/13/83/67/1029138367.db2.gz PJZGAVHJHSPHSM-TXEJJXNPSA-N 1 1 359.386 2.970 20 5 FFBDMO Cc1cc(Cl)nc(N2CC[NH+](CCc3ccncc3)CC2)c1[N+](=O)[O-] ZINC001165059621 1029356628 /nfs/dbraw/zinc/35/66/28/1029356628.db2.gz CVWRLUJIMCZNHH-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO Cc1nc(N2CCC([N@H+]3CCc4ccccc4C3)CC2)ncc1[N+](=O)[O-] ZINC001165154661 1029424623 /nfs/dbraw/zinc/42/46/23/1029424623.db2.gz NFTMZQIOYVZYFK-UHFFFAOYSA-N 1 1 353.426 2.720 20 5 FFBDMO Cc1cc(NC2CC[NH+](C[C@@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000782947198 1029860421 /nfs/dbraw/zinc/86/04/21/1029860421.db2.gz FAMDSBZHOXJCSY-KRWDZBQOSA-N 1 1 370.453 2.929 20 5 FFBDMO COC(=O)COc1c(C)cc(NCC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC001165300104 1029935958 /nfs/dbraw/zinc/93/59/58/1029935958.db2.gz HKSSBGWFVJOJMV-AWEZNQCLSA-N 1 1 365.430 2.599 20 5 FFBDMO C/C(=C\C(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784071838 1030452118 /nfs/dbraw/zinc/45/21/18/1030452118.db2.gz DLAXOVZQMWVKMT-AWHXWDPHSA-N 1 1 373.453 2.758 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1Cn1cnc(-c3cccc([N+](=O)[O-])c3)n1)CCOCC2 ZINC000842639141 1030867243 /nfs/dbraw/zinc/86/72/43/1030867243.db2.gz OWZLTWZVMOEOAK-CQSZACIVSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1CCC(=O)N1 ZINC001143128587 1031255156 /nfs/dbraw/zinc/25/51/56/1031255156.db2.gz KEQVSRWMIGXEGY-INIZCTEOSA-N 1 1 362.433 2.980 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1CNC(=O)C1 ZINC001143296293 1031398862 /nfs/dbraw/zinc/39/88/62/1031398862.db2.gz BOYASFQRSGZQQU-OAHLLOKOSA-N 1 1 362.433 2.837 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](Cc2cccc(C)c2)C1 ZINC001149847445 1031606323 /nfs/dbraw/zinc/60/63/23/1031606323.db2.gz MWWMELFBXQFTPY-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC001205890527 1032050094 /nfs/dbraw/zinc/05/00/94/1032050094.db2.gz SRFHOCHPJDFJIJ-TXEJJXNPSA-N 1 1 361.364 2.501 20 5 FFBDMO COc1ccc(CNC(=O)Nc2cc(C)c3[nH+]ccn3c2)cc1[N+](=O)[O-] ZINC001218783653 1033340046 /nfs/dbraw/zinc/34/00/46/1033340046.db2.gz SPAJWKHFWWKCFJ-UHFFFAOYSA-N 1 1 355.354 2.881 20 5 FFBDMO COC(=O)c1cccc2nc([C@](F)(Cl)O[C@H](C)C[N+](C)(C)C)[nH]c21 ZINC001223402747 1033428493 /nfs/dbraw/zinc/42/84/93/1033428493.db2.gz HDPKBOWWQBHCAB-QLJPJBMISA-O 1 1 358.821 2.779 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000830456879 1033621320 /nfs/dbraw/zinc/62/13/20/1033621320.db2.gz MWQPOFULZMFYPN-HIFRSBDPSA-N 1 1 367.446 2.782 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001138093726 1033733968 /nfs/dbraw/zinc/73/39/68/1033733968.db2.gz WCCKJKZBMWOQGT-VIFPVBQESA-N 1 1 358.801 2.572 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ncc(F)cc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001226754503 1034820791 /nfs/dbraw/zinc/82/07/91/1034820791.db2.gz QKTAMVOCVSGXAO-YXJHDRRASA-N 1 1 371.368 2.882 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ncc(F)cc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001226754503 1034820805 /nfs/dbraw/zinc/82/08/05/1034820805.db2.gz QKTAMVOCVSGXAO-YXJHDRRASA-N 1 1 371.368 2.882 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000832659927 1034898952 /nfs/dbraw/zinc/89/89/52/1034898952.db2.gz NHLJGKJMYYVUJI-IBGZPJMESA-N 1 1 360.410 2.521 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000832660257 1034899320 /nfs/dbraw/zinc/89/93/20/1034899320.db2.gz STHVRCUDTUVFDD-IBGZPJMESA-N 1 1 360.410 2.521 20 5 FFBDMO COC(=O)c1cccc([N+](=O)[O-])c1O[C@@H]1CC[N@H+]([C@H](C)c2ccccn2)C1 ZINC001227123814 1034941355 /nfs/dbraw/zinc/94/13/55/1034941355.db2.gz HHCRRWAUPFAIKH-ZIAGYGMSSA-N 1 1 371.393 2.991 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@H](Oc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001227521508 1035595413 /nfs/dbraw/zinc/59/54/13/1035595413.db2.gz RSMYIHYUSBUIMP-GOEBONIOSA-N 1 1 363.414 2.667 20 5 FFBDMO CN1CC(Oc2nc3ccc(NC(=O)C[NH+](C)C)cc3c3ccccc32)C1 ZINC001229805809 1036907782 /nfs/dbraw/zinc/90/77/82/1036907782.db2.gz LSXGONKXSVANSJ-UHFFFAOYSA-N 1 1 364.449 2.581 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)[C@@H](C)C[N@H+]1C ZINC001277849083 1036996534 /nfs/dbraw/zinc/99/65/34/1036996534.db2.gz INLZDARVKDPYQY-XQQFMLRXSA-N 1 1 356.426 2.883 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(OCC)c1 ZINC001207137303 1037179450 /nfs/dbraw/zinc/17/94/50/1037179450.db2.gz BYDBMKLQBACKMH-AWEZNQCLSA-N 1 1 350.419 2.989 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2CCC[N@@H+]([C@@H](C)c3ccccn3)C2)n1 ZINC001234881017 1037221922 /nfs/dbraw/zinc/22/19/22/1037221922.db2.gz KXFITKCMJBRMKS-KBPBESRZSA-N 1 1 358.398 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)n1 ZINC001234881017 1037221932 /nfs/dbraw/zinc/22/19/32/1037221932.db2.gz KXFITKCMJBRMKS-KBPBESRZSA-N 1 1 358.398 2.998 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001536918880 1070085993 /nfs/dbraw/zinc/08/59/93/1070085993.db2.gz VEZUAOGTEFPIDP-APWZRJJASA-N 1 1 366.421 2.645 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@H]3CCCN(C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256085215 1038371444 /nfs/dbraw/zinc/37/14/44/1038371444.db2.gz LSIBMBZDGGGKCU-OAHLLOKOSA-N 1 1 362.474 2.504 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H]4COC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100852 1038383694 /nfs/dbraw/zinc/38/36/94/1038383694.db2.gz QPUCFKRHTTUJKT-GJZGRUSLSA-N 1 1 361.442 2.541 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(-c2nc3ccc(C[NH+](C)C)cc3[nH]2)c1 ZINC001251001790 1038889782 /nfs/dbraw/zinc/88/97/82/1038889782.db2.gz ZKQHOLCFUQJKPG-UHFFFAOYSA-N 1 1 354.366 2.986 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1Cc1nnc(CC[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC001258080209 1039157750 /nfs/dbraw/zinc/15/77/50/1039157750.db2.gz GLRVDWAVDKVLQD-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@@H]4COC[C@H](C3)C4(F)F)CC2)cc1 ZINC001254480122 1040747417 /nfs/dbraw/zinc/74/74/17/1040747417.db2.gz AOGJGSZNPXMAGK-OKILXGFUSA-N 1 1 367.396 2.777 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC[N@@H+](Cc2ccccc2)[C@H](CO)C1 ZINC001254550987 1040792238 /nfs/dbraw/zinc/79/22/38/1040792238.db2.gz UXMUGNRTCIOWSM-XLIONFOSSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001254550987 1040792268 /nfs/dbraw/zinc/79/22/68/1040792268.db2.gz UXMUGNRTCIOWSM-XLIONFOSSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN(Cc2ccccc2)[C@H](CO)C1 ZINC001254550987 1040792276 /nfs/dbraw/zinc/79/22/76/1040792276.db2.gz UXMUGNRTCIOWSM-XLIONFOSSA-N 1 1 369.465 2.705 20 5 FFBDMO CCN(C)c1ncnc2c1CC[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254563034 1040800230 /nfs/dbraw/zinc/80/02/30/1040800230.db2.gz WMJMUIWMIRPJHG-OAHLLOKOSA-N 1 1 369.469 2.873 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@H]3[C@H]1CCN3Cc1cccnc1)C2 ZINC001254596048 1040824449 /nfs/dbraw/zinc/82/44/49/1040824449.db2.gz MLCVYZMRILUXJU-QHAWAJNXSA-N 1 1 364.449 2.806 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CCn3cnc(COCC4CC4)c3C1)C2 ZINC001254595570 1040825025 /nfs/dbraw/zinc/82/50/25/1040825025.db2.gz ITNQHLQCSYTRML-SFHVURJKSA-N 1 1 368.437 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCn3cnc(COCC4CC4)c3C1)C2 ZINC001254595570 1040825039 /nfs/dbraw/zinc/82/50/39/1040825039.db2.gz ITNQHLQCSYTRML-SFHVURJKSA-N 1 1 368.437 2.701 20 5 FFBDMO CC(C)Oc1ncnc2c1CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254597593 1040827210 /nfs/dbraw/zinc/82/72/10/1040827210.db2.gz TWDNACCMJJHNQO-KRWDZBQOSA-N 1 1 368.437 2.740 20 5 FFBDMO COc1ccc(CC[N@@H+](C[C@@H](C)O)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001254599667 1040830762 /nfs/dbraw/zinc/83/07/62/1040830762.db2.gz OGTNVLYBAYRZBI-QRWLVFNGSA-N 1 1 370.449 2.996 20 5 FFBDMO Cc1cc(O[C@@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ncn1 ZINC001254610335 1040838911 /nfs/dbraw/zinc/83/89/11/1040838911.db2.gz JQOQRMZIKMLXIF-ZWKOTPCHSA-N 1 1 354.410 2.704 20 5 FFBDMO COc1cccc(O[C@@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610256 1040839970 /nfs/dbraw/zinc/83/99/70/1040839970.db2.gz ISCXLIFGQDZQNH-IAGOWNOFSA-N 1 1 355.394 2.619 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ccncc3[N+](=O)[O-])C2)ccn1 ZINC001261757823 1041401022 /nfs/dbraw/zinc/40/10/22/1041401022.db2.gz FMZLCFNBBSQBOA-KRWDZBQOSA-N 1 1 371.441 2.883 20 5 FFBDMO Cc1nc(NCC2([N@@H+](C)Cc3ccccc3)CCOCC2)ncc1[N+](=O)[O-] ZINC001262374849 1041663757 /nfs/dbraw/zinc/66/37/57/1041663757.db2.gz QXIXVSHMYXLQPT-UHFFFAOYSA-N 1 1 371.441 2.786 20 5 FFBDMO O=C(Nc1cc[nH+]c(N2CCCCC2)c1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC001538464608 1070438360 /nfs/dbraw/zinc/43/83/60/1070438360.db2.gz OIZIOYODBMJMMW-UHFFFAOYSA-N 1 1 370.365 2.961 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001311321798 1043885039 /nfs/dbraw/zinc/88/50/39/1043885039.db2.gz ZLVKOYVOVBRJLX-OKILXGFUSA-N 1 1 350.419 2.524 20 5 FFBDMO CC[N@H+]1CC[C@@H](Cn2c(C)nnc2N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC001313883911 1044436877 /nfs/dbraw/zinc/43/68/77/1044436877.db2.gz LENHOZJULMPVPT-MRXNPFEDSA-N 1 1 372.473 2.515 20 5 FFBDMO CCC1([NH2+]Cc2cc(C)ccc2F)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281004606 1044791811 /nfs/dbraw/zinc/79/18/11/1044791811.db2.gz QYVOOFZCFGXZHW-NVXWUHKLSA-N 1 1 363.433 2.660 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)COc2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001318693078 1044811658 /nfs/dbraw/zinc/81/16/58/1044811658.db2.gz CFHWCJGNEYILDR-INIZCTEOSA-N 1 1 370.409 2.780 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@@H+]1C ZINC001539396566 1070629692 /nfs/dbraw/zinc/62/96/92/1070629692.db2.gz NCXMVNNEUOGGGJ-NSHDSACASA-N 1 1 370.247 2.880 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001539397627 1070631133 /nfs/dbraw/zinc/63/11/33/1070631133.db2.gz VEANEKQBKZMJLL-ZDUSSCGKSA-N 1 1 355.822 2.618 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001319691116 1045240768 /nfs/dbraw/zinc/24/07/68/1045240768.db2.gz NAAVHYQBGHARSX-ZWKOTPCHSA-N 1 1 372.400 2.979 20 5 FFBDMO O=C(OCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccn(-c2cc[nH+]cc2)n1 ZINC001324685701 1046167031 /nfs/dbraw/zinc/16/70/31/1046167031.db2.gz ICAQVOBWQORAOS-UHFFFAOYSA-N 1 1 365.305 2.674 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC001324864879 1046260953 /nfs/dbraw/zinc/26/09/53/1046260953.db2.gz WMQIPOBOLNIGIR-HZPDHXFCSA-N 1 1 365.861 2.724 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@@H+](CC)C1 ZINC001325142179 1046390180 /nfs/dbraw/zinc/39/01/80/1046390180.db2.gz BDWQRNPTOVYUBF-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[N@H+]1CCCC[C@H]1C ZINC001540833306 1071014801 /nfs/dbraw/zinc/01/48/01/1071014801.db2.gz LUMTUHRXJKXOCW-KGLIPLIRSA-N 1 1 371.441 2.978 20 5 FFBDMO Cc1nc(Nc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)ncc1[N+](=O)[O-] ZINC001333587389 1048992345 /nfs/dbraw/zinc/99/23/45/1048992345.db2.gz JPYIKULFFSUOGM-MRXNPFEDSA-N 1 1 354.414 2.721 20 5 FFBDMO CC[C@H]1CN(c2nnc([C@H](C)[N+](=O)[O-])n2CC)CC[N@H+]1Cc1ccccc1 ZINC001341000718 1051337396 /nfs/dbraw/zinc/33/73/96/1051337396.db2.gz DEKJDMXFUGJNMI-RDJZCZTQSA-N 1 1 372.473 2.737 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001303800977 1051449815 /nfs/dbraw/zinc/44/98/15/1051449815.db2.gz KHPOSVGFDNCRIL-HOCLYGCPSA-N 1 1 360.458 2.654 20 5 FFBDMO CC(C)Cn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001342989091 1051605228 /nfs/dbraw/zinc/60/52/28/1051605228.db2.gz VPVVEIQODFYXKR-ZIAGYGMSSA-N 1 1 374.445 2.633 20 5 FFBDMO CC1(C)CO[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC001307665653 1052332888 /nfs/dbraw/zinc/33/28/88/1052332888.db2.gz ZSKOHPAGJJIPRD-HNNXBMFYSA-N 1 1 373.457 2.798 20 5 FFBDMO C[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001307710065 1052339633 /nfs/dbraw/zinc/33/96/33/1052339633.db2.gz PNWJFUFGUWMLHP-TVQRCGJNSA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001307710065 1052339639 /nfs/dbraw/zinc/33/96/39/1052339639.db2.gz PNWJFUFGUWMLHP-TVQRCGJNSA-N 1 1 352.778 2.501 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@H]2C[C@@H](OC)C23CCC3)c([N+](=O)[O-])c1 ZINC001307772090 1052348133 /nfs/dbraw/zinc/34/81/33/1052348133.db2.gz QOBSCICIJDJVLT-DLBZAZTESA-N 1 1 350.415 2.872 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2COC(C)(C)C)c([N+](=O)[O-])c1 ZINC001308063127 1052397359 /nfs/dbraw/zinc/39/73/59/1052397359.db2.gz CMKGKBQWFVQZEG-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2COC(C)(C)C)c([N+](=O)[O-])c1 ZINC001308063127 1052397365 /nfs/dbraw/zinc/39/73/65/1052397365.db2.gz CMKGKBQWFVQZEG-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC001308081243 1052402628 /nfs/dbraw/zinc/40/26/28/1052402628.db2.gz GKQNSYPAMKQLMR-MBNYWOFBSA-N 1 1 374.397 2.837 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]1(CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC001308161189 1052421285 /nfs/dbraw/zinc/42/12/85/1052421285.db2.gz QEHVLQCPHANTAR-IBGZPJMESA-N 1 1 355.394 2.517 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]1(CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC001308161189 1052421288 /nfs/dbraw/zinc/42/12/88/1052421288.db2.gz QEHVLQCPHANTAR-IBGZPJMESA-N 1 1 355.394 2.517 20 5 FFBDMO COc1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1 ZINC001345728341 1052590916 /nfs/dbraw/zinc/59/09/16/1052590916.db2.gz USIUVIRSDUGWPT-ZDUSSCGKSA-N 1 1 350.419 2.942 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC001335983397 1053686620 /nfs/dbraw/zinc/68/66/20/1053686620.db2.gz BEHVFQOVSGCGNC-HNNXBMFYSA-N 1 1 359.357 2.529 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001337997030 1055159995 /nfs/dbraw/zinc/15/99/95/1055159995.db2.gz MDSCOXHLWQHWCK-SFHVURJKSA-N 1 1 360.458 2.508 20 5 FFBDMO COC(=O)/C=C/c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)o1 ZINC000848882621 1055297288 /nfs/dbraw/zinc/29/72/88/1055297288.db2.gz VZZYUPFAUVEENN-BQYQJAHWSA-N 1 1 371.393 2.696 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001444843866 1058341999 /nfs/dbraw/zinc/34/19/99/1058341999.db2.gz COGBYEWRCGFKBC-SNVBAGLBSA-N 1 1 372.828 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@H]3CCC[N@H+]3Cc3ccccc32)n1 ZINC001354985767 1059734289 /nfs/dbraw/zinc/73/42/89/1059734289.db2.gz ZXTCKRGVBYHZKN-OAHLLOKOSA-N 1 1 352.394 2.923 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000848481749 1060116150 /nfs/dbraw/zinc/11/61/50/1060116150.db2.gz CQRJQHWOQYASOZ-IEBWSBKVSA-N 1 1 373.453 2.617 20 5 FFBDMO CC(C)CO[C@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482648 1060121481 /nfs/dbraw/zinc/12/14/81/1060121481.db2.gz SHTJDKNVAGDHPO-ZWKOTPCHSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)CO[C@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848482648 1060121488 /nfs/dbraw/zinc/12/14/88/1060121488.db2.gz SHTJDKNVAGDHPO-ZWKOTPCHSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000848487804 1060138522 /nfs/dbraw/zinc/13/85/22/1060138522.db2.gz XLFLJOFZAUPGIC-FUHWJXTLSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000848487804 1060138537 /nfs/dbraw/zinc/13/85/37/1060138537.db2.gz XLFLJOFZAUPGIC-FUHWJXTLSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000848489764 1060148422 /nfs/dbraw/zinc/14/84/22/1060148422.db2.gz RJMQJSJMIOFPGG-OAHLLOKOSA-N 1 1 365.380 2.989 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001457018947 1060253989 /nfs/dbraw/zinc/25/39/89/1060253989.db2.gz GRKIUUCFFQUGQX-ZDUSSCGKSA-N 1 1 351.366 2.975 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC001457163500 1060296085 /nfs/dbraw/zinc/29/60/85/1060296085.db2.gz KYKKIGSHHGDKRC-UHFFFAOYSA-N 1 1 374.372 2.795 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)[C@@H]2C1 ZINC001521372842 1060562994 /nfs/dbraw/zinc/56/29/94/1060562994.db2.gz JYEXLZVYNAYHNC-BMGDILEWSA-N 1 1 358.442 2.609 20 5 FFBDMO CCC(=O)NC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001460776814 1061096886 /nfs/dbraw/zinc/09/68/86/1061096886.db2.gz FFGUVMOBHXMZLH-LBPRGKRZSA-N 1 1 373.413 2.696 20 5 FFBDMO COc1c(O)ccc(C[NH2+][C@H](CC(=O)N(C)C)c2ccccc2)c1[N+](=O)[O-] ZINC001462266352 1061562530 /nfs/dbraw/zinc/56/25/30/1061562530.db2.gz IEFHVZVFFGVBCU-OAHLLOKOSA-N 1 1 373.409 2.618 20 5 FFBDMO C[C@@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000774596804 1062075964 /nfs/dbraw/zinc/07/59/64/1062075964.db2.gz LNUYQQDDYIUSCK-MLGOLLRUSA-N 1 1 370.365 2.959 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1 ZINC001523692369 1062582663 /nfs/dbraw/zinc/58/26/63/1062582663.db2.gz DNMXLFMOEAEYSC-GOSISDBHSA-N 1 1 354.410 2.899 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001465900086 1063255303 /nfs/dbraw/zinc/25/53/03/1063255303.db2.gz NFOFCXZTVPPUMS-BDJLRTHQSA-N 1 1 354.410 2.543 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001525865162 1063443630 /nfs/dbraw/zinc/44/36/30/1063443630.db2.gz IVIUTTCGQXUSLK-OCCSQVGLSA-N 1 1 369.849 2.958 20 5 FFBDMO CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cc1N)[N@H+]1CCc2ccccc2C1 ZINC001442345265 1063525636 /nfs/dbraw/zinc/52/56/36/1063525636.db2.gz LWARNJGFUYUGDR-UHFFFAOYSA-N 1 1 368.437 2.744 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cc(Cl)ccc2F)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001495916091 1063557145 /nfs/dbraw/zinc/55/71/45/1063557145.db2.gz CYQDKCZBYFQXOF-UKRRQHHQSA-N 1 1 369.824 2.663 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(NCC2([N@H+]3CCOC(C)(C)C3)CCCCC2)n1 ZINC001472691594 1065128566 /nfs/dbraw/zinc/12/85/66/1065128566.db2.gz SKHWREAAHVDFQQ-UHFFFAOYSA-N 1 1 351.451 2.554 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2c[nH]nc2C[C@@H](C)C1 ZINC001473797162 1065365321 /nfs/dbraw/zinc/36/53/21/1065365321.db2.gz NXYJMITYFBBGEB-GFCCVEGCSA-N 1 1 357.414 2.649 20 5 FFBDMO CC(C)(C)[S@@](=O)CC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001474013095 1065439598 /nfs/dbraw/zinc/43/95/98/1065439598.db2.gz KEYIFZJEFSEBFC-FQEVSTJZSA-N 1 1 363.277 2.994 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CCC(c2cc(C3CC[NH2+]CC3)n[nH]2)CC1 ZINC001580875404 1078881697 /nfs/dbraw/zinc/88/16/97/1078881697.db2.gz KHQFMCMODVJXPY-UHFFFAOYSA-N 1 1 356.430 2.564 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C[C@@]2(C)C1 ZINC001557741021 1075882573 /nfs/dbraw/zinc/88/25/73/1075882573.db2.gz HPZPPJCDDWILFH-HDICACEKSA-N 1 1 365.861 2.981 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001559080732 1076123946 /nfs/dbraw/zinc/12/39/46/1076123946.db2.gz SFLVBJFRNGERJM-UONOGXRCSA-N 1 1 358.442 2.979 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC001559226690 1076137206 /nfs/dbraw/zinc/13/72/06/1076137206.db2.gz MZRSBBJGNVJGMW-ZDUSSCGKSA-N 1 1 367.409 2.610 20 5 FFBDMO C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C1CCCC1 ZINC001559280885 1076145531 /nfs/dbraw/zinc/14/55/31/1076145531.db2.gz YYMLLRHYRSFPIJ-ZDUSSCGKSA-N 1 1 358.442 2.933 20 5 FFBDMO C[C@H]1CCC(C)(C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559904136 1076200658 /nfs/dbraw/zinc/20/06/58/1076200658.db2.gz ZGQJCWTZSKUMEM-HNNXBMFYSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1nnc(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)o1 ZINC001559944269 1076204102 /nfs/dbraw/zinc/20/41/02/1076204102.db2.gz KQSOJIAJIBIZMD-WKILWMFISA-N 1 1 360.414 2.634 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1CN[C@]1(CO)CCC[N@H+](Cc2ccccc2)C1 ZINC001560134396 1076232695 /nfs/dbraw/zinc/23/26/95/1076232695.db2.gz DNJYTZOIKIWMSD-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1CN[C@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC001560134396 1076232698 /nfs/dbraw/zinc/23/26/98/1076232698.db2.gz DNJYTZOIKIWMSD-HXUWFJFHSA-N 1 1 373.428 2.851 20 5 FFBDMO O=C(CC[N@@H+]1CCS[C@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC001560146981 1076235646 /nfs/dbraw/zinc/23/56/46/1076235646.db2.gz DRAUMAZRGLQALC-LBPRGKRZSA-N 1 1 363.361 2.903 20 5 FFBDMO O=C(CC[N@H+]1CCS[C@H](C(F)(F)F)C1)Nc1ccccc1[N+](=O)[O-] ZINC001560146981 1076235650 /nfs/dbraw/zinc/23/56/50/1076235650.db2.gz DRAUMAZRGLQALC-LBPRGKRZSA-N 1 1 363.361 2.903 20 5 FFBDMO COc1nscc1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001560174120 1076241010 /nfs/dbraw/zinc/24/10/10/1076241010.db2.gz VPSWSJAMMPWEGW-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1nscc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001560174120 1076241012 /nfs/dbraw/zinc/24/10/12/1076241012.db2.gz VPSWSJAMMPWEGW-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC001560736065 1076295019 /nfs/dbraw/zinc/29/50/19/1076295019.db2.gz GAQJCHCNANGZKR-PBHICJAKSA-N 1 1 371.437 2.919 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC001560736065 1076295021 /nfs/dbraw/zinc/29/50/21/1076295021.db2.gz GAQJCHCNANGZKR-PBHICJAKSA-N 1 1 371.437 2.919 20 5 FFBDMO C[N@@H+](CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1)Cc1ccccc1F ZINC001568436758 1077091364 /nfs/dbraw/zinc/09/13/64/1077091364.db2.gz SDXGVPVNYRRCCL-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO C[N@H+](CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)Cc1ccccc1F ZINC001568436758 1077091370 /nfs/dbraw/zinc/09/13/70/1077091370.db2.gz SDXGVPVNYRRCCL-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO C[N@@H+](CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)Cc1ccccc1F ZINC001568436758 1077091376 /nfs/dbraw/zinc/09/13/76/1077091376.db2.gz SDXGVPVNYRRCCL-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO CN(CCC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001569201483 1077133921 /nfs/dbraw/zinc/13/39/21/1077133921.db2.gz AANHBHFUEOIHKO-ZIAGYGMSSA-N 1 1 360.241 2.597 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)cc1 ZINC001587797260 1079867728 /nfs/dbraw/zinc/86/77/28/1079867728.db2.gz YGFGSQCJTVHETM-HNNXBMFYSA-N 1 1 372.400 2.629 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001589966700 1080908653 /nfs/dbraw/zinc/90/86/53/1080908653.db2.gz CAEVDDFTJJXVNL-JTQLQIEISA-N 1 1 369.341 2.534 20 5 FFBDMO CC1(C)C[N@@H+](Cc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC001590104748 1081016122 /nfs/dbraw/zinc/01/61/22/1081016122.db2.gz VYKKQMWNVMMWSS-UHFFFAOYSA-N 1 1 372.429 2.699 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(NC(=O)c2ccoc2C)CC1 ZINC000366625104 512113419 /nfs/dbraw/zinc/11/34/19/512113419.db2.gz BWBFCYBWBUFAHE-UHFFFAOYSA-N 1 1 373.409 2.899 20 5 FFBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)N(C)C ZINC000104675898 250182877 /nfs/dbraw/zinc/18/28/77/250182877.db2.gz YLQSHAASVIPEHD-UHFFFAOYSA-N 1 1 360.414 2.593 20 5 FFBDMO O=C1[C@H]([N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1CC(F)(F)F ZINC000153257529 251119448 /nfs/dbraw/zinc/11/94/48/251119448.db2.gz VBFHWJDDKKRVFP-CQSZACIVSA-N 1 1 357.332 2.722 20 5 FFBDMO O=C1[C@H]([N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCN1CC(F)(F)F ZINC000153257529 251119451 /nfs/dbraw/zinc/11/94/51/251119451.db2.gz VBFHWJDDKKRVFP-CQSZACIVSA-N 1 1 357.332 2.722 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@@H](O)COCCOC(C)C ZINC000272283969 252000085 /nfs/dbraw/zinc/00/00/85/252000085.db2.gz FUQFVNRXNGFUSA-DOTOQJQBSA-N 1 1 354.447 2.699 20 5 FFBDMO C[C@H](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000273244672 252262840 /nfs/dbraw/zinc/26/28/40/252262840.db2.gz XTWXHUYZIBKJLU-LLVKDONJSA-N 1 1 361.489 2.736 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000277094247 256160826 /nfs/dbraw/zinc/16/08/26/256160826.db2.gz VZNXILFRYZBSPY-MRXNPFEDSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000277094247 256160828 /nfs/dbraw/zinc/16/08/28/256160828.db2.gz VZNXILFRYZBSPY-MRXNPFEDSA-N 1 1 371.462 2.942 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000277615576 256217923 /nfs/dbraw/zinc/21/79/23/256217923.db2.gz QJNXZEXHPGOQDY-KGLIPLIRSA-N 1 1 361.442 2.986 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](C)OC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000279124212 256383925 /nfs/dbraw/zinc/38/39/25/256383925.db2.gz UVRMWKYHCBNDAI-AWEZNQCLSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C)OC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000279124212 256383927 /nfs/dbraw/zinc/38/39/27/256383927.db2.gz UVRMWKYHCBNDAI-AWEZNQCLSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000279134976 256385520 /nfs/dbraw/zinc/38/55/20/256385520.db2.gz RHIIAZJICQPVQU-BEFAXECRSA-N 1 1 360.502 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000067613959 221263627 /nfs/dbraw/zinc/26/36/27/221263627.db2.gz MLCZVEMQGLYNPM-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000067613959 221263628 /nfs/dbraw/zinc/26/36/28/221263628.db2.gz MLCZVEMQGLYNPM-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000286128369 257021643 /nfs/dbraw/zinc/02/16/43/257021643.db2.gz HEGXLIJKCVKZAG-BBRMVZONSA-N 1 1 374.441 2.538 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000286464139 257038398 /nfs/dbraw/zinc/03/83/98/257038398.db2.gz KOGDAEPTCDDXNP-XFJQVIQYSA-N 1 1 359.426 2.587 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000286522433 257041126 /nfs/dbraw/zinc/04/11/26/257041126.db2.gz NGDFSNJHKDAAAS-DGCLKSJQSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCc3occc3C2)c([N+](=O)[O-])c1 ZINC000288861233 257232951 /nfs/dbraw/zinc/23/29/51/257232951.db2.gz PTZAUGMLKZKBBH-UHFFFAOYSA-N 1 1 359.382 2.973 20 5 FFBDMO Cc1c(C[N@H+]2CCC[C@@H](CNC(=O)C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000289513443 257285204 /nfs/dbraw/zinc/28/52/04/257285204.db2.gz RCOQFJPKHVKQJP-LBPRGKRZSA-N 1 1 359.348 2.794 20 5 FFBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1[C@H]1CCCO1 ZINC000289969485 257309288 /nfs/dbraw/zinc/30/92/88/257309288.db2.gz XELNISAFCGOFOM-WBVHZDCISA-N 1 1 365.405 2.952 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1(C)C ZINC000296103505 257671647 /nfs/dbraw/zinc/67/16/47/257671647.db2.gz RCVJTVIYBOLWPZ-OAHLLOKOSA-N 1 1 353.394 2.809 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000298545217 257921104 /nfs/dbraw/zinc/92/11/04/257921104.db2.gz NMQUOGIMKYJOAZ-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301110077 258026188 /nfs/dbraw/zinc/02/61/88/258026188.db2.gz XVGFTHQACMYHQS-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301189927 258032755 /nfs/dbraw/zinc/03/27/55/258032755.db2.gz LUFXKIILNOHBJE-HNNXBMFYSA-N 1 1 352.866 2.855 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1N1CC[NH+](Cc2cccc(O)c2)CC1 ZINC000301371879 258045555 /nfs/dbraw/zinc/04/55/55/258045555.db2.gz VQUUBODIYCJAQO-UHFFFAOYSA-N 1 1 357.410 2.769 20 5 FFBDMO C[C@@H](CNc1ccc(Br)cc1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000301387172 258046758 /nfs/dbraw/zinc/04/67/58/258046758.db2.gz WKXRNNAWZXNLQH-NSHDSACASA-N 1 1 358.236 2.738 20 5 FFBDMO Cc1ccc(CNc2ccc3ncc([N+](=O)[O-])n3n2)c(N2CCCC2)[nH+]1 ZINC000302028585 258083086 /nfs/dbraw/zinc/08/30/86/258083086.db2.gz BBAGXUIHQVEXRG-UHFFFAOYSA-N 1 1 353.386 2.553 20 5 FFBDMO Nc1nc(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC000302200698 258094701 /nfs/dbraw/zinc/09/47/01/258094701.db2.gz ZDZNDCPBRWHGEL-ARFHVFGLSA-N 1 1 368.441 2.680 20 5 FFBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000302466553 258102817 /nfs/dbraw/zinc/10/28/17/258102817.db2.gz SQUSGWZJMODIEX-LJQANCHMSA-N 1 1 359.401 2.807 20 5 FFBDMO Cc1nc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000301736145 258065635 /nfs/dbraw/zinc/06/56/35/258065635.db2.gz VCAKYMNXXNUSGO-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@H]1[NH+]1CCOCC1 ZINC000301920818 258075657 /nfs/dbraw/zinc/07/56/57/258075657.db2.gz XFIMHDKBQOWPTD-RHSMWYFYSA-N 1 1 363.458 2.929 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301996819 258081123 /nfs/dbraw/zinc/08/11/23/258081123.db2.gz OUXVRMUCWQCAEX-HNNXBMFYSA-N 1 1 366.425 2.738 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000331106905 258177259 /nfs/dbraw/zinc/17/72/59/258177259.db2.gz GSHOKAFOYRSGRS-XQQFMLRXSA-N 1 1 369.412 2.898 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000331119959 258177531 /nfs/dbraw/zinc/17/75/31/258177531.db2.gz FXCVEMBEAGVJDX-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000331900394 258205252 /nfs/dbraw/zinc/20/52/52/258205252.db2.gz GWUCUGCCKBAICO-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000332331087 258225514 /nfs/dbraw/zinc/22/55/14/258225514.db2.gz QIGNCCSOIYPIGV-UGSOOPFHSA-N 1 1 365.430 2.821 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000332343495 258226235 /nfs/dbraw/zinc/22/62/35/258226235.db2.gz SRCLUXCLRCDYFD-KGLIPLIRSA-N 1 1 368.231 2.714 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389550 258228277 /nfs/dbraw/zinc/22/82/77/258228277.db2.gz LFWQEFSCEVWQIS-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389550 258228278 /nfs/dbraw/zinc/22/82/78/258228278.db2.gz LFWQEFSCEVWQIS-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)cc1[N+](=O)[O-] ZINC000032483434 506259027 /nfs/dbraw/zinc/25/90/27/506259027.db2.gz ISPJLICIFJVXHI-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000366958581 512269268 /nfs/dbraw/zinc/26/92/68/512269268.db2.gz AKGKKUVGWXZTRE-MRXNPFEDSA-N 1 1 370.365 2.728 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000366958581 512269273 /nfs/dbraw/zinc/26/92/73/512269273.db2.gz AKGKKUVGWXZTRE-MRXNPFEDSA-N 1 1 370.365 2.728 20 5 FFBDMO Cc1ccccc1OCCC[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053722488 506435746 /nfs/dbraw/zinc/43/57/46/506435746.db2.gz XZPGTEDGVNFOHA-UHFFFAOYSA-N 1 1 357.410 2.903 20 5 FFBDMO Cc1ccccc1OCCC[N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053722488 506435755 /nfs/dbraw/zinc/43/57/55/506435755.db2.gz XZPGTEDGVNFOHA-UHFFFAOYSA-N 1 1 357.410 2.903 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000375350591 512280328 /nfs/dbraw/zinc/28/03/28/512280328.db2.gz XKLWBYHVWILYSX-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000041576993 506533380 /nfs/dbraw/zinc/53/33/80/506533380.db2.gz JHXITOUFGVRJTM-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[NH+](C)C ZINC000010448122 506742344 /nfs/dbraw/zinc/74/23/44/506742344.db2.gz KEDFYLKYQXZMTK-MRXNPFEDSA-N 1 1 373.409 2.645 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]1C[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000067613962 506950397 /nfs/dbraw/zinc/95/03/97/506950397.db2.gz MLCZVEMQGLYNPM-BFYDXBDKSA-N 1 1 361.442 2.617 20 5 FFBDMO C[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCCC[C@@H]1C ZINC000067830431 507020516 /nfs/dbraw/zinc/02/05/16/507020516.db2.gz LCVDQMPWFRYJEE-GJZGRUSLSA-N 1 1 358.442 2.929 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](c1cccs1)[NH+](C)C ZINC000045797393 507022258 /nfs/dbraw/zinc/02/22/58/507022258.db2.gz UXDPWSIVCIWZEX-CYBMUJFWSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccc(CC(=O)NCCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000067907333 507048362 /nfs/dbraw/zinc/04/83/62/507048362.db2.gz JRIXWOFNCBBARI-OAHLLOKOSA-N 1 1 363.458 2.917 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1 ZINC000068798955 507329262 /nfs/dbraw/zinc/32/92/62/507329262.db2.gz KJEICGICVADOOW-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000069064070 507392568 /nfs/dbraw/zinc/39/25/68/507392568.db2.gz IQSHYWCJVBPKIS-ZDUSSCGKSA-N 1 1 355.460 2.531 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051049487 507727819 /nfs/dbraw/zinc/72/78/19/507727819.db2.gz PZXFFLJUADVAOK-HOTGVXAUSA-N 1 1 363.458 2.990 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000028885380 507748633 /nfs/dbraw/zinc/74/86/33/507748633.db2.gz HKTSIEUMVFMFQL-UHFFFAOYSA-N 1 1 369.421 2.708 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000051468349 507771309 /nfs/dbraw/zinc/77/13/09/507771309.db2.gz ZKMRKEPPBWYZKL-UHFFFAOYSA-N 1 1 360.439 2.886 20 5 FFBDMO Cc1ccc(S(=O)(=O)N(CC[NH+](C)C)c2ccccc2)cc1[N+](=O)[O-] ZINC000063864321 507777202 /nfs/dbraw/zinc/77/72/02/507777202.db2.gz HRYRRZQNUUUXIJ-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO O=[N+]([O-])c1c(NCc2cccc(C[NH+]3CCOCC3)c2)nc2sccn21 ZINC000052429142 507808816 /nfs/dbraw/zinc/80/88/16/507808816.db2.gz VLTKTFNJGFBDPQ-UHFFFAOYSA-N 1 1 373.438 2.748 20 5 FFBDMO Cc1c(NC(=O)c2ccc(C[NH+]3CCN(C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000072795058 507853338 /nfs/dbraw/zinc/85/33/38/507853338.db2.gz SHZCMTKBLDYKQR-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO C[C@H](NC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986910 507881930 /nfs/dbraw/zinc/88/19/30/507881930.db2.gz SLNLQIGKHUEVJJ-KBXCAEBGSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@H](NC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986910 507881933 /nfs/dbraw/zinc/88/19/33/507881933.db2.gz SLNLQIGKHUEVJJ-KBXCAEBGSA-N 1 1 354.410 2.832 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1SC ZINC000108305799 507886295 /nfs/dbraw/zinc/88/62/95/507886295.db2.gz NPVDBJPOUVGOTL-GFCCVEGCSA-N 1 1 365.455 2.539 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000108305863 507886348 /nfs/dbraw/zinc/88/63/48/507886348.db2.gz IRJKUBKZTNWJIQ-BXUZGUMPSA-N 1 1 367.833 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](Cn4ccnn4)C3)co2)cc1 ZINC000089934668 507887330 /nfs/dbraw/zinc/88/73/30/507887330.db2.gz OCSMXLPDTKZZDY-AWEZNQCLSA-N 1 1 368.397 2.754 20 5 FFBDMO CC[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O ZINC000110559916 508033708 /nfs/dbraw/zinc/03/37/08/508033708.db2.gz IKYJOVDTVOXMDE-YPMHNXCESA-N 1 1 372.263 2.639 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000110992513 508063895 /nfs/dbraw/zinc/06/38/95/508063895.db2.gz PMGBJZIJPOYQAR-LBPRGKRZSA-N 1 1 367.471 2.930 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075860887 508138065 /nfs/dbraw/zinc/13/80/65/508138065.db2.gz MIEODZKNSOKLLC-OAHLLOKOSA-N 1 1 359.430 2.951 20 5 FFBDMO CC(=O)Nc1ccccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534764 508148441 /nfs/dbraw/zinc/14/84/41/508148441.db2.gz FVULVTLCALYBTF-HNNXBMFYSA-N 1 1 355.398 2.635 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000081363234 508167769 /nfs/dbraw/zinc/16/77/69/508167769.db2.gz HIVYMPBUQMCNGA-OAHLLOKOSA-N 1 1 358.442 2.740 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700822 508211973 /nfs/dbraw/zinc/21/19/73/508211973.db2.gz MNMSDAWCRAQOMF-CQSZACIVSA-N 1 1 363.458 2.978 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000112700822 508211974 /nfs/dbraw/zinc/21/19/74/508211974.db2.gz MNMSDAWCRAQOMF-CQSZACIVSA-N 1 1 363.458 2.978 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000076494034 508213866 /nfs/dbraw/zinc/21/38/66/508213866.db2.gz XXOPRFPMDGGKHD-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000076494034 508213868 /nfs/dbraw/zinc/21/38/68/508213868.db2.gz XXOPRFPMDGGKHD-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000076495182 508214254 /nfs/dbraw/zinc/21/42/54/508214254.db2.gz SUQNMQDAWACUSJ-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000076495182 508214255 /nfs/dbraw/zinc/21/42/55/508214255.db2.gz SUQNMQDAWACUSJ-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000076757176 508251407 /nfs/dbraw/zinc/25/14/07/508251407.db2.gz PEFMUNWZNDACBX-WMZOPIPTSA-N 1 1 357.410 2.521 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000076805932 508255467 /nfs/dbraw/zinc/25/54/67/508255467.db2.gz OXYKSAUPQJJPLV-CQSZACIVSA-N 1 1 357.385 2.897 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C(C)C)C2CCOCC2)c([N+](=O)[O-])c1 ZINC000077357020 508305003 /nfs/dbraw/zinc/30/50/03/508305003.db2.gz MRTGFJRQYXPFJY-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000085636705 508315265 /nfs/dbraw/zinc/31/52/65/508315265.db2.gz JFKRPTYPGVXYOD-OAHLLOKOSA-N 1 1 362.430 2.540 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000087026884 508332067 /nfs/dbraw/zinc/33/20/67/508332067.db2.gz POINVJZFRAQLKD-UHFFFAOYSA-N 1 1 367.449 2.914 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1 ZINC000114641562 508332962 /nfs/dbraw/zinc/33/29/62/508332962.db2.gz RGKXQMXLPAYCTA-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000121869895 508436930 /nfs/dbraw/zinc/43/69/30/508436930.db2.gz AXTBWXRWQFSWJJ-MFKMUULPSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000156671450 508459924 /nfs/dbraw/zinc/45/99/24/508459924.db2.gz ZTLHAKWTCNYICR-YJBOKZPZSA-N 1 1 368.437 2.643 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000157709330 508601174 /nfs/dbraw/zinc/60/11/74/508601174.db2.gz MWBBTOCVUNKOAR-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000122945843 508611753 /nfs/dbraw/zinc/61/17/53/508611753.db2.gz LHOFJONZTILPNW-CQSZACIVSA-N 1 1 362.430 2.989 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCCc3c2cnn3C)cccc1[N+](=O)[O-] ZINC000135563840 508624772 /nfs/dbraw/zinc/62/47/72/508624772.db2.gz JDILXTWDKGCAIT-KRWDZBQOSA-N 1 1 371.441 2.975 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000135575564 508625324 /nfs/dbraw/zinc/62/53/24/508625324.db2.gz OVJZHKYGZZIDNO-QGZVFWFLSA-N 1 1 371.441 2.975 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000135575585 508625816 /nfs/dbraw/zinc/62/58/16/508625816.db2.gz OVJZHKYGZZIDNO-KRWDZBQOSA-N 1 1 371.441 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(c4cnccn4)CC3)o2)cc1 ZINC000157901664 508630037 /nfs/dbraw/zinc/63/00/37/508630037.db2.gz AIHFZVKATRUDQP-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO CO[C@@H]1CC[C@H]2OCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000157977922 508641449 /nfs/dbraw/zinc/64/14/49/508641449.db2.gz AOLZDXUJGLRTSH-KZNAEPCWSA-N 1 1 350.415 2.632 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccccc1F ZINC000118866182 508689198 /nfs/dbraw/zinc/68/91/98/508689198.db2.gz SFMJZUSUQMMZDR-ZDUSSCGKSA-N 1 1 373.388 2.644 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000129183030 508695331 /nfs/dbraw/zinc/69/53/31/508695331.db2.gz JRMUEUOWXNDUTD-JQWIXIFHSA-N 1 1 355.236 2.673 20 5 FFBDMO CCc1nc(CN2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)cs1 ZINC000154459762 508789264 /nfs/dbraw/zinc/78/92/64/508789264.db2.gz YWKRIXSOQWINLO-UHFFFAOYSA-N 1 1 360.483 2.974 20 5 FFBDMO C[N@H+](CCOCc1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000154650913 508827008 /nfs/dbraw/zinc/82/70/08/508827008.db2.gz JFLBFKDJOQYHKT-IBGZPJMESA-N 1 1 369.421 2.849 20 5 FFBDMO C[N@@H+](CCOCc1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000154650913 508827009 /nfs/dbraw/zinc/82/70/09/508827009.db2.gz JFLBFKDJOQYHKT-IBGZPJMESA-N 1 1 369.421 2.849 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1C[C@@H](C)O ZINC000119959210 508897803 /nfs/dbraw/zinc/89/78/03/508897803.db2.gz KWSVXHNLLKJAKJ-HUUCEWRRSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@H]1SCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1ccccc1 ZINC000159834171 508898670 /nfs/dbraw/zinc/89/86/70/508898670.db2.gz ZPMWIUJVEGKWOU-KDOFPFPSSA-N 1 1 359.451 2.935 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000119968114 508900203 /nfs/dbraw/zinc/90/02/03/508900203.db2.gz RABNTDQUBHHAAN-RDJZCZTQSA-N 1 1 369.421 2.610 20 5 FFBDMO O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1 ZINC000155127264 508929858 /nfs/dbraw/zinc/92/98/58/508929858.db2.gz UPTAJQMGKJUIJG-UHFFFAOYSA-N 1 1 369.219 2.669 20 5 FFBDMO C[C@H]1C[C@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102479 508956797 /nfs/dbraw/zinc/95/67/97/508956797.db2.gz XPMHSOLAZYVRFZ-BBRMVZONSA-N 1 1 355.442 2.710 20 5 FFBDMO C[C@H]1C[C@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102479 508956800 /nfs/dbraw/zinc/95/68/00/508956800.db2.gz XPMHSOLAZYVRFZ-BBRMVZONSA-N 1 1 355.442 2.710 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000131802349 508970969 /nfs/dbraw/zinc/97/09/69/508970969.db2.gz ZGDXOVSAERBZHL-MRXNPFEDSA-N 1 1 359.382 2.531 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000120728258 509053289 /nfs/dbraw/zinc/05/32/89/509053289.db2.gz QLJYHESONXMVPU-HOCLYGCPSA-N 1 1 360.458 2.607 20 5 FFBDMO Cc1c([C@@H](C)NC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788169 509083880 /nfs/dbraw/zinc/08/38/80/509083880.db2.gz COTLWQBJUWKGRR-VQIMIIECSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1c([C@@H](C)NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000151788169 509083881 /nfs/dbraw/zinc/08/38/81/509083881.db2.gz COTLWQBJUWKGRR-VQIMIIECSA-N 1 1 369.465 2.973 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1 ZINC000121083230 509124651 /nfs/dbraw/zinc/12/46/51/509124651.db2.gz DSYZUHQUTXZMBY-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[NH+](CC2CC2)CC1 ZINC000126964751 509152871 /nfs/dbraw/zinc/15/28/71/509152871.db2.gz ZKFDQDISHMEJRF-UHFFFAOYSA-N 1 1 357.332 2.781 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[N@H+]1C1CC1 ZINC000182350656 509189619 /nfs/dbraw/zinc/18/96/19/509189619.db2.gz AGTQNNUJVALKDH-ZJUUUORDSA-N 1 1 355.341 2.551 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000247961972 509201015 /nfs/dbraw/zinc/20/10/15/509201015.db2.gz GJEJBNOHHNBZGN-XJKSGUPXSA-N 1 1 351.834 2.733 20 5 FFBDMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266834961 509217735 /nfs/dbraw/zinc/21/77/35/509217735.db2.gz FIKLNUUZERGXDH-OLZOCXBDSA-N 1 1 363.439 2.915 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000162733255 509289457 /nfs/dbraw/zinc/28/94/57/509289457.db2.gz UTALYLCUKGSOAO-KBPBESRZSA-N 1 1 364.446 2.913 20 5 FFBDMO C[C@@H]1CN(C)c2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248474790 509338331 /nfs/dbraw/zinc/33/83/31/509338331.db2.gz XJHJMEHATADSRF-NVXWUHKLSA-N 1 1 371.437 2.675 20 5 FFBDMO CCOC(=O)C[C@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000182625256 509340566 /nfs/dbraw/zinc/34/05/66/509340566.db2.gz MEXGCAPEGOINFN-LBPRGKRZSA-N 1 1 351.403 2.505 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000173000482 509344437 /nfs/dbraw/zinc/34/44/37/509344437.db2.gz RORJQWMVUPVIDL-UHFFFAOYSA-N 1 1 353.422 2.872 20 5 FFBDMO Cc1ccc2[nH+]c(Cn3cc(Br)cc([N+](=O)[O-])c3=O)cn2c1 ZINC000179278822 509353024 /nfs/dbraw/zinc/35/30/24/509353024.db2.gz KNFXHPCPWFZTHN-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CCOc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000176271607 509413630 /nfs/dbraw/zinc/41/36/30/509413630.db2.gz SNWBGQRPRWEWBO-OAHLLOKOSA-N 1 1 351.447 2.646 20 5 FFBDMO C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182821064 509442470 /nfs/dbraw/zinc/44/24/70/509442470.db2.gz OIFKCTLTOJQDGH-HUUCEWRRSA-N 1 1 360.458 2.776 20 5 FFBDMO CC(C)C(=O)N1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000264313664 509452314 /nfs/dbraw/zinc/45/23/14/509452314.db2.gz TWHAVXXNDLNXGI-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000248759282 509473589 /nfs/dbraw/zinc/47/35/89/509473589.db2.gz JFQHYUSZLNYSCH-NVXWUHKLSA-N 1 1 355.394 2.779 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000173258694 509485126 /nfs/dbraw/zinc/48/51/26/509485126.db2.gz RKUJBHQCFCHVGZ-HUUCEWRRSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000248920093 509544844 /nfs/dbraw/zinc/54/48/44/509544844.db2.gz WNDFNMFVYCTQEZ-DNVCBOLYSA-N 1 1 368.437 2.915 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CC[N@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000165725496 509581889 /nfs/dbraw/zinc/58/18/89/509581889.db2.gz DSXQRHVWWVXTQY-JTQLQIEISA-N 1 1 355.236 2.957 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](O)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000179951903 509686067 /nfs/dbraw/zinc/68/60/67/509686067.db2.gz WORNPQPKRAEYJI-QGZVFWFLSA-N 1 1 358.394 2.749 20 5 FFBDMO COCCO[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000189668538 509692414 /nfs/dbraw/zinc/69/24/14/509692414.db2.gz RBKSBJIJZNLIKA-MRXNPFEDSA-N 1 1 361.398 2.530 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186405687 509694066 /nfs/dbraw/zinc/69/40/66/509694066.db2.gz ZPLUNOBSTRSVEQ-GOSISDBHSA-N 1 1 359.382 2.820 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186405687 509694073 /nfs/dbraw/zinc/69/40/73/509694073.db2.gz ZPLUNOBSTRSVEQ-GOSISDBHSA-N 1 1 359.382 2.820 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000173666514 509708962 /nfs/dbraw/zinc/70/89/62/509708962.db2.gz JIIRFWPGFGDVQE-HNNXBMFYSA-N 1 1 369.487 2.652 20 5 FFBDMO COc1ccc(C[N@H+](CCO)Cc2ccc([N+](=O)[O-])cc2C)c(OC)c1 ZINC000183342049 509727059 /nfs/dbraw/zinc/72/70/59/509727059.db2.gz VTVWSVHRDGCFJV-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(C[N@@H+](CCO)Cc2ccc([N+](=O)[O-])cc2C)c(OC)c1 ZINC000183342049 509727062 /nfs/dbraw/zinc/72/70/62/509727062.db2.gz VTVWSVHRDGCFJV-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180095516 509749713 /nfs/dbraw/zinc/74/97/13/509749713.db2.gz TUSHOFXSYZWVLP-SJORKVTESA-N 1 1 370.365 2.678 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180184420 509798200 /nfs/dbraw/zinc/79/82/00/509798200.db2.gz ZWZPPBVFCLROJZ-LPHOPBHVSA-N 1 1 354.410 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(Cn3cncn3)CC2)c1 ZINC000189970545 509859038 /nfs/dbraw/zinc/85/90/38/509859038.db2.gz WWWMBAJAYFVGAO-UHFFFAOYSA-N 1 1 367.356 2.700 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177195619 509930249 /nfs/dbraw/zinc/93/02/49/509930249.db2.gz FYYSZQRVIJMAAW-DGCLKSJQSA-N 1 1 367.833 2.759 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000177208027 509937077 /nfs/dbraw/zinc/93/70/77/509937077.db2.gz NWMUOXNEWGHTPX-DZGCQCFKSA-N 1 1 358.442 2.550 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000255939128 509940288 /nfs/dbraw/zinc/94/02/88/509940288.db2.gz GXJGZLVXXMBGEC-HZPDHXFCSA-N 1 1 374.485 2.855 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCOCC1 ZINC000180708401 510064547 /nfs/dbraw/zinc/06/45/47/510064547.db2.gz BZEBXSAMAFYJNA-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000265458014 510064939 /nfs/dbraw/zinc/06/49/39/510064939.db2.gz YBDLZASEOCJNRL-AWEZNQCLSA-N 1 1 354.410 2.577 20 5 FFBDMO COc1cc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)ncn1 ZINC000184069369 510116260 /nfs/dbraw/zinc/11/62/60/510116260.db2.gz QUAFYMZIEBQEDE-CQSZACIVSA-N 1 1 357.414 2.585 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180848468 510142553 /nfs/dbraw/zinc/14/25/53/510142553.db2.gz LSQILKSERRLOMD-GOEBONIOSA-N 1 1 368.437 2.960 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180848505 510143222 /nfs/dbraw/zinc/14/32/22/510143222.db2.gz LSQILKSERRLOMD-HOCLYGCPSA-N 1 1 368.437 2.960 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000190510277 510175148 /nfs/dbraw/zinc/17/51/48/510175148.db2.gz HTMLEUGEERVMDV-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000190510277 510175157 /nfs/dbraw/zinc/17/51/57/510175157.db2.gz HTMLEUGEERVMDV-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(C[N@@H+]1CCCc2ccccc2C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000171595362 510243503 /nfs/dbraw/zinc/24/35/03/510243503.db2.gz WBKQTXMJTPYWFP-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO O=C(C[N@H+]1CCCc2ccccc2C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000171595362 510243509 /nfs/dbraw/zinc/24/35/09/510243509.db2.gz WBKQTXMJTPYWFP-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000246021976 510255096 /nfs/dbraw/zinc/25/50/96/510255096.db2.gz PEFMUNWZNDACBX-SJLPKXTDSA-N 1 1 357.410 2.521 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000269496533 510435425 /nfs/dbraw/zinc/43/54/25/510435425.db2.gz KISFEUAFEIVELK-SJLPKXTDSA-N 1 1 372.469 2.796 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374419 510453876 /nfs/dbraw/zinc/45/38/76/510453876.db2.gz MCOLVTOKXHLXRB-ZIAGYGMSSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374419 510453879 /nfs/dbraw/zinc/45/38/79/510453879.db2.gz MCOLVTOKXHLXRB-ZIAGYGMSSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000246374419 510453884 /nfs/dbraw/zinc/45/38/84/510453884.db2.gz MCOLVTOKXHLXRB-ZIAGYGMSSA-N 1 1 363.462 2.607 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178142263 510454207 /nfs/dbraw/zinc/45/42/07/510454207.db2.gz MHKGWQAODARLPG-AWEZNQCLSA-N 1 1 361.442 2.874 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000175212126 510534821 /nfs/dbraw/zinc/53/48/21/510534821.db2.gz JDRPLTSESJJQDO-CQSZACIVSA-N 1 1 371.441 2.911 20 5 FFBDMO O=c1cc(C[N@@H+]2CCC[C@@H](OCCO)C2)c2c(ccc3ccccc32)o1 ZINC000172302444 510656906 /nfs/dbraw/zinc/65/69/06/510656906.db2.gz RFTJKGWVKPVCTG-QGZVFWFLSA-N 1 1 353.418 2.920 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](CCO)c1ccccc1 ZINC000266627512 510696266 /nfs/dbraw/zinc/69/62/66/510696266.db2.gz OIEGHTSRJDDXBF-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC000266627512 510696271 /nfs/dbraw/zinc/69/62/71/510696271.db2.gz OIEGHTSRJDDXBF-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)c(Cl)c1 ZINC000182200709 510810702 /nfs/dbraw/zinc/81/07/02/510810702.db2.gz VJEFNLRLUHKIGP-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)c(Cl)c1 ZINC000182200709 510810709 /nfs/dbraw/zinc/81/07/09/510810709.db2.gz VJEFNLRLUHKIGP-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCCC[C@H]2C[NH+]2CCOCC2)c(Cl)c1 ZINC000182200709 510810719 /nfs/dbraw/zinc/81/07/19/510810719.db2.gz VJEFNLRLUHKIGP-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000182256909 510836391 /nfs/dbraw/zinc/83/63/91/510836391.db2.gz GRFBJVCAVVYTKR-OAHLLOKOSA-N 1 1 359.382 2.820 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000182256909 510836395 /nfs/dbraw/zinc/83/63/95/510836395.db2.gz GRFBJVCAVVYTKR-OAHLLOKOSA-N 1 1 359.382 2.820 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247302989 510856191 /nfs/dbraw/zinc/85/61/91/510856191.db2.gz VDCCLMSEVGPAFL-YOEHRIQHSA-N 1 1 364.446 2.853 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247334925 510857546 /nfs/dbraw/zinc/85/75/46/510857546.db2.gz VSMYRLNAXWWUJV-GJZGRUSLSA-N 1 1 371.441 2.610 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000360306299 510895686 /nfs/dbraw/zinc/89/56/86/510895686.db2.gz WHCSOSOKLCHQHU-CQSZACIVSA-N 1 1 357.414 2.537 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC=C(c3ccnn3C)CC2)cccc1[N+](=O)[O-] ZINC000285546417 510949785 /nfs/dbraw/zinc/94/97/85/510949785.db2.gz IMVVBSBVXCKQQY-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n1 ZINC000285651500 510994947 /nfs/dbraw/zinc/99/49/47/510994947.db2.gz MIQCLRLJRGLHOC-AWEZNQCLSA-N 1 1 363.349 2.591 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n1 ZINC000285651500 510994951 /nfs/dbraw/zinc/99/49/51/510994951.db2.gz MIQCLRLJRGLHOC-AWEZNQCLSA-N 1 1 363.349 2.591 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000278812339 511007447 /nfs/dbraw/zinc/00/74/47/511007447.db2.gz HMJLMQBJLYXBBZ-INIZCTEOSA-N 1 1 363.458 2.549 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000285687714 511011328 /nfs/dbraw/zinc/01/13/28/511011328.db2.gz OGRQRERTTLMMQU-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000285687714 511011334 /nfs/dbraw/zinc/01/13/34/511011334.db2.gz OGRQRERTTLMMQU-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000279381560 511063204 /nfs/dbraw/zinc/06/32/04/511063204.db2.gz VAFJGJCBGCYDKB-MWLCHTKSSA-N 1 1 355.797 2.671 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H]2CCCC[C@H]21 ZINC000297802762 511072708 /nfs/dbraw/zinc/07/27/08/511072708.db2.gz HYUZMUFZFQQSIT-HZPDHXFCSA-N 1 1 363.414 2.575 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000279408194 511072905 /nfs/dbraw/zinc/07/29/05/511072905.db2.gz XBLXCHDOPRWBKL-JQWIXIFHSA-N 1 1 357.813 2.871 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000361654163 511076106 /nfs/dbraw/zinc/07/61/06/511076106.db2.gz YRPNHRFSAUARRF-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000294595593 511115273 /nfs/dbraw/zinc/11/52/73/511115273.db2.gz WCBXZERUVGIBIV-GFCCVEGCSA-N 1 1 368.397 2.556 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000365006288 511203025 /nfs/dbraw/zinc/20/30/25/511203025.db2.gz VTTWMPAVRRAUPO-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1Cc2c([nH+]cn2CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@@H]1C ZINC000295109398 511285302 /nfs/dbraw/zinc/28/53/02/511285302.db2.gz HJQYWLPNPBMZLR-WDEREUQCSA-N 1 1 372.381 2.530 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000295125902 511291249 /nfs/dbraw/zinc/29/12/49/511291249.db2.gz JHQUXAABRJURKX-JTQLQIEISA-N 1 1 362.373 2.839 20 5 FFBDMO COCc1cccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271790043 511325619 /nfs/dbraw/zinc/32/56/19/511325619.db2.gz ULMHFOJUKMUKQH-AWEZNQCLSA-N 1 1 357.410 2.708 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)Nc1c[nH+]ccc1-n1cc(C)cn1 ZINC000365239061 511336378 /nfs/dbraw/zinc/33/63/78/511336378.db2.gz CVYYRDKEOGNRRR-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363099660 511351900 /nfs/dbraw/zinc/35/19/00/511351900.db2.gz WUANTXJMKLOOLW-WDEREUQCSA-N 1 1 370.356 2.945 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000298708173 511383061 /nfs/dbraw/zinc/38/30/61/511383061.db2.gz JXSRSMNGVKJSNA-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000291908886 511386638 /nfs/dbraw/zinc/38/66/38/511386638.db2.gz RQUXHPOWPDIOTI-LJQANCHMSA-N 1 1 360.385 2.879 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000291908886 511386643 /nfs/dbraw/zinc/38/66/43/511386643.db2.gz RQUXHPOWPDIOTI-LJQANCHMSA-N 1 1 360.385 2.879 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCC[C@@](C)(OC)CC1 ZINC000280250676 511392395 /nfs/dbraw/zinc/39/23/95/511392395.db2.gz BMGCQFQEQHZNGD-SCLBCKFNSA-N 1 1 365.430 2.821 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000292026531 511436332 /nfs/dbraw/zinc/43/63/32/511436332.db2.gz YQSDMCYUZVXMOC-DOMZBBRYSA-N 1 1 354.370 2.849 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](n2cccn2)C1 ZINC000292026531 511436335 /nfs/dbraw/zinc/43/63/35/511436335.db2.gz YQSDMCYUZVXMOC-DOMZBBRYSA-N 1 1 354.370 2.849 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000272123830 511439098 /nfs/dbraw/zinc/43/90/98/511439098.db2.gz TWDRVQOSRLTKMN-CYBMUJFWSA-N 1 1 353.325 2.699 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000295667278 511475782 /nfs/dbraw/zinc/47/57/82/511475782.db2.gz IVHDXAQAGNVRTL-CQSZACIVSA-N 1 1 361.442 2.939 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272252922 511480722 /nfs/dbraw/zinc/48/07/22/511480722.db2.gz YQIONMZJXYOSSF-UHFFFAOYSA-N 1 1 365.821 2.685 20 5 FFBDMO COc1cc(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000292155554 511486695 /nfs/dbraw/zinc/48/66/95/511486695.db2.gz OBAZBELCPVDBLW-KRWDZBQOSA-N 1 1 371.384 2.732 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000365625967 511566856 /nfs/dbraw/zinc/56/68/56/511566856.db2.gz IUUOGPVIVOMLBV-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C2CC2)O1 ZINC000280743841 511584823 /nfs/dbraw/zinc/58/48/23/511584823.db2.gz ZYYAGUAIMYYLQU-ACJLOTCBSA-N 1 1 356.426 2.995 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C2CC2)O1 ZINC000280743841 511584827 /nfs/dbraw/zinc/58/48/27/511584827.db2.gz ZYYAGUAIMYYLQU-ACJLOTCBSA-N 1 1 356.426 2.995 20 5 FFBDMO CCn1cc([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000296056248 511604392 /nfs/dbraw/zinc/60/43/92/511604392.db2.gz NVOZWUXSNWUATM-JTQLQIEISA-N 1 1 351.794 2.754 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000296148014 511634294 /nfs/dbraw/zinc/63/42/94/511634294.db2.gz TVFCAWHLLIKOBO-MRXNPFEDSA-N 1 1 365.430 2.679 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000296215928 511659464 /nfs/dbraw/zinc/65/94/64/511659464.db2.gz CXJXRUGELZTOEC-DOTOQJQBSA-N 1 1 359.426 2.500 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCOCC2)[C@@H]1C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000296220217 511661952 /nfs/dbraw/zinc/66/19/52/511661952.db2.gz PGBYOOGHEAGDOJ-SFHVURJKSA-N 1 1 359.426 2.814 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000296238026 511666426 /nfs/dbraw/zinc/66/64/26/511666426.db2.gz WXGJLJIRLCNSLY-ZDUSSCGKSA-N 1 1 353.394 2.545 20 5 FFBDMO CCOC(=O)[C@H](C)[C@H](C)[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000273966706 511672500 /nfs/dbraw/zinc/67/25/00/511672500.db2.gz HCXQCTZMZLWEHU-GRYCIOLGSA-N 1 1 362.386 2.883 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)c1 ZINC000365841942 511681123 /nfs/dbraw/zinc/68/11/23/511681123.db2.gz PAZKGTREQWRUQX-LEWJYISDSA-N 1 1 370.449 2.945 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)C1 ZINC000292883174 511757541 /nfs/dbraw/zinc/75/75/41/511757541.db2.gz FEGAFLSFWOHIEW-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO C[C@]12CCC[N@@H+]1C[C@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342992 511783635 /nfs/dbraw/zinc/78/36/35/511783635.db2.gz UVKGUDRFWJICFR-RHSMWYFYSA-N 1 1 359.386 2.516 20 5 FFBDMO C[C@]12CCC[N@H+]1C[C@H](c1noc(CNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350342992 511783641 /nfs/dbraw/zinc/78/36/41/511783641.db2.gz UVKGUDRFWJICFR-RHSMWYFYSA-N 1 1 359.386 2.516 20 5 FFBDMO CC(C)[N@@H+](CCOCCO)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000314614545 511796195 /nfs/dbraw/zinc/79/61/95/511796195.db2.gz YZDVHXHGIAFJAW-UHFFFAOYSA-N 1 1 361.236 2.577 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000293050379 511821547 /nfs/dbraw/zinc/82/15/47/511821547.db2.gz MVHYZPUFRIPHEM-LJQANCHMSA-N 1 1 363.458 2.962 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281684104 511930587 /nfs/dbraw/zinc/93/05/87/511930587.db2.gz UWMRWOAGMMUZLY-UHFFFAOYSA-N 1 1 360.414 2.774 20 5 FFBDMO Cc1nc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cs1 ZINC000274823201 511954436 /nfs/dbraw/zinc/95/44/36/511954436.db2.gz KJAFXHCNPQIPDA-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO Cc1nc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)cs1 ZINC000274823201 511954444 /nfs/dbraw/zinc/95/44/44/511954444.db2.gz KJAFXHCNPQIPDA-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO CS(=O)(=O)CC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000366441814 512026354 /nfs/dbraw/zinc/02/63/54/512026354.db2.gz OXIJPFPFARGWIW-OAHLLOKOSA-N 1 1 370.471 2.653 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000366554537 512083496 /nfs/dbraw/zinc/08/34/96/512083496.db2.gz MKQFGPKQPIZPPK-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000366554537 512083499 /nfs/dbraw/zinc/08/34/99/512083499.db2.gz MKQFGPKQPIZPPK-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375745822 512482470 /nfs/dbraw/zinc/48/24/70/512482470.db2.gz RISWVLBNUKPAGD-CPTIBSQESA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375745822 512482477 /nfs/dbraw/zinc/48/24/77/512482477.db2.gz RISWVLBNUKPAGD-CPTIBSQESA-N 1 1 365.817 2.542 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CC2 ZINC000378510390 512798714 /nfs/dbraw/zinc/79/87/14/512798714.db2.gz FTAQYMLCCHEOLZ-UHFFFAOYSA-N 1 1 358.442 2.870 20 5 FFBDMO COc1cc(C(=O)N2CCC(n3c[nH+]cc3C)CC2)c([N+](=O)[O-])cc1OC ZINC000372303749 512805551 /nfs/dbraw/zinc/80/55/51/512805551.db2.gz ZSPZRCLBBIKORY-UHFFFAOYSA-N 1 1 374.397 2.594 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](CCC(=O)OC(C)(C)C)C1 ZINC000412060495 512937593 /nfs/dbraw/zinc/93/75/93/512937593.db2.gz FTJAGAJPCNQSNA-CYBMUJFWSA-N 1 1 352.435 2.662 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](CCC(=O)OC(C)(C)C)C1 ZINC000412060495 512937595 /nfs/dbraw/zinc/93/75/95/512937595.db2.gz FTJAGAJPCNQSNA-CYBMUJFWSA-N 1 1 352.435 2.662 20 5 FFBDMO CCOc1cc(C[N@@H+](C)C(C)(C)CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000412096103 512959757 /nfs/dbraw/zinc/95/97/57/512959757.db2.gz MMOQFQJJCZLJPF-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)n1 ZINC000374749730 512984258 /nfs/dbraw/zinc/98/42/58/512984258.db2.gz KZCNYRGZHUITPP-UHFFFAOYSA-N 1 1 374.397 2.706 20 5 FFBDMO C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374797698 513009400 /nfs/dbraw/zinc/00/94/00/513009400.db2.gz FUSIWKIWWUYVAW-HOCLYGCPSA-N 1 1 368.437 2.817 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000372810110 513053898 /nfs/dbraw/zinc/05/38/98/513053898.db2.gz NIZGUZCUQBUEIL-SJLPKXTDSA-N 1 1 374.441 2.815 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H](C)[NH+]1CCOCC1 ZINC000450314000 513138033 /nfs/dbraw/zinc/13/80/33/513138033.db2.gz SPHICFDTXLEGPV-STQMWFEESA-N 1 1 362.455 2.661 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000428802417 513195910 /nfs/dbraw/zinc/19/59/10/513195910.db2.gz JJVSLDQKQIBDKN-HXUWFJFHSA-N 1 1 370.405 2.790 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000428811578 513197983 /nfs/dbraw/zinc/19/79/83/513197983.db2.gz JOUFLYILCDWNMP-HXUWFJFHSA-N 1 1 370.405 2.790 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000428820952 513201418 /nfs/dbraw/zinc/20/14/18/513201418.db2.gz VVDNTLSKZZOEHF-FQEVSTJZSA-N 1 1 370.405 2.920 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H](C)[N@@H+](CC)C[C@H]1C ZINC000439888178 513203981 /nfs/dbraw/zinc/20/39/81/513203981.db2.gz NBDQLZCZLAPOSL-CHWSQXEVSA-N 1 1 350.419 2.940 20 5 FFBDMO C[N@@H+](CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569718 513254826 /nfs/dbraw/zinc/25/48/26/513254826.db2.gz OKIHSCKEXFDHCU-QGZVFWFLSA-N 1 1 355.442 2.608 20 5 FFBDMO CN(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569718 513254830 /nfs/dbraw/zinc/25/48/30/513254830.db2.gz OKIHSCKEXFDHCU-QGZVFWFLSA-N 1 1 355.442 2.608 20 5 FFBDMO CN(CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569718 513254832 /nfs/dbraw/zinc/25/48/32/513254832.db2.gz OKIHSCKEXFDHCU-QGZVFWFLSA-N 1 1 355.442 2.608 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000434445804 513324892 /nfs/dbraw/zinc/32/48/92/513324892.db2.gz QELGHFFAGWEHSW-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCCN(c3cc[nH+]c(N4CCOCC4)n3)C2)cc1 ZINC000450757749 513327340 /nfs/dbraw/zinc/32/73/40/513327340.db2.gz LGVPVXQGJBBNDR-MRXNPFEDSA-N 1 1 369.425 2.605 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C[N@H+]1CCO ZINC000418107569 513375009 /nfs/dbraw/zinc/37/50/09/513375009.db2.gz FBFUFFIGPUELSM-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1CCO ZINC000418107569 513375014 /nfs/dbraw/zinc/37/50/14/513375014.db2.gz FBFUFFIGPUELSM-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1CCO ZINC000418107569 513375020 /nfs/dbraw/zinc/37/50/20/513375020.db2.gz FBFUFFIGPUELSM-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421710622 513382733 /nfs/dbraw/zinc/38/27/33/513382733.db2.gz LMVCZJSKUSQYQD-LBPRGKRZSA-N 1 1 357.863 2.893 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c1C ZINC000434777475 513427372 /nfs/dbraw/zinc/42/73/72/513427372.db2.gz UPIMJSYEOBIEOO-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1C ZINC000434777475 513427381 /nfs/dbraw/zinc/42/73/81/513427381.db2.gz UPIMJSYEOBIEOO-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccncc1Cl ZINC000421844708 513450700 /nfs/dbraw/zinc/45/07/00/513450700.db2.gz UIGGOSPRWLTYJM-NSHDSACASA-N 1 1 369.830 2.768 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(-c4cc[nH]n4)o3)CC2)c1 ZINC000435134808 513519716 /nfs/dbraw/zinc/51/97/16/513519716.db2.gz JXALDDBVWFNWMF-UHFFFAOYSA-N 1 1 353.382 2.900 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000447981090 513645904 /nfs/dbraw/zinc/64/59/04/513645904.db2.gz XWYXTDPTVKMKRP-MRXNPFEDSA-N 1 1 364.446 2.523 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000413437359 513656152 /nfs/dbraw/zinc/65/61/52/513656152.db2.gz KFVRMMCHHNMIED-AWEZNQCLSA-N 1 1 371.441 2.703 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451342293 513687803 /nfs/dbraw/zinc/68/78/03/513687803.db2.gz MKJQLUNJDGLUNP-CGTJXYLNSA-N 1 1 361.442 2.857 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000419005206 513714638 /nfs/dbraw/zinc/71/46/38/513714638.db2.gz RSRXEUPNVUIGBN-QWHCGFSZSA-N 1 1 362.455 2.610 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000419005214 513714742 /nfs/dbraw/zinc/71/47/42/513714742.db2.gz RSRXEUPNVUIGBN-STQMWFEESA-N 1 1 362.455 2.610 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000430662863 513714957 /nfs/dbraw/zinc/71/49/57/513714957.db2.gz KSFDTVUAOZOSFK-HOCLYGCPSA-N 1 1 356.426 2.716 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCSC[C@@H]2C2CCC2)c1 ZINC000419363170 513789156 /nfs/dbraw/zinc/78/91/56/513789156.db2.gz OPPSIOBOAPLGPR-NVXWUHKLSA-N 1 1 352.456 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)cc1 ZINC000436255104 513808095 /nfs/dbraw/zinc/80/80/95/513808095.db2.gz WXMRYBDXKNCPHN-RTWAWAEBSA-N 1 1 367.449 2.723 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)c1 ZINC000436261183 513810613 /nfs/dbraw/zinc/81/06/13/513810613.db2.gz PAFMUYDHJDROHP-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)c1 ZINC000436261183 513810621 /nfs/dbraw/zinc/81/06/21/513810621.db2.gz PAFMUYDHJDROHP-UXHICEINSA-N 1 1 353.422 2.680 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000426193913 513867924 /nfs/dbraw/zinc/86/79/24/513867924.db2.gz KTXVNCIJQLJHBU-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])cc1OC(F)F ZINC000426202919 513871096 /nfs/dbraw/zinc/87/10/96/513871096.db2.gz HZOIYLCXIKTSET-DGCLKSJQSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000448776250 513893487 /nfs/dbraw/zinc/89/34/87/513893487.db2.gz FJYYAWPFWIKJLF-GFCCVEGCSA-N 1 1 367.421 2.983 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000451690947 513911869 /nfs/dbraw/zinc/91/18/69/513911869.db2.gz ARPFUZJBYWCGBP-FZKCQIBNSA-N 1 1 361.442 2.713 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](CO)CC(C)(C)C)cccc1[N+](=O)[O-] ZINC000451783589 513978488 /nfs/dbraw/zinc/97/84/88/513978488.db2.gz SBNZDSWSMCFBPC-AWEZNQCLSA-N 1 1 351.447 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420344289 514101785 /nfs/dbraw/zinc/10/17/85/514101785.db2.gz SNZJELLNLMEZPY-HRCADAONSA-N 1 1 360.458 2.552 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1)CCC(F)(F)F ZINC000427209975 514151388 /nfs/dbraw/zinc/15/13/88/514151388.db2.gz AQBANWSJTWVRBV-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NCCC[N@H+]1CCc2ccccc2C1 ZINC000420582094 514192305 /nfs/dbraw/zinc/19/23/05/514192305.db2.gz GYHHXEIZKFEXOZ-UHFFFAOYSA-N 1 1 354.410 2.554 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452103054 514193537 /nfs/dbraw/zinc/19/35/37/514193537.db2.gz LNQZBUWIXQCGLJ-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO COC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452106475 514195288 /nfs/dbraw/zinc/19/52/88/514195288.db2.gz QQXQKQVOUZDKGK-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346338 514199972 /nfs/dbraw/zinc/19/99/72/514199972.db2.gz UZUWWNDFQXUMFA-KGLIPLIRSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346338 514199976 /nfs/dbraw/zinc/19/99/76/514199976.db2.gz UZUWWNDFQXUMFA-KGLIPLIRSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346338 514199978 /nfs/dbraw/zinc/19/99/78/514199978.db2.gz UZUWWNDFQXUMFA-KGLIPLIRSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000444346338 514199980 /nfs/dbraw/zinc/19/99/80/514199980.db2.gz UZUWWNDFQXUMFA-KGLIPLIRSA-N 1 1 371.441 2.615 20 5 FFBDMO COC(=O)c1cc([C@@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)oc1C ZINC000432778556 514282404 /nfs/dbraw/zinc/28/24/04/514282404.db2.gz DXXKEQGTZTXPPL-DGCLKSJQSA-N 1 1 374.397 2.925 20 5 FFBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c(c1)NC(=O)CO2 ZINC000444679310 514290714 /nfs/dbraw/zinc/29/07/14/514290714.db2.gz AHVVOOJLFJXCMR-JTQLQIEISA-N 1 1 367.365 2.653 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000427920873 514346481 /nfs/dbraw/zinc/34/64/81/514346481.db2.gz CPAWIFNCWCJKIO-UHFFFAOYSA-N 1 1 373.384 2.834 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@@H](O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000433073326 514371562 /nfs/dbraw/zinc/37/15/62/514371562.db2.gz FPXFFHUFYWYMKA-INIZCTEOSA-N 1 1 360.410 2.518 20 5 FFBDMO CC(C)c1ccc(CNC[C@H](N2CC[NH2+]CC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000414986640 514388798 /nfs/dbraw/zinc/38/87/98/514388798.db2.gz NWRHHNIQYOMOMO-INIZCTEOSA-N 1 1 374.407 2.644 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000420949383 514397517 /nfs/dbraw/zinc/39/75/17/514397517.db2.gz VLRCYHXPXMLUKI-NEPJUHHUSA-N 1 1 374.384 2.698 20 5 FFBDMO CC[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@H](CC)O1 ZINC000420960568 514403326 /nfs/dbraw/zinc/40/33/26/514403326.db2.gz RNXBTMAZWMOXNH-GASCZTMLSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H](C3CCCC3)C2)cc1 ZINC000420967666 514408265 /nfs/dbraw/zinc/40/82/65/514408265.db2.gz YXSNUKLYLNKJSQ-HNNXBMFYSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H](C3CCCC3)C2)cc1 ZINC000420967666 514408271 /nfs/dbraw/zinc/40/82/71/514408271.db2.gz YXSNUKLYLNKJSQ-HNNXBMFYSA-N 1 1 352.456 2.881 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000449933415 514430427 /nfs/dbraw/zinc/43/04/27/514430427.db2.gz AVMPITURWKWDAO-UHFFFAOYSA-N 1 1 358.398 2.659 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](O)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004362 514432269 /nfs/dbraw/zinc/43/22/69/514432269.db2.gz FSONQMKBAIZYGX-JQWIXIFHSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](O)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004362 514432277 /nfs/dbraw/zinc/43/22/77/514432277.db2.gz FSONQMKBAIZYGX-JQWIXIFHSA-N 1 1 360.357 2.593 20 5 FFBDMO CC[N@H+](Cc1ccc2ccccc2c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000438834952 514451387 /nfs/dbraw/zinc/45/13/87/514451387.db2.gz LHNPKALKALQQMH-IBGZPJMESA-N 1 1 354.410 2.828 20 5 FFBDMO [NH3+]C1(CNCc2csc([N+](=O)[O-])c2)CCN(Cc2ccccc2)CC1 ZINC000415139949 514465259 /nfs/dbraw/zinc/46/52/59/514465259.db2.gz YBYXERHEXVRFPU-UHFFFAOYSA-N 1 1 360.483 2.739 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000445574999 514495219 /nfs/dbraw/zinc/49/52/19/514495219.db2.gz NZMYZXSUBKTQDT-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000439474916 514560891 /nfs/dbraw/zinc/56/08/91/514560891.db2.gz XVLOCNLZUAEBPU-RDTXWAMCSA-N 1 1 350.415 2.948 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000466158208 514566693 /nfs/dbraw/zinc/56/66/93/514566693.db2.gz PQQQTCWKUBGUGK-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCn4c[nH+]cc4C3)n2)c2c1NCCC2 ZINC000453233590 514575064 /nfs/dbraw/zinc/57/50/64/514575064.db2.gz HVKWCQOFXGYGNI-LLVKDONJSA-N 1 1 366.381 2.929 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000466222074 514582005 /nfs/dbraw/zinc/58/20/05/514582005.db2.gz GBOPXCMKXKDAAD-GJZGRUSLSA-N 1 1 352.822 2.674 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470808051 514619782 /nfs/dbraw/zinc/61/97/82/514619782.db2.gz KWMKFCIGLYPKMN-PMPSAXMXSA-N 1 1 373.432 2.990 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000475568976 514718577 /nfs/dbraw/zinc/71/85/77/514718577.db2.gz WJYPLKXBNBQSTR-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000475578725 514720647 /nfs/dbraw/zinc/72/06/47/514720647.db2.gz CFCYWCHQTVAGTI-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000475578725 514720649 /nfs/dbraw/zinc/72/06/49/514720649.db2.gz CFCYWCHQTVAGTI-UHFFFAOYSA-N 1 1 356.378 2.705 20 5 FFBDMO Cc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461958195 514805971 /nfs/dbraw/zinc/80/59/71/514805971.db2.gz QLLJVJFGRFEYDF-UHFFFAOYSA-N 1 1 355.320 2.972 20 5 FFBDMO Cc1c(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000480070907 514831770 /nfs/dbraw/zinc/83/17/70/514831770.db2.gz IOPISRBDTALRRX-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502893770 514833049 /nfs/dbraw/zinc/83/30/49/514833049.db2.gz IVECDHZGRCFBPK-OAHLLOKOSA-N 1 1 359.430 2.921 20 5 FFBDMO C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCCC[C@H]1C ZINC000498472637 514918900 /nfs/dbraw/zinc/91/89/00/514918900.db2.gz LCVDQMPWFRYJEE-HUUCEWRRSA-N 1 1 358.442 2.929 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000467217807 514942556 /nfs/dbraw/zinc/94/25/56/514942556.db2.gz OOCBKCMOQGXVQZ-OLZOCXBDSA-N 1 1 352.822 2.674 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC[N@H+]1C ZINC000462480374 515076009 /nfs/dbraw/zinc/07/60/09/515076009.db2.gz LUIANQHGYDWVFD-HOCLYGCPSA-N 1 1 356.426 2.885 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2ccnc(N(C)C)n2)CC1 ZINC000490035499 515077384 /nfs/dbraw/zinc/07/73/84/515077384.db2.gz CSDDXUVKHXMCKN-OAHLLOKOSA-N 1 1 370.457 2.642 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)c1cc(C[NH+]2CCCC2)on1 ZINC000462506878 515094140 /nfs/dbraw/zinc/09/41/40/515094140.db2.gz XCPKDBYVPWNZTR-UHFFFAOYSA-N 1 1 364.789 2.762 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000481008996 515170531 /nfs/dbraw/zinc/17/05/31/515170531.db2.gz FRIGKNOAGPTEJA-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000481039717 515183323 /nfs/dbraw/zinc/18/33/23/515183323.db2.gz OBDLGICHQJMMJN-CABCVRRESA-N 1 1 369.487 2.753 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C[C@@H]1C ZINC000481057240 515190174 /nfs/dbraw/zinc/19/01/74/515190174.db2.gz KGXDYLUPCCJQCX-LSDHHAIUSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467391 515191041 /nfs/dbraw/zinc/19/10/41/515191041.db2.gz XAHDSFGYPUHULR-CCKFTAQKSA-N 1 1 369.421 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000509467391 515191050 /nfs/dbraw/zinc/19/10/50/515191050.db2.gz XAHDSFGYPUHULR-CCKFTAQKSA-N 1 1 369.421 2.896 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000472325698 515225575 /nfs/dbraw/zinc/22/55/75/515225575.db2.gz LFVDMJHCAFZGLY-SFHVURJKSA-N 1 1 371.437 2.773 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(c3ccc([N+](=O)[O-])c(OCc4ccccc4)n3)C[C@H]2C1 ZINC000485997865 515291207 /nfs/dbraw/zinc/29/12/07/515291207.db2.gz DIDQVOWDWSKSOD-IYBDPMFKSA-N 1 1 354.410 2.567 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000468695378 515474771 /nfs/dbraw/zinc/47/47/71/515474771.db2.gz SFIGHURGNOPWPS-ZFWWWQNUSA-N 1 1 354.410 2.742 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000486432416 515481453 /nfs/dbraw/zinc/48/14/53/515481453.db2.gz YMPWEQWAMFSYPK-NWDGAFQWSA-N 1 1 355.385 2.747 20 5 FFBDMO COCC[N@@H+]1CC[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146111 515506117 /nfs/dbraw/zinc/50/61/17/515506117.db2.gz YCINQAZKALPDKW-ICSRJNTNSA-N 1 1 355.438 2.995 20 5 FFBDMO COCC[N@H+]1CC[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146111 515506127 /nfs/dbraw/zinc/50/61/27/515506127.db2.gz YCINQAZKALPDKW-ICSRJNTNSA-N 1 1 355.438 2.995 20 5 FFBDMO O=C([C@@H]1CCCc2[nH+]ccn21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000486490726 515506756 /nfs/dbraw/zinc/50/67/56/515506756.db2.gz UJIOLSXJVPIWCM-WMLDXEAASA-N 1 1 358.423 2.943 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000486512979 515519290 /nfs/dbraw/zinc/51/92/90/515519290.db2.gz KUFIYNMNKGOOTF-SFHVURJKSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCC[NH+]3CCC3)cc2[N+](=O)[O-])C1 ZINC000505424863 515530289 /nfs/dbraw/zinc/53/02/89/515530289.db2.gz HGRBCHUAHVUIFG-HUUCEWRRSA-N 1 1 360.458 2.513 20 5 FFBDMO CCOc1cc(C[N@@H+](CCC(N)=O)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492652971 515550865 /nfs/dbraw/zinc/55/08/65/515550865.db2.gz LJVDLFKEQOHOIU-UHFFFAOYSA-N 1 1 357.410 2.871 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000500121232 515598492 /nfs/dbraw/zinc/59/84/92/515598492.db2.gz KVPOXMUTUFQLGJ-KGLIPLIRSA-N 1 1 371.441 2.550 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@H]21 ZINC000493507335 515638815 /nfs/dbraw/zinc/63/88/15/515638815.db2.gz UQEMXWJKXGWXAU-SLEUVZQESA-N 1 1 367.833 2.568 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457116058 515661837 /nfs/dbraw/zinc/66/18/37/515661837.db2.gz LERVPYZZXYSYLH-JSGCOSHPSA-N 1 1 369.849 2.957 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc1Cl ZINC000478047757 515682638 /nfs/dbraw/zinc/68/26/38/515682638.db2.gz OGYBUBXUVCGAKB-UHFFFAOYSA-N 1 1 350.762 2.663 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)[NH+]1CCOCC1 ZINC000511032021 515751238 /nfs/dbraw/zinc/75/12/38/515751238.db2.gz RMUUCJJOZJWZHN-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO COC(=O)c1cnc(NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000478285647 515766668 /nfs/dbraw/zinc/76/66/68/515766668.db2.gz WKKVIKLDOVXNGK-BETUJISGSA-N 1 1 350.419 2.556 20 5 FFBDMO COc1ccccc1CNC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511089773 515775264 /nfs/dbraw/zinc/77/52/64/515775264.db2.gz HGYKGVUZTFOJRF-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO COc1ccccc1CNC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511089773 515775271 /nfs/dbraw/zinc/77/52/71/515775271.db2.gz HGYKGVUZTFOJRF-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO Cc1cc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])n(C(C)(C)C)n1 ZINC000511104827 515780823 /nfs/dbraw/zinc/78/08/23/515780823.db2.gz GKJMIQXEFJSIND-UHFFFAOYSA-N 1 1 373.457 2.968 20 5 FFBDMO Cc1cc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])n(C(C)(C)C)n1 ZINC000511104827 515780835 /nfs/dbraw/zinc/78/08/35/515780835.db2.gz GKJMIQXEFJSIND-UHFFFAOYSA-N 1 1 373.457 2.968 20 5 FFBDMO O=C(Nc1ccccc1)[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000478421274 515816434 /nfs/dbraw/zinc/81/64/34/515816434.db2.gz ZOSGICWUQGKBQB-GOSISDBHSA-N 1 1 365.393 2.761 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1OC)[NH+](C)C ZINC000474190511 515926853 /nfs/dbraw/zinc/92/68/53/515926853.db2.gz OCRBHGUDCXISLA-INIZCTEOSA-N 1 1 373.409 2.645 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000483115961 515936388 /nfs/dbraw/zinc/93/63/88/515936388.db2.gz DMXIYHUAFHIBFI-MAUKXSAKSA-N 1 1 360.385 2.963 20 5 FFBDMO CCCN(CC[NH+]1CCCCCC1)C(=O)c1n[nH]c(CC)c1[N+](=O)[O-] ZINC000494843888 515979639 /nfs/dbraw/zinc/97/96/39/515979639.db2.gz CDTDHMGOWVCYIQ-UHFFFAOYSA-N 1 1 351.451 2.609 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853994 515989016 /nfs/dbraw/zinc/98/90/16/515989016.db2.gz PEPATMYMOLUVQB-RISCZKNCSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853994 515989026 /nfs/dbraw/zinc/98/90/26/515989026.db2.gz PEPATMYMOLUVQB-RISCZKNCSA-N 1 1 353.806 2.688 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3nc4cc(F)ccc4o3)C2)nc1 ZINC000464890309 516007482 /nfs/dbraw/zinc/00/74/82/516007482.db2.gz WXCUCJGOOUJFNR-GFCCVEGCSA-N 1 1 357.345 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3nc4cc(F)ccc4o3)C2)nc1 ZINC000464890309 516007491 /nfs/dbraw/zinc/00/74/91/516007491.db2.gz WXCUCJGOOUJFNR-GFCCVEGCSA-N 1 1 357.345 2.957 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000470007121 516077281 /nfs/dbraw/zinc/07/72/81/516077281.db2.gz ARRMNEODRJVJJM-ONGXEEELSA-N 1 1 374.340 2.588 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@H]1C ZINC000470007121 516077291 /nfs/dbraw/zinc/07/72/91/516077291.db2.gz ARRMNEODRJVJJM-ONGXEEELSA-N 1 1 374.340 2.588 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000460284495 516101101 /nfs/dbraw/zinc/10/11/01/516101101.db2.gz QMMSQBNLMMLPPN-INIZCTEOSA-N 1 1 356.430 2.546 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000483701147 516178258 /nfs/dbraw/zinc/17/82/58/516178258.db2.gz LVYKUQAMVXBMSM-DZGCQCFKSA-N 1 1 364.446 2.618 20 5 FFBDMO COc1c(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000474777981 516191519 /nfs/dbraw/zinc/19/15/19/516191519.db2.gz YJOXUTMQZHEPFS-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO CC(C)[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000488509595 516246737 /nfs/dbraw/zinc/24/67/37/516246737.db2.gz ASZNVEBMPLQYEM-SFHVURJKSA-N 1 1 357.458 2.767 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000502185489 516316957 /nfs/dbraw/zinc/31/69/57/516316957.db2.gz HYTBDKGUEUUZFT-AWEZNQCLSA-N 1 1 354.838 2.922 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000557639664 516353328 /nfs/dbraw/zinc/35/33/28/516353328.db2.gz SBFBJSLDKKPBOG-HZPDHXFCSA-N 1 1 370.409 2.942 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000523280133 516421208 /nfs/dbraw/zinc/42/12/08/516421208.db2.gz HNEUSECOSRNRJT-MRXNPFEDSA-N 1 1 365.478 2.569 20 5 FFBDMO COc1ccc(CNC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000517738095 516431803 /nfs/dbraw/zinc/43/18/03/516431803.db2.gz WGEZANITQNMRIB-KGLIPLIRSA-N 1 1 364.446 2.523 20 5 FFBDMO COc1c(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000561282256 516499036 /nfs/dbraw/zinc/49/90/36/516499036.db2.gz RMMXERKTPHZMAK-UHFFFAOYSA-N 1 1 355.394 2.560 20 5 FFBDMO Cc1ncc2c(n1)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000535789694 516510029 /nfs/dbraw/zinc/51/00/29/516510029.db2.gz HCTXFSZEZMPOPA-UHFFFAOYSA-N 1 1 350.325 2.853 20 5 FFBDMO Cc1ncc2c(n1)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000535789694 516510036 /nfs/dbraw/zinc/51/00/36/516510036.db2.gz HCTXFSZEZMPOPA-UHFFFAOYSA-N 1 1 350.325 2.853 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000561347285 516535350 /nfs/dbraw/zinc/53/53/50/516535350.db2.gz IDPLMKXOSNMIJX-GDZNZVCISA-N 1 1 365.861 2.979 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)c2c(c1)COCO2 ZINC000540428024 516551188 /nfs/dbraw/zinc/55/11/88/516551188.db2.gz FJOOBYXYOYGNCL-UHFFFAOYSA-N 1 1 370.361 2.969 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@@H](C)C1 ZINC000558022809 516556459 /nfs/dbraw/zinc/55/64/59/516556459.db2.gz JOASVHSDNGZAEJ-JCGVRSQUSA-N 1 1 356.426 2.878 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000547789420 516566062 /nfs/dbraw/zinc/56/60/62/516566062.db2.gz FTSAZZOHLSZSFA-AWEZNQCLSA-N 1 1 357.414 2.583 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000513678578 516716694 /nfs/dbraw/zinc/71/66/94/516716694.db2.gz PHXOQKJEOVUQDD-GOSISDBHSA-N 1 1 352.394 2.956 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000561777382 516768787 /nfs/dbraw/zinc/76/87/87/516768787.db2.gz WBJFMQRYPWKQTB-KRWDZBQOSA-N 1 1 362.474 2.899 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000541106694 516879155 /nfs/dbraw/zinc/87/91/55/516879155.db2.gz UPAHZQKNWVBKJU-STQMWFEESA-N 1 1 350.419 2.845 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1)CC(C)C ZINC000536926942 516983117 /nfs/dbraw/zinc/98/31/17/516983117.db2.gz IVWUXRNPSUDORP-UHFFFAOYSA-N 1 1 351.451 2.538 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cccc(O)c1 ZINC000532566429 517036737 /nfs/dbraw/zinc/03/67/37/517036737.db2.gz LNABCGLCWUYFLO-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO O=C(CCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000562529288 517169418 /nfs/dbraw/zinc/16/94/18/517169418.db2.gz XIXJUIAPHRURSA-UHFFFAOYSA-N 1 1 354.410 2.775 20 5 FFBDMO Cc1ncc(C[N@@H+](C)CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)s1 ZINC000532919503 517201209 /nfs/dbraw/zinc/20/12/09/517201209.db2.gz GNQGMXZCOJZQHS-UHFFFAOYSA-N 1 1 362.411 2.790 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCN3CCOC[C@H]3C2)s1 ZINC000541761092 517202419 /nfs/dbraw/zinc/20/24/19/517202419.db2.gz XLSGVLCHXZQGQF-CQSZACIVSA-N 1 1 359.451 2.840 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000532988298 517238936 /nfs/dbraw/zinc/23/89/36/517238936.db2.gz ACCDSAPUAUPOAG-CHWSQXEVSA-N 1 1 368.865 2.991 20 5 FFBDMO COc1ccc(CC(=O)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000532991254 517241485 /nfs/dbraw/zinc/24/14/85/517241485.db2.gz OLPRYROSPSEUFO-MRXNPFEDSA-N 1 1 363.458 2.630 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Cn2c[nH+]c3c2CCCC3)c([N+](=O)[O-])c1 ZINC000537581430 517242471 /nfs/dbraw/zinc/24/24/71/517242471.db2.gz MIPVHISQHQGZLM-UHFFFAOYSA-N 1 1 371.441 2.597 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000552457833 517269021 /nfs/dbraw/zinc/26/90/21/517269021.db2.gz GUOIXDFQJVWJBZ-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000552457833 517269027 /nfs/dbraw/zinc/26/90/27/517269027.db2.gz GUOIXDFQJVWJBZ-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccc(O)cc2C1 ZINC000533072317 517278839 /nfs/dbraw/zinc/27/88/39/517278839.db2.gz FENQHPMOLFFXSI-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C[C@H]1C ZINC000545830096 517384091 /nfs/dbraw/zinc/38/40/91/517384091.db2.gz QRKSQHVLJBCRKS-OLZOCXBDSA-N 1 1 351.422 2.953 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000552805468 517399880 /nfs/dbraw/zinc/39/98/80/517399880.db2.gz CFQHCQCJTDGDIH-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000552805468 517399891 /nfs/dbraw/zinc/39/98/91/517399891.db2.gz CFQHCQCJTDGDIH-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000538275735 517536072 /nfs/dbraw/zinc/53/60/72/517536072.db2.gz JNCYVABZSGJPRA-KRWDZBQOSA-N 1 1 373.384 2.600 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)[C@H]2CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496330 517595071 /nfs/dbraw/zinc/59/50/71/517595071.db2.gz KXDRLEYQNHKQKO-POZUXBRTSA-N 1 1 360.410 2.827 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c1 ZINC000538421467 517613413 /nfs/dbraw/zinc/61/34/13/517613413.db2.gz IQEQRLQTJIZTMW-KRWDZBQOSA-N 1 1 369.421 2.975 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c1 ZINC000538421467 517613423 /nfs/dbraw/zinc/61/34/23/517613423.db2.gz IQEQRLQTJIZTMW-KRWDZBQOSA-N 1 1 369.421 2.975 20 5 FFBDMO CN1CCN(c2cc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])ccn2)CC1 ZINC000521272272 517676774 /nfs/dbraw/zinc/67/67/74/517676774.db2.gz WPKPDMUAWULZPC-SFHVURJKSA-N 1 1 367.453 2.519 20 5 FFBDMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000521290157 517682198 /nfs/dbraw/zinc/68/21/98/517682198.db2.gz WYLSTOGFSTTXOC-RDJZCZTQSA-N 1 1 368.437 2.956 20 5 FFBDMO Cc1n[nH]cc1CCC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556863191 517714351 /nfs/dbraw/zinc/71/43/51/517714351.db2.gz WGZNLKHNKAUDPT-KRWDZBQOSA-N 1 1 354.414 2.672 20 5 FFBDMO CN(c1ccccc1)c1ccc(CNC[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563318 517725778 /nfs/dbraw/zinc/72/57/78/517725778.db2.gz JQUCDZQFCWBJIV-FQEVSTJZSA-N 1 1 370.453 2.519 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH2+]C[C@@]2(O)CCN(C)C2)cc1[N+](=O)[O-] ZINC000546563318 517725783 /nfs/dbraw/zinc/72/57/83/517725783.db2.gz JQUCDZQFCWBJIV-FQEVSTJZSA-N 1 1 370.453 2.519 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)s1 ZINC000553482555 517739149 /nfs/dbraw/zinc/73/91/49/517739149.db2.gz GTEKNXXCCHYLSZ-STQMWFEESA-N 1 1 363.443 2.655 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000542852638 517782047 /nfs/dbraw/zinc/78/20/47/517782047.db2.gz OBYWXDDGLPDZIY-GXSJLCMTSA-N 1 1 355.341 2.551 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542921255 517816541 /nfs/dbraw/zinc/81/65/41/517816541.db2.gz ZNHLQSOUVSMXCS-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000543437367 518091499 /nfs/dbraw/zinc/09/14/99/518091499.db2.gz UBVMRRDKWLVVFD-VXGBXAGGSA-N 1 1 369.263 2.981 20 5 FFBDMO COCC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccco1 ZINC000543458485 518103031 /nfs/dbraw/zinc/10/30/31/518103031.db2.gz ADRNSDKELRTGOH-CYBMUJFWSA-N 1 1 363.370 2.502 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000543504732 518120797 /nfs/dbraw/zinc/12/07/97/518120797.db2.gz LJBVTGGCASIXBG-LBPRGKRZSA-N 1 1 361.402 2.670 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000543574256 518142109 /nfs/dbraw/zinc/14/21/09/518142109.db2.gz PVZSAQIEHWSKRA-QFBILLFUSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000543574256 518142114 /nfs/dbraw/zinc/14/21/14/518142114.db2.gz PVZSAQIEHWSKRA-QFBILLFUSA-N 1 1 364.442 2.616 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1C ZINC000531141299 518152658 /nfs/dbraw/zinc/15/26/58/518152658.db2.gz QCCGODROAOLRSH-UKRRQHHQSA-N 1 1 359.430 2.949 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCCC[C@@H]1C ZINC000535371125 518177054 /nfs/dbraw/zinc/17/70/54/518177054.db2.gz FEGMICBIGZKLSS-KBPBESRZSA-N 1 1 358.442 2.998 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000567084612 518344054 /nfs/dbraw/zinc/34/40/54/518344054.db2.gz FBMJHJKUDBZCLJ-HNNXBMFYSA-N 1 1 373.457 2.744 20 5 FFBDMO CC(C)N1CC[NH+]([C@H]2CCN(c3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000572966982 518443155 /nfs/dbraw/zinc/44/31/55/518443155.db2.gz JPTGENGLEYHWFX-SFHVURJKSA-N 1 1 369.469 2.748 20 5 FFBDMO Cc1c(CNC(=O)[C@H]2CCC[N@@H+](Cc3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000573036212 518475291 /nfs/dbraw/zinc/47/52/91/518475291.db2.gz DOCZNRWFRGNGET-SFHVURJKSA-N 1 1 368.437 2.827 20 5 FFBDMO O=C(C[N@H+]1CCCCC[C@@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000585754959 518586399 /nfs/dbraw/zinc/58/63/99/518586399.db2.gz YUUGEWKLRLNOCI-CYBMUJFWSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000585754959 518586405 /nfs/dbraw/zinc/58/64/05/518586405.db2.gz YUUGEWKLRLNOCI-CYBMUJFWSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000582270159 518670295 /nfs/dbraw/zinc/67/02/95/518670295.db2.gz LXRSENFGJPBURP-MRXNPFEDSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000582270159 518670301 /nfs/dbraw/zinc/67/03/01/518670301.db2.gz LXRSENFGJPBURP-MRXNPFEDSA-N 1 1 366.421 2.670 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000570597062 518686102 /nfs/dbraw/zinc/68/61/02/518686102.db2.gz QCYGTKNBIZMJGL-WMLDXEAASA-N 1 1 373.457 2.821 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000570597062 518686108 /nfs/dbraw/zinc/68/61/08/518686108.db2.gz QCYGTKNBIZMJGL-WMLDXEAASA-N 1 1 373.457 2.821 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000587981919 518691604 /nfs/dbraw/zinc/69/16/04/518691604.db2.gz IPTVVSNDPRFHLL-UHFFFAOYSA-N 1 1 356.213 2.962 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000588640394 518793394 /nfs/dbraw/zinc/79/33/94/518793394.db2.gz UQJSQYWJJXVWII-SFHVURJKSA-N 1 1 368.437 2.965 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000588640394 518793400 /nfs/dbraw/zinc/79/34/00/518793400.db2.gz UQJSQYWJJXVWII-SFHVURJKSA-N 1 1 368.437 2.965 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCn1cc(Br)cn1 ZINC000588986331 518888296 /nfs/dbraw/zinc/88/82/96/518888296.db2.gz DIICGSPJTHBEFW-UHFFFAOYSA-N 1 1 369.219 2.565 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c1 ZINC000589518594 519023812 /nfs/dbraw/zinc/02/38/12/519023812.db2.gz ZVZJQDJXLLWYLH-CZUORRHYSA-N 1 1 350.415 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)c1 ZINC000580200627 519057801 /nfs/dbraw/zinc/05/78/01/519057801.db2.gz AZDGSGQZGFGYLN-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000568574810 519106684 /nfs/dbraw/zinc/10/66/84/519106684.db2.gz KWTDMFDAQMQQFJ-NSHDSACASA-N 1 1 372.263 2.745 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H]2COC[C@H]2OC)cc1OC ZINC000580309202 519111423 /nfs/dbraw/zinc/11/14/23/519111423.db2.gz LNDCYSDTRLFXAP-RVZJWNSFSA-N 1 1 368.430 2.532 20 5 FFBDMO O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000574367890 519119397 /nfs/dbraw/zinc/11/93/97/519119397.db2.gz WSQLEIACLJBLLS-QGZVFWFLSA-N 1 1 371.441 2.884 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H](C)CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000577542629 519132506 /nfs/dbraw/zinc/13/25/06/519132506.db2.gz AXWSVLISSCNEQK-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000577542629 519132511 /nfs/dbraw/zinc/13/25/11/519132511.db2.gz AXWSVLISSCNEQK-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659906 519152912 /nfs/dbraw/zinc/15/29/12/519152912.db2.gz MRKJNEJDKSRWGL-HNAYVOBHSA-N 1 1 366.421 2.893 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659906 519152918 /nfs/dbraw/zinc/15/29/18/519152918.db2.gz MRKJNEJDKSRWGL-HNAYVOBHSA-N 1 1 366.421 2.893 20 5 FFBDMO Cn1cc([C@@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2(C)C)cn1 ZINC000565842679 519158183 /nfs/dbraw/zinc/15/81/83/519158183.db2.gz UMDYXYAGMBRMOD-AWEZNQCLSA-N 1 1 354.414 2.830 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2(C)C)cn1 ZINC000565842679 519158186 /nfs/dbraw/zinc/15/81/86/519158186.db2.gz UMDYXYAGMBRMOD-AWEZNQCLSA-N 1 1 354.414 2.830 20 5 FFBDMO C[C@H](CN1CCOCC1)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590177310 519168667 /nfs/dbraw/zinc/16/86/67/519168667.db2.gz SXSCQJQPGHIQPO-GFCCVEGCSA-N 1 1 361.364 2.766 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[C@H]4C[N@@H+](C)C[C@H]43)cc2[N+](=O)[O-])CC1 ZINC000590446586 519235499 /nfs/dbraw/zinc/23/54/99/519235499.db2.gz UWQQAOQUKZOFNY-QFBILLFUSA-N 1 1 372.469 2.607 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000571782401 519273353 /nfs/dbraw/zinc/27/33/53/519273353.db2.gz ORQQJEADKXOTBK-OKILXGFUSA-N 1 1 373.457 2.836 20 5 FFBDMO CC1(C)CC[N@@H+](CC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000574768765 519324057 /nfs/dbraw/zinc/32/40/57/519324057.db2.gz NIIITVZWNIGELV-UHFFFAOYSA-N 1 1 359.348 2.962 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000572056759 519420395 /nfs/dbraw/zinc/42/03/95/519420395.db2.gz ZUNHPEZXHJRWBZ-SGMGOOAPSA-N 1 1 366.849 2.744 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000578149355 519444157 /nfs/dbraw/zinc/44/41/57/519444157.db2.gz RUGYOVPDLLMFNE-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000578149355 519444167 /nfs/dbraw/zinc/44/41/67/519444167.db2.gz RUGYOVPDLLMFNE-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000578149355 519444172 /nfs/dbraw/zinc/44/41/72/519444172.db2.gz RUGYOVPDLLMFNE-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000566461870 519506296 /nfs/dbraw/zinc/50/62/96/519506296.db2.gz SWYSUFFORQNLQI-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)C(C)(C)C2)cc1[N+](=O)[O-] ZINC000566461870 519506299 /nfs/dbraw/zinc/50/62/99/519506299.db2.gz SWYSUFFORQNLQI-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000583943461 519510184 /nfs/dbraw/zinc/51/01/84/519510184.db2.gz KUSCCUBATFVPDL-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO CN1CCN(c2ccc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])cn2)CC1 ZINC000566473489 519511836 /nfs/dbraw/zinc/51/18/36/519511836.db2.gz BKYFLCLCCSTOKV-GOSISDBHSA-N 1 1 367.453 2.519 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000569401098 519529568 /nfs/dbraw/zinc/52/95/68/519529568.db2.gz OMKLYKMKELZUJF-AWEZNQCLSA-N 1 1 373.457 2.650 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000591147591 519529730 /nfs/dbraw/zinc/52/97/30/519529730.db2.gz RKWWOEAEBORHFX-OAHLLOKOSA-N 1 1 355.442 2.723 20 5 FFBDMO CN1CCC([N@@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147580 519530407 /nfs/dbraw/zinc/53/04/07/519530407.db2.gz OJFYLLLZESRSFA-NSHDSACASA-N 1 1 373.379 2.589 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3C(F)(F)F)C2)CC1 ZINC000591147580 519530411 /nfs/dbraw/zinc/53/04/11/519530411.db2.gz OJFYLLLZESRSFA-NSHDSACASA-N 1 1 373.379 2.589 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(Cc2nccs2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000602952781 519990778 /nfs/dbraw/zinc/99/07/78/519990778.db2.gz BPKQBQUUFHUCQA-UHFFFAOYSA-N 1 1 374.466 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c(Cl)c1 ZINC000594483201 519992251 /nfs/dbraw/zinc/99/22/51/519992251.db2.gz CVLWAUGWVTYTPD-UONOGXRCSA-N 1 1 373.862 2.543 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000594547609 520021765 /nfs/dbraw/zinc/02/17/65/520021765.db2.gz UQAFBXPXLCPQEK-AWEZNQCLSA-N 1 1 366.437 2.713 20 5 FFBDMO CC(C)(C(=O)N1CC[NH+](CCCF)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000600077151 520032064 /nfs/dbraw/zinc/03/20/64/520032064.db2.gz WHQOWCCCMJEGKU-UHFFFAOYSA-N 1 1 355.385 2.515 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000594586000 520039502 /nfs/dbraw/zinc/03/95/02/520039502.db2.gz IRBWJTQHNZRAMU-UHFFFAOYSA-N 1 1 368.453 2.960 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)s1 ZINC000594613697 520056315 /nfs/dbraw/zinc/05/63/15/520056315.db2.gz QUSZGYNGOKIZEB-UONOGXRCSA-N 1 1 359.451 2.574 20 5 FFBDMO CCOC(=O)Cc1ccc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])c1 ZINC000591895312 520073492 /nfs/dbraw/zinc/07/34/92/520073492.db2.gz NKNRSXCDDRPBID-UHFFFAOYSA-N 1 1 372.425 2.888 20 5 FFBDMO Cc1[nH]c2nc[nH+]c(N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1C ZINC000591925793 520090538 /nfs/dbraw/zinc/09/05/38/520090538.db2.gz PJYYDVOHGFDMKL-LBPRGKRZSA-N 1 1 353.386 2.569 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCc4ccc(O)cc4CC3)o2)cc1 ZINC000608866710 520149184 /nfs/dbraw/zinc/14/91/84/520149184.db2.gz VAXONWKLDKEXNM-UHFFFAOYSA-N 1 1 366.377 2.951 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCNc1[nH+]cnc2[nH]ccc21 ZINC000608884920 520153986 /nfs/dbraw/zinc/15/39/86/520153986.db2.gz OEFQGAXJPFXIEV-UHFFFAOYSA-N 1 1 366.303 2.831 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594788155 520158394 /nfs/dbraw/zinc/15/83/94/520158394.db2.gz FXZXZFUEDSXCDX-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000594793093 520161388 /nfs/dbraw/zinc/16/13/88/520161388.db2.gz UVAITUGCUNNDOY-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO Cn1c(C(=O)N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000608964824 520170607 /nfs/dbraw/zinc/17/06/07/520170607.db2.gz ZKAGLISIQGIJLP-UHFFFAOYSA-N 1 1 370.453 2.918 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000600298486 520188822 /nfs/dbraw/zinc/18/88/22/520188822.db2.gz KTJRMBIDNKBFCL-KRWDZBQOSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000600298486 520188829 /nfs/dbraw/zinc/18/88/29/520188829.db2.gz KTJRMBIDNKBFCL-KRWDZBQOSA-N 1 1 369.421 2.537 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC000597709748 520190673 /nfs/dbraw/zinc/19/06/73/520190673.db2.gz BBISPXPMSDFJKP-LJQANCHMSA-N 1 1 354.410 2.701 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000609157479 520213676 /nfs/dbraw/zinc/21/36/76/520213676.db2.gz UVIYIEFZGKHUGZ-MRXNPFEDSA-N 1 1 357.414 2.765 20 5 FFBDMO COc1ccc(N2C[C@@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2=O)cc1 ZINC000594967364 520232895 /nfs/dbraw/zinc/23/28/95/520232895.db2.gz XBNOMDCEHUIABF-ZDUSSCGKSA-N 1 1 359.357 2.638 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000609309851 520270906 /nfs/dbraw/zinc/27/09/06/520270906.db2.gz OYLISEOZJDYWBB-OAHLLOKOSA-N 1 1 356.426 2.683 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000600474551 520281438 /nfs/dbraw/zinc/28/14/38/520281438.db2.gz YORQELUDYFPDID-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000600474552 520281601 /nfs/dbraw/zinc/28/16/01/520281601.db2.gz YORQELUDYFPDID-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(CNc3ccsc3[N+](=O)[O-])c2)C1 ZINC000609384128 520300496 /nfs/dbraw/zinc/30/04/96/520300496.db2.gz RDLGSLGCQZILKF-OAHLLOKOSA-N 1 1 374.466 2.966 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000609441579 520312222 /nfs/dbraw/zinc/31/22/22/520312222.db2.gz KAQIJQPMZMSAPE-KRWDZBQOSA-N 1 1 367.421 2.601 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000597925401 520326459 /nfs/dbraw/zinc/32/64/59/520326459.db2.gz OMRXELAHDOEVAO-MRXNPFEDSA-N 1 1 374.485 2.800 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000603628965 520330841 /nfs/dbraw/zinc/33/08/41/520330841.db2.gz BKBSFNRTFIBYIM-UHFFFAOYSA-N 1 1 368.437 2.714 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000609509296 520336891 /nfs/dbraw/zinc/33/68/91/520336891.db2.gz NMUUMCBCYDROIU-BXUZGUMPSA-N 1 1 367.833 2.711 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1C ZINC000603659049 520337288 /nfs/dbraw/zinc/33/72/88/520337288.db2.gz UGOKHXACJLLPPF-JSGCOSHPSA-N 1 1 369.487 2.610 20 5 FFBDMO CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CC[N@@H+](CC)C1 ZINC000598044153 520392890 /nfs/dbraw/zinc/39/28/90/520392890.db2.gz YPGRTEUXIGIMMU-QGZVFWFLSA-N 1 1 374.485 2.754 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705264 520410455 /nfs/dbraw/zinc/41/04/55/520410455.db2.gz NEGHAMSYECYZPG-GXTWGEPZSA-N 1 1 369.849 2.611 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000610100366 520539620 /nfs/dbraw/zinc/53/96/20/520539620.db2.gz WYQVHIKUZLVESH-QZTJIDSGSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445590 520565633 /nfs/dbraw/zinc/56/56/33/520565633.db2.gz KOBKAFGMPVOGFV-NFAWXSAZSA-N 1 1 371.441 2.949 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000598342480 520566332 /nfs/dbraw/zinc/56/63/32/520566332.db2.gz NTELWNLSLCPWCR-LLVKDONJSA-N 1 1 353.444 2.539 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC000598342336 520566947 /nfs/dbraw/zinc/56/69/47/520566947.db2.gz MIEVIJLOPBAULA-HNNXBMFYSA-N 1 1 354.410 2.871 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000598342707 520567297 /nfs/dbraw/zinc/56/72/97/520567297.db2.gz PEDGJYFGEITAMZ-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO CCCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000592828329 520604743 /nfs/dbraw/zinc/60/47/43/520604743.db2.gz GPQJXCWXHNAAEU-ZDUSSCGKSA-N 1 1 370.247 2.914 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC3(CCC3)OC[C@H]2C)c([N+](=O)[O-])c1 ZINC000595684050 520645741 /nfs/dbraw/zinc/64/57/41/520645741.db2.gz ZJWZIMPALUIOCM-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO COc1cc2c(c(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)c1)O[C@H](C)C2 ZINC000601149303 520662323 /nfs/dbraw/zinc/66/23/23/520662323.db2.gz KSEPKZUDXDZNBM-XCLFUZPHSA-N 1 1 372.421 2.924 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598507880 520664588 /nfs/dbraw/zinc/66/45/88/520664588.db2.gz DILZMBKDUWLFHF-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598507880 520664595 /nfs/dbraw/zinc/66/45/95/520664595.db2.gz DILZMBKDUWLFHF-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000595758163 520702259 /nfs/dbraw/zinc/70/22/59/520702259.db2.gz CIXNSVUTMAWOPE-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](OC(C)C)C2)c([N+](=O)[O-])c1 ZINC000593055718 520714027 /nfs/dbraw/zinc/71/40/27/520714027.db2.gz NIWVESMEGBUCFD-HNNXBMFYSA-N 1 1 365.430 2.821 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000598624199 520749596 /nfs/dbraw/zinc/74/95/96/520749596.db2.gz GCANYZPVDYJSOV-AWEZNQCLSA-N 1 1 362.430 2.985 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595830353 520753555 /nfs/dbraw/zinc/75/35/55/520753555.db2.gz KRIVLCZAEMKGJG-PWSUYJOCSA-N 1 1 358.341 2.673 20 5 FFBDMO NC(=O)c1cccc2c1CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000595902391 520807952 /nfs/dbraw/zinc/80/79/52/520807952.db2.gz IQQZGLBSEBRVOQ-UHFFFAOYSA-N 1 1 355.394 2.521 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@H]2C)cc1OC ZINC000593188159 520810658 /nfs/dbraw/zinc/81/06/58/520810658.db2.gz WWZMRGRAPJDZFP-JHJVBQTASA-N 1 1 365.430 2.555 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c1[N+](=O)[O-] ZINC000618068291 520863347 /nfs/dbraw/zinc/86/33/47/520863347.db2.gz NHCUBXAVVRETJT-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000618068291 520863353 /nfs/dbraw/zinc/86/33/53/520863353.db2.gz NHCUBXAVVRETJT-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[N@H+]1CCc2ccccc2C1 ZINC000596074869 520895228 /nfs/dbraw/zinc/89/52/28/520895228.db2.gz IRMPDXSUOIOFBG-CYBMUJFWSA-N 1 1 354.410 2.552 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593322461 520910220 /nfs/dbraw/zinc/91/02/20/520910220.db2.gz NIKHGYIPMGYYBY-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593322461 520910222 /nfs/dbraw/zinc/91/02/22/520910222.db2.gz NIKHGYIPMGYYBY-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596150503 520939949 /nfs/dbraw/zinc/93/99/49/520939949.db2.gz CALAZBNDOZAEPV-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@H](c3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000596175625 520952595 /nfs/dbraw/zinc/95/25/95/520952595.db2.gz VHKYFRCYTHXTRO-SNVBAGLBSA-N 1 1 364.789 2.762 20 5 FFBDMO C[C@H](c1cccc(F)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1 ZINC000596180014 520955556 /nfs/dbraw/zinc/95/55/56/520955556.db2.gz WQZGBANUOHFCIQ-CYBMUJFWSA-N 1 1 372.400 2.716 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@]3(C2)C(=O)Nc2ccccc23)cc1[N+](=O)[O-] ZINC000614584075 521034810 /nfs/dbraw/zinc/03/48/10/521034810.db2.gz YKVWZENQHJKYHV-IBGZPJMESA-N 1 1 353.378 2.699 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599126057 521043731 /nfs/dbraw/zinc/04/37/31/521043731.db2.gz LQRIWQSWIBWPRJ-UHFFFAOYSA-N 1 1 367.203 2.682 20 5 FFBDMO COc1cccc(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1[N+](=O)[O-] ZINC000596425280 521065004 /nfs/dbraw/zinc/06/50/04/521065004.db2.gz XKWKQFUTOJIMJN-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000593559784 521076603 /nfs/dbraw/zinc/07/66/03/521076603.db2.gz NMFMADGXWJCLPV-VQIMIIECSA-N 1 1 357.385 2.838 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C3CCCCC3)C2)s1 ZINC000596478113 521093090 /nfs/dbraw/zinc/09/30/90/521093090.db2.gz GSDWUNPNNWZICP-NSHDSACASA-N 1 1 373.500 2.879 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CCCCC3)C2)s1 ZINC000596478113 521093095 /nfs/dbraw/zinc/09/30/95/521093095.db2.gz GSDWUNPNNWZICP-NSHDSACASA-N 1 1 373.500 2.879 20 5 FFBDMO C[C@@H](C[NH+]1CCC(C)CC1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000596488158 521096531 /nfs/dbraw/zinc/09/65/31/521096531.db2.gz NAKIFSBMEPVDPF-ZDUSSCGKSA-N 1 1 355.460 2.531 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000596540036 521124126 /nfs/dbraw/zinc/12/41/26/521124126.db2.gz SCFBQUOIOPISSF-CYBMUJFWSA-N 1 1 359.348 2.649 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000599319243 521149682 /nfs/dbraw/zinc/14/96/82/521149682.db2.gz CZQOBILOGRYQHA-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593716634 521170847 /nfs/dbraw/zinc/17/08/47/521170847.db2.gz UTHDWPMNJLESBN-UHFFFAOYSA-N 1 1 374.416 2.652 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611578005 521232829 /nfs/dbraw/zinc/23/28/29/521232829.db2.gz MLZUPDNHBHTULJ-CYBMUJFWSA-N 1 1 357.357 2.935 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1C ZINC000599464895 521241165 /nfs/dbraw/zinc/24/11/65/521241165.db2.gz WKMOKMFIGPXKFN-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000594016657 521349190 /nfs/dbraw/zinc/34/91/90/521349190.db2.gz CIELSRGHXXFCRI-CYBMUJFWSA-N 1 1 374.384 2.984 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@H]1CCCC2 ZINC000594018417 521352408 /nfs/dbraw/zinc/35/24/08/521352408.db2.gz KGJNBPVVHCRQRQ-KZULUSFZSA-N 1 1 359.382 2.901 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccc(=O)[nH]n1 ZINC000599641283 521353452 /nfs/dbraw/zinc/35/34/52/521353452.db2.gz MOHIOGVKNZEJFI-INIZCTEOSA-N 1 1 371.397 2.565 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc4nccnc4c3)C2)nc1 ZINC000602471615 521363686 /nfs/dbraw/zinc/36/36/86/521363686.db2.gz FHMJLAOVUOHJEA-CQSZACIVSA-N 1 1 350.382 2.619 20 5 FFBDMO COC[C@@H](C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCc2ccccc21 ZINC000599682858 521396934 /nfs/dbraw/zinc/39/69/34/521396934.db2.gz MHUKSMGVPWCPIY-DNVCBOLYSA-N 1 1 371.437 2.781 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000611984091 521420056 /nfs/dbraw/zinc/42/00/56/521420056.db2.gz CUVOCRQCYLBKAJ-UHFFFAOYSA-N 1 1 358.394 2.669 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 ZINC000611984091 521420063 /nfs/dbraw/zinc/42/00/63/521420063.db2.gz CUVOCRQCYLBKAJ-UHFFFAOYSA-N 1 1 358.394 2.669 20 5 FFBDMO C[C@H]1OCC[C@@]12C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000619175817 521433649 /nfs/dbraw/zinc/43/36/49/521433649.db2.gz QAJGADKAROAKEV-IIDMSEBBSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@@H](O)C(F)(F)F ZINC000602743127 521509361 /nfs/dbraw/zinc/50/93/61/521509361.db2.gz IFEMVZLJLVNWKI-MHTLYPKNSA-N 1 1 363.155 2.820 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000602779967 521527795 /nfs/dbraw/zinc/52/77/95/521527795.db2.gz NVMKNFKUMAKVPE-GOSISDBHSA-N 1 1 372.404 2.694 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000602779967 521527800 /nfs/dbraw/zinc/52/78/00/521527800.db2.gz NVMKNFKUMAKVPE-GOSISDBHSA-N 1 1 372.404 2.694 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000602828604 521557115 /nfs/dbraw/zinc/55/71/15/521557115.db2.gz HXDRXXVRNFRZOX-FQEVSTJZSA-N 1 1 369.469 2.698 20 5 FFBDMO O=C(N[C@@H]1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccc([N+](=O)[O-])[nH]1 ZINC000612285760 521561368 /nfs/dbraw/zinc/56/13/68/521561368.db2.gz DKJIIUWXJVTFSL-BRWVUGGUSA-N 1 1 368.437 2.953 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CCC[N@H+](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000619541082 521759305 /nfs/dbraw/zinc/75/93/05/521759305.db2.gz FEQICVJHIFCANR-LLVKDONJSA-N 1 1 371.235 2.881 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)[nH+]c1 ZINC000511443867 561869541 /nfs/dbraw/zinc/86/95/41/561869541.db2.gz JGJGNAMBQUYEQE-UHFFFAOYSA-N 1 1 371.441 2.984 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)CC1 ZINC000825282218 607451604 /nfs/dbraw/zinc/45/16/04/607451604.db2.gz RFLPLUYRHAYIFP-UHFFFAOYSA-N 1 1 373.461 2.723 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CCN(c3cc([N+](=O)[O-])ccn3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164837831 720509264 /nfs/dbraw/zinc/50/92/64/720509264.db2.gz PNZQHSILARIZJG-BPQIPLTHSA-N 1 1 370.457 2.564 20 5 FFBDMO CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926760 721855240 /nfs/dbraw/zinc/85/52/40/721855240.db2.gz JFJNMFVORBXGNZ-RTBURBONSA-N 1 1 361.493 2.998 20 5 FFBDMO C[NH+](C)CCN1CC[C@@H]2[C@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926760 721855243 /nfs/dbraw/zinc/85/52/43/721855243.db2.gz JFJNMFVORBXGNZ-RTBURBONSA-N 1 1 361.493 2.998 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1F ZINC000154236886 728799374 /nfs/dbraw/zinc/79/93/74/728799374.db2.gz ASHPAAAQZVNIRZ-ZDUSSCGKSA-N 1 1 373.450 2.585 20 5 FFBDMO CCN(CC)C(=O)C1([NH2+]Cn2nc(C)c([N+](=O)[O-])c2C)CCCCC1 ZINC000161169289 728929775 /nfs/dbraw/zinc/92/97/75/728929775.db2.gz GRCUNNYOKZXXEN-UHFFFAOYSA-N 1 1 351.451 2.527 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000746390590 735480287 /nfs/dbraw/zinc/48/02/87/735480287.db2.gz MCUJSJRRNWICDN-UHFFFAOYSA-N 1 1 350.444 2.752 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000746535445 735491886 /nfs/dbraw/zinc/49/18/86/735491886.db2.gz ZNMSWOAIUWDJOS-MRXNPFEDSA-N 1 1 362.499 2.918 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000066080335 728166477 /nfs/dbraw/zinc/16/64/77/728166477.db2.gz VJQAWXKXVDWKEH-LLVKDONJSA-N 1 1 364.427 2.807 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000066080335 728166480 /nfs/dbraw/zinc/16/64/80/728166480.db2.gz VJQAWXKXVDWKEH-LLVKDONJSA-N 1 1 364.427 2.807 20 5 FFBDMO CC1CCC([NH+]2CCN(S(=O)(=O)c3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000119772287 728600058 /nfs/dbraw/zinc/60/00/58/728600058.db2.gz GDCZYXVSSXSTMM-UHFFFAOYSA-N 1 1 373.500 2.541 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000249830689 729621760 /nfs/dbraw/zinc/62/17/60/729621760.db2.gz TWZNDYJOLZGYOG-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000249830689 729621764 /nfs/dbraw/zinc/62/17/64/729621764.db2.gz TWZNDYJOLZGYOG-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000249830689 729621767 /nfs/dbraw/zinc/62/17/67/729621767.db2.gz TWZNDYJOLZGYOG-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000861340485 730601001 /nfs/dbraw/zinc/60/10/01/730601001.db2.gz HYSXHYBICRLLNI-BLLLJJGKSA-N 1 1 354.428 2.583 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000861343844 730601253 /nfs/dbraw/zinc/60/12/53/730601253.db2.gz LODGZZVCIABZGK-BDJLRTHQSA-N 1 1 354.428 2.583 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2C[C@H](S(=O)(=O)c3ccccc3)C2)cs1 ZINC000865767023 730995244 /nfs/dbraw/zinc/99/52/44/730995244.db2.gz NAEDGJOTUDFNTD-MQMHXKEQSA-N 1 1 352.437 2.751 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)N1CCN(C)CC1 ZINC000872033408 731722609 /nfs/dbraw/zinc/72/26/09/731722609.db2.gz GRCLEUJSUHOTJM-ZIAGYGMSSA-N 1 1 352.504 2.603 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000874825290 732104001 /nfs/dbraw/zinc/10/40/01/732104001.db2.gz ITZLMAKJJMOMKW-ZIAGYGMSSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cc(Br)c([N+](=O)[O-])s3)CC[C@@H]21 ZINC000877741010 732421458 /nfs/dbraw/zinc/42/14/58/732421458.db2.gz MAAWBRCYEAPWDU-SKDRFNHKSA-N 1 1 360.277 2.945 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H](C)[N@@H+]1C ZINC000878653785 732572682 /nfs/dbraw/zinc/57/26/82/732572682.db2.gz HPNLAXMWYCLMSR-PHIMTYICSA-N 1 1 365.821 2.823 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000878836096 732602674 /nfs/dbraw/zinc/60/26/74/732602674.db2.gz HUCWATGRXBZBDR-XQQFMLRXSA-N 1 1 368.865 2.990 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880005888 732817377 /nfs/dbraw/zinc/81/73/77/732817377.db2.gz DSSVFENLICQCFG-HIFRSBDPSA-N 1 1 363.439 2.589 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]Cc1cnc2n1CCC2 ZINC000883288239 733360387 /nfs/dbraw/zinc/36/03/87/733360387.db2.gz XBHCZUDUUXIVIR-UHFFFAOYSA-N 1 1 351.204 2.790 20 5 FFBDMO CN(C)c1ncc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000883287930 733360578 /nfs/dbraw/zinc/36/05/78/733360578.db2.gz LHLCJJGFTBNIKI-UHFFFAOYSA-N 1 1 366.219 2.503 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](OC(F)F)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782531107 738731159 /nfs/dbraw/zinc/73/11/59/738731159.db2.gz OEKKESDSTAGOHK-LLVKDONJSA-N 1 1 361.320 2.766 20 5 FFBDMO CC(C)(C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000928095255 738821523 /nfs/dbraw/zinc/82/15/23/738821523.db2.gz NRZXRWZAGSHEPF-HOTGVXAUSA-N 1 1 363.483 2.568 20 5 FFBDMO CCc1nc(C[NH+]2CCC(CNc3c([N+](=O)[O-])cnn3C)CC2)cs1 ZINC000892462670 734562201 /nfs/dbraw/zinc/56/22/01/734562201.db2.gz ULIVYDQQWKGENC-UHFFFAOYSA-N 1 1 364.475 2.671 20 5 FFBDMO C[C@@]1(NC(=O)c2sc(Br)cc2[N+](=O)[O-])C[NH+]2CCC1CC2 ZINC000892775009 734602410 /nfs/dbraw/zinc/60/24/10/734602410.db2.gz WPHZWVUWGNKREV-CYBMUJFWSA-N 1 1 374.260 2.633 20 5 FFBDMO CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000732034218 734712922 /nfs/dbraw/zinc/71/29/22/734712922.db2.gz DHVMNLBEBGIRAY-GFCCVEGCSA-N 1 1 368.231 2.666 20 5 FFBDMO COc1cc(NC[C@H]2CC[N@H+]2C2CCOCC2)c(Cl)cc1[N+](=O)[O-] ZINC000896525772 735173007 /nfs/dbraw/zinc/17/30/07/735173007.db2.gz OPADDPHGEDTZQT-GFCCVEGCSA-N 1 1 355.822 2.922 20 5 FFBDMO CCN1CCC[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C1=O ZINC000896729535 735181659 /nfs/dbraw/zinc/18/16/59/735181659.db2.gz PZKGPZIUQQSJDE-SNVBAGLBSA-N 1 1 362.249 2.519 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000901135550 735748007 /nfs/dbraw/zinc/74/80/07/735748007.db2.gz ODPGEFWEANLYOW-ZWNOBZJWSA-N 1 1 355.797 2.944 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](Cc3nccs3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000902648685 735975703 /nfs/dbraw/zinc/97/57/03/735975703.db2.gz BVSJYTSSDUTNSL-GFCCVEGCSA-N 1 1 358.427 2.627 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000902648686 735975845 /nfs/dbraw/zinc/97/58/45/735975845.db2.gz BVSJYTSSDUTNSL-LBPRGKRZSA-N 1 1 358.427 2.627 20 5 FFBDMO CCCC[N@H+](CCOC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752793670 736012896 /nfs/dbraw/zinc/01/28/96/736012896.db2.gz RMIMFRNLYYTYDQ-UHFFFAOYSA-N 1 1 350.419 2.543 20 5 FFBDMO CCCC[N@@H+](CCOC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000752793670 736012901 /nfs/dbraw/zinc/01/29/01/736012901.db2.gz RMIMFRNLYYTYDQ-UHFFFAOYSA-N 1 1 350.419 2.543 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761042773 736689668 /nfs/dbraw/zinc/68/96/68/736689668.db2.gz RPYFRXWPBJGYSP-JTQLQIEISA-N 1 1 359.304 2.777 20 5 FFBDMO O=C(N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000764294481 737009436 /nfs/dbraw/zinc/00/94/36/737009436.db2.gz VYDFEWIKKFMILK-GDBMZVCRSA-N 1 1 367.833 2.621 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000913759904 737443859 /nfs/dbraw/zinc/44/38/59/737443859.db2.gz BXRJIGPGHPFKGE-CZUORRHYSA-N 1 1 351.834 2.733 20 5 FFBDMO CN(CC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000768760949 737455567 /nfs/dbraw/zinc/45/55/67/737455567.db2.gz UECPELBXPOQFGJ-UHFFFAOYSA-N 1 1 353.419 2.772 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H](C)C[N@@H+]1C ZINC000769141857 737500486 /nfs/dbraw/zinc/50/04/86/737500486.db2.gz NITRCCSPDXNQTL-BDAKNGLRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@@H](C)C[N@H+]1C ZINC000769141857 737500489 /nfs/dbraw/zinc/50/04/89/737500489.db2.gz NITRCCSPDXNQTL-BDAKNGLRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[N@H+](CCc1ccc(F)cc1)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000919947612 737884042 /nfs/dbraw/zinc/88/40/42/737884042.db2.gz DNNYKOSHYGTMGH-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCc1ccc(F)cc1)Cn1cc(Br)c([N+](=O)[O-])n1 ZINC000919947612 737884045 /nfs/dbraw/zinc/88/40/45/737884045.db2.gz DNNYKOSHYGTMGH-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000923274480 738264770 /nfs/dbraw/zinc/26/47/70/738264770.db2.gz LIDSPGLUJKBAKM-NWDGAFQWSA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000778245027 738366546 /nfs/dbraw/zinc/36/65/46/738366546.db2.gz HGDBKGLQGDVMBJ-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000778245027 738366551 /nfs/dbraw/zinc/36/65/51/738366551.db2.gz HGDBKGLQGDVMBJ-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO CCOCCOCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000787237192 739117104 /nfs/dbraw/zinc/11/71/04/739117104.db2.gz PNVNWLODQQMPHG-UHFFFAOYSA-N 1 1 356.810 2.540 20 5 FFBDMO CCOCCOCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000787237192 739117109 /nfs/dbraw/zinc/11/71/09/739117109.db2.gz PNVNWLODQQMPHG-UHFFFAOYSA-N 1 1 356.810 2.540 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)COC(=O)N1 ZINC000932020607 739374805 /nfs/dbraw/zinc/37/48/05/739374805.db2.gz IJRGEPFFXPYHCJ-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436150 739453753 /nfs/dbraw/zinc/45/37/53/739453753.db2.gz HIGQREOSWFXADM-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436150 739453756 /nfs/dbraw/zinc/45/37/56/739453756.db2.gz HIGQREOSWFXADM-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000790667755 739483648 /nfs/dbraw/zinc/48/36/48/739483648.db2.gz FNEYGTCMFVZDJJ-LBPRGKRZSA-N 1 1 355.797 2.530 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000933980295 739714829 /nfs/dbraw/zinc/71/48/29/739714829.db2.gz DUAZNKAZYXJXSF-QGZVFWFLSA-N 1 1 362.455 2.887 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000793309813 739765327 /nfs/dbraw/zinc/76/53/27/739765327.db2.gz RQAWTTOZGGFINA-ZDUSSCGKSA-N 1 1 350.488 2.778 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000935685971 739994407 /nfs/dbraw/zinc/99/44/07/739994407.db2.gz JBODGVCAQPCLOC-KBPBESRZSA-N 1 1 353.419 2.575 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+]C1(C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000940107334 740147007 /nfs/dbraw/zinc/14/70/07/740147007.db2.gz IYZRXAZVOXIFFO-CZUORRHYSA-N 1 1 365.861 2.784 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000801551590 740629763 /nfs/dbraw/zinc/62/97/63/740629763.db2.gz OVNZKMYTYHMACL-GFCCVEGCSA-N 1 1 361.236 2.575 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000804381437 740867540 /nfs/dbraw/zinc/86/75/40/740867540.db2.gz MQLOFVAGRNEBDO-SECBINFHSA-N 1 1 374.210 2.663 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000804381437 740867544 /nfs/dbraw/zinc/86/75/44/740867544.db2.gz MQLOFVAGRNEBDO-SECBINFHSA-N 1 1 374.210 2.663 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H](C)C1 ZINC000809982020 741369393 /nfs/dbraw/zinc/36/93/93/741369393.db2.gz FOBHJCXRQWGUNY-GHMZBOCLSA-N 1 1 362.257 2.789 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCn2cnc(Br)n2)C2CC2)cc1 ZINC000821402487 742622032 /nfs/dbraw/zinc/62/20/32/742622032.db2.gz UNVZECUDFSXXKT-UHFFFAOYSA-N 1 1 366.219 2.613 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3c(Br)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000827216705 743535434 /nfs/dbraw/zinc/53/54/34/743535434.db2.gz CNUKZOBDCKAFTH-CMPLNLGQSA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827308978 743552780 /nfs/dbraw/zinc/55/27/80/743552780.db2.gz DTXHRFONAXZOLO-GXFFZTMASA-N 1 1 357.332 2.780 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H]1C1CCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000830219135 745325454 /nfs/dbraw/zinc/32/54/54/745325454.db2.gz HVXQPZBGKSZOSF-INIZCTEOSA-N 1 1 351.378 2.563 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F ZINC000830744950 745424029 /nfs/dbraw/zinc/42/40/29/745424029.db2.gz ZSYBASMRVRZXCK-UHFFFAOYSA-N 1 1 352.341 2.849 20 5 FFBDMO O=C(CC[N@H+]1CCSC[C@@H]1C1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000831778966 745582850 /nfs/dbraw/zinc/58/28/50/745582850.db2.gz ZCPDJCXELDNXPB-OAHLLOKOSA-N 1 1 353.419 2.890 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1Cl ZINC000834598238 745864779 /nfs/dbraw/zinc/86/47/79/745864779.db2.gz JVVHCJBCQZOZID-KBPBESRZSA-N 1 1 355.797 2.815 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000839105069 746775762 /nfs/dbraw/zinc/77/57/62/746775762.db2.gz OEICIYCKWSHDSF-YJBOKZPZSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000839532338 746848685 /nfs/dbraw/zinc/84/86/85/746848685.db2.gz WQEYIRSHFRGJFY-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@@H]1C ZINC000839580945 746861216 /nfs/dbraw/zinc/86/12/16/746861216.db2.gz OVMIDZVRKGFZLE-MWLCHTKSSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@@H]1C ZINC000839580945 746861223 /nfs/dbraw/zinc/86/12/23/746861223.db2.gz OVMIDZVRKGFZLE-MWLCHTKSSA-N 1 1 357.204 2.741 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C[C@H](C)O1 ZINC000843981747 747944907 /nfs/dbraw/zinc/94/49/07/747944907.db2.gz SNTQARSWTLMQND-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000844902200 748131998 /nfs/dbraw/zinc/13/19/98/748131998.db2.gz KZGIVXHBXUNEKP-QEORTHHSSA-N 1 1 353.850 2.967 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NCCNc2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC000503411913 814827325 /nfs/dbraw/zinc/82/73/25/814827325.db2.gz JUOHBLKDUMHSCJ-UHFFFAOYSA-N 1 1 372.429 2.512 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(N[C@H]3CC[N@@H+](Cc4ccccc4)C3)cc2N1 ZINC000312812354 972007217 /nfs/dbraw/zinc/00/72/17/972007217.db2.gz RRMQAFKVCJJYTI-AWEZNQCLSA-N 1 1 368.393 2.612 20 5 FFBDMO Cc1ccc(-c2ccc(N3CCc4[nH+]ccn4CC3)nn2)cc1[N+](=O)[O-] ZINC001167180739 960366148 /nfs/dbraw/zinc/36/61/48/960366148.db2.gz QKKZBSYRGHBPGD-UHFFFAOYSA-N 1 1 350.382 2.619 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872274722 1013195730 /nfs/dbraw/zinc/19/57/30/1013195730.db2.gz APKZNZULFQRJTK-AEFFLSMTSA-N 1 1 364.442 2.758 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000872286590 1013200113 /nfs/dbraw/zinc/20/01/13/1013200113.db2.gz LULZHGRLEBQOKL-PKOBYXMFSA-N 1 1 361.442 2.719 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCCN1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC001174994053 1013358922 /nfs/dbraw/zinc/35/89/22/1013358922.db2.gz PWBHLFUWQNGKSA-ROUUACIJSA-N 1 1 353.422 2.932 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3cc([N+](=O)[O-])ccc3F)c2C(N)=O)C1 ZINC001175735760 1013546690 /nfs/dbraw/zinc/54/66/90/1013546690.db2.gz KBHJFQGVHUGADG-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3cc([N+](=O)[O-])ccc3F)c2C(N)=O)C1 ZINC001175735760 1013546700 /nfs/dbraw/zinc/54/67/00/1013546700.db2.gz KBHJFQGVHUGADG-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO O=[N+]([O-])c1ncccc1CN1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176262225 1013672652 /nfs/dbraw/zinc/67/26/52/1013672652.db2.gz IKUIOSLVRVNCSI-MJGOQNOKSA-N 1 1 352.438 2.944 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000176734475 966800410 /nfs/dbraw/zinc/80/04/10/966800410.db2.gz VJJJRZXKUHTSIY-UHFFFAOYSA-N 1 1 357.385 2.830 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000176734475 966800418 /nfs/dbraw/zinc/80/04/18/966800418.db2.gz VJJJRZXKUHTSIY-UHFFFAOYSA-N 1 1 357.385 2.830 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(F)cc(C)c2[N+](=O)[O-])cn1 ZINC000176782007 967455785 /nfs/dbraw/zinc/45/57/85/967455785.db2.gz CBHWJZNEAFVGRS-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001176676129 1013750399 /nfs/dbraw/zinc/75/03/99/1013750399.db2.gz UPUVUHKAKZKTEN-KRWDZBQOSA-N 1 1 352.435 2.625 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc(CC(=O)OCC)cc2[N+](=O)[O-])C1 ZINC000825791133 1014026183 /nfs/dbraw/zinc/02/61/83/1014026183.db2.gz ZWAMYQMFRIPQDI-MRXNPFEDSA-N 1 1 363.458 2.869 20 5 FFBDMO C[C@]1([C@H]2CCCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)COC(=O)N1 ZINC000895531843 970707533 /nfs/dbraw/zinc/70/75/33/970707533.db2.gz MNFNGXJDMZTYAU-KPZWWZAWSA-N 1 1 356.382 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3ccccc3N3CCOCC3)nc2c1 ZINC000876978625 1014438543 /nfs/dbraw/zinc/43/85/43/1014438543.db2.gz SBPMZCIKMMKUAW-UHFFFAOYSA-N 1 1 368.393 2.862 20 5 FFBDMO CC/C=C\CC[NH2+]C[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001105423346 979413205 /nfs/dbraw/zinc/41/32/05/979413205.db2.gz OYGBXXMYLCHMKS-MIRROOGISA-N 1 1 371.481 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn(C[C@@H]4CCCO4)nn3)C2)cc1 ZINC000877565357 1014629475 /nfs/dbraw/zinc/62/94/75/1014629475.db2.gz GCIZIAGUSHMIAE-APWZRJJASA-N 1 1 371.441 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn(C[C@@H]4CCCO4)nn3)C2)cc1 ZINC000877565357 1014629482 /nfs/dbraw/zinc/62/94/82/1014629482.db2.gz GCIZIAGUSHMIAE-APWZRJJASA-N 1 1 371.441 2.745 20 5 FFBDMO CCc1cccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001029964224 980152614 /nfs/dbraw/zinc/15/26/14/980152614.db2.gz AHGICPGQOZMPGA-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1cccc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964224 980152620 /nfs/dbraw/zinc/15/26/20/980152620.db2.gz AHGICPGQOZMPGA-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1cccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964224 980152623 /nfs/dbraw/zinc/15/26/23/980152623.db2.gz AHGICPGQOZMPGA-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO COCCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC[NH+](C)CC1 ZINC000877664297 1014666293 /nfs/dbraw/zinc/66/62/93/1014666293.db2.gz MGDHDWVZDCHRPQ-UHFFFAOYSA-N 1 1 362.430 2.526 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687929 1014681645 /nfs/dbraw/zinc/68/16/45/1014681645.db2.gz NXOZDLCCOBCNAC-DLBZAZTESA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687929 1014681651 /nfs/dbraw/zinc/68/16/51/1014681651.db2.gz NXOZDLCCOBCNAC-DLBZAZTESA-N 1 1 354.410 2.599 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2cc(C(=O)OC(C)(C)C)nn2C)cc1[N+](=O)[O-] ZINC000877729906 1014700975 /nfs/dbraw/zinc/70/09/75/1014700975.db2.gz FNPHJEJWONPVCK-UHFFFAOYSA-N 1 1 360.414 2.882 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000729682644 981284603 /nfs/dbraw/zinc/28/46/03/981284603.db2.gz XMGAVQZKDDUZJF-QGZVFWFLSA-N 1 1 371.437 2.976 20 5 FFBDMO COc1cc(CN[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000729682644 981284609 /nfs/dbraw/zinc/28/46/09/981284609.db2.gz XMGAVQZKDDUZJF-QGZVFWFLSA-N 1 1 371.437 2.976 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000897536124 981638290 /nfs/dbraw/zinc/63/82/90/981638290.db2.gz INOKEBHDYCUMLS-JCGIZDLHSA-N 1 1 358.442 2.949 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)[C@@H](C)C1 ZINC000910293605 981901553 /nfs/dbraw/zinc/90/15/53/981901553.db2.gz PJBDAGWMYFLULO-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@H+]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000898034994 982600011 /nfs/dbraw/zinc/60/00/11/982600011.db2.gz GADSGMXGXZWBFG-QGZVFWFLSA-N 1 1 357.458 2.739 20 5 FFBDMO CCOCCO[C@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000138485085 982725921 /nfs/dbraw/zinc/72/59/21/982725921.db2.gz ZALFZMQNVXYXGU-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO CCOCCO[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000138485085 982725925 /nfs/dbraw/zinc/72/59/25/982725925.db2.gz ZALFZMQNVXYXGU-SFHVURJKSA-N 1 1 360.414 2.543 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878259045 1014953466 /nfs/dbraw/zinc/95/34/66/1014953466.db2.gz XYNQIUFVOSGHPH-UKRRQHHQSA-N 1 1 359.430 2.807 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000763852948 983863264 /nfs/dbraw/zinc/86/32/64/983863264.db2.gz FYSCSXVCNQZCBW-CQSZACIVSA-N 1 1 358.398 2.812 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC1CC1)Cn1nc(C)c2cc([N+](=O)[O-])ccc21 ZINC000764924622 984817461 /nfs/dbraw/zinc/81/74/61/984817461.db2.gz KTFKODYYLFTSRQ-UHFFFAOYSA-N 1 1 360.414 2.876 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000172951487 985722810 /nfs/dbraw/zinc/72/28/10/985722810.db2.gz CRBMRZOKJOSDBU-HNNXBMFYSA-N 1 1 361.398 2.884 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000172951487 985722818 /nfs/dbraw/zinc/72/28/18/985722818.db2.gz CRBMRZOKJOSDBU-HNNXBMFYSA-N 1 1 361.398 2.884 20 5 FFBDMO Cc1[nH+]ccn1CCCc1nc(CCNc2ccccc2[N+](=O)[O-])no1 ZINC000761970461 988015040 /nfs/dbraw/zinc/01/50/40/988015040.db2.gz SQTAEGCDRJRPJI-UHFFFAOYSA-N 1 1 356.386 2.770 20 5 FFBDMO C[C@H]1CC2(CCC2)C[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000762147240 988154193 /nfs/dbraw/zinc/15/41/93/988154193.db2.gz XXBMDPXQKYFKLW-SCLBCKFNSA-N 1 1 372.425 2.584 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC2)CC1 ZINC000879250851 1015438727 /nfs/dbraw/zinc/43/87/27/1015438727.db2.gz KCOYBSKVAHANIA-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CN1 ZINC000125843951 989015009 /nfs/dbraw/zinc/01/50/09/989015009.db2.gz ZASXSHDYHKKIPJ-RHSMWYFYSA-N 1 1 370.409 2.740 20 5 FFBDMO Cc1ccc(CCC[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035704796 990528603 /nfs/dbraw/zinc/52/86/03/990528603.db2.gz YQXIZYBMJKHFAN-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879575103 1015592480 /nfs/dbraw/zinc/59/24/80/1015592480.db2.gz GONKOHABASDEKG-IVMMDQJWSA-N 1 1 357.414 2.732 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@H+]1CCc2ccccc2C1 ZINC000921161645 990991070 /nfs/dbraw/zinc/99/10/70/990991070.db2.gz UAINPAQGYHBMNZ-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)COc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC001116090762 1032121897 /nfs/dbraw/zinc/12/18/97/1032121897.db2.gz BJZVXDDJRPXCIO-MRXNPFEDSA-N 1 1 370.409 2.780 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184481540 992778336 /nfs/dbraw/zinc/77/83/36/992778336.db2.gz BRQKVODVEXURBL-GOEBONIOSA-N 1 1 368.437 2.960 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)c1 ZINC000811800397 995257051 /nfs/dbraw/zinc/25/70/51/995257051.db2.gz QNAOTFAHYZMVFM-SFHVURJKSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)c1 ZINC000811800397 995257063 /nfs/dbraw/zinc/25/70/63/995257063.db2.gz QNAOTFAHYZMVFM-SFHVURJKSA-N 1 1 352.398 2.868 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000747828597 995573492 /nfs/dbraw/zinc/57/34/92/995573492.db2.gz GVNYXLPGNJUNNK-HZPDHXFCSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000823994015 996773627 /nfs/dbraw/zinc/77/36/27/996773627.db2.gz NBMYQENUGKWEOB-ZDUSSCGKSA-N 1 1 357.414 2.819 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825183636 997242353 /nfs/dbraw/zinc/24/23/53/997242353.db2.gz OTRBFZXRTHKGGQ-LJQANCHMSA-N 1 1 371.437 2.785 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000825198610 997272361 /nfs/dbraw/zinc/27/23/61/997272361.db2.gz IFVYHEYKEAJAOS-MRXNPFEDSA-N 1 1 355.394 2.704 20 5 FFBDMO CCc1cccc(NC(=O)C[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000732230899 998563205 /nfs/dbraw/zinc/56/32/05/998563205.db2.gz UUXLZYJNMNOPRO-UHFFFAOYSA-N 1 1 373.409 2.903 20 5 FFBDMO O=C(Oc1cccc(C[N@H+]2CCc3ccccc3C2)c1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC000845719430 998636031 /nfs/dbraw/zinc/63/60/31/998636031.db2.gz BAVKLOSDCFBOQN-RTBURBONSA-N 1 1 352.390 2.816 20 5 FFBDMO O=C(Oc1cccc(C[N@@H+]2CCc3ccccc3C2)c1)[C@@H]1CC1[N+](=O)[O-] ZINC000845719430 998636037 /nfs/dbraw/zinc/63/60/37/998636037.db2.gz BAVKLOSDCFBOQN-RTBURBONSA-N 1 1 352.390 2.816 20 5 FFBDMO O=C(Oc1cccc(C[N@H+]2CCc3ccccc3C2)c1)[C@@H]1CC1[N+](=O)[O-] ZINC000845719430 998636042 /nfs/dbraw/zinc/63/60/42/998636042.db2.gz BAVKLOSDCFBOQN-RTBURBONSA-N 1 1 352.390 2.816 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000845733428 998640211 /nfs/dbraw/zinc/64/02/11/998640211.db2.gz ARKAULCFYDSCMD-MRXNPFEDSA-N 1 1 358.398 2.810 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cc1C ZINC001000156502 1016250967 /nfs/dbraw/zinc/25/09/67/1016250967.db2.gz ZQOWRGNEKHOKTL-RTBURBONSA-N 1 1 371.481 2.829 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000803860685 1016248006 /nfs/dbraw/zinc/24/80/06/1016248006.db2.gz PLCBQBLNZWRUPG-HNNXBMFYSA-N 1 1 364.398 2.769 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])c2nonc21 ZINC000733190235 998916240 /nfs/dbraw/zinc/91/62/40/998916240.db2.gz BLWUMFGAYURMKK-CYBMUJFWSA-N 1 1 353.382 2.842 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2nc3ccccn3c2[N+](=O)[O-])[C@H](C)C1 ZINC000734483330 999295136 /nfs/dbraw/zinc/29/51/36/999295136.db2.gz YSZLMUOOXCPPMD-HUUCEWRRSA-N 1 1 361.446 2.791 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000737417582 999710943 /nfs/dbraw/zinc/71/09/43/999710943.db2.gz MOTIHCRWPGSJJQ-UHFFFAOYSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000745090079 999892017 /nfs/dbraw/zinc/89/20/17/999892017.db2.gz UNPRZFOHWOZOBV-XJKSGUPXSA-N 1 1 363.414 2.585 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC3(CC2)CN(Cc2ccccc2)CCO3)C1 ZINC001169019596 1000017424 /nfs/dbraw/zinc/01/74/24/1000017424.db2.gz GSNAMIYUYWHECH-WOJBJXKFSA-N 1 1 373.497 2.799 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169026971 1000018479 /nfs/dbraw/zinc/01/84/79/1000018479.db2.gz ZKMNCYJJLSMMCP-VXIBKDFQSA-N 1 1 361.442 2.529 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)c1 ZINC001169150970 1000027845 /nfs/dbraw/zinc/02/78/45/1000027845.db2.gz XSZPUUZHLCNTKV-SFHVURJKSA-N 1 1 371.412 2.976 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001169503741 1000054040 /nfs/dbraw/zinc/05/40/40/1000054040.db2.gz LMIYVMYVBNJWBN-QAPCUYQASA-N 1 1 370.409 2.861 20 5 FFBDMO CC(C)[N@@H+](C)[C@H]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C1 ZINC001157021916 1001332135 /nfs/dbraw/zinc/33/21/35/1001332135.db2.gz RZUQGGWEYPEXJV-QMMMGPOBSA-N 1 1 367.759 2.976 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000787391058 1001689715 /nfs/dbraw/zinc/68/97/15/1001689715.db2.gz RBCOEOHQODZYAH-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000787391058 1001689717 /nfs/dbraw/zinc/68/97/17/1001689717.db2.gz RBCOEOHQODZYAH-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000774728530 1002530974 /nfs/dbraw/zinc/53/09/74/1002530974.db2.gz ANLFLLSVWOEDMT-UHFFFAOYSA-N 1 1 370.409 2.706 20 5 FFBDMO C[C@H](CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC001184839251 1002734002 /nfs/dbraw/zinc/73/40/02/1002734002.db2.gz FOODNWFTRLULNS-UONOGXRCSA-N 1 1 358.442 2.979 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)c1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001185421513 1002938619 /nfs/dbraw/zinc/93/86/19/1002938619.db2.gz WZAZKUIHOVDYGF-LBPRGKRZSA-N 1 1 359.386 2.829 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)[C@@H]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170354374 1003121364 /nfs/dbraw/zinc/12/13/64/1003121364.db2.gz JVJNEBXINALODY-UKRRQHHQSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1ccc(C[C@H](C)N2CC([NH+]3CCC(F)(F)CC3)C2)c([N+](=O)[O-])c1 ZINC001170347164 1003133843 /nfs/dbraw/zinc/13/38/43/1003133843.db2.gz QYOLAQZXEQXGCC-ZDUSSCGKSA-N 1 1 369.412 2.950 20 5 FFBDMO CCN1C[C@H](C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)Oc2ccccc21 ZINC000776277793 1005336307 /nfs/dbraw/zinc/33/63/07/1005336307.db2.gz SGYFBKCSWIFCGJ-PKOBYXMFSA-N 1 1 371.437 2.848 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001050325677 1016968003 /nfs/dbraw/zinc/96/80/03/1016968003.db2.gz KLTSGBVRULWJJS-GFOCRRMGSA-N 1 1 363.433 2.564 20 5 FFBDMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(Cl)cc(Cl)c1 ZINC001490192843 1005671067 /nfs/dbraw/zinc/67/10/67/1005671067.db2.gz HGIIVUNWFRFUFZ-ZIAGYGMSSA-N 1 1 360.241 2.597 20 5 FFBDMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(Cl)cc(Cl)c1 ZINC001490192843 1005671068 /nfs/dbraw/zinc/67/10/68/1005671068.db2.gz HGIIVUNWFRFUFZ-ZIAGYGMSSA-N 1 1 360.241 2.597 20 5 FFBDMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(Cl)cc(Cl)c1 ZINC001490192843 1005671070 /nfs/dbraw/zinc/67/10/70/1005671070.db2.gz HGIIVUNWFRFUFZ-ZIAGYGMSSA-N 1 1 360.241 2.597 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCCC2CCC2)CC1 ZINC001490616635 1005745631 /nfs/dbraw/zinc/74/56/31/1005745631.db2.gz JHQOOMZJHRWSIP-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO Cc1noc(C[NH+]2CCC(CN(C)C(=O)OC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000851752105 1005911411 /nfs/dbraw/zinc/91/14/11/1005911411.db2.gz ZEEFNEVKJUARPM-UHFFFAOYSA-N 1 1 368.434 2.970 20 5 FFBDMO CO[C@H]1CC[C@@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000851935800 1005924536 /nfs/dbraw/zinc/92/45/36/1005924536.db2.gz SNPUZCUKLCVTRN-HIFRSBDPSA-N 1 1 359.430 2.551 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1[N+](=O)[O-] ZINC000851938790 1005924750 /nfs/dbraw/zinc/92/47/50/1005924750.db2.gz YRYLFVJBLYROPX-QGZVFWFLSA-N 1 1 366.418 2.724 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c1[N+](=O)[O-] ZINC000851938790 1005924751 /nfs/dbraw/zinc/92/47/51/1005924751.db2.gz YRYLFVJBLYROPX-QGZVFWFLSA-N 1 1 366.418 2.724 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580730 1005961128 /nfs/dbraw/zinc/96/11/28/1005961128.db2.gz ZHVKUBLQBCEJRC-LESCRADOSA-N 1 1 363.458 2.645 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852306407 1005969611 /nfs/dbraw/zinc/96/96/11/1005969611.db2.gz DQDOSASPDLHYCE-OAHLLOKOSA-N 1 1 367.446 2.863 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN(Cc3cccc4c3CC[NH2+]C4)CC2)cc1 ZINC000852742497 1006164581 /nfs/dbraw/zinc/16/45/81/1006164581.db2.gz IMPOMMQAQKUAAI-UHFFFAOYSA-N 1 1 352.438 2.563 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000110991790 1006247232 /nfs/dbraw/zinc/24/72/32/1006247232.db2.gz UJGWOKUOEMPRBL-CYBMUJFWSA-N 1 1 364.402 2.724 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@H]1CC[C@@H](C)C1 ZINC000853507862 1006421262 /nfs/dbraw/zinc/42/12/62/1006421262.db2.gz CHSCVPGGFXIYEQ-CABCVRRESA-N 1 1 359.430 2.948 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC001189997668 1007417285 /nfs/dbraw/zinc/41/72/85/1007417285.db2.gz RXDSCSBXJAPLIO-HNNXBMFYSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000817179808 1007458705 /nfs/dbraw/zinc/45/87/05/1007458705.db2.gz STBOGSXQWRFLHO-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000817178665 1007458916 /nfs/dbraw/zinc/45/89/16/1007458916.db2.gz FJYCSBCCPILXET-UHFFFAOYSA-N 1 1 356.378 2.784 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000855809690 1007575124 /nfs/dbraw/zinc/57/51/24/1007575124.db2.gz JODKZHHZZUZBQB-CYBMUJFWSA-N 1 1 365.405 2.636 20 5 FFBDMO CC(C)c1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000885882248 1007819561 /nfs/dbraw/zinc/81/95/61/1007819561.db2.gz GKJYTANMRNAWKJ-MRXNPFEDSA-N 1 1 361.442 2.701 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ncc([N+](=O)[O-])cc3C)C2)ccn1 ZINC000856533878 1007873166 /nfs/dbraw/zinc/87/31/66/1007873166.db2.gz QNZYYQSCOUCMNA-GOSISDBHSA-N 1 1 371.441 2.803 20 5 FFBDMO N[C@@H](CCC[NH3+])Nc1ccc2ccc3ccc(Br)nc3c2n1 ZINC001170900125 1007899697 /nfs/dbraw/zinc/89/96/97/1007899697.db2.gz IQENUZZNBSSTGK-CYBMUJFWSA-N 1 1 360.259 2.981 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC000858036585 1008285426 /nfs/dbraw/zinc/28/54/26/1008285426.db2.gz PAIBJSCZWZGLOO-INIZCTEOSA-N 1 1 373.409 2.839 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000858780249 1008422744 /nfs/dbraw/zinc/42/27/44/1008422744.db2.gz LMRKATUNWBRKIJ-CQSZACIVSA-N 1 1 364.402 2.733 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(C(=O)N(C)C)c1 ZINC001177240582 1008534346 /nfs/dbraw/zinc/53/43/46/1008534346.db2.gz LRLZVSIWMNYLHE-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000823765508 1009218745 /nfs/dbraw/zinc/21/87/45/1009218745.db2.gz NPLPMJKXOCUFAC-SJLPKXTDSA-N 1 1 373.409 2.565 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126475809 1009232263 /nfs/dbraw/zinc/23/22/63/1009232263.db2.gz ZVKWAYUNOHOWNL-PXAZEXFGSA-N 1 1 374.397 2.592 20 5 FFBDMO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C[C@@H]2CCOC2)CC1 ZINC000866270174 1010966950 /nfs/dbraw/zinc/96/69/50/1010966950.db2.gz SOQOJBIFWLFPHK-GJZGRUSLSA-N 1 1 365.449 2.755 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000867031703 1011925674 /nfs/dbraw/zinc/92/56/74/1011925674.db2.gz VRPFWCVPEUYINF-QFBILLFUSA-N 1 1 357.385 2.838 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000867031701 1011925849 /nfs/dbraw/zinc/92/58/49/1011925849.db2.gz VRPFWCVPEUYINF-APWZRJJASA-N 1 1 357.385 2.838 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC[C@H]1O ZINC001173009937 1012178921 /nfs/dbraw/zinc/17/89/21/1012178921.db2.gz KHCVIHFETVZBEJ-SJKOYZFVSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@H]1COCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010630 1012182158 /nfs/dbraw/zinc/18/21/58/1012182158.db2.gz WNVLQRYIVXKJCK-GFCCVEGCSA-N 1 1 355.385 2.810 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@@H](CCO)C3)CC2)c(F)c1 ZINC001173014757 1012184899 /nfs/dbraw/zinc/18/48/99/1012184899.db2.gz AJHCZPMAVNHGSB-ZDUSSCGKSA-N 1 1 369.412 2.936 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCCC34COC4)CC2)c(F)c1 ZINC001173018425 1012189986 /nfs/dbraw/zinc/18/99/86/1012189986.db2.gz STYRHYFYHUQDFX-UHFFFAOYSA-N 1 1 353.369 2.707 20 5 FFBDMO COC(=O)C1CC[NH+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173180750 1012324353 /nfs/dbraw/zinc/32/43/53/1012324353.db2.gz MQIZFAJFLVOWKR-LLVKDONJSA-N 1 1 354.378 2.559 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CCN2c2ncccn2)C1 ZINC001173222940 1012354977 /nfs/dbraw/zinc/35/49/77/1012354977.db2.gz DQNYTBZKAOSCHU-DNVCBOLYSA-N 1 1 353.426 2.671 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001173224442 1012359371 /nfs/dbraw/zinc/35/93/71/1012359371.db2.gz FWOVRMCFNQYBJR-DYESRHJHSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001173224442 1012359386 /nfs/dbraw/zinc/35/93/86/1012359386.db2.gz FWOVRMCFNQYBJR-DYESRHJHSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001173224442 1012359399 /nfs/dbraw/zinc/35/93/99/1012359399.db2.gz FWOVRMCFNQYBJR-DYESRHJHSA-N 1 1 369.465 2.705 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@H]1Cc1cnn(C)c1 ZINC001173230270 1012363487 /nfs/dbraw/zinc/36/34/87/1012363487.db2.gz ZPZVOBPARNVQKB-XPGWFJOJSA-N 1 1 372.469 2.981 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](C3OCCO3)C2)c(Br)c1 ZINC000718981032 1012535441 /nfs/dbraw/zinc/53/54/41/1012535441.db2.gz SAAQWHPHGHPQRN-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870863289 1012609206 /nfs/dbraw/zinc/60/92/06/1012609206.db2.gz XWKQVVODOXSQQC-PKOBYXMFSA-N 1 1 373.384 2.508 20 5 FFBDMO C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1 ZINC000870873418 1012614827 /nfs/dbraw/zinc/61/48/27/1012614827.db2.gz CSIAIUJQUYUPRF-LXGCGDOSSA-N 1 1 369.421 2.757 20 5 FFBDMO Cc1ccccc1[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1 ZINC000870893714 1012623790 /nfs/dbraw/zinc/62/37/90/1012623790.db2.gz TWYCMWLTYQZCET-UYAOXDASSA-N 1 1 369.421 2.677 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c(N2CCCC2)[nH+]1 ZINC000801950048 1019533744 /nfs/dbraw/zinc/53/37/44/1019533744.db2.gz GDXHLOZYNSQVTQ-UHFFFAOYSA-N 1 1 373.388 2.550 20 5 FFBDMO CCOc1cc(N2CCN(Cc3[nH]c(C)[nH+]c3C)CC2)ccc1[N+](=O)[O-] ZINC000930284885 1019962722 /nfs/dbraw/zinc/96/27/22/1019962722.db2.gz GZXURFYDSABABS-UHFFFAOYSA-N 1 1 359.430 2.656 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505650 1020062659 /nfs/dbraw/zinc/06/26/59/1020062659.db2.gz UWNFOACSADQXAZ-IRXDYDNUSA-N 1 1 371.462 2.934 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505650 1020062668 /nfs/dbraw/zinc/06/26/68/1020062668.db2.gz UWNFOACSADQXAZ-IRXDYDNUSA-N 1 1 371.462 2.934 20 5 FFBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726586212 1020488489 /nfs/dbraw/zinc/48/84/89/1020488489.db2.gz IPFBARIZDAXWIR-UONOGXRCSA-N 1 1 360.414 2.831 20 5 FFBDMO COCCOc1ncccc1C[NH2+][C@H](C)c1cc(OC)cc([N+](=O)[O-])c1 ZINC000903068804 1020661165 /nfs/dbraw/zinc/66/11/65/1020661165.db2.gz NBBFOGMOCZPQFM-CYBMUJFWSA-N 1 1 361.398 2.874 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932136890 1020716238 /nfs/dbraw/zinc/71/62/38/1020716238.db2.gz LOACDOBSFOVLLT-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932136890 1020716246 /nfs/dbraw/zinc/71/62/46/1020716246.db2.gz LOACDOBSFOVLLT-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000749598922 1021012070 /nfs/dbraw/zinc/01/20/70/1021012070.db2.gz MKUFGURELPZJQY-OAHLLOKOSA-N 1 1 360.458 2.655 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@H]2OCCc3ccccc32)c2ncc([N+](=O)[O-])cc12 ZINC000749949804 1021159095 /nfs/dbraw/zinc/15/90/95/1021159095.db2.gz ZGDMFMGJJGUDGD-GOSISDBHSA-N 1 1 367.409 2.851 20 5 FFBDMO Cc1nn(C[N@@H+](C)C[C@H]2OCCc3ccccc32)c2ncc([N+](=O)[O-])cc12 ZINC000749949804 1021159098 /nfs/dbraw/zinc/15/90/98/1021159098.db2.gz ZGDMFMGJJGUDGD-GOSISDBHSA-N 1 1 367.409 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c1 ZINC000934268177 1021182647 /nfs/dbraw/zinc/18/26/47/1021182647.db2.gz HUPNVVBJILCONI-HOTGVXAUSA-N 1 1 373.375 2.645 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1Cc2ncccc2N2CCC[C@H]2C1 ZINC000934492242 1021259281 /nfs/dbraw/zinc/25/92/81/1021259281.db2.gz SELVJTURPRUCCL-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000750056642 1021284379 /nfs/dbraw/zinc/28/43/79/1021284379.db2.gz YNPLNVLMPJXANG-GOSISDBHSA-N 1 1 358.394 2.694 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000934836969 1021421962 /nfs/dbraw/zinc/42/19/62/1021421962.db2.gz GUIPBEFTCXMJCB-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000047213895 1022526320 /nfs/dbraw/zinc/52/63/20/1022526320.db2.gz FIQJVQABTVAGQX-HNNXBMFYSA-N 1 1 362.474 2.903 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000751935428 1022982091 /nfs/dbraw/zinc/98/20/91/1022982091.db2.gz VXNLYOZSQXXCAF-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000075005595 1022987122 /nfs/dbraw/zinc/98/71/22/1022987122.db2.gz UCVSVSLHMPNIGH-AWEZNQCLSA-N 1 1 365.430 2.915 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(CN3CCNC[C@]4(CCCC[NH2+]4)C3)nc12 ZINC001222683724 1033111835 /nfs/dbraw/zinc/11/18/35/1033111835.db2.gz AAFVUIATHRWWNA-JOCHJYFZSA-N 1 1 361.493 2.701 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803953 1023208574 /nfs/dbraw/zinc/20/85/74/1023208574.db2.gz PFBZYUVUBIGGKA-RISCZKNCSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803953 1023208577 /nfs/dbraw/zinc/20/85/77/1023208577.db2.gz PFBZYUVUBIGGKA-RISCZKNCSA-N 1 1 367.450 2.601 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351091 1033113544 /nfs/dbraw/zinc/11/35/44/1033113544.db2.gz SRNHDZKCHZBUFO-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351091 1033113551 /nfs/dbraw/zinc/11/35/51/1033113551.db2.gz SRNHDZKCHZBUFO-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC001122957992 1023573510 /nfs/dbraw/zinc/57/35/10/1023573510.db2.gz LBOKDAYSAUWKOT-PBHICJAKSA-N 1 1 372.425 2.554 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001121200895 1023647239 /nfs/dbraw/zinc/64/72/39/1023647239.db2.gz YXWALRDAPKQGHE-UHTWSYAYSA-N 1 1 369.874 2.797 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC001123274497 1023717462 /nfs/dbraw/zinc/71/74/62/1023717462.db2.gz HSZQFMQFAUHFHT-LBPRGKRZSA-N 1 1 350.419 2.845 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)NC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000837135170 1025605588 /nfs/dbraw/zinc/60/55/88/1025605588.db2.gz PIVJVGIIVIXTKV-PEZBUJJGSA-N 1 1 374.485 2.530 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H]2C[C@H](C)C[N@@H+](Cc3ccccc3)C2)n1 ZINC000839091966 1026584637 /nfs/dbraw/zinc/58/46/37/1026584637.db2.gz VCSSNFFYHUAMQU-GOEBONIOSA-N 1 1 372.425 2.879 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C(N)=O)[C@@H](c2ccccc2)C1 ZINC000839640209 1026769785 /nfs/dbraw/zinc/76/97/85/1026769785.db2.gz ICLNPMNWCLYKAY-MSOLQXFVSA-N 1 1 369.421 2.694 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000840116299 1026962918 /nfs/dbraw/zinc/96/29/18/1026962918.db2.gz OAKLXBMMMKTGTO-YEWFCNIMSA-N 1 1 351.410 2.955 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000840230824 1027013452 /nfs/dbraw/zinc/01/34/52/1027013452.db2.gz LRXVIFMRVRTZLF-LBPRGKRZSA-N 1 1 359.382 2.880 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)C(C)(C)C[NH+]1CCOCC1 ZINC000840568253 1027118988 /nfs/dbraw/zinc/11/89/88/1027118988.db2.gz KCTRXMIDLUQDPL-SQFISAMPSA-N 1 1 361.442 2.567 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3nc(Cl)ncc3[N+](=O)[O-])C2)c1 ZINC001161186719 1028054236 /nfs/dbraw/zinc/05/42/36/1028054236.db2.gz FLWGFECYORSMAO-LBPRGKRZSA-N 1 1 363.805 2.733 20 5 FFBDMO CC(C)[C@@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000780497737 1028715422 /nfs/dbraw/zinc/71/54/22/1028715422.db2.gz MMSDLJTWPBEKNA-KUHUBIRLSA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)Oc1ccnc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)n1 ZINC001163263582 1028858731 /nfs/dbraw/zinc/85/87/31/1028858731.db2.gz GRSYDJDDMJXQHB-SOFGYWHQSA-N 1 1 358.402 2.711 20 5 FFBDMO COc1nc(N2CC[NH+](C[C@@H](OC)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001155705255 1028859647 /nfs/dbraw/zinc/85/96/47/1028859647.db2.gz CIOKKERTZQBJOU-QGZVFWFLSA-N 1 1 372.425 2.508 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cccc(F)c2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494621 1029298809 /nfs/dbraw/zinc/29/88/09/1029298809.db2.gz PDJRKIUJXYWTEI-TZMCWYRMSA-N 1 1 369.824 2.520 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000781736106 1029382035 /nfs/dbraw/zinc/38/20/35/1029382035.db2.gz VMTFMHXKHCNLGT-CQSZACIVSA-N 1 1 365.386 2.853 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cc(Cl)cc([N+](=O)[O-])n2)CC1 ZINC001165107089 1029391905 /nfs/dbraw/zinc/39/19/05/1029391905.db2.gz FGFXFUQQTUEUPF-AWEZNQCLSA-N 1 1 354.838 2.723 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc([C@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)c1 ZINC000782222793 1029615344 /nfs/dbraw/zinc/61/53/44/1029615344.db2.gz FSTBXWYPIVMHPW-IBGZPJMESA-N 1 1 366.377 2.738 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c2nonc21 ZINC000841138615 1030067923 /nfs/dbraw/zinc/06/79/23/1030067923.db2.gz ZRVNJPYXVAHTPU-UHFFFAOYSA-N 1 1 353.382 2.843 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)OCCO1 ZINC000784039036 1030435853 /nfs/dbraw/zinc/43/58/53/1030435853.db2.gz RRCGZOLUVDRNEE-QGZVFWFLSA-N 1 1 372.425 2.891 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3cccnc3)C2)nc1-c1ccncc1 ZINC000842629354 1030852403 /nfs/dbraw/zinc/85/24/03/1030852403.db2.gz VHFSGXODGPRUKQ-INIZCTEOSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3cccnc3)C2)nc1-c1ccncc1 ZINC000842629354 1030852419 /nfs/dbraw/zinc/85/24/19/1030852419.db2.gz VHFSGXODGPRUKQ-INIZCTEOSA-N 1 1 350.382 2.695 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc([O-])ccc1[N+](=O)[O-])c1ccc(N2CCNC2=O)cc1 ZINC000829751727 1033320913 /nfs/dbraw/zinc/32/09/13/1033320913.db2.gz NRYUIFKERXQLST-GFCCVEGCSA-N 1 1 356.382 2.681 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)NCCc4cccc([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001225484560 1034274559 /nfs/dbraw/zinc/27/45/59/1034274559.db2.gz MYAXOLSGIXCCOS-BGYRXZFFSA-N 1 1 372.469 2.655 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc(Cl)c(F)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001226909068 1034880066 /nfs/dbraw/zinc/88/00/66/1034880066.db2.gz PRJXXINUWBGOPZ-ACGQPVHCSA-N 1 1 372.780 2.933 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001139628008 1035183576 /nfs/dbraw/zinc/18/35/76/1035183576.db2.gz KTHVJMSMIFABEU-AWEZNQCLSA-N 1 1 356.426 2.887 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])c3nc[nH]c32)C1 ZINC001227692265 1035675448 /nfs/dbraw/zinc/67/54/48/1035675448.db2.gz VQNJGUXVZNIZBF-OLZOCXBDSA-N 1 1 368.397 2.866 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Oc1nc(C2CC2)[nH]c(=O)c1[N+](=O)[O-] ZINC001228610054 1036203189 /nfs/dbraw/zinc/20/31/89/1036203189.db2.gz NBZBXPBWPPWTRE-WFASDCNBSA-N 1 1 370.409 2.867 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1nc(C2CC2)[nH]c(=O)c1[N+](=O)[O-] ZINC001228610054 1036203207 /nfs/dbraw/zinc/20/32/07/1036203207.db2.gz NBZBXPBWPPWTRE-WFASDCNBSA-N 1 1 370.409 2.867 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3nccc4ccc([N+](=O)[O-])cc43)C[C@H]1[N@H+]2C ZINC001229010083 1036456333 /nfs/dbraw/zinc/45/63/33/1036456333.db2.gz ZCJQZOSUBYIDHQ-ONIAQPFYSA-N 1 1 371.393 2.689 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@@H+](Cc3ccccc3Cl)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229378253 1036639825 /nfs/dbraw/zinc/63/98/25/1036639825.db2.gz JMNPNDOGSOSFKZ-GFCCVEGCSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@@H+](Cc3ccccc3Cl)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229378253 1036639839 /nfs/dbraw/zinc/63/98/39/1036639839.db2.gz JMNPNDOGSOSFKZ-GFCCVEGCSA-N 1 1 364.789 2.706 20 5 FFBDMO O=[N+]([O-])c1cc([N+](=O)[O-])c(O[C@H]2CCc3[nH+]ccn3C2)c2ncccc12 ZINC001233906835 1036820446 /nfs/dbraw/zinc/82/04/46/1036820446.db2.gz ZJJGNCVBNLNBPQ-JTQLQIEISA-N 1 1 355.310 2.642 20 5 FFBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC001229869578 1036950157 /nfs/dbraw/zinc/95/01/57/1036950157.db2.gz DCDUJLHYSMHXTI-ZSBIGDGJSA-N 1 1 351.359 2.824 20 5 FFBDMO COc1c(O)cc(O[C@@H]2CCC[N@@H+](C)C2)c2c(=O)c3ccccc3n(C)c12 ZINC001234172816 1036954163 /nfs/dbraw/zinc/95/41/63/1036954163.db2.gz VILVTIFJADGQHC-CYBMUJFWSA-N 1 1 368.433 2.879 20 5 FFBDMO Cc1cc(=O)oc2c1ccc(OC1CC[NH+](CCF)CC1)c2[N+](=O)[O-] ZINC001229945598 1036994247 /nfs/dbraw/zinc/99/42/47/1036994247.db2.gz YTAXYUSRLRHJES-UHFFFAOYSA-N 1 1 350.346 2.822 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1cc(N2CCOCC2)ccc1[N+](=O)[O-] ZINC001234363478 1037005157 /nfs/dbraw/zinc/00/51/57/1037005157.db2.gz JHODDGXRRHZSRC-CCWDJLKJSA-N 1 1 361.442 2.541 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2c([O-])ccc3c([O-])c4c(=O)cc(O)cc-4oc32)CC1 ZINC001234751653 1037168765 /nfs/dbraw/zinc/16/87/65/1037168765.db2.gz BVAWYWWRQNHWQG-LBPRGKRZSA-N 1 1 371.389 2.926 20 5 FFBDMO CCOc1cc(NC(=O)NCCNc2cccc(C)[nH+]2)ccc1[N+](=O)[O-] ZINC001207138457 1037182734 /nfs/dbraw/zinc/18/27/34/1037182734.db2.gz XBTSNTQDZMBMGU-UHFFFAOYSA-N 1 1 359.386 2.931 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@]4(CCOC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093889 1038379349 /nfs/dbraw/zinc/37/93/49/1038379349.db2.gz RRJXMHYZCRQLGQ-IBGZPJMESA-N 1 1 361.442 2.685 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c(F)cc1[N+](=O)[O-] ZINC001208543850 1038400479 /nfs/dbraw/zinc/40/04/79/1038400479.db2.gz NMRMCRPSYXFTRK-UHFFFAOYSA-N 1 1 373.450 2.585 20 5 FFBDMO C[C@H]1C[NH+](CCc2nnc(C(C)(C)c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258091308 1039164086 /nfs/dbraw/zinc/16/40/86/1039164086.db2.gz LIFHFKMKVIIQIB-KBPBESRZSA-N 1 1 374.441 2.955 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC001258147312 1039228722 /nfs/dbraw/zinc/22/87/22/1039228722.db2.gz YIFCUCIAPSHXAI-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO Cc1nc(N2C[C@@H](C)O[C@H](C)C2)cc(Nc2ccc(N)c([N+](=O)[O-])c2)[nH+]1 ZINC001209933756 1039295168 /nfs/dbraw/zinc/29/51/68/1039295168.db2.gz CBBCVLUCBHCDLW-GHMZBOCLSA-N 1 1 358.402 2.633 20 5 FFBDMO N[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1F ZINC001246572805 1039401751 /nfs/dbraw/zinc/40/17/51/1039401751.db2.gz UVDNNOUDXGLPRA-CZUORRHYSA-N 1 1 372.391 2.603 20 5 FFBDMO O=[N+]([O-])c1ncccc1-c1nc(-c2ccc(C[NH+]3CCOCC3)cc2)no1 ZINC001213172320 1040304571 /nfs/dbraw/zinc/30/45/71/1040304571.db2.gz UDGWMNDDUQYFSY-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CCc1ccc(C[C@@H]([NH3+])c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)cc1 ZINC001249354388 1040698322 /nfs/dbraw/zinc/69/83/22/1040698322.db2.gz LSFPZCUWTLXKQW-CYBMUJFWSA-N 1 1 357.345 2.984 20 5 FFBDMO O=C1N[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c2ccccc21 ZINC001254467728 1040735388 /nfs/dbraw/zinc/73/53/88/1040735388.db2.gz DBTYLRAERZTRPZ-GOSISDBHSA-N 1 1 352.394 2.595 20 5 FFBDMO Cc1noc([C@H]2CC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)n1 ZINC001254480388 1040747676 /nfs/dbraw/zinc/74/76/76/1040747676.db2.gz FFQPQWCSHHUVDN-AWEZNQCLSA-N 1 1 357.414 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1C[C@H]3CN(Cc4ccccn4)C[C@H]3C1)C2 ZINC001254596680 1040823848 /nfs/dbraw/zinc/82/38/48/1040823848.db2.gz QETVJCVPVMIFKN-LVCYWYKZSA-N 1 1 364.449 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@@]3(C[C@@H](OCC4CC4)CO3)C1)C2 ZINC001254599925 1040829138 /nfs/dbraw/zinc/82/91/38/1040829138.db2.gz MVANZBUKBBWDBR-VAMGGRTRSA-N 1 1 358.438 2.722 20 5 FFBDMO COc1cccc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)n1 ZINC001254610259 1040839474 /nfs/dbraw/zinc/83/94/74/1040839474.db2.gz ISCXLIFGQDZQNH-SJORKVTESA-N 1 1 355.394 2.619 20 5 FFBDMO C[C@H](c1nnc(N(C)C[C@H]2CCCC[N@H+]2Cc2ccccc2)n1C)[N+](=O)[O-] ZINC001262863738 1041910776 /nfs/dbraw/zinc/91/07/76/1041910776.db2.gz OLBRMCXTUFOWKT-NVXWUHKLSA-N 1 1 372.473 2.644 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001310520083 1043699900 /nfs/dbraw/zinc/69/99/00/1043699900.db2.gz VSZWXIMHVRJQHH-MRXNPFEDSA-N 1 1 369.425 2.506 20 5 FFBDMO C[N@H+]1CC[C@@](O)(CNCc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001321128752 1045555901 /nfs/dbraw/zinc/55/59/01/1045555901.db2.gz AUIZIHPIZFBSOC-QGZVFWFLSA-N 1 1 365.817 2.664 20 5 FFBDMO CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)c1nc([C@@H]([NH3+])c2ccccc2)no1 ZINC001326173156 1046793901 /nfs/dbraw/zinc/79/39/01/1046793901.db2.gz PDZAKDQCXWEFJU-OLZOCXBDSA-N 1 1 371.401 2.631 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](O)C12CCCC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001331344658 1047878671 /nfs/dbraw/zinc/87/86/71/1047878671.db2.gz FBXIIXFKVBLCBZ-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](O)C12CCCC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001331344658 1047878681 /nfs/dbraw/zinc/87/86/81/1047878681.db2.gz FBXIIXFKVBLCBZ-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO CCOP(=O)(OCC)[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001327511190 1047928437 /nfs/dbraw/zinc/92/84/37/1047928437.db2.gz DRBQZSJGOLOOFQ-OAHLLOKOSA-N 1 1 358.331 2.537 20 5 FFBDMO C[N@@H+]1CCO[C@H](CSc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001327713246 1048008801 /nfs/dbraw/zinc/00/88/01/1048008801.db2.gz ABXCGZFMWHXNLN-JTQLQIEISA-N 1 1 354.819 2.614 20 5 FFBDMO C[N@H+]1CCO[C@H](CSc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001327713246 1048008817 /nfs/dbraw/zinc/00/88/17/1048008817.db2.gz ABXCGZFMWHXNLN-JTQLQIEISA-N 1 1 354.819 2.614 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC001540670910 1070964253 /nfs/dbraw/zinc/96/42/53/1070964253.db2.gz ZDJSHXRTJRSQQZ-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC001540670910 1070964257 /nfs/dbraw/zinc/96/42/57/1070964257.db2.gz ZDJSHXRTJRSQQZ-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@@H+]2CCC(CO)(CO)C2)o1 ZINC001328316422 1048257248 /nfs/dbraw/zinc/25/72/48/1048257248.db2.gz QSWPURWQYJGHFP-UHFFFAOYSA-N 1 1 366.801 2.685 20 5 FFBDMO Cc1nc(Nc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)ncc1[N+](=O)[O-] ZINC001333587384 1048992283 /nfs/dbraw/zinc/99/22/83/1048992283.db2.gz JPYIKULFFSUOGM-INIZCTEOSA-N 1 1 354.414 2.721 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@@H+](C)C(C)C ZINC001292841643 1049413234 /nfs/dbraw/zinc/41/32/34/1049413234.db2.gz YVROMGJAWVTNIG-UHFFFAOYSA-N 1 1 360.462 2.725 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001295966505 1050005746 /nfs/dbraw/zinc/00/57/46/1050005746.db2.gz MMSWIYBBNXLMCM-UHFFFAOYSA-N 1 1 365.821 2.612 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC001297010022 1050112188 /nfs/dbraw/zinc/11/21/88/1050112188.db2.gz ZGRPZKYXJYAJFG-MRXNPFEDSA-N 1 1 372.400 2.665 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC001297065162 1050117286 /nfs/dbraw/zinc/11/72/86/1050117286.db2.gz FSIFQYMUGFICPD-UHFFFAOYSA-N 1 1 371.441 2.837 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3c(C)cncc3[N+](=O)[O-])CC2)c1 ZINC001341815754 1050430850 /nfs/dbraw/zinc/43/08/50/1050430850.db2.gz KNPCBBQMQQFBQF-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCC2)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001303551154 1051382815 /nfs/dbraw/zinc/38/28/15/1051382815.db2.gz LRJNXBLTRPCVRB-UHFFFAOYSA-N 1 1 354.288 2.686 20 5 FFBDMO O=C(OC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC001344932866 1052142779 /nfs/dbraw/zinc/14/27/79/1052142779.db2.gz WLRXLHLWLDSJSA-CYBMUJFWSA-N 1 1 354.790 2.658 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001345039475 1052214802 /nfs/dbraw/zinc/21/48/02/1052214802.db2.gz QKAWKUIEMQSSRN-KDURUIRLSA-N 1 1 374.441 2.943 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001307820090 1052353608 /nfs/dbraw/zinc/35/36/08/1052353608.db2.gz YDHBORDMPFYNOP-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001307820090 1052353612 /nfs/dbraw/zinc/35/36/12/1052353612.db2.gz YDHBORDMPFYNOP-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1N1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC001343916842 1052487470 /nfs/dbraw/zinc/48/74/70/1052487470.db2.gz OXNRIVRTRXXLAR-HNNXBMFYSA-N 1 1 369.469 2.780 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001345925565 1052673537 /nfs/dbraw/zinc/67/35/37/1052673537.db2.gz UGOXXYGAUGYNAB-CHWSQXEVSA-N 1 1 362.382 2.540 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001335442050 1053367180 /nfs/dbraw/zinc/36/71/80/1053367180.db2.gz VTHHSUALZFKUSH-IRXDYDNUSA-N 1 1 355.442 2.819 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC001336560206 1054062740 /nfs/dbraw/zinc/06/27/40/1054062740.db2.gz FBULVXIDCIYTAW-CXAGYDPISA-N 1 1 358.442 2.725 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000847254990 1055322551 /nfs/dbraw/zinc/32/25/51/1055322551.db2.gz IGNYBJMAUCTYED-GJZGRUSLSA-N 1 1 364.421 2.547 20 5 FFBDMO CCOC(=O)C[C@H]1CCC[N@@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC001338448674 1055524433 /nfs/dbraw/zinc/52/44/33/1055524433.db2.gz OWTDIOJOVHOSDC-CYBMUJFWSA-N 1 1 352.387 2.530 20 5 FFBDMO CCOC(=O)C[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC001338448674 1055524438 /nfs/dbraw/zinc/52/44/38/1055524438.db2.gz OWTDIOJOVHOSDC-CYBMUJFWSA-N 1 1 352.387 2.530 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC4(CCCCO4)CC3)n2)c1 ZINC001349937934 1055548181 /nfs/dbraw/zinc/54/81/81/1055548181.db2.gz PVDBTTXIDXJCON-UHFFFAOYSA-N 1 1 357.414 2.846 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@]2([NH+]3CCOCC3)CCSC2)c2ccccc21 ZINC001349968681 1055564518 /nfs/dbraw/zinc/56/45/18/1055564518.db2.gz FVJCXXBLGNDBHR-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)OCC[C@H]2CC[N@H+](C)C2)c1 ZINC000847819790 1056678211 /nfs/dbraw/zinc/67/82/11/1056678211.db2.gz SOEYBOJEGOZCAR-OAHLLOKOSA-N 1 1 372.425 2.647 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC001449167773 1058868216 /nfs/dbraw/zinc/86/82/16/1058868216.db2.gz DBEJAZKKUTULRY-OAHLLOKOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC001449167773 1058868242 /nfs/dbraw/zinc/86/82/42/1058868242.db2.gz DBEJAZKKUTULRY-OAHLLOKOSA-N 1 1 357.385 2.733 20 5 FFBDMO CC(C)[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC001457091768 1060274398 /nfs/dbraw/zinc/27/43/98/1060274398.db2.gz ZOVWMKGFIARFCA-YOEHRIQHSA-N 1 1 371.441 2.806 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000848587247 1060317146 /nfs/dbraw/zinc/31/71/46/1060317146.db2.gz GVHNOIZTRMQDSH-ZDUSSCGKSA-N 1 1 371.384 2.757 20 5 FFBDMO O=C(OC[C@H]1CC[N@H+]1C1CCOCC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC001517121113 1060354004 /nfs/dbraw/zinc/35/40/04/1060354004.db2.gz CSAFCRRHCJXIDI-GOSISDBHSA-N 1 1 374.437 2.813 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1nc3ccccc3cc1[N+](=O)[O-])C2 ZINC001458467212 1060596533 /nfs/dbraw/zinc/59/65/33/1060596533.db2.gz GJZQHLVMNFJCLZ-AWEZNQCLSA-N 1 1 367.409 2.610 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848783793 1060688006 /nfs/dbraw/zinc/68/80/06/1060688006.db2.gz CYSGIBPJPMTPNY-MSOLQXFVSA-N 1 1 358.442 2.916 20 5 FFBDMO CC[N@H+](CCC(=O)OC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001459399380 1060754713 /nfs/dbraw/zinc/75/47/13/1060754713.db2.gz ZRDIYJCTINOMTR-UHFFFAOYSA-N 1 1 368.777 2.683 20 5 FFBDMO CC[N@@H+](CCC(=O)OC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001459399380 1060754725 /nfs/dbraw/zinc/75/47/25/1060754725.db2.gz ZRDIYJCTINOMTR-UHFFFAOYSA-N 1 1 368.777 2.683 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)CC(C)(C)CNC(=O)OC(C)(C)C ZINC001459641850 1060788309 /nfs/dbraw/zinc/78/83/09/1060788309.db2.gz ZMYOGRFIKWRSTQ-UHFFFAOYSA-N 1 1 369.466 2.582 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@H]2C[C@H](O)C23CCC3)o1 ZINC001460424385 1060990504 /nfs/dbraw/zinc/99/05/04/1060990504.db2.gz AFNDCRBKXPKBGC-STQMWFEESA-N 1 1 364.789 2.691 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001460745987 1061086812 /nfs/dbraw/zinc/08/68/12/1061086812.db2.gz HQNKQEMASBULQA-AZUAARDMSA-N 1 1 369.469 2.554 20 5 FFBDMO NC(=O)c1ccc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC001461331805 1061291186 /nfs/dbraw/zinc/29/11/86/1061291186.db2.gz JJENBQSVQQMXCT-UHFFFAOYSA-N 1 1 352.350 2.639 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc(S(N)(=O)=O)s1)c1cccc([N+](=O)[O-])c1 ZINC001461411703 1061314105 /nfs/dbraw/zinc/31/41/05/1061314105.db2.gz YYGJVELUBAGRDC-ZDUSSCGKSA-N 1 1 355.441 2.545 20 5 FFBDMO Cc1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c2c(n1)CCCC2 ZINC001461923558 1061450950 /nfs/dbraw/zinc/45/09/50/1061450950.db2.gz BCVCFZLKGVSTDU-UHFFFAOYSA-N 1 1 367.453 2.894 20 5 FFBDMO Nc1c(NC(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc(Cl)cc1[N+](=O)[O-] ZINC001476915805 1061509786 /nfs/dbraw/zinc/50/97/86/1061509786.db2.gz CFHWJWURBNQMOL-GFCCVEGCSA-N 1 1 367.837 2.969 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001463990568 1062369289 /nfs/dbraw/zinc/36/92/89/1062369289.db2.gz DUTKSLDLMNFWQB-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@H+](C)C3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001463990568 1062369311 /nfs/dbraw/zinc/36/93/11/1062369311.db2.gz DUTKSLDLMNFWQB-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001465619771 1063157508 /nfs/dbraw/zinc/15/75/08/1063157508.db2.gz AAQULNOJVCOACW-GDBMZVCRSA-N 1 1 368.437 2.960 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001441690076 1063464678 /nfs/dbraw/zinc/46/46/78/1063464678.db2.gz RIKBAZLTUVIAGW-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO CCN(CC[NH2+]Cc1ccc(-c2ccccc2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001497389978 1063702582 /nfs/dbraw/zinc/70/25/82/1063702582.db2.gz CSDWRDGRBJZAFJ-WOJBJXKFSA-N 1 1 367.449 2.957 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001469560226 1064168245 /nfs/dbraw/zinc/16/82/45/1064168245.db2.gz QVWOPMLJGOQXLI-CQSZACIVSA-N 1 1 354.838 2.526 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2nc(-c3ccccn3)no2)CC1 ZINC001473141345 1065206264 /nfs/dbraw/zinc/20/62/64/1065206264.db2.gz PFOSUACSRSAQBW-UHFFFAOYSA-N 1 1 366.381 2.814 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+](CCO)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001473293786 1065236349 /nfs/dbraw/zinc/23/63/49/1065236349.db2.gz ZQTWBOUYGOKRKP-HNNXBMFYSA-N 1 1 357.410 2.979 20 5 FFBDMO C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001473759282 1065349118 /nfs/dbraw/zinc/34/91/18/1065349118.db2.gz BYYKZBBRJWIYTB-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO COc1ccccc1[C@H]([NH3+])C(=O)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC001579302426 1078613858 /nfs/dbraw/zinc/61/38/58/1078613858.db2.gz WRLQXDUOHXSLQM-INIZCTEOSA-N 1 1 352.350 2.790 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2C(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC001579779254 1078681576 /nfs/dbraw/zinc/68/15/76/1078681576.db2.gz JYQUFZWNTJCSSH-UHFFFAOYSA-N 1 1 354.410 2.719 20 5 FFBDMO C[C@@H]1C[C@H]2CC[C@@H](C(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)C[N@H+]2C1 ZINC001557207951 1075822396 /nfs/dbraw/zinc/82/23/96/1075822396.db2.gz GLOGPCTUGLUVII-NQBHXWOUSA-N 1 1 353.369 2.610 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001558316373 1075978594 /nfs/dbraw/zinc/97/85/94/1075978594.db2.gz XFAXTOXKZQSKQB-KRWDZBQOSA-N 1 1 373.457 2.784 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C(C)(C)C1 ZINC001558527873 1076025259 /nfs/dbraw/zinc/02/52/59/1076025259.db2.gz SWOFYSQCOSGMQW-CQSZACIVSA-N 1 1 364.402 2.580 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001559080733 1076123896 /nfs/dbraw/zinc/12/38/96/1076123896.db2.gz SFLVBJFRNGERJM-ZIAGYGMSSA-N 1 1 358.442 2.979 20 5 FFBDMO COC(=O)[C@@H](C)C[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559486021 1076166491 /nfs/dbraw/zinc/16/64/91/1076166491.db2.gz BLBIAOZQHIPWHD-VIFPVBQESA-N 1 1 368.777 2.539 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001559486021 1076166493 /nfs/dbraw/zinc/16/64/93/1076166493.db2.gz BLBIAOZQHIPWHD-VIFPVBQESA-N 1 1 368.777 2.539 20 5 FFBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559751936 1076187947 /nfs/dbraw/zinc/18/79/47/1076187947.db2.gz OVYXPFHFHOPEAB-LPHOPBHVSA-N 1 1 374.485 2.754 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC001560274127 1076258549 /nfs/dbraw/zinc/25/85/49/1076258549.db2.gz DDNYWGZIMKRLGK-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001561617206 1076399277 /nfs/dbraw/zinc/39/92/77/1076399277.db2.gz AHENPIMAUVXEFJ-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO CCOc1cc(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC001567354556 1077020266 /nfs/dbraw/zinc/02/02/66/1077020266.db2.gz FBGUMFYXYRXJJN-CYBMUJFWSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001567356436 1077020837 /nfs/dbraw/zinc/02/08/37/1077020837.db2.gz VYNUYBDQCYLGAZ-CYBMUJFWSA-N 1 1 370.247 2.960 20 5 FFBDMO Cc1cccc(CCC[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c1 ZINC001567998746 1077065210 /nfs/dbraw/zinc/06/52/10/1077065210.db2.gz YHQTZQSPVQSICC-QZTJIDSGSA-N 1 1 359.470 2.611 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000117573574 250353513 /nfs/dbraw/zinc/35/35/13/250353513.db2.gz VZXVUEXNFLVAPV-CQSZACIVSA-N 1 1 351.790 2.803 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000152832600 251073981 /nfs/dbraw/zinc/07/39/81/251073981.db2.gz GPCZJRLWTJWWRA-ZYHUDNBSSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000192483843 251276933 /nfs/dbraw/zinc/27/69/33/251276933.db2.gz PCXYNEKTQQXAKK-LBPRGKRZSA-N 1 1 364.427 2.755 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])s3)C2)cc(OC)c1 ZINC000192483843 251276939 /nfs/dbraw/zinc/27/69/39/251276939.db2.gz PCXYNEKTQQXAKK-LBPRGKRZSA-N 1 1 364.427 2.755 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)[C@H]2C1 ZINC000272383879 252025514 /nfs/dbraw/zinc/02/55/14/252025514.db2.gz CCDKXXOIKPULTE-WBMJQRKESA-N 1 1 372.450 2.885 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475880 252047162 /nfs/dbraw/zinc/04/71/62/252047162.db2.gz BEZDINIIJMEIEW-SFHVURJKSA-N 1 1 357.458 2.882 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272527031 252059768 /nfs/dbraw/zinc/05/97/68/252059768.db2.gz MGGNGMVKISUEHY-YJBOKZPZSA-N 1 1 357.458 2.882 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CSCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000272588183 252074039 /nfs/dbraw/zinc/07/40/39/252074039.db2.gz ZQNRMZWYZCHNGT-GJZGRUSLSA-N 1 1 364.496 2.856 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](COc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000272588424 252074508 /nfs/dbraw/zinc/07/45/08/252074508.db2.gz PDXFAQYIHXTSPN-CQSZACIVSA-N 1 1 355.394 2.595 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1=CC[N@@H+](C)CC1 ZINC000272919574 252165301 /nfs/dbraw/zinc/16/53/01/252165301.db2.gz KDJLTXBRAVCWPJ-AWEZNQCLSA-N 1 1 358.442 2.575 20 5 FFBDMO C[C@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C1=CC[N@@H+](C)CC1 ZINC000272987578 252183726 /nfs/dbraw/zinc/18/37/26/252183726.db2.gz PPVJVFYEJINCGH-AWEZNQCLSA-N 1 1 358.442 2.919 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000277199418 256171614 /nfs/dbraw/zinc/17/16/14/256171614.db2.gz FKYUVUSDSZOFAY-CXAGYDPISA-N 1 1 359.426 2.692 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NCc1ccccc1C[N@@H+]1CC[C@H](O)C1)CCN2 ZINC000278189310 256286130 /nfs/dbraw/zinc/28/61/30/256286130.db2.gz DODJOCLGXUMLKE-INIZCTEOSA-N 1 1 368.437 2.742 20 5 FFBDMO COc1ccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000285787457 257004703 /nfs/dbraw/zinc/00/47/03/257004703.db2.gz LSQBIKJMUPRYGH-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279139855 256386032 /nfs/dbraw/zinc/38/60/32/256386032.db2.gz RUWGNTQPUYSACH-DNVCBOLYSA-N 1 1 360.502 2.933 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](CC(F)(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000278805464 256350377 /nfs/dbraw/zinc/35/03/77/256350377.db2.gz OWQSYDXFTYCLLC-LLVKDONJSA-N 1 1 357.332 2.758 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](CC(F)(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000278805464 256350379 /nfs/dbraw/zinc/35/03/79/256350379.db2.gz OWQSYDXFTYCLLC-LLVKDONJSA-N 1 1 357.332 2.758 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@H]2C1 ZINC000286492255 257039907 /nfs/dbraw/zinc/03/99/07/257039907.db2.gz TXFMIZAAQNCUHW-PBHICJAKSA-N 1 1 366.421 2.823 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2ncnc3sc([N+](=O)[O-])cc32)CCCO1 ZINC000287686122 257102380 /nfs/dbraw/zinc/10/23/80/257102380.db2.gz JRRCFMVFCUODKI-NSHDSACASA-N 1 1 351.432 2.512 20 5 FFBDMO CN1CCN(CCC[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000289400895 257279360 /nfs/dbraw/zinc/27/93/60/257279360.db2.gz GMRICAGDTBRLGJ-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO CN1CCN(CCC[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000289400895 257279361 /nfs/dbraw/zinc/27/93/61/257279361.db2.gz GMRICAGDTBRLGJ-UHFFFAOYSA-N 1 1 372.469 2.924 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4ccncc4)CC3)nc2c1 ZINC000289504925 257284769 /nfs/dbraw/zinc/28/47/69/257284769.db2.gz LAFILXUTXNTGBB-UHFFFAOYSA-N 1 1 366.425 2.621 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NCc1cc(C)[nH+]c(N2CCCC2)c1 ZINC000290384780 257329389 /nfs/dbraw/zinc/32/93/89/257329389.db2.gz OJPTVOGPQPBOBD-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000289547115 257286850 /nfs/dbraw/zinc/28/68/50/257286850.db2.gz DZXZKXUJNNYMMI-UHFFFAOYSA-N 1 1 370.837 2.559 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000291066604 257378996 /nfs/dbraw/zinc/37/89/96/257378996.db2.gz YGNWHQBMNRJDAP-LBPRGKRZSA-N 1 1 360.414 2.699 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(CNc3sccc3[N+](=O)[O-])c2)C1 ZINC000302035769 258083473 /nfs/dbraw/zinc/08/34/73/258083473.db2.gz UPMUEQWQFOJTEO-OAHLLOKOSA-N 1 1 374.466 2.966 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Br)CC[N@@H+]1CC(C)(C)O ZINC000302497647 258104149 /nfs/dbraw/zinc/10/41/49/258104149.db2.gz NDTSGKPEILJUMM-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1CC(C)(C)O ZINC000302497647 258104151 /nfs/dbraw/zinc/10/41/51/258104151.db2.gz NDTSGKPEILJUMM-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000302510191 258104685 /nfs/dbraw/zinc/10/46/85/258104685.db2.gz NTDYGWTULWEGOR-MBNYWOFBSA-N 1 1 354.838 2.721 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000302510191 258104687 /nfs/dbraw/zinc/10/46/87/258104687.db2.gz NTDYGWTULWEGOR-MBNYWOFBSA-N 1 1 354.838 2.721 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000302549942 258105819 /nfs/dbraw/zinc/10/58/19/258105819.db2.gz VWQJNQHXJJGBRU-VNHYZAJKSA-N 1 1 364.402 2.581 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000302549942 258105820 /nfs/dbraw/zinc/10/58/20/258105820.db2.gz VWQJNQHXJJGBRU-VNHYZAJKSA-N 1 1 364.402 2.581 20 5 FFBDMO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665256 258107409 /nfs/dbraw/zinc/10/74/09/258107409.db2.gz PWNCDVJNGNVZRJ-MGPQQGTHSA-N 1 1 369.487 2.777 20 5 FFBDMO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665250 258107449 /nfs/dbraw/zinc/10/74/49/258107449.db2.gz PWNCDVJNGNVZRJ-HZSPNIEDSA-N 1 1 369.487 2.777 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665250 258107450 /nfs/dbraw/zinc/10/74/50/258107450.db2.gz PWNCDVJNGNVZRJ-HZSPNIEDSA-N 1 1 369.487 2.777 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC000302685297 258108133 /nfs/dbraw/zinc/10/81/33/258108133.db2.gz AACLLPRRBGJMNP-MRXNPFEDSA-N 1 1 373.457 2.594 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCCc3c2cnn3CCO)c1 ZINC000324412179 258115816 /nfs/dbraw/zinc/11/58/16/258115816.db2.gz WBDXUVMCJJIQQQ-HNNXBMFYSA-N 1 1 350.806 2.604 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3ccc(C)cc3[N+](=O)[O-])CC2)CC1 ZINC000301441541 258050002 /nfs/dbraw/zinc/05/00/02/258050002.db2.gz NGOCPAJBWYINKO-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000301682241 258062626 /nfs/dbraw/zinc/06/26/26/258062626.db2.gz KEGDMXKCFQAKFU-LBPRGKRZSA-N 1 1 373.251 2.521 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301964442 258078538 /nfs/dbraw/zinc/07/85/38/258078538.db2.gz NTATVLHSSDZEMN-GOEBONIOSA-N 1 1 366.425 2.960 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000331736832 258198664 /nfs/dbraw/zinc/19/86/64/258198664.db2.gz VGROSAPUHNITQH-INIZCTEOSA-N 1 1 361.442 2.828 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000331825448 258201825 /nfs/dbraw/zinc/20/18/25/258201825.db2.gz MXYBKXOLVQJHQR-HYVNUMGLSA-N 1 1 360.458 2.967 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC000052862982 506267237 /nfs/dbraw/zinc/26/72/37/506267237.db2.gz OHMPLYKRRXFRBM-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC000052862982 506267241 /nfs/dbraw/zinc/26/72/41/506267241.db2.gz OHMPLYKRRXFRBM-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC000052862981 506268782 /nfs/dbraw/zinc/26/87/82/506268782.db2.gz OHMPLYKRRXFRBM-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC000052862981 506268790 /nfs/dbraw/zinc/26/87/90/506268790.db2.gz OHMPLYKRRXFRBM-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCN2CC[NH+](CCOc3ccccc3)CC2)cc1 ZINC000065208834 506269237 /nfs/dbraw/zinc/26/92/37/506269237.db2.gz JCZFWAYLFHHZAQ-UHFFFAOYSA-N 1 1 371.437 2.670 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000003537816 506340762 /nfs/dbraw/zinc/34/07/62/506340762.db2.gz HQHGWWDGZURPKO-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO C[N@@H+](CCNC(=O)CCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000054265695 506526205 /nfs/dbraw/zinc/52/62/05/506526205.db2.gz IWVQYUBHZBDBIP-UHFFFAOYSA-N 1 1 356.426 2.645 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1CCOCC1 ZINC000054328469 506538978 /nfs/dbraw/zinc/53/89/78/506538978.db2.gz BSDOGYMITUCEMO-QGZVFWFLSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000007641035 506577339 /nfs/dbraw/zinc/57/73/39/506577339.db2.gz XVGQJYZTIPQFCR-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000007641035 506577342 /nfs/dbraw/zinc/57/73/42/506577342.db2.gz XVGQJYZTIPQFCR-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO C[N@@H+](CCCNC(=O)COc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000009982019 506720811 /nfs/dbraw/zinc/72/08/11/506720811.db2.gz VVHJOEXNWXENBE-UHFFFAOYSA-N 1 1 357.410 2.612 20 5 FFBDMO Cc1c(NC(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043347341 506737471 /nfs/dbraw/zinc/73/74/71/506737471.db2.gz VUYHBWLYUUJTGI-BETUJISGSA-N 1 1 350.419 2.524 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCCC[C@@H]1C ZINC000067052669 506739136 /nfs/dbraw/zinc/73/91/36/506739136.db2.gz AMUZZHSQNJOKRY-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000017281879 507118740 /nfs/dbraw/zinc/11/87/40/507118740.db2.gz NVTANQCKHXPNMZ-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000057005754 507144479 /nfs/dbraw/zinc/14/44/79/507144479.db2.gz NAZTUTRPUGGVJE-KRWDZBQOSA-N 1 1 354.410 2.669 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941833 507154192 /nfs/dbraw/zinc/15/41/92/507154192.db2.gz DWZDJFNSCIDVCD-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941833 507154196 /nfs/dbraw/zinc/15/41/96/507154196.db2.gz DWZDJFNSCIDVCD-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[NH+](Cc2cccs2)CC1 ZINC000019540102 507177588 /nfs/dbraw/zinc/17/75/88/507177588.db2.gz RCKIOZAEUZDORN-UHFFFAOYSA-N 1 1 374.466 2.721 20 5 FFBDMO Cc1ccc(C[N@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000024813875 507441195 /nfs/dbraw/zinc/44/11/95/507441195.db2.gz XVQNRHQASDJUGL-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000024813875 507441203 /nfs/dbraw/zinc/44/12/03/507441203.db2.gz XVQNRHQASDJUGL-UHFFFAOYSA-N 1 1 357.366 2.702 20 5 FFBDMO C[N@@H+](Cc1ccccc1NC(=O)Cn1cnc([N+](=O)[O-])n1)C1CCCCC1 ZINC000048223797 507483359 /nfs/dbraw/zinc/48/33/59/507483359.db2.gz WEJASVVCYVLKCM-UHFFFAOYSA-N 1 1 372.429 2.590 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](CCn2cccn2)CC1 ZINC000049982846 507649753 /nfs/dbraw/zinc/64/97/53/507649753.db2.gz MQYNLBJOQOCYER-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000071014314 507679381 /nfs/dbraw/zinc/67/93/81/507679381.db2.gz JLBLTSLOUUKGRK-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000051049482 507727280 /nfs/dbraw/zinc/72/72/80/507727280.db2.gz PZXFFLJUADVAOK-HZPDHXFCSA-N 1 1 363.458 2.990 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000063483194 507736484 /nfs/dbraw/zinc/73/64/84/507736484.db2.gz NROZYBNPVVPMHR-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000063483194 507736489 /nfs/dbraw/zinc/73/64/89/507736489.db2.gz NROZYBNPVVPMHR-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000029050220 507755426 /nfs/dbraw/zinc/75/54/26/507755426.db2.gz WJCYZMLMQZHTST-HNNXBMFYSA-N 1 1 350.806 2.619 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)[NH+]1CCOCC1 ZINC000029208289 507768901 /nfs/dbraw/zinc/76/89/01/507768901.db2.gz WGQXFFXRRWRKKY-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000052247559 507804028 /nfs/dbraw/zinc/80/40/28/507804028.db2.gz SNRPHQMZDZBBLO-CQSZACIVSA-N 1 1 369.487 2.922 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089888567 507879054 /nfs/dbraw/zinc/87/90/54/507879054.db2.gz YOOAQRYYRQABIS-CQSZACIVSA-N 1 1 358.398 2.598 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089888567 507879056 /nfs/dbraw/zinc/87/90/56/507879056.db2.gz YOOAQRYYRQABIS-CQSZACIVSA-N 1 1 358.398 2.598 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H](O)c2nccn2C)CC1 ZINC000089924837 507884334 /nfs/dbraw/zinc/88/43/34/507884334.db2.gz OYYUTJQGHVVUGW-SFHVURJKSA-N 1 1 374.441 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1 ZINC000089952228 507889860 /nfs/dbraw/zinc/88/98/60/507889860.db2.gz QGMQIWIDYIPIGW-WBVHZDCISA-N 1 1 352.456 2.960 20 5 FFBDMO Cc1sc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000073306263 507912971 /nfs/dbraw/zinc/91/29/71/507912971.db2.gz CTXBPJKVBWVZTN-UHFFFAOYSA-N 1 1 362.411 2.717 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000090552870 507927367 /nfs/dbraw/zinc/92/73/67/507927367.db2.gz PWAYBIUTBMXFBY-LJQANCHMSA-N 1 1 350.378 2.531 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000090553060 507927515 /nfs/dbraw/zinc/92/75/15/507927515.db2.gz OVDZKYVDXPJBPT-AWEZNQCLSA-N 1 1 368.393 2.777 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(Br)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000079804449 508002662 /nfs/dbraw/zinc/00/26/62/508002662.db2.gz YXSHBZFLEHUGJL-SECBINFHSA-N 1 1 356.220 2.570 20 5 FFBDMO C[C@@H](c1ccccn1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000091702504 508003965 /nfs/dbraw/zinc/00/39/65/508003965.db2.gz KYJGDKPDYGWLPW-ZDUSSCGKSA-N 1 1 356.382 2.981 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000110354012 508022816 /nfs/dbraw/zinc/02/28/16/508022816.db2.gz XCRPOLVMCQTOSR-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CC[C@@H](c1ccncc1)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000092224518 508052486 /nfs/dbraw/zinc/05/24/86/508052486.db2.gz NVIOTNRVTYZPLA-KRWDZBQOSA-N 1 1 354.410 2.962 20 5 FFBDMO CC[C@@H](c1ccncc1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000092224518 508052487 /nfs/dbraw/zinc/05/24/87/508052487.db2.gz NVIOTNRVTYZPLA-KRWDZBQOSA-N 1 1 354.410 2.962 20 5 FFBDMO CC[N@@H+](Cc1cnn(C)c1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092437599 508071291 /nfs/dbraw/zinc/07/12/91/508071291.db2.gz RMRSZPUXPKMHQK-UHFFFAOYSA-N 1 1 354.414 2.751 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000081121239 508139698 /nfs/dbraw/zinc/13/96/98/508139698.db2.gz GDSLUZUIXGYXHD-LJQANCHMSA-N 1 1 353.422 2.870 20 5 FFBDMO COCCOc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534755 508148327 /nfs/dbraw/zinc/14/83/27/508148327.db2.gz FZNIMZPMBDYRPZ-MRXNPFEDSA-N 1 1 372.425 2.701 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1OC ZINC000093534463 508148384 /nfs/dbraw/zinc/14/83/84/508148384.db2.gz BGNCGWSNMSMHMG-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO CCc1nn(C)c(NCCc2[nH+]ccn2Cc2ccccc2)c1[N+](=O)[O-] ZINC000094133632 508170174 /nfs/dbraw/zinc/17/01/74/508170174.db2.gz ITYMHVHYVHWNLZ-UHFFFAOYSA-N 1 1 354.414 2.790 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)CC12CCCCC2 ZINC000081598580 508195113 /nfs/dbraw/zinc/19/51/13/508195113.db2.gz IZRJGMSSMXFCNM-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1c(C)noc1C ZINC000113950765 508287769 /nfs/dbraw/zinc/28/77/69/508287769.db2.gz UZYSJEVWRNWIPI-MWLCHTKSSA-N 1 1 362.386 2.886 20 5 FFBDMO CN1[C@@H]2CC[C@H]1CC([N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC000367211236 512387959 /nfs/dbraw/zinc/38/79/59/512387959.db2.gz JOSSHXGOOVXSQW-NNQSOWQGSA-N 1 1 364.421 2.620 20 5 FFBDMO CN1[C@@H]2CC[C@H]1CC([N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC000367211236 512387963 /nfs/dbraw/zinc/38/79/63/512387963.db2.gz JOSSHXGOOVXSQW-NNQSOWQGSA-N 1 1 364.421 2.620 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000085619960 508314319 /nfs/dbraw/zinc/31/43/19/508314319.db2.gz ULXLNLSDZLWSCI-HNNXBMFYSA-N 1 1 364.446 2.690 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000115270096 508379992 /nfs/dbraw/zinc/37/99/92/508379992.db2.gz TYBFDUPMYZJKEF-CJNGLKHVSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000133527019 508411646 /nfs/dbraw/zinc/41/16/46/508411646.db2.gz LZIJCKFZHPBJIU-TZMCWYRMSA-N 1 1 369.425 2.596 20 5 FFBDMO CC(=O)N(c1nc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cs1)C1CC1 ZINC000115616422 508418611 /nfs/dbraw/zinc/41/86/11/508418611.db2.gz PDDXPELPTKANNY-UHFFFAOYSA-N 1 1 360.439 2.899 20 5 FFBDMO C[C@@H](O)C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668724 508490318 /nfs/dbraw/zinc/49/03/18/508490318.db2.gz NGVQRVTYZJITOK-GRYCIOLGSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668724 508490323 /nfs/dbraw/zinc/49/03/23/508490323.db2.gz NGVQRVTYZJITOK-GRYCIOLGSA-N 1 1 355.822 2.811 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000377691218 512400711 /nfs/dbraw/zinc/40/07/11/512400711.db2.gz HMPJWRYQBPAGAK-UFRUDQCGSA-N 1 1 358.486 2.646 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000153581332 508602484 /nfs/dbraw/zinc/60/24/84/508602484.db2.gz LTZXVXYXQGKPJV-HZPDHXFCSA-N 1 1 364.490 2.528 20 5 FFBDMO CC[C@@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128688009 508629013 /nfs/dbraw/zinc/62/90/13/508629013.db2.gz PANLCJGDJSBBKI-HZPDHXFCSA-N 1 1 353.394 2.688 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000123062780 508630214 /nfs/dbraw/zinc/63/02/14/508630214.db2.gz XUKSVHUWCXNTOD-UHFFFAOYSA-N 1 1 371.397 2.661 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(c4cnccn4)CC3)o2)c1 ZINC000157920146 508632704 /nfs/dbraw/zinc/63/27/04/508632704.db2.gz ZTDJDWCWMXDUDB-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000123422134 508684261 /nfs/dbraw/zinc/68/42/61/508684261.db2.gz MYSUNKDAEPTKJL-KGLIPLIRSA-N 1 1 356.426 2.993 20 5 FFBDMO CC[N@H+](Cc1ccc(C(=O)N(C)C)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153970204 508688860 /nfs/dbraw/zinc/68/88/60/508688860.db2.gz VQUQBTVWHQHZGK-LJQANCHMSA-N 1 1 371.437 2.852 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000154011567 508698908 /nfs/dbraw/zinc/69/89/08/508698908.db2.gz PWRBFZODPJTKKC-SFHVURJKSA-N 1 1 360.458 2.607 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000154100128 508717355 /nfs/dbraw/zinc/71/73/55/508717355.db2.gz PMKRVMUJCUCJMA-DYVFJYSZSA-N 1 1 359.426 2.692 20 5 FFBDMO CCc1ccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000158950781 508772851 /nfs/dbraw/zinc/77/28/51/508772851.db2.gz MMHFQDYEJWSHBG-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]([NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000119576679 508821592 /nfs/dbraw/zinc/82/15/92/508821592.db2.gz BUTSWFNOLFBSJR-INIZCTEOSA-N 1 1 354.410 2.568 20 5 FFBDMO O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000142388876 508823224 /nfs/dbraw/zinc/82/32/24/508823224.db2.gz IHBKNVMBQBKJEK-KRWDZBQOSA-N 1 1 372.469 2.508 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000148596172 508864509 /nfs/dbraw/zinc/86/45/09/508864509.db2.gz RDYRDTDQBLKMNI-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150863910 508910837 /nfs/dbraw/zinc/91/08/37/508910837.db2.gz DTJHUNUSILJYFI-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150863910 508910842 /nfs/dbraw/zinc/91/08/42/508910842.db2.gz DTJHUNUSILJYFI-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000131405721 508927566 /nfs/dbraw/zinc/92/75/66/508927566.db2.gz RVIYSRHEMZPQIZ-CYBMUJFWSA-N 1 1 357.414 2.562 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000150964413 508931724 /nfs/dbraw/zinc/93/17/24/508931724.db2.gz YZFNSQALJZHSOB-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000150964413 508931728 /nfs/dbraw/zinc/93/17/28/508931728.db2.gz YZFNSQALJZHSOB-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO CN(CCCN1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000161046505 509064651 /nfs/dbraw/zinc/06/46/51/509064651.db2.gz RTSWMAQOIRACMF-UHFFFAOYSA-N 1 1 360.380 2.687 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000121012560 509109361 /nfs/dbraw/zinc/10/93/61/509109361.db2.gz KPCQBXPRDTZJFX-OAHLLOKOSA-N 1 1 371.441 2.727 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1C ZINC000121013880 509110234 /nfs/dbraw/zinc/11/02/34/509110234.db2.gz UQZRBGISGDPFKV-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1(O)CCCC1 ZINC000152061268 509138792 /nfs/dbraw/zinc/13/87/92/509138792.db2.gz FGSUSRUGBZVVQE-LLVKDONJSA-N 1 1 355.822 2.812 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2C)cn1 ZINC000161819833 509155884 /nfs/dbraw/zinc/15/58/84/509155884.db2.gz ZYHHWASMFTUHLM-UHFFFAOYSA-N 1 1 351.366 2.974 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121427114 509173198 /nfs/dbraw/zinc/17/31/98/509173198.db2.gz TYBIKAAUUXHLBD-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ncc([N+](=O)[O-])s2)[C@H](c2ccccc2)C1 ZINC000195508257 509200311 /nfs/dbraw/zinc/20/03/11/509200311.db2.gz YWVOFRLKBNWQEJ-HNNXBMFYSA-N 1 1 361.471 2.842 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182373547 509201399 /nfs/dbraw/zinc/20/13/99/509201399.db2.gz ALHCZIVUIVZWBV-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182373547 509201402 /nfs/dbraw/zinc/20/14/02/509201402.db2.gz ALHCZIVUIVZWBV-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000248017608 509216461 /nfs/dbraw/zinc/21/64/61/509216461.db2.gz QPHNBLRBNWTMKD-INIZCTEOSA-N 1 1 360.414 2.799 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000248039355 509223612 /nfs/dbraw/zinc/22/36/12/509223612.db2.gz LRXDHDZXNHMAQX-MAUKXSAKSA-N 1 1 355.394 2.779 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172801690 509244097 /nfs/dbraw/zinc/24/40/97/509244097.db2.gz FAEOAIPVZCWCHB-GXTWGEPZSA-N 1 1 366.849 2.745 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248356597 509274819 /nfs/dbraw/zinc/27/48/19/509274819.db2.gz OMLJYRJFIKNSHO-HOCLYGCPSA-N 1 1 369.487 2.562 20 5 FFBDMO CCN1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)CC1 ZINC000266987097 509294035 /nfs/dbraw/zinc/29/40/35/509294035.db2.gz SOZCILFKFQYHPU-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO COc1cccc(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)c1[N+](=O)[O-] ZINC000185698766 509310025 /nfs/dbraw/zinc/31/00/25/509310025.db2.gz TWIRPYLWBZMSJZ-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@@H](C)CC1 ZINC000192192803 509396535 /nfs/dbraw/zinc/39/65/35/509396535.db2.gz OFBNQNZIIXQEMT-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1csc([N+](=O)[O-])c1 ZINC000264285975 509433429 /nfs/dbraw/zinc/43/34/29/509433429.db2.gz JFZXEMLZZQLFGT-HNNXBMFYSA-N 1 1 359.451 2.951 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CCOC3)CC2)c(Br)c1 ZINC000267419329 509471385 /nfs/dbraw/zinc/47/13/85/509471385.db2.gz UDPWMVJTMPGMIX-GFCCVEGCSA-N 1 1 370.247 2.516 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000248901873 509535700 /nfs/dbraw/zinc/53/57/00/509535700.db2.gz UNMXMMYRDXQWRK-HNAYVOBHSA-N 1 1 368.437 2.915 20 5 FFBDMO CCCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 ZINC000179611869 509536053 /nfs/dbraw/zinc/53/60/53/509536053.db2.gz YPIVKSNVZPAEID-IQIBNGDESA-N 1 1 352.456 2.897 20 5 FFBDMO CCCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 ZINC000179611869 509536057 /nfs/dbraw/zinc/53/60/57/509536057.db2.gz YPIVKSNVZPAEID-IQIBNGDESA-N 1 1 352.456 2.897 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000248950445 509552357 /nfs/dbraw/zinc/55/23/57/509552357.db2.gz ZSWZCAYWMOWPDA-MAUKXSAKSA-N 1 1 368.437 2.915 20 5 FFBDMO COC[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000189417483 509565585 /nfs/dbraw/zinc/56/55/85/509565585.db2.gz CUEPSRLOYXNLML-CZUORRHYSA-N 1 1 361.398 2.528 20 5 FFBDMO C[C@@H](NCc1ccc(C(=O)NCC[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173429001 509593803 /nfs/dbraw/zinc/59/38/03/509593803.db2.gz DJTMYFMVEFSTHI-OAHLLOKOSA-N 1 1 370.453 2.737 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2cccc(NCc3cccc([N+](=O)[O-])c3)c2)CC1 ZINC000189512598 509610995 /nfs/dbraw/zinc/61/09/95/509610995.db2.gz IVBNNIKCKFKUMP-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CN1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000183308929 509709618 /nfs/dbraw/zinc/70/96/18/509709618.db2.gz LVLOGTMOOASPDW-HDICACEKSA-N 1 1 360.502 2.894 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000189723670 509720996 /nfs/dbraw/zinc/72/09/96/509720996.db2.gz YORINFGROGLUSP-KRWDZBQOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@@](C)(O)C[N@@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000189736474 509725772 /nfs/dbraw/zinc/72/57/72/509725772.db2.gz UGKNPEQTAPDUPE-HXUWFJFHSA-N 1 1 371.437 2.857 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000268120190 509768580 /nfs/dbraw/zinc/76/85/80/509768580.db2.gz KREZYWINYIDATD-HUUCEWRRSA-N 1 1 352.822 2.674 20 5 FFBDMO COc1cc(C[N@@H+](CC(C)(C)O)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000189901923 509818876 /nfs/dbraw/zinc/81/88/76/509818876.db2.gz ZLKXJNSJOJPKAF-UHFFFAOYSA-N 1 1 374.384 2.983 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@H]1C ZINC000186691461 509856785 /nfs/dbraw/zinc/85/67/85/509856785.db2.gz CCNIKFBWPBPZTH-CYBMUJFWSA-N 1 1 364.446 2.521 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1 ZINC000183560617 509861037 /nfs/dbraw/zinc/86/10/37/509861037.db2.gz XDXVLSQSTDBWNR-UHFFFAOYSA-N 1 1 355.398 2.648 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000190028581 509895058 /nfs/dbraw/zinc/89/50/58/509895058.db2.gz BHHJQEADZYNKQZ-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(c1cc3c(cc1[N+](=O)[O-])CCC(=O)N3)C2 ZINC000173998356 509896814 /nfs/dbraw/zinc/89/68/14/509896814.db2.gz ZDGCINNJSJYURD-LSDHHAIUSA-N 1 1 358.442 2.931 20 5 FFBDMO COC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000190072880 509921913 /nfs/dbraw/zinc/92/19/13/509921913.db2.gz PSTNBDVPERTDAA-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1SC ZINC000245436957 509933219 /nfs/dbraw/zinc/93/32/19/509933219.db2.gz DNVWKTLOJCAROT-NEPJUHHUSA-N 1 1 365.455 2.634 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000265284419 509966601 /nfs/dbraw/zinc/96/66/01/509966601.db2.gz JFMLLZICXQPKNK-ZIAGYGMSSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@@H](C[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000183956338 510056720 /nfs/dbraw/zinc/05/67/20/510056720.db2.gz OUYCLKPUDCHDFI-SWLSCSKDSA-N 1 1 360.439 2.892 20 5 FFBDMO C[C@@H](C[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000183956338 510056729 /nfs/dbraw/zinc/05/67/29/510056729.db2.gz OUYCLKPUDCHDFI-SWLSCSKDSA-N 1 1 360.439 2.892 20 5 FFBDMO C[N@@H+](CCOc1ccc(C(F)(F)F)cc1)CCn1cc([N+](=O)[O-])cn1 ZINC000190369010 510091133 /nfs/dbraw/zinc/09/11/33/510091133.db2.gz BEHJWHZHDSYRAC-UHFFFAOYSA-N 1 1 358.320 2.821 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268847594 510097184 /nfs/dbraw/zinc/09/71/84/510097184.db2.gz PXYPUVCDOQVYOU-SJORKVTESA-N 1 1 355.442 2.819 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)c1[N+](=O)[O-] ZINC000171368274 510111119 /nfs/dbraw/zinc/11/11/19/510111119.db2.gz MCSPEDXFMYJADK-CYBMUJFWSA-N 1 1 365.821 2.566 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245803151 510151585 /nfs/dbraw/zinc/15/15/85/510151585.db2.gz YBZOQNDGQFZZMT-ZFWWWQNUSA-N 1 1 351.447 2.774 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)[NH2+]Cc2ccccc21 ZINC000262149904 510191605 /nfs/dbraw/zinc/19/16/05/510191605.db2.gz FWFLBFTTZCZWCS-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174655963 510234131 /nfs/dbraw/zinc/23/41/31/510234131.db2.gz GJVYVDXAGJGNQN-GFCCVEGCSA-N 1 1 359.213 2.591 20 5 FFBDMO C[N@H+](Cc1cccc(Cl)c1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174655963 510234138 /nfs/dbraw/zinc/23/41/38/510234138.db2.gz GJVYVDXAGJGNQN-GFCCVEGCSA-N 1 1 359.213 2.591 20 5 FFBDMO CCCO[C@H]1CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000246016833 510251016 /nfs/dbraw/zinc/25/10/16/510251016.db2.gz KBRIBVHRNLJJMP-ROUUACIJSA-N 1 1 361.442 2.981 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+](C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000265835443 510254395 /nfs/dbraw/zinc/25/43/95/510254395.db2.gz DYZBWMKSCNGNFB-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000265835443 510254398 /nfs/dbraw/zinc/25/43/98/510254398.db2.gz DYZBWMKSCNGNFB-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000184341581 510272771 /nfs/dbraw/zinc/27/27/71/510272771.db2.gz YNAPVQGWELYPER-CYBMUJFWSA-N 1 1 374.466 2.881 20 5 FFBDMO CC[C@@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000187539351 510321405 /nfs/dbraw/zinc/32/14/05/510321405.db2.gz CCUNRNSSCFRLTM-MRXNPFEDSA-N 1 1 355.822 2.671 20 5 FFBDMO CC[C@@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000187539351 510321411 /nfs/dbraw/zinc/32/14/11/510321411.db2.gz CCUNRNSSCFRLTM-MRXNPFEDSA-N 1 1 355.822 2.671 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194589982 510435603 /nfs/dbraw/zinc/43/56/03/510435603.db2.gz CWORRBGUFZICEU-ZDUSSCGKSA-N 1 1 359.386 2.691 20 5 FFBDMO Cn1cc(CN[C@@H]2CCC[C@H]([NH+](C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175012903 510436207 /nfs/dbraw/zinc/43/62/07/510436207.db2.gz ZNDGVASYFSFNGK-AEFFLSMTSA-N 1 1 357.458 2.958 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1OC ZINC000266168452 510444783 /nfs/dbraw/zinc/44/47/83/510444783.db2.gz QERWCIHNWHUXKG-AWEZNQCLSA-N 1 1 365.430 2.558 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@H](COC)c2ccccc2)c([N+](=O)[O-])c1 ZINC000181695563 510543725 /nfs/dbraw/zinc/54/37/25/510543725.db2.gz PLJRFJKYWQEOFU-QGZVFWFLSA-N 1 1 373.409 2.909 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@@H+](C)CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000175312563 510583981 /nfs/dbraw/zinc/58/39/81/510583981.db2.gz OPXNMZWTKZIUEP-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@H+](C)CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000175312563 510583983 /nfs/dbraw/zinc/58/39/83/510583983.db2.gz OPXNMZWTKZIUEP-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000194915397 510588074 /nfs/dbraw/zinc/58/80/74/510588074.db2.gz BINUDWXSSOTEGB-CYBMUJFWSA-N 1 1 374.466 2.631 20 5 FFBDMO C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000194915397 510588081 /nfs/dbraw/zinc/58/80/81/510588081.db2.gz BINUDWXSSOTEGB-CYBMUJFWSA-N 1 1 374.466 2.631 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000181931756 510666152 /nfs/dbraw/zinc/66/61/52/510666152.db2.gz OUSDZZUUMCWSGQ-QLFBSQMISA-N 1 1 354.472 2.941 20 5 FFBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181939536 510670750 /nfs/dbraw/zinc/67/07/50/510670750.db2.gz ZMNKOMKOODNARP-RDJZCZTQSA-N 1 1 359.426 2.900 20 5 FFBDMO C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1ccccc1 ZINC000270235558 510727867 /nfs/dbraw/zinc/72/78/67/510727867.db2.gz BEGHVEQKPREZPX-RBUKOAKNSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1ccccc1 ZINC000270235558 510727871 /nfs/dbraw/zinc/72/78/71/510727871.db2.gz BEGHVEQKPREZPX-RBUKOAKNSA-N 1 1 369.421 2.996 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000246914935 510742808 /nfs/dbraw/zinc/74/28/08/510742808.db2.gz INPLEWFYGKULQB-ZFWWWQNUSA-N 1 1 351.834 2.876 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000191653284 510774221 /nfs/dbraw/zinc/77/42/21/510774221.db2.gz NAUSFVVCWWQOOT-CABCVRRESA-N 1 1 360.458 2.904 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000247111225 510836490 /nfs/dbraw/zinc/83/64/90/510836490.db2.gz LOAVKESDIAXOQD-BBRMVZONSA-N 1 1 351.834 2.733 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000247267803 510854950 /nfs/dbraw/zinc/85/49/50/510854950.db2.gz FIQCKGSRMPODET-XEZPLFJOSA-N 1 1 351.472 2.874 20 5 FFBDMO CCc1ccc([C@H]2CCCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000247500217 510863395 /nfs/dbraw/zinc/86/33/95/510863395.db2.gz LPWLQSAWIQDKDK-NVXWUHKLSA-N 1 1 362.430 2.925 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247557967 510865655 /nfs/dbraw/zinc/86/56/55/510865655.db2.gz ZINRTXZBPSFAJB-MAUKXSAKSA-N 1 1 362.474 2.976 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000360341608 510898505 /nfs/dbraw/zinc/89/85/05/510898505.db2.gz GOUYEPYYYAUQFJ-NWDGAFQWSA-N 1 1 368.231 2.714 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000270607709 510922270 /nfs/dbraw/zinc/92/22/70/510922270.db2.gz DWFFNIBEBHYFFG-APWZRJJASA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000285567944 510958757 /nfs/dbraw/zinc/95/87/57/510958757.db2.gz SCQAKBBQCHZHMS-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOc2cc(O)ccc2C1 ZINC000285567944 510958760 /nfs/dbraw/zinc/95/87/60/510958760.db2.gz SCQAKBBQCHZHMS-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000361035447 510983939 /nfs/dbraw/zinc/98/39/39/510983939.db2.gz ZQBGNAVEJWZFSK-KUHUBIRLSA-N 1 1 368.437 2.939 20 5 FFBDMO Cc1ccc(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)cc1[N+](=O)[O-] ZINC000270835990 510999707 /nfs/dbraw/zinc/99/97/07/510999707.db2.gz DHFXFHIFQQPVQZ-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000285687713 511010962 /nfs/dbraw/zinc/01/09/62/511010962.db2.gz OGRQRERTTLMMQU-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1 ZINC000285687713 511010965 /nfs/dbraw/zinc/01/09/65/511010965.db2.gz OGRQRERTTLMMQU-HNNXBMFYSA-N 1 1 359.386 2.760 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286515341 511027740 /nfs/dbraw/zinc/02/77/40/511027740.db2.gz NACHZEYTDQXRCR-SWLSCSKDSA-N 1 1 362.348 2.856 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CN1CCN(C)CC1 ZINC000271024209 511061384 /nfs/dbraw/zinc/06/13/84/511061384.db2.gz AYHQGVKDHWTBTM-HZPDHXFCSA-N 1 1 366.531 2.691 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000282787526 511112030 /nfs/dbraw/zinc/11/20/30/511112030.db2.gz PIIZJDMFGWVUGQ-UHFFFAOYSA-N 1 1 359.430 2.764 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000271214841 511123180 /nfs/dbraw/zinc/12/31/80/511123180.db2.gz WYXXGOMANFCFHO-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000271214841 511123188 /nfs/dbraw/zinc/12/31/88/511123188.db2.gz WYXXGOMANFCFHO-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)[nH+]1 ZINC000364920557 511154653 /nfs/dbraw/zinc/15/46/53/511154653.db2.gz ZQFYEOYUBBXERD-AWEZNQCLSA-N 1 1 355.398 2.597 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000279809195 511222428 /nfs/dbraw/zinc/22/24/28/511222428.db2.gz XDFLUUUBCQJXCL-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C(c1cc(F)ccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279813612 511225871 /nfs/dbraw/zinc/22/58/71/511225871.db2.gz ZXDBYULCAYUDFU-IYBDPMFKSA-N 1 1 369.396 2.938 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000362776420 511236529 /nfs/dbraw/zinc/23/65/29/511236529.db2.gz UZUNJGCMPSLDGW-HOCLYGCPSA-N 1 1 361.442 2.979 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CC23CCOCC3)cn1 ZINC000295098306 511281325 /nfs/dbraw/zinc/28/13/25/511281325.db2.gz UMTATYCPVYRAGO-SFHVURJKSA-N 1 1 356.426 2.725 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271713274 511298589 /nfs/dbraw/zinc/29/85/89/511298589.db2.gz JKDYPOXMWKJPEW-NSHDSACASA-N 1 1 363.443 2.934 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC(F)(F)[C@H](CO)C3)o2)c1 ZINC000291907060 511387164 /nfs/dbraw/zinc/38/71/64/511387164.db2.gz RPZXGUGPHHOGGM-ZDUSSCGKSA-N 1 1 367.352 2.742 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000299222123 511557333 /nfs/dbraw/zinc/55/73/33/511557333.db2.gz IOJFTQSEYZHURT-WBVHZDCISA-N 1 1 365.430 2.557 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCO[C@@H](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000274160933 511738944 /nfs/dbraw/zinc/73/89/44/511738944.db2.gz AKIIVISDTOGSGF-CGTJXYLNSA-N 1 1 356.426 2.965 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000365999260 511777003 /nfs/dbraw/zinc/77/70/03/511777003.db2.gz YKJZLMUWTGVRJD-HZPDHXFCSA-N 1 1 355.394 2.782 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000284654050 511811090 /nfs/dbraw/zinc/81/10/90/511811090.db2.gz GCVCAGJKMGNHKJ-OAHLLOKOSA-N 1 1 373.413 2.526 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cn2)cc1 ZINC000363876280 511823857 /nfs/dbraw/zinc/82/38/57/511823857.db2.gz PTJVVWCVUXWMLA-LBPRGKRZSA-N 1 1 351.366 2.975 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+](C)CCCO)c([N+](=O)[O-])c1 ZINC000281589284 511901759 /nfs/dbraw/zinc/90/17/59/511901759.db2.gz FJPHIESEKSDFLJ-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)CCCO)c([N+](=O)[O-])c1 ZINC000281589284 511901763 /nfs/dbraw/zinc/90/17/63/511901763.db2.gz FJPHIESEKSDFLJ-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293333069 511926887 /nfs/dbraw/zinc/92/68/87/511926887.db2.gz CUTDVZIKZBSVKP-UHFFFAOYSA-N 1 1 359.348 2.962 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cn1 ZINC000274750906 511930476 /nfs/dbraw/zinc/93/04/76/511930476.db2.gz HLKVMCPMKZUSCU-NSHDSACASA-N 1 1 369.830 2.768 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293353978 511934824 /nfs/dbraw/zinc/93/48/24/511934824.db2.gz KXMZRIYPIUGQTA-YMTOWFKASA-N 1 1 357.332 2.826 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293601843 512023694 /nfs/dbraw/zinc/02/36/94/512023694.db2.gz VBXMPEWWCOEUHF-KGLIPLIRSA-N 1 1 357.332 2.970 20 5 FFBDMO Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285267809 512058040 /nfs/dbraw/zinc/05/80/40/512058040.db2.gz JKYBEZAXRKZCDQ-RDJZCZTQSA-N 1 1 366.368 2.843 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000293827376 512093346 /nfs/dbraw/zinc/09/33/46/512093346.db2.gz BRCAFEDEHGPGDP-IBGZPJMESA-N 1 1 360.458 2.731 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375758919 512490810 /nfs/dbraw/zinc/49/08/10/512490810.db2.gz BLZIZJVGBHGMDS-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375758919 512490813 /nfs/dbraw/zinc/49/08/13/512490813.db2.gz BLZIZJVGBHGMDS-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1ccc([C@@H](C)NCC(=O)NC2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000411475212 512653598 /nfs/dbraw/zinc/65/35/98/512653598.db2.gz NJHVQHPXABDNTJ-OAHLLOKOSA-N 1 1 362.474 2.543 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@@]2(CO)CCCc3ccccc32)c2c(c1)COCO2 ZINC000374149695 512678788 /nfs/dbraw/zinc/67/87/88/512678788.db2.gz UECLJPULJXGXHN-HXUWFJFHSA-N 1 1 370.405 2.775 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000372103221 512717203 /nfs/dbraw/zinc/71/72/03/512717203.db2.gz QXVRFFKGKWMZSD-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000370012963 512727735 /nfs/dbraw/zinc/72/77/35/512727735.db2.gz UKXSPVFPJHDPGS-OAHLLOKOSA-N 1 1 371.441 2.530 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158778 512739697 /nfs/dbraw/zinc/73/96/97/512739697.db2.gz YYIMTECVGBDOMQ-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158778 512739702 /nfs/dbraw/zinc/73/97/02/512739702.db2.gz YYIMTECVGBDOMQ-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000411697889 512766455 /nfs/dbraw/zinc/76/64/55/512766455.db2.gz LJMXTRXEYFDYGI-CQSZACIVSA-N 1 1 365.430 2.559 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC000411784745 512810164 /nfs/dbraw/zinc/81/01/64/512810164.db2.gz AJXLOKZSAOWGCQ-ZDUSSCGKSA-N 1 1 367.446 2.661 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000378563070 512825882 /nfs/dbraw/zinc/82/58/82/512825882.db2.gz RPNPHXGVQGCEDT-CGTJXYLNSA-N 1 1 355.442 2.634 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Br)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000376543092 512865225 /nfs/dbraw/zinc/86/52/25/512865225.db2.gz WBDDCWGBBQTJGA-LLVKDONJSA-N 1 1 368.231 2.668 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000383835702 512881388 /nfs/dbraw/zinc/88/13/88/512881388.db2.gz SXBJJCHULPGTKW-WBMJQRKESA-N 1 1 372.400 2.709 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@H](O)C[C@@H]3c3ccccc3)o2)cc1 ZINC000411956654 512889431 /nfs/dbraw/zinc/88/94/31/512889431.db2.gz WJUBYKVTVCYENV-IAGOWNOFSA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@H](O)C[C@@H]3c3ccccc3)o2)cc1 ZINC000411956654 512889434 /nfs/dbraw/zinc/88/94/34/512889434.db2.gz WJUBYKVTVCYENV-IAGOWNOFSA-N 1 1 366.377 2.953 20 5 FFBDMO COC(=O)c1cn([C@@H]2CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nn1 ZINC000368356454 512912364 /nfs/dbraw/zinc/91/23/64/512912364.db2.gz AOFWSSUYXXFJPK-UKRRQHHQSA-N 1 1 373.413 2.679 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](N3CCCC3=O)CC2)c([N+](=O)[O-])cc1F ZINC000412057499 512935838 /nfs/dbraw/zinc/93/58/38/512935838.db2.gz RDYROJHKSFWRIB-AWEZNQCLSA-N 1 1 365.405 2.719 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](N3CCCC3=O)CC2)c([N+](=O)[O-])cc1F ZINC000412057499 512935843 /nfs/dbraw/zinc/93/58/43/512935843.db2.gz RDYROJHKSFWRIB-AWEZNQCLSA-N 1 1 365.405 2.719 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075636 512994767 /nfs/dbraw/zinc/99/47/67/512994767.db2.gz ZQSCELOCRODPTN-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075636 512994769 /nfs/dbraw/zinc/99/47/69/512994769.db2.gz ZQSCELOCRODPTN-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000372903378 513096860 /nfs/dbraw/zinc/09/68/60/513096860.db2.gz ZGDIYJKRAAVNRP-ZDUSSCGKSA-N 1 1 353.394 2.811 20 5 FFBDMO C[C@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C[NH+]1CCOCC1 ZINC000450349866 513153536 /nfs/dbraw/zinc/15/35/36/513153536.db2.gz VQTZAIPLNJTHHH-CYBMUJFWSA-N 1 1 362.455 2.520 20 5 FFBDMO O=C(NC1CC1)c1ccc(NC[C@@H]2CCCC[N@H+]2C2CC2)c([N+](=O)[O-])c1 ZINC000433799381 513154034 /nfs/dbraw/zinc/15/40/34/513154034.db2.gz QZILMJHTEDRAEV-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CCCC[N@@H+]2C2CC2)ncc1[N+](=O)[O-] ZINC000433818923 513158758 /nfs/dbraw/zinc/15/87/58/513158758.db2.gz OCGPYNNUCYNNEW-LBPRGKRZSA-N 1 1 369.263 2.911 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CCCC[N@H+]2C2CC2)ncc1[N+](=O)[O-] ZINC000433818923 513158764 /nfs/dbraw/zinc/15/87/64/513158764.db2.gz OCGPYNNUCYNNEW-LBPRGKRZSA-N 1 1 369.263 2.911 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000428992585 513243390 /nfs/dbraw/zinc/24/33/90/513243390.db2.gz BHAUZZYUBWEZOP-JKIFEVAISA-N 1 1 371.441 2.807 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000421426973 513259633 /nfs/dbraw/zinc/25/96/33/513259633.db2.gz KZWSKZKDAXZYKF-GJZGRUSLSA-N 1 1 363.458 2.829 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000429039199 513263815 /nfs/dbraw/zinc/26/38/15/513263815.db2.gz HIZBCVVEPVTHON-HEHGZKQESA-N 1 1 351.422 2.905 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C)c3)C2)CC1 ZINC000450777153 513336331 /nfs/dbraw/zinc/33/63/31/513336331.db2.gz RWHNXASQKBLYOJ-SFHVURJKSA-N 1 1 374.485 2.674 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000421708042 513380778 /nfs/dbraw/zinc/38/07/78/513380778.db2.gz YXVUESBTUSIATG-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H]1CC[C@H]([N@@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429755139 513457963 /nfs/dbraw/zinc/45/79/63/513457963.db2.gz ASQWJHWVEQKNSI-RYUDHWBXSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429755138 513458215 /nfs/dbraw/zinc/45/82/15/513458215.db2.gz ASQWJHWVEQKNSI-NWDGAFQWSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413137881 513473199 /nfs/dbraw/zinc/47/31/99/513473199.db2.gz OZPMTUCDARHUBI-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413137857 513473251 /nfs/dbraw/zinc/47/32/51/513473251.db2.gz OZELZLRJPQLJMU-GOSISDBHSA-N 1 1 369.469 2.749 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441193829 513509171 /nfs/dbraw/zinc/50/91/71/513509171.db2.gz IAIWETVOMLRVAV-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(-c4cc[nH]n4)o3)C2)nc1 ZINC000435123567 513517962 /nfs/dbraw/zinc/51/79/62/513517962.db2.gz HPVGMSJFGYZLLE-LBPRGKRZSA-N 1 1 354.370 2.659 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1nnnn1-c1ccccc1)C1CC1 ZINC000441270191 513525280 /nfs/dbraw/zinc/52/52/80/513525280.db2.gz TVCCJGJBEZYBRT-UHFFFAOYSA-N 1 1 364.409 2.778 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CCCO1 ZINC000413262296 513555786 /nfs/dbraw/zinc/55/57/86/513555786.db2.gz JRKYXCNKVMAIQA-NSHDSACASA-N 1 1 362.352 2.921 20 5 FFBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1(CCO)CCOCC1 ZINC000425465381 513579701 /nfs/dbraw/zinc/57/97/01/513579701.db2.gz ZHPPFLUVJAVYRW-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCc1ccccc1[N+](=O)[O-] ZINC000416153678 513604432 /nfs/dbraw/zinc/60/44/32/513604432.db2.gz FBMUBMAAWSTGPX-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H](n4ccnn4)C3)o2)c1 ZINC000425521395 513618943 /nfs/dbraw/zinc/61/89/43/513618943.db2.gz ZPBJZBBPKAJBRV-INIZCTEOSA-N 1 1 368.397 2.721 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)s1 ZINC000435637895 513647229 /nfs/dbraw/zinc/64/72/29/513647229.db2.gz QMAPHWGPBKJAAB-ZDUSSCGKSA-N 1 1 373.500 2.732 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000413437361 513656100 /nfs/dbraw/zinc/65/61/00/513656100.db2.gz KFVRMMCHHNMIED-CQSZACIVSA-N 1 1 371.441 2.703 20 5 FFBDMO CCN(CCC[NH+]1CCCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000451291945 513657922 /nfs/dbraw/zinc/65/79/22/513657922.db2.gz BIMOCEYLEDJTFW-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000448593311 513799102 /nfs/dbraw/zinc/79/91/02/513799102.db2.gz YMTBYWNVNYAFGH-LBPRGKRZSA-N 1 1 353.394 2.737 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451523805 513805135 /nfs/dbraw/zinc/80/51/35/513805135.db2.gz DHQYKFGJRPEQME-IIYDPXPESA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451523805 513805145 /nfs/dbraw/zinc/80/51/45/513805145.db2.gz DHQYKFGJRPEQME-IIYDPXPESA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(CN[C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422947971 513987363 /nfs/dbraw/zinc/98/73/63/513987363.db2.gz RHSOOZTZMNKITJ-UZLBHIALSA-N 1 1 369.421 2.949 20 5 FFBDMO COc1ccc(CN[C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1[N+](=O)[O-] ZINC000422947969 513988136 /nfs/dbraw/zinc/98/81/36/513988136.db2.gz RHSOOZTZMNKITJ-OXJNMPFZSA-N 1 1 369.421 2.949 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000431786288 514001941 /nfs/dbraw/zinc/00/19/41/514001941.db2.gz SACQPYJKXQZINJ-CQSZACIVSA-N 1 1 357.414 2.610 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448985467 514008231 /nfs/dbraw/zinc/00/82/31/514008231.db2.gz XGKHNFKMLHYXHI-INIZCTEOSA-N 1 1 361.442 2.938 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2nccc(C(F)(F)F)n2)n1 ZINC000414239684 514017225 /nfs/dbraw/zinc/01/72/25/514017225.db2.gz LGLDBJPDBVWQCZ-WDEREUQCSA-N 1 1 370.335 2.874 20 5 FFBDMO C[C@@H]1CC[N@H+](C)CCN1C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444041577 514105849 /nfs/dbraw/zinc/10/58/49/514105849.db2.gz CAHQFFFCYZPJTO-CYBMUJFWSA-N 1 1 367.424 2.987 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444041577 514105854 /nfs/dbraw/zinc/10/58/54/514105854.db2.gz CAHQFFFCYZPJTO-CYBMUJFWSA-N 1 1 367.424 2.987 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c1 ZINC000420417397 514140695 /nfs/dbraw/zinc/14/06/95/514140695.db2.gz KMXHZILDIDSXFR-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1OC)CCC(F)(F)F ZINC000427209331 514151691 /nfs/dbraw/zinc/15/16/91/514151691.db2.gz BGVWJCIUZZHHTC-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO C[C@@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000420604078 514197179 /nfs/dbraw/zinc/19/71/79/514197179.db2.gz QZJOZZLUKOXTQG-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000452112072 514198153 /nfs/dbraw/zinc/19/81/53/514198153.db2.gz FAURMWXSDMZMBH-CYBMUJFWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000420612917 514200067 /nfs/dbraw/zinc/20/00/67/514200067.db2.gz QHDTXTZWMSTRBI-MRXNPFEDSA-N 1 1 368.437 2.795 20 5 FFBDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000449421970 514204147 /nfs/dbraw/zinc/20/41/47/514204147.db2.gz MFJQCTHGMDQNNE-PWSUYJOCSA-N 1 1 360.357 2.798 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000444618151 514275786 /nfs/dbraw/zinc/27/57/86/514275786.db2.gz ITZHBKCCHLBQKY-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000420831234 514326463 /nfs/dbraw/zinc/32/64/63/514326463.db2.gz YXEQNLISXNHKMM-AWEZNQCLSA-N 1 1 354.838 2.526 20 5 FFBDMO Cc1ccc([C@@H](C)Nc2ccc3c(c2)C[N@@H+](CC(N)=O)CC3)cc1[N+](=O)[O-] ZINC000433075171 514371440 /nfs/dbraw/zinc/37/14/40/514371440.db2.gz JVSUUQZNARDETL-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1ccc([C@@H](C)Nc2ccc3c(c2)C[N@H+](CC(N)=O)CC3)cc1[N+](=O)[O-] ZINC000433075171 514371441 /nfs/dbraw/zinc/37/14/41/514371441.db2.gz JVSUUQZNARDETL-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO O=C(N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000438557199 514402319 /nfs/dbraw/zinc/40/23/19/514402319.db2.gz JWWOVJYMBATNIT-KRWDZBQOSA-N 1 1 369.425 2.752 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000452578191 514409964 /nfs/dbraw/zinc/40/99/64/514409964.db2.gz ZIGLBYMEQFWPEQ-NSHDSACASA-N 1 1 368.397 2.622 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1CC(OC(C)(C)C)C1 ZINC000421007412 514434886 /nfs/dbraw/zinc/43/48/86/514434886.db2.gz LGQGMXJARLSFHC-UHFFFAOYSA-N 1 1 365.430 2.820 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1CC(OC(C)(C)C)C1 ZINC000421007412 514434892 /nfs/dbraw/zinc/43/48/92/514434892.db2.gz LGQGMXJARLSFHC-UHFFFAOYSA-N 1 1 365.430 2.820 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000415130631 514459225 /nfs/dbraw/zinc/45/92/25/514459225.db2.gz XMAIGQJVSPGSNQ-APWZRJJASA-N 1 1 363.458 2.712 20 5 FFBDMO Cc1c(CC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438904679 514464870 /nfs/dbraw/zinc/46/48/70/514464870.db2.gz VQUZOIZGPFPTEC-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCCC[C@H]1C ZINC000445487275 514485661 /nfs/dbraw/zinc/48/56/61/514485661.db2.gz FAHIPHXKPPWZOB-HUUCEWRRSA-N 1 1 360.458 2.925 20 5 FFBDMO CC[NH+](CC)CCN(Cc1cccs1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000470641677 514561959 /nfs/dbraw/zinc/56/19/59/514561959.db2.gz NFKYAWNPIRQWKS-UHFFFAOYSA-N 1 1 365.459 2.672 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000466222078 514581868 /nfs/dbraw/zinc/58/18/68/514581868.db2.gz GBOPXCMKXKDAAD-LSDHHAIUSA-N 1 1 352.822 2.674 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1C ZINC000497734047 514614273 /nfs/dbraw/zinc/61/42/73/514614273.db2.gz LXZQHCMTPXFVRJ-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000461643668 514682164 /nfs/dbraw/zinc/68/21/64/514682164.db2.gz SNZJWGMPWUNRIC-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000475719513 514776141 /nfs/dbraw/zinc/77/61/41/514776141.db2.gz UPRODPOIZFZIGR-QGZVFWFLSA-N 1 1 370.405 2.964 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000502809317 514786933 /nfs/dbraw/zinc/78/69/33/514786933.db2.gz CFAFJQZIVKEMDS-OAHLLOKOSA-N 1 1 364.446 2.667 20 5 FFBDMO Cc1c(CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000480071680 514832781 /nfs/dbraw/zinc/83/27/81/514832781.db2.gz WOCQDLSBYBNESL-MRXNPFEDSA-N 1 1 360.458 2.777 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502917953 514842032 /nfs/dbraw/zinc/84/20/32/514842032.db2.gz GFOXASMKLNUHIZ-OAHLLOKOSA-N 1 1 359.430 2.921 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@H](C[N@@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000503194242 514951879 /nfs/dbraw/zinc/95/18/79/514951879.db2.gz WBNADXRVWHURFX-GOSISDBHSA-N 1 1 371.485 2.891 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@H](C[N@H+]1CCc2ccccc2C1)C(C)(C)C ZINC000503194242 514951889 /nfs/dbraw/zinc/95/18/89/514951889.db2.gz WBNADXRVWHURFX-GOSISDBHSA-N 1 1 371.485 2.891 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@H]1C ZINC000498568312 514977329 /nfs/dbraw/zinc/97/73/29/514977329.db2.gz AXRLZSSZVMWODX-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000467547090 515042565 /nfs/dbraw/zinc/04/25/65/515042565.db2.gz FFSIEZQUOIRCMK-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000467547090 515042577 /nfs/dbraw/zinc/04/25/77/515042577.db2.gz FFSIEZQUOIRCMK-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000489977139 515055419 /nfs/dbraw/zinc/05/54/19/515055419.db2.gz DQZLDRMLMUXANS-RYUDHWBXSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1C ZINC000480946224 515147591 /nfs/dbraw/zinc/14/75/91/515147591.db2.gz ANGOXYKWHRQZRB-TZMCWYRMSA-N 1 1 369.487 2.610 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000490294976 515168195 /nfs/dbraw/zinc/16/81/95/515168195.db2.gz YMDXKARYVRANNR-OAHLLOKOSA-N 1 1 369.849 2.816 20 5 FFBDMO CS(=O)(=O)C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000463057021 515353864 /nfs/dbraw/zinc/35/38/64/515353864.db2.gz PYNMDZQWPWBYRV-GJBHZFNWSA-N 1 1 360.435 2.984 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000468479139 515378047 /nfs/dbraw/zinc/37/80/47/515378047.db2.gz MCOOTAHFRXMNQK-OAHLLOKOSA-N 1 1 351.472 2.924 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000468484708 515380680 /nfs/dbraw/zinc/38/06/80/515380680.db2.gz UXDCMMUKQWKNID-INIZCTEOSA-N 1 1 356.426 2.993 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176088 515386498 /nfs/dbraw/zinc/38/64/98/515386498.db2.gz KHDFVUKWMNMOQI-ACJLOTCBSA-N 1 1 355.394 2.551 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176088 515386511 /nfs/dbraw/zinc/38/65/11/515386511.db2.gz KHDFVUKWMNMOQI-ACJLOTCBSA-N 1 1 355.394 2.551 20 5 FFBDMO CN(CC(=O)N1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000463358026 515456909 /nfs/dbraw/zinc/45/69/09/515456909.db2.gz CMVRMMIECNMBQQ-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO CN(CC(=O)N1CC[N@@H+](C)C[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000463358026 515456919 /nfs/dbraw/zinc/45/69/19/515456919.db2.gz CMVRMMIECNMBQQ-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492178019 515510907 /nfs/dbraw/zinc/51/09/07/515510907.db2.gz JFGXHTIJMDDQAM-PMACEKPBSA-N 1 1 354.454 2.520 20 5 FFBDMO CN1CCN(C)[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492178019 515510919 /nfs/dbraw/zinc/51/09/19/515510919.db2.gz JFGXHTIJMDDQAM-PMACEKPBSA-N 1 1 354.454 2.520 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473158355 515520942 /nfs/dbraw/zinc/52/09/42/515520942.db2.gz GRAXHDRPTRPLTG-ZDUSSCGKSA-N 1 1 355.803 2.571 20 5 FFBDMO COc1cccc([C@H]2[C@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)CC[N@H+]2C2CC2)c1 ZINC000481941349 515522352 /nfs/dbraw/zinc/52/23/52/515522352.db2.gz HPVRDGKCELLSKB-AEFFLSMTSA-N 1 1 370.409 2.639 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000500121233 515598352 /nfs/dbraw/zinc/59/83/52/515598352.db2.gz KVPOXMUTUFQLGJ-UONOGXRCSA-N 1 1 371.441 2.550 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1CN1CC[NH+](CCOc2ccccc2)CC1 ZINC000505642937 515619604 /nfs/dbraw/zinc/61/96/04/515619604.db2.gz XWQFZCMJMZYGMC-UHFFFAOYSA-N 1 1 359.401 2.931 20 5 FFBDMO CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000463841097 515637401 /nfs/dbraw/zinc/63/74/01/515637401.db2.gz LTCQDOSVYGUEBW-GFCCVEGCSA-N 1 1 357.332 2.922 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000457090282 515641431 /nfs/dbraw/zinc/64/14/31/515641431.db2.gz LXPWSOODHUSGTN-HNNXBMFYSA-N 1 1 357.414 2.540 20 5 FFBDMO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000457090282 515641440 /nfs/dbraw/zinc/64/14/40/515641440.db2.gz LXPWSOODHUSGTN-HNNXBMFYSA-N 1 1 357.414 2.540 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000457090282 515641448 /nfs/dbraw/zinc/64/14/48/515641448.db2.gz LXPWSOODHUSGTN-HNNXBMFYSA-N 1 1 357.414 2.540 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000473511910 515642387 /nfs/dbraw/zinc/64/23/87/515642387.db2.gz FIEMQEHKPBPKPQ-INIZCTEOSA-N 1 1 356.426 2.834 20 5 FFBDMO COc1cccc(C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C2CCC(O)CC2)c1 ZINC000478031314 515674673 /nfs/dbraw/zinc/67/46/73/515674673.db2.gz GKEOPWJGJUOOAK-UHFFFAOYSA-N 1 1 374.441 2.606 20 5 FFBDMO C[C@@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc2c(s1)CCC2 ZINC000459628891 515706840 /nfs/dbraw/zinc/70/68/40/515706840.db2.gz FSRPAVUZJXUBGZ-IAQYHMDHSA-N 1 1 372.450 2.996 20 5 FFBDMO CCN1CC[NH+](CCCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000478242616 515749896 /nfs/dbraw/zinc/74/98/96/515749896.db2.gz YIEAHYYVCOGNHF-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO NC(=O)C1([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)C2CC3CC(C2)CC1C3 ZINC000459777979 515799274 /nfs/dbraw/zinc/79/92/74/515799274.db2.gz OTBCVNDRHORCTB-UHFFFAOYSA-N 1 1 365.380 2.643 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2cc([N+](=O)[O-])n[nH]2)c1 ZINC000506631399 515937162 /nfs/dbraw/zinc/93/71/62/515937162.db2.gz IAIWXTVKKNGJQC-UHFFFAOYSA-N 1 1 354.370 2.938 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487925642 516034676 /nfs/dbraw/zinc/03/46/76/516034676.db2.gz WVQYQZZDGFOOKU-ABAIWWIYSA-N 1 1 366.849 2.573 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C ZINC000487992113 516067526 /nfs/dbraw/zinc/06/75/26/516067526.db2.gz XBICEWLWNKIBTM-BBRMVZONSA-N 1 1 365.430 2.679 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCC[C@H]1C ZINC000487998522 516073098 /nfs/dbraw/zinc/07/30/98/516073098.db2.gz IGARPZFQQOKSCD-CJNGLKHVSA-N 1 1 365.430 2.679 20 5 FFBDMO CNC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000474786228 516194793 /nfs/dbraw/zinc/19/47/93/516194793.db2.gz QNJHPJAKTRQTAR-QGZVFWFLSA-N 1 1 368.437 2.665 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@]4(CCOC4)C3)o2)c([N+](=O)[O-])c1 ZINC000470326116 516204922 /nfs/dbraw/zinc/20/49/22/516204922.db2.gz WYPRPOVQTAYOOM-LJQANCHMSA-N 1 1 374.393 2.855 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@]4(CCOC4)C3)o2)c([N+](=O)[O-])c1 ZINC000470326116 516204925 /nfs/dbraw/zinc/20/49/25/516204925.db2.gz WYPRPOVQTAYOOM-LJQANCHMSA-N 1 1 374.393 2.855 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488714512 516292148 /nfs/dbraw/zinc/29/21/48/516292148.db2.gz NCEXXZOOIOFYEJ-LBTNJELSSA-N 1 1 372.469 2.654 20 5 FFBDMO COC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000488748782 516299991 /nfs/dbraw/zinc/29/99/91/516299991.db2.gz HORQCXVJBQHLFO-GDZNZVCISA-N 1 1 361.442 2.856 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000512668151 516319684 /nfs/dbraw/zinc/31/96/84/516319684.db2.gz JGTFUSXXAAMLGP-SVEBXFOSSA-N 1 1 361.467 2.648 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000512668151 516319687 /nfs/dbraw/zinc/31/96/87/516319687.db2.gz JGTFUSXXAAMLGP-SVEBXFOSSA-N 1 1 361.467 2.648 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000497428004 516322048 /nfs/dbraw/zinc/32/20/48/516322048.db2.gz HRUCCMQVDSJMKU-ZWKOTPCHSA-N 1 1 371.462 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccc(F)cc2Cl)cc1 ZINC000543619552 516331565 /nfs/dbraw/zinc/33/15/65/516331565.db2.gz DTOKYKSHXAYFLK-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000561015894 516339514 /nfs/dbraw/zinc/33/95/14/516339514.db2.gz OTVSPINKXJYZFI-KRWDZBQOSA-N 1 1 369.421 2.673 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000557639667 516354085 /nfs/dbraw/zinc/35/40/85/516354085.db2.gz SBFBJSLDKKPBOG-JKSUJKDBSA-N 1 1 370.409 2.942 20 5 FFBDMO Cc1noc(C)c1C[NH+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000561139433 516402401 /nfs/dbraw/zinc/40/24/01/516402401.db2.gz GOTVUCTVVAFKDQ-UHFFFAOYSA-N 1 1 374.426 2.527 20 5 FFBDMO Cn1c(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572612 516404847 /nfs/dbraw/zinc/40/48/47/516404847.db2.gz IEGPBFWAANQUCS-BBRMVZONSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000535572612 516404855 /nfs/dbraw/zinc/40/48/55/516404855.db2.gz IEGPBFWAANQUCS-BBRMVZONSA-N 1 1 362.817 2.762 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)C[C@@H]1Cc1ccccc1 ZINC000557741357 516413839 /nfs/dbraw/zinc/41/38/39/516413839.db2.gz DLRZQEBZCBRDFN-AWEZNQCLSA-N 1 1 369.450 2.963 20 5 FFBDMO CCOc1ccc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000561274196 516494945 /nfs/dbraw/zinc/49/49/45/516494945.db2.gz AQROCJGRRSAAAL-UHFFFAOYSA-N 1 1 369.421 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCN(c3cc[nH+]cc3Br)C2)nc1 ZINC000561283190 516501537 /nfs/dbraw/zinc/50/15/37/516501537.db2.gz PINUQKKXMCAOFD-SNVBAGLBSA-N 1 1 364.203 2.838 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000531629015 516562125 /nfs/dbraw/zinc/56/21/25/516562125.db2.gz JSLUGQABWVWFPW-KRWDZBQOSA-N 1 1 369.425 2.512 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000531629016 516564281 /nfs/dbraw/zinc/56/42/81/516564281.db2.gz JSLUGQABWVWFPW-QGZVFWFLSA-N 1 1 369.425 2.512 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000540478249 516572374 /nfs/dbraw/zinc/57/23/74/516572374.db2.gz PKRJACHQLJWZTE-KRWDZBQOSA-N 1 1 373.384 2.600 20 5 FFBDMO C[C@@H]1CC[N@@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140111 516646638 /nfs/dbraw/zinc/64/66/38/516646638.db2.gz LAXFBSLUEBHELQ-CJNGLKHVSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140111 516646645 /nfs/dbraw/zinc/64/66/45/516646645.db2.gz LAXFBSLUEBHELQ-CJNGLKHVSA-N 1 1 357.410 2.739 20 5 FFBDMO Cc1ccc2nc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cc(=O)n2c1 ZINC000554846182 516661918 /nfs/dbraw/zinc/66/19/18/516661918.db2.gz MKWPYYYMNYHSLE-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1 ZINC000540687079 516670364 /nfs/dbraw/zinc/67/03/64/516670364.db2.gz FIXBAPGCCAHOKN-QGZVFWFLSA-N 1 1 363.458 2.909 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000536391302 516748162 /nfs/dbraw/zinc/74/81/62/516748162.db2.gz UHPNZZPYZMGKNQ-MRXNPFEDSA-N 1 1 356.426 2.601 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000548094766 516758909 /nfs/dbraw/zinc/75/89/09/516758909.db2.gz OJWUUYCITFPYDK-IEBWSBKVSA-N 1 1 368.437 2.882 20 5 FFBDMO C[C@H]1CCC[C@](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000518810959 516784631 /nfs/dbraw/zinc/78/46/31/516784631.db2.gz IRZJEPYJEUGTHS-SGTLLEGYSA-N 1 1 359.430 2.711 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000555110837 516786358 /nfs/dbraw/zinc/78/63/58/516786358.db2.gz VIMILLWGYXXHNY-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000532169966 516840486 /nfs/dbraw/zinc/84/04/86/516840486.db2.gz YZQACRUNJQWGCD-WBVHZDCISA-N 1 1 362.430 2.668 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000558642079 516853896 /nfs/dbraw/zinc/85/38/96/516853896.db2.gz SJXDYIABSJLJTI-GOSISDBHSA-N 1 1 373.457 2.600 20 5 FFBDMO Cn1ccnc1[C@H](N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000514098396 516861382 /nfs/dbraw/zinc/86/13/82/516861382.db2.gz GOWHRWNYJABYSY-JFIYKMOQSA-N 1 1 355.442 2.634 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551782912 516868931 /nfs/dbraw/zinc/86/89/31/516868931.db2.gz XCGQSBNEAJQMNW-SFHVURJKSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551782912 516868941 /nfs/dbraw/zinc/86/89/41/516868941.db2.gz XCGQSBNEAJQMNW-SFHVURJKSA-N 1 1 353.422 2.523 20 5 FFBDMO Cc1cc(NCCCN2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000514213692 516905823 /nfs/dbraw/zinc/90/58/23/516905823.db2.gz HZJUAGJSSFSWCW-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000558762869 516933220 /nfs/dbraw/zinc/93/32/20/516933220.db2.gz ZKZXMBVCQVGLMY-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCc3ccccc3C2)c1 ZINC000558762869 516933233 /nfs/dbraw/zinc/93/32/33/516933233.db2.gz ZKZXMBVCQVGLMY-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000544848589 516958652 /nfs/dbraw/zinc/95/86/52/516958652.db2.gz FQSGKRAFWBTGOH-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000525397445 517029751 /nfs/dbraw/zinc/02/97/51/517029751.db2.gz PFNBQKNMEGYWTK-CHWSQXEVSA-N 1 1 372.425 2.793 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454599 517046377 /nfs/dbraw/zinc/04/63/77/517046377.db2.gz JREOXJYWGZABQM-DNVCBOLYSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H](NC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454599 517046386 /nfs/dbraw/zinc/04/63/86/517046386.db2.gz JREOXJYWGZABQM-DNVCBOLYSA-N 1 1 369.421 2.673 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000525554725 517074574 /nfs/dbraw/zinc/07/45/74/517074574.db2.gz PEUUTBNRAOYPTK-BLLLJJGKSA-N 1 1 362.455 2.808 20 5 FFBDMO Cc1c(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cccc1[N+](=O)[O-] ZINC000552198734 517134687 /nfs/dbraw/zinc/13/46/87/517134687.db2.gz DRKDVVWUBQJDKG-INIZCTEOSA-N 1 1 355.394 2.722 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000532823012 517159293 /nfs/dbraw/zinc/15/92/93/517159293.db2.gz GRJYXBTZRAXQON-CYBMUJFWSA-N 1 1 353.378 2.884 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000532823012 517159297 /nfs/dbraw/zinc/15/92/97/517159297.db2.gz GRJYXBTZRAXQON-CYBMUJFWSA-N 1 1 353.378 2.884 20 5 FFBDMO C[C@H]1c2cccn2CC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532901642 517195680 /nfs/dbraw/zinc/19/56/80/517195680.db2.gz DIVCMRQPZBZYSE-ZDUSSCGKSA-N 1 1 356.382 2.771 20 5 FFBDMO C[C@H]1c2cccn2CC[N@@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532901642 517195683 /nfs/dbraw/zinc/19/56/83/517195683.db2.gz DIVCMRQPZBZYSE-ZDUSSCGKSA-N 1 1 356.382 2.771 20 5 FFBDMO CSC1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCC1 ZINC000519824372 517206152 /nfs/dbraw/zinc/20/61/52/517206152.db2.gz HBNWFWMQCFSKAY-UHFFFAOYSA-N 1 1 355.485 2.700 20 5 FFBDMO C[C@@H](C[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 ZINC000532942555 517215158 /nfs/dbraw/zinc/21/51/58/517215158.db2.gz LPRBHUWQNXUSML-ZDUSSCGKSA-N 1 1 371.393 2.998 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccccc1)C[C@H](C)O ZINC000532974060 517228055 /nfs/dbraw/zinc/22/80/55/517228055.db2.gz NAAJPDRGVPEBRU-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccccc1)C[C@H](C)O ZINC000532974060 517228066 /nfs/dbraw/zinc/22/80/66/517228066.db2.gz NAAJPDRGVPEBRU-HNNXBMFYSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1cc(N2CCC(OCC[NH+](C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000542120326 517391666 /nfs/dbraw/zinc/39/16/66/517391666.db2.gz ZSDMJTQKSHHYTQ-UHFFFAOYSA-N 1 1 358.442 2.998 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1F)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000542210166 517436913 /nfs/dbraw/zinc/43/69/13/517436913.db2.gz PZSHDCWBZMLSFS-CQSZACIVSA-N 1 1 352.337 2.745 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1F)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000542210166 517436918 /nfs/dbraw/zinc/43/69/18/517436918.db2.gz PZSHDCWBZMLSFS-CQSZACIVSA-N 1 1 352.337 2.745 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000533447571 517468392 /nfs/dbraw/zinc/46/83/92/517468392.db2.gz JQMWOFNZELFBSN-JSGCOSHPSA-N 1 1 368.865 2.991 20 5 FFBDMO COc1ccc2c(c1)CCC[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC000542279880 517482336 /nfs/dbraw/zinc/48/23/36/517482336.db2.gz QDAYJDITHJLBBI-KRWDZBQOSA-N 1 1 372.421 2.792 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(N2CCOCC2)s1 ZINC000549411110 517551402 /nfs/dbraw/zinc/55/14/02/517551402.db2.gz WEZUMALKJOLGLD-UHFFFAOYSA-N 1 1 362.455 2.562 20 5 FFBDMO C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1Cc1ccccc1 ZINC000553343489 517655344 /nfs/dbraw/zinc/65/53/44/517655344.db2.gz ROVSHSOWGQWSBX-MRXNPFEDSA-N 1 1 352.438 2.926 20 5 FFBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708887 517666952 /nfs/dbraw/zinc/66/69/52/517666952.db2.gz GKYNFAORANJAMT-SWLSCSKDSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549708887 517666960 /nfs/dbraw/zinc/66/69/60/517666960.db2.gz GKYNFAORANJAMT-SWLSCSKDSA-N 1 1 373.375 2.909 20 5 FFBDMO CCNC(=O)[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000549843466 517741035 /nfs/dbraw/zinc/74/10/35/517741035.db2.gz OLGFHEZURHSREC-HNNXBMFYSA-N 1 1 362.455 2.969 20 5 FFBDMO C[NH+](C)C1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCCCC1 ZINC000560393181 517763447 /nfs/dbraw/zinc/76/34/47/517763447.db2.gz PISXOQPNMDVCDZ-QGZVFWFLSA-N 1 1 365.474 2.579 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000538918883 517843133 /nfs/dbraw/zinc/84/31/33/517843133.db2.gz PGYLAPLFCQZXKP-SRVKXCTJSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C ZINC000538918883 517843144 /nfs/dbraw/zinc/84/31/44/517843144.db2.gz PGYLAPLFCQZXKP-SRVKXCTJSA-N 1 1 355.822 2.567 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1 ZINC000553812829 517917991 /nfs/dbraw/zinc/91/79/91/517917991.db2.gz AKTOAQGFNKMENA-HOTGVXAUSA-N 1 1 363.458 2.909 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000543158476 517937246 /nfs/dbraw/zinc/93/72/46/517937246.db2.gz HFHSSFSVKGVUJM-OAHLLOKOSA-N 1 1 357.435 2.990 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)CSc2ccccc2[N+](=O)[O-])C1 ZINC000543158476 517937254 /nfs/dbraw/zinc/93/72/54/517937254.db2.gz HFHSSFSVKGVUJM-OAHLLOKOSA-N 1 1 357.435 2.990 20 5 FFBDMO C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000553867777 517942738 /nfs/dbraw/zinc/94/27/38/517942738.db2.gz XBJUPRZPEYIFQP-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO COc1ccccc1CCNC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000539379148 518018589 /nfs/dbraw/zinc/01/85/89/518018589.db2.gz NNBGYAYTIGWGLN-AWEZNQCLSA-N 1 1 357.410 2.613 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000557526746 518056938 /nfs/dbraw/zinc/05/69/38/518056938.db2.gz KKZJTLCLUCQWAL-LLVKDONJSA-N 1 1 357.863 2.893 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000557526746 518056945 /nfs/dbraw/zinc/05/69/45/518056945.db2.gz KKZJTLCLUCQWAL-LLVKDONJSA-N 1 1 357.863 2.893 20 5 FFBDMO CC(C)(CS(C)(=O)=O)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000547285613 518057289 /nfs/dbraw/zinc/05/72/89/518057289.db2.gz VENLKTNBQBCYEF-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000522386956 518093842 /nfs/dbraw/zinc/09/38/42/518093842.db2.gz QKRGINYGRBIKTN-CHWSQXEVSA-N 1 1 369.849 2.816 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000543574257 518142476 /nfs/dbraw/zinc/14/24/76/518142476.db2.gz PVZSAQIEHWSKRA-VQIMIIECSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000543574257 518142482 /nfs/dbraw/zinc/14/24/82/518142482.db2.gz PVZSAQIEHWSKRA-VQIMIIECSA-N 1 1 364.442 2.616 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856256 518204773 /nfs/dbraw/zinc/20/47/73/518204773.db2.gz MCVVFPCEXMXSTL-QAPCUYQASA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856256 518204778 /nfs/dbraw/zinc/20/47/78/518204778.db2.gz MCVVFPCEXMXSTL-QAPCUYQASA-N 1 1 352.394 2.585 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC(C)(C)[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000566884671 518246356 /nfs/dbraw/zinc/24/63/56/518246356.db2.gz QNOLNTSZRCZQRF-DLBZAZTESA-N 1 1 350.415 2.872 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000584547548 518393589 /nfs/dbraw/zinc/39/35/89/518393589.db2.gz HGLQJOMBIQMINR-PRXAMGSTSA-N 1 1 367.396 2.604 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000584562100 518397843 /nfs/dbraw/zinc/39/78/43/518397843.db2.gz RKNSBGCRMIRDJD-CVEARBPZSA-N 1 1 354.410 2.517 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(CC(F)(F)F)C1=O ZINC000567252596 518432615 /nfs/dbraw/zinc/43/26/15/518432615.db2.gz JQPWNGITUYXWJI-CQSZACIVSA-N 1 1 359.348 2.622 20 5 FFBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C[C@H]21 ZINC000585781920 518595388 /nfs/dbraw/zinc/59/53/88/518595388.db2.gz CXXAPYLQXGSABT-SJORKVTESA-N 1 1 372.400 2.705 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)[C@@H]2C1 ZINC000585783658 518596125 /nfs/dbraw/zinc/59/61/25/518596125.db2.gz ZLUVLQCGSKGCCF-SJORKVTESA-N 1 1 354.410 2.566 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+]1C1CC1 ZINC000586836241 518658651 /nfs/dbraw/zinc/65/86/51/518658651.db2.gz KNEPYQSMSYCHSP-CYBMUJFWSA-N 1 1 354.204 2.923 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCC[N@H+]1C1CC1 ZINC000586836241 518658659 /nfs/dbraw/zinc/65/86/59/518658659.db2.gz KNEPYQSMSYCHSP-CYBMUJFWSA-N 1 1 354.204 2.923 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000579419902 518669121 /nfs/dbraw/zinc/66/91/21/518669121.db2.gz WPRSTNTUHCPZLQ-KRWDZBQOSA-N 1 1 374.441 2.516 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000570888239 518826159 /nfs/dbraw/zinc/82/61/59/518826159.db2.gz FKJJSBVEUZHZOE-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000568010484 518830291 /nfs/dbraw/zinc/83/02/91/518830291.db2.gz IBDHIOYRNLBWRX-LJQANCHMSA-N 1 1 354.410 2.693 20 5 FFBDMO COc1ccc(NC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000571077483 518914861 /nfs/dbraw/zinc/91/48/61/518914861.db2.gz KVEFIECGKNDYCF-UHFFFAOYSA-N 1 1 370.409 2.953 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)c1 ZINC000577172052 518948714 /nfs/dbraw/zinc/94/87/14/518948714.db2.gz ZXNHQAGIARTYNT-SFHVURJKSA-N 1 1 373.384 2.919 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCNC(=O)C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000589205616 518951927 /nfs/dbraw/zinc/95/19/27/518951927.db2.gz CHZHURLAJIVSQP-GFCCVEGCSA-N 1 1 359.382 2.574 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCNC(=O)C[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000589205616 518951935 /nfs/dbraw/zinc/95/19/35/518951935.db2.gz CHZHURLAJIVSQP-GFCCVEGCSA-N 1 1 359.382 2.574 20 5 FFBDMO Cc1c(Cc2nc([C@@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303315 519013851 /nfs/dbraw/zinc/01/38/51/519013851.db2.gz MYKGBQAVLHSVNX-MAUKXSAKSA-N 1 1 358.398 2.803 20 5 FFBDMO Cc1c(Cc2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303315 519013858 /nfs/dbraw/zinc/01/38/58/519013858.db2.gz MYKGBQAVLHSVNX-MAUKXSAKSA-N 1 1 358.398 2.803 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000577338970 519028500 /nfs/dbraw/zinc/02/85/00/519028500.db2.gz FKVNDYPICYXYEN-AUUYWEPGSA-N 1 1 369.421 2.904 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000589634569 519048857 /nfs/dbraw/zinc/04/88/57/519048857.db2.gz HBZHWONMHYAJBG-CABCVRRESA-N 1 1 371.441 2.545 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000565670743 519073528 /nfs/dbraw/zinc/07/35/28/519073528.db2.gz RVZRNXIUNVMUQA-LJQANCHMSA-N 1 1 367.449 2.831 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000565670743 519073531 /nfs/dbraw/zinc/07/35/31/519073531.db2.gz RVZRNXIUNVMUQA-LJQANCHMSA-N 1 1 367.449 2.831 20 5 FFBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)C(C)C ZINC000583094316 519073801 /nfs/dbraw/zinc/07/38/01/519073801.db2.gz LXVZJAXJXLVFGO-UHFFFAOYSA-N 1 1 354.426 2.713 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@](C)(O)C2)cc1OC ZINC000571792808 519277378 /nfs/dbraw/zinc/27/73/78/519277378.db2.gz PIBGUAVLKWOFLM-FZKQIMNGSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@](C)(O)C2)cc1OC ZINC000571792808 519277386 /nfs/dbraw/zinc/27/73/86/519277386.db2.gz PIBGUAVLKWOFLM-FZKQIMNGSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@](C)(O)C2)cc1OC ZINC000571792813 519277859 /nfs/dbraw/zinc/27/78/59/519277859.db2.gz PIBGUAVLKWOFLM-UGSOOPFHSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@](C)(O)C2)cc1OC ZINC000571792813 519277868 /nfs/dbraw/zinc/27/78/68/519277868.db2.gz PIBGUAVLKWOFLM-UGSOOPFHSA-N 1 1 352.431 2.985 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@H]2CN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569229158 519444417 /nfs/dbraw/zinc/44/44/17/519444417.db2.gz AKMXVIKVNSOWFT-GUYCJALGSA-N 1 1 368.441 2.861 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000569401099 519529480 /nfs/dbraw/zinc/52/94/80/519529480.db2.gz OMKLYKMKELZUJF-CQSZACIVSA-N 1 1 373.457 2.650 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(c3ccncn3)CC1)OCCO2 ZINC000591261359 519564270 /nfs/dbraw/zinc/56/42/70/519564270.db2.gz LRXHLPSJDMNJER-UHFFFAOYSA-N 1 1 356.382 2.536 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443823 519613377 /nfs/dbraw/zinc/61/33/77/519613377.db2.gz GIWQEUCZDUEEEP-CXAGYDPISA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443823 519613381 /nfs/dbraw/zinc/61/33/81/519613381.db2.gz GIWQEUCZDUEEEP-CXAGYDPISA-N 1 1 371.441 2.781 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000591510765 519934439 /nfs/dbraw/zinc/93/44/39/519934439.db2.gz JISDUFZCNFUMHH-IAGOWNOFSA-N 1 1 361.442 2.585 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000594417588 519954849 /nfs/dbraw/zinc/95/48/49/519954849.db2.gz CCRYPJQOOHITKG-CRAIPNDOSA-N 1 1 369.425 2.732 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594484098 519992922 /nfs/dbraw/zinc/99/29/22/519992922.db2.gz SAJZTWDXWISUML-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600007436 519997986 /nfs/dbraw/zinc/99/79/86/519997986.db2.gz RBFYGKJGQCKDSZ-UHFFFAOYSA-N 1 1 373.409 2.668 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997774 520013414 /nfs/dbraw/zinc/01/34/14/520013414.db2.gz QMTMYCXSDGZUHM-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997774 520013421 /nfs/dbraw/zinc/01/34/21/520013421.db2.gz QMTMYCXSDGZUHM-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000600193898 520115022 /nfs/dbraw/zinc/11/50/22/520115022.db2.gz YLABPQZLOFHXAB-SFHVURJKSA-N 1 1 360.366 2.619 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597584045 520119312 /nfs/dbraw/zinc/11/93/12/520119312.db2.gz XDEXLKHBFNKQSG-CABCVRRESA-N 1 1 367.446 2.965 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597606072 520132130 /nfs/dbraw/zinc/13/21/30/520132130.db2.gz UGJOWSRXPGSRPW-JSGCOSHPSA-N 1 1 369.849 2.958 20 5 FFBDMO CC(C)[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000600227072 520138425 /nfs/dbraw/zinc/13/84/25/520138425.db2.gz IHQOKOMMXKYATM-LJQANCHMSA-N 1 1 368.437 2.972 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000600227072 520138434 /nfs/dbraw/zinc/13/84/34/520138434.db2.gz IHQOKOMMXKYATM-LJQANCHMSA-N 1 1 368.437 2.972 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866591 520148349 /nfs/dbraw/zinc/14/83/49/520148349.db2.gz BCGAIWOJTZGTCD-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866591 520148362 /nfs/dbraw/zinc/14/83/62/520148362.db2.gz BCGAIWOJTZGTCD-CYBMUJFWSA-N 1 1 355.394 2.728 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252754 520159567 /nfs/dbraw/zinc/15/95/67/520159567.db2.gz NEIXDABCEIJAIG-INIZCTEOSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252754 520159581 /nfs/dbraw/zinc/15/95/81/520159581.db2.gz NEIXDABCEIJAIG-INIZCTEOSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252754 520159587 /nfs/dbraw/zinc/15/95/87/520159587.db2.gz NEIXDABCEIJAIG-INIZCTEOSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594854664 520190033 /nfs/dbraw/zinc/19/00/33/520190033.db2.gz VEACCJWGDYKADT-CQSZACIVSA-N 1 1 367.471 2.589 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000597714283 520193732 /nfs/dbraw/zinc/19/37/32/520193732.db2.gz HZDKMWJJVXRDRV-QGZVFWFLSA-N 1 1 351.834 2.735 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000600315927 520201259 /nfs/dbraw/zinc/20/12/59/520201259.db2.gz XHNZJBUASGVIKZ-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000592153437 520228090 /nfs/dbraw/zinc/22/80/90/520228090.db2.gz ARNIILOSPHYCJQ-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@H+](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594956285 520228909 /nfs/dbraw/zinc/22/89/09/520228909.db2.gz IYIQBQXPMGVLPC-INIZCTEOSA-N 1 1 357.458 2.958 20 5 FFBDMO Cn1cc(C[NH2+][C@H]2CCN(C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594956285 520228915 /nfs/dbraw/zinc/22/89/15/520228915.db2.gz IYIQBQXPMGVLPC-INIZCTEOSA-N 1 1 357.458 2.958 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)C(=O)NCc1ccccc1 ZINC000595006255 520252181 /nfs/dbraw/zinc/25/21/81/520252181.db2.gz HSDPCWZNAHDMMO-ZIAGYGMSSA-N 1 1 357.410 2.959 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCc2c1cnn2CCO ZINC000595019009 520259062 /nfs/dbraw/zinc/25/90/62/520259062.db2.gz VLSDPHLJNQUJQV-MLGOLLRUSA-N 1 1 360.414 2.520 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000609313834 520274001 /nfs/dbraw/zinc/27/40/01/520274001.db2.gz KMHRFAWQHZNJGL-UHFFFAOYSA-N 1 1 369.377 2.726 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000609313834 520274005 /nfs/dbraw/zinc/27/40/05/520274005.db2.gz KMHRFAWQHZNJGL-UHFFFAOYSA-N 1 1 369.377 2.726 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1Cc2ccccc2N(C)C1=O ZINC000595067893 520277949 /nfs/dbraw/zinc/27/79/49/520277949.db2.gz YYDDQYSTBPGWRL-BLLLJJGKSA-N 1 1 355.394 2.842 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600470115 520279901 /nfs/dbraw/zinc/27/99/01/520279901.db2.gz FWDZYYFLWVVQFO-OAHLLOKOSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600473179 520281400 /nfs/dbraw/zinc/28/14/00/520281400.db2.gz SQBXKZJYFYGHMD-INIZCTEOSA-N 1 1 356.426 2.752 20 5 FFBDMO COc1ccnc(C[NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1F ZINC000595082271 520285702 /nfs/dbraw/zinc/28/57/02/520285702.db2.gz XLRSFAGWBWPAMV-LLVKDONJSA-N 1 1 362.361 2.644 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492580 520415582 /nfs/dbraw/zinc/41/55/82/520415582.db2.gz AXYQFCXKWFQABD-PMPSAXMXSA-N 1 1 360.458 2.633 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592494026 520415730 /nfs/dbraw/zinc/41/57/30/520415730.db2.gz ZMKSBISBKOTHSI-HOTGVXAUSA-N 1 1 360.458 2.553 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592494025 520416760 /nfs/dbraw/zinc/41/67/60/520416760.db2.gz ZMKSBISBKOTHSI-CVEARBPZSA-N 1 1 360.458 2.553 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000617353048 520449116 /nfs/dbraw/zinc/44/91/16/520449116.db2.gz MYHLSYZSOBWGQL-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000604096876 520449826 /nfs/dbraw/zinc/44/98/26/520449826.db2.gz DMPMKDYHDXHKNA-KRWDZBQOSA-N 1 1 356.426 2.736 20 5 FFBDMO Cc1noc(C[NH+]2CCC(n3ccc(C(F)(F)F)n3)CC2)c1[N+](=O)[O-] ZINC000595430035 520465873 /nfs/dbraw/zinc/46/58/73/520465873.db2.gz UYCHKZDSIGESJM-UHFFFAOYSA-N 1 1 359.308 2.944 20 5 FFBDMO C[N@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000598195181 520487859 /nfs/dbraw/zinc/48/78/59/520487859.db2.gz LOTAZSAKFJXIKJ-QGZVFWFLSA-N 1 1 369.421 2.689 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000598195181 520487864 /nfs/dbraw/zinc/48/78/64/520487864.db2.gz LOTAZSAKFJXIKJ-QGZVFWFLSA-N 1 1 369.421 2.689 20 5 FFBDMO COC(=O)c1ccc2[nH]c(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])nc2c1 ZINC000595485780 520502722 /nfs/dbraw/zinc/50/27/22/520502722.db2.gz XVNGSZHJVSPAKL-UHFFFAOYSA-N 1 1 368.393 2.932 20 5 FFBDMO COC(=O)c1ccc2[nH]c(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])nc2c1 ZINC000595485780 520502730 /nfs/dbraw/zinc/50/27/30/520502730.db2.gz XVNGSZHJVSPAKL-UHFFFAOYSA-N 1 1 368.393 2.932 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](c1cccnc1)C(C)(C)CO ZINC000595502273 520512861 /nfs/dbraw/zinc/51/28/61/520512861.db2.gz XXTXPCIGXSLFDH-SFHVURJKSA-N 1 1 372.425 2.586 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000598341907 520564994 /nfs/dbraw/zinc/56/49/94/520564994.db2.gz IBHOSPCMAISJDK-LBPRGKRZSA-N 1 1 356.220 2.571 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000610208560 520579691 /nfs/dbraw/zinc/57/96/91/520579691.db2.gz DQOOPSABZHCSHF-AAEUAGOBSA-N 1 1 355.822 2.616 20 5 FFBDMO O=C(NCC[NH+]1Cc2ccccc2C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000604550631 520598867 /nfs/dbraw/zinc/59/88/67/520598867.db2.gz PJRKPENJOYRXGP-UHFFFAOYSA-N 1 1 350.378 2.822 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H](C)c1cscn1 ZINC000595669459 520635359 /nfs/dbraw/zinc/63/53/59/520635359.db2.gz UXKHBDXESVCOPF-JTQLQIEISA-N 1 1 350.400 2.739 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000601136225 520654747 /nfs/dbraw/zinc/65/47/47/520654747.db2.gz YPOKGANREVMGHG-NSHDSACASA-N 1 1 355.320 2.946 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000601136225 520654753 /nfs/dbraw/zinc/65/47/53/520654753.db2.gz YPOKGANREVMGHG-NSHDSACASA-N 1 1 355.320 2.946 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3ccnc(C)n3)C2)c([N+](=O)[O-])c1 ZINC000610368053 520655041 /nfs/dbraw/zinc/65/50/41/520655041.db2.gz OSJABBMKTSQISV-OAHLLOKOSA-N 1 1 372.425 2.960 20 5 FFBDMO CC(C)N(C)c1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1 ZINC000601148894 520659732 /nfs/dbraw/zinc/65/97/32/520659732.db2.gz HJNAHXOBANUJDW-IBGZPJMESA-N 1 1 358.442 2.832 20 5 FFBDMO COc1c(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598509064 520669175 /nfs/dbraw/zinc/66/91/75/520669175.db2.gz FZMOABZQEOSWPD-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1c(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598509064 520669182 /nfs/dbraw/zinc/66/91/82/520669182.db2.gz FZMOABZQEOSWPD-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601169506 520670685 /nfs/dbraw/zinc/67/06/85/520670685.db2.gz BNYOZKGFDYOVOD-UONOGXRCSA-N 1 1 362.389 2.928 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@H](CC)CO1 ZINC000593058089 520715759 /nfs/dbraw/zinc/71/57/59/520715759.db2.gz JAMFXVQJTJECKV-UKRRQHHQSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)OCC12CCC2 ZINC000593094228 520740477 /nfs/dbraw/zinc/74/04/77/520740477.db2.gz YCADOUBFLXYZIB-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000598614583 520743366 /nfs/dbraw/zinc/74/33/66/520743366.db2.gz LTOAOYBEIWCOPI-CJNGLKHVSA-N 1 1 370.409 2.709 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C2CC2)cc1 ZINC000610580740 520748177 /nfs/dbraw/zinc/74/81/77/520748177.db2.gz DMTJRAFANIDMTK-UHFFFAOYSA-N 1 1 366.377 3.000 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C2CC2)cc1 ZINC000610580740 520748183 /nfs/dbraw/zinc/74/81/83/520748183.db2.gz DMTJRAFANIDMTK-UHFFFAOYSA-N 1 1 366.377 3.000 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000595825708 520749871 /nfs/dbraw/zinc/74/98/71/520749871.db2.gz FVCQERGXTLSCMK-RBUKOAKNSA-N 1 1 371.437 2.545 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581036 520750796 /nfs/dbraw/zinc/75/07/96/520750796.db2.gz ZHPOFMSOOYJRTK-LZWOXQAQSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581036 520750805 /nfs/dbraw/zinc/75/08/05/520750805.db2.gz ZHPOFMSOOYJRTK-LZWOXQAQSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581036 520750809 /nfs/dbraw/zinc/75/08/09/520750809.db2.gz ZHPOFMSOOYJRTK-LZWOXQAQSA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H](C)O1 ZINC000610581036 520750818 /nfs/dbraw/zinc/75/08/18/520750818.db2.gz ZHPOFMSOOYJRTK-LZWOXQAQSA-N 1 1 374.441 2.810 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000598627703 520751371 /nfs/dbraw/zinc/75/13/71/520751371.db2.gz XQUMAXHIDPYDHV-CZUORRHYSA-N 1 1 370.409 2.851 20 5 FFBDMO CCC[N@H+](C)CC(C)(C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000595872832 520782711 /nfs/dbraw/zinc/78/27/11/520782711.db2.gz HUWFRKMTQKUZQI-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000595872832 520782719 /nfs/dbraw/zinc/78/27/19/520782719.db2.gz HUWFRKMTQKUZQI-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C[N@H+]1C ZINC000593189113 520813873 /nfs/dbraw/zinc/81/38/73/520813873.db2.gz IKUCMWTYZNDHMR-AXFHLTTASA-N 1 1 357.357 2.749 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC2(CCC2)[C@H]1c1ccncc1 ZINC000596038405 520871696 /nfs/dbraw/zinc/87/16/96/520871696.db2.gz MLGDROVDTOHFDR-QFBILLFUSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC2(CCC2)[C@H]1c1ccncc1 ZINC000596038405 520871703 /nfs/dbraw/zinc/87/17/03/520871703.db2.gz MLGDROVDTOHFDR-QFBILLFUSA-N 1 1 369.421 2.957 20 5 FFBDMO C[N@@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@H](c2ccccc2)C1 ZINC000610930367 520908107 /nfs/dbraw/zinc/90/81/07/520908107.db2.gz DQSUPMMCWJQOBH-SFHVURJKSA-N 1 1 369.421 2.855 20 5 FFBDMO C[N@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)[C@H](c2ccccc2)C1 ZINC000610930367 520908114 /nfs/dbraw/zinc/90/81/14/520908114.db2.gz DQSUPMMCWJQOBH-SFHVURJKSA-N 1 1 369.421 2.855 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593322017 520908619 /nfs/dbraw/zinc/90/86/19/520908619.db2.gz KUJKJWVWNLECSA-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593322017 520908627 /nfs/dbraw/zinc/90/86/27/520908627.db2.gz KUJKJWVWNLECSA-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593323636 520909819 /nfs/dbraw/zinc/90/98/19/520909819.db2.gz ROUARRHWULPWRM-SFHVURJKSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593323636 520909825 /nfs/dbraw/zinc/90/98/25/520909825.db2.gz ROUARRHWULPWRM-SFHVURJKSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1 ZINC000596106787 520916933 /nfs/dbraw/zinc/91/69/33/520916933.db2.gz VYZPSBYTYZCDSF-UHFFFAOYSA-N 1 1 355.442 2.920 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951109 520917575 /nfs/dbraw/zinc/91/75/75/520917575.db2.gz GZESEVVKGXVFRX-GXTWGEPZSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951109 520917583 /nfs/dbraw/zinc/91/75/83/520917583.db2.gz GZESEVVKGXVFRX-GXTWGEPZSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951109 520917584 /nfs/dbraw/zinc/91/75/84/520917584.db2.gz GZESEVVKGXVFRX-GXTWGEPZSA-N 1 1 361.446 2.530 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000610968321 520922610 /nfs/dbraw/zinc/92/26/10/520922610.db2.gz VQAFYFMCHKUJTI-IBGZPJMESA-N 1 1 372.469 2.650 20 5 FFBDMO Cc1cc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])s1 ZINC000596175170 520952142 /nfs/dbraw/zinc/95/21/42/520952142.db2.gz QJXUUMVUFSLPFJ-YIONKMFJSA-N 1 1 350.488 2.712 20 5 FFBDMO COc1cc(N2CC[N@H+](CC(C)(C)O)[C@@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596223138 520979870 /nfs/dbraw/zinc/97/98/70/520979870.db2.gz QASRSWZDBGJYNH-NSHDSACASA-N 1 1 357.838 2.538 20 5 FFBDMO COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596223138 520979878 /nfs/dbraw/zinc/97/98/78/520979878.db2.gz QASRSWZDBGJYNH-NSHDSACASA-N 1 1 357.838 2.538 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC(C[NH+]3CCOCC3)C2)nc1-c1ccc(F)cc1 ZINC000596239415 520990021 /nfs/dbraw/zinc/99/00/21/520990021.db2.gz GUJYXDQNXMDYNZ-UHFFFAOYSA-N 1 1 372.400 2.564 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1c(Br)cccc1[N+](=O)[O-] ZINC000599080994 521021266 /nfs/dbraw/zinc/02/12/66/521021266.db2.gz RNZFMPSWJROURB-NWDGAFQWSA-N 1 1 368.231 2.714 20 5 FFBDMO COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(C)cc1C ZINC000611185041 521028988 /nfs/dbraw/zinc/02/89/88/521028988.db2.gz QTZZYDQRFRSQFZ-UHFFFAOYSA-N 1 1 359.426 2.522 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCOCC12CCCC2 ZINC000611194895 521031660 /nfs/dbraw/zinc/03/16/60/521031660.db2.gz MGNYKDKORVLFQC-UHFFFAOYSA-N 1 1 361.398 2.538 20 5 FFBDMO CC[N@@H+](C[C@H]1CCOC1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000611205371 521036868 /nfs/dbraw/zinc/03/68/68/521036868.db2.gz YHHNUCXOBQGPBK-VXGBXAGGSA-N 1 1 355.822 2.934 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000596462804 521085228 /nfs/dbraw/zinc/08/52/28/521085228.db2.gz TUQFJJSHJNXGDQ-QGZVFWFLSA-N 1 1 357.458 2.873 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC([N@@H+]4CC[C@@H](O)C4)C3)s2)cc1 ZINC000593679675 521150673 /nfs/dbraw/zinc/15/06/73/521150673.db2.gz GGQDORRDMLXUQD-MRXNPFEDSA-N 1 1 359.451 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC([N@H+]4CC[C@@H](O)C4)C3)s2)cc1 ZINC000593679675 521150685 /nfs/dbraw/zinc/15/06/85/521150685.db2.gz GGQDORRDMLXUQD-MRXNPFEDSA-N 1 1 359.451 2.574 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3C[S@]4=O)o2)c([N+](=O)[O-])c1 ZINC000593689396 521159154 /nfs/dbraw/zinc/15/91/54/521159154.db2.gz TURPKLFESLMJGC-JVQKCWSZSA-N 1 1 362.407 2.569 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3C[S@]4=O)o2)c([N+](=O)[O-])c1 ZINC000593689396 521159162 /nfs/dbraw/zinc/15/91/62/521159162.db2.gz TURPKLFESLMJGC-JVQKCWSZSA-N 1 1 362.407 2.569 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)CCO)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000593694491 521162195 /nfs/dbraw/zinc/16/21/95/521162195.db2.gz NJKNAMHSPOLNFU-JTQLQIEISA-N 1 1 366.336 2.747 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C1CC1 ZINC000593697998 521164676 /nfs/dbraw/zinc/16/46/76/521164676.db2.gz WPABIBCKPSRIMC-UONOGXRCSA-N 1 1 370.352 2.827 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596625225 521173803 /nfs/dbraw/zinc/17/38/03/521173803.db2.gz QGELKAXDPFHDFI-CQSZACIVSA-N 1 1 362.430 2.847 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000611512578 521193937 /nfs/dbraw/zinc/19/39/37/521193937.db2.gz HYBCRFQEDNDHCB-HNNXBMFYSA-N 1 1 366.849 2.574 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000611554931 521216786 /nfs/dbraw/zinc/21/67/86/521216786.db2.gz CJWKJWYKDQNEHI-BZPMIXESSA-N 1 1 362.348 2.997 20 5 FFBDMO Cc1ccccc1-c1noc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1 ZINC000618759084 521218254 /nfs/dbraw/zinc/21/82/54/521218254.db2.gz IRPCUDXYTJIDJO-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1ccc(CNC(=O)NCc2ccccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611576893 521229427 /nfs/dbraw/zinc/22/94/27/521229427.db2.gz HYYVUEWLMKSKCO-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)c1[N+](=O)[O-] ZINC000611582777 521236062 /nfs/dbraw/zinc/23/60/62/521236062.db2.gz HLZBAYRFGZBTKV-UHFFFAOYSA-N 1 1 372.429 2.504 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000599516341 521273269 /nfs/dbraw/zinc/27/32/69/521273269.db2.gz REKWDILMESMYQJ-CQSZACIVSA-N 1 1 363.364 2.914 20 5 FFBDMO CC(C)[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000599548065 521288645 /nfs/dbraw/zinc/28/86/45/521288645.db2.gz ALOVAEPCEKLEST-GOSISDBHSA-N 1 1 357.458 2.634 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599576167 521308945 /nfs/dbraw/zinc/30/89/45/521308945.db2.gz KFDHMAMJDJGIBN-VHSXEESVSA-N 1 1 356.220 2.570 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](OC2CCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000594027585 521359770 /nfs/dbraw/zinc/35/97/70/521359770.db2.gz WQRPUPFNKZBAJA-QGZVFWFLSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](OC2CCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000594027585 521359776 /nfs/dbraw/zinc/35/97/76/521359776.db2.gz WQRPUPFNKZBAJA-QGZVFWFLSA-N 1 1 359.426 2.517 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000602474184 521366542 /nfs/dbraw/zinc/36/65/42/521366542.db2.gz ITBGCFHEKCPFKH-CYBMUJFWSA-N 1 1 373.375 2.768 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000602474184 521366550 /nfs/dbraw/zinc/36/65/50/521366550.db2.gz ITBGCFHEKCPFKH-CYBMUJFWSA-N 1 1 373.375 2.768 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000599671021 521385198 /nfs/dbraw/zinc/38/51/98/521385198.db2.gz VYIFYFRTVJNRTM-GOSISDBHSA-N 1 1 356.378 2.746 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(Cc3cc(Br)c([N+](=O)[O-])s3)[C@H]2C1 ZINC000602592399 521429818 /nfs/dbraw/zinc/42/98/18/521429818.db2.gz QWUKHRIZZNYFOB-CABZTGNLSA-N 1 1 360.277 2.945 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCCCS1(=O)=O ZINC000602605266 521434939 /nfs/dbraw/zinc/43/49/39/521434939.db2.gz XNNNQBVEVAOVSB-LBPRGKRZSA-N 1 1 366.361 2.671 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000594199246 521464873 /nfs/dbraw/zinc/46/48/73/521464873.db2.gz IHWVGXQXVXBBLG-WBVHZDCISA-N 1 1 358.442 2.916 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000594198712 521465300 /nfs/dbraw/zinc/46/53/00/521465300.db2.gz VFPGQRSUYZPBKF-GDBMZVCRSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619252168 521471499 /nfs/dbraw/zinc/47/14/99/521471499.db2.gz FSSZCBBRBKFPHF-RCBQFDQVSA-N 1 1 367.446 2.720 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)c1 ZINC000619254077 521473563 /nfs/dbraw/zinc/47/35/63/521473563.db2.gz HTDHOQWOFLLHGD-DZGCQCFKSA-N 1 1 353.419 2.575 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597094324 521500000 /nfs/dbraw/zinc/50/00/00/521500000.db2.gz DIQQYYQFLLXKBZ-JTQLQIEISA-N 1 1 355.826 2.682 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12)C1=CC[N@@H+](C)CC1 ZINC000599832639 521500754 /nfs/dbraw/zinc/50/07/54/521500754.db2.gz GYBWFFLOKSAAQI-LBPRGKRZSA-N 1 1 355.398 2.915 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597095687 521501295 /nfs/dbraw/zinc/50/12/95/521501295.db2.gz FDRQDXGJYJHOKF-ZDUSSCGKSA-N 1 1 355.826 2.634 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597095632 521501705 /nfs/dbraw/zinc/50/17/05/521501705.db2.gz YNAGTOVIENTCMX-SNVBAGLBSA-N 1 1 355.826 2.826 20 5 FFBDMO O=C1[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CCN1C1CCC1 ZINC000602732142 521502554 /nfs/dbraw/zinc/50/25/54/521502554.db2.gz ZQYWWHSDZAFORP-NSHDSACASA-N 1 1 374.260 2.662 20 5 FFBDMO COc1cccc(C[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C2CCC(O)CC2)c1 ZINC000602780638 521526853 /nfs/dbraw/zinc/52/68/53/521526853.db2.gz KPGUYLWIOPNANH-UHFFFAOYSA-N 1 1 374.441 2.643 20 5 FFBDMO COc1cccc(C[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C2CCC(O)CC2)c1 ZINC000602780638 521526857 /nfs/dbraw/zinc/52/68/57/521526857.db2.gz KPGUYLWIOPNANH-UHFFFAOYSA-N 1 1 374.441 2.643 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000602786554 521531481 /nfs/dbraw/zinc/53/14/81/521531481.db2.gz QZRRSDCZKGNRDX-SFHVURJKSA-N 1 1 357.458 2.554 20 5 FFBDMO C[NH+](C)[C@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000594336035 521564642 /nfs/dbraw/zinc/56/46/42/521564642.db2.gz FEDNKUVVWIMNFJ-KRWDZBQOSA-N 1 1 374.828 2.831 20 5 FFBDMO CC(C)[N@@H+]1CCCC[C@@H]1Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000619864457 521909180 /nfs/dbraw/zinc/90/91/80/521909180.db2.gz SJQRAPAWSMZFIY-LLVKDONJSA-N 1 1 358.236 2.782 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1Cn1cc([N+](=O)[O-])cc(Br)c1=O ZINC000619864457 521909190 /nfs/dbraw/zinc/90/91/90/521909190.db2.gz SJQRAPAWSMZFIY-LLVKDONJSA-N 1 1 358.236 2.782 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000026218839 535521248 /nfs/dbraw/zinc/52/12/48/535521248.db2.gz RNGDCILWTUHWSD-CQSZACIVSA-N 1 1 363.414 2.507 20 5 FFBDMO Cc1nc(Cl)nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164725140 720333321 /nfs/dbraw/zinc/33/33/21/720333321.db2.gz LVLHYICCHOSDSM-UONOGXRCSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723932 720367184 /nfs/dbraw/zinc/36/71/84/720367184.db2.gz IDIJMOKSVQGAQY-GJZGRUSLSA-N 1 1 359.817 2.891 20 5 FFBDMO COCCO[C@]12CCC[C@@]1([NH2+]Cc1ccc([N+](=O)[O-])cc1F)CCO2 ZINC000897998980 735301835 /nfs/dbraw/zinc/30/18/35/735301835.db2.gz DXUCXQFTIWAXCL-IAGOWNOFSA-N 1 1 354.378 2.526 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(C3OCCO3)CC2)ccc1Br ZINC000130066721 728714928 /nfs/dbraw/zinc/71/49/28/728714928.db2.gz CUTGIFIXKOCGTI-UHFFFAOYSA-N 1 1 371.231 2.942 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@@H+]1CCOC ZINC000139682338 728741271 /nfs/dbraw/zinc/74/12/71/728741271.db2.gz ZJLBTMZGQFWBEA-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CCOC ZINC000139682338 728741272 /nfs/dbraw/zinc/74/12/72/728741272.db2.gz ZJLBTMZGQFWBEA-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000232652389 729552414 /nfs/dbraw/zinc/55/24/14/729552414.db2.gz CKOIMUCVVZTEDG-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@H](O)c3ccc(Cl)cc3)C2)nc1 ZINC000245441997 729569981 /nfs/dbraw/zinc/56/99/81/729569981.db2.gz HSMKHPHUIUAFNR-ZBFHGGJFSA-N 1 1 362.817 2.863 20 5 FFBDMO CNC(=O)C1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC1 ZINC000779176913 738441782 /nfs/dbraw/zinc/44/17/82/738441782.db2.gz ULEQBWNGIPDQFB-UHFFFAOYSA-N 1 1 360.439 2.867 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000861340143 730600585 /nfs/dbraw/zinc/60/05/85/730600585.db2.gz FFZMUYULNXRSIX-IFIJOSMWSA-N 1 1 368.455 2.728 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000861996881 730659919 /nfs/dbraw/zinc/65/99/19/730659919.db2.gz QQHAFTCKNLLYFA-ZDUSSCGKSA-N 1 1 360.267 2.659 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NCC[N@@H+]1CCc2sccc2C1 ZINC000864982387 730898723 /nfs/dbraw/zinc/89/87/23/730898723.db2.gz RGGNVZVFWRCWDC-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NCC[N@H+]1CCc2sccc2C1 ZINC000864982387 730898727 /nfs/dbraw/zinc/89/87/27/730898727.db2.gz RGGNVZVFWRCWDC-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000872033931 731722994 /nfs/dbraw/zinc/72/29/94/731722994.db2.gz KKZZUQLTOWVPST-CFVMTHIKSA-N 1 1 351.472 2.831 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CN2CCC[C@@H]2CO1 ZINC000872033931 731722998 /nfs/dbraw/zinc/72/29/98/731722998.db2.gz KKZZUQLTOWVPST-CFVMTHIKSA-N 1 1 351.472 2.831 20 5 FFBDMO C[C@@H]([NH2+]C[C@H]1CS(=O)(=O)c2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872075888 731727362 /nfs/dbraw/zinc/72/73/62/731727362.db2.gz VJLABBMOAUMLHD-NEPJUHHUSA-N 1 1 364.398 2.956 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000874837190 732105781 /nfs/dbraw/zinc/10/57/81/732105781.db2.gz IZUFOJFYQPPDAK-STQMWFEESA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@]12COC[C@@H]1C[N@@H+](Cc1nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o1)C2 ZINC000878949130 732620366 /nfs/dbraw/zinc/62/03/66/732620366.db2.gz IXLUSQSQGCQURP-QFYYESIMSA-N 1 1 364.789 2.767 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)o1 ZINC000878991190 732627985 /nfs/dbraw/zinc/62/79/85/732627985.db2.gz VSVOYSCVMUBRIB-MNOVXSKESA-N 1 1 364.789 2.767 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000879560715 732723227 /nfs/dbraw/zinc/72/32/27/732723227.db2.gz IFHZXQDTTFTUMD-QWHCGFSZSA-N 1 1 365.455 2.617 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000879563084 732724448 /nfs/dbraw/zinc/72/44/48/732724448.db2.gz QGCXSGGKWFGBFE-STQMWFEESA-N 1 1 363.439 2.578 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCO[C@@H](C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000880047659 732830524 /nfs/dbraw/zinc/83/05/24/732830524.db2.gz WCLKKKOMWDKBRS-CQSZACIVSA-N 1 1 364.320 2.635 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCO[C@@H](C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC000880047659 732830529 /nfs/dbraw/zinc/83/05/29/732830529.db2.gz WCLKKKOMWDKBRS-CQSZACIVSA-N 1 1 364.320 2.635 20 5 FFBDMO O=C(NCc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCC[N@H+]1C1CC1 ZINC000881865510 733123141 /nfs/dbraw/zinc/12/31/41/733123141.db2.gz XPEAEZVUYUFVLQ-CYBMUJFWSA-N 1 1 368.231 2.600 20 5 FFBDMO CC1CC[NH+](Cc2cn(Cc3c(F)cc([N+](=O)[O-])cc3F)nn2)CC1 ZINC000883993928 733468133 /nfs/dbraw/zinc/46/81/33/733468133.db2.gz FKBPTIONOUMCDU-UHFFFAOYSA-N 1 1 351.357 2.745 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886562229 733802388 /nfs/dbraw/zinc/80/23/88/733802388.db2.gz TWXXFFHRRWHRHU-GARJFASQSA-N 1 1 355.847 2.870 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886562229 733802392 /nfs/dbraw/zinc/80/23/92/733802392.db2.gz TWXXFFHRRWHRHU-GARJFASQSA-N 1 1 355.847 2.870 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000888288150 734032205 /nfs/dbraw/zinc/03/22/05/734032205.db2.gz CQBGLVFOVSDULT-NEPJUHHUSA-N 1 1 368.821 2.541 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928081583 738817726 /nfs/dbraw/zinc/81/77/26/738817726.db2.gz PJZUASSJQXAGGM-ZFWWWQNUSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928081583 738817738 /nfs/dbraw/zinc/81/77/38/738817738.db2.gz PJZUASSJQXAGGM-ZFWWWQNUSA-N 1 1 369.874 2.866 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678301 738826091 /nfs/dbraw/zinc/82/60/91/738826091.db2.gz ZBFBVNGXOPGCCK-STQMWFEESA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678301 738826094 /nfs/dbraw/zinc/82/60/94/738826094.db2.gz ZBFBVNGXOPGCCK-STQMWFEESA-N 1 1 356.806 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1ccc(N2CCOCC2)nc1 ZINC000892524003 734568991 /nfs/dbraw/zinc/56/89/91/734568991.db2.gz GQVNQFIUMISGRO-UHFFFAOYSA-N 1 1 362.817 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@H](C4OCCO4)C3)c2c1 ZINC000738150476 735023515 /nfs/dbraw/zinc/02/35/15/735023515.db2.gz VZIPNPBJFKAGHN-NSHDSACASA-N 1 1 365.411 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@H](C4OCCO4)C3)c2c1 ZINC000738150476 735023520 /nfs/dbraw/zinc/02/35/20/735023520.db2.gz VZIPNPBJFKAGHN-NSHDSACASA-N 1 1 365.411 2.914 20 5 FFBDMO O=[N+]([O-])c1nn(C[N@H+](C[C@@H]2CCCO2)C2CCCC2)cc1Br ZINC000742166684 735208341 /nfs/dbraw/zinc/20/83/41/735208341.db2.gz QKKNNMQCVBQJJQ-LBPRGKRZSA-N 1 1 373.251 2.935 20 5 FFBDMO O=[N+]([O-])c1nn(C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)cc1Br ZINC000742166684 735208347 /nfs/dbraw/zinc/20/83/47/735208347.db2.gz QKKNNMQCVBQJJQ-LBPRGKRZSA-N 1 1 373.251 2.935 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000900043663 735593150 /nfs/dbraw/zinc/59/31/50/735593150.db2.gz XXPWSIQXLGVGCA-WDEREUQCSA-N 1 1 368.231 2.666 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756937481 736374852 /nfs/dbraw/zinc/37/48/52/736374852.db2.gz WVQYSEQPAKFRBN-AWEZNQCLSA-N 1 1 354.838 2.922 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000906240752 736475347 /nfs/dbraw/zinc/47/53/47/736475347.db2.gz OZROIAPYEXCWGC-KGLIPLIRSA-N 1 1 351.834 2.924 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906790860 736543960 /nfs/dbraw/zinc/54/39/60/736543960.db2.gz JTAALZSLRNHMLW-LRDDRELGSA-N 1 1 353.850 2.979 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000906848208 736550880 /nfs/dbraw/zinc/55/08/80/736550880.db2.gz VGNLOKBHYRFUSS-ZDUSSCGKSA-N 1 1 353.850 2.981 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000766253170 737212619 /nfs/dbraw/zinc/21/26/19/737212619.db2.gz JATYXDAGLZYRPN-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000771508622 737731547 /nfs/dbraw/zinc/73/15/47/737731547.db2.gz IPXCVWRYPUIGAH-GFCCVEGCSA-N 1 1 363.443 2.594 20 5 FFBDMO C[N@H+](CC(=O)OCCSc1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1 ZINC000774346542 737982889 /nfs/dbraw/zinc/98/28/89/737982889.db2.gz VXCDKPCYFOTIQJ-ZDUSSCGKSA-N 1 1 356.469 2.667 20 5 FFBDMO C[N@@H+](CC(=O)OCCSc1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1 ZINC000774346542 737982894 /nfs/dbraw/zinc/98/28/94/737982894.db2.gz VXCDKPCYFOTIQJ-ZDUSSCGKSA-N 1 1 356.469 2.667 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000922643842 738178485 /nfs/dbraw/zinc/17/84/85/738178485.db2.gz BVYCFPQPSSROPY-RCBQFDQVSA-N 1 1 364.471 2.535 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776590751 738212279 /nfs/dbraw/zinc/21/22/79/738212279.db2.gz KGAMYCXIJCWFLW-YOEHRIQHSA-N 1 1 350.415 2.684 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)C[C@@H]1C ZINC000778009120 738342142 /nfs/dbraw/zinc/34/21/42/738342142.db2.gz KTLWDFOOYKDJJA-STQMWFEESA-N 1 1 373.450 2.536 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC000929522532 738994957 /nfs/dbraw/zinc/99/49/57/738994957.db2.gz YQTOSAAXTXYPGC-LLVKDONJSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC000929522532 738994959 /nfs/dbraw/zinc/99/49/59/738994959.db2.gz YQTOSAAXTXYPGC-LLVKDONJSA-N 1 1 356.220 2.587 20 5 FFBDMO COCC[N@H+](Cc1scnc1C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000785996809 739017706 /nfs/dbraw/zinc/01/77/06/739017706.db2.gz UZFADTQBXBPWRC-OAHLLOKOSA-N 1 1 351.428 2.542 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700842 739313947 /nfs/dbraw/zinc/31/39/47/739313947.db2.gz ZPBRZOUTUMTEJK-ZIAGYGMSSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700842 739313951 /nfs/dbraw/zinc/31/39/51/739313951.db2.gz ZPBRZOUTUMTEJK-ZIAGYGMSSA-N 1 1 359.220 2.593 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790599081 739473141 /nfs/dbraw/zinc/47/31/41/739473141.db2.gz RRYUQFKKFPLTAY-LLVKDONJSA-N 1 1 357.813 2.778 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000933440258 739626418 /nfs/dbraw/zinc/62/64/18/739626418.db2.gz CJVOLHRQAMPQPS-RKDXNWHRSA-N 1 1 358.801 2.524 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000933798681 739691265 /nfs/dbraw/zinc/69/12/65/739691265.db2.gz RPVXMHXMBCAFMU-ZDUSSCGKSA-N 1 1 353.850 2.981 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000793189969 739750355 /nfs/dbraw/zinc/75/03/55/739750355.db2.gz DPMVIAZDFOPCPB-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)cc1Cl ZINC000793192815 739750618 /nfs/dbraw/zinc/75/06/18/739750618.db2.gz SIUZJVQJZJVKCP-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO C[C@]1(C2CC2)COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000934477438 739790720 /nfs/dbraw/zinc/79/07/20/739790720.db2.gz JRFOLSHILRWJSI-QGZVFWFLSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@]12CSC[C@H]1C[N@@H+](CCCn1c(=O)oc3ccc([N+](=O)[O-])cc31)C2 ZINC000934770817 739836888 /nfs/dbraw/zinc/83/68/88/739836888.db2.gz HECNDFPARXBVRF-PXAZEXFGSA-N 1 1 363.439 2.578 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000935685966 739994391 /nfs/dbraw/zinc/99/43/91/739994391.db2.gz JAVLKFWGYMUVKP-ZBFHGGJFSA-N 1 1 369.824 2.826 20 5 FFBDMO CCC(CC)C[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000957547900 740545536 /nfs/dbraw/zinc/54/55/36/740545536.db2.gz UGZJTVJNCRGKER-IAGOWNOFSA-N 1 1 351.491 2.792 20 5 FFBDMO COc1ccc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000811446647 741522774 /nfs/dbraw/zinc/52/27/74/741522774.db2.gz WAPDZDXIWVQMFR-KRWDZBQOSA-N 1 1 354.378 2.859 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCCCS1(=O)=O ZINC000811488578 741528977 /nfs/dbraw/zinc/52/89/77/741528977.db2.gz CNPMWOBXFRCBDQ-NSHDSACASA-N 1 1 367.254 2.959 20 5 FFBDMO COC[C@H](C)[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174063 741685197 /nfs/dbraw/zinc/68/51/97/741685197.db2.gz OYBCONBTXWTWKG-ZQIUZPCESA-N 1 1 350.415 2.631 20 5 FFBDMO COC[C@H](C)[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174063 741685201 /nfs/dbraw/zinc/68/52/01/741685201.db2.gz OYBCONBTXWTWKG-ZQIUZPCESA-N 1 1 350.415 2.631 20 5 FFBDMO NC(=[NH+]OCc1ccc(Br)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000814265444 741806929 /nfs/dbraw/zinc/80/69/29/741806929.db2.gz SRQNJYLGNIJAMC-UHFFFAOYSA-N 1 1 358.192 2.782 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000814655834 741854147 /nfs/dbraw/zinc/85/41/47/741854147.db2.gz YHCOCIRMSVKHDZ-NOZJJQNGSA-N 1 1 367.203 2.532 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000814910274 741874364 /nfs/dbraw/zinc/87/43/64/741874364.db2.gz YHVUABDNZXQRMW-QGZVFWFLSA-N 1 1 367.833 2.957 20 5 FFBDMO Cc1cc(Cl)nc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000819289404 742368452 /nfs/dbraw/zinc/36/84/52/742368452.db2.gz CTFLKEBZVRSQAB-UHFFFAOYSA-N 1 1 369.830 2.515 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1 ZINC000822654790 742764619 /nfs/dbraw/zinc/76/46/19/742764619.db2.gz SHVBUPKHCPBIAG-GFCCVEGCSA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F ZINC000822811236 742786240 /nfs/dbraw/zinc/78/62/40/742786240.db2.gz CGJOWYHFWFZXNM-SECBINFHSA-N 1 1 352.341 2.752 20 5 FFBDMO C[NH+]1CCN(c2ccc(NC(=O)CCC(C)(C)[N+](=O)[O-])cc2Cl)CC1 ZINC000822919166 742803489 /nfs/dbraw/zinc/80/34/89/742803489.db2.gz ZHUYNRGFJFMPPN-UHFFFAOYSA-N 1 1 368.865 2.866 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])CC[C@H]21 ZINC000828509654 745078067 /nfs/dbraw/zinc/07/80/67/745078067.db2.gz FMOATODEBMSSTM-IUODEOHRSA-N 1 1 351.834 2.733 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000830678751 745404693 /nfs/dbraw/zinc/40/46/93/745404693.db2.gz OGMALJPYHAWRLJ-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000830678751 745404695 /nfs/dbraw/zinc/40/46/95/745404695.db2.gz OGMALJPYHAWRLJ-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO C[N@@H+](CCCCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000836359825 746200958 /nfs/dbraw/zinc/20/09/58/746200958.db2.gz ZMCMZLAQWNWGAR-UHFFFAOYSA-N 1 1 354.838 2.922 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000836949174 746335404 /nfs/dbraw/zinc/33/54/04/746335404.db2.gz INKHPSLNSZMVNH-LBPRGKRZSA-N 1 1 357.813 2.873 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000838514895 746655956 /nfs/dbraw/zinc/65/59/56/746655956.db2.gz WUXVXCANMTUBJJ-AWEZNQCLSA-N 1 1 354.838 2.872 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839479561 746835198 /nfs/dbraw/zinc/83/51/98/746835198.db2.gz DTGNYMUCIQTYGW-NSHDSACASA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839479561 746835205 /nfs/dbraw/zinc/83/52/05/746835205.db2.gz DTGNYMUCIQTYGW-NSHDSACASA-N 1 1 356.220 2.587 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CCC(=O)N1 ZINC000839670340 746887137 /nfs/dbraw/zinc/88/71/37/746887137.db2.gz UAKMGRGNVXVFIH-GFCCVEGCSA-N 1 1 370.247 2.846 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](CCC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000840186421 747032792 /nfs/dbraw/zinc/03/27/92/747032792.db2.gz ZJEYDAUPSFNDGH-CQSZACIVSA-N 1 1 352.435 2.891 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](CCC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000840186421 747032806 /nfs/dbraw/zinc/03/28/06/747032806.db2.gz ZJEYDAUPSFNDGH-CQSZACIVSA-N 1 1 352.435 2.891 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)OCC[C@H]2CC[N@@H+](C)C2)cc1SC ZINC000847827798 748791610 /nfs/dbraw/zinc/79/16/10/748791610.db2.gz XURURYPDXRTOOU-LLVKDONJSA-N 1 1 354.428 2.824 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848490614 748940157 /nfs/dbraw/zinc/94/01/57/748940157.db2.gz QAHFZGYLBWFKRG-PBHICJAKSA-N 1 1 363.483 2.943 20 5 FFBDMO O=C(C[N@@H+](C1CC1)C1(CO)CCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852159171 749789758 /nfs/dbraw/zinc/78/97/58/749789758.db2.gz QHGUMABTBKPKRV-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1CCO ZINC000852463430 749867588 /nfs/dbraw/zinc/86/75/88/749867588.db2.gz VXGXOPGPQGRJQD-WBMJQRKESA-N 1 1 353.394 2.545 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000853240767 750036202 /nfs/dbraw/zinc/03/62/02/750036202.db2.gz FJDJOABGWCFMDB-MNOVXSKESA-N 1 1 356.220 2.632 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000824414156 946698553 /nfs/dbraw/zinc/69/85/53/946698553.db2.gz VSSWUCYRHBDOIY-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO CN(C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000888922591 971401964 /nfs/dbraw/zinc/40/19/64/971401964.db2.gz CVJZIZOBXCZSFM-CQSZACIVSA-N 1 1 354.410 2.639 20 5 FFBDMO O=C1OCCCN1C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000896866390 971926402 /nfs/dbraw/zinc/92/64/02/971926402.db2.gz SGQVIOSPMBXBDH-UHFFFAOYSA-N 1 1 356.382 2.954 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(NCCc2cn3c([nH+]2)CCCC3)c2ccccc21 ZINC000891719951 964953499 /nfs/dbraw/zinc/95/34/99/964953499.db2.gz UMTCSXKGELUXKA-UHFFFAOYSA-N 1 1 367.409 2.634 20 5 FFBDMO Cn1ccc([C@H]2CCC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC001176252180 1013670295 /nfs/dbraw/zinc/67/02/95/1013670295.db2.gz DYHBUPBNLVKLBU-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1ccc([C@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)n1 ZINC001176252180 1013670304 /nfs/dbraw/zinc/67/03/04/1013670304.db2.gz DYHBUPBNLVKLBU-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C2CCC2)cc1 ZINC001029305139 967651447 /nfs/dbraw/zinc/65/14/47/967651447.db2.gz TTYJZUXJTVUPSX-IYWMVGAKSA-N 1 1 369.465 2.795 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C2CCC2)cc1 ZINC001029305139 967651457 /nfs/dbraw/zinc/65/14/57/967651457.db2.gz TTYJZUXJTVUPSX-IYWMVGAKSA-N 1 1 369.465 2.795 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C2CCC2)cc1 ZINC001029305139 967651464 /nfs/dbraw/zinc/65/14/64/967651464.db2.gz TTYJZUXJTVUPSX-IYWMVGAKSA-N 1 1 369.465 2.795 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000121062579 968080554 /nfs/dbraw/zinc/08/05/54/968080554.db2.gz URQFUOCXNHXYGA-RYQLBKOJSA-N 1 1 364.442 2.614 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000708701190 968879099 /nfs/dbraw/zinc/87/90/99/968879099.db2.gz HHHJWDYSWRLAOF-HOCLYGCPSA-N 1 1 368.437 2.675 20 5 FFBDMO C[N@H+](Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)C(C1CC1)C1CC1 ZINC000066078683 969257999 /nfs/dbraw/zinc/25/79/99/969257999.db2.gz XDSPXQPWLUMNEK-UHFFFAOYSA-N 1 1 354.410 2.896 20 5 FFBDMO C[N@@H+](Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)C(C1CC1)C1CC1 ZINC000066078683 969258006 /nfs/dbraw/zinc/25/80/06/969258006.db2.gz XDSPXQPWLUMNEK-UHFFFAOYSA-N 1 1 354.410 2.896 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2cnn(C)c2)C1 ZINC000875054484 1013958861 /nfs/dbraw/zinc/95/88/61/1013958861.db2.gz UNRULVSPQBWPSS-MSOLQXFVSA-N 1 1 371.441 2.781 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000103458329 970400952 /nfs/dbraw/zinc/40/09/52/970400952.db2.gz ZXGLVDMTJNKPKS-ZDUSSCGKSA-N 1 1 358.398 2.689 20 5 FFBDMO Cc1cc(C2(C(=O)O[C@H]3CC[N@H+](Cc4cccc([N+](=O)[O-])c4)C3)CC2)on1 ZINC000893054306 970543311 /nfs/dbraw/zinc/54/33/11/970543311.db2.gz YSJCXYPIMNDJKG-INIZCTEOSA-N 1 1 371.393 2.741 20 5 FFBDMO Cc1cc(C2(C(=O)O[C@H]3CC[N@@H+](Cc4cccc([N+](=O)[O-])c4)C3)CC2)on1 ZINC000893054306 970543323 /nfs/dbraw/zinc/54/33/23/970543323.db2.gz YSJCXYPIMNDJKG-INIZCTEOSA-N 1 1 371.393 2.741 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)CC[C@H]21 ZINC000897016384 973154541 /nfs/dbraw/zinc/15/45/41/973154541.db2.gz GRHSAGVYWSAMQL-RHSMWYFYSA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1cc(C)c(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC000985431932 974069278 /nfs/dbraw/zinc/06/92/78/974069278.db2.gz UVMQGKHCEAIZTM-IEBWSBKVSA-N 1 1 359.470 2.700 20 5 FFBDMO Cc1cc(C)c(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC000985431932 974069283 /nfs/dbraw/zinc/06/92/83/974069283.db2.gz UVMQGKHCEAIZTM-IEBWSBKVSA-N 1 1 359.470 2.700 20 5 FFBDMO Cc1cc(C)c(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC000985431932 974069288 /nfs/dbraw/zinc/06/92/88/974069288.db2.gz UVMQGKHCEAIZTM-IEBWSBKVSA-N 1 1 359.470 2.700 20 5 FFBDMO Cc1ncccc1OC[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000842173531 976710131 /nfs/dbraw/zinc/71/01/31/976710131.db2.gz RHNAKTPPVQLFDX-QZTJIDSGSA-N 1 1 357.410 2.875 20 5 FFBDMO CCC1([NH+]2CCC2)CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000899563669 977239836 /nfs/dbraw/zinc/23/98/36/977239836.db2.gz KKDZGMCIHABTTA-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1CCCCC1)C2 ZINC000982278400 977375871 /nfs/dbraw/zinc/37/58/71/977375871.db2.gz AZFUFSYUWVXUEY-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CCC1CCCCC1)C2 ZINC000982278400 977375876 /nfs/dbraw/zinc/37/58/76/977375876.db2.gz AZFUFSYUWVXUEY-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1CCCCC1)C2 ZINC000982278400 977375881 /nfs/dbraw/zinc/37/58/81/977375881.db2.gz AZFUFSYUWVXUEY-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO O=[N+]([O-])c1cnn(C2CC(N[C@@H](C[NH+]3CCCC3)c3ccccc3)C2)c1 ZINC000876881071 1014409338 /nfs/dbraw/zinc/40/93/38/1014409338.db2.gz UYVUPUPMNLSPIP-TVPLGVNVSA-N 1 1 355.442 2.922 20 5 FFBDMO CCN(CC[NH2+]Cc1ccc(C2CCCC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001482925312 981590924 /nfs/dbraw/zinc/59/09/24/981590924.db2.gz RGHDWMAAUQHERN-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO Cc1cc(C)c(C[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c(C)c1 ZINC000963789284 1014764356 /nfs/dbraw/zinc/76/43/56/1014764356.db2.gz VZJKCHYFTXWARD-ZMFIRQTCSA-N 1 1 371.481 2.794 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878136093 1014877979 /nfs/dbraw/zinc/87/79/79/1014877979.db2.gz RRVZGIQPBLWMHF-AWEZNQCLSA-N 1 1 359.430 2.951 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000157923135 984704389 /nfs/dbraw/zinc/70/43/89/984704389.db2.gz FAAFPBCWOMPSSE-VQTJNVASSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000157923135 984704396 /nfs/dbraw/zinc/70/43/96/984704396.db2.gz FAAFPBCWOMPSSE-VQTJNVASSA-N 1 1 356.422 2.962 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000765651450 985273204 /nfs/dbraw/zinc/27/32/04/985273204.db2.gz RAPJBWDLRDPBKT-DAXSKMNVSA-N 1 1 352.394 2.660 20 5 FFBDMO Nc1ccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000062231603 985445746 /nfs/dbraw/zinc/44/57/46/985445746.db2.gz BDSALKSXEKRCDI-MRXNPFEDSA-N 1 1 368.437 2.819 20 5 FFBDMO C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC3(CCCC3)C2)C1=O ZINC000173441955 985833379 /nfs/dbraw/zinc/83/33/79/985833379.db2.gz CVLLOHDZUNPNLB-SFHVURJKSA-N 1 1 372.425 2.585 20 5 FFBDMO CC(C)N(CC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001486368075 987276133 /nfs/dbraw/zinc/27/61/33/987276133.db2.gz JFJAUZTVILYTEP-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)N(CC[N@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001486368075 987276142 /nfs/dbraw/zinc/27/61/42/987276142.db2.gz JFJAUZTVILYTEP-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)N(CC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001486368075 987276152 /nfs/dbraw/zinc/27/61/52/987276152.db2.gz JFJAUZTVILYTEP-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC2(CC1)CC[NH+](C)CC2 ZINC000879249600 1015439082 /nfs/dbraw/zinc/43/90/82/1015439082.db2.gz VTRPQYSDRSTIQH-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO [NH3+]Cc1ncn(-c2ncc(C(F)(F)F)cc2-c2cccc([N+](=O)[O-])c2)n1 ZINC001168754115 990000415 /nfs/dbraw/zinc/00/04/15/990000415.db2.gz ODNNCODDQFGYGD-UHFFFAOYSA-N 1 1 364.287 2.715 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c1 ZINC001034816043 990270467 /nfs/dbraw/zinc/27/04/67/990270467.db2.gz JFCXIHNEFGGNON-IEBWSBKVSA-N 1 1 371.412 2.705 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3CCCCC3)C2)CC1 ZINC001035187181 990409438 /nfs/dbraw/zinc/40/94/38/990409438.db2.gz OYBICRFETMWSQW-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCC3CCCCC3)C2)CC1 ZINC001035187181 990409444 /nfs/dbraw/zinc/40/94/44/990409444.db2.gz OYBICRFETMWSQW-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3CCCCC3)C2)CC1 ZINC001035187181 990409449 /nfs/dbraw/zinc/40/94/49/990409449.db2.gz OYBICRFETMWSQW-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CC3CCC4(CC4)CC3)C2)CC1 ZINC001035706640 990529699 /nfs/dbraw/zinc/52/96/99/990529699.db2.gz JNYPEAVEZDWDFN-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)[nH+]c1 ZINC000194952301 990678311 /nfs/dbraw/zinc/67/83/11/990678311.db2.gz LRTATYFMBYXYEL-UHFFFAOYSA-N 1 1 354.410 2.831 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373105465 990717370 /nfs/dbraw/zinc/71/73/70/990717370.db2.gz YHCHDCTWFNWBKQ-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373105465 990717374 /nfs/dbraw/zinc/71/73/74/990717374.db2.gz YHCHDCTWFNWBKQ-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO O=C(NCC1C[NH+](Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031662336 990859335 /nfs/dbraw/zinc/85/93/35/990859335.db2.gz BVCSQUIQJZORRS-RTBURBONSA-N 1 1 357.454 2.557 20 5 FFBDMO CC1(C)[C@H](c2ccccc2F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000879638865 1015621225 /nfs/dbraw/zinc/62/12/25/1015621225.db2.gz GHEKIKRNSSAKRJ-ZBFHGGJFSA-N 1 1 362.405 2.559 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000179544230 991290120 /nfs/dbraw/zinc/29/01/20/991290120.db2.gz DNNBAJMAGGWAEH-CYBMUJFWSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000179544230 991290125 /nfs/dbraw/zinc/29/01/25/991290125.db2.gz DNNBAJMAGGWAEH-CYBMUJFWSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1cc(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000068548611 991465186 /nfs/dbraw/zinc/46/51/86/991465186.db2.gz FJBJBKRRQMKWFE-GASCZTMLSA-N 1 1 362.474 2.973 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000880059783 1015744038 /nfs/dbraw/zinc/74/40/38/1015744038.db2.gz QIQVHBZQVTVYHB-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO COc1cc2c(cc1OC)[C@H](C)[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000880088085 1015752337 /nfs/dbraw/zinc/75/23/37/1015752337.db2.gz IVRSSVBILJBKOO-LBPRGKRZSA-N 1 1 360.414 2.736 20 5 FFBDMO COc1cc2c(cc1OC)[C@H](C)[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000880088085 1015752342 /nfs/dbraw/zinc/75/23/42/1015752342.db2.gz IVRSSVBILJBKOO-LBPRGKRZSA-N 1 1 360.414 2.736 20 5 FFBDMO CCCCC[C@H](C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664893 993255341 /nfs/dbraw/zinc/25/53/41/993255341.db2.gz ASLHPWAQFMSPIC-GJZGRUSLSA-N 1 1 363.462 2.561 20 5 FFBDMO CCCCC[C@H](C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664893 993255344 /nfs/dbraw/zinc/25/53/44/993255344.db2.gz ASLHPWAQFMSPIC-GJZGRUSLSA-N 1 1 363.462 2.561 20 5 FFBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccccc1 ZINC000880462622 1015840354 /nfs/dbraw/zinc/84/03/54/1015840354.db2.gz UISKECGZBRIKOH-GOSISDBHSA-N 1 1 357.410 2.613 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccccc1 ZINC000880462622 1015840362 /nfs/dbraw/zinc/84/03/62/1015840362.db2.gz UISKECGZBRIKOH-GOSISDBHSA-N 1 1 357.410 2.613 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495770 995572454 /nfs/dbraw/zinc/57/24/54/995572454.db2.gz XOOPITJFAOLCRZ-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495770 995572463 /nfs/dbraw/zinc/57/24/63/995572463.db2.gz XOOPITJFAOLCRZ-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000747839435 995622463 /nfs/dbraw/zinc/62/24/63/995622463.db2.gz GOPBSBWAUQKXTO-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000747839435 995622465 /nfs/dbraw/zinc/62/24/65/995622465.db2.gz GOPBSBWAUQKXTO-CQSZACIVSA-N 1 1 358.373 2.980 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000823981537 996772280 /nfs/dbraw/zinc/77/22/80/996772280.db2.gz ZLFFQTLOWCSMEM-BBRMVZONSA-N 1 1 369.425 2.962 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC[C@H]21 ZINC000827268058 1016089436 /nfs/dbraw/zinc/08/94/36/1016089436.db2.gz QFZYCCXORCPEQT-NVXWUHKLSA-N 1 1 366.421 2.823 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000730806517 997496193 /nfs/dbraw/zinc/49/61/93/997496193.db2.gz RDVQPZQPDLZCMC-TXEJJXNPSA-N 1 1 366.418 2.979 20 5 FFBDMO CC(C)O[C@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000844718454 998091539 /nfs/dbraw/zinc/09/15/39/998091539.db2.gz VKZCVTIXHNOWQQ-HNNXBMFYSA-N 1 1 362.430 2.684 20 5 FFBDMO CC(C)O[C@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000844718454 998091547 /nfs/dbraw/zinc/09/15/47/998091547.db2.gz VKZCVTIXHNOWQQ-HNNXBMFYSA-N 1 1 362.430 2.684 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)CC[C@H]2CCCC[N@H+]2C)c1 ZINC000845165719 998392665 /nfs/dbraw/zinc/39/26/65/998392665.db2.gz SRDYYLYYOKVAHS-OAHLLOKOSA-N 1 1 364.398 2.689 20 5 FFBDMO C[C@@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000803856271 1016246004 /nfs/dbraw/zinc/24/60/04/1016246004.db2.gz OCICYLSQOLAGDK-HIFRSBDPSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000803858856 1016247307 /nfs/dbraw/zinc/24/73/07/1016247307.db2.gz KAAYAFNFRFMAPT-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)Cc2ccc(C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000738522997 999626695 /nfs/dbraw/zinc/62/66/95/999626695.db2.gz NSROOSXUKNMDRL-UHFFFAOYSA-N 1 1 359.430 2.604 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741016726 999702480 /nfs/dbraw/zinc/70/24/80/999702480.db2.gz JYZRDVOVZBXSJR-MQYQWHSLSA-N 1 1 363.414 2.726 20 5 FFBDMO CC(C)[C@@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1CCCC1 ZINC000741017577 999702731 /nfs/dbraw/zinc/70/27/31/999702731.db2.gz OXVJNPWNBOBORP-INIZCTEOSA-N 1 1 374.397 2.808 20 5 FFBDMO C[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCCCC1 ZINC000741027710 999704745 /nfs/dbraw/zinc/70/47/45/999704745.db2.gz BQJOIUXBTPEIDF-ZDUSSCGKSA-N 1 1 374.397 2.953 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000742052797 999753339 /nfs/dbraw/zinc/75/33/39/999753339.db2.gz USTFMVYXNDYDJD-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCCC4(CCOCC4)C3)n2)c1 ZINC000742159714 999762901 /nfs/dbraw/zinc/76/29/01/999762901.db2.gz UMZAMMKSGJPIKX-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000744400659 999855207 /nfs/dbraw/zinc/85/52/07/999855207.db2.gz ORTMRGVCEZTCRL-UHFFFAOYSA-N 1 1 371.441 2.945 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169011906 1000015617 /nfs/dbraw/zinc/01/56/17/1000015617.db2.gz NHCSVVAZHMBHEO-CABCVRRESA-N 1 1 353.463 2.907 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019809 1000017618 /nfs/dbraw/zinc/01/76/18/1000017618.db2.gz JSYGEFBUXICUAU-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019809 1000017619 /nfs/dbraw/zinc/01/76/19/1000017619.db2.gz JSYGEFBUXICUAU-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169026964 1000018319 /nfs/dbraw/zinc/01/83/19/1000018319.db2.gz ZKMNCYJJLSMMCP-LSTDLKDCSA-N 1 1 361.442 2.529 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCc3ncnc(-c4ccccc4)c3CC2)C1 ZINC001169024874 1000018323 /nfs/dbraw/zinc/01/83/23/1000018323.db2.gz RWTBWFNMDFWFFV-NVXWUHKLSA-N 1 1 352.438 2.990 20 5 FFBDMO CS(=O)(=O)c1cccc([C@@H]2CCC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)c1 ZINC001169046921 1000018362 /nfs/dbraw/zinc/01/83/62/1000018362.db2.gz OLCBYTPVVWIEOR-DJIMGWMZSA-N 1 1 366.483 2.715 20 5 FFBDMO CC[N@@H+](C[C@@H]1CN(Cc2ccccc2)CCO1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169053546 1000019040 /nfs/dbraw/zinc/01/90/40/1000019040.db2.gz ILKDBAONGHNECZ-AQNXPRMDSA-N 1 1 361.486 2.655 20 5 FFBDMO Nc1ccc(NCCCN2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000804346056 1000095988 /nfs/dbraw/zinc/09/59/88/1000095988.db2.gz HWGVYUREGIDLCN-UHFFFAOYSA-N 1 1 369.469 2.797 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000767458888 1000116373 /nfs/dbraw/zinc/11/63/73/1000116373.db2.gz JSQJUKSKKPEBRH-CYBMUJFWSA-N 1 1 369.425 2.605 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN(Cc3ccc4c(c3)C[NH2+]CC4)CC2)cc1 ZINC000846218521 1000233144 /nfs/dbraw/zinc/23/31/44/1000233144.db2.gz WHNFUMXRLWSIHN-UHFFFAOYSA-N 1 1 352.438 2.563 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)CC1 ZINC000771403695 1001102991 /nfs/dbraw/zinc/10/29/91/1001102991.db2.gz HLESADPFHDFBSQ-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)CC1 ZINC000771403695 1001102994 /nfs/dbraw/zinc/10/29/94/1001102994.db2.gz HLESADPFHDFBSQ-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO C/C(=C/C(=O)NC(C)(C)CCN1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000771663334 1001171754 /nfs/dbraw/zinc/17/17/54/1001171754.db2.gz MGZRWMQPFSSGET-NXVVXOECSA-N 1 1 374.485 2.530 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](Oc3ncccc3F)C2)cc1 ZINC000785841257 1001492198 /nfs/dbraw/zinc/49/21/98/1001492198.db2.gz QTPRTXSGJQCJGO-RDJZCZTQSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](Oc3ncccc3F)C2)cc1 ZINC000785841257 1001492200 /nfs/dbraw/zinc/49/22/00/1001492200.db2.gz QTPRTXSGJQCJGO-RDJZCZTQSA-N 1 1 361.373 2.706 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)C[C@H]2CNC(=O)OC(C)(C)C)c1 ZINC000746704031 1001705549 /nfs/dbraw/zinc/70/55/49/1001705549.db2.gz WIHDOCANJMWEHG-CQSZACIVSA-N 1 1 364.446 2.548 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CC[N@H+](C)C[C@H]2CNC(=O)OC(C)(C)C)c1 ZINC000746704031 1001705551 /nfs/dbraw/zinc/70/55/51/1001705551.db2.gz WIHDOCANJMWEHG-CQSZACIVSA-N 1 1 364.446 2.548 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c1 ZINC001171361848 1001712863 /nfs/dbraw/zinc/71/28/63/1001712863.db2.gz KMJIAHZTLLHAGP-GIVPXCGWSA-N 1 1 367.449 2.835 20 5 FFBDMO Cc1c(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469145 1001807457 /nfs/dbraw/zinc/80/74/57/1001807457.db2.gz NTVGKWYEVUOQEJ-WOJBJXKFSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1c(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469145 1001807472 /nfs/dbraw/zinc/80/74/72/1001807472.db2.gz NTVGKWYEVUOQEJ-WOJBJXKFSA-N 1 1 369.465 2.876 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001186571358 1003347913 /nfs/dbraw/zinc/34/79/13/1003347913.db2.gz IGQQDROIGDIOFU-QFBILLFUSA-N 1 1 351.406 2.966 20 5 FFBDMO C[N@@H+](CCCC[NH+]1CCCCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001197283514 1004163124 /nfs/dbraw/zinc/16/31/24/1004163124.db2.gz CBRGHNDREMBEQU-LJQANCHMSA-N 1 1 374.485 2.898 20 5 FFBDMO CN(CCCC[NH+]1CCCCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001197283514 1004163130 /nfs/dbraw/zinc/16/31/30/1004163130.db2.gz CBRGHNDREMBEQU-LJQANCHMSA-N 1 1 374.485 2.898 20 5 FFBDMO O=[N+]([O-])c1cc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)cs1 ZINC001193800396 1004585779 /nfs/dbraw/zinc/58/57/79/1004585779.db2.gz PSLPRAMKSYYUMX-CYBMUJFWSA-N 1 1 373.500 2.732 20 5 FFBDMO C[N@@H+](Cc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001050244677 1016930399 /nfs/dbraw/zinc/93/03/99/1016930399.db2.gz SAHINPXJWWWOPC-RTBURBONSA-N 1 1 353.422 2.600 20 5 FFBDMO C[N@H+](Cc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050244677 1016930409 /nfs/dbraw/zinc/93/04/09/1016930409.db2.gz SAHINPXJWWWOPC-RTBURBONSA-N 1 1 353.422 2.600 20 5 FFBDMO C[N@@H+](Cc1ccccc1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050244677 1016930420 /nfs/dbraw/zinc/93/04/20/1016930420.db2.gz SAHINPXJWWWOPC-RTBURBONSA-N 1 1 353.422 2.600 20 5 FFBDMO Cc1cc(C)cc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001050325725 1016967942 /nfs/dbraw/zinc/96/79/42/1016967942.db2.gz LKSRBHPQIUHDHZ-NXWXRZEISA-N 1 1 359.470 2.733 20 5 FFBDMO Cc1cccc(C)c1C[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001050325459 1016969144 /nfs/dbraw/zinc/96/91/44/1016969144.db2.gz FGJLVSRKAKNZGW-YWTNHNAXSA-N 1 1 359.470 2.733 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581305 1005961104 /nfs/dbraw/zinc/96/11/04/1005961104.db2.gz BWDXSXRBNXBCFP-QGZVFWFLSA-N 1 1 374.393 2.506 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000852514974 1006061155 /nfs/dbraw/zinc/06/11/55/1006061155.db2.gz NIYWCCYIXXLQLR-LEWJYISDSA-N 1 1 369.465 2.877 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H]1CC1CCC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000815293121 1006567736 /nfs/dbraw/zinc/56/77/36/1006567736.db2.gz XEOHAAIIXNGSJF-HNNXBMFYSA-N 1 1 365.405 2.954 20 5 FFBDMO O=[N+]([O-])c1c(F)cccc1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000748308556 1017065697 /nfs/dbraw/zinc/06/56/97/1017065697.db2.gz SWKASYODOSVDPH-UHFFFAOYSA-N 1 1 359.405 2.753 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@H]2C1 ZINC001135059705 1006659645 /nfs/dbraw/zinc/65/96/45/1006659645.db2.gz OGWVPHGZKNTZTA-HERUPUMHSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC001189253714 1006975675 /nfs/dbraw/zinc/97/56/75/1006975675.db2.gz OXGOZMKJXZWKEB-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000112695129 1007001392 /nfs/dbraw/zinc/00/13/92/1007001392.db2.gz ILKDFYDEQQSAKY-CQSZACIVSA-N 1 1 373.457 2.776 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000112695129 1007001406 /nfs/dbraw/zinc/00/14/06/1007001406.db2.gz ILKDFYDEQQSAKY-CQSZACIVSA-N 1 1 373.457 2.776 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)CC1 ZINC000816952852 1007275214 /nfs/dbraw/zinc/27/52/14/1007275214.db2.gz SVZIEHXBSJQYPX-HNAYVOBHSA-N 1 1 372.469 2.607 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000856354738 1007784394 /nfs/dbraw/zinc/78/43/94/1007784394.db2.gz KOCMPWLHJZJMFX-HNNXBMFYSA-N 1 1 373.384 2.503 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000856356142 1007785110 /nfs/dbraw/zinc/78/51/10/1007785110.db2.gz YCYVFFZHWLNIBQ-SCEWNMGZSA-N 1 1 351.406 2.999 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000885880200 1007819237 /nfs/dbraw/zinc/81/92/37/1007819237.db2.gz ODIAPHIFMJJZJX-INIZCTEOSA-N 1 1 361.442 2.503 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593320 1007903852 /nfs/dbraw/zinc/90/38/52/1007903852.db2.gz RASCHDVXESPKNW-NVAPOSRTSA-N 1 1 372.425 2.623 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593320 1007903856 /nfs/dbraw/zinc/90/38/56/1007903856.db2.gz RASCHDVXESPKNW-NVAPOSRTSA-N 1 1 372.425 2.623 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000819016293 1008024845 /nfs/dbraw/zinc/02/48/45/1008024845.db2.gz WUNFZMFPRUVYMT-WIYYLYMNSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000819016293 1008024849 /nfs/dbraw/zinc/02/48/49/1008024849.db2.gz WUNFZMFPRUVYMT-WIYYLYMNSA-N 1 1 369.465 2.782 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)CC1 ZINC000857308380 1008117935 /nfs/dbraw/zinc/11/79/35/1008117935.db2.gz NWGIAOKQQCUPJS-UHFFFAOYSA-N 1 1 374.485 2.999 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@H](C)O1 ZINC000858238528 1008330466 /nfs/dbraw/zinc/33/04/66/1008330466.db2.gz KOGXKZDKVMFENN-GASCZTMLSA-N 1 1 371.437 2.977 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001136452013 1008468996 /nfs/dbraw/zinc/46/89/96/1008468996.db2.gz MEOWAPRSGCOETE-INIZCTEOSA-N 1 1 368.437 2.819 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]Cc1ccsc1)CC1CCCC1 ZINC001177314072 1008559882 /nfs/dbraw/zinc/55/98/82/1008559882.db2.gz ZLEZFDXHBUDKHQ-IAGOWNOFSA-N 1 1 365.499 2.912 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001177514776 1008637840 /nfs/dbraw/zinc/63/78/40/1008637840.db2.gz UKEZMQCOLUHADU-UHFFFAOYSA-N 1 1 367.203 2.546 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC2)[nH+]c1C ZINC001178042931 1008857184 /nfs/dbraw/zinc/85/71/84/1008857184.db2.gz OASRVLANCQFMHN-UHFFFAOYSA-N 1 1 361.377 2.676 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC1[N+](=O)[O-] ZINC001178463978 1008999001 /nfs/dbraw/zinc/99/90/01/1008999001.db2.gz PGLGOANAZJUSCN-SJLPKXTDSA-N 1 1 358.442 2.599 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)[nH+]c1 ZINC001178609374 1009055411 /nfs/dbraw/zinc/05/54/11/1009055411.db2.gz JRRUWUSRVSZICD-UHFFFAOYSA-N 1 1 352.753 2.933 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001178757188 1009117840 /nfs/dbraw/zinc/11/78/40/1009117840.db2.gz LHSVBIMYNGTQSJ-GFCCVEGCSA-N 1 1 354.838 2.633 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001178757188 1009117845 /nfs/dbraw/zinc/11/78/45/1009117845.db2.gz LHSVBIMYNGTQSJ-GFCCVEGCSA-N 1 1 354.838 2.633 20 5 FFBDMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000823765506 1009218537 /nfs/dbraw/zinc/21/85/37/1009218537.db2.gz NPLPMJKXOCUFAC-FUHWJXTLSA-N 1 1 373.409 2.565 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000130430571 1009335836 /nfs/dbraw/zinc/33/58/36/1009335836.db2.gz ZEHFIHOKXNILKT-AWEZNQCLSA-N 1 1 356.426 2.993 20 5 FFBDMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861825788 1009574163 /nfs/dbraw/zinc/57/41/63/1009574163.db2.gz YLUHYBVXRWERTG-RTBURBONSA-N 1 1 369.421 2.683 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000862631807 1009910529 /nfs/dbraw/zinc/91/05/29/1009910529.db2.gz VTTPFVPFLPRDRA-MRXNPFEDSA-N 1 1 360.458 2.798 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000794641794 1010439272 /nfs/dbraw/zinc/43/92/72/1010439272.db2.gz XLVCGLUAFBEFDQ-KBPBESRZSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000794641794 1010439275 /nfs/dbraw/zinc/43/92/75/1010439275.db2.gz XLVCGLUAFBEFDQ-KBPBESRZSA-N 1 1 361.398 2.599 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 ZINC000865564383 1010818044 /nfs/dbraw/zinc/81/80/44/1010818044.db2.gz BWHLDUMUFOIIMV-INIZCTEOSA-N 1 1 359.401 2.937 20 5 FFBDMO COc1ccccc1[C@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867944161 1011126671 /nfs/dbraw/zinc/12/66/71/1011126671.db2.gz QJFDSJCKYKPKDA-VBKZILBWSA-N 1 1 369.421 2.793 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000869306182 1011719125 /nfs/dbraw/zinc/71/91/25/1011719125.db2.gz FHXMMKXJKQXYQM-MRXNPFEDSA-N 1 1 357.385 2.667 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000867031704 1011926355 /nfs/dbraw/zinc/92/63/55/1011926355.db2.gz VRPFWCVPEUYINF-VQIMIIECSA-N 1 1 357.385 2.838 20 5 FFBDMO COC[C@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906365 1012077906 /nfs/dbraw/zinc/07/79/06/1012077906.db2.gz HAMOYVYXMYEGPE-SJORKVTESA-N 1 1 370.453 2.822 20 5 FFBDMO COC[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906365 1012077924 /nfs/dbraw/zinc/07/79/24/1012077924.db2.gz HAMOYVYXMYEGPE-SJORKVTESA-N 1 1 370.453 2.822 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870086975 1012117764 /nfs/dbraw/zinc/11/77/64/1012117764.db2.gz HRCPLYLPGRFVIJ-XYDKVEKUSA-N 1 1 367.405 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](Oc3ncc(F)cn3)C1)CC2 ZINC001172913083 1012125999 /nfs/dbraw/zinc/12/59/99/1012125999.db2.gz OTLFKBLWCWFPRJ-SJLPKXTDSA-N 1 1 372.400 2.925 20 5 FFBDMO C[C@@H]1CC(=O)CC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009477 1012179062 /nfs/dbraw/zinc/17/90/62/1012179062.db2.gz CUVWLPMCZRRWJM-LLVKDONJSA-N 1 1 353.369 2.895 20 5 FFBDMO C[C@@H]1CC(=O)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009477 1012179069 /nfs/dbraw/zinc/17/90/69/1012179069.db2.gz CUVWLPMCZRRWJM-LLVKDONJSA-N 1 1 353.369 2.895 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1O ZINC001173010655 1012181227 /nfs/dbraw/zinc/18/12/27/1012181227.db2.gz WWZHFOABPMFHFF-BZNIZROVSA-N 1 1 355.385 2.545 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H](C)CO1 ZINC001173016238 1012187693 /nfs/dbraw/zinc/18/76/93/1012187693.db2.gz AIDKCMQEXQWAPW-NWDGAFQWSA-N 1 1 355.385 2.951 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2C[C@H]3CC[N@@H+](C2)[C@@H]3C)c1F ZINC001173182686 1012327514 /nfs/dbraw/zinc/32/75/14/1012327514.db2.gz KEYMIENDDDAFEM-DGAVXFQQSA-N 1 1 351.422 2.746 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H]2C[C@H]3CC[N@H+](C2)[C@@H]3C)c1F ZINC001173182686 1012327524 /nfs/dbraw/zinc/32/75/24/1012327524.db2.gz KEYMIENDDDAFEM-DGAVXFQQSA-N 1 1 351.422 2.746 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N[C@H]2C[C@H]3CC[N@@H+](C2)[C@@H]3C)c1F ZINC001173182686 1012327534 /nfs/dbraw/zinc/32/75/34/1012327534.db2.gz KEYMIENDDDAFEM-DGAVXFQQSA-N 1 1 351.422 2.746 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2C[C@H]3CCN(C2)[C@@H]3C)c1F ZINC001173182686 1012327540 /nfs/dbraw/zinc/32/75/40/1012327540.db2.gz KEYMIENDDDAFEM-DGAVXFQQSA-N 1 1 351.422 2.746 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC12CC2 ZINC001173191621 1012331140 /nfs/dbraw/zinc/33/11/40/1012331140.db2.gz DVVJDUONKJPEBD-AAEUAGOBSA-N 1 1 366.389 2.559 20 5 FFBDMO COC(=O)CC[C@@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195487 1012337181 /nfs/dbraw/zinc/33/71/81/1012337181.db2.gz GTSNHUMKQJZTJC-QWHCGFSZSA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)C[C@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173194311 1012338364 /nfs/dbraw/zinc/33/83/64/1012338364.db2.gz ZHDMEUQWDABHGR-VXGBXAGGSA-N 1 1 354.378 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC3(C[NH+](C)C3)CC2)c1F ZINC001173194281 1012338993 /nfs/dbraw/zinc/33/89/93/1012338993.db2.gz YZXVNYNYGJZAJZ-ZDUSSCGKSA-N 1 1 351.422 2.701 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CCN(c3ncccn3)C[C@H]2C1 ZINC001173223848 1012357675 /nfs/dbraw/zinc/35/76/75/1012357675.db2.gz IEZPDWCONSVEDM-NXHRZFHOSA-N 1 1 367.453 2.774 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226287 1012362089 /nfs/dbraw/zinc/36/20/89/1012362089.db2.gz LOMUODOVUTXOAC-ZDUSSCGKSA-N 1 1 372.425 2.710 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173226287 1012362103 /nfs/dbraw/zinc/36/21/03/1012362103.db2.gz LOMUODOVUTXOAC-ZDUSSCGKSA-N 1 1 372.425 2.710 20 5 FFBDMO CCOCc1nnn2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173229509 1012363198 /nfs/dbraw/zinc/36/31/98/1012363198.db2.gz XCYQBRYPZPYGPS-CQSZACIVSA-N 1 1 359.430 2.560 20 5 FFBDMO Cc1nn(CN2CC[N@H+](C)C[C@H]2c2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000748449969 1017240380 /nfs/dbraw/zinc/24/03/80/1017240380.db2.gz PBGLYCSHCFWLMZ-SFHVURJKSA-N 1 1 366.425 2.594 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000827395468 1017913392 /nfs/dbraw/zinc/91/33/92/1017913392.db2.gz KSQFAJRRFCCZFQ-MRXNPFEDSA-N 1 1 372.400 2.716 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000827395468 1017913409 /nfs/dbraw/zinc/91/34/09/1017913409.db2.gz KSQFAJRRFCCZFQ-MRXNPFEDSA-N 1 1 372.400 2.716 20 5 FFBDMO O=[N+]([O-])CCN1CC[NH+](CCOC(c2ccccc2)c2ccccc2)CC1 ZINC000929845955 1019687753 /nfs/dbraw/zinc/68/77/53/1019687753.db2.gz NCWNELZYAXLDMP-UHFFFAOYSA-N 1 1 369.465 2.687 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C(=O)OC(C)(C)C ZINC000828917411 1032903953 /nfs/dbraw/zinc/90/39/53/1032903953.db2.gz GNKMNPSRINAPKF-KBRIMQKVSA-N 1 1 364.442 2.928 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1 ZINC000931796557 1020590894 /nfs/dbraw/zinc/59/08/94/1020590894.db2.gz OGJOOOAFSOUKSC-ICSRJNTNSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1 ZINC000931796557 1020590899 /nfs/dbraw/zinc/59/08/99/1020590899.db2.gz OGJOOOAFSOUKSC-ICSRJNTNSA-N 1 1 364.405 2.999 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932136893 1020718915 /nfs/dbraw/zinc/71/89/15/1020718915.db2.gz LOACDOBSFOVLLT-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932136893 1020718922 /nfs/dbraw/zinc/71/89/22/1020718922.db2.gz LOACDOBSFOVLLT-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1CC1 ZINC000187462085 1021098548 /nfs/dbraw/zinc/09/85/48/1021098548.db2.gz FQUAUXIQMQTNHE-IBGZPJMESA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1CC1 ZINC000187462105 1021098599 /nfs/dbraw/zinc/09/85/99/1021098599.db2.gz FQUAUXIQMQTNHE-LJQANCHMSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1 ZINC000933944552 1021118645 /nfs/dbraw/zinc/11/86/45/1021118645.db2.gz HWNPLBRVASAECB-KFKAGJAMSA-N 1 1 357.454 2.889 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c1 ZINC000934268178 1021182406 /nfs/dbraw/zinc/18/24/06/1021182406.db2.gz HUPNVVBJILCONI-HZPDHXFCSA-N 1 1 373.375 2.645 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])C1 ZINC000934735518 1021378706 /nfs/dbraw/zinc/37/87/06/1021378706.db2.gz ZPYAHRANNKAWTR-GOSISDBHSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])C1 ZINC000934735518 1021378724 /nfs/dbraw/zinc/37/87/24/1021378724.db2.gz ZPYAHRANNKAWTR-GOSISDBHSA-N 1 1 362.430 2.965 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@@H](c4nccs4)C3)n2)c1 ZINC001119331721 1022693370 /nfs/dbraw/zinc/69/33/70/1022693370.db2.gz QWLSMXIJBDEWGL-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](c4nccs4)C3)n2)c1 ZINC001119331721 1022693375 /nfs/dbraw/zinc/69/33/75/1022693375.db2.gz QWLSMXIJBDEWGL-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001119387012 1022731051 /nfs/dbraw/zinc/73/10/51/1022731051.db2.gz ZXXAZTLBTWBSLJ-ZDUSSCGKSA-N 1 1 350.394 2.977 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1c1ccncc1 ZINC001122950945 1023570729 /nfs/dbraw/zinc/57/07/29/1023570729.db2.gz ABNDOIAIHOUKCT-GBESFXJTSA-N 1 1 367.405 2.911 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1c1ccncc1 ZINC001122950945 1023570736 /nfs/dbraw/zinc/57/07/36/1023570736.db2.gz ABNDOIAIHOUKCT-GBESFXJTSA-N 1 1 367.405 2.911 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc2nc(O[C@H]3C[C@@H](O)C3)c3ccccc3c2c1 ZINC001218421032 1033148811 /nfs/dbraw/zinc/14/88/11/1033148811.db2.gz RBYSGCRXKTYIIY-GASCZTMLSA-N 1 1 365.433 2.790 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC001123268819 1023716057 /nfs/dbraw/zinc/71/60/57/1023716057.db2.gz UIQDHYDADBXENI-DOMZBBRYSA-N 1 1 350.419 2.797 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C ZINC001121698217 1023934111 /nfs/dbraw/zinc/93/41/11/1023934111.db2.gz CVHSMZVGPNHNLK-OLZOCXBDSA-N 1 1 362.434 2.633 20 5 FFBDMO C[C@H]1CC[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999362 1024419739 /nfs/dbraw/zinc/41/97/39/1024419739.db2.gz HMMVLAAOWMBCEW-DJJJIMSYSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999362 1024419742 /nfs/dbraw/zinc/41/97/42/1024419742.db2.gz HMMVLAAOWMBCEW-DJJJIMSYSA-N 1 1 374.441 2.687 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000195128586 1024946074 /nfs/dbraw/zinc/94/60/74/1024946074.db2.gz UZCFEDPWEBDYLT-MRXNPFEDSA-N 1 1 358.398 2.727 20 5 FFBDMO COc1cc(OCC(=O)OC[C@H]2CCCC[N@H+]2C(C)C)ccc1[N+](=O)[O-] ZINC000837472245 1025832636 /nfs/dbraw/zinc/83/26/36/1025832636.db2.gz KCBUNTMACWOEKM-CQSZACIVSA-N 1 1 366.414 2.788 20 5 FFBDMO C[C@@H]1C[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)C[N@@H+](Cc2ccccc2)C1 ZINC000839093028 1026585977 /nfs/dbraw/zinc/58/59/77/1026585977.db2.gz XKQLRMFYCNTZQL-QAPCUYQASA-N 1 1 372.425 2.635 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC(C)(C)C1 ZINC000840183708 1027001265 /nfs/dbraw/zinc/00/12/65/1027001265.db2.gz IHUSYDRHOYRZLC-LJQANCHMSA-N 1 1 374.441 2.830 20 5 FFBDMO O=C(NC1CC[NH+](CCF)CC1)c1cccc2nc3ccccc3nc21 ZINC001153870859 1028034484 /nfs/dbraw/zinc/03/44/84/1028034484.db2.gz OTJCXSLWGMVQMZ-UHFFFAOYSA-N 1 1 352.413 2.947 20 5 FFBDMO CN1CC[NH+](CCCNc2nc(-c3ccccc3)ccc2[N+](=O)[O-])CC1 ZINC001161703506 1028284622 /nfs/dbraw/zinc/28/46/22/1028284622.db2.gz HKJFHRUXCMZZCH-UHFFFAOYSA-N 1 1 355.442 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[N@H+]4CCc5ccccc5[C@@H]4C3)c2c1 ZINC001155093161 1028577714 /nfs/dbraw/zinc/57/77/14/1028577714.db2.gz YYYNCEMQPQFAIU-IBGZPJMESA-N 1 1 361.405 2.957 20 5 FFBDMO CC[N@H+](Cc1cccc(C)c1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713119 1028582679 /nfs/dbraw/zinc/58/26/79/1028582679.db2.gz MZVPOLJZFNJITA-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@@H+](Cc1cccc(C)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713119 1028582688 /nfs/dbraw/zinc/58/26/88/1028582688.db2.gz MZVPOLJZFNJITA-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@H+](Cc1cccc(C)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713119 1028582700 /nfs/dbraw/zinc/58/27/00/1028582700.db2.gz MZVPOLJZFNJITA-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001163643542 1029004314 /nfs/dbraw/zinc/00/43/14/1029004314.db2.gz UDHPFPDQDAFNQR-UHFFFAOYSA-N 1 1 354.414 2.824 20 5 FFBDMO COc1nc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)ncc1[N+](=O)[O-] ZINC001156314328 1029139586 /nfs/dbraw/zinc/13/95/86/1029139586.db2.gz FWWKPOVBHCCGQM-BZUAXINKSA-N 1 1 369.425 2.716 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)nc1N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC001165086697 1029376206 /nfs/dbraw/zinc/37/62/06/1029376206.db2.gz OAJMABLYWAEDDP-UKRRQHHQSA-N 1 1 359.817 2.749 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000781736105 1029381245 /nfs/dbraw/zinc/38/12/45/1029381245.db2.gz VMTFMHXKHCNLGT-AWEZNQCLSA-N 1 1 365.386 2.853 20 5 FFBDMO C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000888092494 1029618811 /nfs/dbraw/zinc/61/88/11/1029618811.db2.gz XFOCXZYYRGKCKJ-YVEFUNNKSA-N 1 1 366.801 2.826 20 5 FFBDMO Cc1ccc(-c2ccc(NCC3([NH+]4CCCC4)COC3)nn2)cc1[N+](=O)[O-] ZINC001157656591 1029639109 /nfs/dbraw/zinc/63/91/09/1029639109.db2.gz ZWXFKZKOAQBSEE-UHFFFAOYSA-N 1 1 369.425 2.637 20 5 FFBDMO Cc1cc(Cl)nc(N2CC[NH+](Cc3cccc(N)c3)CC2)c1[N+](=O)[O-] ZINC001158481146 1029838334 /nfs/dbraw/zinc/83/83/34/1029838334.db2.gz VGZNIWFGJQNKRU-UHFFFAOYSA-N 1 1 361.833 2.856 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000784030775 1030428596 /nfs/dbraw/zinc/42/85/96/1030428596.db2.gz WPHDXHUCBPLLEA-MRXNPFEDSA-N 1 1 371.372 2.898 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](Oc3cccc(F)c3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000784030775 1030428611 /nfs/dbraw/zinc/42/86/11/1030428611.db2.gz WPHDXHUCBPLLEA-MRXNPFEDSA-N 1 1 371.372 2.898 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@]2(O)CCc3ccccc32)c2ccc([N+](=O)[O-])cc12 ZINC000842623224 1030841883 /nfs/dbraw/zinc/84/18/83/1030841883.db2.gz LBCMRDZLTVIRHQ-HXUWFJFHSA-N 1 1 366.421 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cc4c(cn3)OCCO4)CC2)cc1 ZINC001204609699 1031391292 /nfs/dbraw/zinc/39/12/92/1031391292.db2.gz XTPDZOYCGMLCLJ-UHFFFAOYSA-N 1 1 371.393 2.804 20 5 FFBDMO NC[C@@H]([NH3+])c1ccc(C(=O)Nc2cc3nc4ccccc4nc3cc2N)cc1 ZINC001218859488 1033382118 /nfs/dbraw/zinc/38/21/18/1033382118.db2.gz OKKZHBGRJNZFBS-OAHLLOKOSA-N 1 1 372.432 2.576 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCOC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)cc1 ZINC001224777171 1034002031 /nfs/dbraw/zinc/00/20/31/1034002031.db2.gz NAYHTGWJNNUHTK-FQEVSTJZSA-N 1 1 372.421 2.891 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCOC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)cc1 ZINC001224777171 1034002045 /nfs/dbraw/zinc/00/20/45/1034002045.db2.gz NAYHTGWJNNUHTK-FQEVSTJZSA-N 1 1 372.421 2.891 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1 ZINC001226171626 1034558976 /nfs/dbraw/zinc/55/89/76/1034558976.db2.gz DPLJFUHAKADGJU-ZFWWWQNUSA-N 1 1 370.409 2.693 20 5 FFBDMO O=c1nc2ccc([N+](=O)[O-])cc2c(OC2CCN(c3cc[nH+]cc3)CC2)[nH]1 ZINC001227097211 1034933706 /nfs/dbraw/zinc/93/37/06/1034933706.db2.gz XBMXRJYDZXFBRE-UHFFFAOYSA-N 1 1 367.365 2.686 20 5 FFBDMO C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1 ZINC001228609224 1036203064 /nfs/dbraw/zinc/20/30/64/1036203064.db2.gz BCSTVEBQGBGEMV-WCQYABFASA-N 1 1 371.397 2.577 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1 ZINC001228609224 1036203085 /nfs/dbraw/zinc/20/30/85/1036203085.db2.gz BCSTVEBQGBGEMV-WCQYABFASA-N 1 1 371.397 2.577 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001229451113 1036683080 /nfs/dbraw/zinc/68/30/80/1036683080.db2.gz CLNDFBVGOXSLEW-FVQHAEBGSA-N 1 1 355.394 2.803 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2cc(O)c(OC)c3c2c(=O)c2ccccc2n3C)C1 ZINC001234168870 1036954525 /nfs/dbraw/zinc/95/45/25/1036954525.db2.gz AQVGYTYAMBWGFI-CYBMUJFWSA-N 1 1 368.433 2.879 20 5 FFBDMO Cc1c(Br)c(O[C@H]2CCc3[nH+]ccn3C2)ncc1[N+](=O)[O-] ZINC001231094889 1037467295 /nfs/dbraw/zinc/46/72/95/1037467295.db2.gz JNGLPEKYNDKEIM-VIFPVBQESA-N 1 1 353.176 2.651 20 5 FFBDMO COc1cc(N2CCC([NH2+]C(C)(C)CCN(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256087694 1038372520 /nfs/dbraw/zinc/37/25/20/1038372520.db2.gz LORKKFQCSJYFSD-UHFFFAOYSA-N 1 1 364.490 2.892 20 5 FFBDMO COc1cc(N2CCC([NH2+]CC(C)(C)CN(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256087997 1038372609 /nfs/dbraw/zinc/37/26/09/1038372609.db2.gz UQHTXWBOZCWIIF-UHFFFAOYSA-N 1 1 364.490 2.750 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@](C)(O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092947 1038378147 /nfs/dbraw/zinc/37/81/47/1038378147.db2.gz BTHQBGBBDLZDSI-LJQANCHMSA-N 1 1 363.458 2.809 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H]4OCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100777 1038385276 /nfs/dbraw/zinc/38/52/76/1038385276.db2.gz OTBJXHXCQXEJRO-RDTXWAMCSA-N 1 1 361.442 2.683 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CC[C@]4(CCN(C)C4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101473 1038386973 /nfs/dbraw/zinc/38/69/73/1038386973.db2.gz JTUJNEQQVTXINC-FQEVSTJZSA-N 1 1 374.485 2.600 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@]4(CCN(C)C4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101473 1038386986 /nfs/dbraw/zinc/38/69/86/1038386986.db2.gz JTUJNEQQVTXINC-FQEVSTJZSA-N 1 1 374.485 2.600 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@H+](C)CCO1 ZINC001210683677 1039669277 /nfs/dbraw/zinc/66/92/77/1039669277.db2.gz YFJSMLFZAPECRX-PXAZEXFGSA-N 1 1 358.398 2.589 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@@H+](C)CCO1 ZINC001210683677 1039669282 /nfs/dbraw/zinc/66/92/82/1039669282.db2.gz YFJSMLFZAPECRX-PXAZEXFGSA-N 1 1 358.398 2.589 20 5 FFBDMO CCOc1ccc(C[C@H]([NH3+])c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)cc1 ZINC001247667045 1039874969 /nfs/dbraw/zinc/87/49/69/1039874969.db2.gz SILGFRBIEICBRC-ZDUSSCGKSA-N 1 1 373.344 2.820 20 5 FFBDMO COc1ncc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)cc1C ZINC001248209544 1040174078 /nfs/dbraw/zinc/17/40/78/1040174078.db2.gz PFXIHEQSVMNAPC-CQSZACIVSA-N 1 1 355.354 2.599 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC001213164972 1040298538 /nfs/dbraw/zinc/29/85/38/1040298538.db2.gz HMPCMSRTNDGRQZ-AWEZNQCLSA-N 1 1 367.471 2.589 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC001213164973 1040299252 /nfs/dbraw/zinc/29/92/52/1040299252.db2.gz HMPCMSRTNDGRQZ-CQSZACIVSA-N 1 1 367.471 2.589 20 5 FFBDMO CC[NH+]1CCN(Cc2nc(-c3ccc4ccc5cccnc5c4n3)no2)CC1 ZINC001248954745 1040524997 /nfs/dbraw/zinc/52/49/97/1040524997.db2.gz WELCXVOCJZFICF-UHFFFAOYSA-N 1 1 374.448 2.971 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC001254551511 1040792817 /nfs/dbraw/zinc/79/28/17/1040792817.db2.gz CMZMNSIBRJEHRP-JJAZEVLHSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(CCc2ccncc2)CC1 ZINC001254562144 1040798999 /nfs/dbraw/zinc/79/89/99/1040798999.db2.gz JXXRADFWCOODQA-QGZVFWFLSA-N 1 1 354.454 2.781 20 5 FFBDMO CC(=O)N1CCCC[C@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594724 1040823062 /nfs/dbraw/zinc/82/30/62/1040823062.db2.gz HFDYZDJQMMYBOK-WOJBJXKFSA-N 1 1 357.454 2.929 20 5 FFBDMO O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)N1CC1CC1 ZINC001254596238 1040823818 /nfs/dbraw/zinc/82/38/18/1040823818.db2.gz MVQJLLYJZUOCII-FHWLQOOXSA-N 1 1 355.438 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCCN(c3ccc(F)cn3)CC1)C2 ZINC001254595969 1040824070 /nfs/dbraw/zinc/82/40/70/1040824070.db2.gz AORXEWLIIYQSTL-GOSISDBHSA-N 1 1 356.401 2.808 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@H]3[C@H]1CCN3Cc1cccnc1)C2 ZINC001254596045 1040825239 /nfs/dbraw/zinc/82/52/39/1040825239.db2.gz MLCVYZMRILUXJU-PCCBWWKXSA-N 1 1 364.449 2.806 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]31)C2 ZINC001254596690 1040825736 /nfs/dbraw/zinc/82/57/36/1040825736.db2.gz QLGAYJBXFHKPLC-IYWMVGAKSA-N 1 1 358.438 2.720 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]31)C2 ZINC001254596690 1040825749 /nfs/dbraw/zinc/82/57/49/1040825749.db2.gz QLGAYJBXFHKPLC-IYWMVGAKSA-N 1 1 358.438 2.720 20 5 FFBDMO CC(C)C(=O)N1CCC[C@]12CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599051 1040830088 /nfs/dbraw/zinc/83/00/88/1040830088.db2.gz JWXGCJJTWCCQJH-AZUAARDMSA-N 1 1 357.454 2.785 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)[C@H]2C1 ZINC001538046057 1070324163 /nfs/dbraw/zinc/32/41/63/1070324163.db2.gz GUMXWPGOKJRZEV-JCGIZDLHSA-N 1 1 372.469 2.655 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(-c2nc3ccc(N4CC[NH+](C)CC4)cc3[nH]2)c1 ZINC001250871111 1041412010 /nfs/dbraw/zinc/41/20/10/1041412010.db2.gz FVQHNESQYNXKOE-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001265557689 1042865767 /nfs/dbraw/zinc/86/57/67/1042865767.db2.gz XVXVSJPCYYFBNB-KDOFPFPSSA-N 1 1 368.437 2.939 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001311332074 1043891161 /nfs/dbraw/zinc/89/11/61/1043891161.db2.gz RUORDYOWBGMIQK-UHFFFAOYSA-N 1 1 360.414 2.838 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313376427 1044337535 /nfs/dbraw/zinc/33/75/35/1044337535.db2.gz PORJMMRTUKBVMV-AEFFLSMTSA-N 1 1 360.458 2.968 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)CNc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001318609295 1044771486 /nfs/dbraw/zinc/77/14/86/1044771486.db2.gz HTKREOBHNWUNLM-OAHLLOKOSA-N 1 1 369.425 2.813 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CC/C=C\c2ccccc2)CC1 ZINC001318886466 1044924167 /nfs/dbraw/zinc/92/41/67/1044924167.db2.gz RNYRUKWZQBJQPZ-IYKQLEIESA-N 1 1 371.481 2.973 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+]1Cc1ccccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001319556754 1045194813 /nfs/dbraw/zinc/19/48/13/1045194813.db2.gz CDZZQCMPMUJLGK-IBGZPJMESA-N 1 1 366.421 2.539 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1Cc1ccccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001319556754 1045194816 /nfs/dbraw/zinc/19/48/16/1045194816.db2.gz CDZZQCMPMUJLGK-IBGZPJMESA-N 1 1 366.421 2.539 20 5 FFBDMO Cc1c(C(=O)OCCOc2ccccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001320636068 1045440687 /nfs/dbraw/zinc/44/06/87/1045440687.db2.gz GFMHNSLPNYDQJA-UHFFFAOYSA-N 1 1 368.349 2.720 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001749 1046301910 /nfs/dbraw/zinc/30/19/10/1046301910.db2.gz AGISPAYCDKQONJ-WMZOPIPTSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001749 1046301923 /nfs/dbraw/zinc/30/19/23/1046301923.db2.gz AGISPAYCDKQONJ-WMZOPIPTSA-N 1 1 372.400 2.951 20 5 FFBDMO COc1ccc(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC001331314133 1047858345 /nfs/dbraw/zinc/85/83/45/1047858345.db2.gz GEPTVPHLKNDTAN-SFHVURJKSA-N 1 1 367.409 2.654 20 5 FFBDMO COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Br)C1CCOCC1 ZINC001331808912 1048122217 /nfs/dbraw/zinc/12/22/17/1048122217.db2.gz XBVONTHKEOVCQL-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1Br)C1CCOCC1 ZINC001331808912 1048122213 /nfs/dbraw/zinc/12/22/13/1048122213.db2.gz XBVONTHKEOVCQL-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO COc1ccc(OCC[N@@H+](Cc2ccccc2)[C@H](C)CO)c([N+](=O)[O-])c1 ZINC001330088229 1049034355 /nfs/dbraw/zinc/03/43/55/1049034355.db2.gz ABLCPUHTCRNBTB-OAHLLOKOSA-N 1 1 360.410 2.865 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC(C)(C)[N@H+]2CCc3ccccc3C2)n1 ZINC001292150852 1049146058 /nfs/dbraw/zinc/14/60/58/1049146058.db2.gz RDPWQTGDZHPKIT-UHFFFAOYSA-N 1 1 368.437 2.865 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001307154700 1049459666 /nfs/dbraw/zinc/45/96/66/1049459666.db2.gz ZTKJDGSSDKPDMP-MCIONIFRSA-N 1 1 365.430 2.599 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001307154700 1049459671 /nfs/dbraw/zinc/45/96/71/1049459671.db2.gz ZTKJDGSSDKPDMP-MCIONIFRSA-N 1 1 365.430 2.599 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(c3ncnc4c(Cl)cc([N+](=O)[O-])cc43)C[C@@]2(C)C1 ZINC001307178585 1049812046 /nfs/dbraw/zinc/81/20/46/1049812046.db2.gz DOGSCCQBZOSLGX-CALCHBBNSA-N 1 1 361.833 2.969 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1C[C@@H]2C[C@]2(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC001340919768 1051247680 /nfs/dbraw/zinc/24/76/80/1051247680.db2.gz DZJZQPWCXGRALD-PWIZWCRZSA-N 1 1 351.406 2.569 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](n2ccnn2)CC1 ZINC001307965639 1052372830 /nfs/dbraw/zinc/37/28/30/1052372830.db2.gz JOJZACKBPWNZTD-HNNXBMFYSA-N 1 1 372.429 2.551 20 5 FFBDMO CN(C)c1ccc(F)cc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001308573893 1052472303 /nfs/dbraw/zinc/47/23/03/1052472303.db2.gz PCUWLVUVGRJNLV-HNNXBMFYSA-N 1 1 359.405 2.881 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CN(C)CCN1C ZINC001308949277 1052524541 /nfs/dbraw/zinc/52/45/41/1052524541.db2.gz XPOVVTKPVNKLNI-QMTHXVAHSA-N 1 1 361.273 2.626 20 5 FFBDMO O=C(N[C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccc([N+](=O)[O-])[nH]1 ZINC001334858728 1053119291 /nfs/dbraw/zinc/11/92/91/1053119291.db2.gz MKSADZHKHABNEU-IKGGRYGDSA-N 1 1 368.437 2.953 20 5 FFBDMO C[N@@H+]1C[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830720 1054266104 /nfs/dbraw/zinc/26/61/04/1054266104.db2.gz UTQGAWRZPRUCNC-YZGWKJHDSA-N 1 1 355.438 2.563 20 5 FFBDMO C[N@H+]1C[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830720 1054266113 /nfs/dbraw/zinc/26/61/13/1054266113.db2.gz UTQGAWRZPRUCNC-YZGWKJHDSA-N 1 1 355.438 2.563 20 5 FFBDMO CN1C[C@@H](C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC001336830720 1054266119 /nfs/dbraw/zinc/26/61/19/1054266119.db2.gz UTQGAWRZPRUCNC-YZGWKJHDSA-N 1 1 355.438 2.563 20 5 FFBDMO O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC001347772346 1054304157 /nfs/dbraw/zinc/30/41/57/1054304157.db2.gz XHMYVMOHFMSHQR-LBPRGKRZSA-N 1 1 357.332 2.924 20 5 FFBDMO C[N@@H+](CCNC(=O)CCc1cc(F)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC001356104621 1055290146 /nfs/dbraw/zinc/29/01/46/1055290146.db2.gz RTLFGJITWGCQSW-UHFFFAOYSA-N 1 1 359.401 2.915 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC001338384692 1055466534 /nfs/dbraw/zinc/46/65/34/1055466534.db2.gz VCYCCWHAJJOTME-CYBMUJFWSA-N 1 1 359.348 2.649 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC2)cc1 ZINC001350433551 1055771442 /nfs/dbraw/zinc/77/14/42/1055771442.db2.gz OAOFWYSJNXALGV-UHFFFAOYSA-N 1 1 368.437 2.714 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC001444270508 1058291520 /nfs/dbraw/zinc/29/15/20/1058291520.db2.gz ZPBJCZHBZAOWGL-MRXNPFEDSA-N 1 1 354.410 2.571 20 5 FFBDMO Cc1ccc(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704260 1059151938 /nfs/dbraw/zinc/15/19/38/1059151938.db2.gz SCUNSGSORUPPDI-VQTJNVASSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704260 1059151943 /nfs/dbraw/zinc/15/19/43/1059151943.db2.gz SCUNSGSORUPPDI-VQTJNVASSA-N 1 1 369.465 2.876 20 5 FFBDMO O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001454337516 1059505384 /nfs/dbraw/zinc/50/53/84/1059505384.db2.gz JDPLIAANWNVFQC-OAHLLOKOSA-N 1 1 361.785 2.741 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848478908 1060107729 /nfs/dbraw/zinc/10/77/29/1060107729.db2.gz OLBKVWSTNFFWAH-MAUKXSAKSA-N 1 1 361.442 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCOC3(CCOCC3)CC2)c1 ZINC000848484736 1060129706 /nfs/dbraw/zinc/12/97/06/1060129706.db2.gz PMLZYKWMSRFJQA-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCOC3(CCOCC3)CC2)c1 ZINC000848484736 1060129709 /nfs/dbraw/zinc/12/97/09/1060129709.db2.gz PMLZYKWMSRFJQA-UHFFFAOYSA-N 1 1 372.425 2.687 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000848487869 1060139477 /nfs/dbraw/zinc/13/94/77/1060139477.db2.gz ZOZDAFMXQXSFDM-OKZBNKHCSA-N 1 1 359.426 2.512 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491413 1060148964 /nfs/dbraw/zinc/14/89/64/1060148964.db2.gz WAFSMCSKRMOCFM-QZTJIDSGSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491413 1060148968 /nfs/dbraw/zinc/14/89/68/1060148968.db2.gz WAFSMCSKRMOCFM-QZTJIDSGSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848496900 1060167816 /nfs/dbraw/zinc/16/78/16/1060167816.db2.gz HPNTWFDOIYGTAS-OALUTQOASA-N 1 1 373.453 2.902 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H](OC2CCC2)C1 ZINC000848496900 1060167821 /nfs/dbraw/zinc/16/78/21/1060167821.db2.gz HPNTWFDOIYGTAS-OALUTQOASA-N 1 1 373.453 2.902 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001458644202 1060639993 /nfs/dbraw/zinc/63/99/93/1060639993.db2.gz IUMCQXQQRBVKGS-AWEZNQCLSA-N 1 1 358.442 2.613 20 5 FFBDMO Nc1[nH+]ccc2c1CN(c1ncnc3c(Cl)cc([N+](=O)[O-])cc31)CC2 ZINC001458699107 1060650452 /nfs/dbraw/zinc/65/04/52/1060650452.db2.gz BSIQHUMAKRRXJH-UHFFFAOYSA-N 1 1 356.773 2.731 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001465065132 1062960229 /nfs/dbraw/zinc/96/02/29/1062960229.db2.gz FYZQBMHZHMAQPK-VIFPVBQESA-N 1 1 358.801 2.574 20 5 FFBDMO Cc1c(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)cnn1-c1cc[nH+]cc1 ZINC001532389392 1063054342 /nfs/dbraw/zinc/05/43/42/1063054342.db2.gz VOSWSIWNWUPVNY-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H](C)C2)n1 ZINC001525879413 1063447109 /nfs/dbraw/zinc/44/71/09/1063447109.db2.gz UYPVRWWBGLXIEW-HNNXBMFYSA-N 1 1 368.437 2.892 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001468570615 1064006562 /nfs/dbraw/zinc/00/65/62/1064006562.db2.gz WDBXBGPYPLYKPO-OAHLLOKOSA-N 1 1 373.457 2.690 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001470781682 1064449105 /nfs/dbraw/zinc/44/91/05/1064449105.db2.gz XYPKRKSYSRHBEO-AUUYWEPGSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1cc(NC[C@H]2CCCC[N@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001472831848 1065154074 /nfs/dbraw/zinc/15/40/74/1065154074.db2.gz URFOTXRBQBYDTH-OAHLLOKOSA-N 1 1 355.442 2.926 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[NH+]1CCN(c2cc(Cl)ccn2)CC1 ZINC001473808197 1065371491 /nfs/dbraw/zinc/37/14/91/1065371491.db2.gz AETTYLXHWDYXGV-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(-c2ccc(F)cc2)nn1 ZINC001474469447 1065529208 /nfs/dbraw/zinc/52/92/08/1065529208.db2.gz JEPQKUSITFPOBZ-UHFFFAOYSA-N 1 1 355.373 2.989 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cn(-c2ccc(F)cc2)nn1 ZINC001474469447 1065529218 /nfs/dbraw/zinc/52/92/18/1065529218.db2.gz JEPQKUSITFPOBZ-UHFFFAOYSA-N 1 1 355.373 2.989 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@@H+](Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC001474633239 1065566932 /nfs/dbraw/zinc/56/69/32/1065566932.db2.gz ANLWCIUAIHHVAE-IBGZPJMESA-N 1 1 374.441 2.727 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCC[N@H+](C)C1CCCCC1 ZINC001474879755 1065634954 /nfs/dbraw/zinc/63/49/54/1065634954.db2.gz NECYOEHTIGSELZ-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO CCc1ccc2c(c1)CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001578263763 1078457623 /nfs/dbraw/zinc/45/76/23/1078457623.db2.gz WQYLNCVLXLPFGK-HXUWFJFHSA-N 1 1 353.422 2.916 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC001583145779 1079170606 /nfs/dbraw/zinc/17/06/06/1079170606.db2.gz UCQJEYMCEKGFPA-STQMWFEESA-N 1 1 352.822 2.577 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC001585138745 1079430186 /nfs/dbraw/zinc/43/01/86/1079430186.db2.gz LCHVTOQFJRMAQZ-INIZCTEOSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC001585138745 1079430188 /nfs/dbraw/zinc/43/01/88/1079430188.db2.gz LCHVTOQFJRMAQZ-INIZCTEOSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC001557740127 1075882723 /nfs/dbraw/zinc/88/27/23/1075882723.db2.gz DIGIGJPETBVUMM-DOPJRALCSA-N 1 1 363.483 2.876 20 5 FFBDMO Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)c1 ZINC001557759643 1075885364 /nfs/dbraw/zinc/88/53/64/1075885364.db2.gz BIVQONSKYAQROW-HNNXBMFYSA-N 1 1 371.441 2.754 20 5 FFBDMO CCc1[nH+]ccn1CCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559279887 1076144992 /nfs/dbraw/zinc/14/49/92/1076144992.db2.gz IAHIRJSNZBNNNB-UHFFFAOYSA-N 1 1 352.398 2.653 20 5 FFBDMO CCOc1cc(C[NH2+][C@](C)(CC(=O)OC)c2cccnc2)ccc1[N+](=O)[O-] ZINC001560244013 1076255540 /nfs/dbraw/zinc/25/55/40/1076255540.db2.gz BOPWUUVBZNVZLT-LJQANCHMSA-N 1 1 373.409 2.957 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001566364207 1076951524 /nfs/dbraw/zinc/95/15/24/1076951524.db2.gz IAQZXTFIVKSVRL-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@@H+](CC/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001567746939 1077050484 /nfs/dbraw/zinc/05/04/84/1077050484.db2.gz RKBMDRCBMOQZHQ-PEABSYDSSA-N 1 1 371.481 2.926 20 5 FFBDMO C[N@H+](CC/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001567746939 1077050489 /nfs/dbraw/zinc/05/04/89/1077050489.db2.gz RKBMDRCBMOQZHQ-PEABSYDSSA-N 1 1 371.481 2.926 20 5 FFBDMO C[N@@H+](CC/C=C/c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001567746939 1077050493 /nfs/dbraw/zinc/05/04/93/1077050493.db2.gz RKBMDRCBMOQZHQ-PEABSYDSSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001587763422 1079858576 /nfs/dbraw/zinc/85/85/76/1079858576.db2.gz MMNJDKQRDKOSAE-KGLIPLIRSA-N 1 1 351.834 2.876 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2cc(-c3nn[nH]n3)ccc2[N+](=O)[O-])C1 ZINC001589629849 1080642302 /nfs/dbraw/zinc/64/23/02/1080642302.db2.gz KHORDCGHAAJGJO-CYBMUJFWSA-N 1 1 359.434 2.555 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000411325689 512581255 /nfs/dbraw/zinc/58/12/55/512581255.db2.gz OLEIXWQZSIYQCE-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000021055029 249326526 /nfs/dbraw/zinc/32/65/26/249326526.db2.gz KLCRWFQXNAQDQF-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO COc1cc(C[N@@H+](C)CC(C)(C)O)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093414553 250034280 /nfs/dbraw/zinc/03/42/80/250034280.db2.gz FPGZGEGQVHEZIK-UHFFFAOYSA-N 1 1 366.336 2.747 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000093910506 250051076 /nfs/dbraw/zinc/05/10/76/250051076.db2.gz HQSIOKXVZBKDGY-GASCZTMLSA-N 1 1 363.458 2.749 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000101531673 250075037 /nfs/dbraw/zinc/07/50/37/250075037.db2.gz XGQCZEKQSCQYPW-UHFFFAOYSA-N 1 1 357.410 2.969 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272493737 252051619 /nfs/dbraw/zinc/05/16/19/252051619.db2.gz FINBPQBHNFXJQE-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO Cc1cc(C[C@H](C)[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000272586843 252073680 /nfs/dbraw/zinc/07/36/80/252073680.db2.gz ZHNFVBHJJFSIHO-SJCJKPOMSA-N 1 1 354.414 2.670 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)cc1SC ZINC000272625324 252084263 /nfs/dbraw/zinc/08/42/63/252084263.db2.gz APXATACKJWAVFU-NSHDSACASA-N 1 1 365.455 2.706 20 5 FFBDMO C[C@@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1=CC[N@@H+](C)CC1 ZINC000272954835 252174370 /nfs/dbraw/zinc/17/43/70/252174370.db2.gz MZCLSNAQFXWKIW-CQSZACIVSA-N 1 1 358.442 2.919 20 5 FFBDMO COc1ccc(OCC[NH2+][C@@H](CO)c2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC000273125161 252223540 /nfs/dbraw/zinc/22/35/40/252223540.db2.gz QHESIGBZSJRNRL-AWEZNQCLSA-N 1 1 368.336 2.584 20 5 FFBDMO C[C@@H](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000273244677 252263097 /nfs/dbraw/zinc/26/30/97/252263097.db2.gz XTWXHUYZIBKJLU-NSHDSACASA-N 1 1 361.489 2.736 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276089072 256071721 /nfs/dbraw/zinc/07/17/21/256071721.db2.gz PWGKVBJFHFMZCI-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO CCOc1cc(C[N@H+]2CCOCC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000276982760 256149389 /nfs/dbraw/zinc/14/93/89/256149389.db2.gz YPPUGMMFJPSGSS-UHFFFAOYSA-N 1 1 350.415 2.623 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CCCO1 ZINC000277185204 256170095 /nfs/dbraw/zinc/17/00/95/256170095.db2.gz HOEHUWRJMCMTFI-LBPRGKRZSA-N 1 1 370.837 2.871 20 5 FFBDMO CCOc1cc(CN2CCC(C[NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000276914637 256142144 /nfs/dbraw/zinc/14/21/44/256142144.db2.gz OBOSKJTYUDUGJO-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO COc1ccc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000278190161 256286070 /nfs/dbraw/zinc/28/60/70/256286070.db2.gz UIEJVQFSZYJSFV-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000278265812 256293110 /nfs/dbraw/zinc/29/31/10/256293110.db2.gz YPVVZHVIFLRMHU-SFHVURJKSA-N 1 1 367.409 2.780 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000278333739 256300910 /nfs/dbraw/zinc/30/09/10/256300910.db2.gz MDSKHBGMIRGSPT-UHFFFAOYSA-N 1 1 371.393 2.747 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H](Oc3ncccc3F)C2)c1 ZINC000278905136 256361188 /nfs/dbraw/zinc/36/11/88/256361188.db2.gz SBIOXCNICBLMJF-RDJZCZTQSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](Oc3ncccc3F)C2)c1 ZINC000278905136 256361189 /nfs/dbraw/zinc/36/11/89/256361189.db2.gz SBIOXCNICBLMJF-RDJZCZTQSA-N 1 1 361.373 2.706 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)[C@H](C)C1 ZINC000279388509 256411356 /nfs/dbraw/zinc/41/13/56/256411356.db2.gz IOUVZFKQKOMXMU-DOMZBBRYSA-N 1 1 366.437 2.602 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1 ZINC000288680383 257217759 /nfs/dbraw/zinc/21/77/59/257217759.db2.gz CRJXSCPJMDHXTE-WOJBJXKFSA-N 1 1 374.412 2.694 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)c1 ZINC000289785864 257299481 /nfs/dbraw/zinc/29/94/81/257299481.db2.gz HLCZZDNPEOSZAW-INIZCTEOSA-N 1 1 357.414 2.684 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000289889419 257304927 /nfs/dbraw/zinc/30/49/27/257304927.db2.gz RVWXQYINTWCUKC-HOTGVXAUSA-N 1 1 352.431 2.614 20 5 FFBDMO C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+](C2CCC2)C1 ZINC000292457368 257496261 /nfs/dbraw/zinc/49/62/61/257496261.db2.gz ZRBQQOZZWYTIMV-GFCCVEGCSA-N 1 1 357.414 2.554 20 5 FFBDMO CCN1CC[NH+]([C@H](C)CNc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000302047124 258083892 /nfs/dbraw/zinc/08/38/92/258083892.db2.gz YRGVETCRLCELEX-OAHLLOKOSA-N 1 1 357.458 2.889 20 5 FFBDMO COC(=O)c1cnc(N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302749515 258109731 /nfs/dbraw/zinc/10/97/31/258109731.db2.gz GRQRHRXGLSQSBX-FRRDWIJNSA-N 1 1 350.419 2.555 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2ncc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000301578374 258056740 /nfs/dbraw/zinc/05/67/40/258056740.db2.gz ZLROTUNCPGZIMM-ZWNOBZJWSA-N 1 1 357.252 2.919 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1Cl ZINC000301732619 258065224 /nfs/dbraw/zinc/06/52/24/258065224.db2.gz YRRTXMKILAAHQJ-BXUZGUMPSA-N 1 1 367.833 2.955 20 5 FFBDMO CC[C@@H]1CCCC[N@@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301887639 258072965 /nfs/dbraw/zinc/07/29/65/258072965.db2.gz MUNPFFYWBQJLNB-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301887639 258072966 /nfs/dbraw/zinc/07/29/66/258072966.db2.gz MUNPFFYWBQJLNB-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[NH+]1CCN([C@H]2CCN(c3cc(C)nc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000301984810 258080452 /nfs/dbraw/zinc/08/04/52/258080452.db2.gz CHKUCLQDBDSVCQ-INIZCTEOSA-N 1 1 369.469 2.668 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@H]3CCC[N@H+]3Cc3ccccc3)nn21 ZINC000302011206 258081694 /nfs/dbraw/zinc/08/16/94/258081694.db2.gz WIXTXOOLZPCLKD-OAHLLOKOSA-N 1 1 352.398 2.714 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O ZINC000330700641 258168825 /nfs/dbraw/zinc/16/88/25/258168825.db2.gz GXULSFWCTQVKQU-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O ZINC000330700641 258168826 /nfs/dbraw/zinc/16/88/26/258168826.db2.gz GXULSFWCTQVKQU-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000332081535 258212994 /nfs/dbraw/zinc/21/29/94/258212994.db2.gz MFTSQKKIYPGJOT-KRWDZBQOSA-N 1 1 374.485 2.802 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000332081536 258213100 /nfs/dbraw/zinc/21/31/00/258213100.db2.gz MFTSQKKIYPGJOT-QGZVFWFLSA-N 1 1 374.485 2.802 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402838 258228962 /nfs/dbraw/zinc/22/89/62/258228962.db2.gz VBBGYJYVYLCBIO-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402838 258228963 /nfs/dbraw/zinc/22/89/63/258228963.db2.gz VBBGYJYVYLCBIO-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453418 258231007 /nfs/dbraw/zinc/23/10/07/258231007.db2.gz GMAHWCWWGKZQNN-CYBMUJFWSA-N 1 1 363.462 2.743 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453418 258231008 /nfs/dbraw/zinc/23/10/08/258231008.db2.gz GMAHWCWWGKZQNN-CYBMUJFWSA-N 1 1 363.462 2.743 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453418 258231009 /nfs/dbraw/zinc/23/10/09/258231009.db2.gz GMAHWCWWGKZQNN-CYBMUJFWSA-N 1 1 363.462 2.743 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NCCC[N@H+]1CCc2ccccc2C1 ZINC000032401641 506247809 /nfs/dbraw/zinc/24/78/09/506247809.db2.gz ZLPVAWALOWCBGF-UHFFFAOYSA-N 1 1 369.421 2.538 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCc2ccccc2C1 ZINC000032447133 506255459 /nfs/dbraw/zinc/25/54/59/506255459.db2.gz XWYHYVSADLQNFU-INIZCTEOSA-N 1 1 356.426 2.500 20 5 FFBDMO Cc1nc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)nc2ccccc12 ZINC000366743574 512168119 /nfs/dbraw/zinc/16/81/19/512168119.db2.gz GLVGEJARQCRXGU-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@H](C)O1 ZINC000041865250 506561580 /nfs/dbraw/zinc/56/15/80/506561580.db2.gz KEEMMTXRWUEQJR-STQMWFEESA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000007641040 506576432 /nfs/dbraw/zinc/57/64/32/506576432.db2.gz XVGQJYZTIPQFCR-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000007641040 506576436 /nfs/dbraw/zinc/57/64/36/506576436.db2.gz XVGQJYZTIPQFCR-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000043149450 506709352 /nfs/dbraw/zinc/70/93/52/506709352.db2.gz JYJYWULMHILGKB-MRXNPFEDSA-N 1 1 364.446 2.772 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2c[nH+]c3n2CCCC3)c1 ZINC000375382036 512294688 /nfs/dbraw/zinc/29/46/88/512294688.db2.gz UPCDXIUYBIYSOF-UHFFFAOYSA-N 1 1 358.398 2.521 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000043342984 506735232 /nfs/dbraw/zinc/73/52/32/506735232.db2.gz MWDVDGIAWXVIPT-CYBMUJFWSA-N 1 1 370.837 2.727 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000010448456 506742357 /nfs/dbraw/zinc/74/23/57/506742357.db2.gz RWUXILJSOSKYIR-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO O=C(NCC[NH+]1CCN(c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000043801880 506782248 /nfs/dbraw/zinc/78/22/48/506782248.db2.gz ANHHHGPXMLQQPN-UHFFFAOYSA-N 1 1 369.425 2.539 20 5 FFBDMO CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000367020000 512299455 /nfs/dbraw/zinc/29/94/55/512299455.db2.gz KURRFUNJGPHZHA-UKRRQHHQSA-N 1 1 357.414 2.616 20 5 FFBDMO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1OC ZINC000067386435 506856468 /nfs/dbraw/zinc/85/64/68/506856468.db2.gz IFTOMOVWZHZXCD-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1ccccc1OC ZINC000067386435 506856469 /nfs/dbraw/zinc/85/64/69/506856469.db2.gz IFTOMOVWZHZXCD-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000067536292 506914703 /nfs/dbraw/zinc/91/47/03/506914703.db2.gz WXNBGAVNUZAVFT-QGZVFWFLSA-N 1 1 354.410 2.669 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000067536693 506915527 /nfs/dbraw/zinc/91/55/27/506915527.db2.gz YLJBAUDKOMIPOS-UHFFFAOYSA-N 1 1 368.437 2.665 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000067711093 506985237 /nfs/dbraw/zinc/98/52/37/506985237.db2.gz OOZOEMDUAGYCSL-UHFFFAOYSA-N 1 1 369.487 2.699 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000068085106 507104659 /nfs/dbraw/zinc/10/46/59/507104659.db2.gz IJYJWKHHQABEEK-CYBMUJFWSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@@H]1CCC[N@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085106 507104663 /nfs/dbraw/zinc/10/46/63/507104663.db2.gz IJYJWKHHQABEEK-CYBMUJFWSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085106 507104670 /nfs/dbraw/zinc/10/46/70/507104670.db2.gz IJYJWKHHQABEEK-CYBMUJFWSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941832 507154329 /nfs/dbraw/zinc/15/43/29/507154329.db2.gz DWZDJFNSCIDVCD-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000018941832 507154334 /nfs/dbraw/zinc/15/43/34/507154334.db2.gz DWZDJFNSCIDVCD-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269019 512321719 /nfs/dbraw/zinc/32/17/19/512321719.db2.gz VCSFWQYZYXFMKC-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO C[NH+]1CCC(N2CC[C@@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269019 512321722 /nfs/dbraw/zinc/32/17/22/512321722.db2.gz VCSFWQYZYXFMKC-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[NH+](Cc2cccs2)CC1 ZINC000019540099 507176594 /nfs/dbraw/zinc/17/65/94/507176594.db2.gz QCTGGDYQOQTLIW-UHFFFAOYSA-N 1 1 374.466 2.721 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2cccs2)CC1 ZINC000019540061 507177160 /nfs/dbraw/zinc/17/71/60/507177160.db2.gz ULHAJDLYQYLBAF-CQSZACIVSA-N 1 1 374.466 2.801 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N[C@@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])CC1 ZINC000057553080 507287224 /nfs/dbraw/zinc/28/72/24/507287224.db2.gz BWLVYBSLJGBGNL-MRXNPFEDSA-N 1 1 372.469 2.798 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000371328812 512333215 /nfs/dbraw/zinc/33/32/15/512333215.db2.gz ZGRFKVMFUPHXBK-HOTGVXAUSA-N 1 1 356.426 2.854 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000047623464 507366590 /nfs/dbraw/zinc/36/65/90/507366590.db2.gz MLADTFHERIHXJF-KRWDZBQOSA-N 1 1 369.421 2.754 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000047624130 507366624 /nfs/dbraw/zinc/36/66/24/507366624.db2.gz YEPXQZXYYCUYDZ-GOSISDBHSA-N 1 1 369.421 2.879 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000047624130 507366633 /nfs/dbraw/zinc/36/66/33/507366633.db2.gz YEPXQZXYYCUYDZ-GOSISDBHSA-N 1 1 369.421 2.879 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000069090993 507406144 /nfs/dbraw/zinc/40/61/44/507406144.db2.gz GQHDOWGSCLNUHX-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])cc1OC(F)F ZINC000069249905 507445732 /nfs/dbraw/zinc/44/57/32/507445732.db2.gz KKIDNUQIKMNXSR-LBPRGKRZSA-N 1 1 360.357 2.942 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])cc1OC(F)F ZINC000069249905 507445738 /nfs/dbraw/zinc/44/57/38/507445738.db2.gz KKIDNUQIKMNXSR-LBPRGKRZSA-N 1 1 360.357 2.942 20 5 FFBDMO CCOc1ccc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000026711958 507603404 /nfs/dbraw/zinc/60/34/04/507603404.db2.gz PDIYWEINBCXESH-KRWDZBQOSA-N 1 1 360.410 2.865 20 5 FFBDMO O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CC[NH+](CC2CC2)CC1 ZINC000050587647 507694276 /nfs/dbraw/zinc/69/42/76/507694276.db2.gz FWAQIAKUKZVHOR-UHFFFAOYSA-N 1 1 372.450 2.886 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051380775 507766667 /nfs/dbraw/zinc/76/66/67/507766667.db2.gz WRRJTWMYYLAZNR-GFCCVEGCSA-N 1 1 358.423 2.685 20 5 FFBDMO Cc1c(C[N@H+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cccc1[N+](=O)[O-] ZINC000051563274 507775418 /nfs/dbraw/zinc/77/54/18/507775418.db2.gz BSAOYBYRPOSDFZ-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000072836542 507860416 /nfs/dbraw/zinc/86/04/16/507860416.db2.gz BDOFWNAUHROGGK-INIZCTEOSA-N 1 1 365.455 2.966 20 5 FFBDMO CN(CC[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000107683271 507862718 /nfs/dbraw/zinc/86/27/18/507862718.db2.gz VAPZPLMDCZSRLS-UHFFFAOYSA-N 1 1 356.426 2.992 20 5 FFBDMO CC(C)OCC[NH+]1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089907572 507882057 /nfs/dbraw/zinc/88/20/57/507882057.db2.gz BJPMIKMHLDCPII-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](C[C@@H]1CCCO1)[C@@H]1CCSC1 ZINC000089952931 507890378 /nfs/dbraw/zinc/89/03/78/507890378.db2.gz XNJRZFVBNBUUJQ-CABCVRRESA-N 1 1 352.456 2.960 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNc3c([N+](=O)[O-])c(C)nn3C)CC2)oc1C ZINC000078620438 507890393 /nfs/dbraw/zinc/89/03/93/507890393.db2.gz NPKKLLZZULYPSC-UHFFFAOYSA-N 1 1 362.434 2.566 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000090002035 507898897 /nfs/dbraw/zinc/89/88/97/507898897.db2.gz ISGMLUYABZYGNS-ZBFHGGJFSA-N 1 1 360.801 2.818 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@@H]1c1ccc(Cl)cc1 ZINC000090002035 507898900 /nfs/dbraw/zinc/89/89/00/507898900.db2.gz ISGMLUYABZYGNS-ZBFHGGJFSA-N 1 1 360.801 2.818 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000078828811 507912152 /nfs/dbraw/zinc/91/21/52/507912152.db2.gz FLOISUOEZKIKOB-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000078828811 507912153 /nfs/dbraw/zinc/91/21/53/507912153.db2.gz FLOISUOEZKIKOB-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCN(CC(F)F)CC1 ZINC000091083003 507951692 /nfs/dbraw/zinc/95/16/92/507951692.db2.gz JZXJCQVPZOYNOK-UHFFFAOYSA-N 1 1 370.400 2.505 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000091457725 507987515 /nfs/dbraw/zinc/98/75/15/507987515.db2.gz DWAHGOGHLGBZFN-HNNXBMFYSA-N 1 1 360.458 2.975 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000079945111 508017808 /nfs/dbraw/zinc/01/78/08/508017808.db2.gz NHQZZPYMXFUOGZ-GOEBONIOSA-N 1 1 368.437 2.960 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000091856883 508019696 /nfs/dbraw/zinc/01/96/96/508019696.db2.gz DWEBMEDYAGHEMA-GXTWGEPZSA-N 1 1 360.382 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c1 ZINC000091856883 508019697 /nfs/dbraw/zinc/01/96/97/508019697.db2.gz DWEBMEDYAGHEMA-GXTWGEPZSA-N 1 1 360.382 2.903 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000092456115 508072288 /nfs/dbraw/zinc/07/22/88/508072288.db2.gz AXSDPRIGJFCDJE-OAHLLOKOSA-N 1 1 372.425 2.770 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000111631059 508111852 /nfs/dbraw/zinc/11/18/52/508111852.db2.gz GETSJTWTWNZUPK-CYBMUJFWSA-N 1 1 359.430 2.521 20 5 FFBDMO C[C@@H](CCO)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000093303083 508137056 /nfs/dbraw/zinc/13/70/56/508137056.db2.gz XTZBHVIPWZCHNU-INIZCTEOSA-N 1 1 371.437 2.831 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000075861424 508138429 /nfs/dbraw/zinc/13/84/29/508138429.db2.gz KKDFASREYRCHCG-OAHLLOKOSA-N 1 1 359.430 2.951 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H](CC(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000093808898 508156385 /nfs/dbraw/zinc/15/63/85/508156385.db2.gz LYRLVYLUGISEHK-CYBMUJFWSA-N 1 1 373.409 2.951 20 5 FFBDMO CCc1nsc(N2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000076184898 508167354 /nfs/dbraw/zinc/16/73/54/508167354.db2.gz YERGJUUJNVPXIA-UHFFFAOYSA-N 1 1 361.471 2.764 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000112699498 508210627 /nfs/dbraw/zinc/21/06/27/508210627.db2.gz UXIFJKQREWSCOO-OAHLLOKOSA-N 1 1 363.458 2.848 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](CCO)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000112698553 508210715 /nfs/dbraw/zinc/21/07/15/508210715.db2.gz TVQGADUUUNZBCO-UHFFFAOYSA-N 1 1 371.437 2.769 20 5 FFBDMO CC(C)c1[nH+]ccn1CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000114160128 508296826 /nfs/dbraw/zinc/29/68/26/508296826.db2.gz KMBCSGVMADWQQE-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)c1ccco1 ZINC000088479059 508372020 /nfs/dbraw/zinc/37/20/20/508372020.db2.gz OOOLLSIZQDJAJI-INIZCTEOSA-N 1 1 358.398 2.558 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)cc1SC ZINC000115438373 508394299 /nfs/dbraw/zinc/39/42/99/508394299.db2.gz OTAVYXZRLGDDGR-LBPRGKRZSA-N 1 1 367.471 2.739 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000121795973 508420256 /nfs/dbraw/zinc/42/02/56/508420256.db2.gz ACTXZNVKGCZQNR-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156462736 508424035 /nfs/dbraw/zinc/42/40/35/508424035.db2.gz HWBXALBKSWUOEL-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156462736 508424038 /nfs/dbraw/zinc/42/40/38/508424038.db2.gz HWBXALBKSWUOEL-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157317794 508551870 /nfs/dbraw/zinc/55/18/70/508551870.db2.gz LOAVKESDIAXOQD-CZUORRHYSA-N 1 1 351.834 2.733 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000116756597 508555086 /nfs/dbraw/zinc/55/50/86/508555086.db2.gz RDSGSWQWOVSSBX-CQSZACIVSA-N 1 1 367.833 2.618 20 5 FFBDMO Cc1c(CC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000128162765 508556431 /nfs/dbraw/zinc/55/64/31/508556431.db2.gz ZFMLQTAUBCUIMR-UHFFFAOYSA-N 1 1 359.401 2.833 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(C2CCOCC2)CC1 ZINC000153587113 508603396 /nfs/dbraw/zinc/60/33/96/508603396.db2.gz XNFYPLRYGQYBHI-UHFFFAOYSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000122946865 508612074 /nfs/dbraw/zinc/61/20/74/508612074.db2.gz SAQNOUSMISBFCF-OCCSQVGLSA-N 1 1 369.849 2.958 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000123046130 508627477 /nfs/dbraw/zinc/62/74/77/508627477.db2.gz GUHDFIKBSYWFMJ-CYBMUJFWSA-N 1 1 350.419 2.942 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H]2CCCc3c2cnn3C)c([N+](=O)[O-])c1 ZINC000135594002 508629382 /nfs/dbraw/zinc/62/93/82/508629382.db2.gz YYWACIFTAPMQDG-HNNXBMFYSA-N 1 1 360.414 2.725 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153774751 508645567 /nfs/dbraw/zinc/64/55/67/508645567.db2.gz TWUUVTZSDWJKBG-ZVZYQTTQSA-N 1 1 363.458 2.645 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CCc1nccs1 ZINC000158042852 508649211 /nfs/dbraw/zinc/64/92/11/508649211.db2.gz WHRHSWHNXGEBNO-LLVKDONJSA-N 1 1 364.427 2.561 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCc1nccs1 ZINC000158042852 508649214 /nfs/dbraw/zinc/64/92/14/508649214.db2.gz WHRHSWHNXGEBNO-LLVKDONJSA-N 1 1 364.427 2.561 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@@H](C)[C@@H]1C ZINC000118415712 508650514 /nfs/dbraw/zinc/65/05/14/508650514.db2.gz DAXZMQJOJIKWGS-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000367254823 512409885 /nfs/dbraw/zinc/40/98/85/512409885.db2.gz XLSABRCCSSJADZ-GOOCMWNKSA-N 1 1 369.425 2.677 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000367254823 512409887 /nfs/dbraw/zinc/40/98/87/512409887.db2.gz XLSABRCCSSJADZ-GOOCMWNKSA-N 1 1 369.425 2.677 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc2C1 ZINC000129314706 508712025 /nfs/dbraw/zinc/71/20/25/508712025.db2.gz ALDXDDYZEKLKKR-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc2C1 ZINC000129314706 508712030 /nfs/dbraw/zinc/71/20/30/508712030.db2.gz ALDXDDYZEKLKKR-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000119058029 508716740 /nfs/dbraw/zinc/71/67/40/508716740.db2.gz WTCRCVMXJQKHFU-ZDUSSCGKSA-N 1 1 359.430 2.754 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](Cn2ccnn2)C1 ZINC000119092649 508724390 /nfs/dbraw/zinc/72/43/90/508724390.db2.gz SNDIJVJYBPQAKX-OAHLLOKOSA-N 1 1 359.430 2.886 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000137476547 508757158 /nfs/dbraw/zinc/75/71/58/508757158.db2.gz WLSZNRQAIHCRDW-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000119418891 508792029 /nfs/dbraw/zinc/79/20/29/508792029.db2.gz SDPBKEZVVXTMJZ-MRXNPFEDSA-N 1 1 362.474 2.881 20 5 FFBDMO CC[N@H+](CCc1nccs1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000159411064 508838704 /nfs/dbraw/zinc/83/87/04/508838704.db2.gz CXMFRVHSQWVTOW-UHFFFAOYSA-N 1 1 360.439 2.505 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000159411064 508838706 /nfs/dbraw/zinc/83/87/06/508838706.db2.gz CXMFRVHSQWVTOW-UHFFFAOYSA-N 1 1 360.439 2.505 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOC3(C2)CCCCCC3)c1 ZINC000119715673 508848959 /nfs/dbraw/zinc/84/89/59/508848959.db2.gz CKKHEGYAKDODAJ-KRWDZBQOSA-N 1 1 364.442 2.760 20 5 FFBDMO O=C1C[C@@H]([N@@H+]2CC[C@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000119720767 508850571 /nfs/dbraw/zinc/85/05/71/508850571.db2.gz WEZVYEOCVWHMDJ-MAUKXSAKSA-N 1 1 365.389 2.716 20 5 FFBDMO O=C1C[C@@H]([N@H+]2CC[C@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000119720767 508850575 /nfs/dbraw/zinc/85/05/75/508850575.db2.gz WEZVYEOCVWHMDJ-MAUKXSAKSA-N 1 1 365.389 2.716 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1C)[NH+](C)C ZINC000159548031 508857502 /nfs/dbraw/zinc/85/75/02/508857502.db2.gz VNVVATKEUACWEL-SFHVURJKSA-N 1 1 371.437 2.873 20 5 FFBDMO C[C@H](C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@@H+]1CCc2ccccc2C1 ZINC000119773825 508860196 /nfs/dbraw/zinc/86/01/96/508860196.db2.gz IPJWVOUXXWLFQA-OAHLLOKOSA-N 1 1 365.433 2.926 20 5 FFBDMO C[C@H](C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCc2ccccc2C1 ZINC000119773825 508860199 /nfs/dbraw/zinc/86/01/99/508860199.db2.gz IPJWVOUXXWLFQA-OAHLLOKOSA-N 1 1 365.433 2.926 20 5 FFBDMO Cc1ccc([C@@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)[NH+](C)C)cc1 ZINC000130921539 508864960 /nfs/dbraw/zinc/86/49/60/508864960.db2.gz VRVYZOCYDIQTNL-CYBMUJFWSA-N 1 1 369.468 2.546 20 5 FFBDMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)c1ccco1 ZINC000130923473 508866148 /nfs/dbraw/zinc/86/61/48/508866148.db2.gz XPEDCJGGGKKFOL-LLVKDONJSA-N 1 1 373.456 2.611 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000155008341 508902922 /nfs/dbraw/zinc/90/29/22/508902922.db2.gz SVOOBCOQHPZHEH-QGZVFWFLSA-N 1 1 354.410 2.770 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000120090093 508925684 /nfs/dbraw/zinc/92/56/84/508925684.db2.gz LOJMHLQHYSOPHM-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO CCN1CCC([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125198411 508945894 /nfs/dbraw/zinc/94/58/94/508945894.db2.gz LNMJTRRBPWLQGG-UHFFFAOYSA-N 1 1 357.458 2.911 20 5 FFBDMO CC[NH+]1CCC(N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125198411 508945897 /nfs/dbraw/zinc/94/58/97/508945897.db2.gz LNMJTRRBPWLQGG-UHFFFAOYSA-N 1 1 357.458 2.911 20 5 FFBDMO C[C@@H]1C[C@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102424 508956558 /nfs/dbraw/zinc/95/65/58/508956558.db2.gz XPMHSOLAZYVRFZ-CJNGLKHVSA-N 1 1 355.442 2.710 20 5 FFBDMO C[C@@H]1C[C@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102424 508956562 /nfs/dbraw/zinc/95/65/62/508956562.db2.gz XPMHSOLAZYVRFZ-CJNGLKHVSA-N 1 1 355.442 2.710 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000160237022 508958429 /nfs/dbraw/zinc/95/84/29/508958429.db2.gz BOIIIVQNUUNRFL-HIFRSBDPSA-N 1 1 352.398 2.570 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000120554742 509019725 /nfs/dbraw/zinc/01/97/25/509019725.db2.gz ZHGBDTOATHXULD-OCCSQVGLSA-N 1 1 369.849 2.816 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000125738498 509024099 /nfs/dbraw/zinc/02/40/99/509024099.db2.gz IITARBGUGPMJJC-CZUORRHYSA-N 1 1 354.410 2.699 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000155936385 509095706 /nfs/dbraw/zinc/09/57/06/509095706.db2.gz AVRCFLZANMJSLU-OAHLLOKOSA-N 1 1 364.446 2.868 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000133474065 509164241 /nfs/dbraw/zinc/16/42/41/509164241.db2.gz SWFDEOHHGNKLBU-HNNXBMFYSA-N 1 1 359.382 2.763 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C[C@H](C)O1 ZINC000263846286 509183333 /nfs/dbraw/zinc/18/33/33/509183333.db2.gz XGBCLXDOXJSWSZ-BETUJISGSA-N 1 1 367.471 2.618 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000247920484 509191604 /nfs/dbraw/zinc/19/16/04/509191604.db2.gz BDTHXDIYRLQRGG-DLBZAZTESA-N 1 1 372.469 2.751 20 5 FFBDMO CNC(=O)c1ccc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)c([N+](=O)[O-])c1 ZINC000185484234 509198655 /nfs/dbraw/zinc/19/86/55/509198655.db2.gz UFSNTZIXZYMVTG-ZDUSSCGKSA-N 1 1 374.466 2.899 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000247967440 509204247 /nfs/dbraw/zinc/20/42/47/509204247.db2.gz DXKWFRWNTVWYGX-ZBFHGGJFSA-N 1 1 356.426 2.704 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175994494 509261626 /nfs/dbraw/zinc/26/16/26/509261626.db2.gz LBVKDMSGWVXHRY-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000175994494 509261633 /nfs/dbraw/zinc/26/16/33/509261633.db2.gz LBVKDMSGWVXHRY-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)(C)OC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000162617267 509265611 /nfs/dbraw/zinc/26/56/11/509265611.db2.gz KLFYTJWKVADERG-QGZVFWFLSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000191992777 509281545 /nfs/dbraw/zinc/28/15/45/509281545.db2.gz URHOUCZHHLDDBR-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C3CCOCC3)CC2)c(Br)c1 ZINC000267027686 509313818 /nfs/dbraw/zinc/31/38/18/509313818.db2.gz KEMYQQOJLMNXFD-UHFFFAOYSA-N 1 1 370.247 2.658 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CN1CCOCC1)c1ccccc1 ZINC000172977120 509331911 /nfs/dbraw/zinc/33/19/11/509331911.db2.gz DRCHAAZPAIZBQN-IBGZPJMESA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000248478460 509338963 /nfs/dbraw/zinc/33/89/63/509338963.db2.gz ZGQWUVITVCSOHD-DLBZAZTESA-N 1 1 364.442 2.758 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000176202014 509376008 /nfs/dbraw/zinc/37/60/08/509376008.db2.gz SYSSDNMQDLNEDC-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC000176202014 509376014 /nfs/dbraw/zinc/37/60/14/509376014.db2.gz SYSSDNMQDLNEDC-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)n1 ZINC000176202014 509376023 /nfs/dbraw/zinc/37/60/23/509376023.db2.gz SYSSDNMQDLNEDC-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1SC ZINC000264221708 509393047 /nfs/dbraw/zinc/39/30/47/509393047.db2.gz WBQCHZBPDASGRZ-STQMWFEESA-N 1 1 365.455 2.682 20 5 FFBDMO COc1cc(C[NH2+]C[C@H](C)N(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000264234170 509398830 /nfs/dbraw/zinc/39/88/30/509398830.db2.gz CSSPOWSALGOKOQ-JTQLQIEISA-N 1 1 365.352 2.584 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000248716305 509449240 /nfs/dbraw/zinc/44/92/40/509449240.db2.gz BWGZVRNRUNFATM-RHSMWYFYSA-N 1 1 369.421 2.854 20 5 FFBDMO COC(=O)c1cnc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000189300307 509508483 /nfs/dbraw/zinc/50/84/83/509508483.db2.gz AFXSSMUGPFQFLL-MRXNPFEDSA-N 1 1 370.409 2.853 20 5 FFBDMO C[C@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173326264 509534263 /nfs/dbraw/zinc/53/42/63/509534263.db2.gz UTDCLJFZDLJGFK-HNNXBMFYSA-N 1 1 355.442 2.592 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCN(C)CC1 ZINC000192648084 509581913 /nfs/dbraw/zinc/58/19/13/509581913.db2.gz HNBCFBYCLBTZPZ-WOJBJXKFSA-N 1 1 360.502 2.834 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(Cn4cncn4)CC3)co2)cc1 ZINC000186215059 509583255 /nfs/dbraw/zinc/58/32/55/509583255.db2.gz XGLMFFNDJCDXQX-UHFFFAOYSA-N 1 1 368.397 2.754 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000249096875 509603777 /nfs/dbraw/zinc/60/37/77/509603777.db2.gz UDDICBNIMIRRQW-NWDGAFQWSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000249096875 509603782 /nfs/dbraw/zinc/60/37/82/509603782.db2.gz UDDICBNIMIRRQW-NWDGAFQWSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179868566 509654057 /nfs/dbraw/zinc/65/40/57/509654057.db2.gz CAFPSTSZBPOKLX-GFCCVEGCSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179868566 509654060 /nfs/dbraw/zinc/65/40/60/509654060.db2.gz CAFPSTSZBPOKLX-GFCCVEGCSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179917793 509672317 /nfs/dbraw/zinc/67/23/17/509672317.db2.gz CRDQBHBLLWWQQG-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCCO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179917793 509672324 /nfs/dbraw/zinc/67/23/24/509672324.db2.gz CRDQBHBLLWWQQG-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1ccc(F)cc1[C@H](C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000179938431 509680993 /nfs/dbraw/zinc/68/09/93/509680993.db2.gz FLGOMTJAYBLUDL-LBPRGKRZSA-N 1 1 373.384 2.982 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173644456 509695259 /nfs/dbraw/zinc/69/52/59/509695259.db2.gz LJYQVSNGGFBZQA-SFHVURJKSA-N 1 1 361.442 2.839 20 5 FFBDMO Cn1cc(CNC[C@@H]2CC[N@@H+](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237766493 509729919 /nfs/dbraw/zinc/72/99/19/509729919.db2.gz NTUHYOSHKHKRAK-AWEZNQCLSA-N 1 1 355.442 2.569 20 5 FFBDMO Cn1cc(CNC[C@@H]2CC[N@H+](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237766493 509729926 /nfs/dbraw/zinc/72/99/26/509729926.db2.gz NTUHYOSHKHKRAK-AWEZNQCLSA-N 1 1 355.442 2.569 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ncc([N+](=O)[O-])s2)[C@@H](c2ccccc2)C1 ZINC000249653550 509732315 /nfs/dbraw/zinc/73/23/15/509732315.db2.gz YWVOFRLKBNWQEJ-OAHLLOKOSA-N 1 1 361.471 2.842 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](c1ccccc1)[NH+](C)C ZINC000186493527 509738553 /nfs/dbraw/zinc/73/85/53/509738553.db2.gz HNTLQSQNYFOSAQ-XIKOKIGWSA-N 1 1 367.409 2.892 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000268120192 509767961 /nfs/dbraw/zinc/76/79/61/509767961.db2.gz KREZYWINYIDATD-LSDHHAIUSA-N 1 1 352.822 2.674 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000268196493 509807996 /nfs/dbraw/zinc/80/79/96/509807996.db2.gz FTPYIXFUWLUBIG-AWEZNQCLSA-N 1 1 362.430 2.941 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[N@H+]1C1CC1 ZINC000177179019 509920815 /nfs/dbraw/zinc/92/08/15/509920815.db2.gz PAJMQTLKAIDHIC-KGLIPLIRSA-N 1 1 358.442 2.550 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180507570 509959989 /nfs/dbraw/zinc/95/99/89/509959989.db2.gz PWIRLQJYIZOMSU-CYBMUJFWSA-N 1 1 363.414 2.708 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])c1 ZINC000245526786 509983675 /nfs/dbraw/zinc/98/36/75/509983675.db2.gz FLCKJRJFCIFRML-RHSMWYFYSA-N 1 1 360.414 2.762 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)cc1C ZINC000261598856 509993621 /nfs/dbraw/zinc/99/36/21/509993621.db2.gz APMZWDZNOXOKFR-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[C@@H]1CCCN(C(=O)C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000174241691 510020843 /nfs/dbraw/zinc/02/08/43/510020843.db2.gz NRLMFPPQROBWQC-OAHLLOKOSA-N 1 1 361.442 2.697 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@@H](C)C1 ZINC000245615710 510041123 /nfs/dbraw/zinc/04/11/23/510041123.db2.gz CVIPXINHGGMJOJ-SCLBCKFNSA-N 1 1 358.442 2.807 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000245670175 510072860 /nfs/dbraw/zinc/07/28/60/510072860.db2.gz RYKUPPNLPHJJEU-RBUKOAKNSA-N 1 1 368.437 2.882 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(NCC[N@H+]3CCc4ccccc4C3)cc2N1 ZINC000193827502 510088289 /nfs/dbraw/zinc/08/82/89/510088289.db2.gz XYIOQIZQRSAVTM-UHFFFAOYSA-N 1 1 366.421 2.950 20 5 FFBDMO C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@@H](C)C1 ZINC000245696784 510092705 /nfs/dbraw/zinc/09/27/05/510092705.db2.gz YIGWJUILVHYUKZ-ZIAGYGMSSA-N 1 1 358.442 2.855 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261863045 510093957 /nfs/dbraw/zinc/09/39/57/510093957.db2.gz WQUDMJXRZMISPB-CXAGYDPISA-N 1 1 372.450 2.644 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000261952570 510127583 /nfs/dbraw/zinc/12/75/83/510127583.db2.gz LQZQMNMAQKCLGN-CQSZACIVSA-N 1 1 361.423 2.760 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194013448 510174743 /nfs/dbraw/zinc/17/47/43/510174743.db2.gz UURJSBMBEHTZGR-GFCCVEGCSA-N 1 1 351.359 2.667 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194013448 510174747 /nfs/dbraw/zinc/17/47/47/510174747.db2.gz UURJSBMBEHTZGR-GFCCVEGCSA-N 1 1 351.359 2.667 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000265743191 510206837 /nfs/dbraw/zinc/20/68/37/510206837.db2.gz CKIILQZMUJRTPK-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1 ZINC000174705557 510262866 /nfs/dbraw/zinc/26/28/66/510262866.db2.gz VNNONRMTHGRSFG-HNAYVOBHSA-N 1 1 369.421 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1 ZINC000174705557 510262871 /nfs/dbraw/zinc/26/28/71/510262871.db2.gz VNNONRMTHGRSFG-HNAYVOBHSA-N 1 1 369.421 2.897 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@](O)(C(F)(F)F)C3)o2)c1 ZINC000174751489 510292470 /nfs/dbraw/zinc/29/24/70/510292470.db2.gz VOVXBASBBIUBLF-OAHLLOKOSA-N 1 1 371.315 2.791 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1CN1CCCC1 ZINC000171708303 510323075 /nfs/dbraw/zinc/32/30/75/510323075.db2.gz IUVGNSAWTBPEDZ-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000171708303 510323080 /nfs/dbraw/zinc/32/30/80/510323080.db2.gz IUVGNSAWTBPEDZ-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269293366 510327198 /nfs/dbraw/zinc/32/71/98/510327198.db2.gz QRAUKRRLKODKRW-INIZCTEOSA-N 1 1 369.421 2.595 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269293366 510327205 /nfs/dbraw/zinc/32/72/05/510327205.db2.gz QRAUKRRLKODKRW-INIZCTEOSA-N 1 1 369.421 2.595 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000266009070 510355107 /nfs/dbraw/zinc/35/51/07/510355107.db2.gz RZTUZWHSDQDPKR-NHYWBVRUSA-N 1 1 364.402 2.614 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000246255290 510392594 /nfs/dbraw/zinc/39/25/94/510392594.db2.gz UBHJHXDLEJKOET-CVEARBPZSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc2[nH+]c(Cn3cc(Br)c(=O)c([N+](=O)[O-])c3)cn2c1 ZINC000178090805 510428687 /nfs/dbraw/zinc/42/86/87/510428687.db2.gz HFCMFQCTCVXAKL-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000269500620 510438704 /nfs/dbraw/zinc/43/87/04/510438704.db2.gz YZNNMEUJDBGTSA-HNNXBMFYSA-N 1 1 371.441 2.836 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[N@@H+](CC(C)(C)O)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000190988661 510454112 /nfs/dbraw/zinc/45/41/12/510454112.db2.gz NDRFLMJSXHGZRL-AWEZNQCLSA-N 1 1 363.458 2.635 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[N@H+]1C1CC1 ZINC000184856891 510548887 /nfs/dbraw/zinc/54/88/87/510548887.db2.gz HUZIPDDPOCZUAB-ZJUUUORDSA-N 1 1 368.231 2.712 20 5 FFBDMO CCC[C@]1(COC)CCC[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000194934756 510598652 /nfs/dbraw/zinc/59/86/52/510598652.db2.gz RHBLDVSUCUMGOO-QGZVFWFLSA-N 1 1 370.471 2.650 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000194934756 510598660 /nfs/dbraw/zinc/59/86/60/510598660.db2.gz RHBLDVSUCUMGOO-QGZVFWFLSA-N 1 1 370.471 2.650 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+](CCc2ccccc2)Cc2cccnc2)c1 ZINC000191352377 510617908 /nfs/dbraw/zinc/61/79/08/510617908.db2.gz KBRJTANVMYIRCV-UHFFFAOYSA-N 1 1 351.410 2.931 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2cccc(Cl)c2)c1 ZINC000246773995 510665312 /nfs/dbraw/zinc/66/53/12/510665312.db2.gz RYFKKCFKKGWBLO-HZPDHXFCSA-N 1 1 350.806 2.643 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188297389 510696269 /nfs/dbraw/zinc/69/62/69/510696269.db2.gz JIRSTRYJKCQDMI-HXUWFJFHSA-N 1 1 355.438 2.664 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000182022844 510716106 /nfs/dbraw/zinc/71/61/06/510716106.db2.gz MEMCCIZYMURHED-JCGIZDLHSA-N 1 1 364.442 2.614 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000246891091 510730455 /nfs/dbraw/zinc/73/04/55/510730455.db2.gz UMNYCBWUIJQIEU-SUMWQHHRSA-N 1 1 367.421 2.601 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246927385 510749386 /nfs/dbraw/zinc/74/93/86/510749386.db2.gz WWUHAFMOMORZDA-JSGCOSHPSA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172583223 510804371 /nfs/dbraw/zinc/80/43/71/510804371.db2.gz VHVYWEWOXDQFJG-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000247190402 510850308 /nfs/dbraw/zinc/85/03/08/510850308.db2.gz BQNUUJUJPRPIIS-LZQZEXGQSA-N 1 1 358.442 2.934 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247544712 510864951 /nfs/dbraw/zinc/86/49/51/510864951.db2.gz YHKBHFBNURRJNA-GUYCJALGSA-N 1 1 360.458 2.971 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](N2CCCC2)C[C@@H]1C ZINC000285415677 510897370 /nfs/dbraw/zinc/89/73/70/510897370.db2.gz DIMAHPCRGTWKSC-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](N2CCCC2)C[C@@H]1C ZINC000285415677 510897377 /nfs/dbraw/zinc/89/73/77/510897377.db2.gz DIMAHPCRGTWKSC-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO CN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285523426 510940681 /nfs/dbraw/zinc/94/06/81/510940681.db2.gz OOHOGHOILUPKSA-PBWFPOADSA-N 1 1 366.849 2.744 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](C2CCOCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364607290 510967342 /nfs/dbraw/zinc/96/73/42/510967342.db2.gz MOYPNZCCZQULQW-AWEZNQCLSA-N 1 1 365.405 2.811 20 5 FFBDMO Cc1cc(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)cc([N+](=O)[O-])c1 ZINC000270877692 511013158 /nfs/dbraw/zinc/01/31/58/511013158.db2.gz JUWLCRMAEGTCGE-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000361256719 511021270 /nfs/dbraw/zinc/02/12/70/511021270.db2.gz DKIKGIVMIJISKG-INIZCTEOSA-N 1 1 354.410 2.584 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000294596800 511114572 /nfs/dbraw/zinc/11/45/72/511114572.db2.gz USMIWNPTJFFRPA-VXGBXAGGSA-N 1 1 353.394 2.593 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000294662526 511135396 /nfs/dbraw/zinc/13/53/96/511135396.db2.gz IIHNBOLXFBKVSS-HNNXBMFYSA-N 1 1 361.442 2.794 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCc1cnccn1 ZINC000271283431 511149800 /nfs/dbraw/zinc/14/98/00/511149800.db2.gz APJJNFZLQCKWAK-LBPRGKRZSA-N 1 1 354.370 2.670 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1cnccn1 ZINC000271283431 511149805 /nfs/dbraw/zinc/14/98/05/511149805.db2.gz APJJNFZLQCKWAK-LBPRGKRZSA-N 1 1 354.370 2.670 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@@H](C)C1 ZINC000294946460 511229969 /nfs/dbraw/zinc/22/99/69/511229969.db2.gz LUVFCFLGNLFLRY-UGSOOPFHSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000294946460 511229971 /nfs/dbraw/zinc/22/99/71/511229971.db2.gz LUVFCFLGNLFLRY-UGSOOPFHSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@@H](C)C1 ZINC000294946460 511229973 /nfs/dbraw/zinc/22/99/73/511229973.db2.gz LUVFCFLGNLFLRY-UGSOOPFHSA-N 1 1 371.441 2.787 20 5 FFBDMO COc1cccc(CNC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271577754 511251072 /nfs/dbraw/zinc/25/10/72/511251072.db2.gz BGYSZSSVMZSJQA-KGLIPLIRSA-N 1 1 357.410 2.959 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271666993 511281263 /nfs/dbraw/zinc/28/12/63/511281263.db2.gz AAYSMLFWHDKBGH-AWEZNQCLSA-N 1 1 357.410 2.913 20 5 FFBDMO O=C(NCC[NH+]1CCSCC1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291729497 511312830 /nfs/dbraw/zinc/31/28/30/511312830.db2.gz BZRKQUHTXLJEOE-UHFFFAOYSA-N 1 1 364.254 2.680 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000295283124 511347751 /nfs/dbraw/zinc/34/77/51/511347751.db2.gz HXJQAJWEVLXRAU-LLVKDONJSA-N 1 1 369.824 2.873 20 5 FFBDMO Cc1cc(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)cc(N2CCCC2)[nH+]1 ZINC000291840156 511359319 /nfs/dbraw/zinc/35/93/19/511359319.db2.gz DWBWOSOYTMTRNG-UHFFFAOYSA-N 1 1 373.388 2.550 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000298659288 511364908 /nfs/dbraw/zinc/36/49/08/511364908.db2.gz XVMYYKLRYFXUIJ-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000298659288 511364914 /nfs/dbraw/zinc/36/49/14/511364914.db2.gz XVMYYKLRYFXUIJ-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295341742 511369776 /nfs/dbraw/zinc/36/97/76/511369776.db2.gz MRLIHZZRMPZKFI-HNNXBMFYSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295387615 511387310 /nfs/dbraw/zinc/38/73/10/511387310.db2.gz RECPLVVOMDHWME-FZKQIMNGSA-N 1 1 369.425 2.684 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000272031217 511406242 /nfs/dbraw/zinc/40/62/42/511406242.db2.gz MYFJXJLFLBWIRR-UHFFFAOYSA-N 1 1 369.219 2.741 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)n1 ZINC000272243971 511477621 /nfs/dbraw/zinc/47/76/21/511477621.db2.gz NZEIRLMSQXOOJH-HNNXBMFYSA-N 1 1 373.461 2.837 20 5 FFBDMO C[C@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000292180745 511495341 /nfs/dbraw/zinc/49/53/41/511495341.db2.gz DXVYAXAAXPDTHA-OAHLLOKOSA-N 1 1 360.458 2.653 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000295735089 511499788 /nfs/dbraw/zinc/49/97/88/511499788.db2.gz WFNMIJLCQNODRD-JKSUJKDBSA-N 1 1 369.421 2.645 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000363416272 511537197 /nfs/dbraw/zinc/53/71/97/511537197.db2.gz BHAQXWSBQOZYKC-WMZOPIPTSA-N 1 1 360.458 2.844 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000295865563 511538981 /nfs/dbraw/zinc/53/89/81/511538981.db2.gz FHOOAVOYQZCSIZ-INIZCTEOSA-N 1 1 365.430 2.679 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnnn1Cc1ccccc1 ZINC000292702908 511692167 /nfs/dbraw/zinc/69/21/67/511692167.db2.gz COJWRSMRTSFCNV-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnnn1Cc1ccccc1 ZINC000292702908 511692170 /nfs/dbraw/zinc/69/21/70/511692170.db2.gz COJWRSMRTSFCNV-UHFFFAOYSA-N 1 1 351.410 2.909 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3cccs3)CC2)c1 ZINC000302092204 511705938 /nfs/dbraw/zinc/70/59/38/511705938.db2.gz MPLMBAQJXYQTDZ-UHFFFAOYSA-N 1 1 361.423 2.765 20 5 FFBDMO C[C@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+](C2CC2)C1 ZINC000296698134 511858695 /nfs/dbraw/zinc/85/86/95/511858695.db2.gz KRSLTRSWLIUJOI-ZDUSSCGKSA-N 1 1 357.414 2.561 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000326955684 511866239 /nfs/dbraw/zinc/86/62/39/511866239.db2.gz PCWBEQIEJAONSJ-AWEZNQCLSA-N 1 1 367.833 2.575 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000281682170 511929594 /nfs/dbraw/zinc/92/95/94/511929594.db2.gz USBQMQWRPAMMRB-CVEARBPZSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000275099845 512040920 /nfs/dbraw/zinc/04/09/20/512040920.db2.gz KOSKITCCOGWOBW-SNVBAGLBSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000275134020 512051866 /nfs/dbraw/zinc/05/18/66/512051866.db2.gz SNJLKVXKUVHBTG-SNVBAGLBSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293743977 512069676 /nfs/dbraw/zinc/06/96/76/512069676.db2.gz HYETYVSFICVFRR-JTQLQIEISA-N 1 1 357.332 2.828 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000373769018 512496108 /nfs/dbraw/zinc/49/61/08/512496108.db2.gz GHJZZRYPYUCVAY-INIZCTEOSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000373769018 512496111 /nfs/dbraw/zinc/49/61/11/512496111.db2.gz GHJZZRYPYUCVAY-INIZCTEOSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C(C)C)C1CCOCC1 ZINC000411397858 512616526 /nfs/dbraw/zinc/61/65/26/512616526.db2.gz ZZVDGPOCFIYRPZ-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1F ZINC000411414185 512624351 /nfs/dbraw/zinc/62/43/51/512624351.db2.gz HSHJKCAJGNISAY-QWHCGFSZSA-N 1 1 367.421 2.664 20 5 FFBDMO Cn1nccc1[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411671979 512749284 /nfs/dbraw/zinc/74/92/84/512749284.db2.gz MLCNHDQBYSOQKQ-QGZVFWFLSA-N 1 1 357.414 2.884 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c1 ZINC000378491495 512787653 /nfs/dbraw/zinc/78/76/53/512787653.db2.gz GXSVOIRQMMANJA-KBXCAEBGSA-N 1 1 362.405 2.561 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2CCc3[nH+]ccn3C2)n1 ZINC000376405554 512804527 /nfs/dbraw/zinc/80/45/27/512804527.db2.gz BELLNYLYLXDMQR-GFCCVEGCSA-N 1 1 354.370 2.559 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@](CO)(c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000368262187 512870756 /nfs/dbraw/zinc/87/07/56/512870756.db2.gz WLHONXZMTAIFCH-HXUWFJFHSA-N 1 1 369.421 2.559 20 5 FFBDMO CCc1nn(C)c(Cl)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000376654669 512922445 /nfs/dbraw/zinc/92/24/45/512922445.db2.gz YQMXUFANFRVKMB-UHFFFAOYSA-N 1 1 352.826 2.578 20 5 FFBDMO C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000396612274 512942075 /nfs/dbraw/zinc/94/20/75/512942075.db2.gz HRPUMWOOWGAKRX-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000396612274 512942076 /nfs/dbraw/zinc/94/20/76/512942076.db2.gz HRPUMWOOWGAKRX-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000397976620 512952309 /nfs/dbraw/zinc/95/23/09/512952309.db2.gz KWJZIHPNMNUTDR-XJKSGUPXSA-N 1 1 354.410 2.769 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000368446078 512952428 /nfs/dbraw/zinc/95/24/28/512952428.db2.gz SPJJJDWQQMRIQQ-QZTJIDSGSA-N 1 1 369.469 2.815 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000368446077 512952658 /nfs/dbraw/zinc/95/26/58/512952658.db2.gz SPJJJDWQQMRIQQ-MSOLQXFVSA-N 1 1 369.469 2.815 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000408168806 513013299 /nfs/dbraw/zinc/01/32/99/513013299.db2.gz LULOOVRDEWQXFV-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000408168806 513013300 /nfs/dbraw/zinc/01/33/00/513013300.db2.gz LULOOVRDEWQXFV-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000408217949 513024047 /nfs/dbraw/zinc/02/40/47/513024047.db2.gz GOKMZJJVMQWLQY-LZWOXQAQSA-N 1 1 367.471 2.621 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000372769179 513036603 /nfs/dbraw/zinc/03/66/03/513036603.db2.gz WJDQRRBRQQPOCD-CHWSQXEVSA-N 1 1 357.332 2.970 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H]3CCCC[C@]32c2ccccc2)c1 ZINC000370706824 513062860 /nfs/dbraw/zinc/06/28/60/513062860.db2.gz FVDFXYLXHBDWBE-UHOSZYNNSA-N 1 1 356.426 2.554 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](Cc2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000374935495 513081067 /nfs/dbraw/zinc/08/10/67/513081067.db2.gz YJZRECVXLWBPIY-INIZCTEOSA-N 1 1 354.410 2.517 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000433826646 513161158 /nfs/dbraw/zinc/16/11/58/513161158.db2.gz QPWLFUSHZOBAOI-OKILXGFUSA-N 1 1 365.478 2.929 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1nccc2cc([N+](=O)[O-])ccc21 ZINC000450402956 513178608 /nfs/dbraw/zinc/17/86/08/513178608.db2.gz LMOVLQXECKEFDJ-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000412703384 513235397 /nfs/dbraw/zinc/23/53/97/513235397.db2.gz XRXJRDMLBBYGJX-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000412703384 513235402 /nfs/dbraw/zinc/23/54/02/513235402.db2.gz XRXJRDMLBBYGJX-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1nc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)ncc1[N+](=O)[O-] ZINC000450537586 513240453 /nfs/dbraw/zinc/24/04/53/513240453.db2.gz DZGPVLMVAWHSSJ-IRXDYDNUSA-N 1 1 353.426 2.652 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H](C)C1 ZINC000429017074 513255700 /nfs/dbraw/zinc/25/57/00/513255700.db2.gz DSFCSUUIWBDWTF-QWQRMKEZSA-N 1 1 361.442 2.623 20 5 FFBDMO CC(C)C[C@@H](C[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000450589127 513263332 /nfs/dbraw/zinc/26/33/32/513263332.db2.gz CBQDEFXVGMCTJM-AWEZNQCLSA-N 1 1 369.487 2.921 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429040832 513263952 /nfs/dbraw/zinc/26/39/52/513263952.db2.gz NGGQSHMYLVKPGJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429040832 513263957 /nfs/dbraw/zinc/26/39/57/513263957.db2.gz NGGQSHMYLVKPGJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429040832 513263962 /nfs/dbraw/zinc/26/39/62/513263962.db2.gz NGGQSHMYLVKPGJ-SIXWZSSISA-N 1 1 374.485 2.894 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000429173317 513298260 /nfs/dbraw/zinc/29/82/60/513298260.db2.gz UZCUPGULESYQJL-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000429173317 513298267 /nfs/dbraw/zinc/29/82/67/513298267.db2.gz UZCUPGULESYQJL-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000434425226 513319615 /nfs/dbraw/zinc/31/96/15/513319615.db2.gz NTNITVJZABOXRF-SFHVURJKSA-N 1 1 369.425 2.527 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000421713850 513383272 /nfs/dbraw/zinc/38/32/72/513383272.db2.gz UCNZJYAMMOBRNA-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000421713851 513383604 /nfs/dbraw/zinc/38/36/04/513383604.db2.gz UCNZJYAMMOBRNA-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413085450 513434522 /nfs/dbraw/zinc/43/45/22/513434522.db2.gz WEPYSDADGGXABC-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)o2)c([N+](=O)[O-])c1 ZINC000425349404 513522105 /nfs/dbraw/zinc/52/21/05/513522105.db2.gz CZKUYCSHIWTNNS-GFCCVEGCSA-N 1 1 369.381 2.971 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428567 513559900 /nfs/dbraw/zinc/55/99/00/513559900.db2.gz XBQDXJGIOXQYMX-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425428567 513559904 /nfs/dbraw/zinc/55/99/04/513559904.db2.gz XBQDXJGIOXQYMX-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO COc1ccc(CNC(=O)CC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000416135569 513589441 /nfs/dbraw/zinc/58/94/41/513589441.db2.gz QVWXPUGULYGBDB-UHFFFAOYSA-N 1 1 369.421 2.668 20 5 FFBDMO O=C(C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1)Nc1ccccc1[N+](=O)[O-] ZINC000425546302 513632686 /nfs/dbraw/zinc/63/26/86/513632686.db2.gz DPPUFJXESYRZBZ-GOSISDBHSA-N 1 1 359.426 2.814 20 5 FFBDMO O=C(C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1)Nc1ccccc1[N+](=O)[O-] ZINC000425546302 513632690 /nfs/dbraw/zinc/63/26/90/513632690.db2.gz DPPUFJXESYRZBZ-GOSISDBHSA-N 1 1 359.426 2.814 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000447981088 513644882 /nfs/dbraw/zinc/64/48/82/513644882.db2.gz XWYXTDPTVKMKRP-INIZCTEOSA-N 1 1 364.446 2.523 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000451373550 513708223 /nfs/dbraw/zinc/70/82/23/513708223.db2.gz RPOMRGYIYSJGTJ-IZSNYMMISA-N 1 1 357.410 2.686 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000418993579 513710059 /nfs/dbraw/zinc/71/00/59/513710059.db2.gz HCHVNPXWVHKTED-KBPBESRZSA-N 1 1 374.416 2.687 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418066 513737317 /nfs/dbraw/zinc/73/73/17/513737317.db2.gz LYKKDFWSQUACCP-MAZHCROVSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418066 513737324 /nfs/dbraw/zinc/73/73/24/513737324.db2.gz LYKKDFWSQUACCP-MAZHCROVSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451432886 513749659 /nfs/dbraw/zinc/74/96/59/513749659.db2.gz ZZFWPUNNXRUBIU-XNRPHZJLSA-N 1 1 367.833 2.812 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436072867 513752337 /nfs/dbraw/zinc/75/23/37/513752337.db2.gz CRKQESBMFHDJOB-ZDUSSCGKSA-N 1 1 367.424 2.892 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@@H]1C ZINC000451522734 513806780 /nfs/dbraw/zinc/80/67/80/513806780.db2.gz BRHLXPCNNKXSNP-BBRMVZONSA-N 1 1 363.414 2.640 20 5 FFBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)[C@@H]1CCNC1=O ZINC000442967448 513830698 /nfs/dbraw/zinc/83/06/98/513830698.db2.gz NTULRQRKSRSXDY-OAHLLOKOSA-N 1 1 359.382 2.574 20 5 FFBDMO CC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)[C@@H]1CCNC1=O ZINC000442967448 513830703 /nfs/dbraw/zinc/83/07/03/513830703.db2.gz NTULRQRKSRSXDY-OAHLLOKOSA-N 1 1 359.382 2.574 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H](C)[N@@H+]1C ZINC000436506335 513876706 /nfs/dbraw/zinc/87/67/06/513876706.db2.gz WDHWAFFDWQCTIW-AOOOYVTPSA-N 1 1 358.345 2.753 20 5 FFBDMO COc1ccc2c(c1)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCO2 ZINC000451641645 513881751 /nfs/dbraw/zinc/88/17/51/513881751.db2.gz IVPNNWBKHBKCPA-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc2c(c1)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCO2 ZINC000451641645 513881760 /nfs/dbraw/zinc/88/17/60/513881760.db2.gz IVPNNWBKHBKCPA-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](CO)CC(C)(C)C ZINC000451777276 513974554 /nfs/dbraw/zinc/97/45/54/513974554.db2.gz IFQPOYQLUNDYNV-CQSZACIVSA-N 1 1 367.446 2.661 20 5 FFBDMO CCOCC[NH+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000448944409 513983915 /nfs/dbraw/zinc/98/39/15/513983915.db2.gz RGLROGLTQBVTIT-UHFFFAOYSA-N 1 1 362.455 2.877 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451821128 514002649 /nfs/dbraw/zinc/00/26/49/514002649.db2.gz FXUVFJBKVYFGHC-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000451868842 514033136 /nfs/dbraw/zinc/03/31/36/514033136.db2.gz DZNRCHVHUUDGCH-ZDUSSCGKSA-N 1 1 361.364 2.790 20 5 FFBDMO Cc1c([C@H]2OCC[C@@H]2[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])cnn1C ZINC000431935374 514044953 /nfs/dbraw/zinc/04/49/53/514044953.db2.gz FNDPAXROQPIQKK-GOEBONIOSA-N 1 1 350.806 2.910 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cccc(OC)c1[N+](=O)[O-])[NH+](C)C ZINC000443926034 514072939 /nfs/dbraw/zinc/07/29/39/514072939.db2.gz ZQYHPEIVYMTUFN-OAHLLOKOSA-N 1 1 373.409 2.645 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000444025920 514102905 /nfs/dbraw/zinc/10/29/05/514102905.db2.gz RVNOJVDCUXYVGB-CHWSQXEVSA-N 1 1 350.419 2.940 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444034565 514103578 /nfs/dbraw/zinc/10/35/78/514103578.db2.gz HWGMBTCADKBVMK-GFCCVEGCSA-N 1 1 353.397 2.644 20 5 FFBDMO COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(F)c(Cl)c1 ZINC000451972877 514103947 /nfs/dbraw/zinc/10/39/47/514103947.db2.gz GDRFGLVYKNYPMW-UHFFFAOYSA-N 1 1 356.785 2.732 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1cccc([N+](=O)[O-])c1C)CCC(F)(F)F ZINC000427207138 514150282 /nfs/dbraw/zinc/15/02/82/514150282.db2.gz WKQFISMBOQUGHZ-UHFFFAOYSA-N 1 1 361.364 2.836 20 5 FFBDMO CCOc1cccc(C[N@H+](CCO)Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000452045266 514158291 /nfs/dbraw/zinc/15/82/91/514158291.db2.gz ISOMKQVNRTVITM-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000452045266 514158297 /nfs/dbraw/zinc/15/82/97/514158297.db2.gz ISOMKQVNRTVITM-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+]Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000420466609 514158782 /nfs/dbraw/zinc/15/87/82/514158782.db2.gz XBLIMZYMVHQGKO-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO COC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097505 514188639 /nfs/dbraw/zinc/18/86/39/514188639.db2.gz ZQJGFAPCGWDQDY-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO COC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452097505 514188647 /nfs/dbraw/zinc/18/86/47/514188647.db2.gz ZQJGFAPCGWDQDY-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000427360232 514193950 /nfs/dbraw/zinc/19/39/50/514193950.db2.gz YLFODJVQHIYHCE-KBXCAEBGSA-N 1 1 369.421 2.854 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000427360235 514194555 /nfs/dbraw/zinc/19/45/55/514194555.db2.gz YLFODJVQHIYHCE-RDTXWAMCSA-N 1 1 369.421 2.854 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000444333979 514196824 /nfs/dbraw/zinc/19/68/24/514196824.db2.gz DRHIHNXAKGVEEH-UHFFFAOYSA-N 1 1 367.424 2.987 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000420601218 514197399 /nfs/dbraw/zinc/19/73/99/514197399.db2.gz NDVQRGZMSYRDPC-HNNXBMFYSA-N 1 1 354.410 2.770 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346340 514199415 /nfs/dbraw/zinc/19/94/15/514199415.db2.gz UZUWWNDFQXUMFA-UONOGXRCSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346340 514199420 /nfs/dbraw/zinc/19/94/20/514199420.db2.gz UZUWWNDFQXUMFA-UONOGXRCSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346340 514199426 /nfs/dbraw/zinc/19/94/26/514199426.db2.gz UZUWWNDFQXUMFA-UONOGXRCSA-N 1 1 371.441 2.615 20 5 FFBDMO CCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000444346340 514199430 /nfs/dbraw/zinc/19/94/30/514199430.db2.gz UZUWWNDFQXUMFA-UONOGXRCSA-N 1 1 371.441 2.615 20 5 FFBDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000449421968 514204977 /nfs/dbraw/zinc/20/49/77/514204977.db2.gz MFJQCTHGMDQNNE-CMPLNLGQSA-N 1 1 360.357 2.798 20 5 FFBDMO Cc1cccnc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449489257 514226488 /nfs/dbraw/zinc/22/64/88/514226488.db2.gz PUCMEHPKBHXGNK-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437987926 514283506 /nfs/dbraw/zinc/28/35/06/514283506.db2.gz RMXSVURGFNEJAY-SUMWQHHRSA-N 1 1 358.442 2.752 20 5 FFBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)NCC1CCCC1 ZINC000444675939 514291555 /nfs/dbraw/zinc/29/15/55/514291555.db2.gz OSELICUQFDHBDK-UHFFFAOYSA-N 1 1 359.430 2.646 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1cc2ccccc2c2cccnc12 ZINC000452343040 514293689 /nfs/dbraw/zinc/29/36/89/514293689.db2.gz ANGWZCRUPJGFFJ-KRWDZBQOSA-N 1 1 363.461 2.965 20 5 FFBDMO C[C@@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[N@H+]1CCCC[C@H]1C ZINC000444850051 514351136 /nfs/dbraw/zinc/35/11/36/514351136.db2.gz NXVSPXIIPWBEMQ-OLZOCXBDSA-N 1 1 374.445 2.533 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CCCO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000449792022 514353185 /nfs/dbraw/zinc/35/31/85/514353185.db2.gz RBIBBGHNEQKKQW-LBPRGKRZSA-N 1 1 374.384 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC000445255803 514453496 /nfs/dbraw/zinc/45/34/96/514453496.db2.gz ZMOXGRKIMYSUNE-UHFFFAOYSA-N 1 1 364.446 2.525 20 5 FFBDMO Cc1c(CC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000438904680 514464787 /nfs/dbraw/zinc/46/47/87/514464787.db2.gz VQUZOIZGPFPTEC-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO C[N@@H+](CC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCSC1 ZINC000452863719 514523486 /nfs/dbraw/zinc/52/34/86/514523486.db2.gz VXOXRWBQHVYDDD-NVXWUHKLSA-N 1 1 363.483 2.738 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000439485731 514564878 /nfs/dbraw/zinc/56/48/78/514564878.db2.gz UOGXGTOPEJHNRW-GOSISDBHSA-N 1 1 350.415 2.695 20 5 FFBDMO Cc1nc(NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)ncc1[N+](=O)[O-] ZINC000450256796 514567480 /nfs/dbraw/zinc/56/74/80/514567480.db2.gz INNRRDNVGCNYPZ-AWEZNQCLSA-N 1 1 355.442 2.959 20 5 FFBDMO O=C([C@H]1CC[N@@H+]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000475516010 514698360 /nfs/dbraw/zinc/69/83/60/514698360.db2.gz CXMKZYVKBYIMMO-LJQANCHMSA-N 1 1 351.406 2.754 20 5 FFBDMO O=C([C@H]1CC[N@H+]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000475516010 514698361 /nfs/dbraw/zinc/69/83/61/514698361.db2.gz CXMKZYVKBYIMMO-LJQANCHMSA-N 1 1 351.406 2.754 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(CNc3ccncc3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000508228401 514714387 /nfs/dbraw/zinc/71/43/87/514714387.db2.gz AMJLFEGHECZAPY-GASCZTMLSA-N 1 1 356.426 2.633 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489179375 514740552 /nfs/dbraw/zinc/74/05/52/514740552.db2.gz ZAEKPCMZZXICNV-DOTOQJQBSA-N 1 1 353.426 2.821 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000489416114 514837411 /nfs/dbraw/zinc/83/74/11/514837411.db2.gz YYMHWPAUFUCVHA-HDMKZQKVSA-N 1 1 360.458 2.509 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000484929722 514847921 /nfs/dbraw/zinc/84/79/21/514847921.db2.gz XZZUPTUKEOZWMH-BBRMVZONSA-N 1 1 359.430 2.949 20 5 FFBDMO CCc1ccc(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000471358308 514849933 /nfs/dbraw/zinc/84/99/33/514849933.db2.gz SYGYWWRKMZBUFM-KBPBESRZSA-N 1 1 363.458 2.775 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000498569550 514977382 /nfs/dbraw/zinc/97/73/82/514977382.db2.gz APAHKWGQNLHEOD-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000476381881 515027471 /nfs/dbraw/zinc/02/74/71/515027471.db2.gz YEYXDRGEKZQOAK-ZBFHGGJFSA-N 1 1 371.441 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCn3cc[nH+]c3C2)nc1OCc1ccccc1 ZINC000489929103 515035451 /nfs/dbraw/zinc/03/54/51/515035451.db2.gz VPCIEBPJFKYDMW-HNNXBMFYSA-N 1 1 365.393 2.614 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]CCc3n[nH]c(C)n3)o2)c([N+](=O)[O-])c1 ZINC000503575665 515085483 /nfs/dbraw/zinc/08/54/83/515085483.db2.gz IFHRUOHNTXHBIX-UHFFFAOYSA-N 1 1 357.370 2.622 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]CCc3nnc(C)[nH]3)o2)c([N+](=O)[O-])c1 ZINC000503575665 515085492 /nfs/dbraw/zinc/08/54/92/515085492.db2.gz IFHRUOHNTXHBIX-UHFFFAOYSA-N 1 1 357.370 2.622 20 5 FFBDMO CNc1c(C(=O)NC[C@H](c2ccccc2OC)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000462904513 515291530 /nfs/dbraw/zinc/29/15/30/515291530.db2.gz GJCHEXQKSCYCPA-MRXNPFEDSA-N 1 1 372.425 2.678 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486033027 515305157 /nfs/dbraw/zinc/30/51/57/515305157.db2.gz ZOVDQCNVCMOBJM-LBPRGKRZSA-N 1 1 355.385 2.652 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1OC)CCC(F)(F)F ZINC000477123799 515338148 /nfs/dbraw/zinc/33/81/48/515338148.db2.gz SUTKOYUWWNCIAP-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO Cc1c(CNC(=O)[C@@H](C)[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000481475774 515339536 /nfs/dbraw/zinc/33/95/36/515339536.db2.gz SJVLMKPRKKGFSN-OAHLLOKOSA-N 1 1 353.422 2.966 20 5 FFBDMO Cc1c(CNC(=O)[C@@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000481475774 515339547 /nfs/dbraw/zinc/33/95/47/515339547.db2.gz SJVLMKPRKKGFSN-OAHLLOKOSA-N 1 1 353.422 2.966 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000477139076 515344707 /nfs/dbraw/zinc/34/47/07/515344707.db2.gz PSXRZXGIVMTYMI-FRRDWIJNSA-N 1 1 373.500 2.682 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510844 515355227 /nfs/dbraw/zinc/35/52/27/515355227.db2.gz NTGCSIJXIZNIIR-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510844 515355234 /nfs/dbraw/zinc/35/52/34/515355234.db2.gz NTGCSIJXIZNIIR-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@H]1C[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])n2C)C[N@H+]1Cc1ccccc1 ZINC000510150546 515451660 /nfs/dbraw/zinc/45/16/60/515451660.db2.gz WMKVEKYAKKDKMB-DOTOQJQBSA-N 1 1 370.453 2.964 20 5 FFBDMO CC[C@@H](C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(=O)OC ZINC000499789705 515455839 /nfs/dbraw/zinc/45/58/39/515455839.db2.gz IGIIMXLUQNLYQK-CYBMUJFWSA-N 1 1 351.403 2.505 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C(C)C)N1CCN(C)CC1 ZINC000468654880 515455869 /nfs/dbraw/zinc/45/58/69/515455869.db2.gz CZBMEOGXZMIRKS-PGNDWZGLSA-N 1 1 360.502 2.860 20 5 FFBDMO C[C@@H]1C[C@@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510231772 515476378 /nfs/dbraw/zinc/47/63/78/515476378.db2.gz ZIGDTZGKQLKOPV-GDBMZVCRSA-N 1 1 356.426 2.953 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000481839886 515485389 /nfs/dbraw/zinc/48/53/89/515485389.db2.gz VSQQMKKJPVRXLT-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000499879357 515491140 /nfs/dbraw/zinc/49/11/40/515491140.db2.gz RZFIRMGACYIUBD-UKRRQHHQSA-N 1 1 354.410 2.742 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000486512978 515518526 /nfs/dbraw/zinc/51/85/26/515518526.db2.gz KUFIYNMNKGOOTF-GOSISDBHSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000473285765 515564224 /nfs/dbraw/zinc/56/42/24/515564224.db2.gz YKDZQYRNDJYHKS-UOIKSKOESA-N 1 1 356.426 2.809 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC[NH2+]2)cc1 ZINC000505573288 515590319 /nfs/dbraw/zinc/59/03/19/515590319.db2.gz RZOUFFVLKNZPGN-QGZVFWFLSA-N 1 1 369.421 2.953 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCCO)Cc1ccccc1 ZINC000486784551 515630773 /nfs/dbraw/zinc/63/07/73/515630773.db2.gz ZHRQNNRTSZBQJB-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCCO)Cc1ccccc1 ZINC000486784551 515630778 /nfs/dbraw/zinc/63/07/78/515630778.db2.gz ZHRQNNRTSZBQJB-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473514413 515641624 /nfs/dbraw/zinc/64/16/24/515641624.db2.gz RPYYADMZQOYIHP-KRWDZBQOSA-N 1 1 369.469 2.749 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000493998979 515708807 /nfs/dbraw/zinc/70/88/07/515708807.db2.gz GWLRKXLMLPSGNS-ACJLOTCBSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000493998979 515708818 /nfs/dbraw/zinc/70/88/18/515708818.db2.gz GWLRKXLMLPSGNS-ACJLOTCBSA-N 1 1 355.394 2.693 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1c[nH+]ccc1-n1cccn1 ZINC000505894325 515713952 /nfs/dbraw/zinc/71/39/52/515713952.db2.gz SBPWWXOPJKXPAF-UHFFFAOYSA-N 1 1 362.349 2.769 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000494045866 515719293 /nfs/dbraw/zinc/71/92/93/515719293.db2.gz CNRPIDYKQMBXLO-DNVCBOLYSA-N 1 1 369.421 2.753 20 5 FFBDMO C[N@H+](Cc1cccc2[nH]ccc21)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000494110026 515736698 /nfs/dbraw/zinc/73/66/98/515736698.db2.gz YFKVCCIPFNHOSM-HNNXBMFYSA-N 1 1 355.394 2.948 20 5 FFBDMO C[C@H](CC[NH+]1CCOCC1)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000511062384 515761053 /nfs/dbraw/zinc/76/10/53/515761053.db2.gz KBVRAQOZEPNPMM-GFCCVEGCSA-N 1 1 363.439 2.650 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000511128536 515796998 /nfs/dbraw/zinc/79/69/98/515796998.db2.gz XGXIRKAQZSDZQM-AWEZNQCLSA-N 1 1 373.375 2.870 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000511128536 515797006 /nfs/dbraw/zinc/79/70/06/515797006.db2.gz XGXIRKAQZSDZQM-AWEZNQCLSA-N 1 1 373.375 2.870 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000459802556 515816222 /nfs/dbraw/zinc/81/62/22/515816222.db2.gz MPVPSWKPEAMVQJ-ZWKOTPCHSA-N 1 1 361.442 2.796 20 5 FFBDMO CN(C)c1[nH+]cc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1C ZINC000511198386 515823502 /nfs/dbraw/zinc/82/35/02/515823502.db2.gz MWXQGKIHMNLNKP-UHFFFAOYSA-N 1 1 359.430 2.622 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511531534 515936146 /nfs/dbraw/zinc/93/61/46/515936146.db2.gz ZCBCDKMMHDRFFJ-JKSUJKDBSA-N 1 1 362.474 2.899 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1 ZINC000469789544 515965986 /nfs/dbraw/zinc/96/59/86/515965986.db2.gz YUHBGXAFAWJMQL-DOTOQJQBSA-N 1 1 365.474 2.830 20 5 FFBDMO CCCCOC1CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000464853709 515988741 /nfs/dbraw/zinc/98/87/41/515988741.db2.gz JLRVCINGHRJHRU-SFHVURJKSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000487819716 515991249 /nfs/dbraw/zinc/99/12/49/515991249.db2.gz QCAGYOWAQVDGCG-FZMZJTMJSA-N 1 1 366.849 2.715 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3nc4cc(F)ccc4o3)C2)nc1 ZINC000464890310 516007151 /nfs/dbraw/zinc/00/71/51/516007151.db2.gz WXCUCJGOOUJFNR-LBPRGKRZSA-N 1 1 357.345 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3nc4cc(F)ccc4o3)C2)nc1 ZINC000464890310 516007159 /nfs/dbraw/zinc/00/71/59/516007159.db2.gz WXCUCJGOOUJFNR-LBPRGKRZSA-N 1 1 357.345 2.957 20 5 FFBDMO COc1ccnc(N2CC[NH+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000470177748 516163514 /nfs/dbraw/zinc/16/35/14/516163514.db2.gz FOIPZWPGYWZWIS-NTCAYCPXSA-N 1 1 369.425 2.619 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(Cc2cnn(C)c2)CC1 ZINC000470176477 516163576 /nfs/dbraw/zinc/16/35/76/516163576.db2.gz WOAAZSNHBBRTAM-YBEGLDIGSA-N 1 1 355.442 2.549 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000488475661 516235223 /nfs/dbraw/zinc/23/52/23/516235223.db2.gz JRGBBCHHLSPYIU-ZBFHGGJFSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000507542617 516237412 /nfs/dbraw/zinc/23/74/12/516237412.db2.gz DDTJLUWQHRLMFD-ZDUSSCGKSA-N 1 1 369.468 2.546 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000488716166 516292911 /nfs/dbraw/zinc/29/29/11/516292911.db2.gz QYQXYXXDHYYAHS-RVKKMQEKSA-N 1 1 374.485 2.900 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](N2CCOCC2)C(F)(F)F)c(Cl)c1 ZINC000512983477 516433526 /nfs/dbraw/zinc/43/35/26/516433526.db2.gz RQALZMIJLJWPPP-ZDUSSCGKSA-N 1 1 367.755 2.601 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000547799411 516570216 /nfs/dbraw/zinc/57/02/16/516570216.db2.gz ZDQRYPLGPMFSEF-MRXNPFEDSA-N 1 1 371.441 2.727 20 5 FFBDMO CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000513467897 516636896 /nfs/dbraw/zinc/63/68/96/516636896.db2.gz ZGXQYJAAWMKDCM-SFHVURJKSA-N 1 1 355.442 2.664 20 5 FFBDMO Cn1cc(C[N@H+](C)[C@H]2CCN(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513467897 516636903 /nfs/dbraw/zinc/63/69/03/516636903.db2.gz ZGXQYJAAWMKDCM-SFHVURJKSA-N 1 1 355.442 2.664 20 5 FFBDMO Cn1cc(C[N@@H+](C)[C@H]2CCN(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000513467897 516636912 /nfs/dbraw/zinc/63/69/12/516636912.db2.gz ZGXQYJAAWMKDCM-SFHVURJKSA-N 1 1 355.442 2.664 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CCN(CCO)CC1 ZINC000513579127 516676558 /nfs/dbraw/zinc/67/65/58/516676558.db2.gz UHYPFCCHNIEBJX-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC[NH+](CCO)CC1 ZINC000513579127 516676566 /nfs/dbraw/zinc/67/65/66/516676566.db2.gz UHYPFCCHNIEBJX-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO Cc1nn(C)c(C)c1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513656589 516710194 /nfs/dbraw/zinc/71/01/94/516710194.db2.gz VNUBTZOFYRAHHX-SFHVURJKSA-N 1 1 368.441 2.600 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000555044191 516756601 /nfs/dbraw/zinc/75/66/01/516756601.db2.gz IMXFZCNJGUQRLF-OAHLLOKOSA-N 1 1 361.442 2.797 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCN3CCCc4ccccc43)C2)nc1 ZINC000536425931 516759138 /nfs/dbraw/zinc/75/91/38/516759138.db2.gz IEZSMBVHIVHXBV-QGZVFWFLSA-N 1 1 367.453 2.929 20 5 FFBDMO C[C@@H]1CCC[C@](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000518810962 516783906 /nfs/dbraw/zinc/78/39/06/516783906.db2.gz IRZJEPYJEUGTHS-XIKOKIGWSA-N 1 1 359.430 2.711 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000544623187 516842366 /nfs/dbraw/zinc/84/23/66/516842366.db2.gz PLLVFBSTGRTLSX-UHFFFAOYSA-N 1 1 359.361 2.791 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH+]2CCC(O)CC2)cc1OC ZINC000541056338 516851054 /nfs/dbraw/zinc/85/10/54/516851054.db2.gz IYWSWJQMTIXTMW-ZDUSSCGKSA-N 1 1 352.431 2.985 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[N@@H+](C)[C@@H](C(C)C)C1 ZINC000558834903 516965227 /nfs/dbraw/zinc/96/52/27/516965227.db2.gz NCSWOXRUZZTXOF-MRXNPFEDSA-N 1 1 358.446 2.650 20 5 FFBDMO Cc1c(Br)c(=O)n(Cc2cn3ccccc3[nH+]2)cc1[N+](=O)[O-] ZINC000541286745 516967347 /nfs/dbraw/zinc/96/73/47/516967347.db2.gz QVIKLQXMDXUTEW-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO Cc1ccc(NC(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000532424058 516970115 /nfs/dbraw/zinc/97/01/15/516970115.db2.gz NLRMJRFAOLNMCN-HOTGVXAUSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000525291268 516996761 /nfs/dbraw/zinc/99/67/61/516996761.db2.gz BOQVESYHISDJST-MRXNPFEDSA-N 1 1 363.461 2.613 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC1 ZINC000537017685 517005705 /nfs/dbraw/zinc/00/57/05/517005705.db2.gz KNFPMVYBLCBBTC-UHFFFAOYSA-N 1 1 354.410 2.823 20 5 FFBDMO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046605 517017926 /nfs/dbraw/zinc/01/79/26/517017926.db2.gz WNMAEGFKFSBUJU-VXGBXAGGSA-N 1 1 360.370 2.617 20 5 FFBDMO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046605 517017932 /nfs/dbraw/zinc/01/79/32/517017932.db2.gz WNMAEGFKFSBUJU-VXGBXAGGSA-N 1 1 360.370 2.617 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H](c1ccco1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000552038050 517044744 /nfs/dbraw/zinc/04/47/44/517044744.db2.gz JKLJJGDKAVDASW-FUHWJXTLSA-N 1 1 369.425 2.903 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000541525056 517094263 /nfs/dbraw/zinc/09/42/63/517094263.db2.gz WEWAJIPSKXKSAW-ZFWWWQNUSA-N 1 1 364.446 2.618 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)c3ccc([N+](=O)[O-])cn3)C2)s1 ZINC000552134516 517101332 /nfs/dbraw/zinc/10/13/32/517101332.db2.gz OCWBKDDUNIDBQQ-AWEZNQCLSA-N 1 1 374.466 2.954 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000552999989 517471715 /nfs/dbraw/zinc/47/17/15/517471715.db2.gz ZIFZNMPTLXMVMK-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000552999989 517471725 /nfs/dbraw/zinc/47/17/25/517471725.db2.gz ZIFZNMPTLXMVMK-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000520898538 517545998 /nfs/dbraw/zinc/54/59/98/517545998.db2.gz CAHKXFJFQOFKJT-ZIAGYGMSSA-N 1 1 369.487 2.698 20 5 FFBDMO Cc1cc(N(C)CCC[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549491830 517588858 /nfs/dbraw/zinc/58/88/58/517588858.db2.gz HAINOVXVTVAUTI-UHFFFAOYSA-N 1 1 374.407 2.996 20 5 FFBDMO CCc1ccc([C@H]([NH2+]CCCS(C)(=O)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542495400 517593617 /nfs/dbraw/zinc/59/36/17/517593617.db2.gz YGNRKWONIDKVHM-QGZVFWFLSA-N 1 1 366.439 2.864 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000560275424 517672528 /nfs/dbraw/zinc/67/25/28/517672528.db2.gz VBBOPQKRCZQAKQ-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000521290158 517681659 /nfs/dbraw/zinc/68/16/59/517681659.db2.gz WYLSTOGFSTTXOC-WBVHZDCISA-N 1 1 368.437 2.956 20 5 FFBDMO COc1cc(C[N@@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000549829565 517732230 /nfs/dbraw/zinc/73/22/30/517732230.db2.gz XFTYVXYFGKDIHP-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1cc(C[N@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000549829565 517732241 /nfs/dbraw/zinc/73/22/41/517732241.db2.gz XFTYVXYFGKDIHP-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO CCCN(CC[NH+]1CCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000553484681 517739887 /nfs/dbraw/zinc/73/98/87/517739887.db2.gz VEYOGLHOOOXTMY-UHFFFAOYSA-N 1 1 359.430 2.809 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC2 ZINC000563252546 517771620 /nfs/dbraw/zinc/77/16/20/517771620.db2.gz HMZILHBVIZHORO-OAHLLOKOSA-N 1 1 354.410 2.853 20 5 FFBDMO CCCCO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C ZINC000534178482 517773617 /nfs/dbraw/zinc/77/36/17/517773617.db2.gz VBGXZRHKKNXPOD-CVEARBPZSA-N 1 1 351.447 2.672 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](Cc2ccccn2)C(C)C)cc1[N+](=O)[O-] ZINC000530447170 517779717 /nfs/dbraw/zinc/77/97/17/517779717.db2.gz FXFXCTJSFRSWFY-UHFFFAOYSA-N 1 1 373.409 2.952 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](Cc2ccccn2)C(C)C)cc1[N+](=O)[O-] ZINC000530447170 517779725 /nfs/dbraw/zinc/77/97/25/517779725.db2.gz FXFXCTJSFRSWFY-UHFFFAOYSA-N 1 1 373.409 2.952 20 5 FFBDMO C[C@@H]1CCC[N@@H+](C(C)(C)CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000521769820 517850813 /nfs/dbraw/zinc/85/08/13/517850813.db2.gz DEHOPSBDGQFOBW-GFCCVEGCSA-N 1 1 373.450 2.523 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000521769820 517850823 /nfs/dbraw/zinc/85/08/23/517850823.db2.gz DEHOPSBDGQFOBW-GFCCVEGCSA-N 1 1 373.450 2.523 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000522010337 517948612 /nfs/dbraw/zinc/94/86/12/517948612.db2.gz AGEFAQOIWYMNLW-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000539378556 518018372 /nfs/dbraw/zinc/01/83/72/518018372.db2.gz FTYVCGIBMIGTDF-QGZVFWFLSA-N 1 1 361.373 2.958 20 5 FFBDMO C[NH+](C)C1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCCCC1 ZINC000564118405 518314328 /nfs/dbraw/zinc/31/43/28/518314328.db2.gz GYDJXHHHPSIACZ-MRXNPFEDSA-N 1 1 365.474 2.579 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCOCC2)C1 ZINC000567120312 518361677 /nfs/dbraw/zinc/36/16/77/518361677.db2.gz BJMGPUQZLKMVBQ-GOSISDBHSA-N 1 1 363.458 2.679 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCOCC2)C1 ZINC000567120312 518361681 /nfs/dbraw/zinc/36/16/81/518361681.db2.gz BJMGPUQZLKMVBQ-GOSISDBHSA-N 1 1 363.458 2.679 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]([NH+]2CCOCC2)C1 ZINC000567120312 518361688 /nfs/dbraw/zinc/36/16/88/518361688.db2.gz BJMGPUQZLKMVBQ-GOSISDBHSA-N 1 1 363.458 2.679 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000564314581 518394084 /nfs/dbraw/zinc/39/40/84/518394084.db2.gz KEDIWOAURJTOEG-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000564314581 518394091 /nfs/dbraw/zinc/39/40/91/518394091.db2.gz KEDIWOAURJTOEG-INIZCTEOSA-N 1 1 371.393 2.879 20 5 FFBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000584869446 518516119 /nfs/dbraw/zinc/51/61/19/518516119.db2.gz HVSACGIIUOEUJR-DJIMGWMZSA-N 1 1 361.442 2.719 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000582202869 518634932 /nfs/dbraw/zinc/63/49/32/518634932.db2.gz FWKZBPLNYPXLHM-MRXNPFEDSA-N 1 1 373.457 2.792 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)c1 ZINC000564840490 518644803 /nfs/dbraw/zinc/64/48/03/518644803.db2.gz JTBZODHAYPAJQL-KRWDZBQOSA-N 1 1 359.357 2.529 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(C)[nH+]c2N2CCCC2)n1 ZINC000588014181 518701240 /nfs/dbraw/zinc/70/12/40/518701240.db2.gz DDSGQNLXAGNLCS-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000573534846 518710503 /nfs/dbraw/zinc/71/05/03/518710503.db2.gz SLYRZPZEUNZQCF-CQSZACIVSA-N 1 1 373.457 2.602 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCc2c[nH+]cn2C1 ZINC000588067670 518715000 /nfs/dbraw/zinc/71/50/00/518715000.db2.gz IFCKBGGIZKASQO-VIFPVBQESA-N 1 1 350.762 2.658 20 5 FFBDMO CN(C(=O)c1c(N)cccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000571050105 518904670 /nfs/dbraw/zinc/90/46/70/518904670.db2.gz MZBVJIOPADZGGS-HNNXBMFYSA-N 1 1 354.410 2.524 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](c3ccnc(C)n3)C2)c1 ZINC000589497249 519017479 /nfs/dbraw/zinc/01/74/79/519017479.db2.gz JHNHOAUKDLBYQQ-HNNXBMFYSA-N 1 1 370.409 2.859 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](c3ccnc(C)n3)C2)c1 ZINC000589497249 519017486 /nfs/dbraw/zinc/01/74/86/519017486.db2.gz JHNHOAUKDLBYQQ-HNNXBMFYSA-N 1 1 370.409 2.859 20 5 FFBDMO CCc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000565559194 519017810 /nfs/dbraw/zinc/01/78/10/519017810.db2.gz SIQYREIKYIIJPJ-CQSZACIVSA-N 1 1 367.453 2.932 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000589607176 519040460 /nfs/dbraw/zinc/04/04/60/519040460.db2.gz VLRVZPPGPLYTHU-CYBMUJFWSA-N 1 1 352.435 2.523 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000590581009 519273955 /nfs/dbraw/zinc/27/39/55/519273955.db2.gz GJPQAKNCGDGIEW-VXGBXAGGSA-N 1 1 367.833 2.955 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N1CCC(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000574842840 519360481 /nfs/dbraw/zinc/36/04/81/519360481.db2.gz ILLHRQSDPAUKOW-GASCZTMLSA-N 1 1 363.458 2.929 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000591048626 519490616 /nfs/dbraw/zinc/49/06/16/519490616.db2.gz CCYBUQMVCGEWIO-RBUKOAKNSA-N 1 1 369.421 2.565 20 5 FFBDMO CN1CCN(c2ccc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])cn2)CC1 ZINC000566473490 519512099 /nfs/dbraw/zinc/51/20/99/519512099.db2.gz BKYFLCLCCSTOKV-SFHVURJKSA-N 1 1 367.453 2.519 20 5 FFBDMO COc1cc(F)c(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1OC ZINC000578366971 519555670 /nfs/dbraw/zinc/55/56/70/519555670.db2.gz BYPAXHJENRSUKI-UHFFFAOYSA-N 1 1 364.377 2.785 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000602874563 519942651 /nfs/dbraw/zinc/94/26/51/519942651.db2.gz QCQUJTLYVHSJSX-FRRDWIJNSA-N 1 1 368.865 2.990 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@@H](C(C)(C)C)C1 ZINC000602874494 519942853 /nfs/dbraw/zinc/94/28/53/519942853.db2.gz RSYXIKUGLWJYSM-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)[C@@H](C(C)(C)C)C1 ZINC000602874494 519942857 /nfs/dbraw/zinc/94/28/57/519942857.db2.gz RSYXIKUGLWJYSM-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)[C@@H](C(C)(C)C)C1 ZINC000602874494 519942863 /nfs/dbraw/zinc/94/28/63/519942863.db2.gz RSYXIKUGLWJYSM-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594418461 519953651 /nfs/dbraw/zinc/95/36/51/519953651.db2.gz JFHOKYFIEFUCNC-QZTJIDSGSA-N 1 1 360.458 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]([C@@H]2CCCO2)C2(CO)CCC2)c(F)c1 ZINC000602891467 519953905 /nfs/dbraw/zinc/95/39/05/519953905.db2.gz NKVBUOQXFGWCRE-JKSUJKDBSA-N 1 1 356.369 2.673 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594419219 519954001 /nfs/dbraw/zinc/95/40/01/519954001.db2.gz PIKLCMFPNBITGP-SJORKVTESA-N 1 1 359.426 2.691 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594420540 519955637 /nfs/dbraw/zinc/95/56/37/519955637.db2.gz WGCQUQRGERUJIA-JKSUJKDBSA-N 1 1 361.442 2.805 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594484096 519993057 /nfs/dbraw/zinc/99/30/57/519993057.db2.gz SAJZTWDXWISUML-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599999204 519993507 /nfs/dbraw/zinc/99/35/07/519993507.db2.gz MODAPRLJJDCVEO-LLVKDONJSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cncn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000602963744 519997412 /nfs/dbraw/zinc/99/74/12/519997412.db2.gz ZOHIRGZKTWMACB-HXUWFJFHSA-N 1 1 366.421 2.837 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594551506 520023253 /nfs/dbraw/zinc/02/32/53/520023253.db2.gz FLTBQCAUUYHFLJ-LESCRADOSA-N 1 1 360.458 2.837 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594551506 520023261 /nfs/dbraw/zinc/02/32/61/520023261.db2.gz FLTBQCAUUYHFLJ-LESCRADOSA-N 1 1 360.458 2.837 20 5 FFBDMO C[C@@]1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCCS1 ZINC000600111796 520053649 /nfs/dbraw/zinc/05/36/49/520053649.db2.gz FSCGFLBYYKWAGE-HNNXBMFYSA-N 1 1 355.485 2.700 20 5 FFBDMO COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000600194019 520115666 /nfs/dbraw/zinc/11/56/66/520115666.db2.gz ZWCHVHWDFNPVEP-GOSISDBHSA-N 1 1 360.366 2.619 20 5 FFBDMO CCn1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616786263 520139432 /nfs/dbraw/zinc/13/94/32/520139432.db2.gz RAKHLFQNZUCIRP-ZDUSSCGKSA-N 1 1 360.414 2.884 20 5 FFBDMO CCn1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616786263 520139437 /nfs/dbraw/zinc/13/94/37/520139437.db2.gz RAKHLFQNZUCIRP-ZDUSSCGKSA-N 1 1 360.414 2.884 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000600230355 520139442 /nfs/dbraw/zinc/13/94/42/520139442.db2.gz RQDZRKFJTWBGDY-ZDUSSCGKSA-N 1 1 365.405 2.879 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000600251898 520158008 /nfs/dbraw/zinc/15/80/08/520158008.db2.gz DOTBIFLUSWHHGR-IBGZPJMESA-N 1 1 370.453 2.916 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594853963 520191105 /nfs/dbraw/zinc/19/11/05/520191105.db2.gz BQEZYWSLQKOGPS-AWEZNQCLSA-N 1 1 367.471 2.589 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000600300488 520191144 /nfs/dbraw/zinc/19/11/44/520191144.db2.gz ZTDPQNNIYCLZNM-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000600300488 520191156 /nfs/dbraw/zinc/19/11/56/520191156.db2.gz ZTDPQNNIYCLZNM-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO Cn1c(C(=O)N2CC[N@H+](Cc3ccccc3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000609192492 520224329 /nfs/dbraw/zinc/22/43/29/520224329.db2.gz HIMRPNKAHVMISY-UHFFFAOYSA-N 1 1 356.426 2.670 20 5 FFBDMO Cn1c(C(=O)N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000609192492 520224335 /nfs/dbraw/zinc/22/43/35/520224335.db2.gz HIMRPNKAHVMISY-UHFFFAOYSA-N 1 1 356.426 2.670 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000603400538 520247012 /nfs/dbraw/zinc/24/70/12/520247012.db2.gz HWLONMRBLITKDZ-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1ncnc2cccc([N+](=O)[O-])c21 ZINC000603401545 520249836 /nfs/dbraw/zinc/24/98/36/520249836.db2.gz PRDPEYQQNRLABJ-UHFFFAOYSA-N 1 1 366.425 2.891 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000600472747 520279599 /nfs/dbraw/zinc/27/95/99/520279599.db2.gz PMXQUFWGEPMFHH-HNNXBMFYSA-N 1 1 369.425 2.527 20 5 FFBDMO Cc1ccncc1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000595073940 520281836 /nfs/dbraw/zinc/28/18/36/520281836.db2.gz PONAXEKXRNBAGN-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000597859761 520286737 /nfs/dbraw/zinc/28/67/37/520286737.db2.gz HGCDQRZCIGYINO-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO CCOc1ccc([C@H](C)NC2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106582 520297047 /nfs/dbraw/zinc/29/70/47/520297047.db2.gz VKZIXAQCNATUIO-YOEHRIQHSA-N 1 1 363.458 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CCN(CC[N@H+](C)Cc2ccccc2)CC1 ZINC000609384014 520300802 /nfs/dbraw/zinc/30/08/02/520300802.db2.gz XTXOGRCJFRRBMK-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO CCOc1cc(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000597922968 520324451 /nfs/dbraw/zinc/32/44/51/520324451.db2.gz HQWAZXQGLGSCCD-GFCCVEGCSA-N 1 1 365.430 2.605 20 5 FFBDMO CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598039034 520388887 /nfs/dbraw/zinc/38/88/87/520388887.db2.gz HOZKSWQBVJYHMD-LBPRGKRZSA-N 1 1 357.357 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)OCC1(C)C ZINC000609671685 520401305 /nfs/dbraw/zinc/40/13/05/520401305.db2.gz ISXQTEHYPSVMCP-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO CNc1c(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000613234404 520402874 /nfs/dbraw/zinc/40/28/74/520402874.db2.gz HHTMCIOVMBAAKX-MRXNPFEDSA-N 1 1 368.437 2.983 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592478844 520406579 /nfs/dbraw/zinc/40/65/79/520406579.db2.gz KBSYNKOONYQHQZ-RDJZCZTQSA-N 1 1 360.458 2.696 20 5 FFBDMO Cc1noc(C[N@@H+](C)C2CCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595370738 520434102 /nfs/dbraw/zinc/43/41/02/520434102.db2.gz IZBDMCVPORCQNI-UHFFFAOYSA-N 1 1 358.398 2.628 20 5 FFBDMO Cc1noc(C[N@H+](C)C2CCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595370738 520434104 /nfs/dbraw/zinc/43/41/04/520434104.db2.gz IZBDMCVPORCQNI-UHFFFAOYSA-N 1 1 358.398 2.628 20 5 FFBDMO CN(CCOCC[NH3+])Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000600773392 520461531 /nfs/dbraw/zinc/46/15/31/520461531.db2.gz HQJZGNAMJSMXEX-UHFFFAOYSA-N 1 1 358.442 2.770 20 5 FFBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000609874650 520464913 /nfs/dbraw/zinc/46/49/13/520464913.db2.gz CHKWPLMWXLARAQ-INIZCTEOSA-N 1 1 367.833 2.575 20 5 FFBDMO O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000609874651 520465105 /nfs/dbraw/zinc/46/51/05/520465105.db2.gz CHKWPLMWXLARAQ-MRXNPFEDSA-N 1 1 367.833 2.575 20 5 FFBDMO CC1(C)C[C@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CO1 ZINC000595433115 520467909 /nfs/dbraw/zinc/46/79/09/520467909.db2.gz NWSAUMRAVPVKEE-AWEZNQCLSA-N 1 1 359.430 2.551 20 5 FFBDMO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000595434000 520468119 /nfs/dbraw/zinc/46/81/19/520468119.db2.gz RGHZPTFWBYWAKE-CYBMUJFWSA-N 1 1 372.429 2.592 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000609963932 520491915 /nfs/dbraw/zinc/49/19/15/520491915.db2.gz JQVKYJWUSCZYCS-OLZOCXBDSA-N 1 1 350.419 2.841 20 5 FFBDMO CC(C)(CO)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccnc1 ZINC000595498525 520509279 /nfs/dbraw/zinc/50/92/79/520509279.db2.gz DPVYWCAXEGGQMO-QGZVFWFLSA-N 1 1 355.398 2.716 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000595505292 520514554 /nfs/dbraw/zinc/51/45/54/520514554.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000595505292 520514561 /nfs/dbraw/zinc/51/45/61/520514561.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@]2(CC[NH+](C)C2)C1 ZINC000595505292 520514568 /nfs/dbraw/zinc/51/45/68/520514568.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595505292 520514578 /nfs/dbraw/zinc/51/45/78/520514578.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000595505292 520514585 /nfs/dbraw/zinc/51/45/85/520514585.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000595505292 520514594 /nfs/dbraw/zinc/51/45/94/520514594.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000595505292 520514601 /nfs/dbraw/zinc/51/46/01/520514601.db2.gz RMTSDZSXJRZFED-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000595503715 520515176 /nfs/dbraw/zinc/51/51/76/520515176.db2.gz ARJDEGDUERIVNO-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445591 520565354 /nfs/dbraw/zinc/56/53/54/520565354.db2.gz KOBKAFGMPVOGFV-UMVBOHGHSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604474450 520571732 /nfs/dbraw/zinc/57/17/32/520571732.db2.gz UOJJGRIHUIJPDG-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000610208562 520580314 /nfs/dbraw/zinc/58/03/14/520580314.db2.gz DQOOPSABZHCSHF-WCQYABFASA-N 1 1 355.822 2.616 20 5 FFBDMO CCO[C@H]1C[C@@H](O)C12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601119428 520645517 /nfs/dbraw/zinc/64/55/17/520645517.db2.gz RRMYESFWHOPERH-MSOLQXFVSA-N 1 1 357.410 2.899 20 5 FFBDMO CCN(CC)c1ncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)s1 ZINC000601149846 520661072 /nfs/dbraw/zinc/66/10/72/520661072.db2.gz QPLFIUXUZXHZRG-KRWDZBQOSA-N 1 1 364.471 2.895 20 5 FFBDMO COc1ccc(CC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598508290 520667564 /nfs/dbraw/zinc/66/75/64/520667564.db2.gz FWOBNFQUMBHAQK-KRWDZBQOSA-N 1 1 369.421 2.537 20 5 FFBDMO Cn1nccc1[C@@H]1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601171173 520670901 /nfs/dbraw/zinc/67/09/01/520670901.db2.gz HGZGUWHGCYJHED-XIKOKIGWSA-N 1 1 353.382 2.631 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598511958 520672161 /nfs/dbraw/zinc/67/21/61/520672161.db2.gz VMUQXLQXTJDHGC-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000601184413 520677144 /nfs/dbraw/zinc/67/71/44/520677144.db2.gz LAFNQUAYGLJXNJ-LBPRGKRZSA-N 1 1 350.806 2.715 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH+]2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 ZINC000610447525 520690501 /nfs/dbraw/zinc/69/05/01/520690501.db2.gz GRPOQGRBPOUWHV-RKDXNWHRSA-N 1 1 360.258 2.854 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c1 ZINC000593034660 520696470 /nfs/dbraw/zinc/69/64/70/520696470.db2.gz QTPIPGGLFRSXQI-FUHWJXTLSA-N 1 1 356.378 2.689 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c1 ZINC000593034660 520696475 /nfs/dbraw/zinc/69/64/75/520696475.db2.gz QTPIPGGLFRSXQI-FUHWJXTLSA-N 1 1 356.378 2.689 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598557997 520703715 /nfs/dbraw/zinc/70/37/15/520703715.db2.gz BEJPQZMATHPFKE-AYOQOUSVSA-N 1 1 357.454 2.937 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@]2(CO)CCC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000610481133 520708416 /nfs/dbraw/zinc/70/84/16/520708416.db2.gz JUWSGSCHFSIKGZ-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000610481133 520708426 /nfs/dbraw/zinc/70/84/26/520708426.db2.gz JUWSGSCHFSIKGZ-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)c([N+](=O)[O-])c1 ZINC000593053880 520711272 /nfs/dbraw/zinc/71/12/72/520711272.db2.gz BZQXZZFALINSEL-UHFFFAOYSA-N 1 1 361.295 2.560 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595786256 520724427 /nfs/dbraw/zinc/72/44/27/520724427.db2.gz HDASYRNGCNDLSF-LZQZEXGQSA-N 1 1 373.453 2.981 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595790882 520727426 /nfs/dbraw/zinc/72/74/26/520727426.db2.gz ZJUCSCFRNMUJNU-JFIYKMOQSA-N 1 1 364.442 2.616 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000598620534 520748200 /nfs/dbraw/zinc/74/82/00/520748200.db2.gz YHWWAHNJYJVWJO-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+]Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000601342390 520748749 /nfs/dbraw/zinc/74/87/49/520748749.db2.gz WOXJWJXWXQPRJL-SNVBAGLBSA-N 1 1 367.452 2.652 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000598645779 520758325 /nfs/dbraw/zinc/75/83/25/520758325.db2.gz IBTUWDKYMAGNCT-AAEUAGOBSA-N 1 1 374.384 2.698 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc(O)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000595844209 520761239 /nfs/dbraw/zinc/76/12/39/520761239.db2.gz FWFLPKXZTWSEHV-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc(O)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000595844209 520761249 /nfs/dbraw/zinc/76/12/49/520761249.db2.gz FWFLPKXZTWSEHV-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000593144392 520777386 /nfs/dbraw/zinc/77/73/86/520777386.db2.gz BYYIWPXUMURWKI-MRXNPFEDSA-N 1 1 371.412 2.915 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C[N@H+]1C ZINC000593188461 520813217 /nfs/dbraw/zinc/81/32/17/520813217.db2.gz IAVSDAZCYPKBCI-AXFHLTTASA-N 1 1 370.247 2.910 20 5 FFBDMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601537539 520831424 /nfs/dbraw/zinc/83/14/24/520831424.db2.gz FOCMONVYCUGQFX-DLBZAZTESA-N 1 1 361.417 2.661 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCOCC3(CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000614222778 520857348 /nfs/dbraw/zinc/85/73/48/520857348.db2.gz AFCNIMCHCRCUJU-QGZVFWFLSA-N 1 1 359.426 2.593 20 5 FFBDMO O=C1[C@H]([N@H+]2CCOCC3(CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000614222778 520857353 /nfs/dbraw/zinc/85/73/53/520857353.db2.gz AFCNIMCHCRCUJU-QGZVFWFLSA-N 1 1 359.426 2.593 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000596038399 520870912 /nfs/dbraw/zinc/87/09/12/520870912.db2.gz MLGDROVDTOHFDR-APWZRJJASA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000596038399 520870918 /nfs/dbraw/zinc/87/09/18/520870918.db2.gz MLGDROVDTOHFDR-APWZRJJASA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1 ZINC000596039701 520872452 /nfs/dbraw/zinc/87/24/52/520872452.db2.gz RZXGQVCDWCCLEX-PKOBYXMFSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1 ZINC000596039701 520872457 /nfs/dbraw/zinc/87/24/57/520872457.db2.gz RZXGQVCDWCCLEX-PKOBYXMFSA-N 1 1 369.421 2.957 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859836 520876334 /nfs/dbraw/zinc/87/63/34/520876334.db2.gz OZFLFJRWAFCACV-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNc3cc[nH]c(=O)c3[N+](=O)[O-])c2)CCO1 ZINC000596087634 520904675 /nfs/dbraw/zinc/90/46/75/520904675.db2.gz IZAXVQHKBSGYID-CYBMUJFWSA-N 1 1 358.398 2.528 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNc3cc[nH]c(=O)c3[N+](=O)[O-])c2)CCO1 ZINC000596087634 520904681 /nfs/dbraw/zinc/90/46/81/520904681.db2.gz IZAXVQHKBSGYID-CYBMUJFWSA-N 1 1 358.398 2.528 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593320265 520908425 /nfs/dbraw/zinc/90/84/25/520908425.db2.gz BYFYCPUPOWDCCM-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593320265 520908429 /nfs/dbraw/zinc/90/84/29/520908429.db2.gz BYFYCPUPOWDCCM-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO NC(=O)c1cc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596109049 520917552 /nfs/dbraw/zinc/91/75/52/520917552.db2.gz ZUVDJZOMNTZFNA-MRXNPFEDSA-N 1 1 368.437 2.670 20 5 FFBDMO NC(=O)c1cc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596109047 520918247 /nfs/dbraw/zinc/91/82/47/520918247.db2.gz ZUVDJZOMNTZFNA-INIZCTEOSA-N 1 1 368.437 2.670 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596116944 520921307 /nfs/dbraw/zinc/92/13/07/520921307.db2.gz RVUZSPNHTHAHEK-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000596116944 520921316 /nfs/dbraw/zinc/92/13/16/520921316.db2.gz RVUZSPNHTHAHEK-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000601726307 520921974 /nfs/dbraw/zinc/92/19/74/520921974.db2.gz HTRCKZYBDHPGQG-MRXNPFEDSA-N 1 1 371.441 2.503 20 5 FFBDMO C[C@@H]1CN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O ZINC000596223946 520978668 /nfs/dbraw/zinc/97/86/68/520978668.db2.gz VDGPPOSKYPUAFT-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599066017 521010378 /nfs/dbraw/zinc/01/03/78/521010378.db2.gz NCRPIAIXEJOOEM-YQVWRLOYSA-N 1 1 360.410 2.969 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)[C@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599066018 521011222 /nfs/dbraw/zinc/01/12/22/521011222.db2.gz NCRPIAIXEJOOEM-ZHALLVOQSA-N 1 1 360.410 2.969 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000611182177 521027144 /nfs/dbraw/zinc/02/71/44/521027144.db2.gz XMDKSGFZKXTCGR-MRXNPFEDSA-N 1 1 356.426 2.601 20 5 FFBDMO Cc1nc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)ccc1[N+](=O)[O-] ZINC000593496583 521031329 /nfs/dbraw/zinc/03/13/29/521031329.db2.gz SNBAZHDMXYKIDF-RTBURBONSA-N 1 1 368.437 2.778 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596514871 521108143 /nfs/dbraw/zinc/10/81/43/521108143.db2.gz MAIBBIVJYJRRHH-QZTJIDSGSA-N 1 1 361.442 2.797 20 5 FFBDMO C[C@H](CNC(=O)c1c(Br)cccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000599303527 521138318 /nfs/dbraw/zinc/13/83/18/521138318.db2.gz RBJHTYMXXGFDRP-SECBINFHSA-N 1 1 356.220 2.570 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC000599311074 521142823 /nfs/dbraw/zinc/14/28/23/521142823.db2.gz CSANWFLQOFHWEV-UHFFFAOYSA-N 1 1 356.220 2.571 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735960 521182738 /nfs/dbraw/zinc/18/27/38/521182738.db2.gz AYJYDPNHUMBGQB-UNEWFSDZSA-N 1 1 353.850 2.967 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735960 521182744 /nfs/dbraw/zinc/18/27/44/521182744.db2.gz AYJYDPNHUMBGQB-UNEWFSDZSA-N 1 1 353.850 2.967 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000611553904 521216023 /nfs/dbraw/zinc/21/60/23/521216023.db2.gz ZGWGFUJGLVLXDZ-UHFFFAOYSA-N 1 1 369.421 2.957 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000611553904 521216025 /nfs/dbraw/zinc/21/60/25/521216025.db2.gz ZGWGFUJGLVLXDZ-UHFFFAOYSA-N 1 1 369.421 2.957 20 5 FFBDMO COC(=O)c1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000599433188 521219282 /nfs/dbraw/zinc/21/92/82/521219282.db2.gz CTHLXYIJOQDMQC-CQSZACIVSA-N 1 1 356.382 2.551 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)c1 ZINC000611582789 521237175 /nfs/dbraw/zinc/23/71/75/521237175.db2.gz ICUSJIAHXOUJMV-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000618806260 521246490 /nfs/dbraw/zinc/24/64/90/521246490.db2.gz PUJLJXFMYDPXSR-GFCCVEGCSA-N 1 1 360.336 2.507 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614717 521249226 /nfs/dbraw/zinc/24/92/26/521249226.db2.gz CLMDHNWBGLIFOZ-VXGBXAGGSA-N 1 1 355.341 2.553 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599567843 521304281 /nfs/dbraw/zinc/30/42/81/521304281.db2.gz POBTVZMUECJYRO-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599636266 521348640 /nfs/dbraw/zinc/34/86/40/521348640.db2.gz CGNJJEMYHXAJKW-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599636266 521348647 /nfs/dbraw/zinc/34/86/47/521348647.db2.gz CGNJJEMYHXAJKW-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599639700 521351961 /nfs/dbraw/zinc/35/19/61/521351961.db2.gz MZCJWPKRCFABJF-XAYKYTGQSA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(=O)[nH]n1 ZINC000599641285 521352787 /nfs/dbraw/zinc/35/27/87/521352787.db2.gz MOHIOGVKNZEJFI-MRXNPFEDSA-N 1 1 371.397 2.565 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2ncc(C)cn2)CC1 ZINC000594020515 521354982 /nfs/dbraw/zinc/35/49/82/521354982.db2.gz ZTEDRCUZQVNONV-UHFFFAOYSA-N 1 1 358.398 2.745 20 5 FFBDMO C[C@@H]1C[C@H](N(C)Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000602472320 521362631 /nfs/dbraw/zinc/36/26/31/521362631.db2.gz DZEJDPCQHDCLRZ-CRAIPNDOSA-N 1 1 357.458 2.813 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccnn3CC3CCC3)C2)nc1 ZINC000602474654 521366384 /nfs/dbraw/zinc/36/63/84/521366384.db2.gz QZHJFBFLGXKLFV-HNNXBMFYSA-N 1 1 356.430 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccnn3CC3CCC3)C2)nc1 ZINC000602474654 521366389 /nfs/dbraw/zinc/36/63/89/521366389.db2.gz QZHJFBFLGXKLFV-HNNXBMFYSA-N 1 1 356.430 2.673 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632103 521447984 /nfs/dbraw/zinc/44/79/84/521447984.db2.gz VOPBXQDGMXXZJO-BHYNMZESSA-N 1 1 357.332 2.699 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632103 521447994 /nfs/dbraw/zinc/44/79/94/521447994.db2.gz VOPBXQDGMXXZJO-BHYNMZESSA-N 1 1 357.332 2.699 20 5 FFBDMO Nc1c(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597093936 521499709 /nfs/dbraw/zinc/49/97/09/521499709.db2.gz CYBVNAUCLLCZOB-JQWIXIFHSA-N 1 1 353.810 2.579 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(c2cccc(F)c2F)CC1 ZINC000602837675 521562473 /nfs/dbraw/zinc/56/24/73/521562473.db2.gz YHSPDYYXAFUAGP-UHFFFAOYSA-N 1 1 365.384 2.590 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625866 719086926 /nfs/dbraw/zinc/08/69/26/719086926.db2.gz HESZIOCQDDWPKB-PKOBYXMFSA-N 1 1 368.437 2.637 20 5 FFBDMO CSc1nc(Cl)c([N+](=O)[O-])c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1 ZINC001164766339 721281612 /nfs/dbraw/zinc/28/16/12/721281612.db2.gz DPEZIVJTZHVYMP-UHFFFAOYSA-N 1 1 369.878 2.682 20 5 FFBDMO CC[N@@H+](CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000155169344 728822082 /nfs/dbraw/zinc/82/20/82/728822082.db2.gz TZKWDPIZGXEFJR-UHFFFAOYSA-N 1 1 371.235 2.963 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000898513777 735373480 /nfs/dbraw/zinc/37/34/80/735373480.db2.gz YEOKOPMMSHXVFA-HIFRSBDPSA-N 1 1 350.415 2.948 20 5 FFBDMO CC(C)[C@@H](CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000043331363 727969077 /nfs/dbraw/zinc/96/90/77/727969077.db2.gz OIDPKXYCSXRLEA-OAHLLOKOSA-N 1 1 370.837 2.727 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000112308698 728544724 /nfs/dbraw/zinc/54/47/24/728544724.db2.gz BHMGLKANPOBLLJ-UHFFFAOYSA-N 1 1 352.391 2.582 20 5 FFBDMO O=c1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc2sccn21 ZINC000130100433 728715148 /nfs/dbraw/zinc/71/51/48/728715148.db2.gz OXDRJRKKPQNXFF-UHFFFAOYSA-N 1 1 356.407 2.829 20 5 FFBDMO O=c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc2sccn21 ZINC000130100433 728715149 /nfs/dbraw/zinc/71/51/49/728715149.db2.gz OXDRJRKKPQNXFF-UHFFFAOYSA-N 1 1 356.407 2.829 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172179714 729021060 /nfs/dbraw/zinc/02/10/60/729021060.db2.gz SJKDWRQKKFTWCZ-QGZVFWFLSA-N 1 1 366.893 2.850 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1NC[C@H]1CCC[N@@H+]1CCCO ZINC000856761586 730355592 /nfs/dbraw/zinc/35/55/92/730355592.db2.gz RTRGGBZTVCDXHI-LLVKDONJSA-N 1 1 358.236 2.616 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860054504 730474568 /nfs/dbraw/zinc/47/45/68/730474568.db2.gz LWJIQMWPINJMLD-SNVBAGLBSA-N 1 1 350.400 2.739 20 5 FFBDMO COCCN(Cc1cccs1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867950673 731244832 /nfs/dbraw/zinc/24/48/32/731244832.db2.gz YOBOBMRSIKVGNA-KRWDZBQOSA-N 1 1 363.439 2.505 20 5 FFBDMO CCS[C@@H]1CC[C@H](N(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867962443 731246066 /nfs/dbraw/zinc/24/60/66/731246066.db2.gz BJGZQVZKZWSLTJ-YSVLISHTSA-N 1 1 351.472 2.901 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)CN1CCN(C)CC1 ZINC000872034653 731722988 /nfs/dbraw/zinc/72/29/88/731722988.db2.gz QCLZUCJJCVLHTR-ZIAGYGMSSA-N 1 1 352.504 2.603 20 5 FFBDMO C[C@@H](N[C@H]1CCN(C2CC[NH+](C)CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872036522 731723068 /nfs/dbraw/zinc/72/30/68/731723068.db2.gz TVSPWSXVCHGJPE-KGLIPLIRSA-N 1 1 350.438 2.553 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)CN1CCN(C)CC1 ZINC000872034652 731723118 /nfs/dbraw/zinc/72/31/18/731723118.db2.gz QCLZUCJJCVLHTR-UONOGXRCSA-N 1 1 352.504 2.603 20 5 FFBDMO C[C@@H]1CN(c2cc(Br)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000780655010 738565897 /nfs/dbraw/zinc/56/58/97/738565897.db2.gz NNJQBSHDMSXRQV-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000874830733 732104797 /nfs/dbraw/zinc/10/47/97/732104797.db2.gz SSOOZDBWODIGQO-ZIAGYGMSSA-N 1 1 355.797 2.625 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000877742369 732422335 /nfs/dbraw/zinc/42/23/35/732422335.db2.gz DABYVQCXJPUQLD-JSGCOSHPSA-N 1 1 354.248 2.883 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877834967 732444288 /nfs/dbraw/zinc/44/42/88/732444288.db2.gz CDHSIQWABNQIKT-NSHDSACASA-N 1 1 360.357 2.798 20 5 FFBDMO CN(Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@H+]1C ZINC000878722349 732583048 /nfs/dbraw/zinc/58/30/48/732583048.db2.gz FABKEAWCTBGHNL-LBPRGKRZSA-N 1 1 365.821 2.824 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC000879575734 732727433 /nfs/dbraw/zinc/72/74/33/732727433.db2.gz MYBKEAHCKURVSS-XHBSWPGZSA-N 1 1 366.849 2.601 20 5 FFBDMO COCC[N@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCOCC1 ZINC000879711073 732756681 /nfs/dbraw/zinc/75/66/81/732756681.db2.gz YDHXEYJQBXCRGG-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1Br)C1CCOCC1 ZINC000879711073 732756684 /nfs/dbraw/zinc/75/66/84/732756684.db2.gz YDHXEYJQBXCRGG-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008760 732818785 /nfs/dbraw/zinc/81/87/85/732818785.db2.gz HDKAYOSQULOXOA-KGLIPLIRSA-N 1 1 363.439 2.589 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H](O)c1cccc(Br)c1 ZINC000886247607 733765916 /nfs/dbraw/zinc/76/59/16/733765916.db2.gz VVEWWNYKXPSCEA-CQSZACIVSA-N 1 1 366.215 2.918 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H](O)c1cccc(Br)c1 ZINC000886247607 733765920 /nfs/dbraw/zinc/76/59/20/733765920.db2.gz VVEWWNYKXPSCEA-CQSZACIVSA-N 1 1 366.215 2.918 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000886829649 733846173 /nfs/dbraw/zinc/84/61/73/733846173.db2.gz DTAHCHCJZBRYFN-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098213 738823437 /nfs/dbraw/zinc/82/34/37/738823437.db2.gz HFYZFNMFWFTMRM-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098213 738823443 /nfs/dbraw/zinc/82/34/43/738823443.db2.gz HFYZFNMFWFTMRM-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO CSc1ccc(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928104549 738825633 /nfs/dbraw/zinc/82/56/33/738825633.db2.gz VZUWCALUWWYBQW-JSGCOSHPSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC000928104549 738825635 /nfs/dbraw/zinc/82/56/35/738825635.db2.gz VZUWCALUWWYBQW-JSGCOSHPSA-N 1 1 367.496 2.626 20 5 FFBDMO CCO/C=C/[C@@](O)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(F)(F)F ZINC000895710506 735044616 /nfs/dbraw/zinc/04/46/16/735044616.db2.gz MDKMZRYUWWTSOK-URWSZGRFSA-N 1 1 352.284 2.667 20 5 FFBDMO C[N@@H+]1CC[C@H]1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000928574885 738883966 /nfs/dbraw/zinc/88/39/66/738883966.db2.gz ZCTOBEHZBTYMQO-JTQLQIEISA-N 1 1 363.361 2.526 20 5 FFBDMO C[N@H+]1CC[C@H]1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000928574885 738883971 /nfs/dbraw/zinc/88/39/71/738883971.db2.gz ZCTOBEHZBTYMQO-JTQLQIEISA-N 1 1 363.361 2.526 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000749561896 735731411 /nfs/dbraw/zinc/73/14/11/735731411.db2.gz QOYJDUBXPUOMQY-OLZOCXBDSA-N 1 1 367.833 2.935 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000901135546 735748018 /nfs/dbraw/zinc/74/80/18/735748018.db2.gz ODPGEFWEANLYOW-GXFFZTMASA-N 1 1 355.797 2.944 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252895 735778947 /nfs/dbraw/zinc/77/89/47/735778947.db2.gz PKUKKXYVGVXWNF-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252895 735778950 /nfs/dbraw/zinc/77/89/50/735778950.db2.gz PKUKKXYVGVXWNF-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO COc1cc(F)c([N+](=O)[O-])c(N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000751947121 735939391 /nfs/dbraw/zinc/93/93/91/735939391.db2.gz PSKNWBQJCHGXHL-UHFFFAOYSA-N 1 1 355.410 2.537 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2ccc(S(C)(=O)=O)s2)cc([N+](=O)[O-])c1 ZINC000903157993 736044354 /nfs/dbraw/zinc/04/43/54/736044354.db2.gz PZBPSBHFKDTTDC-JTQLQIEISA-N 1 1 370.452 2.919 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000755036487 736228074 /nfs/dbraw/zinc/22/80/74/736228074.db2.gz XMGCQWZOWKJFLO-JTQLQIEISA-N 1 1 371.235 2.821 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906969754 736566610 /nfs/dbraw/zinc/56/66/10/736566610.db2.gz BETJTCRYMZUSDD-BZNIZROVSA-N 1 1 351.834 2.780 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000801864687 740659357 /nfs/dbraw/zinc/65/93/57/740659357.db2.gz PXWXJTUOAKZUHH-LBPRGKRZSA-N 1 1 352.410 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000766205925 737207657 /nfs/dbraw/zinc/20/76/57/737207657.db2.gz ATHJAKXEQPTYRY-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000766205925 737207660 /nfs/dbraw/zinc/20/76/60/737207660.db2.gz ATHJAKXEQPTYRY-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@@](O)(C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1)C(F)(F)F ZINC000767903887 737380969 /nfs/dbraw/zinc/38/09/69/737380969.db2.gz UVOBHSLAYRLFRM-LSDHHAIUSA-N 1 1 362.348 2.654 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000768110206 737398850 /nfs/dbraw/zinc/39/88/50/737398850.db2.gz PKLNYGCFZBVJTI-UHFFFAOYSA-N 1 1 355.385 2.925 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH+]1CCC(C2OCCO2)CC1 ZINC000769301123 737515774 /nfs/dbraw/zinc/51/57/74/737515774.db2.gz KLADHTUDXCJTJS-UHFFFAOYSA-N 1 1 371.231 2.942 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000770687269 737653007 /nfs/dbraw/zinc/65/30/07/737653007.db2.gz HONKFXBQUIVYRH-GFCCVEGCSA-N 1 1 355.803 2.571 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000770690346 737653726 /nfs/dbraw/zinc/65/37/26/737653726.db2.gz VNBQGIVZXZAGFZ-LBPRGKRZSA-N 1 1 355.803 2.571 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000771996173 737774198 /nfs/dbraw/zinc/77/41/98/737774198.db2.gz OKHGKLRZBKTNBK-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(Cc3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000814178252 741801100 /nfs/dbraw/zinc/80/11/00/741801100.db2.gz JAQRIZYRGWCTNL-HNNXBMFYSA-N 1 1 354.248 2.885 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@@H+]3CCC[C@H](C4OCCO4)C3)c2c(Cl)c1 ZINC000774634982 738007948 /nfs/dbraw/zinc/00/79/48/738007948.db2.gz GMJIJWJLVVCPBE-NSHDSACASA-N 1 1 366.805 2.640 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CCC[C@H](C4OCCO4)C3)c2c(Cl)c1 ZINC000774634982 738007952 /nfs/dbraw/zinc/00/79/52/738007952.db2.gz GMJIJWJLVVCPBE-NSHDSACASA-N 1 1 366.805 2.640 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c([N+](=O)[O-])c1 ZINC000931915141 739352284 /nfs/dbraw/zinc/35/22/84/739352284.db2.gz UXDWQKJSDWTYJZ-CYBMUJFWSA-N 1 1 361.295 2.560 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@]3(CC(F)(F)C3(F)F)C2)c([N+](=O)[O-])c1 ZINC000931915141 739352289 /nfs/dbraw/zinc/35/22/89/739352289.db2.gz UXDWQKJSDWTYJZ-CYBMUJFWSA-N 1 1 361.295 2.560 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[NH+](C2CCC2)CC1 ZINC000790272525 739431560 /nfs/dbraw/zinc/43/15/60/739431560.db2.gz RQPZABYERSMRDM-UHFFFAOYSA-N 1 1 353.806 2.709 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000933247689 739588771 /nfs/dbraw/zinc/58/87/71/739588771.db2.gz IENQQYLKYYLAPN-AWEZNQCLSA-N 1 1 368.865 2.849 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1 ZINC000791917806 739616433 /nfs/dbraw/zinc/61/64/33/739616433.db2.gz XPKFFNURYNLFPU-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000934547897 739802557 /nfs/dbraw/zinc/80/25/57/739802557.db2.gz JUFLACOLDFETPE-AWEZNQCLSA-N 1 1 351.422 2.761 20 5 FFBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000797076851 740210046 /nfs/dbraw/zinc/21/00/46/740210046.db2.gz JXJYFYIIHCPAEO-AWEZNQCLSA-N 1 1 350.415 2.525 20 5 FFBDMO O=C(CC[N@@H+]1CCC=C(Br)C1)Nc1ccccc1[N+](=O)[O-] ZINC000799328623 740409449 /nfs/dbraw/zinc/40/94/49/740409449.db2.gz QPMQRLMWCWWZBV-UHFFFAOYSA-N 1 1 354.204 2.908 20 5 FFBDMO O=C(CC[N@H+]1CCC=C(Br)C1)Nc1ccccc1[N+](=O)[O-] ZINC000799328623 740409451 /nfs/dbraw/zinc/40/94/51/740409451.db2.gz QPMQRLMWCWWZBV-UHFFFAOYSA-N 1 1 354.204 2.908 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810617907 741432900 /nfs/dbraw/zinc/43/29/00/741432900.db2.gz JAVBLSZNAPDEPR-SECBINFHSA-N 1 1 355.297 2.947 20 5 FFBDMO CC(C)CO[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171240 741684540 /nfs/dbraw/zinc/68/45/40/741684540.db2.gz HHNGUTFOZXIVOL-YOEHRIQHSA-N 1 1 350.415 2.773 20 5 FFBDMO CC(C)CO[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171240 741684541 /nfs/dbraw/zinc/68/45/41/741684541.db2.gz HHNGUTFOZXIVOL-YOEHRIQHSA-N 1 1 350.415 2.773 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000813634295 741741717 /nfs/dbraw/zinc/74/17/17/741741717.db2.gz HZZKXJCXPSTGTC-INIZCTEOSA-N 1 1 353.806 2.567 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)C2)C1 ZINC000815145234 741907143 /nfs/dbraw/zinc/90/71/43/741907143.db2.gz PUTUSNXMFFOGIK-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1n1cccn1 ZINC000815166949 741908332 /nfs/dbraw/zinc/90/83/32/741908332.db2.gz MXJVTHFXULKJHC-BZUAXINKSA-N 1 1 350.806 2.953 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC(=O)N(C)C)CC1 ZINC000815190418 741910724 /nfs/dbraw/zinc/91/07/24/741910724.db2.gz VXCSSXFOVYQSCP-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000815314224 741924515 /nfs/dbraw/zinc/92/45/15/741924515.db2.gz KLONPZJWRQQQBZ-MRXNPFEDSA-N 1 1 353.394 2.809 20 5 FFBDMO O=C(NC1CC[NH+](CCCc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002789069 742173779 /nfs/dbraw/zinc/17/37/79/742173779.db2.gz RVUBTEYGYDNGES-IAGOWNOFSA-N 1 1 365.861 2.518 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cc(Cl)c([N+](=O)[O-])cc1NC(C)=O ZINC000823277363 742871538 /nfs/dbraw/zinc/87/15/38/742871538.db2.gz UFBMQKJOFXJMBL-UHFFFAOYSA-N 1 1 370.837 2.668 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503874 742928560 /nfs/dbraw/zinc/92/85/60/742928560.db2.gz ZXLRLIPQCVBAEH-SJLPKXTDSA-N 1 1 350.415 2.682 20 5 FFBDMO CC[C@](C)(C(=O)OC)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000823503874 742928563 /nfs/dbraw/zinc/92/85/63/742928563.db2.gz ZXLRLIPQCVBAEH-SJLPKXTDSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC001045437069 743273951 /nfs/dbraw/zinc/27/39/51/743273951.db2.gz BWDLJHLPDUGIQY-GDBMZVCRSA-N 1 1 365.861 2.784 20 5 FFBDMO C[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CS1(=O)=O ZINC000827163980 743524118 /nfs/dbraw/zinc/52/41/18/743524118.db2.gz ALWWTXKBLMVTBT-KWQFWETISA-N 1 1 367.254 2.957 20 5 FFBDMO C[C@H]1CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000830082583 745303341 /nfs/dbraw/zinc/30/33/41/745303341.db2.gz JUYFXLRBHVPPAA-LBPRGKRZSA-N 1 1 366.849 2.603 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1C(F)(F)F ZINC000835458896 746017668 /nfs/dbraw/zinc/01/76/68/746017668.db2.gz VUIUGJHYCGMHPU-BFHYXJOUSA-N 1 1 358.316 2.911 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1C(F)(F)F ZINC000835458896 746017673 /nfs/dbraw/zinc/01/76/73/746017673.db2.gz VUIUGJHYCGMHPU-BFHYXJOUSA-N 1 1 358.316 2.911 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839417151 746825360 /nfs/dbraw/zinc/82/53/60/746825360.db2.gz YSRDSVKKBGCZKT-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839417151 746825366 /nfs/dbraw/zinc/82/53/66/746825366.db2.gz YSRDSVKKBGCZKT-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000839440441 746828640 /nfs/dbraw/zinc/82/86/40/746828640.db2.gz SQPZAIWMWWHZDD-LLVKDONJSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577696 746860683 /nfs/dbraw/zinc/86/06/83/746860683.db2.gz VJQFZAIMRAGMAF-HFAKWTLXSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839577696 746860686 /nfs/dbraw/zinc/86/06/86/746860686.db2.gz VJQFZAIMRAGMAF-HFAKWTLXSA-N 1 1 355.822 2.668 20 5 FFBDMO CSC[C@@H]1CCC[N@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078461 746993907 /nfs/dbraw/zinc/99/39/07/746993907.db2.gz UYJQAILBSDJWDJ-CXAGYDPISA-N 1 1 365.455 2.565 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078461 746993910 /nfs/dbraw/zinc/99/39/10/746993910.db2.gz UYJQAILBSDJWDJ-CXAGYDPISA-N 1 1 365.455 2.565 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCS(=O)(=O)C2CC2)c2ccccc2)c1 ZINC000840882318 747211919 /nfs/dbraw/zinc/21/19/19/747211919.db2.gz IRCCWRHEHOYCNZ-SFHVURJKSA-N 1 1 360.435 2.851 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](COC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000842831161 747701468 /nfs/dbraw/zinc/70/14/68/747701468.db2.gz QSDZNNRIRTUWAZ-GFCCVEGCSA-N 1 1 350.371 2.601 20 5 FFBDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000844388415 748019188 /nfs/dbraw/zinc/01/91/88/748019188.db2.gz YWMSPDDYQLJDQT-OCCSQVGLSA-N 1 1 353.394 2.952 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H](CC)CO1 ZINC000844388413 748019302 /nfs/dbraw/zinc/01/93/02/748019302.db2.gz YWMSPDDYQLJDQT-GXTWGEPZSA-N 1 1 353.394 2.952 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000846930023 748577990 /nfs/dbraw/zinc/57/79/90/748577990.db2.gz PQFLWNGSFMKQCB-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO C[N@H+]1CC[C@H](CCOC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000847825214 748790598 /nfs/dbraw/zinc/79/05/98/748790598.db2.gz PJVPZVFQOJHYKY-SNVBAGLBSA-N 1 1 357.204 2.856 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481177 748937074 /nfs/dbraw/zinc/93/70/74/748937074.db2.gz WGPRPBAMUSDAFB-IAGOWNOFSA-N 1 1 363.483 2.942 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCS1 ZINC000848481177 748937081 /nfs/dbraw/zinc/93/70/81/748937081.db2.gz WGPRPBAMUSDAFB-IAGOWNOFSA-N 1 1 363.483 2.942 20 5 FFBDMO CCOP(=O)(OCC)[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000851869764 749711895 /nfs/dbraw/zinc/71/18/95/749711895.db2.gz QEJDXQPHHXPMQZ-HNNXBMFYSA-N 1 1 358.331 2.537 20 5 FFBDMO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](O)C(F)(F)F ZINC000852035559 749757969 /nfs/dbraw/zinc/75/79/69/749757969.db2.gz ODSMYBVVTIMWQD-RYUDHWBXSA-N 1 1 351.281 2.540 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+](CCOCCO)C2CCC2)ccc1Br ZINC000852291343 749824857 /nfs/dbraw/zinc/82/48/57/749824857.db2.gz VLASREURMLMBGC-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895843990 970992167 /nfs/dbraw/zinc/99/21/67/970992167.db2.gz KWTSVFZGLBPDMO-QAPCUYQASA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@]2(C)C1 ZINC000871752798 1013054026 /nfs/dbraw/zinc/05/40/26/1013054026.db2.gz HCGFRKRJFSLQFC-OXJNMPFZSA-N 1 1 368.437 2.527 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000053709981 971879408 /nfs/dbraw/zinc/87/94/08/971879408.db2.gz UASYLJNHTKHAMO-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116004149 1032060430 /nfs/dbraw/zinc/06/04/30/1032060430.db2.gz HPPFOOXOVRZLSG-GOSISDBHSA-N 1 1 354.410 2.661 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116004149 1032060445 /nfs/dbraw/zinc/06/04/45/1032060445.db2.gz HPPFOOXOVRZLSG-GOSISDBHSA-N 1 1 354.410 2.661 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC001167100784 960046030 /nfs/dbraw/zinc/04/60/30/960046030.db2.gz MPCKFLBUHSYMMH-AWEZNQCLSA-N 1 1 356.382 2.551 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC001167100784 960046041 /nfs/dbraw/zinc/04/60/41/960046041.db2.gz MPCKFLBUHSYMMH-AWEZNQCLSA-N 1 1 356.382 2.551 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000825655093 1013368556 /nfs/dbraw/zinc/36/85/56/1013368556.db2.gz IDLFYHWTNAZEEN-GOSISDBHSA-N 1 1 368.437 2.827 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC001175300897 1013432999 /nfs/dbraw/zinc/43/29/99/1013432999.db2.gz IVEGPSZFKWUCFZ-PZROIBLQSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]([C@@H]2CCCO2)C1 ZINC000933181445 963676357 /nfs/dbraw/zinc/67/63/57/963676357.db2.gz QUJQXMHEDBSXKE-NXHRZFHOSA-N 1 1 362.426 2.570 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCN1C(=O)OC(C)(C)C ZINC000933468061 964429463 /nfs/dbraw/zinc/42/94/63/964429463.db2.gz QBKRQZHXFJPANS-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])s1 ZINC001213164962 967084853 /nfs/dbraw/zinc/08/48/53/967084853.db2.gz HGZUVNFJOLMCLE-LBPRGKRZSA-N 1 1 373.500 2.650 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(C)ccc2ccccc21 ZINC001480973926 969470582 /nfs/dbraw/zinc/47/05/82/969470582.db2.gz BPYFPMXRQVTXBY-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)ccc2ccccc21 ZINC001480973926 969470585 /nfs/dbraw/zinc/47/05/85/969470585.db2.gz BPYFPMXRQVTXBY-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)ccc2ccccc21 ZINC001480973926 969470588 /nfs/dbraw/zinc/47/05/88/969470588.db2.gz BPYFPMXRQVTXBY-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccc(C4CCCC4)cc3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001025775531 970416365 /nfs/dbraw/zinc/41/63/65/970416365.db2.gz FDXCAZLHGWKDSB-OBKDMQGPSA-N 1 1 369.465 2.556 20 5 FFBDMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc(C4CCCC4)cc3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-] ZINC001025775531 970416372 /nfs/dbraw/zinc/41/63/72/970416372.db2.gz FDXCAZLHGWKDSB-OBKDMQGPSA-N 1 1 369.465 2.556 20 5 FFBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccc(C4CCCC4)cc3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-] ZINC001025775531 970416378 /nfs/dbraw/zinc/41/63/78/970416378.db2.gz FDXCAZLHGWKDSB-OBKDMQGPSA-N 1 1 369.465 2.556 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000875631199 1014056400 /nfs/dbraw/zinc/05/64/00/1014056400.db2.gz XEYNOMPRBQWANP-AWEZNQCLSA-N 1 1 361.442 2.537 20 5 FFBDMO CC(=O)Oc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000125522455 1014061133 /nfs/dbraw/zinc/06/11/33/1014061133.db2.gz VIXSZFFNNNEDID-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)C(=O)Nc1ccccc1 ZINC001168074377 974186779 /nfs/dbraw/zinc/18/67/79/974186779.db2.gz RHECGGVEZBMMPU-AWEZNQCLSA-N 1 1 359.430 2.839 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c(C)cc1[N+](=O)[O-] ZINC001211765777 977852670 /nfs/dbraw/zinc/85/26/70/977852670.db2.gz BUCPGXXEILQCCC-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c(C)cc1[N+](=O)[O-] ZINC001211765777 977852678 /nfs/dbraw/zinc/85/26/78/977852678.db2.gz BUCPGXXEILQCCC-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126244396 977997749 /nfs/dbraw/zinc/99/77/49/977997749.db2.gz OPTXAPGLTMZHHX-NSHDSACASA-N 1 1 364.402 2.724 20 5 FFBDMO Cn1cc(C[NH+]2CCC([C@@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])n1 ZINC000877583101 1014634813 /nfs/dbraw/zinc/63/48/13/1014634813.db2.gz DITXRXPZPVMPAE-MRXNPFEDSA-N 1 1 366.368 2.552 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687089 1014677397 /nfs/dbraw/zinc/67/73/97/1014677397.db2.gz DBINMQBFJGUUFV-ZWKOTPCHSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877687089 1014677404 /nfs/dbraw/zinc/67/74/04/1014677404.db2.gz DBINMQBFJGUUFV-ZWKOTPCHSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691823 1014686255 /nfs/dbraw/zinc/68/62/55/1014686255.db2.gz PHGYJBMSLOFYRU-QZTJIDSGSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3C)Cc3cccnc3N2C1 ZINC000877691823 1014686260 /nfs/dbraw/zinc/68/62/60/1014686260.db2.gz PHGYJBMSLOFYRU-QZTJIDSGSA-N 1 1 368.437 2.908 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)C2)C1 ZINC000897848808 982536815 /nfs/dbraw/zinc/53/68/15/982536815.db2.gz BYWBEPVMRDQHOF-HXUWFJFHSA-N 1 1 368.437 2.888 20 5 FFBDMO COc1cc(C[NH2+]Cc2c(C)nc3ccccn32)c([N+](=O)[O-])cc1OC ZINC000898276632 982662759 /nfs/dbraw/zinc/66/27/59/982662759.db2.gz RTBOTIOIHZPWSW-UHFFFAOYSA-N 1 1 356.382 2.858 20 5 FFBDMO CC(C)COC1CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000054571406 983006143 /nfs/dbraw/zinc/00/61/43/983006143.db2.gz QVHYXSOKSHNPLY-UHFFFAOYSA-N 1 1 359.430 2.948 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000878286176 1014966583 /nfs/dbraw/zinc/96/65/83/1014966583.db2.gz KIVJQCXFWCXKHH-DLBZAZTESA-N 1 1 362.405 2.827 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC000913282208 984230734 /nfs/dbraw/zinc/23/07/34/984230734.db2.gz ZYYBTURIZAYNSC-CALCHBBNSA-N 1 1 369.368 2.610 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](C)c1cccc(N2CCOC2=O)c1 ZINC000878530097 1015088121 /nfs/dbraw/zinc/08/81/21/1015088121.db2.gz PHZQBKOMOPAOFW-ZDUSSCGKSA-N 1 1 373.413 2.749 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000311652741 986485752 /nfs/dbraw/zinc/48/57/52/986485752.db2.gz UNZVYTPBQZCPSV-UGSOOPFHSA-N 1 1 354.410 2.570 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@H](O)COCc1ccccc1 ZINC000114462503 987739967 /nfs/dbraw/zinc/73/99/67/987739967.db2.gz LIBILNCIWSUAMQ-SFHVURJKSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](O)COCc1ccccc1 ZINC000114462503 987739976 /nfs/dbraw/zinc/73/99/76/987739976.db2.gz LIBILNCIWSUAMQ-SFHVURJKSA-N 1 1 360.410 2.613 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000762638101 988544212 /nfs/dbraw/zinc/54/42/12/988544212.db2.gz AIQXIRNYLWIISA-SJLPKXTDSA-N 1 1 361.398 2.524 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)c(C)c1 ZINC000946589336 988766011 /nfs/dbraw/zinc/76/60/11/988766011.db2.gz SVIPNNKHYKJCMY-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c(C)c1 ZINC000946589336 988766022 /nfs/dbraw/zinc/76/60/22/988766022.db2.gz SVIPNNKHYKJCMY-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c(C)c1 ZINC000946589336 988766031 /nfs/dbraw/zinc/76/60/31/988766031.db2.gz SVIPNNKHYKJCMY-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000922748265 988864830 /nfs/dbraw/zinc/86/48/30/988864830.db2.gz QVPSERTXLJFFJN-OAHLLOKOSA-N 1 1 358.398 2.812 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000193913880 989106782 /nfs/dbraw/zinc/10/67/82/989106782.db2.gz ZJWDMYLIWWLTMP-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccc(C(F)F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034645958 990148567 /nfs/dbraw/zinc/14/85/67/990148567.db2.gz XNZYYNXZIJTHAW-KLHDSHLOSA-N 1 1 367.396 2.806 20 5 FFBDMO Cc1ccc(CC[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)cc1 ZINC001035186968 990409860 /nfs/dbraw/zinc/40/98/60/990409860.db2.gz NZKGOSPGSJMIBA-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccc(CC[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035186968 990409875 /nfs/dbraw/zinc/40/98/75/990409875.db2.gz NZKGOSPGSJMIBA-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccc(CC[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035186968 990409882 /nfs/dbraw/zinc/40/98/82/990409882.db2.gz NZKGOSPGSJMIBA-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO COc1cccc(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)c1[N+](=O)[O-] ZINC000194756883 990516557 /nfs/dbraw/zinc/51/65/57/990516557.db2.gz JZTUGKPWQJBUDQ-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO Cn1cc(C[NH2+]Cc2cc(C3CC3)n(C)n2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000922957142 990767781 /nfs/dbraw/zinc/76/77/81/990767781.db2.gz NWIXTMCYKNSCRQ-UHFFFAOYSA-N 1 1 366.425 2.896 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000195418494 990923787 /nfs/dbraw/zinc/92/37/87/990923787.db2.gz JMXHKDDSRSGITL-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000068085305 991331138 /nfs/dbraw/zinc/33/11/38/991331138.db2.gz JCRPMRWZUWLHJK-ZDUSSCGKSA-N 1 1 364.402 2.745 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C/C=C\c2ccccc2)CC1 ZINC001484135710 991407456 /nfs/dbraw/zinc/40/74/56/991407456.db2.gz GBAPFLMIQINRRV-IJKBJJPYSA-N 1 1 357.454 2.583 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)NCC(C)C)CC1 ZINC000747530564 994295600 /nfs/dbraw/zinc/29/56/00/994295600.db2.gz QGNSVKULUZXZLN-UHFFFAOYSA-N 1 1 363.458 2.978 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H](C3CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000880576016 1015875202 /nfs/dbraw/zinc/87/52/02/1015875202.db2.gz NOQFEIROKYOSLA-INIZCTEOSA-N 1 1 361.442 2.722 20 5 FFBDMO Nc1ccc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1[N+](=O)[O-] ZINC000809994748 994661262 /nfs/dbraw/zinc/66/12/62/994661262.db2.gz FVWRZHVFOKOFKG-QGZVFWFLSA-N 1 1 357.410 2.847 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000810618449 994839544 /nfs/dbraw/zinc/83/95/44/994839544.db2.gz QGIDCYDSCRGXNH-GFCCVEGCSA-N 1 1 369.381 2.746 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810842137 994949180 /nfs/dbraw/zinc/94/91/80/994949180.db2.gz SSPORWHEYPVCOI-CJNGLKHVSA-N 1 1 356.382 2.564 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000811583440 995189057 /nfs/dbraw/zinc/18/90/57/995189057.db2.gz HQXLTBWOPDYMSF-NSHDSACASA-N 1 1 366.418 2.970 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000747812618 995527342 /nfs/dbraw/zinc/52/73/42/995527342.db2.gz FDUNHRCVPQVODG-UHFFFAOYSA-N 1 1 365.393 2.651 20 5 FFBDMO C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@H]1C[N@H+](C)CCO1 ZINC000880709489 1015951539 /nfs/dbraw/zinc/95/15/39/1015951539.db2.gz NVOBHUWRGXKXNA-MLGOLLRUSA-N 1 1 364.446 2.733 20 5 FFBDMO C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1C(C)(C)C)[C@H]1C[N@@H+](C)CCO1 ZINC000880709489 1015951548 /nfs/dbraw/zinc/95/15/48/1015951548.db2.gz NVOBHUWRGXKXNA-MLGOLLRUSA-N 1 1 364.446 2.733 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495767 995572013 /nfs/dbraw/zinc/57/20/13/995572013.db2.gz XOOPITJFAOLCRZ-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495767 995572020 /nfs/dbraw/zinc/57/20/20/995572020.db2.gz XOOPITJFAOLCRZ-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO COCc1cncc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813174233 995634581 /nfs/dbraw/zinc/63/45/81/995634581.db2.gz SUZPHJDQARPAHD-SFHVURJKSA-N 1 1 371.393 2.568 20 5 FFBDMO COCc1cncc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813174233 995634583 /nfs/dbraw/zinc/63/45/83/995634583.db2.gz SUZPHJDQARPAHD-SFHVURJKSA-N 1 1 371.393 2.568 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825389871 997333307 /nfs/dbraw/zinc/33/33/07/997333307.db2.gz VZPUTLMCUBYERC-BJZITVGISA-N 1 1 369.421 2.580 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC000844948765 998268859 /nfs/dbraw/zinc/26/88/59/998268859.db2.gz GZIVRFMILJVJCD-SQFISAMPSA-N 1 1 361.442 2.567 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000731892162 998304272 /nfs/dbraw/zinc/30/42/72/998304272.db2.gz VTOJTYYNSRTUFV-UHFFFAOYSA-N 1 1 362.474 2.756 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2nc3ccccn3c2[N+](=O)[O-])[C@H](C)C1 ZINC000734483321 999294955 /nfs/dbraw/zinc/29/49/55/999294955.db2.gz YSZLMUOOXCPPMD-CABCVRRESA-N 1 1 361.446 2.791 20 5 FFBDMO Cn1cc(CN2CCCC[C@@]3(CC[NH2+]C3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000903959475 1016332908 /nfs/dbraw/zinc/33/29/08/1016332908.db2.gz IQVZTBXVHQJGKG-FQEVSTJZSA-N 1 1 369.469 2.961 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC000741014011 999700673 /nfs/dbraw/zinc/70/06/73/999700673.db2.gz QCWRCWKOGDXGLD-KRWDZBQOSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000742241815 999766020 /nfs/dbraw/zinc/76/60/20/999766020.db2.gz XKIOTIQFGTXVPJ-INIZCTEOSA-N 1 1 363.461 2.755 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1 ZINC000742397277 999772223 /nfs/dbraw/zinc/77/22/23/999772223.db2.gz FTDQVFYLAOKGCT-UHFFFAOYSA-N 1 1 362.430 2.862 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011031 1000015348 /nfs/dbraw/zinc/01/53/48/1000015348.db2.gz HLXXRBZEVGUMBL-ATNYBXOESA-N 1 1 353.463 2.811 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]21 ZINC001169010288 1000015413 /nfs/dbraw/zinc/01/54/13/1000015413.db2.gz CFLZMLIHLKPAHY-JJXSEGSLSA-N 1 1 353.463 2.763 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018473 1000017293 /nfs/dbraw/zinc/01/72/93/1000017293.db2.gz CNYAPEJHBNSURC-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018473 1000017295 /nfs/dbraw/zinc/01/72/95/1000017295.db2.gz CNYAPEJHBNSURC-IXDOHACOSA-N 1 1 362.474 2.674 20 5 FFBDMO O=C1c2cccc(F)c2CN1[C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169056296 1000019048 /nfs/dbraw/zinc/01/90/48/1000019048.db2.gz RGKAVOICKRGZRS-RBSFLKMASA-N 1 1 361.417 2.691 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2nc(C)ccc2[N+](=O)[O-])c2ccccc12 ZINC001169114215 1000026249 /nfs/dbraw/zinc/02/62/49/1000026249.db2.gz ICZHZRAZLXRXSO-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147145 1000434940 /nfs/dbraw/zinc/43/49/40/1000434940.db2.gz VHBXBWSJZMVTOP-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147145 1000434944 /nfs/dbraw/zinc/43/49/44/1000434944.db2.gz VHBXBWSJZMVTOP-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO C[N@@H+](CCOC(=O)c1cc([N+](=O)[O-])c(F)cc1N)Cc1ccc(F)cc1 ZINC000769117471 1000438610 /nfs/dbraw/zinc/43/86/10/1000438610.db2.gz UNVCGWISRVDAFJ-UHFFFAOYSA-N 1 1 365.336 2.744 20 5 FFBDMO CN(C)c1cc[nH+]c(NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000770445968 1000791838 /nfs/dbraw/zinc/79/18/38/1000791838.db2.gz OLYLMCZOHVLTIA-UHFFFAOYSA-N 1 1 370.335 2.994 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](F)C1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170516 1000838644 /nfs/dbraw/zinc/83/86/44/1000838644.db2.gz AKSHHPVAFBACPF-XJKSGUPXSA-N 1 1 353.419 2.603 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](F)C1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170516 1000838650 /nfs/dbraw/zinc/83/86/50/1000838650.db2.gz AKSHHPVAFBACPF-XJKSGUPXSA-N 1 1 353.419 2.603 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000786580966 1001600993 /nfs/dbraw/zinc/60/09/93/1001600993.db2.gz LTZHDKWZXCNNEK-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000786580966 1001600997 /nfs/dbraw/zinc/60/09/97/1001600997.db2.gz LTZHDKWZXCNNEK-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2c(F)cccc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001276199566 1016524961 /nfs/dbraw/zinc/52/49/61/1016524961.db2.gz ATPYPKADIAUZAJ-MLGOLLRUSA-N 1 1 367.396 2.539 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791390427 1002685516 /nfs/dbraw/zinc/68/55/16/1002685516.db2.gz GNMCFTHZJXAFLX-UHFFFAOYSA-N 1 1 374.416 2.957 20 5 FFBDMO COC(=O)CC[C@@H]1CC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352804 1003121841 /nfs/dbraw/zinc/12/18/41/1003121841.db2.gz QQPBAYFSRSSACT-ZIAGYGMSSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](Oc3nccc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001170356057 1003122463 /nfs/dbraw/zinc/12/24/63/1003122463.db2.gz VIMLCEKHFNDGGJ-PBHICJAKSA-N 1 1 372.425 2.786 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355047 1003123413 /nfs/dbraw/zinc/12/34/13/1003123413.db2.gz VJUYFCPGJUAIHZ-WBMJQRKESA-N 1 1 368.455 2.515 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355047 1003123421 /nfs/dbraw/zinc/12/34/21/1003123421.db2.gz VJUYFCPGJUAIHZ-WBMJQRKESA-N 1 1 368.455 2.515 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)CCOc1cccc([N+](=O)[O-])c1 ZINC001196166622 1003692563 /nfs/dbraw/zinc/69/25/63/1003692563.db2.gz MNSJWVKMVWFBGO-UHFFFAOYSA-N 1 1 353.419 2.820 20 5 FFBDMO CC(C)(C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1CCCC1 ZINC000805611191 1004071998 /nfs/dbraw/zinc/07/19/98/1004071998.db2.gz URYDPXFZMOAZMB-UHFFFAOYSA-N 1 1 360.370 2.562 20 5 FFBDMO O=C(CC[NH2+][C@@H](CO)c1c(F)cccc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC001192461007 1004177195 /nfs/dbraw/zinc/17/71/95/1004177195.db2.gz GQXZOTMTBPDLIJ-HNNXBMFYSA-N 1 1 365.336 2.525 20 5 FFBDMO CCN1C[C@@H](C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)Oc2ccccc21 ZINC000776277789 1005336225 /nfs/dbraw/zinc/33/62/25/1005336225.db2.gz SGYFBKCSWIFCGJ-MJGOQNOKSA-N 1 1 371.437 2.848 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776582267 1005962674 /nfs/dbraw/zinc/96/26/74/1005962674.db2.gz NPGYJZFWJWALEB-YOEHRIQHSA-N 1 1 363.458 2.503 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000852514278 1006061068 /nfs/dbraw/zinc/06/10/68/1006061068.db2.gz DWGUQWLZYQUOCP-SFTDATJTSA-N 1 1 369.465 2.877 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000852514975 1006061626 /nfs/dbraw/zinc/06/16/26/1006061626.db2.gz NIYWCCYIXXLQLR-NHCUHLMSSA-N 1 1 369.465 2.877 20 5 FFBDMO C[N@@H+](Cc1cn(C[C@H](O)c2cccc([N+](=O)[O-])c2)nn1)C1CCCCC1 ZINC000881411260 1006089824 /nfs/dbraw/zinc/08/98/24/1006089824.db2.gz XYWVRSJKWQNIDD-SFHVURJKSA-N 1 1 359.430 2.684 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498945 1006415451 /nfs/dbraw/zinc/41/54/51/1006415451.db2.gz SKLCGHZBNOFWCB-JKSUJKDBSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498945 1006415454 /nfs/dbraw/zinc/41/54/54/1006415454.db2.gz SKLCGHZBNOFWCB-JKSUJKDBSA-N 1 1 359.430 2.946 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853503307 1006416927 /nfs/dbraw/zinc/41/69/27/1006416927.db2.gz GJNSHIGOBAJSBA-LSDHHAIUSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3cccnc3)C2)nc1-c1ccccn1 ZINC000853517714 1006425643 /nfs/dbraw/zinc/42/56/43/1006425643.db2.gz BXOLFCWMDAKYRZ-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3cccnc3)C2)nc1-c1ccccn1 ZINC000853517714 1006425647 /nfs/dbraw/zinc/42/56/47/1006425647.db2.gz BXOLFCWMDAKYRZ-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)n2)c1 ZINC000853624885 1006481888 /nfs/dbraw/zinc/48/18/88/1006481888.db2.gz SOECQIKWDWCTDH-KDURUIRLSA-N 1 1 369.425 2.703 20 5 FFBDMO C[N@H+]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC12CCCCC2 ZINC000853656184 1006495313 /nfs/dbraw/zinc/49/53/13/1006495313.db2.gz KCRCTUFCNVJJMK-UHFFFAOYSA-N 1 1 358.442 2.934 20 5 FFBDMO Cc1noc(COC(=O)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000853898229 1006577015 /nfs/dbraw/zinc/57/70/15/1006577015.db2.gz GBBSORBSFYJULA-OAHLLOKOSA-N 1 1 359.382 2.847 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC001135059703 1006659726 /nfs/dbraw/zinc/65/97/26/1006659726.db2.gz OGWVPHGZKNTZTA-CUOATXAZSA-N 1 1 357.332 2.684 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1F ZINC000817182377 1007462412 /nfs/dbraw/zinc/46/24/12/1007462412.db2.gz PWKCJWSLQCKTKE-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO C[C@@H]1C[C@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000817376773 1007569386 /nfs/dbraw/zinc/56/93/86/1007569386.db2.gz CSGCWUUJURQOLU-HZSPNIEDSA-N 1 1 367.450 2.620 20 5 FFBDMO C[C@@H]1C[C@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000817376773 1007569395 /nfs/dbraw/zinc/56/93/95/1007569395.db2.gz CSGCWUUJURQOLU-HZSPNIEDSA-N 1 1 367.450 2.620 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000856354914 1007784780 /nfs/dbraw/zinc/78/47/80/1007784780.db2.gz MCXYNSOLRKRUGO-HNNXBMFYSA-N 1 1 370.365 2.507 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000856354914 1007784785 /nfs/dbraw/zinc/78/47/85/1007784785.db2.gz MCXYNSOLRKRUGO-HNNXBMFYSA-N 1 1 370.365 2.507 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000819410693 1008140972 /nfs/dbraw/zinc/14/09/72/1008140972.db2.gz KAKUEFVNOGFFGM-FQEVSTJZSA-N 1 1 370.453 2.882 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1cccn1 ZINC000821172197 1008427026 /nfs/dbraw/zinc/42/70/26/1008427026.db2.gz YZJUQPXHICBIBI-YOEHRIQHSA-N 1 1 358.398 2.560 20 5 FFBDMO C[C@@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1cccn1 ZINC000821172197 1008427028 /nfs/dbraw/zinc/42/70/28/1008427028.db2.gz YZJUQPXHICBIBI-YOEHRIQHSA-N 1 1 358.398 2.560 20 5 FFBDMO CCN1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC001177257212 1008542139 /nfs/dbraw/zinc/54/21/39/1008542139.db2.gz RFYIZVJMEMOLGP-INIZCTEOSA-N 1 1 372.469 2.970 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859613052 1008588748 /nfs/dbraw/zinc/58/87/48/1008588748.db2.gz VZKZAGFPRUOJHC-COXVUDFISA-N 1 1 364.442 2.928 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@]3(CO)CCC[C@@H]23)c([N+](=O)[O-])cc1OC(F)F ZINC000886623895 1008778593 /nfs/dbraw/zinc/77/85/93/1008778593.db2.gz RYEDDWAXYNONSF-NVXWUHKLSA-N 1 1 372.368 2.942 20 5 FFBDMO Cc1nc(C(C)C)oc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178458810 1008994476 /nfs/dbraw/zinc/99/44/76/1008994476.db2.gz ZNUPNICYMMKYFM-HUUCEWRRSA-N 1 1 366.462 2.538 20 5 FFBDMO C[N@H+]1CCN(CCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1(C)C ZINC000861526559 1009453252 /nfs/dbraw/zinc/45/32/52/1009453252.db2.gz VPQXCQXZAJHZBJ-UHFFFAOYSA-N 1 1 370.453 2.504 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C[C@]2(C)C1 ZINC000887926299 1009682424 /nfs/dbraw/zinc/68/24/24/1009682424.db2.gz CYBRSUOGOLEPCA-QRWLVFNGSA-N 1 1 366.421 2.681 20 5 FFBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000714037330 1010068915 /nfs/dbraw/zinc/06/89/15/1010068915.db2.gz SDRDASTYCIQCAS-UOIKSKOESA-N 1 1 355.369 2.594 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000863031982 1010085793 /nfs/dbraw/zinc/08/57/93/1010085793.db2.gz KOOMDEYOQKXCAI-CYBMUJFWSA-N 1 1 364.421 2.547 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCc2c(F)cc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000867975808 1011136838 /nfs/dbraw/zinc/13/68/38/1011136838.db2.gz AQXRBYDIERGVBU-GOSISDBHSA-N 1 1 361.348 2.632 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909134 1012074296 /nfs/dbraw/zinc/07/42/96/1012074296.db2.gz GMOSGWVORWQREV-CRAIPNDOSA-N 1 1 370.453 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@@H](OCC3CC3)[C@H]3COC[C@H]31)CC2 ZINC001172908126 1012079604 /nfs/dbraw/zinc/07/96/04/1012079604.db2.gz AYXOIYWZMCWSCE-GFOJFJKKSA-N 1 1 372.465 2.968 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC[C@H]1O ZINC001173009938 1012179445 /nfs/dbraw/zinc/17/94/45/1012179445.db2.gz KHCVIHFETVZBEJ-YVEFUNNKSA-N 1 1 369.412 2.935 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC(F)(F)[C@@H](CO)C2)c1F ZINC001173179411 1012322784 /nfs/dbraw/zinc/32/27/84/1012322784.db2.gz FMULNUFNLJJYQY-WDEREUQCSA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1F ZINC001173179411 1012322799 /nfs/dbraw/zinc/32/27/99/1012322799.db2.gz FMULNUFNLJJYQY-WDEREUQCSA-N 1 1 362.348 2.623 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173188132 1012328972 /nfs/dbraw/zinc/32/89/72/1012328972.db2.gz CRGUYOIDJLWRDB-NEPJUHHUSA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173196554 1012341329 /nfs/dbraw/zinc/34/13/29/1012341329.db2.gz NOQGTXRDUVVQTC-NEPJUHHUSA-N 1 1 354.378 2.701 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@@H]([C@H]2CCCCO2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870955488 1012649676 /nfs/dbraw/zinc/64/96/76/1012649676.db2.gz YLTRSEMUOHINBG-LSBZLQRGSA-N 1 1 361.442 2.576 20 5 FFBDMO CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc[nH+]1 ZINC000748584435 1017398796 /nfs/dbraw/zinc/39/87/96/1017398796.db2.gz IFUOAXRTHUMYPI-UHFFFAOYSA-N 1 1 355.398 2.908 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC[C@@H](OCC4CC4)C3)n2)c1 ZINC000777551832 1017682023 /nfs/dbraw/zinc/68/20/23/1017682023.db2.gz OLXDZTSNEGLCAW-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H](OCC4CC4)C3)n2)c1 ZINC000777551832 1017682033 /nfs/dbraw/zinc/68/20/33/1017682033.db2.gz OLXDZTSNEGLCAW-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000827925795 1019004158 /nfs/dbraw/zinc/00/41/58/1019004158.db2.gz CQJPKRPYDXLBSR-GUDVDZBRSA-N 1 1 367.405 2.577 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@](CO)(c3ccccc3)C2)cc1 ZINC000801581070 1019139715 /nfs/dbraw/zinc/13/97/15/1019139715.db2.gz ZKDRURBHKUPHMW-FQEVSTJZSA-N 1 1 356.422 3.000 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc2cc[nH]c2c1 ZINC000929164713 1019300006 /nfs/dbraw/zinc/30/00/06/1019300006.db2.gz LHBVQTCLNKKRFP-MRXNPFEDSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1ccc2cc[nH]c2c1 ZINC000929164713 1019300018 /nfs/dbraw/zinc/30/00/18/1019300018.db2.gz LHBVQTCLNKKRFP-MRXNPFEDSA-N 1 1 355.394 2.948 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C2CC(OCc3ccccc3)C2)CC1 ZINC000930681197 1020133073 /nfs/dbraw/zinc/13/30/73/1020133073.db2.gz SQQWUPSQQOSGMN-UHFFFAOYSA-N 1 1 368.437 2.860 20 5 FFBDMO CCOC(=O)/C=C/C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000930809326 1020198020 /nfs/dbraw/zinc/19/80/20/1020198020.db2.gz LZHWQVCGEMAKKR-HGQRNUMOSA-N 1 1 362.426 2.820 20 5 FFBDMO CCOC(=O)/C=C/C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000930809326 1020198025 /nfs/dbraw/zinc/19/80/25/1020198025.db2.gz LZHWQVCGEMAKKR-HGQRNUMOSA-N 1 1 362.426 2.820 20 5 FFBDMO NC(=O)COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000749528233 1021002589 /nfs/dbraw/zinc/00/25/89/1021002589.db2.gz AIPURLJVUSGNTJ-UHFFFAOYSA-N 1 1 355.394 2.624 20 5 FFBDMO NC(=O)COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000749528233 1021002594 /nfs/dbraw/zinc/00/25/94/1021002594.db2.gz AIPURLJVUSGNTJ-UHFFFAOYSA-N 1 1 355.394 2.624 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)c1 ZINC000749686321 1021019985 /nfs/dbraw/zinc/01/99/85/1021019985.db2.gz HNVWGXFIEVZSLK-FUHIMQAGSA-N 1 1 353.422 2.696 20 5 FFBDMO COc1ccc(CSCC(=O)Nc2cc(C)[nH+]c(C)c2)cc1[N+](=O)[O-] ZINC001116496150 1021246963 /nfs/dbraw/zinc/24/69/63/1021246963.db2.gz TVUSZBBNEQVZDO-UHFFFAOYSA-N 1 1 361.423 2.909 20 5 FFBDMO Cc1cccc(NCCNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)[nH+]1 ZINC000750171422 1021466994 /nfs/dbraw/zinc/46/69/94/1021466994.db2.gz ICGMPAMGNJNYNG-UHFFFAOYSA-N 1 1 357.370 2.779 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000778840100 1022429627 /nfs/dbraw/zinc/42/96/27/1022429627.db2.gz BIVXPJIGZVKDCY-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO Cc1noc(C)c1C[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000117335312 1022457241 /nfs/dbraw/zinc/45/72/41/1022457241.db2.gz FIDKPMSBCCONIE-UHFFFAOYSA-N 1 1 360.370 2.630 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCc2cc(F)c(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC001119318066 1022678794 /nfs/dbraw/zinc/67/87/94/1022678794.db2.gz RRKSAFUQZCTHJW-SFHVURJKSA-N 1 1 361.348 2.632 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351089 1033113735 /nfs/dbraw/zinc/11/37/35/1033113735.db2.gz SRNHDZKCHZBUFO-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351089 1033113746 /nfs/dbraw/zinc/11/37/46/1033113746.db2.gz SRNHDZKCHZBUFO-VLIAUNLRSA-N 1 1 369.421 2.688 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001123268822 1023715980 /nfs/dbraw/zinc/71/59/80/1023715980.db2.gz UIQDHYDADBXENI-WFASDCNBSA-N 1 1 350.419 2.797 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000756953721 1023773727 /nfs/dbraw/zinc/77/37/27/1023773727.db2.gz QBLZZGWHZPYUTK-HNNXBMFYSA-N 1 1 372.381 2.902 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000756953721 1023773733 /nfs/dbraw/zinc/77/37/33/1023773733.db2.gz QBLZZGWHZPYUTK-HNNXBMFYSA-N 1 1 372.381 2.902 20 5 FFBDMO CCn1c(C[NH+]2CCCC2)nnc1N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001121768544 1023993473 /nfs/dbraw/zinc/99/34/73/1023993473.db2.gz KWPGLOSDCPRILE-UHFFFAOYSA-N 1 1 370.457 2.971 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)NCc4ccccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001121845657 1024098114 /nfs/dbraw/zinc/09/81/14/1024098114.db2.gz ZDSBSOLYPPLZMS-KDURUIRLSA-N 1 1 358.442 2.612 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@H]2C1 ZINC001124004205 1024217427 /nfs/dbraw/zinc/21/74/27/1024217427.db2.gz UWAMOBIPLHOQMG-XIRDDKMYSA-N 1 1 366.421 2.727 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000838101762 1026208063 /nfs/dbraw/zinc/20/80/63/1026208063.db2.gz LPAVEIJJGHNDBM-HNNXBMFYSA-N 1 1 358.398 2.812 20 5 FFBDMO O=c1c2ccc[nH]c-2cn1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000840126065 1026968249 /nfs/dbraw/zinc/96/82/49/1026968249.db2.gz NYKOQECVAITLTO-OAHLLOKOSA-N 1 1 352.394 2.783 20 5 FFBDMO O=c1c2ccc[nH]c-2cn1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000840126065 1026968257 /nfs/dbraw/zinc/96/82/57/1026968257.db2.gz NYKOQECVAITLTO-OAHLLOKOSA-N 1 1 352.394 2.783 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCC(=O)Nc2ccc(F)cc2)ncc1[N+](=O)[O-] ZINC001161349085 1028143275 /nfs/dbraw/zinc/14/32/75/1028143275.db2.gz XULRHYSUEBRNFC-BQYQJAHWSA-N 1 1 359.361 2.712 20 5 FFBDMO COc1cc(C)[nH]c(=O)c1CNc1cc(C=C[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001161741178 1028299219 /nfs/dbraw/zinc/29/92/19/1028299219.db2.gz AOYIBBUEBJCQHH-AATRIKPKSA-N 1 1 359.386 2.552 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CCc1ccccc1)CC2 ZINC000957548013 1028324285 /nfs/dbraw/zinc/32/42/85/1028324285.db2.gz WYBVQVSMBNXOFP-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001154713357 1028419162 /nfs/dbraw/zinc/41/91/62/1028419162.db2.gz JPGIVEWQERUMPZ-BASYENTBSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001154713357 1028419170 /nfs/dbraw/zinc/41/91/70/1028419170.db2.gz JPGIVEWQERUMPZ-BASYENTBSA-N 1 1 363.458 2.906 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796117420 1028480147 /nfs/dbraw/zinc/48/01/47/1028480147.db2.gz ZHLWJBJZRPRSBA-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796117420 1028480152 /nfs/dbraw/zinc/48/01/52/1028480152.db2.gz ZHLWJBJZRPRSBA-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO CCOc1nc(N2CC[N@@H+]3CCc4ccccc4[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001155094377 1028576565 /nfs/dbraw/zinc/57/65/65/1028576565.db2.gz ASMYPGOUQGFXBM-KRWDZBQOSA-N 1 1 354.410 2.808 20 5 FFBDMO CCOc1nc(N2CC[N@H+]3CCc4ccccc4[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001155094377 1028576569 /nfs/dbraw/zinc/57/65/69/1028576569.db2.gz ASMYPGOUQGFXBM-KRWDZBQOSA-N 1 1 354.410 2.808 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]([NH3+])CNc1cc2ccc(Cl)nc2cc1[N+](=O)[O-] ZINC001162855709 1028680932 /nfs/dbraw/zinc/68/09/32/1028680932.db2.gz JQCOTCOWUJOMPT-JTQLQIEISA-N 1 1 366.805 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2Cc3c[nH+]cn3C2)nc1OCc1ccccc1 ZINC001163832056 1029082968 /nfs/dbraw/zinc/08/29/68/1029082968.db2.gz VYWUQPUSDXGFMJ-CQSZACIVSA-N 1 1 351.366 2.802 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001156316648 1029140998 /nfs/dbraw/zinc/14/09/98/1029140998.db2.gz HIXCKAVUGPEHOW-QILLFSRXSA-N 1 1 353.426 2.895 20 5 FFBDMO CN(C)C1(CNc2ncc(F)c3cc([N+](=O)[O-])ccc32)CC[NH+](C)CC1 ZINC001164211041 1029202076 /nfs/dbraw/zinc/20/20/76/1029202076.db2.gz LBXGSGWCWBVZMD-UHFFFAOYSA-N 1 1 361.421 2.720 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494553 1029296998 /nfs/dbraw/zinc/29/69/98/1029296998.db2.gz LXOMSEKAMNUSMW-RTBURBONSA-N 1 1 367.449 2.881 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)nc1N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001165086691 1029374623 /nfs/dbraw/zinc/37/46/23/1029374623.db2.gz OAJMABLYWAEDDP-HIFRSBDPSA-N 1 1 359.817 2.749 20 5 FFBDMO CCC[C@H]1CN(C(=O)OC(C)(C)C)CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000782095208 1029566322 /nfs/dbraw/zinc/56/63/22/1029566322.db2.gz JKESWYJSDQUMAP-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO CCC[C@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000782095208 1029566327 /nfs/dbraw/zinc/56/63/27/1029566327.db2.gz JKESWYJSDQUMAP-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO C[C@@H]1C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@H]1c1ccccc1 ZINC000782860314 1029839734 /nfs/dbraw/zinc/83/97/34/1029839734.db2.gz FYPUMDGILVBQMZ-KBXCAEBGSA-N 1 1 369.425 2.605 20 5 FFBDMO O=C1N(C[NH+]2CCC([C@@H]3CCOC3)CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000784004029 1030409271 /nfs/dbraw/zinc/40/92/71/1030409271.db2.gz AXABFMJKVYMUOV-MRXNPFEDSA-N 1 1 374.441 2.543 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC([C@H]4CCOC4)CC3)n2)c1 ZINC000784005596 1030409910 /nfs/dbraw/zinc/40/99/10/1030409910.db2.gz PHQNKWLWVXUPQW-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1Cn1cc([N+](=O)[O-])c(-c3ccncc3)n1)CCOCC2 ZINC000842637986 1030866524 /nfs/dbraw/zinc/86/65/24/1030866524.db2.gz HMGUKYRTJKOTEZ-AWEZNQCLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=c1[nH]c2cccc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2o1 ZINC001204305418 1031219692 /nfs/dbraw/zinc/21/96/92/1031219692.db2.gz BSXUYJDIVAXPBI-LBPRGKRZSA-N 1 1 355.354 2.523 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC001149840500 1031605546 /nfs/dbraw/zinc/60/55/46/1031605546.db2.gz YEHCRRSJKMZUCT-KRWDZBQOSA-N 1 1 368.437 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799192001 1031689392 /nfs/dbraw/zinc/68/93/92/1031689392.db2.gz WKWLTYFWOVSWAE-ZIAGYGMSSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799192001 1031689402 /nfs/dbraw/zinc/68/94/02/1031689402.db2.gz WKWLTYFWOVSWAE-ZIAGYGMSSA-N 1 1 370.409 2.815 20 5 FFBDMO O=C(NCC1([NH2+]C/C=C/c2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115529414 1031787424 /nfs/dbraw/zinc/78/74/24/1031787424.db2.gz RAXUOBLKIGOENF-CVRCPQJVSA-N 1 1 357.454 2.774 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000830189216 1033501255 /nfs/dbraw/zinc/50/12/55/1033501255.db2.gz BZTABLROWSTWDL-HZSPNIEDSA-N 1 1 367.450 2.510 20 5 FFBDMO C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000830189216 1033501267 /nfs/dbraw/zinc/50/12/67/1033501267.db2.gz BZTABLROWSTWDL-HZSPNIEDSA-N 1 1 367.450 2.510 20 5 FFBDMO O=c1cc[nH]c(O[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c1[N+](=O)[O-] ZINC001225664527 1034358667 /nfs/dbraw/zinc/35/86/67/1034358667.db2.gz QCENFWHHGIUHTC-YQQAZPJKSA-N 1 1 355.394 2.985 20 5 FFBDMO O=[N+]([O-])c1cccc(O)c1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226334006 1034632750 /nfs/dbraw/zinc/63/27/50/1034632750.db2.gz QHBVXFNJFOBDGU-INIZCTEOSA-N 1 1 358.394 2.970 20 5 FFBDMO COC(=O)C1=C[C@H](Oc2cccc([N+](=O)[O-])c2)C[N@@H+](Cc2ccccc2)C1 ZINC001226768832 1034829681 /nfs/dbraw/zinc/82/96/81/1034829681.db2.gz UDAPOTMIAXIQFZ-IBGZPJMESA-N 1 1 368.389 2.957 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@@H](Oc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC001227521509 1035594767 /nfs/dbraw/zinc/59/47/67/1035594767.db2.gz RSMYIHYUSBUIMP-HOCLYGCPSA-N 1 1 363.414 2.667 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[O-] ZINC001228809488 1036335372 /nfs/dbraw/zinc/33/53/72/1036335372.db2.gz GHAUNSSUBWTSGR-CQSZACIVSA-N 1 1 372.377 2.740 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1O ZINC001228809488 1036335408 /nfs/dbraw/zinc/33/54/08/1036335408.db2.gz GHAUNSSUBWTSGR-CQSZACIVSA-N 1 1 372.377 2.740 20 5 FFBDMO C[C@@H](Oc1cc([N+](=O)[O-])ccc1[O-])[C@@H]1CN(Cc2ccccc2)CCO1 ZINC001229396694 1036649127 /nfs/dbraw/zinc/64/91/27/1036649127.db2.gz WPKKCSCERXZHIX-KUHUBIRLSA-N 1 1 358.394 2.969 20 5 FFBDMO COC(=O)c1cnc(OC2CCN(c3ccc(C)c[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC001233866719 1036796696 /nfs/dbraw/zinc/79/66/96/1036796696.db2.gz POUYMSYAJPVNJV-UHFFFAOYSA-N 1 1 372.381 2.528 20 5 FFBDMO C[NH+]1CCN(c2ncc(-c3ccc4ccc5cccnc5c4n3)cn2)CC1 ZINC001235914351 1037826308 /nfs/dbraw/zinc/82/63/08/1037826308.db2.gz OQDFVMQYQIJQRJ-UHFFFAOYSA-N 1 1 356.433 2.992 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](O)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093261 1038380479 /nfs/dbraw/zinc/38/04/79/1038380479.db2.gz JAFGXVLEWZGMHG-KBXCAEBGSA-N 1 1 363.458 2.665 20 5 FFBDMO CC[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@H]1CCCNC1 ZINC001246854254 1039505587 /nfs/dbraw/zinc/50/55/87/1039505587.db2.gz NYRLCXQBVHUEKY-AWEZNQCLSA-N 1 1 368.428 2.916 20 5 FFBDMO CC[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@H]1CCCNC1 ZINC001246854254 1039505590 /nfs/dbraw/zinc/50/55/90/1039505590.db2.gz NYRLCXQBVHUEKY-AWEZNQCLSA-N 1 1 368.428 2.916 20 5 FFBDMO [NH3+]C1(c2nc(-c3ccc4ccc5cccnc5c4n3)no2)CCC(O)CC1 ZINC001248281960 1040207757 /nfs/dbraw/zinc/20/77/57/1040207757.db2.gz WWVMZOPVIAUQST-UHFFFAOYSA-N 1 1 361.405 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCC[C@@](O)(CF)C3)CC2)cc1 ZINC001254474089 1040738456 /nfs/dbraw/zinc/73/84/56/1040738456.db2.gz LOBOCGUKIFLBOZ-GOSISDBHSA-N 1 1 351.422 2.750 20 5 FFBDMO COC(=O)[C@@H]1CC[C@@H](C)[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254473858 1040740453 /nfs/dbraw/zinc/74/04/53/1040740453.db2.gz IPFRDRVPMWQSFN-HUUCEWRRSA-N 1 1 361.442 2.837 20 5 FFBDMO CCOC(=O)[C@@]12CCO[C@@H]1CC[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254551445 1040791740 /nfs/dbraw/zinc/79/17/40/1040791740.db2.gz BCJLPCKNZFSUFU-POZUXBRTSA-N 1 1 362.426 2.570 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)OC(C)(C)C ZINC001254551513 1040793406 /nfs/dbraw/zinc/79/34/06/1040793406.db2.gz CMZMNSIBRJEHRP-MKVSYHDVSA-N 1 1 361.442 2.981 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561513 1040799526 /nfs/dbraw/zinc/79/95/26/1040799526.db2.gz LVDIJLGIFAJAQV-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561513 1040799535 /nfs/dbraw/zinc/79/95/35/1040799535.db2.gz LVDIJLGIFAJAQV-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOCc1ncn2c1C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)CCC2 ZINC001254596585 1040824311 /nfs/dbraw/zinc/82/43/11/1040824311.db2.gz PDWJQUGQOMNQHD-KRWDZBQOSA-N 1 1 356.426 2.701 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595830 1040825384 /nfs/dbraw/zinc/82/53/84/1040825384.db2.gz NKATXSABTHLIGP-SFHVURJKSA-N 1 1 369.469 2.615 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596890 1040826131 /nfs/dbraw/zinc/82/61/31/1040826131.db2.gz QRRCHSZXAQXTGV-FUHWJXTLSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596890 1040826149 /nfs/dbraw/zinc/82/61/49/1040826149.db2.gz QRRCHSZXAQXTGV-FUHWJXTLSA-N 1 1 370.453 2.914 20 5 FFBDMO COC(=O)[C@H](Cc1ccccc1)[N@H+](C)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609254 1040837449 /nfs/dbraw/zinc/83/74/49/1040837449.db2.gz UPXSACGAYLGXFU-OALUTQOASA-N 1 1 354.406 2.778 20 5 FFBDMO COC(=O)[C@H](Cc1ccccc1)[N@@H+](C)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609254 1040837454 /nfs/dbraw/zinc/83/74/54/1040837454.db2.gz UPXSACGAYLGXFU-OALUTQOASA-N 1 1 354.406 2.778 20 5 FFBDMO COc1ccnc(N([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C2CC[NH2+]CC2)c1 ZINC001254610556 1040839454 /nfs/dbraw/zinc/83/94/54/1040839454.db2.gz KXWHRSATCLBPEK-SFHVURJKSA-N 1 1 368.437 2.724 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC001319485171 1045167437 /nfs/dbraw/zinc/16/74/37/1045167437.db2.gz LVSGIQFSJCEXFZ-APWZRJJASA-N 1 1 372.400 2.707 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001318487850 1045312532 /nfs/dbraw/zinc/31/25/32/1045312532.db2.gz WIZFLGZNBPGBTH-GOSISDBHSA-N 1 1 354.410 2.661 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001318487850 1045312541 /nfs/dbraw/zinc/31/25/41/1045312541.db2.gz WIZFLGZNBPGBTH-GOSISDBHSA-N 1 1 354.410 2.661 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+](C)CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001319999134 1045323191 /nfs/dbraw/zinc/32/31/91/1045323191.db2.gz AWNFZEFSGCDBFB-IEBWSBKVSA-N 1 1 355.438 2.704 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001319999134 1045323199 /nfs/dbraw/zinc/32/31/99/1045323199.db2.gz AWNFZEFSGCDBFB-IEBWSBKVSA-N 1 1 355.438 2.704 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001319999134 1045323206 /nfs/dbraw/zinc/32/32/06/1045323206.db2.gz AWNFZEFSGCDBFB-IEBWSBKVSA-N 1 1 355.438 2.704 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@@H]3CCCC[C@@H]3C2)cc1 ZINC001320887278 1045488327 /nfs/dbraw/zinc/48/83/27/1045488327.db2.gz BOPSFMMYMNNIRX-LSDHHAIUSA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)cc1 ZINC001320887278 1045488330 /nfs/dbraw/zinc/48/83/30/1045488330.db2.gz BOPSFMMYMNNIRX-LSDHHAIUSA-N 1 1 352.456 2.881 20 5 FFBDMO Cc1noc([C@@H]([NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC001474763194 1045852148 /nfs/dbraw/zinc/85/21/48/1045852148.db2.gz ZHTAUKPMIISQOB-ZBEGNZNMSA-N 1 1 361.402 2.990 20 5 FFBDMO COC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001324315475 1045966420 /nfs/dbraw/zinc/96/64/20/1045966420.db2.gz ZQHLFEIRVWLPQD-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001331535493 1047990010 /nfs/dbraw/zinc/99/00/10/1047990010.db2.gz GWATXKDHEQRAOB-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001332911453 1048618010 /nfs/dbraw/zinc/61/80/10/1048618010.db2.gz JDZPKTIYFWELES-QWHCGFSZSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC001333160114 1048737294 /nfs/dbraw/zinc/73/72/94/1048737294.db2.gz UHBYEPDVZJWMRB-ZDUSSCGKSA-N 1 1 351.834 2.878 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC001333311241 1048828028 /nfs/dbraw/zinc/82/80/28/1048828028.db2.gz GITLHQGWESPQCH-ZBFHGGJFSA-N 1 1 351.834 2.924 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001333897297 1049162371 /nfs/dbraw/zinc/16/23/71/1049162371.db2.gz HZRRJFQBJYHFOX-UHFFFAOYSA-N 1 1 360.380 2.687 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC001475349099 1049162969 /nfs/dbraw/zinc/16/29/69/1049162969.db2.gz UGHQTHWDEQXINX-CYBMUJFWSA-N 1 1 357.476 2.610 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC001296127553 1050027219 /nfs/dbraw/zinc/02/72/19/1050027219.db2.gz PXDUFTHJAOBMBH-KRWDZBQOSA-N 1 1 374.485 2.800 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001302725271 1051184777 /nfs/dbraw/zinc/18/47/77/1051184777.db2.gz RWIWFICDJPBEAV-KRWDZBQOSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001305057852 1051793360 /nfs/dbraw/zinc/79/33/60/1051793360.db2.gz DGNNUBHPGFCJFP-OAHLLOKOSA-N 1 1 370.457 2.938 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C1CCCC1 ZINC001307210656 1052268574 /nfs/dbraw/zinc/26/85/74/1052268574.db2.gz UFPGRWWTDFDKRM-CQSZACIVSA-N 1 1 372.469 2.940 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1 ZINC001308079618 1052401147 /nfs/dbraw/zinc/40/11/47/1052401147.db2.gz NUHQLCKUGWBFMS-AWEZNQCLSA-N 1 1 361.442 2.830 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283579 1052441421 /nfs/dbraw/zinc/44/14/21/1052441421.db2.gz ZIFKFDVGXSQFAR-AZUAARDMSA-N 1 1 355.438 2.567 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1 ZINC001308283579 1052441423 /nfs/dbraw/zinc/44/14/23/1052441423.db2.gz ZIFKFDVGXSQFAR-AZUAARDMSA-N 1 1 355.438 2.567 20 5 FFBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CCC[C@H](CCF)C1 ZINC001347239003 1053747063 /nfs/dbraw/zinc/74/70/63/1053747063.db2.gz TWKOMCRUXTUNNF-DYVFJYSZSA-N 1 1 351.378 2.561 20 5 FFBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@H](CCF)C1 ZINC001347239003 1053747075 /nfs/dbraw/zinc/74/70/75/1053747075.db2.gz TWKOMCRUXTUNNF-DYVFJYSZSA-N 1 1 351.378 2.561 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c2ncc([N+](=O)[O-])cc12 ZINC001347244909 1053753651 /nfs/dbraw/zinc/75/36/51/1053753651.db2.gz WPHNJLNRLUZLGG-WMLDXEAASA-N 1 1 359.430 2.887 20 5 FFBDMO CNc1c(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cccc1[N+](=O)[O-] ZINC001336308664 1053916274 /nfs/dbraw/zinc/91/62/74/1053916274.db2.gz IDGGTQWLIBIWCU-KDURUIRLSA-N 1 1 358.442 2.585 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC001336744016 1054186570 /nfs/dbraw/zinc/18/65/70/1054186570.db2.gz CGEYIBJPISZKDL-JTQLQIEISA-N 1 1 374.210 2.711 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001352452856 1055489166 /nfs/dbraw/zinc/48/91/66/1055489166.db2.gz LNRGNUHRTYRAJR-XHSDSOJGSA-N 1 1 372.473 2.735 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC001350857290 1055969495 /nfs/dbraw/zinc/96/94/95/1055969495.db2.gz ZWCMYRCSAVIGMN-MRXNPFEDSA-N 1 1 367.405 2.985 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc2ccccc2c1[N+](=O)[O-] ZINC001544237541 1071616691 /nfs/dbraw/zinc/61/66/91/1071616691.db2.gz JLCYKGFSRZCSPM-HZPDHXFCSA-N 1 1 354.410 2.687 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001339454189 1056470639 /nfs/dbraw/zinc/47/06/39/1056470639.db2.gz HMXAWZDAEQQNGH-WBVHZDCISA-N 1 1 372.473 2.564 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Oc2cccc([N+](=O)[O-])c2)[C@H](c2cnn(C)c2)C1 ZINC000849487699 1056872556 /nfs/dbraw/zinc/87/25/56/1056872556.db2.gz FBLCPNPGHVWRPG-ROUUACIJSA-N 1 1 372.425 2.748 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001449330487 1058891611 /nfs/dbraw/zinc/89/16/11/1058891611.db2.gz JPMSSZSXAHOHCA-UHFFFAOYSA-N 1 1 374.828 2.787 20 5 FFBDMO Cc1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704258 1059152078 /nfs/dbraw/zinc/15/20/78/1059152078.db2.gz SCUNSGSORUPPDI-PMACEKPBSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cc1[N+](=O)[O-] ZINC001200704258 1059152085 /nfs/dbraw/zinc/15/20/85/1059152085.db2.gz SCUNSGSORUPPDI-PMACEKPBSA-N 1 1 369.465 2.876 20 5 FFBDMO C[C@H](C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC001520069487 1059374525 /nfs/dbraw/zinc/37/45/25/1059374525.db2.gz RAYRNTCJXCILSU-WFASDCNBSA-N 1 1 366.389 2.634 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C)CC1(C)C ZINC001456172933 1060035693 /nfs/dbraw/zinc/03/56/93/1060035693.db2.gz FQGCVJJOZDAOGV-CYBMUJFWSA-N 1 1 370.247 2.736 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483116 1060121825 /nfs/dbraw/zinc/12/18/25/1060121825.db2.gz YOPUFPMYXUHPKC-MAUKXSAKSA-N 1 1 355.442 2.832 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000848484343 1060124386 /nfs/dbraw/zinc/12/43/86/1060124386.db2.gz ZAQKVUIIKRBZNG-RBUKOAKNSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000848489763 1060148569 /nfs/dbraw/zinc/14/85/69/1060148569.db2.gz RJMQJSJMIOFPGG-HNNXBMFYSA-N 1 1 365.380 2.989 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848496898 1060167538 /nfs/dbraw/zinc/16/75/38/1060167538.db2.gz HPNTWFDOIYGTAS-MOPGFXCFSA-N 1 1 373.453 2.902 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848496898 1060167549 /nfs/dbraw/zinc/16/75/49/1060167549.db2.gz HPNTWFDOIYGTAS-MOPGFXCFSA-N 1 1 373.453 2.902 20 5 FFBDMO CC(C)Oc1nc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001458594237 1060629612 /nfs/dbraw/zinc/62/96/12/1060629612.db2.gz MBFRLEAUJPTARW-GXTWGEPZSA-N 1 1 352.460 2.769 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H](CO)Cc1ccccc1 ZINC001460412798 1060988645 /nfs/dbraw/zinc/98/86/45/1060988645.db2.gz BMRKQONDAHFJPK-OAHLLOKOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H](CO)Cc1ccccc1 ZINC001460412798 1060988665 /nfs/dbraw/zinc/98/86/65/1060988665.db2.gz BMRKQONDAHFJPK-OAHLLOKOSA-N 1 1 368.393 2.680 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001460780007 1061098690 /nfs/dbraw/zinc/09/86/90/1061098690.db2.gz VVXJUPQYTJKAPM-GOSISDBHSA-N 1 1 373.409 2.516 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001460780007 1061098704 /nfs/dbraw/zinc/09/87/04/1061098704.db2.gz VVXJUPQYTJKAPM-GOSISDBHSA-N 1 1 373.409 2.516 20 5 FFBDMO COC(=O)c1ccc2c(c1)OCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001460937157 1061156298 /nfs/dbraw/zinc/15/62/98/1061156298.db2.gz YZYOMHOUKYLRRJ-UHFFFAOYSA-N 1 1 372.377 2.655 20 5 FFBDMO COC(=O)c1ccc2c(c1)OCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001460937157 1061156306 /nfs/dbraw/zinc/15/63/06/1061156306.db2.gz YZYOMHOUKYLRRJ-UHFFFAOYSA-N 1 1 372.377 2.655 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001460953804 1061163198 /nfs/dbraw/zinc/16/31/98/1061163198.db2.gz BFZUUDPONOMHIH-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001460953804 1061163205 /nfs/dbraw/zinc/16/32/05/1061163205.db2.gz BFZUUDPONOMHIH-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC001462023139 1061479937 /nfs/dbraw/zinc/47/99/37/1061479937.db2.gz ANZBMUGVEATIQA-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC001462023139 1061479947 /nfs/dbraw/zinc/47/99/47/1061479947.db2.gz ANZBMUGVEATIQA-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001464546460 1062678243 /nfs/dbraw/zinc/67/82/43/1062678243.db2.gz SPFKVKCQUNYXMO-SNVBAGLBSA-N 1 1 372.828 2.820 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001466026512 1063299612 /nfs/dbraw/zinc/29/96/12/1063299612.db2.gz FGBVIELVLLGLNR-DZGCQCFKSA-N 1 1 350.444 2.605 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001525865165 1063442581 /nfs/dbraw/zinc/44/25/81/1063442581.db2.gz IVIUTTCGQXUSLK-TZMCWYRMSA-N 1 1 369.849 2.958 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@@H]2C[N@H+](C)CC2(C)C)cc1[N+](=O)[O-] ZINC001472025870 1064898157 /nfs/dbraw/zinc/89/81/57/1064898157.db2.gz HJYGFRLPJMBKIL-CYBMUJFWSA-N 1 1 370.247 2.736 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@@H]1C ZINC001473712604 1065328783 /nfs/dbraw/zinc/32/87/83/1065328783.db2.gz HTDNIZQRTVVYSR-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@@H]1C ZINC001473712604 1065328790 /nfs/dbraw/zinc/32/87/90/1065328790.db2.gz HTDNIZQRTVVYSR-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO Cc1sc(C[NH3+])nc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001579934397 1078720242 /nfs/dbraw/zinc/72/02/42/1078720242.db2.gz QKOIVDLBFXJQKH-UHFFFAOYSA-N 1 1 358.326 2.672 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001585138974 1079430207 /nfs/dbraw/zinc/43/02/07/1079430207.db2.gz OUCJTTHGBBDEKB-OAHLLOKOSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC001585138974 1079430209 /nfs/dbraw/zinc/43/02/09/1079430209.db2.gz OUCJTTHGBBDEKB-OAHLLOKOSA-N 1 1 351.472 2.876 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)cccc1[N+](=O)[O-] ZINC001557757259 1075884756 /nfs/dbraw/zinc/88/47/56/1075884756.db2.gz AQYOIWQJOWBDFR-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)c1 ZINC001557763213 1075886228 /nfs/dbraw/zinc/88/62/28/1075886228.db2.gz UYBXOZRCAGSKRC-AWEZNQCLSA-N 1 1 372.400 2.629 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001557849939 1075899190 /nfs/dbraw/zinc/89/91/90/1075899190.db2.gz QCURCRQLKLWAKJ-CQSZACIVSA-N 1 1 351.834 2.924 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001558525074 1076024752 /nfs/dbraw/zinc/02/47/52/1076024752.db2.gz GHTGNKLQQFKIGY-OAHLLOKOSA-N 1 1 367.471 2.785 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001559102560 1076126071 /nfs/dbraw/zinc/12/60/71/1076126071.db2.gz VQBKFXMZTGQVIX-NSHDSACASA-N 1 1 353.806 2.931 20 5 FFBDMO O=[N+]([O-])c1ccc2ncc([N+](=O)[O-])c(NC[C@@H]3CC[N@H+]3C3CCCC3)c2c1 ZINC001559252110 1076139836 /nfs/dbraw/zinc/13/98/36/1076139836.db2.gz TXJZCXHRMLULFD-AWEZNQCLSA-N 1 1 371.397 2.902 20 5 FFBDMO O=C(C[NH2+]C1(c2ccc3c(c2)OCCO3)CC1)Nc1ccccc1[N+](=O)[O-] ZINC001560172369 1076241344 /nfs/dbraw/zinc/24/13/44/1076241344.db2.gz VBJJYIMHQHOBHV-UHFFFAOYSA-N 1 1 369.377 2.583 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC001560212789 1076248265 /nfs/dbraw/zinc/24/82/65/1076248265.db2.gz QNIYHODARWFJOU-CYBMUJFWSA-N 1 1 357.414 2.881 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c(C)c1[N+](=O)[O-] ZINC001561474839 1076381934 /nfs/dbraw/zinc/38/19/34/1076381934.db2.gz RJGUOXSUSZBAOM-GXTWGEPZSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)n1 ZINC001566426212 1076959110 /nfs/dbraw/zinc/95/91/10/1076959110.db2.gz JMOALRNHUMZGAU-RDJZCZTQSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)n1 ZINC001566426212 1076959114 /nfs/dbraw/zinc/95/91/14/1076959114.db2.gz JMOALRNHUMZGAU-RDJZCZTQSA-N 1 1 358.373 2.613 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2cccc(F)c2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570796191 1077231216 /nfs/dbraw/zinc/23/12/16/1077231216.db2.gz HTECGAOFLKYLNM-UKRRQHHQSA-N 1 1 367.396 2.539 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C(C)(C)C ZINC001570910762 1077241944 /nfs/dbraw/zinc/24/19/44/1077241944.db2.gz RIFCDKCJULAGCF-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC001586485479 1079638315 /nfs/dbraw/zinc/63/83/15/1079638315.db2.gz VJSXACWYRJUOMP-IFXJQAMLSA-N 1 1 368.437 2.939 20 5 FFBDMO C[C@@H](CNc1cccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589877017 1080824918 /nfs/dbraw/zinc/82/49/18/1080824918.db2.gz FQJIJZDANYLLKE-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO C[C@H](Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978294 1080917562 /nfs/dbraw/zinc/91/75/62/1080917562.db2.gz MCVLCTFSSBJPEB-JSGCOSHPSA-N 1 1 371.445 2.840 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000109852445 206064285 /nfs/dbraw/zinc/06/42/85/206064285.db2.gz LTURZQSVKMNCCK-HNNXBMFYSA-N 1 1 355.460 2.528 20 5 FFBDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101908643 250093352 /nfs/dbraw/zinc/09/33/52/250093352.db2.gz KUIWGHRYBSFUQA-INIZCTEOSA-N 1 1 363.458 2.848 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103186627 250138729 /nfs/dbraw/zinc/13/87/29/250138729.db2.gz FUSOFNMPZNRAJP-NSHDSACASA-N 1 1 353.444 2.539 20 5 FFBDMO C[C@@H]1[C@H](C)SCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000118419486 250385346 /nfs/dbraw/zinc/38/53/46/250385346.db2.gz BQEWRORZHSFFTD-NEPJUHHUSA-N 1 1 351.428 2.719 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@@H]1C ZINC000186780921 251261792 /nfs/dbraw/zinc/26/17/92/251261792.db2.gz OKBFYMFAZKCIHG-AWEZNQCLSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272569931 252070672 /nfs/dbraw/zinc/07/06/72/252070672.db2.gz TULDXKIZZVSERX-IUODEOHRSA-N 1 1 368.865 2.772 20 5 FFBDMO CC(=O)c1ccc(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1 ZINC000273196014 252247766 /nfs/dbraw/zinc/24/77/66/252247766.db2.gz NOYSJHLLKWSLCF-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2cnn(C)c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000273437954 252305798 /nfs/dbraw/zinc/30/57/98/252305798.db2.gz YSPOFSHPLRHHAR-JTQLQIEISA-N 1 1 370.356 2.832 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277354680 256188772 /nfs/dbraw/zinc/18/87/72/256188772.db2.gz GERDHQRSYLLNIH-HNNXBMFYSA-N 1 1 364.446 2.834 20 5 FFBDMO CCc1[nH]nc(C(=O)N(Cc2ccccc2)C2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000278684752 256338080 /nfs/dbraw/zinc/33/80/80/256338080.db2.gz UMOFCEJORGRKSQ-UHFFFAOYSA-N 1 1 371.441 2.617 20 5 FFBDMO Cc1nn(C)c(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000286260973 257028111 /nfs/dbraw/zinc/02/81/11/257028111.db2.gz GQKYKSJGPCETBL-LJQANCHMSA-N 1 1 355.442 2.739 20 5 FFBDMO CCOc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278123 257029076 /nfs/dbraw/zinc/02/90/76/257029076.db2.gz BQJNSIFOAPUCIZ-STQMWFEESA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278123 257029077 /nfs/dbraw/zinc/02/90/77/257029077.db2.gz BQJNSIFOAPUCIZ-STQMWFEESA-N 1 1 362.348 2.986 20 5 FFBDMO COC(=O)c1cc(C)nc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000286426050 257036476 /nfs/dbraw/zinc/03/64/76/257036476.db2.gz VUAPHEOLYGRNCM-ZDUSSCGKSA-N 1 1 350.419 2.617 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]([C@@H](C)CO)C1CCCC1 ZINC000287786497 257112536 /nfs/dbraw/zinc/11/25/36/257112536.db2.gz NRAWJEAYGQTUCI-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1ccncc1CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000289987863 257310035 /nfs/dbraw/zinc/31/00/35/257310035.db2.gz KCJVSDDENJJEAG-UHFFFAOYSA-N 1 1 368.437 2.689 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000290053578 257313310 /nfs/dbraw/zinc/31/33/10/257313310.db2.gz XFUVCXKIRAKPLC-OAHLLOKOSA-N 1 1 357.414 2.684 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c2c(c1)COCO2 ZINC000291020393 257374392 /nfs/dbraw/zinc/37/43/92/257374392.db2.gz AFPJQSSTCDTEPW-HXUWFJFHSA-N 1 1 370.405 2.597 20 5 FFBDMO Cc1ccncc1CCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000294068439 257572722 /nfs/dbraw/zinc/57/27/22/257572722.db2.gz QIHSRZGBPJNBTL-UHFFFAOYSA-N 1 1 368.437 2.689 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@H](C)[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301187209 258032608 /nfs/dbraw/zinc/03/26/08/258032608.db2.gz KFNMUTZQGMYGDJ-GJZGRUSLSA-N 1 1 371.441 2.881 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000301231498 258035745 /nfs/dbraw/zinc/03/57/45/258035745.db2.gz FRJWWFZECXLSDQ-HZPDHXFCSA-N 1 1 369.425 2.598 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000301235599 258035856 /nfs/dbraw/zinc/03/58/56/258035856.db2.gz LSWDNICGGZTJEY-OAHLLOKOSA-N 1 1 371.441 2.846 20 5 FFBDMO C[C@H](O)C[NH+]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000302455934 258102574 /nfs/dbraw/zinc/10/25/74/258102574.db2.gz SZCBCAFSOSLLBT-VIFPVBQESA-N 1 1 367.755 2.770 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1Br ZINC000317144149 258115899 /nfs/dbraw/zinc/11/58/99/258115899.db2.gz FOMPHKXUCMFDCN-MNOVXSKESA-N 1 1 368.231 2.714 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1Br ZINC000317301725 258115989 /nfs/dbraw/zinc/11/59/89/258115989.db2.gz MONWWBKHWFMQLP-WDEREUQCSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1[NH+]1CCOCC1 ZINC000301544111 258054870 /nfs/dbraw/zinc/05/48/70/258054870.db2.gz DABSSHPIQHBLRV-XHDPSFHLSA-N 1 1 359.348 2.771 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc(OC)c1 ZINC000301558349 258055715 /nfs/dbraw/zinc/05/57/15/258055715.db2.gz JJDZTJCNQWYLIO-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc(OC)c1 ZINC000301558351 258055972 /nfs/dbraw/zinc/05/59/72/258055972.db2.gz JJDZTJCNQWYLIO-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000301717138 258064139 /nfs/dbraw/zinc/06/41/39/258064139.db2.gz NUKJZUSNAXNDJH-LRDDRELGSA-N 1 1 365.405 2.831 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000301717137 258064160 /nfs/dbraw/zinc/06/41/60/258064160.db2.gz NUKJZUSNAXNDJH-BLLLJJGKSA-N 1 1 365.405 2.831 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301813816 258069119 /nfs/dbraw/zinc/06/91/19/258069119.db2.gz ZFGXHTMMWZZMMT-CQSZACIVSA-N 1 1 369.487 2.921 20 5 FFBDMO CC(=O)c1ccc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])c1 ZINC000301862918 258071646 /nfs/dbraw/zinc/07/16/46/258071646.db2.gz ULUREUIIFBGHQJ-JWTNVVGKSA-N 1 1 372.469 2.545 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000301903795 258073921 /nfs/dbraw/zinc/07/39/21/258073921.db2.gz XPRCCEXCNGLENI-LLVKDONJSA-N 1 1 373.251 2.521 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@H]1[NH+]1CCOCC1 ZINC000301920819 258075434 /nfs/dbraw/zinc/07/54/34/258075434.db2.gz XFIMHDKBQOWPTD-WMLDXEAASA-N 1 1 363.458 2.929 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000330587739 258166266 /nfs/dbraw/zinc/16/62/66/258166266.db2.gz UATMFTKVUHIFKJ-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591160 258166401 /nfs/dbraw/zinc/16/64/01/258166401.db2.gz OFOIEFKJNMPXSK-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591160 258166402 /nfs/dbraw/zinc/16/64/02/258166402.db2.gz OFOIEFKJNMPXSK-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844693 258171607 /nfs/dbraw/zinc/17/16/07/258171607.db2.gz WRUQJJAWFWBKKL-QWRGUYRKSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844693 258171608 /nfs/dbraw/zinc/17/16/08/258171608.db2.gz WRUQJJAWFWBKKL-QWRGUYRKSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844694 258171615 /nfs/dbraw/zinc/17/16/15/258171615.db2.gz WRUQJJAWFWBKKL-WDEREUQCSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000330844694 258171616 /nfs/dbraw/zinc/17/16/16/258171616.db2.gz WRUQJJAWFWBKKL-WDEREUQCSA-N 1 1 357.863 2.891 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000331488222 258188303 /nfs/dbraw/zinc/18/83/03/258188303.db2.gz KIDJATRXWSNNIC-JTQLQIEISA-N 1 1 368.231 2.632 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000332264129 258222318 /nfs/dbraw/zinc/22/23/18/258222318.db2.gz ODOMQPFAVLOSNW-KGLIPLIRSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000332343503 258226453 /nfs/dbraw/zinc/22/64/53/258226453.db2.gz SRCLUXCLRCDYFD-ZIAGYGMSSA-N 1 1 368.231 2.714 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651169 512124418 /nfs/dbraw/zinc/12/44/18/512124418.db2.gz HOXWLYBQXKNVKV-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651169 512124414 /nfs/dbraw/zinc/12/44/14/512124414.db2.gz HOXWLYBQXKNVKV-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C(C)C ZINC000120368651 508981879 /nfs/dbraw/zinc/98/18/79/508981879.db2.gz NQZCXXXATVZTAJ-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000161340500 509104094 /nfs/dbraw/zinc/10/40/94/509104094.db2.gz XVFITMASNUQPND-HZMBPMFUSA-N 1 1 370.247 2.816 20 5 FFBDMO CC[N@@H+](CCc1ccccc1)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000052968726 506288406 /nfs/dbraw/zinc/28/84/06/506288406.db2.gz SMLXOPYBRLYYLU-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000065675139 506342950 /nfs/dbraw/zinc/34/29/50/506342950.db2.gz LRWSJRJSWLXWFO-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095165 512169672 /nfs/dbraw/zinc/16/96/72/512169672.db2.gz OIUFOFCQCNLMJI-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095165 512169675 /nfs/dbraw/zinc/16/96/75/512169675.db2.gz OIUFOFCQCNLMJI-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262652 512190541 /nfs/dbraw/zinc/19/05/41/512190541.db2.gz QGMFMQPBXYAPGZ-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000375209496 512212825 /nfs/dbraw/zinc/21/28/25/512212825.db2.gz FXZVIVXIMFUXBS-QGZVFWFLSA-N 1 1 354.410 2.726 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000053698824 506433276 /nfs/dbraw/zinc/43/32/76/506433276.db2.gz SVROPQDVIKZSNF-AWEZNQCLSA-N 1 1 369.487 2.525 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC000053815260 506451856 /nfs/dbraw/zinc/45/18/56/506451856.db2.gz XCKOXNPWARKWSU-UHFFFAOYSA-N 1 1 353.378 2.689 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC000053815260 506451861 /nfs/dbraw/zinc/45/18/61/506451861.db2.gz XCKOXNPWARKWSU-UHFFFAOYSA-N 1 1 353.378 2.689 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000054202848 506512236 /nfs/dbraw/zinc/51/22/36/506512236.db2.gz LMPOXWGSLHMWQP-ZDUSSCGKSA-N 1 1 358.373 2.980 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000054202848 506512238 /nfs/dbraw/zinc/51/22/38/506512238.db2.gz LMPOXWGSLHMWQP-ZDUSSCGKSA-N 1 1 358.373 2.980 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000054548128 506576535 /nfs/dbraw/zinc/57/65/35/506576535.db2.gz PUPDRQYNHLGWKR-BETUJISGSA-N 1 1 350.419 2.604 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000054548128 506576542 /nfs/dbraw/zinc/57/65/42/506576542.db2.gz PUPDRQYNHLGWKR-BETUJISGSA-N 1 1 350.419 2.604 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000054620807 506589523 /nfs/dbraw/zinc/58/95/23/506589523.db2.gz HDTRAEJWYYZYAV-GFCCVEGCSA-N 1 1 357.414 2.740 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)n1 ZINC000054676376 506600550 /nfs/dbraw/zinc/60/05/50/506600550.db2.gz UBODFHDEQSBRRW-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)n1 ZINC000054676376 506600561 /nfs/dbraw/zinc/60/05/61/506600561.db2.gz UBODFHDEQSBRRW-CYBMUJFWSA-N 1 1 370.369 2.716 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1F ZINC000054763327 506616801 /nfs/dbraw/zinc/61/68/01/506616801.db2.gz FNSRLKZQCBTVDA-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000066924709 506696768 /nfs/dbraw/zinc/69/67/68/506696768.db2.gz MKINPQJPYYENHN-AWEZNQCLSA-N 1 1 360.458 2.655 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000043084472 506697618 /nfs/dbraw/zinc/69/76/18/506697618.db2.gz AWFLGCMRDCYZSJ-STQMWFEESA-N 1 1 365.430 2.605 20 5 FFBDMO Cc1c(NC(=O)NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043346383 506736726 /nfs/dbraw/zinc/73/67/26/506736726.db2.gz OBZGBYLTKFNQDL-RWMBFGLXSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1c(NC(=O)NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043346383 506736733 /nfs/dbraw/zinc/73/67/33/506736733.db2.gz OBZGBYLTKFNQDL-RWMBFGLXSA-N 1 1 350.419 2.522 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCCC[C@H]1C ZINC000067052668 506738392 /nfs/dbraw/zinc/73/83/92/506738392.db2.gz AMUZZHSQNJOKRY-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000043893369 506797942 /nfs/dbraw/zinc/79/79/42/506797942.db2.gz YVLAJYWKCWZAKZ-GJZGRUSLSA-N 1 1 363.462 2.569 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000045465039 506971690 /nfs/dbraw/zinc/97/16/90/506971690.db2.gz BKTGTLFTYXDQOJ-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000068184700 507140447 /nfs/dbraw/zinc/14/04/47/507140447.db2.gz XEAPLLMVNNIJCA-LJQANCHMSA-N 1 1 369.421 2.754 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H](c2cccs2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000047031716 507253381 /nfs/dbraw/zinc/25/33/81/507253381.db2.gz AWAZVMKSQVFYAB-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000047145500 507272960 /nfs/dbraw/zinc/27/29/60/507272960.db2.gz NAXRHTMFLZTZFN-MRXNPFEDSA-N 1 1 374.485 2.659 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047142616 507273223 /nfs/dbraw/zinc/27/32/23/507273223.db2.gz NJUAWBQCDYHFFV-INIZCTEOSA-N 1 1 374.485 2.802 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccco1 ZINC000069039997 507386909 /nfs/dbraw/zinc/38/69/09/507386909.db2.gz GDOFYRRNHMVSNL-QGZVFWFLSA-N 1 1 372.425 2.821 20 5 FFBDMO C[C@@H](CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000069066683 507393817 /nfs/dbraw/zinc/39/38/17/507393817.db2.gz BPVXPQAVXJYHPG-GJZGRUSLSA-N 1 1 364.446 2.536 20 5 FFBDMO COCC[N@H+]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000048426749 507521335 /nfs/dbraw/zinc/52/13/35/507521335.db2.gz VUGSSOPFGHHPAE-UHFFFAOYSA-N 1 1 363.458 2.687 20 5 FFBDMO COC(=O)c1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000026208192 507568418 /nfs/dbraw/zinc/56/84/18/507568418.db2.gz BQXGDWCVAOIAIZ-CYBMUJFWSA-N 1 1 371.393 2.840 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000026208192 507568421 /nfs/dbraw/zinc/56/84/21/507568421.db2.gz BQXGDWCVAOIAIZ-CYBMUJFWSA-N 1 1 371.393 2.840 20 5 FFBDMO C[C@@H](CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[N@H+]1CCCC[C@@H]1C ZINC000049749595 507637208 /nfs/dbraw/zinc/63/72/08/507637208.db2.gz RHYXEHMYWZMXIX-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000028049756 507706787 /nfs/dbraw/zinc/70/67/87/507706787.db2.gz FLAGTCKBHCXWBN-UHFFFAOYSA-N 1 1 355.460 2.528 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051051066 507727554 /nfs/dbraw/zinc/72/75/54/507727554.db2.gz YRLXKXFDNLTPGN-HZPDHXFCSA-N 1 1 363.458 2.990 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000063710512 507762438 /nfs/dbraw/zinc/76/24/38/507762438.db2.gz GQVFQIRSHVJVGU-CQSZACIVSA-N 1 1 351.472 2.924 20 5 FFBDMO C[C@H](C(=O)N(C)c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665301 507840551 /nfs/dbraw/zinc/84/05/51/507840551.db2.gz ARZVMLDUYWHVNQ-CABCVRRESA-N 1 1 369.425 2.528 20 5 FFBDMO C[C@H](C(=O)N(C)c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665301 507840553 /nfs/dbraw/zinc/84/05/53/507840553.db2.gz ARZVMLDUYWHVNQ-CABCVRRESA-N 1 1 369.425 2.528 20 5 FFBDMO CC[NH+](CC)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000072803520 507855431 /nfs/dbraw/zinc/85/54/31/507855431.db2.gz GBSYUKNNWJSSIG-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2)C1 ZINC000072932660 507874314 /nfs/dbraw/zinc/87/43/14/507874314.db2.gz PVNXQBYEKJDGDI-ZDUSSCGKSA-N 1 1 358.398 2.896 20 5 FFBDMO CNC(=O)c1ccc(N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000078506447 507877830 /nfs/dbraw/zinc/87/78/30/507877830.db2.gz ARSUSXYKLIYTHI-KRWDZBQOSA-N 1 1 368.437 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(c4nnc[nH]4)CC3)co2)cc1 ZINC000089909103 507881793 /nfs/dbraw/zinc/88/17/93/507881793.db2.gz YVELFMWIWOKKJT-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000089923394 507884325 /nfs/dbraw/zinc/88/43/25/507884325.db2.gz ODFLULWFXRFLCB-IBGZPJMESA-N 1 1 368.437 2.898 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](Cn4ccnn4)C3)co2)cc1 ZINC000089934669 507887478 /nfs/dbraw/zinc/88/74/78/507887478.db2.gz OCSMXLPDTKZZDY-CQSZACIVSA-N 1 1 368.397 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCCC[C@H]2C[NH+]2CCOCC2)c2ccncc21 ZINC000078619315 507890524 /nfs/dbraw/zinc/89/05/24/507890524.db2.gz SCEOKEOTXVFHAT-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCCC2 ZINC000090550707 507926807 /nfs/dbraw/zinc/92/68/07/507926807.db2.gz ZBNMUCQQFWEKKQ-IAGOWNOFSA-N 1 1 363.458 2.816 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 ZINC000110975336 508062088 /nfs/dbraw/zinc/06/20/88/508062088.db2.gz QZSNUOHCNXDDLR-AWEZNQCLSA-N 1 1 365.478 2.543 20 5 FFBDMO COc1ccc(C[N@H+](CCO)Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000111322152 508090264 /nfs/dbraw/zinc/09/02/64/508090264.db2.gz NYHRYPIUGGUIPT-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(C[N@@H+](CCO)Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000111322152 508090266 /nfs/dbraw/zinc/09/02/66/508090266.db2.gz NYHRYPIUGGUIPT-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092734478 508098711 /nfs/dbraw/zinc/09/87/11/508098711.db2.gz QQOBLWMPJQACQQ-GFCCVEGCSA-N 1 1 371.384 2.934 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092734478 508098712 /nfs/dbraw/zinc/09/87/12/508098712.db2.gz QQOBLWMPJQACQQ-GFCCVEGCSA-N 1 1 371.384 2.934 20 5 FFBDMO C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000111475319 508102689 /nfs/dbraw/zinc/10/26/89/508102689.db2.gz LKCKBEAGPDCACX-INIZCTEOSA-N 1 1 370.453 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccccc1N1CCOCC1)C2 ZINC000093443791 508146141 /nfs/dbraw/zinc/14/61/41/508146141.db2.gz KEAZNBZRTZRXQY-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccccc1N1CCOCC1)C2 ZINC000093443791 508146144 /nfs/dbraw/zinc/14/61/44/508146144.db2.gz KEAZNBZRTZRXQY-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO Cn1cc(C[C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC(F)F)C2)cn1 ZINC000093870630 508158362 /nfs/dbraw/zinc/15/83/62/508158362.db2.gz PLRITPUOJKYHKL-LBPRGKRZSA-N 1 1 366.368 2.994 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000081361074 508167035 /nfs/dbraw/zinc/16/70/35/508167035.db2.gz WHWZCDYLAIEFOE-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000081363502 508167649 /nfs/dbraw/zinc/16/76/49/508167649.db2.gz OOONOZNWUXXEBQ-MRXNPFEDSA-N 1 1 362.474 2.977 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000076487385 508212795 /nfs/dbraw/zinc/21/27/95/508212795.db2.gz PVVZUHJTUQOXJL-MLGOLLRUSA-N 1 1 353.850 2.979 20 5 FFBDMO CC(C)[N@@H+](CCCN1C(=O)NC(C)(C)C1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000098135242 508236406 /nfs/dbraw/zinc/23/64/06/508236406.db2.gz NNLAHPBQBTVBKO-UHFFFAOYSA-N 1 1 362.430 2.526 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000085293269 508302453 /nfs/dbraw/zinc/30/24/53/508302453.db2.gz ORYWKUXTMPUZAK-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000114466922 508318142 /nfs/dbraw/zinc/31/81/42/508318142.db2.gz MPMRPCBOQSVGPO-QGZVFWFLSA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000114466922 508318144 /nfs/dbraw/zinc/31/81/44/508318144.db2.gz MPMRPCBOQSVGPO-QGZVFWFLSA-N 1 1 369.421 2.824 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)COCc1ccccc1F)CC2 ZINC000088616506 508379512 /nfs/dbraw/zinc/37/95/12/508379512.db2.gz TVHBYXVJYOCIIO-SFHVURJKSA-N 1 1 360.385 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)COCc1ccccc1F)CC2 ZINC000088616506 508379514 /nfs/dbraw/zinc/37/95/14/508379514.db2.gz TVHBYXVJYOCIIO-SFHVURJKSA-N 1 1 360.385 2.670 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115273564 508380661 /nfs/dbraw/zinc/38/06/61/508380661.db2.gz YYJPGCHXYXKSNE-QAPCUYQASA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000077839476 508383453 /nfs/dbraw/zinc/38/34/53/508383453.db2.gz UBUTYLMVLWRSAM-SFHVURJKSA-N 1 1 360.458 2.797 20 5 FFBDMO NC(=O)c1ccc(CN2CCC(CCC[NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000122051685 508473891 /nfs/dbraw/zinc/47/38/91/508473891.db2.gz WOFPGYORKZJRSW-UHFFFAOYSA-N 1 1 374.485 2.782 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@@H]1[NH+]1CCOCC1 ZINC000152595048 508476236 /nfs/dbraw/zinc/47/62/36/508476236.db2.gz XFIMHDKBQOWPTD-PBHICJAKSA-N 1 1 363.458 2.929 20 5 FFBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000116163520 508480782 /nfs/dbraw/zinc/48/07/82/508480782.db2.gz BALUMBFQKDXASZ-QGZVFWFLSA-N 1 1 369.421 2.909 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134206222 508507403 /nfs/dbraw/zinc/50/74/03/508507403.db2.gz DYKZRTWQGLQAKX-FZKQIMNGSA-N 1 1 355.394 2.857 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134206222 508507406 /nfs/dbraw/zinc/50/74/06/508507406.db2.gz DYKZRTWQGLQAKX-FZKQIMNGSA-N 1 1 355.394 2.857 20 5 FFBDMO Cn1cnnc1[C@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000157089099 508520909 /nfs/dbraw/zinc/52/09/09/508520909.db2.gz VXGCNXSVSMBGQN-OAHLLOKOSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1cnnc1[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000157089099 508520913 /nfs/dbraw/zinc/52/09/13/508520913.db2.gz VXGCNXSVSMBGQN-OAHLLOKOSA-N 1 1 368.397 2.758 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000116732713 508552049 /nfs/dbraw/zinc/55/20/49/508552049.db2.gz ZWGMACUNTOKVGK-LBPRGKRZSA-N 1 1 367.833 2.618 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000116753275 508554878 /nfs/dbraw/zinc/55/48/78/508554878.db2.gz UCECSGNCYOHMAP-ZDUSSCGKSA-N 1 1 355.822 2.618 20 5 FFBDMO C[N@@H+](CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)Cc1ccccc1 ZINC000122846153 508595946 /nfs/dbraw/zinc/59/59/46/508595946.db2.gz UUXICDQYYUDEEN-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153774971 508645888 /nfs/dbraw/zinc/64/58/88/508645888.db2.gz TWUUVTZSDWJKBG-HFTRVMKXSA-N 1 1 363.458 2.645 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC[N@H+]1CCOC ZINC000153866217 508665881 /nfs/dbraw/zinc/66/58/81/508665881.db2.gz HZGJZYCLIZDYPQ-MRXNPFEDSA-N 1 1 364.446 2.868 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC[C@@H]21 ZINC000158468087 508708361 /nfs/dbraw/zinc/70/83/61/508708361.db2.gz DHWCIFDAUQDTRA-BBRMVZONSA-N 1 1 354.410 2.699 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000137485141 508758749 /nfs/dbraw/zinc/75/87/49/508758749.db2.gz OEGGFTCSDLVUIT-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000138375598 508773012 /nfs/dbraw/zinc/77/30/12/508773012.db2.gz ICQHNMGZEHVNLF-AWEZNQCLSA-N 1 1 357.410 2.826 20 5 FFBDMO Cn1cc(Br)cc1C[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154449298 508787094 /nfs/dbraw/zinc/78/70/94/508787094.db2.gz SSZSRSYRAZQEBK-HNNXBMFYSA-N 1 1 368.231 2.861 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139917382 508797263 /nfs/dbraw/zinc/79/72/63/508797263.db2.gz AVESPDCOWVNIJK-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139917382 508797267 /nfs/dbraw/zinc/79/72/67/508797267.db2.gz AVESPDCOWVNIJK-QAPCUYQASA-N 1 1 360.458 2.648 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000369461290 512421846 /nfs/dbraw/zinc/42/18/46/512421846.db2.gz IIAAGBZFVDBNBN-LBPRGKRZSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000369461290 512421848 /nfs/dbraw/zinc/42/18/48/512421848.db2.gz IIAAGBZFVDBNBN-LBPRGKRZSA-N 1 1 361.377 2.795 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000119769104 508859001 /nfs/dbraw/zinc/85/90/01/508859001.db2.gz AFZKVOPMXUGHAO-KXBFYZLASA-N 1 1 369.421 2.610 20 5 FFBDMO CCc1cc(N[C@@H](C)[C@H]2C[N@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832329 508865615 /nfs/dbraw/zinc/86/56/15/508865615.db2.gz FUCDGWAQJCDDJF-SUMWQHHRSA-N 1 1 371.441 2.745 20 5 FFBDMO CCc1cc(N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832329 508865618 /nfs/dbraw/zinc/86/56/18/508865618.db2.gz FUCDGWAQJCDDJF-SUMWQHHRSA-N 1 1 371.441 2.745 20 5 FFBDMO CC[N@H+](CCO)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000119926402 508890988 /nfs/dbraw/zinc/89/09/88/508890988.db2.gz COQQGBSZXWKEMK-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CCO)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000119926402 508890993 /nfs/dbraw/zinc/89/09/93/508890993.db2.gz COQQGBSZXWKEMK-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000150779572 508892107 /nfs/dbraw/zinc/89/21/07/508892107.db2.gz RVDGTXLWEPXHKK-CYBMUJFWSA-N 1 1 351.422 2.903 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000159815115 508895523 /nfs/dbraw/zinc/89/55/23/508895523.db2.gz VOMGXSQTZSAFFN-UHFFFAOYSA-N 1 1 371.437 2.685 20 5 FFBDMO O=C(NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1[nH]ncc1[N+](=O)[O-] ZINC000160002127 508923756 /nfs/dbraw/zinc/92/37/56/508923756.db2.gz HGIBJGCOMKZESA-ZDUSSCGKSA-N 1 1 363.805 2.538 20 5 FFBDMO CCC[C@@H]1CN(c2cc(OC)c([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000120149172 508938060 /nfs/dbraw/zinc/93/80/60/508938060.db2.gz FEJIOHIDKRZIPV-CYBMUJFWSA-N 1 1 355.410 2.680 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125187755 508944609 /nfs/dbraw/zinc/94/46/09/508944609.db2.gz IITIMPKHXGUBEC-GFCCVEGCSA-N 1 1 353.382 2.714 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000120224791 508953156 /nfs/dbraw/zinc/95/31/56/508953156.db2.gz ATAKDUSARZSZKY-UHFFFAOYSA-N 1 1 357.414 2.518 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000151787570 509082552 /nfs/dbraw/zinc/08/25/52/509082552.db2.gz BYMUIIKQIIOLGS-OXQOHEQNSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000151787570 509082555 /nfs/dbraw/zinc/08/25/55/509082555.db2.gz BYMUIIKQIIOLGS-OXQOHEQNSA-N 1 1 369.465 2.973 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185502687 509210035 /nfs/dbraw/zinc/21/00/35/509210035.db2.gz KMNLEWFIHSKDLC-HNNXBMFYSA-N 1 1 369.421 2.905 20 5 FFBDMO Nc1c(F)c(NCc2ccccc2C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000266854790 509226352 /nfs/dbraw/zinc/22/63/52/509226352.db2.gz MJZHXHJFHKMPMR-UHFFFAOYSA-N 1 1 360.389 2.760 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000182456350 509248064 /nfs/dbraw/zinc/24/80/64/509248064.db2.gz VINUVVPJKOKWNZ-LLVKDONJSA-N 1 1 370.377 2.998 20 5 FFBDMO COCCC[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000188931310 509330039 /nfs/dbraw/zinc/33/00/39/509330039.db2.gz MLSDXPYZTRCBKQ-UHFFFAOYSA-N 1 1 351.428 2.549 20 5 FFBDMO COCCC[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000188931310 509330046 /nfs/dbraw/zinc/33/00/46/509330046.db2.gz MLSDXPYZTRCBKQ-UHFFFAOYSA-N 1 1 351.428 2.549 20 5 FFBDMO C[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766434 509346199 /nfs/dbraw/zinc/34/61/99/509346199.db2.gz QYARXUCIYQMNAB-HZPDHXFCSA-N 1 1 374.485 2.800 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000185837976 509378845 /nfs/dbraw/zinc/37/88/45/509378845.db2.gz JNIJYKWZJMJAOO-JQWIXIFHSA-N 1 1 352.822 2.673 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000185858295 509390847 /nfs/dbraw/zinc/39/08/47/509390847.db2.gz FCOBEKFUDLGRNR-ABAIWWIYSA-N 1 1 354.838 2.776 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000248683253 509434793 /nfs/dbraw/zinc/43/47/93/509434793.db2.gz XPNPTLODYMICHQ-HOCLYGCPSA-N 1 1 371.441 2.594 20 5 FFBDMO Cc1[nH+]ccn1CCCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000173308327 509521487 /nfs/dbraw/zinc/52/14/87/509521487.db2.gz SNURZCJOPHFHAQ-UHFFFAOYSA-N 1 1 372.834 2.512 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1S(=O)(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173310874 509523490 /nfs/dbraw/zinc/52/34/90/509523490.db2.gz LDRDBDJCSAZGJK-ZDUSSCGKSA-N 1 1 363.439 2.696 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000186169446 509556802 /nfs/dbraw/zinc/55/68/02/509556802.db2.gz LWUJOKVFJHTARR-KRWDZBQOSA-N 1 1 354.406 2.882 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000186169466 509557389 /nfs/dbraw/zinc/55/73/89/509557389.db2.gz LWUJOKVFJHTARR-QGZVFWFLSA-N 1 1 354.406 2.882 20 5 FFBDMO COc1ccc(OCC[N@@H+](CCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000173386647 509567834 /nfs/dbraw/zinc/56/78/34/509567834.db2.gz ZPLRIMGHVVYNNN-GOSISDBHSA-N 1 1 372.421 2.964 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCN(C)CC1 ZINC000192648130 509582268 /nfs/dbraw/zinc/58/22/68/509582268.db2.gz HNBCFBYCLBTZPZ-PMACEKPBSA-N 1 1 360.502 2.834 20 5 FFBDMO CCc1n[nH]c(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670312 509590641 /nfs/dbraw/zinc/59/06/41/509590641.db2.gz RBGRPZMLHRVXEL-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670312 509590645 /nfs/dbraw/zinc/59/06/45/509590645.db2.gz RBGRPZMLHRVXEL-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670312 509590648 /nfs/dbraw/zinc/59/06/48/509590648.db2.gz RBGRPZMLHRVXEL-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2cccc(NCc3ccccc3[N+](=O)[O-])c2)CC1 ZINC000189517064 509614516 /nfs/dbraw/zinc/61/45/16/509614516.db2.gz ARAQUSTYAOIVFH-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccco1 ZINC000179947329 509684242 /nfs/dbraw/zinc/68/42/42/509684242.db2.gz ZBBZYSWMCYDTCS-GFCCVEGCSA-N 1 1 369.324 2.822 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000192904231 509692530 /nfs/dbraw/zinc/69/25/30/509692530.db2.gz ZIWXUWKQTWAGNV-INIZCTEOSA-N 1 1 373.457 2.767 20 5 FFBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000189671786 509693496 /nfs/dbraw/zinc/69/34/96/509693496.db2.gz HRBXXVJMOALGAP-KRWDZBQOSA-N 1 1 374.384 2.984 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000189681362 509700231 /nfs/dbraw/zinc/70/02/31/509700231.db2.gz PKMZWDXRBAQODC-CQSZACIVSA-N 1 1 369.487 2.922 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O ZINC000249575451 509715593 /nfs/dbraw/zinc/71/55/93/509715593.db2.gz ACMBOHICQJGXAA-HOCLYGCPSA-N 1 1 363.458 2.635 20 5 FFBDMO Cn1cc(CNC2CC[NH+](C3CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237751026 509727045 /nfs/dbraw/zinc/72/70/45/509727045.db2.gz YLRLTFDFYVUNTI-UHFFFAOYSA-N 1 1 355.442 2.712 20 5 FFBDMO C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H](c1ccccc1)[NH+](C)C ZINC000186493557 509738473 /nfs/dbraw/zinc/73/84/73/509738473.db2.gz HNTLQSQNYFOSAQ-KZULUSFZSA-N 1 1 367.409 2.892 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000268183524 509801773 /nfs/dbraw/zinc/80/17/73/509801773.db2.gz LXOGJEQWMGNUEF-RNCFNFMXSA-N 1 1 357.332 2.826 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C1 ZINC000173951687 509871370 /nfs/dbraw/zinc/87/13/70/509871370.db2.gz DHVYTWRZQCLJJT-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245433184 509929260 /nfs/dbraw/zinc/92/92/60/509929260.db2.gz PAIWRGMEBYZRNU-YJBOKZPZSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245433184 509929261 /nfs/dbraw/zinc/92/92/61/509929261.db2.gz PAIWRGMEBYZRNU-YJBOKZPZSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000193585159 509977602 /nfs/dbraw/zinc/97/76/02/509977602.db2.gz YHIYOSQAJDWGFP-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585159 509977610 /nfs/dbraw/zinc/97/76/10/509977610.db2.gz YHIYOSQAJDWGFP-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585159 509977621 /nfs/dbraw/zinc/97/76/21/509977621.db2.gz YHIYOSQAJDWGFP-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000193704485 510027622 /nfs/dbraw/zinc/02/76/22/510027622.db2.gz UWAMFFIXXNELIR-UHFFFAOYSA-N 1 1 364.402 2.631 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000265392539 510029397 /nfs/dbraw/zinc/02/93/97/510029397.db2.gz UAYOZOGVFJVHCH-UHFFFAOYSA-N 1 1 355.822 2.571 20 5 FFBDMO O=C(NC1CC[NH+](C2CCCC2)CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177408169 510042055 /nfs/dbraw/zinc/04/20/55/510042055.db2.gz DIOMHZOGYXPMPO-UHFFFAOYSA-N 1 1 357.414 2.608 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](C)c1nccs1 ZINC000183930789 510044668 /nfs/dbraw/zinc/04/46/68/510044668.db2.gz UKKPZJXKASHAPS-NSHDSACASA-N 1 1 364.427 2.734 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](C)c1nccs1 ZINC000183930789 510044672 /nfs/dbraw/zinc/04/46/72/510044672.db2.gz UKKPZJXKASHAPS-NSHDSACASA-N 1 1 364.427 2.734 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000245671291 510073243 /nfs/dbraw/zinc/07/32/43/510073243.db2.gz SEENJAHVIIGCKP-KGLIPLIRSA-N 1 1 358.442 2.855 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCOCC4(CCOCC4)C3)co2)cc1 ZINC000184075382 510119783 /nfs/dbraw/zinc/11/97/83/510119783.db2.gz NURXJNIEOKYPHO-UHFFFAOYSA-N 1 1 373.409 2.879 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCOCC4(CCOCC4)C3)co2)cc1 ZINC000184075382 510119792 /nfs/dbraw/zinc/11/97/92/510119792.db2.gz NURXJNIEOKYPHO-UHFFFAOYSA-N 1 1 373.409 2.879 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000245754298 510130268 /nfs/dbraw/zinc/13/02/68/510130268.db2.gz UOBVZCVBKKPJBJ-LSDHHAIUSA-N 1 1 360.458 2.904 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000262002881 510145823 /nfs/dbraw/zinc/14/58/23/510145823.db2.gz QAQUHBJIAGKIQN-SFHVURJKSA-N 1 1 372.400 2.709 20 5 FFBDMO COCCCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000193985537 510162010 /nfs/dbraw/zinc/16/20/10/510162010.db2.gz QPHCKBSXLQAKGT-UHFFFAOYSA-N 1 1 353.375 2.521 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000262101513 510177811 /nfs/dbraw/zinc/17/78/11/510177811.db2.gz ZJIRPDGWPXOUER-QGZVFWFLSA-N 1 1 359.813 2.964 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000180930981 510189144 /nfs/dbraw/zinc/18/91/44/510189144.db2.gz VVJXCWPHSIAHDH-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000180930981 510189149 /nfs/dbraw/zinc/18/91/49/510189149.db2.gz VVJXCWPHSIAHDH-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078906 510205247 /nfs/dbraw/zinc/20/52/47/510205247.db2.gz SNHQXWXIHBPPGF-CXAGYDPISA-N 1 1 360.414 2.952 20 5 FFBDMO COc1ccc([C@@H](CCO)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184301058 510248693 /nfs/dbraw/zinc/24/86/93/510248693.db2.gz LSRWRZCQNAOHOC-MRXNPFEDSA-N 1 1 364.373 2.964 20 5 FFBDMO Cc1cnn([C@H]2CCC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000246043811 510262354 /nfs/dbraw/zinc/26/23/54/510262354.db2.gz SLFVEHYIYHQQNS-ROUUACIJSA-N 1 1 369.425 2.542 20 5 FFBDMO Cc1cnn([C@H]2CCC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000246043811 510262364 /nfs/dbraw/zinc/26/23/64/510262364.db2.gz SLFVEHYIYHQQNS-ROUUACIJSA-N 1 1 369.425 2.542 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246113271 510301411 /nfs/dbraw/zinc/30/14/11/510301411.db2.gz QEVNGRXUEHHRSN-KBXCAEBGSA-N 1 1 360.410 2.603 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246143264 510316800 /nfs/dbraw/zinc/31/68/00/510316800.db2.gz FAEOAIPVZCWCHB-OCCSQVGLSA-N 1 1 366.849 2.745 20 5 FFBDMO CCC[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)Nc1ccc(Cl)cc1 ZINC000174859006 510349620 /nfs/dbraw/zinc/34/96/20/510349620.db2.gz FPRPNGBLGDJYLJ-UHFFFAOYSA-N 1 1 365.821 2.795 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)Nc1ccc(Cl)cc1 ZINC000174859006 510349629 /nfs/dbraw/zinc/34/96/29/510349629.db2.gz FPRPNGBLGDJYLJ-UHFFFAOYSA-N 1 1 365.821 2.795 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000266024503 510365593 /nfs/dbraw/zinc/36/55/93/510365593.db2.gz MHOSTMVIFJYHSG-DOTOQJQBSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000184622163 510421928 /nfs/dbraw/zinc/42/19/28/510421928.db2.gz OEHKPWIMDFYBGN-HNAYVOBHSA-N 1 1 370.453 2.665 20 5 FFBDMO COC(=O)C1=NOC2(C1)CC[NH+](Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000184656691 510444412 /nfs/dbraw/zinc/44/44/12/510444412.db2.gz OTJFJBTYLSFGSO-UHFFFAOYSA-N 1 1 367.789 2.532 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](CO)c1ccccc1 ZINC000269603267 510479039 /nfs/dbraw/zinc/47/90/39/510479039.db2.gz PZHPPRQTHFRHCJ-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CCN(CC[N@H+](C)Cc3ccccc3)CC2)n1 ZINC000178211901 510490638 /nfs/dbraw/zinc/49/06/38/510490638.db2.gz DJILBKLPFSURLN-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO CCc1nc([C@@H](C)[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000184750012 510498292 /nfs/dbraw/zinc/49/82/92/510498292.db2.gz UUAHZZRCHXHGNS-VXGBXAGGSA-N 1 1 351.428 2.704 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000194747068 510509082 /nfs/dbraw/zinc/50/90/82/510509082.db2.gz CGYFZLBKCSDJKP-CQSZACIVSA-N 1 1 372.400 2.568 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000181847613 510624450 /nfs/dbraw/zinc/62/44/50/510624450.db2.gz AIKDKQZNPGVTLY-GFCCVEGCSA-N 1 1 357.863 2.941 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000175485928 510661289 /nfs/dbraw/zinc/66/12/89/510661289.db2.gz VHTOIXULWLCRBU-AWEZNQCLSA-N 1 1 371.393 2.695 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000246870314 510719302 /nfs/dbraw/zinc/71/93/02/510719302.db2.gz SIQAKKVFOIKCFY-WMLDXEAASA-N 1 1 363.458 2.770 20 5 FFBDMO C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1ccccc1 ZINC000270235560 510728217 /nfs/dbraw/zinc/72/82/17/510728217.db2.gz BEGHVEQKPREZPX-RTBURBONSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1ccccc1 ZINC000270235560 510728226 /nfs/dbraw/zinc/72/82/26/510728226.db2.gz BEGHVEQKPREZPX-RTBURBONSA-N 1 1 369.421 2.996 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)n1 ZINC000191608153 510748877 /nfs/dbraw/zinc/74/88/77/510748877.db2.gz WWLBCPGKGFNPLR-HNNXBMFYSA-N 1 1 363.462 2.586 20 5 FFBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270345433 510771102 /nfs/dbraw/zinc/77/11/02/510771102.db2.gz OUDFUWBUHRXVJA-HNNXBMFYSA-N 1 1 354.414 2.614 20 5 FFBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000247181697 510849513 /nfs/dbraw/zinc/84/95/13/510849513.db2.gz BJEGOCFXEXRLHY-IEBWSBKVSA-N 1 1 360.458 2.804 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000247446405 510861081 /nfs/dbraw/zinc/86/10/81/510861081.db2.gz PVVZUHJTUQOXJL-BLLLJJGKSA-N 1 1 353.850 2.979 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c1 ZINC000293865539 510879855 /nfs/dbraw/zinc/87/98/55/510879855.db2.gz DYYDZZXHUKZKGO-LJQANCHMSA-N 1 1 361.442 2.616 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000364604402 510965479 /nfs/dbraw/zinc/96/54/79/510965479.db2.gz JWSNNMJCONRHPJ-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC3(CCC[N@H+]3C)CC2)c([N+](=O)[O-])c1 ZINC000364608898 510967892 /nfs/dbraw/zinc/96/78/92/510967892.db2.gz VYVULGWKFPXAIH-UHFFFAOYSA-N 1 1 360.458 2.798 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270857512 511006489 /nfs/dbraw/zinc/00/64/89/511006489.db2.gz YVMYPUZVFGGTOT-SCLBCKFNSA-N 1 1 358.442 2.752 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)C2)C1 ZINC000294301751 511019245 /nfs/dbraw/zinc/01/92/45/511019245.db2.gz VXPWFEPSJIVHDK-QGZVFWFLSA-N 1 1 369.368 2.754 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000270912701 511024114 /nfs/dbraw/zinc/02/41/14/511024114.db2.gz LYRKBNKTLLKRRL-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000270912701 511024120 /nfs/dbraw/zinc/02/41/20/511024120.db2.gz LYRKBNKTLLKRRL-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294567322 511106403 /nfs/dbraw/zinc/10/64/03/511106403.db2.gz JUDOKKZJVRGMKL-QGZVFWFLSA-N 1 1 362.474 2.730 20 5 FFBDMO CCCC[NH+]1CCC(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000271229315 511130573 /nfs/dbraw/zinc/13/05/73/511130573.db2.gz FKIGLUQYRNVYRR-UHFFFAOYSA-N 1 1 361.489 2.736 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000294662530 511135540 /nfs/dbraw/zinc/13/55/40/511135540.db2.gz IIHNBOLXFBKVSS-OAHLLOKOSA-N 1 1 361.442 2.794 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](CO)c1ccccc1 ZINC000298045078 511155554 /nfs/dbraw/zinc/15/55/54/511155554.db2.gz HEJVMRZYQBOYAW-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO NC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000271397130 511190632 /nfs/dbraw/zinc/19/06/32/511190632.db2.gz VALGQBBVAGVOHL-SNVBAGLBSA-N 1 1 364.789 2.751 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@@H](C)CCN1CC[NH+](C)CC1 ZINC000294836997 511193958 /nfs/dbraw/zinc/19/39/58/511193958.db2.gz AZMHLXFMAQOKKI-AWEZNQCLSA-N 1 1 373.457 2.590 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298443515 511286030 /nfs/dbraw/zinc/28/60/30/511286030.db2.gz ZGPRYQKXWPXMBA-GOEBONIOSA-N 1 1 369.368 2.909 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@]1(C)CCCO ZINC000271987980 511392147 /nfs/dbraw/zinc/39/21/47/511392147.db2.gz DFDCHDDXRWEIQP-GOSISDBHSA-N 1 1 365.430 2.559 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000295417386 511398121 /nfs/dbraw/zinc/39/81/21/511398121.db2.gz DSEFHSLKLZPAKZ-YJBOKZPZSA-N 1 1 373.384 2.918 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)CC[C@@H]21 ZINC000295429928 511402767 /nfs/dbraw/zinc/40/27/67/511402767.db2.gz MKPKVBNNMBXCLC-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@@H]21 ZINC000295429928 511402770 /nfs/dbraw/zinc/40/27/70/511402770.db2.gz MKPKVBNNMBXCLC-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@@H]21 ZINC000295429928 511402775 /nfs/dbraw/zinc/40/27/75/511402775.db2.gz MKPKVBNNMBXCLC-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000283544639 511408910 /nfs/dbraw/zinc/40/89/10/511408910.db2.gz SMNXULCIJGASMS-GFCCVEGCSA-N 1 1 352.410 2.558 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCN2CCO[C@H]1C2 ZINC000295508543 511428620 /nfs/dbraw/zinc/42/86/20/511428620.db2.gz TUNLQNPIRMQYBC-GJZGRUSLSA-N 1 1 359.348 2.519 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000280364669 511437998 /nfs/dbraw/zinc/43/79/98/511437998.db2.gz JZAPZDFYHXMPEP-OAHLLOKOSA-N 1 1 361.373 2.791 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000280364669 511438003 /nfs/dbraw/zinc/43/80/03/511438003.db2.gz JZAPZDFYHXMPEP-OAHLLOKOSA-N 1 1 361.373 2.791 20 5 FFBDMO COCc1ccc(CNC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000292078739 511456349 /nfs/dbraw/zinc/45/63/49/511456349.db2.gz FKDZHTAJAAQHPG-UHFFFAOYSA-N 1 1 371.437 2.882 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000292117225 511472132 /nfs/dbraw/zinc/47/21/32/511472132.db2.gz GGLANEKYEDGUAU-AWEZNQCLSA-N 1 1 371.458 2.813 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000292117225 511472137 /nfs/dbraw/zinc/47/21/37/511472137.db2.gz GGLANEKYEDGUAU-AWEZNQCLSA-N 1 1 371.458 2.813 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000292273637 511533205 /nfs/dbraw/zinc/53/32/05/511533205.db2.gz QIVJQLXUQMREHO-MRXNPFEDSA-N 1 1 371.441 2.658 20 5 FFBDMO CC(C)[N@H+]1CCCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000292315863 511550120 /nfs/dbraw/zinc/55/01/20/511550120.db2.gz BAGHCSVVTUIPIM-CYBMUJFWSA-N 1 1 368.865 2.991 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000299243287 511564201 /nfs/dbraw/zinc/56/42/01/511564201.db2.gz XNDDAVMLIJJMPV-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000299344284 511600457 /nfs/dbraw/zinc/60/04/57/511600457.db2.gz NKLLMNRJRDZSMG-UHFFFAOYSA-N 1 1 354.410 2.586 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000299420217 511629500 /nfs/dbraw/zinc/62/95/00/511629500.db2.gz WUMPFVJDRMAMTC-HOTGVXAUSA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273846512 511629569 /nfs/dbraw/zinc/62/95/69/511629569.db2.gz GTYXDUFQMOSIBD-DYVFJYSZSA-N 1 1 363.433 2.954 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN(C)c1ccccc1 ZINC000303245124 511730814 /nfs/dbraw/zinc/73/08/14/511730814.db2.gz ALKCXBDQJISWID-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303245124 511730820 /nfs/dbraw/zinc/73/08/20/511730820.db2.gz ALKCXBDQJISWID-OAHLLOKOSA-N 1 1 356.426 2.990 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000281180436 511748921 /nfs/dbraw/zinc/74/89/21/511748921.db2.gz QUBBSDCGTJHGGV-LPHOPBHVSA-N 1 1 369.421 2.613 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000292965004 511788189 /nfs/dbraw/zinc/78/81/89/511788189.db2.gz LTARZEQZZNCUSM-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000292965004 511788194 /nfs/dbraw/zinc/78/81/94/511788194.db2.gz LTARZEQZZNCUSM-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000292965004 511788197 /nfs/dbraw/zinc/78/81/97/511788197.db2.gz LTARZEQZZNCUSM-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(C1)CCC[N@H+](C)C2 ZINC000292965004 511788203 /nfs/dbraw/zinc/78/82/03/511788203.db2.gz LTARZEQZZNCUSM-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000274326639 511795499 /nfs/dbraw/zinc/79/54/99/511795499.db2.gz YUTFYRKOGVUFPL-HIFRSBDPSA-N 1 1 371.441 2.692 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000366075464 511824787 /nfs/dbraw/zinc/82/47/87/511824787.db2.gz DMBYZIPGNVYGKF-SNVBAGLBSA-N 1 1 364.789 2.762 20 5 FFBDMO CCc1nocc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000293413359 511955953 /nfs/dbraw/zinc/95/59/53/511955953.db2.gz MQBCBEKZADDQEC-UHFFFAOYSA-N 1 1 362.386 2.614 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000297071336 512008212 /nfs/dbraw/zinc/00/82/12/512008212.db2.gz AGPKMHIWWSEWIO-KRWDZBQOSA-N 1 1 366.849 2.876 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000377776703 512444538 /nfs/dbraw/zinc/44/45/38/512444538.db2.gz HFWOULXORHIHEJ-QWRGUYRKSA-N 1 1 368.231 2.714 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H]1CC(C)C ZINC000411285975 512562280 /nfs/dbraw/zinc/56/22/80/512562280.db2.gz WFEBSIDEQKYMIG-HNNXBMFYSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1F ZINC000411414770 512624608 /nfs/dbraw/zinc/62/46/08/512624608.db2.gz BZAGILSBMDUUDV-OLZOCXBDSA-N 1 1 367.421 2.522 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000374067909 512647435 /nfs/dbraw/zinc/64/74/35/512647435.db2.gz UCSRKBKXLJJJDH-HXUWFJFHSA-N 1 1 369.469 2.816 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000411506018 512666919 /nfs/dbraw/zinc/66/69/19/512666919.db2.gz PBCMRMMUDGPJKB-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000372013914 512678875 /nfs/dbraw/zinc/67/88/75/512678875.db2.gz ROPQQEGSHFURNJ-OAHLLOKOSA-N 1 1 354.410 2.726 20 5 FFBDMO Cc1noc([C@@H]2CCCC[N@@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411730404 512782953 /nfs/dbraw/zinc/78/29/53/512782953.db2.gz OELKWNAHYKKJQF-HNNXBMFYSA-N 1 1 359.386 2.842 20 5 FFBDMO Cc1noc([C@@H]2CCCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)n1 ZINC000411730404 512782959 /nfs/dbraw/zinc/78/29/59/512782959.db2.gz OELKWNAHYKKJQF-HNNXBMFYSA-N 1 1 359.386 2.842 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000411763900 512799799 /nfs/dbraw/zinc/79/97/99/512799799.db2.gz ZJYKPGMPDSHRQZ-CQSZACIVSA-N 1 1 367.471 2.767 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000372330090 512818490 /nfs/dbraw/zinc/81/84/90/512818490.db2.gz DRZXIVZSRBBWNB-MAUKXSAKSA-N 1 1 358.442 2.896 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411823433 512831963 /nfs/dbraw/zinc/83/19/63/512831963.db2.gz PWFKZMFDDQREIS-OAHLLOKOSA-N 1 1 365.430 2.823 20 5 FFBDMO O=[N+]([O-])c1cn(C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)nc1C1CC1 ZINC000370278487 512856493 /nfs/dbraw/zinc/85/64/93/512856493.db2.gz GTPSTOXTCDDWOI-KRWDZBQOSA-N 1 1 356.426 2.960 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CC[C@H](O)C[C@H]4C3)o2)c1 ZINC000412051301 512932757 /nfs/dbraw/zinc/93/27/57/512932757.db2.gz WGYXRCQMSXUIHN-ZOBUZTSGSA-N 1 1 357.410 2.885 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](N2CCCC2=O)CC1 ZINC000412056102 512934251 /nfs/dbraw/zinc/93/42/51/512934251.db2.gz NMVNJYBXPXWSNU-INIZCTEOSA-N 1 1 361.442 2.970 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)CC3(C)C)cc2[N+](=O)[O-])CC1 ZINC000408050488 512989851 /nfs/dbraw/zinc/98/98/51/512989851.db2.gz JWODLFPMRUCKNQ-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)CC3(C)C)cc2[N+](=O)[O-])CC1 ZINC000408050488 512989855 /nfs/dbraw/zinc/98/98/55/512989855.db2.gz JWODLFPMRUCKNQ-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071511 512993814 /nfs/dbraw/zinc/99/38/14/512993814.db2.gz QCDKOZICPCBOHH-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071511 512993816 /nfs/dbraw/zinc/99/38/16/512993816.db2.gz QCDKOZICPCBOHH-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000372769187 513036391 /nfs/dbraw/zinc/03/63/91/513036391.db2.gz WJDQRRBRQQPOCD-STQMWFEESA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445882841 513137868 /nfs/dbraw/zinc/13/78/68/513137868.db2.gz ARCLBQHASRDIHD-CABCVRRESA-N 1 1 360.458 2.783 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]Cc2ccccc21 ZINC000428892552 513217499 /nfs/dbraw/zinc/21/74/99/513217499.db2.gz OTTZIBWYHPCTKW-UHFFFAOYSA-N 1 1 354.410 2.923 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000412703385 513235000 /nfs/dbraw/zinc/23/50/00/513235000.db2.gz XRXJRDMLBBYGJX-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000412703385 513235006 /nfs/dbraw/zinc/23/50/06/513235006.db2.gz XRXJRDMLBBYGJX-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H](c1ccccc1)[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450566528 513252959 /nfs/dbraw/zinc/25/29/59/513252959.db2.gz KXYFLUQDTWFPPN-KYJSFNMBSA-N 1 1 356.426 2.641 20 5 FFBDMO CC[NH+](CC)CC1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1 ZINC000434176313 513255587 /nfs/dbraw/zinc/25/55/87/513255587.db2.gz DMGREIIBMHQPHO-UHFFFAOYSA-N 1 1 351.451 2.635 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000434424052 513319971 /nfs/dbraw/zinc/31/99/71/513319971.db2.gz HLZVUZVVBVCJAP-QGZVFWFLSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@H]2CCCN(c3cc(C)ccc3[N+](=O)[O-])C2)CC1 ZINC000450763648 513330710 /nfs/dbraw/zinc/33/07/10/513330710.db2.gz BMADGVXORXGSOH-GOSISDBHSA-N 1 1 374.485 2.674 20 5 FFBDMO C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C[C@H](C)[N@@H+]1CCO ZINC000450800732 513347970 /nfs/dbraw/zinc/34/79/70/513347970.db2.gz ZMHKBPHPVNICRP-BETUJISGSA-N 1 1 362.455 2.610 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413087958 513436394 /nfs/dbraw/zinc/43/63/94/513436394.db2.gz ZYWYIKLORGZCJF-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441278285 513527911 /nfs/dbraw/zinc/52/79/11/513527911.db2.gz PHUJRZARBXGRFP-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[N@H+](C)Cc3ccccc32)c1F ZINC000413369438 513618788 /nfs/dbraw/zinc/61/87/88/513618788.db2.gz SXELAGNBXIRJHB-UHFFFAOYSA-N 1 1 373.384 2.764 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[N@@H+](C)Cc3ccccc32)c1F ZINC000413369438 513618792 /nfs/dbraw/zinc/61/87/92/513618792.db2.gz SXELAGNBXIRJHB-UHFFFAOYSA-N 1 1 373.384 2.764 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccccc1[N+](=O)[O-] ZINC000451340833 513686407 /nfs/dbraw/zinc/68/64/07/513686407.db2.gz KJIZTYLGQCPKFA-YXJHDRRASA-N 1 1 361.442 2.939 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000430694717 513724760 /nfs/dbraw/zinc/72/47/60/513724760.db2.gz KZRNZKRRKKKPPV-OAHLLOKOSA-N 1 1 372.400 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451414735 513734074 /nfs/dbraw/zinc/73/40/74/513734074.db2.gz IVTUBVANNDYIPN-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451432885 513749361 /nfs/dbraw/zinc/74/93/61/513749361.db2.gz ZZFWPUNNXRUBIU-JGGQBBKZSA-N 1 1 367.833 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCSC[C@@H]2C2CCC2)c1 ZINC000419363168 513789019 /nfs/dbraw/zinc/78/90/19/513789019.db2.gz OPPSIOBOAPLGPR-DOTOQJQBSA-N 1 1 352.456 2.552 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000448695984 513849577 /nfs/dbraw/zinc/84/95/77/513849577.db2.gz CKYZXQHPJIUYHN-NWDGAFQWSA-N 1 1 353.394 2.735 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451861478 514027081 /nfs/dbraw/zinc/02/70/81/514027081.db2.gz AKTHWIBGIMYSPT-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451964046 514098439 /nfs/dbraw/zinc/09/84/39/514098439.db2.gz INIZLDDUQJSHHO-WMLDXEAASA-N 1 1 352.456 2.554 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@]3(CCSC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451963922 514098558 /nfs/dbraw/zinc/09/85/58/514098558.db2.gz IFCUVJNFIAGETF-WMZOPIPTSA-N 1 1 361.467 2.919 20 5 FFBDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000449421971 514204673 /nfs/dbraw/zinc/20/46/73/514204673.db2.gz MFJQCTHGMDQNNE-ZYHUDNBSSA-N 1 1 360.357 2.798 20 5 FFBDMO CSc1cccc(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)c1[N+](=O)[O-] ZINC000432573649 514230991 /nfs/dbraw/zinc/23/09/91/514230991.db2.gz GKWOUSYNLCIKGG-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO CN(CC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000437854712 514252337 /nfs/dbraw/zinc/25/23/37/514252337.db2.gz ZWMMBCCJVSQSFB-KRWDZBQOSA-N 1 1 374.485 2.944 20 5 FFBDMO COC(=O)c1cc([C@@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)oc1C ZINC000432778558 514282755 /nfs/dbraw/zinc/28/27/55/514282755.db2.gz DXXKEQGTZTXPPL-YPMHNXCESA-N 1 1 374.397 2.925 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(NC/C=C/c3ccccc3[N+](=O)[O-])cc2C1 ZINC000433197082 514415262 /nfs/dbraw/zinc/41/52/62/514415262.db2.gz PIVPOHRIMWMKCT-HWKANZROSA-N 1 1 366.421 2.564 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(NC/C=C/c3ccccc3[N+](=O)[O-])cc2C1 ZINC000433197082 514415268 /nfs/dbraw/zinc/41/52/68/514415268.db2.gz PIVPOHRIMWMKCT-HWKANZROSA-N 1 1 366.421 2.564 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCSC1 ZINC000433194343 514415286 /nfs/dbraw/zinc/41/52/86/514415286.db2.gz WGYWHQONRSXKBR-HNNXBMFYSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCSC1 ZINC000433194343 514415294 /nfs/dbraw/zinc/41/52/94/514415294.db2.gz WGYWHQONRSXKBR-HNNXBMFYSA-N 1 1 367.471 2.686 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000428227135 514425988 /nfs/dbraw/zinc/42/59/88/514425988.db2.gz JCACDVNXHIVQIF-SFHVURJKSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@H]1CSCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000428227135 514425995 /nfs/dbraw/zinc/42/59/95/514425995.db2.gz JCACDVNXHIVQIF-SFHVURJKSA-N 1 1 371.462 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCn4cc[nH+]c4C3)n2)c2c1NCCC2 ZINC000453231661 514575343 /nfs/dbraw/zinc/57/53/43/514575343.db2.gz GLJLTMSFQBJLAG-LLVKDONJSA-N 1 1 366.381 2.929 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000458169536 514599265 /nfs/dbraw/zinc/59/92/65/514599265.db2.gz OSADLJCULZOPRN-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000475576241 514720177 /nfs/dbraw/zinc/72/01/77/514720177.db2.gz SRONBMJKHCWXQZ-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000475576241 514720187 /nfs/dbraw/zinc/72/01/87/514720187.db2.gz SRONBMJKHCWXQZ-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO CCOC(=O)c1cc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)cc([N+](=O)[O-])c1 ZINC000502749461 514760760 /nfs/dbraw/zinc/76/07/60/514760760.db2.gz NULVTZJCRIOOAI-UHFFFAOYSA-N 1 1 368.349 2.980 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cccc(C)n2)c([N+](=O)[O-])c1 ZINC000471197374 514792292 /nfs/dbraw/zinc/79/22/92/514792292.db2.gz WXENXQOCYYDVTP-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000458438342 514799004 /nfs/dbraw/zinc/79/90/04/514799004.db2.gz UNHCIMCSIGFQMD-KRWDZBQOSA-N 1 1 362.474 2.949 20 5 FFBDMO Cc1cc(N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461946058 514800488 /nfs/dbraw/zinc/80/04/88/514800488.db2.gz LZVZZOHEKYBJTQ-NEPJUHHUSA-N 1 1 361.364 2.813 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000480375675 514936072 /nfs/dbraw/zinc/93/60/72/514936072.db2.gz GTHGPYVTLIVLIW-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000480375675 514936075 /nfs/dbraw/zinc/93/60/75/514936075.db2.gz GTHGPYVTLIVLIW-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000467217474 514942356 /nfs/dbraw/zinc/94/23/56/514942356.db2.gz NGHLIIHWQAJVGL-UHFFFAOYSA-N 1 1 352.822 2.699 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000480511652 514984038 /nfs/dbraw/zinc/98/40/38/514984038.db2.gz MILYCYVXEZVTNI-CQSZACIVSA-N 1 1 371.441 2.703 20 5 FFBDMO CCS[C@@H]1CCCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000480866803 515115879 /nfs/dbraw/zinc/11/58/79/515115879.db2.gz RKUVMKCTISTZMH-DOTOQJQBSA-N 1 1 354.472 2.942 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000481020513 515175282 /nfs/dbraw/zinc/17/52/82/515175282.db2.gz HNNUJCZKSDPWHA-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C[C@H]1C ZINC000481057237 515189681 /nfs/dbraw/zinc/18/96/81/515189681.db2.gz KGXDYLUPCCJQCX-CABCVRRESA-N 1 1 369.487 2.705 20 5 FFBDMO C[N@@H+]1CC=C(CNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC1 ZINC000462700108 515196526 /nfs/dbraw/zinc/19/65/26/515196526.db2.gz KPRSKVDDWKEQGL-UHFFFAOYSA-N 1 1 354.410 2.665 20 5 FFBDMO C[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCC[C@H](C)C1 ZINC000485824624 515204846 /nfs/dbraw/zinc/20/48/46/515204846.db2.gz ZWSLRBVJPVKRQN-NWDGAFQWSA-N 1 1 355.385 2.652 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519599 515360126 /nfs/dbraw/zinc/36/01/26/515360126.db2.gz LEYZRIFDSVTILG-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519599 515360138 /nfs/dbraw/zinc/36/01/38/515360138.db2.gz LEYZRIFDSVTILG-WBMJQRKESA-N 1 1 363.414 2.505 20 5 FFBDMO COc1cc(C[N@@H+](C[C@H](C)O)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491089732 515375140 /nfs/dbraw/zinc/37/51/40/515375140.db2.gz NGVIPJXWPBHPOQ-NSHDSACASA-N 1 1 362.373 2.839 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000463399837 515476369 /nfs/dbraw/zinc/47/63/69/515476369.db2.gz KRSAUSQSMKZURC-IYBDPMFKSA-N 1 1 362.474 2.515 20 5 FFBDMO CC[N@@H+](CCNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC000454467911 515510457 /nfs/dbraw/zinc/51/04/57/515510457.db2.gz NQZGXQRZFVUUCW-MRXNPFEDSA-N 1 1 360.458 2.968 20 5 FFBDMO CCCN(CC[NH+]1CCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000510486332 515553319 /nfs/dbraw/zinc/55/33/19/515553319.db2.gz YGBYKBLCQRDPTO-UHFFFAOYSA-N 1 1 361.489 2.543 20 5 FFBDMO COc1cccc([C@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC[N@H+]2C2CC2)c1 ZINC000482047139 515557778 /nfs/dbraw/zinc/55/77/78/515557778.db2.gz WAZRZHZECOTURE-QAPCUYQASA-N 1 1 370.409 2.639 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)ccc1[N+](=O)[O-] ZINC000492784580 515563599 /nfs/dbraw/zinc/56/35/99/515563599.db2.gz PWSPYDIGIGEIHR-AWEZNQCLSA-N 1 1 357.414 2.979 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456998686 515574711 /nfs/dbraw/zinc/57/47/11/515574711.db2.gz SGQYNPNZANRUHH-QGZVFWFLSA-N 1 1 357.435 2.860 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C)o1 ZINC000500085750 515585247 /nfs/dbraw/zinc/58/52/47/515585247.db2.gz BCOBSPPDKBEICM-UHFFFAOYSA-N 1 1 361.398 2.973 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000468969811 515606909 /nfs/dbraw/zinc/60/69/09/515606909.db2.gz LWDBXBLRAASLIB-HNNXBMFYSA-N 1 1 356.426 2.550 20 5 FFBDMO CN(C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000463841098 515636764 /nfs/dbraw/zinc/63/67/64/515636764.db2.gz LTCQDOSVYGUEBW-LBPRGKRZSA-N 1 1 357.332 2.922 20 5 FFBDMO CS(=O)(=O)c1ccc(F)c(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000500384862 515682870 /nfs/dbraw/zinc/68/28/70/515682870.db2.gz QHBGSXJCKNGAJB-GQCTYLIASA-N 1 1 364.398 2.940 20 5 FFBDMO CC(=O)N[C@@H](C)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000482498788 515698151 /nfs/dbraw/zinc/69/81/51/515698151.db2.gz CFUHFXSCVSLLKO-NSHDSACASA-N 1 1 371.384 2.933 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC1CC[NH+](Cc2ccccn2)CC1 ZINC000482508956 515701745 /nfs/dbraw/zinc/70/17/45/515701745.db2.gz KLDXRFWDNNIOMX-UHFFFAOYSA-N 1 1 356.426 2.753 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000510887564 515703401 /nfs/dbraw/zinc/70/34/01/515703401.db2.gz KRUGGGWHKCNAOG-ZDUSSCGKSA-N 1 1 359.348 2.875 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2cncc(F)c2)c([N+](=O)[O-])c1 ZINC000459626179 515704347 /nfs/dbraw/zinc/70/43/47/515704347.db2.gz ZWWJCJFRBMPOAI-NSHDSACASA-N 1 1 362.361 2.817 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000494006104 515711736 /nfs/dbraw/zinc/71/17/36/515711736.db2.gz GEEPOXXILYVORV-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@@](O)(CO)C2)cc1[N+](=O)[O-] ZINC000459704672 515757129 /nfs/dbraw/zinc/75/71/29/515757129.db2.gz HSQOYIGWTODPBL-FQEVSTJZSA-N 1 1 371.437 2.682 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000511076518 515769004 /nfs/dbraw/zinc/76/90/04/515769004.db2.gz XXNIJAUTMDZQDA-QGZVFWFLSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000511076518 515769012 /nfs/dbraw/zinc/76/90/12/515769012.db2.gz XXNIJAUTMDZQDA-QGZVFWFLSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(=O)n2cc(Cl)ccc2n1 ZINC000511097191 515779394 /nfs/dbraw/zinc/77/93/94/515779394.db2.gz UKLAZQNFEYZEJD-UHFFFAOYSA-N 1 1 372.812 2.931 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCCCc1ccccc1 ZINC000511126221 515793898 /nfs/dbraw/zinc/79/38/98/515793898.db2.gz YHAUKLYOVCLSGF-UHFFFAOYSA-N 1 1 355.438 2.818 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCCCc1ccccc1 ZINC000511126221 515793907 /nfs/dbraw/zinc/79/39/07/515793907.db2.gz YHAUKLYOVCLSGF-UHFFFAOYSA-N 1 1 355.438 2.818 20 5 FFBDMO O=C(Nc1ccccc1)[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000478421277 515816538 /nfs/dbraw/zinc/81/65/38/515816538.db2.gz ZOSGICWUQGKBQB-SFHVURJKSA-N 1 1 365.393 2.761 20 5 FFBDMO CC(C)(CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000500697531 515820296 /nfs/dbraw/zinc/82/02/96/515820296.db2.gz IUINFYXZZAPLII-UHFFFAOYSA-N 1 1 369.421 2.867 20 5 FFBDMO CC(C)(CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000500697531 515820302 /nfs/dbraw/zinc/82/03/02/515820302.db2.gz IUINFYXZZAPLII-UHFFFAOYSA-N 1 1 369.421 2.867 20 5 FFBDMO CCN(CCn1ccc([N+](=O)[O-])n1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000478437698 515822972 /nfs/dbraw/zinc/82/29/72/515822972.db2.gz QCGNYTPNZABYCL-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000478437698 515822979 /nfs/dbraw/zinc/82/29/79/515822979.db2.gz QCGNYTPNZABYCL-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000478437698 515822985 /nfs/dbraw/zinc/82/29/85/515822985.db2.gz QCGNYTPNZABYCL-SJLPKXTDSA-N 1 1 357.458 2.949 20 5 FFBDMO COc1c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000474201803 515931894 /nfs/dbraw/zinc/93/18/94/515931894.db2.gz YLQUYCOGDGHCSO-OAHLLOKOSA-N 1 1 359.382 2.763 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704656 515933410 /nfs/dbraw/zinc/93/34/10/515933410.db2.gz TTYXLELRFKXRNM-QZTJIDSGSA-N 1 1 359.426 2.591 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704656 515933418 /nfs/dbraw/zinc/93/34/18/515933418.db2.gz TTYXLELRFKXRNM-QZTJIDSGSA-N 1 1 359.426 2.591 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000478733125 515944945 /nfs/dbraw/zinc/94/49/45/515944945.db2.gz AAAWWKLWHGXBQK-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO CC[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1 ZINC000483168863 515966217 /nfs/dbraw/zinc/96/62/17/515966217.db2.gz NHVPDLSXSDLTAS-WMZOPIPTSA-N 1 1 350.415 2.634 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000478824839 515978236 /nfs/dbraw/zinc/97/82/36/515978236.db2.gz BZQSLQVVAMTHLR-UHFFFAOYSA-N 1 1 368.437 2.925 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1C ZINC000487986267 516066138 /nfs/dbraw/zinc/06/61/38/516066138.db2.gz GYTVZQYMEMIGRZ-YOEHRIQHSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1C ZINC000487986267 516066150 /nfs/dbraw/zinc/06/61/50/516066150.db2.gz GYTVZQYMEMIGRZ-YOEHRIQHSA-N 1 1 370.471 2.506 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-])C1CC1 ZINC000495107393 516066719 /nfs/dbraw/zinc/06/67/19/516066719.db2.gz YTUZILTYQKOKCR-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C ZINC000460208857 516068817 /nfs/dbraw/zinc/06/88/17/516068817.db2.gz HPXRHCGOIZWVCR-KGLIPLIRSA-N 1 1 358.446 2.792 20 5 FFBDMO CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507091611 516086082 /nfs/dbraw/zinc/08/60/82/516086082.db2.gz WSVHKNYDDLZTRN-UHFFFAOYSA-N 1 1 370.409 2.684 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000501450764 516108260 /nfs/dbraw/zinc/10/82/60/516108260.db2.gz XFZSNUSJUBUSDO-GJZGRUSLSA-N 1 1 358.442 2.786 20 5 FFBDMO C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000488091190 516113765 /nfs/dbraw/zinc/11/37/65/516113765.db2.gz BNLBRDQXGVHLFU-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000488091190 516113772 /nfs/dbraw/zinc/11/37/72/516113772.db2.gz BNLBRDQXGVHLFU-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000470170581 516161350 /nfs/dbraw/zinc/16/13/50/516161350.db2.gz XLDKBAZJJWKQKN-FXFXYLOPSA-N 1 1 373.453 2.569 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@H]1CCc2[nH+]ccn2C1 ZINC000470352896 516216195 /nfs/dbraw/zinc/21/61/95/516216195.db2.gz FVUMLMAPKBLBAV-LLVKDONJSA-N 1 1 363.805 2.507 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000496074214 516233943 /nfs/dbraw/zinc/23/39/43/516233943.db2.gz UOMMIJLHDPJLAG-ZDUSSCGKSA-N 1 1 358.402 2.583 20 5 FFBDMO C[N@@H+]1CCCC[C@H]1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000496074214 516233950 /nfs/dbraw/zinc/23/39/50/516233950.db2.gz UOMMIJLHDPJLAG-ZDUSSCGKSA-N 1 1 358.402 2.583 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000496074214 516233956 /nfs/dbraw/zinc/23/39/56/516233956.db2.gz UOMMIJLHDPJLAG-ZDUSSCGKSA-N 1 1 358.402 2.583 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000488713933 516291462 /nfs/dbraw/zinc/29/14/62/516291462.db2.gz MJTOOYAYMUBKKG-MISXGVKJSA-N 1 1 369.263 2.919 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)[C@@H](c2ccccc2)C1 ZINC000497402523 516320094 /nfs/dbraw/zinc/32/00/94/516320094.db2.gz UOBZKZQLIIBBQW-NVXWUHKLSA-N 1 1 364.405 2.904 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@H](COC(F)F)C3)o2)cc1 ZINC000512841541 516380983 /nfs/dbraw/zinc/38/09/83/516380983.db2.gz UAOJUBBPFOSXOX-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](COC(F)F)C3)o2)cc1 ZINC000512841541 516380991 /nfs/dbraw/zinc/38/09/91/516380991.db2.gz UAOJUBBPFOSXOX-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000557877167 516483100 /nfs/dbraw/zinc/48/31/00/516483100.db2.gz AKYCUOJHBRQFFU-JKSUJKDBSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1c(F)cncc1F ZINC000513267541 516548957 /nfs/dbraw/zinc/54/89/57/516548957.db2.gz QPUNMTRKVIEEGU-SNVBAGLBSA-N 1 1 350.325 2.947 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240935 516656769 /nfs/dbraw/zinc/65/67/69/516656769.db2.gz TXNUUGRFVJVYRV-GHMZBOCLSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240935 516656778 /nfs/dbraw/zinc/65/67/78/516656778.db2.gz TXNUUGRFVJVYRV-GHMZBOCLSA-N 1 1 357.863 2.891 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCc1cc(F)cc(F)c1 ZINC000554847348 516662344 /nfs/dbraw/zinc/66/23/44/516662344.db2.gz AXCMFBZXFWREMC-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCc1cc(F)cc(F)c1 ZINC000554847348 516662346 /nfs/dbraw/zinc/66/23/46/516662346.db2.gz AXCMFBZXFWREMC-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCO2 ZINC000558363798 516707634 /nfs/dbraw/zinc/70/76/34/516707634.db2.gz XRSYANDCTBJUAO-UHFFFAOYSA-N 1 1 374.393 2.851 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000558460965 516753175 /nfs/dbraw/zinc/75/31/75/516753175.db2.gz BHSBWBZOUXTNOK-LJQANCHMSA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000558460965 516753185 /nfs/dbraw/zinc/75/31/85/516753185.db2.gz BHSBWBZOUXTNOK-LJQANCHMSA-N 1 1 368.437 2.663 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561762603 516757224 /nfs/dbraw/zinc/75/72/24/516757224.db2.gz PBHBWZFGSKDJHQ-JJRVBVJISA-N 1 1 363.483 2.876 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000518871145 516802165 /nfs/dbraw/zinc/80/21/65/516802165.db2.gz XBDUBXCKXRNZAR-XHSDSOJGSA-N 1 1 361.442 2.837 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000541100987 516875070 /nfs/dbraw/zinc/87/50/70/516875070.db2.gz LXFVLMXPECMTQV-STQMWFEESA-N 1 1 350.419 2.845 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514183606 516892094 /nfs/dbraw/zinc/89/20/94/516892094.db2.gz NNVKHSLGIWHXGH-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514183606 516892104 /nfs/dbraw/zinc/89/21/04/516892104.db2.gz NNVKHSLGIWHXGH-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000558739216 516922988 /nfs/dbraw/zinc/92/29/88/516922988.db2.gz GQFULRIQOIXFJQ-GOSISDBHSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N[C@@H]1CCOc2ccccc21 ZINC000558739216 516922998 /nfs/dbraw/zinc/92/29/98/516922998.db2.gz GQFULRIQOIXFJQ-GOSISDBHSA-N 1 1 369.421 2.709 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccccc2-n2cc[nH+]c2C)n1 ZINC000558948125 517012975 /nfs/dbraw/zinc/01/29/75/517012975.db2.gz RZDXUKWGVMBHJT-UHFFFAOYSA-N 1 1 367.365 2.883 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000525355609 517016260 /nfs/dbraw/zinc/01/62/60/517016260.db2.gz YVIFRGISLGHPTJ-GOSISDBHSA-N 1 1 362.474 2.899 20 5 FFBDMO CO[C@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000552066041 517059707 /nfs/dbraw/zinc/05/97/07/517059707.db2.gz WZXXBJMCPDSYBS-ZIAGYGMSSA-N 1 1 372.347 2.975 20 5 FFBDMO C[N@@H+](CCc1cccc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)c1)C1CC1 ZINC000537168595 517064025 /nfs/dbraw/zinc/06/40/25/517064025.db2.gz CUNLZVXEMXUTMC-UHFFFAOYSA-N 1 1 356.382 2.584 20 5 FFBDMO COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)C1 ZINC000537170759 517067269 /nfs/dbraw/zinc/06/72/69/517067269.db2.gz UKJMYDXVDOISKR-CYBMUJFWSA-N 1 1 367.471 2.546 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000545162537 517081682 /nfs/dbraw/zinc/08/16/82/517081682.db2.gz NTPRCVYGVFYZQB-UHFFFAOYSA-N 1 1 357.332 2.995 20 5 FFBDMO C[C@H](C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719603 517085946 /nfs/dbraw/zinc/08/59/46/517085946.db2.gz IYHHNRSVZXGMTK-ZNMIVQPWSA-N 1 1 363.458 2.702 20 5 FFBDMO C[C@H](C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719603 517085956 /nfs/dbraw/zinc/08/59/56/517085956.db2.gz IYHHNRSVZXGMTK-ZNMIVQPWSA-N 1 1 363.458 2.702 20 5 FFBDMO C[C@@H]1C[C@H]1N1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000525708443 517129692 /nfs/dbraw/zinc/12/96/92/517129692.db2.gz PKHPQBYBAKCWBY-AXAPSJFSSA-N 1 1 372.450 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000519697475 517133832 /nfs/dbraw/zinc/13/38/32/517133832.db2.gz KAKMQFWSXQATHL-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO C[C@@H]1c2cccn2CC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532901641 517195666 /nfs/dbraw/zinc/19/56/66/517195666.db2.gz DIVCMRQPZBZYSE-CYBMUJFWSA-N 1 1 356.382 2.771 20 5 FFBDMO C[C@@H]1c2cccn2CC[N@@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532901641 517195669 /nfs/dbraw/zinc/19/56/69/517195669.db2.gz DIVCMRQPZBZYSE-CYBMUJFWSA-N 1 1 356.382 2.771 20 5 FFBDMO C[C@H](C[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 ZINC000532942554 517215185 /nfs/dbraw/zinc/21/51/85/517215185.db2.gz LPRBHUWQNXUSML-CYBMUJFWSA-N 1 1 371.393 2.998 20 5 FFBDMO Cc1cc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)n(C(C)(C)C)n1 ZINC000548928448 517310154 /nfs/dbraw/zinc/31/01/54/517310154.db2.gz SRDAFQVIFDHLHP-UHFFFAOYSA-N 1 1 373.457 2.968 20 5 FFBDMO Cc1cc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)n(C(C)(C)C)n1 ZINC000548928448 517310167 /nfs/dbraw/zinc/31/01/67/517310167.db2.gz SRDAFQVIFDHLHP-UHFFFAOYSA-N 1 1 373.457 2.968 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F ZINC000545878482 517410542 /nfs/dbraw/zinc/41/05/42/517410542.db2.gz QIEAIUDSPBKADK-LBPRGKRZSA-N 1 1 362.405 2.969 20 5 FFBDMO COCC1(C)CC[NH+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000537997774 517429852 /nfs/dbraw/zinc/42/98/52/517429852.db2.gz KCZXUZRNASCYFM-ZDUSSCGKSA-N 1 1 365.430 2.679 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000533409434 517451820 /nfs/dbraw/zinc/45/18/20/517451820.db2.gz WTHRVMLOPLGPTL-OAHLLOKOSA-N 1 1 362.474 2.974 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1C ZINC000533447350 517469415 /nfs/dbraw/zinc/46/94/15/517469415.db2.gz GKHCPFIEUZOVQO-BBRMVZONSA-N 1 1 359.430 2.949 20 5 FFBDMO Cc1c(Cl)cccc1N1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000556532578 517479956 /nfs/dbraw/zinc/47/99/56/517479956.db2.gz VKKHASWFLLRNCL-UHFFFAOYSA-N 1 1 363.849 2.965 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C)[NH+]1CCSCC1 ZINC000533548344 517520125 /nfs/dbraw/zinc/52/01/25/517520125.db2.gz HXEHCHZNWUYKEL-AWEZNQCLSA-N 1 1 351.472 2.769 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ncnc3sc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000553247354 517599717 /nfs/dbraw/zinc/59/97/17/517599717.db2.gz VECNADWFMHGMJI-PHIMTYICSA-N 1 1 365.459 2.899 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000516330942 517662999 /nfs/dbraw/zinc/66/29/99/517662999.db2.gz JKYMCMPJGYRRBV-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO COc1ccc2c(c1)CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000534102290 517742419 /nfs/dbraw/zinc/74/24/19/517742419.db2.gz JFYDCHFIYOXJEK-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000534102290 517742423 /nfs/dbraw/zinc/74/24/23/517742423.db2.gz JFYDCHFIYOXJEK-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000538750895 517762438 /nfs/dbraw/zinc/76/24/38/517762438.db2.gz FNSFDZXZCDFEHD-LBPRGKRZSA-N 1 1 366.414 2.776 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000538750895 517762450 /nfs/dbraw/zinc/76/24/50/517762450.db2.gz FNSFDZXZCDFEHD-LBPRGKRZSA-N 1 1 366.414 2.776 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)CC2 ZINC000563252545 517771298 /nfs/dbraw/zinc/77/12/98/517771298.db2.gz HMZILHBVIZHORO-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[NH+]1CCOCC1 ZINC000534245260 517801952 /nfs/dbraw/zinc/80/19/52/517801952.db2.gz DAEXKWBAVPKZEM-AWEZNQCLSA-N 1 1 374.441 2.553 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000553694123 517856656 /nfs/dbraw/zinc/85/66/56/517856656.db2.gz NIMFAFUYCZDSBO-LBPRGKRZSA-N 1 1 367.471 2.930 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](c2ccccc2)C1 ZINC000557163533 517892966 /nfs/dbraw/zinc/89/29/66/517892966.db2.gz VXWWFSDJARIGMZ-GOSISDBHSA-N 1 1 351.410 2.960 20 5 FFBDMO CC[N@@H+](CCC1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1)CC(C)C ZINC000539097804 517911400 /nfs/dbraw/zinc/91/14/00/517911400.db2.gz ZPWGNNGAFTZLFE-UHFFFAOYSA-N 1 1 351.495 2.908 20 5 FFBDMO Cc1cccc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000557198339 517915656 /nfs/dbraw/zinc/91/56/56/517915656.db2.gz ZHUGFGKATSQSFM-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cccc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000557198339 517915664 /nfs/dbraw/zinc/91/56/64/517915664.db2.gz ZHUGFGKATSQSFM-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000543185953 517954557 /nfs/dbraw/zinc/95/45/57/517954557.db2.gz BKOBWQLZFRATCT-IRXDYDNUSA-N 1 1 372.421 2.735 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000543437363 518090423 /nfs/dbraw/zinc/09/04/23/518090423.db2.gz UBVMRRDKWLVVFD-RYUDHWBXSA-N 1 1 369.263 2.981 20 5 FFBDMO C[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@H+]1CCc2sccc2C1 ZINC000543438729 518092839 /nfs/dbraw/zinc/09/28/39/518092839.db2.gz TYAGFZHROMEVNX-LBPRGKRZSA-N 1 1 369.450 2.880 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000547421569 518131234 /nfs/dbraw/zinc/13/12/34/518131234.db2.gz DPDUUVFNUZNEPM-GOSISDBHSA-N 1 1 356.426 2.876 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000522651379 518140856 /nfs/dbraw/zinc/14/08/56/518140856.db2.gz NTVBZYMPKQIEBO-KGLIPLIRSA-N 1 1 367.833 2.760 20 5 FFBDMO CCC[C@H]1CN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000563849081 518148882 /nfs/dbraw/zinc/14/88/82/518148882.db2.gz HPARUKZBKHDBRX-QAPCUYQASA-N 1 1 363.458 2.658 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000539810155 518165908 /nfs/dbraw/zinc/16/59/08/518165908.db2.gz SUVVYSMOBVDUGL-LLVKDONJSA-N 1 1 357.357 2.656 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCc1cc(C)[nH+]c(N2CCCC2)c1 ZINC000572570578 518251082 /nfs/dbraw/zinc/25/10/82/518251082.db2.gz ROCBTJQDANSUKJ-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCC1([NH+]2CCOCC2)CCCCC1 ZINC000564042662 518279611 /nfs/dbraw/zinc/27/96/11/518279611.db2.gz ZODSSNZHWUOGNX-UHFFFAOYSA-N 1 1 351.451 2.567 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000581455832 518291853 /nfs/dbraw/zinc/29/18/53/518291853.db2.gz BJNYQAMCCALFRC-MJBXVCDLSA-N 1 1 364.446 2.945 20 5 FFBDMO O=[N+]([O-])c1ccc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1CO ZINC000575958603 518360352 /nfs/dbraw/zinc/36/03/52/518360352.db2.gz ZQYQGJAVZAFFOT-IBGZPJMESA-N 1 1 372.421 2.757 20 5 FFBDMO COC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000581690561 518408530 /nfs/dbraw/zinc/40/85/30/518408530.db2.gz OENKVFCNTDMBDK-OAHLLOKOSA-N 1 1 363.801 2.824 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000581698621 518411762 /nfs/dbraw/zinc/41/17/62/518411762.db2.gz OHOFXFJYPVHVMB-CYBMUJFWSA-N 1 1 367.409 2.502 20 5 FFBDMO O=c1c([N+](=O)[O-])cc2c(n1Cc1cn3cc(Cl)ccc3[nH+]1)CCCC2 ZINC000570331549 518554826 /nfs/dbraw/zinc/55/48/26/518554826.db2.gz AWHOGFKFMNIPIF-UHFFFAOYSA-N 1 1 358.785 2.985 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)[C@H]2C1 ZINC000585783657 518595938 /nfs/dbraw/zinc/59/59/38/518595938.db2.gz ZLUVLQCGSKGCCF-IRXDYDNUSA-N 1 1 354.410 2.566 20 5 FFBDMO CN(C)c1ccccc1C[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000579283898 518607395 /nfs/dbraw/zinc/60/73/95/518607395.db2.gz XKYFRVFWYKSJAE-LJQANCHMSA-N 1 1 368.437 2.898 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000579283898 518607401 /nfs/dbraw/zinc/60/74/01/518607401.db2.gz XKYFRVFWYKSJAE-LJQANCHMSA-N 1 1 368.437 2.898 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)C1CCCCC1 ZINC000570460249 518618389 /nfs/dbraw/zinc/61/83/89/518618389.db2.gz WYBVLXSUVFRBKU-UHFFFAOYSA-N 1 1 361.442 2.970 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(F)c1 ZINC000586760549 518632273 /nfs/dbraw/zinc/63/22/73/518632273.db2.gz LEVBJTMJCFGYCJ-CQSZACIVSA-N 1 1 355.385 2.560 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)c1 ZINC000564840494 518644923 /nfs/dbraw/zinc/64/49/23/518644923.db2.gz JTBZODHAYPAJQL-QGZVFWFLSA-N 1 1 359.357 2.529 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000573534845 518710758 /nfs/dbraw/zinc/71/07/58/518710758.db2.gz SLYRZPZEUNZQCF-AWEZNQCLSA-N 1 1 373.457 2.602 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000565202364 518841349 /nfs/dbraw/zinc/84/13/49/518841349.db2.gz ALJVESNZUXOROO-UHFFFAOYSA-N 1 1 355.822 2.570 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2ccccc2)C[C@H](C)O)c1 ZINC000589496178 519018694 /nfs/dbraw/zinc/01/86/94/519018694.db2.gz YJCFXCICPFQISI-AWEZNQCLSA-N 1 1 358.394 2.764 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2ccccc2)C[C@H](C)O)c1 ZINC000589496178 519018699 /nfs/dbraw/zinc/01/86/99/519018699.db2.gz YJCFXCICPFQISI-AWEZNQCLSA-N 1 1 358.394 2.764 20 5 FFBDMO CC(C)[N@H+](C)C[C@@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000577687711 519202300 /nfs/dbraw/zinc/20/23/00/519202300.db2.gz MAKLFGNFGBJDBX-CYBMUJFWSA-N 1 1 359.430 2.700 20 5 FFBDMO C[N@@H+]1CCc2[nH]c3ccc(C(=O)NCc4ccc([N+](=O)[O-])cc4)cc3c2C1 ZINC000590427879 519228131 /nfs/dbraw/zinc/22/81/31/519228131.db2.gz MTTWDDZSUNSSTG-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO C[N@H+]1CCc2[nH]c3ccc(C(=O)NCc4ccc([N+](=O)[O-])cc4)cc3c2C1 ZINC000590427879 519228136 /nfs/dbraw/zinc/22/81/36/519228136.db2.gz MTTWDDZSUNSSTG-UHFFFAOYSA-N 1 1 364.405 2.994 20 5 FFBDMO CCN(CC[NH+]1CCCCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000574625452 519249333 /nfs/dbraw/zinc/24/93/33/519249333.db2.gz IABHYLTZEPMLAL-UHFFFAOYSA-N 1 1 361.489 2.543 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@@H]2COC[C@H]2O)cc1[N+](=O)[O-] ZINC000566036588 519257854 /nfs/dbraw/zinc/25/78/54/519257854.db2.gz OGVPYFZBEHNWCC-RTBURBONSA-N 1 1 357.410 2.554 20 5 FFBDMO CC(C)N1CC[NH+]([C@H]2CCN(c3nccc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000590692865 519319197 /nfs/dbraw/zinc/31/91/97/519319197.db2.gz BCJPQQJFZCDCEZ-INIZCTEOSA-N 1 1 369.469 2.748 20 5 FFBDMO CC(C)N1CC[NH+]([C@@H]2CCN(c3nccc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000590692866 519319346 /nfs/dbraw/zinc/31/93/46/519319346.db2.gz BCJPQQJFZCDCEZ-MRXNPFEDSA-N 1 1 369.469 2.748 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1)Nc1ccc([N+](=O)[O-])cc1 ZINC000583722169 519397902 /nfs/dbraw/zinc/39/79/02/519397902.db2.gz KUVKKBOEOORSRA-FUHWJXTLSA-N 1 1 359.426 2.957 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)n1 ZINC000574933661 519411829 /nfs/dbraw/zinc/41/18/29/519411829.db2.gz BLKNABGOMXHOIT-MJBXVCDLSA-N 1 1 362.430 2.618 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000572146317 519466603 /nfs/dbraw/zinc/46/66/03/519466603.db2.gz NJQWNSAKJPGJOZ-UHFFFAOYSA-N 1 1 374.441 2.894 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000569302517 519476159 /nfs/dbraw/zinc/47/61/59/519476159.db2.gz AISGDGCAUTVENC-UHFFFAOYSA-N 1 1 355.385 2.748 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602875311 519942440 /nfs/dbraw/zinc/94/24/40/519942440.db2.gz ZMKYUMDBCXYBKV-PBHICJAKSA-N 1 1 362.474 2.892 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000599909796 519944439 /nfs/dbraw/zinc/94/44/39/519944439.db2.gz ZZFTUROVNJTNSV-VQTJNVASSA-N 1 1 367.449 2.941 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]([C@@H]2CCCO2)C2(CO)CCC2)c(F)c1 ZINC000602891465 519953328 /nfs/dbraw/zinc/95/33/28/519953328.db2.gz NKVBUOQXFGWCRE-HOTGVXAUSA-N 1 1 356.369 2.673 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000602929458 519977859 /nfs/dbraw/zinc/97/78/59/519977859.db2.gz PAPUKNYEJODQBU-SGTLLEGYSA-N 1 1 359.382 2.881 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000600029499 520008057 /nfs/dbraw/zinc/00/80/57/520008057.db2.gz KRDUGGCFBINVAA-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC(C)(C)n1nnc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000594512571 520008947 /nfs/dbraw/zinc/00/89/47/520008947.db2.gz WFQPFENUWANJTO-ZFWWWQNUSA-N 1 1 358.446 2.837 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[NH+](CCc2cnccn2)CC1 ZINC000602998724 520014664 /nfs/dbraw/zinc/01/46/64/520014664.db2.gz JJWBHQKTSXQYHU-INIZCTEOSA-N 1 1 355.442 2.615 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(CCc2cnccn2)CC1 ZINC000602998724 520014671 /nfs/dbraw/zinc/01/46/71/520014671.db2.gz JJWBHQKTSXQYHU-INIZCTEOSA-N 1 1 355.442 2.615 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[NH+](CCc2cnccn2)CC1 ZINC000602998725 520015225 /nfs/dbraw/zinc/01/52/25/520015225.db2.gz JJWBHQKTSXQYHU-MRXNPFEDSA-N 1 1 355.442 2.615 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(CCc2cnccn2)CC1 ZINC000602998725 520015233 /nfs/dbraw/zinc/01/52/33/520015233.db2.gz JJWBHQKTSXQYHU-MRXNPFEDSA-N 1 1 355.442 2.615 20 5 FFBDMO CCc1[nH]nc(-c2nc(CCCCn3c[nH+]c(C)c3C)no2)c1[N+](=O)[O-] ZINC000594535078 520016920 /nfs/dbraw/zinc/01/69/20/520016920.db2.gz SDTXGRJIJMGWKY-UHFFFAOYSA-N 1 1 359.390 2.767 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCN4CCOC[C@H]4C3)s2)cc1 ZINC000612589967 520037785 /nfs/dbraw/zinc/03/77/85/520037785.db2.gz DZWLSZKZLMZXFD-MRXNPFEDSA-N 1 1 359.451 2.840 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H]3CCC(=O)N(C)C3)o2)c([N+](=O)[O-])c1 ZINC000600178259 520103291 /nfs/dbraw/zinc/10/32/91/520103291.db2.gz JOFYFVMGMHTNSD-ZDUSSCGKSA-N 1 1 373.409 2.916 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000597603518 520130665 /nfs/dbraw/zinc/13/06/65/520130665.db2.gz CXWRCLCVGHTPNA-AWEZNQCLSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000597603518 520130671 /nfs/dbraw/zinc/13/06/71/520130671.db2.gz CXWRCLCVGHTPNA-AWEZNQCLSA-N 1 1 357.414 2.541 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000597603518 520130677 /nfs/dbraw/zinc/13/06/77/520130677.db2.gz CXWRCLCVGHTPNA-AWEZNQCLSA-N 1 1 357.414 2.541 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000600251899 520158105 /nfs/dbraw/zinc/15/81/05/520158105.db2.gz DOTBIFLUSWHHGR-LJQANCHMSA-N 1 1 370.453 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000594793094 520161978 /nfs/dbraw/zinc/16/19/78/520161978.db2.gz UVAITUGCUNNDOY-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO C[NH+]1CCC2(CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)C2)CC1 ZINC000597665713 520165872 /nfs/dbraw/zinc/16/58/72/520165872.db2.gz DQVKFNQWKCKHMG-UHFFFAOYSA-N 1 1 369.425 2.543 20 5 FFBDMO Cc1sc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594854472 520190225 /nfs/dbraw/zinc/19/02/25/520190225.db2.gz LWYJAGGPOPMPFH-GFCCVEGCSA-N 1 1 373.500 2.650 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccc([N+](=O)[O-])s2)CC1)Cc1ccccc1 ZINC000609150026 520209718 /nfs/dbraw/zinc/20/97/18/520209718.db2.gz ACIKMWVEFFMJQT-UHFFFAOYSA-N 1 1 360.483 2.910 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)NCc2ccccc2)C1 ZINC000592155828 520233254 /nfs/dbraw/zinc/23/32/54/520233254.db2.gz RASDWRULICACTF-MRXNPFEDSA-N 1 1 369.421 2.742 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(=O)NCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000592155556 520233455 /nfs/dbraw/zinc/23/34/55/520233455.db2.gz OXJHBPKCCBQKQX-QGZVFWFLSA-N 1 1 369.421 2.742 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNCc2ccc([N+](=O)[O-])cc2F)C1 ZINC000594994288 520247287 /nfs/dbraw/zinc/24/72/87/520247287.db2.gz JLXHTPQNWIHIFJ-LJQANCHMSA-N 1 1 372.444 2.640 20 5 FFBDMO CN1CCN(Cc2ccccc2)[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000594994288 520247294 /nfs/dbraw/zinc/24/72/94/520247294.db2.gz JLXHTPQNWIHIFJ-LJQANCHMSA-N 1 1 372.444 2.640 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C(=O)NCc1ccccc1 ZINC000595006254 520252761 /nfs/dbraw/zinc/25/27/61/520252761.db2.gz HSDPCWZNAHDMMO-UONOGXRCSA-N 1 1 357.410 2.959 20 5 FFBDMO C[N@H+](CCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O)Cc1ccc(F)cc1 ZINC000612998795 520262990 /nfs/dbraw/zinc/26/29/90/520262990.db2.gz QORJZWRJOUHWSH-UHFFFAOYSA-N 1 1 372.356 2.683 20 5 FFBDMO C[N@@H+](CCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O)Cc1ccc(F)cc1 ZINC000612998795 520262992 /nfs/dbraw/zinc/26/29/92/520262992.db2.gz QORJZWRJOUHWSH-UHFFFAOYSA-N 1 1 372.356 2.683 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595049802 520270508 /nfs/dbraw/zinc/27/05/08/520270508.db2.gz OTESUQYCRXTNJU-SJORKVTESA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000597857639 520286526 /nfs/dbraw/zinc/28/65/26/520286526.db2.gz HSUKRNBUEDPMML-LBPRGKRZSA-N 1 1 370.247 2.960 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[NH+](Cc4cccs4)CC3)c2c1 ZINC000609849761 520456827 /nfs/dbraw/zinc/45/68/27/520456827.db2.gz VOVKDNJKYBPLIE-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000598195940 520486215 /nfs/dbraw/zinc/48/62/15/520486215.db2.gz XEVBWXDBENKFHI-IBGZPJMESA-N 1 1 367.449 2.913 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595477833 520496778 /nfs/dbraw/zinc/49/67/78/520496778.db2.gz VQWVUSWVKNOVEL-GOSISDBHSA-N 1 1 354.410 2.669 20 5 FFBDMO CN(CC(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000598218091 520499046 /nfs/dbraw/zinc/49/90/46/520499046.db2.gz FPAVQWJHJZGKTC-HNNXBMFYSA-N 1 1 360.458 2.554 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000604446325 520565661 /nfs/dbraw/zinc/56/56/61/520565661.db2.gz XEGSQJYZHYUEFA-UXLLHSPISA-N 1 1 361.442 2.837 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC000598342338 520565769 /nfs/dbraw/zinc/56/57/69/520565769.db2.gz MIEVIJLOPBAULA-OAHLLOKOSA-N 1 1 354.410 2.871 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000598343034 520566625 /nfs/dbraw/zinc/56/66/25/520566625.db2.gz RULDSAKRRGSDKH-CYBMUJFWSA-N 1 1 360.439 2.932 20 5 FFBDMO Cc1c(CNC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000595587319 520572218 /nfs/dbraw/zinc/57/22/18/520572218.db2.gz GKTQNYIEAZMJHO-SFHVURJKSA-N 1 1 368.437 2.977 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000610223767 520588514 /nfs/dbraw/zinc/58/85/14/520588514.db2.gz JUTHJJQRICFKOT-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000604535302 520593669 /nfs/dbraw/zinc/59/36/69/520593669.db2.gz VALISBMOVZYRIE-SFHVURJKSA-N 1 1 368.437 2.860 20 5 FFBDMO Cc1cc(CN2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)on1 ZINC000601101440 520636713 /nfs/dbraw/zinc/63/67/13/520636713.db2.gz RGQOPYMMFBWIBX-UHFFFAOYSA-N 1 1 353.382 2.762 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000610359977 520649854 /nfs/dbraw/zinc/64/98/54/520649854.db2.gz GZBDHCHWULFIHR-DOTOQJQBSA-N 1 1 356.426 2.635 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)c1 ZINC000593021377 520689491 /nfs/dbraw/zinc/68/94/91/520689491.db2.gz WKGZKINDDSEXOI-UHFFFAOYSA-N 1 1 370.361 2.889 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CO)c1cccc(Cl)c1Cl ZINC000595750020 520697138 /nfs/dbraw/zinc/69/71/38/520697138.db2.gz QDGOJWANUBXHFM-GFCCVEGCSA-N 1 1 359.213 2.764 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CO)c1cccc(Cl)c1Cl ZINC000595750020 520697146 /nfs/dbraw/zinc/69/71/46/520697146.db2.gz QDGOJWANUBXHFM-GFCCVEGCSA-N 1 1 359.213 2.764 20 5 FFBDMO C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000593057756 520712944 /nfs/dbraw/zinc/71/29/44/520712944.db2.gz HRNICKPIWVLSHJ-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](CC)CO1 ZINC000593059750 520716065 /nfs/dbraw/zinc/71/60/65/520716065.db2.gz TWSGEXDKMJPDQE-DZGCQCFKSA-N 1 1 363.414 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c1 ZINC000595786557 520723734 /nfs/dbraw/zinc/72/37/34/520723734.db2.gz BIVMLKJVFLPJEQ-KVSKMBFKSA-N 1 1 364.442 2.616 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc2c(nc[nH+]c2N(C)C)n1C ZINC000610664636 520785234 /nfs/dbraw/zinc/78/52/34/520785234.db2.gz AKRKPXUDWKIEIC-UHFFFAOYSA-N 1 1 368.397 2.812 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@H](C3CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC000595900731 520804625 /nfs/dbraw/zinc/80/46/25/520804625.db2.gz JIJDNWLLSDOAFS-WBVHZDCISA-N 1 1 374.485 2.942 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593182350 520806567 /nfs/dbraw/zinc/80/65/67/520806567.db2.gz JPAFCTXINXXJSI-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC000593182350 520806574 /nfs/dbraw/zinc/80/65/74/520806574.db2.gz JPAFCTXINXXJSI-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO O=C(c1c(F)cccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000601541946 520832693 /nfs/dbraw/zinc/83/26/93/520832693.db2.gz XGBRUQIOZSXFTP-IYBDPMFKSA-N 1 1 369.396 2.938 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC2(CCC2)[C@H]1c1ccncc1 ZINC000596038410 520870667 /nfs/dbraw/zinc/87/06/67/520870667.db2.gz MLGDROVDTOHFDR-VQIMIIECSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC2(CCC2)[C@H]1c1ccncc1 ZINC000596038410 520870679 /nfs/dbraw/zinc/87/06/79/520870679.db2.gz MLGDROVDTOHFDR-VQIMIIECSA-N 1 1 369.421 2.957 20 5 FFBDMO COc1cccc(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000593337158 520920180 /nfs/dbraw/zinc/92/01/80/520920180.db2.gz PGFVRWRARRNVQJ-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000601728164 520921333 /nfs/dbraw/zinc/92/13/33/520921333.db2.gz NSFWRGGTONMBIR-MRXNPFEDSA-N 1 1 371.441 2.503 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2c(Br)cccc2[N+](=O)[O-])n1C ZINC000596127321 520928396 /nfs/dbraw/zinc/92/83/96/520928396.db2.gz YQKQUGHUXQZRLC-UHFFFAOYSA-N 1 1 354.208 2.769 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC2)C1 ZINC000596128766 520929480 /nfs/dbraw/zinc/92/94/80/520929480.db2.gz MOEVECSSPCCBAW-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C[N@H+]1Cc1ccccc1 ZINC000596163473 520946411 /nfs/dbraw/zinc/94/64/11/520946411.db2.gz VMFJCWQTRWNBFJ-BBRMVZONSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596236439 520988833 /nfs/dbraw/zinc/98/88/33/520988833.db2.gz VVAVVEVENPRDAN-CXAGYDPISA-N 1 1 354.410 2.769 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)cc1OC(F)F ZINC000596267882 521001828 /nfs/dbraw/zinc/00/18/28/521001828.db2.gz BBVRNZDLLGLQKO-UHFFFAOYSA-N 1 1 371.384 2.887 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@@H+](CC3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000611132471 521002356 /nfs/dbraw/zinc/00/23/56/521002356.db2.gz PAPQNGNETBUGSL-INIZCTEOSA-N 1 1 353.426 2.678 20 5 FFBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596268962 521002583 /nfs/dbraw/zinc/00/25/83/521002583.db2.gz ONZUYYKRYWWUDO-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070067 521013976 /nfs/dbraw/zinc/01/39/76/521013976.db2.gz JWYAVICKUCSCLR-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596306816 521019688 /nfs/dbraw/zinc/01/96/88/521019688.db2.gz IMDQOHBRKVCCEQ-GFCCVEGCSA-N 1 1 355.460 2.531 20 5 FFBDMO CC[N@@H+](C[C@@H]1CCOC1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000611205370 521036768 /nfs/dbraw/zinc/03/67/68/521036768.db2.gz YHHNUCXOBQGPBK-RYUDHWBXSA-N 1 1 355.822 2.934 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2CC[N@@H+]2Cc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000599139968 521051636 /nfs/dbraw/zinc/05/16/36/521051636.db2.gz QXURIXIBWHPDME-CQSZACIVSA-N 1 1 359.430 2.586 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2CC[N@H+]2Cc2ccc(OC)cc2)c1[N+](=O)[O-] ZINC000599139968 521051641 /nfs/dbraw/zinc/05/16/41/521051641.db2.gz QXURIXIBWHPDME-CQSZACIVSA-N 1 1 359.430 2.586 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+](CCCO)Cc1ccccc1)OCCO2 ZINC000611268987 521067804 /nfs/dbraw/zinc/06/78/04/521067804.db2.gz GXQGTNQLRJRNMA-UHFFFAOYSA-N 1 1 358.394 2.751 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+](CCCO)Cc1ccccc1)OCCO2 ZINC000611268987 521067807 /nfs/dbraw/zinc/06/78/07/521067807.db2.gz GXQGTNQLRJRNMA-UHFFFAOYSA-N 1 1 358.394 2.751 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000596461635 521084649 /nfs/dbraw/zinc/08/46/49/521084649.db2.gz IUEHIXXHXSDZSB-KRWDZBQOSA-N 1 1 357.458 2.873 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000596480941 521092648 /nfs/dbraw/zinc/09/26/48/521092648.db2.gz VBXGFWLMOLZNMB-ZDUSSCGKSA-N 1 1 367.471 2.817 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000596480941 521092653 /nfs/dbraw/zinc/09/26/53/521092653.db2.gz VBXGFWLMOLZNMB-ZDUSSCGKSA-N 1 1 367.471 2.817 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000611350876 521115577 /nfs/dbraw/zinc/11/55/77/521115577.db2.gz VQTGZPUSWHXJPI-HZPDHXFCSA-N 1 1 373.453 2.623 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)O1 ZINC000596614113 521166633 /nfs/dbraw/zinc/16/66/33/521166633.db2.gz RNAMKJCIXIKOOC-MLGOLLRUSA-N 1 1 369.381 2.935 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)O1 ZINC000596614113 521166645 /nfs/dbraw/zinc/16/66/45/521166645.db2.gz RNAMKJCIXIKOOC-MLGOLLRUSA-N 1 1 369.381 2.935 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000596625204 521172224 /nfs/dbraw/zinc/17/22/24/521172224.db2.gz PNCJNEHTDMIIRI-MRXNPFEDSA-N 1 1 370.409 2.999 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000611560790 521219666 /nfs/dbraw/zinc/21/96/66/521219666.db2.gz XHRDTQNPCKGQBE-ZHALLVOQSA-N 1 1 358.442 2.949 20 5 FFBDMO COC(=O)[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000611574643 521228829 /nfs/dbraw/zinc/22/88/29/521228829.db2.gz GVYSAODWDLDPQI-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000599463574 521239615 /nfs/dbraw/zinc/23/96/15/521239615.db2.gz GIXSSWOSWNMZMG-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000599464797 521240404 /nfs/dbraw/zinc/24/04/04/521240404.db2.gz TVUTWHRHMWLUJI-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987343 521331772 /nfs/dbraw/zinc/33/17/72/521331772.db2.gz NOTFAJDNIONUEG-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987343 521331781 /nfs/dbraw/zinc/33/17/81/521331781.db2.gz NOTFAJDNIONUEG-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000594014378 521348258 /nfs/dbraw/zinc/34/82/58/521348258.db2.gz CMEJKELIQFBUIS-GFCCVEGCSA-N 1 1 360.357 2.942 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](Cc1cc3c(cc1[N+](=O)[O-])OCCO3)CC2 ZINC000615283926 521352676 /nfs/dbraw/zinc/35/26/76/521352676.db2.gz LBQQGEJTOCTSTQ-UHFFFAOYSA-N 1 1 370.405 2.975 20 5 FFBDMO C[C@@H]1Cc2ccccc2N1C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC000602452147 521354290 /nfs/dbraw/zinc/35/42/90/521354290.db2.gz GXOXPGABHGSWKI-CQSZACIVSA-N 1 1 355.442 2.744 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000594052455 521374979 /nfs/dbraw/zinc/37/49/79/521374979.db2.gz YBHZEKMVFGMWGX-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@@H+]1Cc1cn(C)nc1[N+](=O)[O-] ZINC000602487387 521375561 /nfs/dbraw/zinc/37/55/61/521375561.db2.gz ZKJRGLAQRDXYLF-HNNXBMFYSA-N 1 1 354.414 2.651 20 5 FFBDMO C[C@@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CN1CCN(C)CC1 ZINC000602538953 521400030 /nfs/dbraw/zinc/40/00/30/521400030.db2.gz GBYCVGSYUPFOHL-ZDUSSCGKSA-N 1 1 374.407 2.587 20 5 FFBDMO C[C@H](NC(=O)c1c(Br)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000599750395 521446655 /nfs/dbraw/zinc/44/66/55/521446655.db2.gz VNYFRNHNJRYXHW-JTQLQIEISA-N 1 1 368.231 2.738 20 5 FFBDMO C[C@H]1c2ccccc2OCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612030189 521446707 /nfs/dbraw/zinc/44/67/07/521446707.db2.gz ABLFUYVACQPYNO-GJZGRUSLSA-N 1 1 358.394 2.790 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@@H](O)C(F)(F)F ZINC000602743123 521509455 /nfs/dbraw/zinc/50/94/55/521509455.db2.gz IFEMVZLJLVNWKI-CLZZGJSISA-N 1 1 363.155 2.820 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000602786784 521531752 /nfs/dbraw/zinc/53/17/52/521531752.db2.gz YAWOOOLJMFGSFG-IUCAKERBSA-N 1 1 360.258 2.772 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CC[C@H]4CCCO4)CC3)nc2c1 ZINC000615796091 521535315 /nfs/dbraw/zinc/53/53/15/521535315.db2.gz PDAUBJJCZJYSBG-OAHLLOKOSA-N 1 1 359.430 2.552 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]Cc2cn(C)nc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000602804396 521542146 /nfs/dbraw/zinc/54/21/46/521542146.db2.gz FXZXKYNDJJCTLG-LLVKDONJSA-N 1 1 358.377 2.812 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)c([N+](=O)[O-])n1 ZINC000602809777 521546107 /nfs/dbraw/zinc/54/61/07/521546107.db2.gz DPIZGMJXPKEPIY-CQSZACIVSA-N 1 1 354.414 2.590 20 5 FFBDMO COc1cc(Br)ccc1[C@H](C)[NH2+]Cc1cn(C)nc1[N+](=O)[O-] ZINC000602814103 521549714 /nfs/dbraw/zinc/54/97/14/521549714.db2.gz CCHPVFPWHLJCFH-VIFPVBQESA-N 1 1 369.219 2.950 20 5 FFBDMO Cc1ncc(CNC(=O)CC[N@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000602830128 521556588 /nfs/dbraw/zinc/55/65/88/521556588.db2.gz KYBAIZVOGHTJCT-UHFFFAOYSA-N 1 1 362.455 2.541 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2nccc3sccc32)CC1 ZINC000602832633 521558444 /nfs/dbraw/zinc/55/84/44/521558444.db2.gz LUDJRKIVXIWEEW-UHFFFAOYSA-N 1 1 372.454 2.532 20 5 FFBDMO Cn1cc(C[NH2+][C@H](CCO)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])n1 ZINC000602837360 521562030 /nfs/dbraw/zinc/56/20/30/521562030.db2.gz VJNHYMBNOSQWBE-CYBMUJFWSA-N 1 1 358.320 2.560 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@@H+](Cc2ccccc2)C[C@@H](C)C1 ZINC000602838362 521562731 /nfs/dbraw/zinc/56/27/31/521562731.db2.gz CYZNXBCUCNAVAB-INIZCTEOSA-N 1 1 357.458 2.554 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)o1 ZINC000597203402 521571347 /nfs/dbraw/zinc/57/13/47/521571347.db2.gz PIWPUAUCFMVXBS-HNNXBMFYSA-N 1 1 357.410 2.761 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164723559 720349652 /nfs/dbraw/zinc/34/96/52/720349652.db2.gz HYBPQQIBCATRMQ-KGLIPLIRSA-N 1 1 374.832 2.595 20 5 FFBDMO Cc1c(C)c(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)ncc1[N+](=O)[O-] ZINC001164788335 721414012 /nfs/dbraw/zinc/41/40/12/721414012.db2.gz SDKVCAFDUTUPQX-KBPBESRZSA-N 1 1 359.455 2.631 20 5 FFBDMO Cc1nc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001164896267 721512055 /nfs/dbraw/zinc/51/20/55/721512055.db2.gz AESSGNGEUAHDJU-WBVHZDCISA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)c(Cl)nc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001165038880 721905251 /nfs/dbraw/zinc/90/52/51/721905251.db2.gz QCLZVESIIHBNFZ-SNVBAGLBSA-N 1 1 361.229 2.598 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)nc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164966759 722070987 /nfs/dbraw/zinc/07/09/87/722070987.db2.gz BCOKUZNNNNEOKD-PHIMTYICSA-N 1 1 373.240 2.596 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153862231 728790137 /nfs/dbraw/zinc/79/01/37/728790137.db2.gz ZPYZQYGHFMFQEK-INIZCTEOSA-N 1 1 366.893 2.850 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)ccc1Cl ZINC000153902357 728790776 /nfs/dbraw/zinc/79/07/76/728790776.db2.gz HRHNCQKFAYWKKA-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)ccc1Cl ZINC000153902357 728790778 /nfs/dbraw/zinc/79/07/78/728790778.db2.gz HRHNCQKFAYWKKA-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCCC[C@@H]2C[NH+]2CCOCC2)ccc1Cl ZINC000153902357 728790780 /nfs/dbraw/zinc/79/07/80/728790780.db2.gz HRHNCQKFAYWKKA-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159135344 728901185 /nfs/dbraw/zinc/90/11/85/728901185.db2.gz LMGKDPFNPYCSCJ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000898513779 735373501 /nfs/dbraw/zinc/37/35/01/735373501.db2.gz YEOKOPMMSHXVFA-ZFWWWQNUSA-N 1 1 350.415 2.948 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000898513778 735373697 /nfs/dbraw/zinc/37/36/97/735373697.db2.gz YEOKOPMMSHXVFA-UKRRQHHQSA-N 1 1 350.415 2.948 20 5 FFBDMO CC[C@@H]1[C@@H](C(=O)NCc2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000899213984 735460363 /nfs/dbraw/zinc/46/03/63/735460363.db2.gz OYRWUFONNKTLGN-QWHCGFSZSA-N 1 1 370.247 2.704 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000152106675 728748032 /nfs/dbraw/zinc/74/80/32/728748032.db2.gz SERIEVZGQQGRQP-AWEZNQCLSA-N 1 1 369.487 2.525 20 5 FFBDMO C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000171954693 729016076 /nfs/dbraw/zinc/01/60/76/729016076.db2.gz LDGZSEPNSPZCPH-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000177217161 729131990 /nfs/dbraw/zinc/13/19/90/729131990.db2.gz BULPMNRHOGKEAH-OAHLLOKOSA-N 1 1 351.384 2.714 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000177217161 729131991 /nfs/dbraw/zinc/13/19/91/729131991.db2.gz BULPMNRHOGKEAH-OAHLLOKOSA-N 1 1 351.384 2.714 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000860098750 730476107 /nfs/dbraw/zinc/47/61/07/730476107.db2.gz QIOJYPVACJVFIQ-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000861345980 730602195 /nfs/dbraw/zinc/60/21/95/730602195.db2.gz BXUMUVXWNGKSAY-YJBOKZPZSA-N 1 1 350.415 2.525 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2cc(F)c([N+](=O)[O-])cc2CO)C[C@H](C)O1 ZINC000865601280 730975145 /nfs/dbraw/zinc/97/51/45/730975145.db2.gz NRXGCJHSQYTYEF-BETUJISGSA-N 1 1 355.410 2.528 20 5 FFBDMO CC[N@@H+](CCNc1cc(F)c([N+](=O)[O-])cc1CO)CCC(F)(F)F ZINC000865725060 730990623 /nfs/dbraw/zinc/99/06/23/730990623.db2.gz QQJBYJGHTCNPRI-UHFFFAOYSA-N 1 1 353.316 2.912 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000865904345 731009678 /nfs/dbraw/zinc/00/96/78/731009678.db2.gz QTIMCFHSKCARFU-LBPRGKRZSA-N 1 1 350.806 2.715 20 5 FFBDMO CC(C)[C@H]1CN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000879601314 732731767 /nfs/dbraw/zinc/73/17/67/732731767.db2.gz NVDJSXXORJWGGT-MLGOLLRUSA-N 1 1 368.865 2.847 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)n1 ZINC000880008758 732818483 /nfs/dbraw/zinc/81/84/83/732818483.db2.gz HDKAYOSQULOXOA-KBPBESRZSA-N 1 1 363.439 2.589 20 5 FFBDMO COc1ccccc1[C@H]1CSCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000880174530 732860006 /nfs/dbraw/zinc/86/00/06/732860006.db2.gz PKVDQDUBEIRFLD-OAHLLOKOSA-N 1 1 362.455 2.980 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320758 732888408 /nfs/dbraw/zinc/88/84/08/732888408.db2.gz XXJYISFUSCZOSO-IUODEOHRSA-N 1 1 358.423 2.646 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320758 732888414 /nfs/dbraw/zinc/88/84/14/732888414.db2.gz XXJYISFUSCZOSO-IUODEOHRSA-N 1 1 358.423 2.646 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]Cc1cnn2c1CCC2 ZINC000883288135 733360526 /nfs/dbraw/zinc/36/05/26/733360526.db2.gz SNDAWKNCJPHQQP-UHFFFAOYSA-N 1 1 351.204 2.790 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000885882497 733724719 /nfs/dbraw/zinc/72/47/19/733724719.db2.gz IMJRKOXSXRIFPK-CQSZACIVSA-N 1 1 367.833 2.540 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886118837 733751795 /nfs/dbraw/zinc/75/17/95/733751795.db2.gz QMLUNAXISUUWEY-STQMWFEESA-N 1 1 350.419 2.725 20 5 FFBDMO CN1C(=O)C[C@H]([NH2+]Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000886169822 733756710 /nfs/dbraw/zinc/75/67/10/733756710.db2.gz JKPFJJFCRCXUSY-HOCLYGCPSA-N 1 1 360.801 2.705 20 5 FFBDMO CC(C)[N@@H+](C)CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000726185033 734412816 /nfs/dbraw/zinc/41/28/16/734412816.db2.gz UJWYSNPAUSZFEZ-UHFFFAOYSA-N 1 1 369.365 2.640 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CN1CC1CC1 ZINC000895716069 735046472 /nfs/dbraw/zinc/04/64/72/735046472.db2.gz DKXSXXFVVYYSTE-SECBINFHSA-N 1 1 374.260 2.519 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)C1 ZINC000895835052 735061427 /nfs/dbraw/zinc/06/14/27/735061427.db2.gz XOJYPLCPRGOFGL-SSDOTTSWSA-N 1 1 350.177 2.865 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000751913259 735933442 /nfs/dbraw/zinc/93/34/42/735933442.db2.gz FRMFMMQBRAICAP-DZGCQCFKSA-N 1 1 350.488 2.913 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ncc1Br ZINC000753024640 736032259 /nfs/dbraw/zinc/03/22/59/736032259.db2.gz VFAWAGXEWUGKKC-SNVBAGLBSA-N 1 1 373.251 2.603 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000756944181 736375713 /nfs/dbraw/zinc/37/57/13/736375713.db2.gz YXFIBRGWGFPXDJ-CYBMUJFWSA-N 1 1 352.822 2.532 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756963380 736377963 /nfs/dbraw/zinc/37/79/63/736377963.db2.gz AAUIDXZMBFKDKH-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000757703785 736420951 /nfs/dbraw/zinc/42/09/51/736420951.db2.gz JLMSULOHSUNEON-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)c([N+](=O)[O-])c1 ZINC000763377423 736932996 /nfs/dbraw/zinc/93/29/96/736932996.db2.gz YBJCPMZOOKAITQ-DZGCQCFKSA-N 1 1 350.375 2.558 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000763677642 736958499 /nfs/dbraw/zinc/95/84/99/736958499.db2.gz VXGGOUJJYGSXMZ-LBPRGKRZSA-N 1 1 370.837 2.871 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910268759 737050567 /nfs/dbraw/zinc/05/05/67/737050567.db2.gz GUUWYZBXBJADGW-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000766557964 737242001 /nfs/dbraw/zinc/24/20/01/737242001.db2.gz XEXIGWVVAVIASH-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO COCCC[N@H+](CCOC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000921056525 737942300 /nfs/dbraw/zinc/94/23/00/737942300.db2.gz TWVHGANYAVLDJC-UHFFFAOYSA-N 1 1 355.416 2.814 20 5 FFBDMO COCCC[N@@H+](CCOC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000921056525 737942303 /nfs/dbraw/zinc/94/23/03/737942303.db2.gz TWVHGANYAVLDJC-UHFFFAOYSA-N 1 1 355.416 2.814 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776597752 738212553 /nfs/dbraw/zinc/21/25/53/738212553.db2.gz MECYMXMUXMJSMG-GOEBONIOSA-N 1 1 350.415 2.539 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)C[C@@H]1C ZINC000778009119 738342075 /nfs/dbraw/zinc/34/20/75/738342075.db2.gz KTLWDFOOYKDJJA-QWHCGFSZSA-N 1 1 373.450 2.536 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000785814475 739000282 /nfs/dbraw/zinc/00/02/82/739000282.db2.gz BKPUQGHVMOGAFV-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931289128 739239127 /nfs/dbraw/zinc/23/91/27/739239127.db2.gz YHODVIZVKVBQTR-UHFFFAOYSA-N 1 1 353.850 2.935 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)COC(=O)N1 ZINC000932027454 739376634 /nfs/dbraw/zinc/37/66/34/739376634.db2.gz YYNMYTAULGCCFM-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)COC(=O)N1 ZINC000932092220 739384792 /nfs/dbraw/zinc/38/47/92/739384792.db2.gz JXKBVVIBUFYRRC-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO CN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000790886787 739509081 /nfs/dbraw/zinc/50/90/81/739509081.db2.gz AWYFOMOPYVXLJN-GFCCVEGCSA-N 1 1 355.797 2.625 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792924996 739719564 /nfs/dbraw/zinc/71/95/64/739719564.db2.gz JQKAVNJOTOLRMA-DZGCQCFKSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@H]1CCCO1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792924996 739719569 /nfs/dbraw/zinc/71/95/69/739719569.db2.gz JQKAVNJOTOLRMA-DZGCQCFKSA-N 1 1 353.806 2.830 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119235 739732875 /nfs/dbraw/zinc/73/28/75/739732875.db2.gz WZXROGVBHCSWHZ-WCQYABFASA-N 1 1 360.357 2.857 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2CC[C@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119235 739732877 /nfs/dbraw/zinc/73/28/77/739732877.db2.gz WZXROGVBHCSWHZ-WCQYABFASA-N 1 1 360.357 2.857 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](Cc2nccs2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000934334124 739767661 /nfs/dbraw/zinc/76/76/61/739767661.db2.gz BNECPXKYLOUNJH-ZDUSSCGKSA-N 1 1 360.439 2.945 20 5 FFBDMO CN(C)[S@](C)(=O)=NCC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000934751674 739832168 /nfs/dbraw/zinc/83/21/68/739832168.db2.gz ZZJORGCHPSOAIP-RUZDIDTESA-N 1 1 372.466 2.520 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000794217884 739864211 /nfs/dbraw/zinc/86/42/11/739864211.db2.gz QMVGJLUYUGFNSZ-GFCCVEGCSA-N 1 1 354.426 2.650 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=S)NC[C@@H]1CCC[N@H+]1CC ZINC000798374634 740326368 /nfs/dbraw/zinc/32/63/68/740326368.db2.gz WKMQDIBWWBGUNC-ZDUSSCGKSA-N 1 1 352.460 2.764 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000803513125 740807347 /nfs/dbraw/zinc/80/73/47/740807347.db2.gz OHXFMQMYWBUZRZ-UHFFFAOYSA-N 1 1 356.806 2.794 20 5 FFBDMO C[C@@H](COC(=O)c1ccccc1OCC[N@H+]1CCCC[C@H]1C)[N+](=O)[O-] ZINC000813109032 741677890 /nfs/dbraw/zinc/67/78/90/741677890.db2.gz NRIGLLBQWYLRPM-CABCVRRESA-N 1 1 350.415 2.762 20 5 FFBDMO O=C1NCC2(CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)O1 ZINC000815098500 741900986 /nfs/dbraw/zinc/90/09/86/741900986.db2.gz HJBNBFCISRPZRQ-UHFFFAOYSA-N 1 1 359.304 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@@H]1CCC[N@H+]1C ZINC000817292267 742118641 /nfs/dbraw/zinc/11/86/41/742118641.db2.gz SCQNKSBOEBBGRS-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@@H](n4ccnn4)C3)c2c1 ZINC000819897685 742441348 /nfs/dbraw/zinc/44/13/48/742441348.db2.gz RUPMDIXZWAONQB-GFCCVEGCSA-N 1 1 360.399 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@@H](n4ccnn4)C3)c2c1 ZINC000819897685 742441351 /nfs/dbraw/zinc/44/13/51/742441351.db2.gz RUPMDIXZWAONQB-GFCCVEGCSA-N 1 1 360.399 2.758 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)C2)C1 ZINC000820610084 742523909 /nfs/dbraw/zinc/52/39/09/742523909.db2.gz VCEMGWRCNRTGEN-MRXNPFEDSA-N 1 1 370.812 2.527 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)c(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643661 742927597 /nfs/dbraw/zinc/92/75/97/742927597.db2.gz QPGRHPLCRKZUML-BRXULGCHSA-N 1 1 369.824 2.661 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1 ZINC000823652018 742956202 /nfs/dbraw/zinc/95/62/02/742956202.db2.gz DWDXSLKSEDCFTJ-UHFFFAOYSA-N 1 1 357.813 2.685 20 5 FFBDMO CCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](CC)C1 ZINC000825018077 743195303 /nfs/dbraw/zinc/19/53/03/743195303.db2.gz GHDIYZMAAQJTFV-VIFPVBQESA-N 1 1 358.801 2.526 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])CC[C@@H]21 ZINC000828509653 745077932 /nfs/dbraw/zinc/07/79/32/745077932.db2.gz FMOATODEBMSSTM-DOMZBBRYSA-N 1 1 351.834 2.733 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1Cl ZINC000836784905 746305312 /nfs/dbraw/zinc/30/53/12/746305312.db2.gz JUHWPYGKSNYEAQ-CYBMUJFWSA-N 1 1 369.849 2.787 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839479560 746835090 /nfs/dbraw/zinc/83/50/90/746835090.db2.gz DTGNYMUCIQTYGW-LLVKDONJSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC000839479560 746835097 /nfs/dbraw/zinc/83/50/97/746835097.db2.gz DTGNYMUCIQTYGW-LLVKDONJSA-N 1 1 356.220 2.587 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590011 746865166 /nfs/dbraw/zinc/86/51/66/746865166.db2.gz MFZFDXOEZHDWQV-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590011 746865168 /nfs/dbraw/zinc/86/51/68/746865168.db2.gz MFZFDXOEZHDWQV-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839643757 746880777 /nfs/dbraw/zinc/88/07/77/746880777.db2.gz SNLLGAPDVZUPGM-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000843981556 747944818 /nfs/dbraw/zinc/94/48/18/747944818.db2.gz IVZNKNIMSWBXBN-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000843981556 747944823 /nfs/dbraw/zinc/94/48/23/747944823.db2.gz IVZNKNIMSWBXBN-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H](CC)CO1 ZINC000844388414 748018985 /nfs/dbraw/zinc/01/89/85/748018985.db2.gz YWMSPDDYQLJDQT-JSGCOSHPSA-N 1 1 353.394 2.952 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473526337 888226058 /nfs/dbraw/zinc/22/60/58/888226058.db2.gz QKSLOSJHMBTULL-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO Cc1c(CNc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000871863379 1013091230 /nfs/dbraw/zinc/09/12/30/1013091230.db2.gz KAJWYUYVQAFLNG-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1cc(C)cc(C[NH+]2CCC(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001267943388 971684470 /nfs/dbraw/zinc/68/44/70/971684470.db2.gz LSHNZMAHBBWITA-RTBURBONSA-N 1 1 359.470 2.687 20 5 FFBDMO C[C@@H]([NH2+]C[C@H]1CN(Cc2ccncc2)CCO1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090228 1013141996 /nfs/dbraw/zinc/14/19/96/1013141996.db2.gz NYSMEUVJDHUWHE-ZBFHGGJFSA-N 1 1 374.416 2.681 20 5 FFBDMO Cc1nn(C[N@H+]2CCCCCCNC(=O)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000872668147 1013244745 /nfs/dbraw/zinc/24/47/45/1013244745.db2.gz XZYPFZCMQNRLRI-UHFFFAOYSA-N 1 1 359.430 2.593 20 5 FFBDMO O=C(N[C@H]1C[C@@H]([NH2+]C2c3ccccc3-c3ccccc32)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001022063939 964189360 /nfs/dbraw/zinc/18/93/60/964189360.db2.gz QCAXEQRSNYRDAM-JSVGYJQLSA-N 1 1 363.417 2.658 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(NC[C@H](c2ccco2)[NH+](C)C)c2ccccc21 ZINC000891485820 964376265 /nfs/dbraw/zinc/37/62/65/964376265.db2.gz VCVBNXUUYFADFQ-CQSZACIVSA-N 1 1 356.382 2.755 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000891741167 964997583 /nfs/dbraw/zinc/99/75/83/964997583.db2.gz LRECGCLYNBONSX-HNNXBMFYSA-N 1 1 374.416 2.973 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001211531644 965605643 /nfs/dbraw/zinc/60/56/43/965605643.db2.gz YZARDEOMEJUYMZ-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN(C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001167642413 967119631 /nfs/dbraw/zinc/11/96/31/967119631.db2.gz XKCIWGGXADQDHL-GOSISDBHSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167642413 967119639 /nfs/dbraw/zinc/11/96/39/967119639.db2.gz XKCIWGGXADQDHL-GOSISDBHSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167642413 967119646 /nfs/dbraw/zinc/11/96/46/967119646.db2.gz XKCIWGGXADQDHL-GOSISDBHSA-N 1 1 357.458 2.696 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000135538942 968080604 /nfs/dbraw/zinc/08/06/04/968080604.db2.gz OFOHJSSEKWTHGW-HNNXBMFYSA-N 1 1 363.462 2.515 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000177645700 969290874 /nfs/dbraw/zinc/29/08/74/969290874.db2.gz CAKLUDNVEZQIHI-UHFFFAOYSA-N 1 1 367.327 2.874 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]2C1 ZINC000895576659 970756036 /nfs/dbraw/zinc/75/60/36/970756036.db2.gz OSLHWHFNCRXKCL-IYBDPMFKSA-N 1 1 355.394 2.765 20 5 FFBDMO C[C@@H](CNC(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897064525 973215368 /nfs/dbraw/zinc/21/53/68/973215368.db2.gz YZWKKIVIQPHWLT-GJZGRUSLSA-N 1 1 360.458 2.824 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000825887750 1014306535 /nfs/dbraw/zinc/30/65/35/1014306535.db2.gz QTZQNKUJBGKYPH-SFHVURJKSA-N 1 1 363.458 2.599 20 5 FFBDMO Cc1ncccc1OC[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000842173533 976710086 /nfs/dbraw/zinc/71/00/86/976710086.db2.gz RHNAKTPPVQLFDX-ROUUACIJSA-N 1 1 357.410 2.875 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCCCCC1)C2 ZINC000982278748 977375406 /nfs/dbraw/zinc/37/54/06/977375406.db2.gz QOTXQMHSIXKXNO-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CC1CCCCCC1)C2 ZINC000982278748 977375412 /nfs/dbraw/zinc/37/54/12/977375412.db2.gz QOTXQMHSIXKXNO-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCCCCC1)C2 ZINC000982278748 977375421 /nfs/dbraw/zinc/37/54/21/977375421.db2.gz QOTXQMHSIXKXNO-LFGUQSLTSA-N 1 1 363.502 2.792 20 5 FFBDMO Cc1cc(N[C@@H]2CCC[N@@H+](C3COC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001168369109 980205547 /nfs/dbraw/zinc/20/55/47/980205547.db2.gz YFHXDFGODBHUAX-OAHLLOKOSA-N 1 1 369.425 2.635 20 5 FFBDMO Cc1cc(N[C@@H]2CCC[N@H+](C3COC3)C2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001168369109 980205551 /nfs/dbraw/zinc/20/55/51/980205551.db2.gz YFHXDFGODBHUAX-OAHLLOKOSA-N 1 1 369.425 2.635 20 5 FFBDMO COc1cc(CN2CC[C@H](C[NH3+])[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000904411375 980269921 /nfs/dbraw/zinc/26/99/21/980269921.db2.gz UXAMTQGVUXTRKZ-NWDGAFQWSA-N 1 1 373.400 2.664 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000877645329 1014658233 /nfs/dbraw/zinc/65/82/33/1014658233.db2.gz IIAIKEHCNKILLU-DLBZAZTESA-N 1 1 368.437 2.562 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000877645329 1014658238 /nfs/dbraw/zinc/65/82/38/1014658238.db2.gz IIAIKEHCNKILLU-DLBZAZTESA-N 1 1 368.437 2.562 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(C)(C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000877835397 1014749773 /nfs/dbraw/zinc/74/97/73/1014749773.db2.gz ADWQXIOPCAKARK-LBPRGKRZSA-N 1 1 374.384 2.840 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)cc1OC ZINC000910294472 981903111 /nfs/dbraw/zinc/90/31/11/981903111.db2.gz UNYWPYJQFYVAFB-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cnc4n3CCOC4)o2)cc1 ZINC000898271422 982663100 /nfs/dbraw/zinc/66/31/00/982663100.db2.gz ZGJOYTVENMVHQU-UHFFFAOYSA-N 1 1 354.366 2.871 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878162038 1014891703 /nfs/dbraw/zinc/89/17/03/1014891703.db2.gz IRGQOBJBWSYSPG-AWEZNQCLSA-N 1 1 359.430 2.809 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000054569183 982985758 /nfs/dbraw/zinc/98/57/58/982985758.db2.gz GLTHRQFUHWLJOU-UHFFFAOYSA-N 1 1 356.382 2.921 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000054569183 982985762 /nfs/dbraw/zinc/98/57/62/982985762.db2.gz GLTHRQFUHWLJOU-UHFFFAOYSA-N 1 1 356.382 2.921 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]21 ZINC000878198465 1014909607 /nfs/dbraw/zinc/90/96/07/1014909607.db2.gz WWELDKVQOINJIB-UKRRQHHQSA-N 1 1 357.414 2.561 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@H]1CCC[N@@H+](C)C1 ZINC000151095493 984177463 /nfs/dbraw/zinc/17/74/63/984177463.db2.gz ULHKWPXEUHJUEW-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO Cc1cc(F)cc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000151104414 984182805 /nfs/dbraw/zinc/18/28/05/984182805.db2.gz YOFVUNHUWGTMBR-UHFFFAOYSA-N 1 1 374.372 2.795 20 5 FFBDMO Cc1nn(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761291357 985124537 /nfs/dbraw/zinc/12/45/37/985124537.db2.gz LXVKBRIJRHUHEG-MRXNPFEDSA-N 1 1 357.458 2.874 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccccc2C2CC2)CC1 ZINC000997772602 985735026 /nfs/dbraw/zinc/73/50/26/985735026.db2.gz OXDMPNAXVFUMNZ-RTBURBONSA-N 1 1 357.454 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)n1 ZINC001128514647 988976945 /nfs/dbraw/zinc/97/69/45/988976945.db2.gz HXXSKHVUBHITES-UHFFFAOYSA-N 1 1 356.382 2.685 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879498331 1015562683 /nfs/dbraw/zinc/56/26/83/1015562683.db2.gz QRJXAAAPOKJTMI-MRXNPFEDSA-N 1 1 354.410 2.853 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000920850074 990926240 /nfs/dbraw/zinc/92/62/40/990926240.db2.gz AVJPRABLRPUXRE-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)OCc1cccnc1[N+](=O)[O-] ZINC000923853432 990972222 /nfs/dbraw/zinc/97/22/22/990972222.db2.gz YDKRYZRHFPHGHH-RHSMWYFYSA-N 1 1 355.394 2.801 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C(=O)OCc1cccnc1[N+](=O)[O-] ZINC000923853448 990972419 /nfs/dbraw/zinc/97/24/19/990972419.db2.gz YDKRYZRHFPHGHH-YOEHRIQHSA-N 1 1 355.394 2.801 20 5 FFBDMO CCc1ccc(C[NH+]2CCC(C)(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001484135761 991407386 /nfs/dbraw/zinc/40/73/86/991407386.db2.gz HYNHMLVKHYBWGQ-QZTJIDSGSA-N 1 1 359.470 2.633 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)COc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001116100047 1032127709 /nfs/dbraw/zinc/12/77/09/1032127709.db2.gz BGUHTRFSBYEPPT-HNNXBMFYSA-N 1 1 370.409 2.780 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC3(CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880455601 1015839544 /nfs/dbraw/zinc/83/95/44/1015839544.db2.gz BNMPMTNEERKPMF-KRWDZBQOSA-N 1 1 359.426 2.735 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1COC(=O)NC1CC1 ZINC000810039971 994685520 /nfs/dbraw/zinc/68/55/20/994685520.db2.gz KUXQFSQHWGYXQS-MRXNPFEDSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1COC(=O)NC1CC1 ZINC000810039971 994685525 /nfs/dbraw/zinc/68/55/25/994685525.db2.gz KUXQFSQHWGYXQS-MRXNPFEDSA-N 1 1 363.414 2.847 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCOc2ccccc2OC)c1 ZINC000811456584 995152172 /nfs/dbraw/zinc/15/21/72/995152172.db2.gz RXTMYLKGIUTTNY-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCOc2ccccc2OC)c1 ZINC000811456584 995152177 /nfs/dbraw/zinc/15/21/77/995152177.db2.gz RXTMYLKGIUTTNY-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO CC1(C2CC2)CC[NH+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000811785085 995259775 /nfs/dbraw/zinc/25/97/75/995259775.db2.gz UXNSFNISUVIADN-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)n2)c1 ZINC000747823579 995553802 /nfs/dbraw/zinc/55/38/02/995553802.db2.gz HEYTZARVOLHIPZ-HOTGVXAUSA-N 1 1 357.414 2.559 20 5 FFBDMO CC(C)(CO)[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000679315051 1015999414 /nfs/dbraw/zinc/99/94/14/1015999414.db2.gz NKAQHENWYCZDSZ-UHFFFAOYSA-N 1 1 363.461 2.917 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C[C@H]1C1CC1 ZINC000844766453 998149404 /nfs/dbraw/zinc/14/94/04/998149404.db2.gz ZFTISCDKBLRJIA-ZWKOTPCHSA-N 1 1 370.409 2.547 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000845733622 998640904 /nfs/dbraw/zinc/64/09/04/998640904.db2.gz XOFGZQGIQSWABE-AWEZNQCLSA-N 1 1 365.386 2.852 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000732568513 998704892 /nfs/dbraw/zinc/70/48/92/998704892.db2.gz YJEWCBOHLUTLPK-UHFFFAOYSA-N 1 1 366.418 2.614 20 5 FFBDMO O=C(c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)N1CC([NH+]2CCCC2)C1 ZINC000828140095 999555983 /nfs/dbraw/zinc/55/59/83/999555983.db2.gz LHENWQDEXAWPDP-UHFFFAOYSA-N 1 1 362.188 2.961 20 5 FFBDMO C[C@@H]1CCCCC[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000738227501 999623105 /nfs/dbraw/zinc/62/31/05/999623105.db2.gz WJRVSIPOHKONQV-ACJLOTCBSA-N 1 1 360.414 2.584 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741027667 999704780 /nfs/dbraw/zinc/70/47/80/999704780.db2.gz AXOJJNJOSTXYPI-KBPBESRZSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C(Nc1ccccn1)[C@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000742588505 999779251 /nfs/dbraw/zinc/77/92/51/999779251.db2.gz PPOZAZQRAPQUFC-HNNXBMFYSA-N 1 1 370.409 2.719 20 5 FFBDMO CC[C@@]1(C)CCC[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386230 999816092 /nfs/dbraw/zinc/81/60/92/999816092.db2.gz FMGYBYHMELNBPQ-RBUKOAKNSA-N 1 1 374.441 2.831 20 5 FFBDMO CC[C@@]1(C)CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386230 999816093 /nfs/dbraw/zinc/81/60/93/999816093.db2.gz FMGYBYHMELNBPQ-RBUKOAKNSA-N 1 1 374.441 2.831 20 5 FFBDMO Cc1nn(CN2CCC(CCC[NH+](C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000766382110 999988818 /nfs/dbraw/zinc/98/88/18/999988818.db2.gz PNBKXUYMJHBLBG-UHFFFAOYSA-N 1 1 360.462 2.659 20 5 FFBDMO CC(C)(C)OC(=O)N1CC([C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169014442 1000015674 /nfs/dbraw/zinc/01/56/74/1000015674.db2.gz ZVDFNZMKEUNOPR-FMKPAKJESA-N 1 1 353.463 2.621 20 5 FFBDMO O=C1c2cccc(F)c2CN1[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169056298 1000018923 /nfs/dbraw/zinc/01/89/23/1000018923.db2.gz RGKAVOICKRGZRS-SOUVJXGZSA-N 1 1 361.417 2.691 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001169503740 1000054069 /nfs/dbraw/zinc/05/40/69/1000054069.db2.gz LMIYVMYVBNJWBN-MAUKXSAKSA-N 1 1 370.409 2.861 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)cc1 ZINC000804338590 1000076430 /nfs/dbraw/zinc/07/64/30/1000076430.db2.gz VYBLZGAGWXAQPO-UHFFFAOYSA-N 1 1 356.426 2.898 20 5 FFBDMO C[C@@H]1CN(c2ccccc2F)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493281 1002093906 /nfs/dbraw/zinc/09/39/06/1002093906.db2.gz GCXWMAJEWIYCAL-AUUYWEPGSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@@H]1CN(c2ccccc2F)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493281 1002093916 /nfs/dbraw/zinc/09/39/16/1002093916.db2.gz GCXWMAJEWIYCAL-AUUYWEPGSA-N 1 1 359.401 2.978 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000791222577 1002611755 /nfs/dbraw/zinc/61/17/55/1002611755.db2.gz WNIKEWCJPQRGGO-CYBMUJFWSA-N 1 1 366.437 2.508 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1F ZINC001185413704 1002949216 /nfs/dbraw/zinc/94/92/16/1002949216.db2.gz WXTVBQKSQXCUBX-CHWSQXEVSA-N 1 1 373.450 2.584 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@H]21 ZINC001185701246 1003026467 /nfs/dbraw/zinc/02/64/67/1003026467.db2.gz FTCIVELAEORKBH-MLGOLLRUSA-N 1 1 371.397 2.972 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](Oc3ncc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC001170355635 1003123135 /nfs/dbraw/zinc/12/31/35/1003123135.db2.gz NGOOEWSNYDSDCH-WMLDXEAASA-N 1 1 372.425 2.786 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341986 1003129823 /nfs/dbraw/zinc/12/98/23/1003129823.db2.gz LHANOAOVCCIOQZ-HUUCEWRRSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341986 1003129832 /nfs/dbraw/zinc/12/98/32/1003129832.db2.gz LHANOAOVCCIOQZ-HUUCEWRRSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001170341345 1003130318 /nfs/dbraw/zinc/13/03/18/1003130318.db2.gz PIXPYBFEHIAACG-CJNGLKHVSA-N 1 1 374.441 2.514 20 5 FFBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000804719822 1003801612 /nfs/dbraw/zinc/80/16/12/1003801612.db2.gz IPVKHZFPRGZMRQ-MRXNPFEDSA-N 1 1 356.382 2.866 20 5 FFBDMO CCN(C)C(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805762632 1004136962 /nfs/dbraw/zinc/13/69/62/1004136962.db2.gz LSFOMMDFRVXPJJ-IAGOWNOFSA-N 1 1 365.430 2.571 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@]12CCCOC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198830783 1004738767 /nfs/dbraw/zinc/73/87/67/1004738767.db2.gz XFJWBZHHYICFBI-IBGZPJMESA-N 1 1 359.426 2.519 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@]12CCCOC2)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198830783 1004738771 /nfs/dbraw/zinc/73/87/71/1004738771.db2.gz XFJWBZHHYICFBI-IBGZPJMESA-N 1 1 359.426 2.519 20 5 FFBDMO C[N@@H+](CCCC(C)(C)C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001195487742 1004975966 /nfs/dbraw/zinc/97/59/66/1004975966.db2.gz KKVUJHWTCYHOGL-UHFFFAOYSA-N 1 1 357.476 2.631 20 5 FFBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275137 1005342318 /nfs/dbraw/zinc/34/23/18/1005342318.db2.gz JJYJYYWHIXVVDU-KUHUBIRLSA-N 1 1 367.409 2.902 20 5 FFBDMO COCCC[N@@H+](Cc1ccncc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000106855908 1005364478 /nfs/dbraw/zinc/36/44/78/1005364478.db2.gz MXWOLRAKRTUBQC-UHFFFAOYSA-N 1 1 355.398 2.836 20 5 FFBDMO COCCC[N@H+](Cc1ccncc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000106855908 1005364479 /nfs/dbraw/zinc/36/44/79/1005364479.db2.gz MXWOLRAKRTUBQC-UHFFFAOYSA-N 1 1 355.398 2.836 20 5 FFBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000776582193 1005962042 /nfs/dbraw/zinc/96/20/42/1005962042.db2.gz LRBNXZHVDJXGOY-ROUUACIJSA-N 1 1 373.384 2.505 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000776582193 1005962043 /nfs/dbraw/zinc/96/20/43/1005962043.db2.gz LRBNXZHVDJXGOY-ROUUACIJSA-N 1 1 373.384 2.505 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000852514976 1006061474 /nfs/dbraw/zinc/06/14/74/1006061474.db2.gz NIYWCCYIXXLQLR-RTWAWAEBSA-N 1 1 369.465 2.877 20 5 FFBDMO CCc1[nH]nc(C(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@H]32)c1[N+](=O)[O-] ZINC000854514036 1006869224 /nfs/dbraw/zinc/86/92/24/1006869224.db2.gz VFJIVQNHIDAIRG-CZUORRHYSA-N 1 1 369.425 2.637 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1 ZINC000776765609 1007036712 /nfs/dbraw/zinc/03/67/12/1007036712.db2.gz HALMXGIJXLVZBG-GOSISDBHSA-N 1 1 356.357 2.635 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2C2CCOCC2)nc1-c1ccncc1 ZINC000776769743 1007059621 /nfs/dbraw/zinc/05/96/21/1007059621.db2.gz HREKCMHVWDZTGZ-INIZCTEOSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001116250315 1032218153 /nfs/dbraw/zinc/21/81/53/1032218153.db2.gz IDPDXBFZUMGRJW-CQSZACIVSA-N 1 1 352.822 2.628 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)OCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000817184052 1007463076 /nfs/dbraw/zinc/46/30/76/1007463076.db2.gz FIJQDWPVMMJARJ-UHFFFAOYSA-N 1 1 370.405 2.713 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@H]3COC4(CCCCC4)O3)CC2)c1 ZINC001190332119 1007587744 /nfs/dbraw/zinc/58/77/44/1007587744.db2.gz PRODSPPOUYVPNK-SFHVURJKSA-N 1 1 361.442 2.793 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593321 1007903654 /nfs/dbraw/zinc/90/36/54/1007903654.db2.gz RASCHDVXESPKNW-ZXYDQQDNSA-N 1 1 372.425 2.623 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593321 1007903661 /nfs/dbraw/zinc/90/36/61/1007903661.db2.gz RASCHDVXESPKNW-ZXYDQQDNSA-N 1 1 372.425 2.623 20 5 FFBDMO Cc1c(C(=O)N2CC[NH2+]Cc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000818543050 1007938400 /nfs/dbraw/zinc/93/84/00/1007938400.db2.gz CYLQKYCKHCGMTQ-UHFFFAOYSA-N 1 1 370.365 2.870 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856671001 1007942575 /nfs/dbraw/zinc/94/25/75/1007942575.db2.gz LHMDZBNEDXZTQD-ACJLOTCBSA-N 1 1 360.414 2.671 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2nccn2CCc2ccccc2)c1 ZINC000819140112 1008041013 /nfs/dbraw/zinc/04/10/13/1008041013.db2.gz JJWDDXTYEGYFEN-IBGZPJMESA-N 1 1 366.421 2.857 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858018417 1008278574 /nfs/dbraw/zinc/27/85/74/1008278574.db2.gz ATQCHFHRHPOZJQ-QGZVFWFLSA-N 1 1 357.414 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccnc(F)c4)CC3)nc2c1 ZINC000859252784 1008493262 /nfs/dbraw/zinc/49/32/62/1008493262.db2.gz UZMFGARESTYZFK-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)O[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000117100641 1008761721 /nfs/dbraw/zinc/76/17/21/1008761721.db2.gz BPWLBXLIQUDPOD-SFHVURJKSA-N 1 1 356.378 2.791 20 5 FFBDMO COc1ccc(OCC[NH+]2CCC(C(=O)OC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000886723691 1008844570 /nfs/dbraw/zinc/84/45/70/1008844570.db2.gz IRRYYJCSCHLQBX-UHFFFAOYSA-N 1 1 366.414 2.646 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000823967620 1009283906 /nfs/dbraw/zinc/28/39/06/1009283906.db2.gz FZWBNGGCQGGMGU-OLZOCXBDSA-N 1 1 361.446 2.952 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000130601030 1009351667 /nfs/dbraw/zinc/35/16/67/1009351667.db2.gz QILUOPAPUCFFIS-DOTOQJQBSA-N 1 1 360.414 2.512 20 5 FFBDMO O=C1[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCN1Cc1ccccn1 ZINC001180322727 1009650703 /nfs/dbraw/zinc/65/07/03/1009650703.db2.gz NQODDKKSMKSUMB-KRWDZBQOSA-N 1 1 374.828 2.924 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@@H]1C ZINC000862099011 1009697606 /nfs/dbraw/zinc/69/76/06/1009697606.db2.gz KWSFRMLRVBBRJK-GASCZTMLSA-N 1 1 371.437 2.929 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@@H]1C ZINC000862099011 1009697611 /nfs/dbraw/zinc/69/76/11/1009697611.db2.gz KWSFRMLRVBBRJK-GASCZTMLSA-N 1 1 371.437 2.929 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C(C)(C)C1 ZINC000862133952 1009713639 /nfs/dbraw/zinc/71/36/39/1009713639.db2.gz FNDXSVNHQANEAF-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C(C)(C)C1 ZINC000862133952 1009713656 /nfs/dbraw/zinc/71/36/56/1009713656.db2.gz FNDXSVNHQANEAF-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cccc1[N+](=O)[O-] ZINC000118866640 1009789158 /nfs/dbraw/zinc/78/91/58/1009789158.db2.gz PNXPFUCWXVTPPS-CQSZACIVSA-N 1 1 357.370 2.893 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000863029189 1010084730 /nfs/dbraw/zinc/08/47/30/1010084730.db2.gz BDHNURBAOMKPGK-CQSZACIVSA-N 1 1 362.386 2.558 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000794589872 1010409928 /nfs/dbraw/zinc/40/99/28/1010409928.db2.gz BUKFSCJKFAHANU-WMHRWZGDSA-N 1 1 367.405 2.813 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635165 1010447422 /nfs/dbraw/zinc/44/74/22/1010447422.db2.gz UGBPWXYHRLXNRY-HUUCEWRRSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635165 1010447426 /nfs/dbraw/zinc/44/74/26/1010447426.db2.gz UGBPWXYHRLXNRY-HUUCEWRRSA-N 1 1 363.414 2.986 20 5 FFBDMO O=C1CN(C[N@@H+](CC2CC2)CC2CCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000794711091 1010564703 /nfs/dbraw/zinc/56/47/03/1010564703.db2.gz PHIMPLAGDFJGMB-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866260617 1010964936 /nfs/dbraw/zinc/96/49/36/1010964936.db2.gz WCSFAAGORKIDIJ-CVEARBPZSA-N 1 1 366.481 2.528 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909137 1012074400 /nfs/dbraw/zinc/07/44/00/1012074400.db2.gz GMOSGWVORWQREV-QAPCUYQASA-N 1 1 370.453 2.817 20 5 FFBDMO COc1ncnc2c1CC[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172908263 1012079801 /nfs/dbraw/zinc/07/98/01/1012079801.db2.gz MXPRSSGKGBPHFW-MRXNPFEDSA-N 1 1 368.437 2.742 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2cn(C)nc21 ZINC001172909492 1012122237 /nfs/dbraw/zinc/12/22/37/1012122237.db2.gz SYTFYLLFFUVNOX-ROUUACIJSA-N 1 1 370.453 2.822 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@]4(CCOC4)C3)CC2)c(F)c1 ZINC001173009903 1012179816 /nfs/dbraw/zinc/17/98/16/1012179816.db2.gz JHIPLPXFIUDFBF-SFHVURJKSA-N 1 1 367.396 2.954 20 5 FFBDMO CN1CCC([N@@H+](C)C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173013777 1012184417 /nfs/dbraw/zinc/18/44/17/1012184417.db2.gz FCNUMXZBONKKTN-UHFFFAOYSA-N 1 1 368.428 2.868 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N3CC[NH+](C4CC4)CC3)CC2)c(F)c1 ZINC001173014350 1012184621 /nfs/dbraw/zinc/18/46/21/1012184621.db2.gz OZECVNNJDFLKDM-UHFFFAOYSA-N 1 1 366.412 2.622 20 5 FFBDMO C[C@@]1(O)CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018661 1012188480 /nfs/dbraw/zinc/18/84/80/1012188480.db2.gz YQNBAINLPQADSM-QGZVFWFLSA-N 1 1 355.385 2.689 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](n3ccnn3)C2)c1F ZINC001173191186 1012330949 /nfs/dbraw/zinc/33/09/49/1012330949.db2.gz AVCYMOQDUJCPSB-STQMWFEESA-N 1 1 363.393 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2nc(C3CC3)no2)c1F ZINC001173189761 1012333267 /nfs/dbraw/zinc/33/32/67/1012333267.db2.gz QVPSOGKZKZEIJY-VIFPVBQESA-N 1 1 350.350 2.724 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c1F ZINC001173192823 1012334162 /nfs/dbraw/zinc/33/41/62/1012334162.db2.gz NAZMMBDPILMNID-WOSRLPQWSA-N 1 1 351.422 2.700 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@@H]3C[N@@H+](C)C[C@H]32)c1F ZINC001173195430 1012338017 /nfs/dbraw/zinc/33/80/17/1012338017.db2.gz FXVJPGYCSGUWHB-WOSRLPQWSA-N 1 1 351.422 2.700 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@H]2COC ZINC001173222012 1012351208 /nfs/dbraw/zinc/35/12/08/1012351208.db2.gz OHHDORIDGHJYAG-ZBFHGGJFSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C[C@H]2COC ZINC001173222012 1012351217 /nfs/dbraw/zinc/35/12/17/1012351217.db2.gz OHHDORIDGHJYAG-ZBFHGGJFSA-N 1 1 358.442 2.988 20 5 FFBDMO COc1ccnc(O[C@H]2CCC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237402 1012382898 /nfs/dbraw/zinc/38/28/98/1012382898.db2.gz JCIWXWOGPJNBGO-PBHICJAKSA-N 1 1 372.425 2.868 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC([C@H]2CCCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870955442 1012649902 /nfs/dbraw/zinc/64/99/02/1012649902.db2.gz XEOUPOPRYXGRAW-MJGOQNOKSA-N 1 1 361.442 2.576 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000827648746 1018581532 /nfs/dbraw/zinc/58/15/32/1018581532.db2.gz FFUUFXMJQMSFOB-UHFFFAOYSA-N 1 1 370.438 2.778 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000827675725 1018608980 /nfs/dbraw/zinc/60/89/80/1018608980.db2.gz XPBZHAPIJNMWKV-GOSISDBHSA-N 1 1 371.437 2.655 20 5 FFBDMO O=C1CN([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c2ccccc2N1 ZINC000801541949 1019098718 /nfs/dbraw/zinc/09/87/18/1019098718.db2.gz WCXSOCXCQBEDCL-CQSZACIVSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)c2ccccc2N1 ZINC000801541949 1019098731 /nfs/dbraw/zinc/09/87/31/1019098731.db2.gz WCXSOCXCQBEDCL-CQSZACIVSA-N 1 1 370.384 2.767 20 5 FFBDMO COc1cn(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)cc1=O ZINC000902291723 1020057449 /nfs/dbraw/zinc/05/74/49/1020057449.db2.gz XZVXEUFERCNWIK-MRXNPFEDSA-N 1 1 357.410 2.911 20 5 FFBDMO O=C1CN(C[N@@H+](C2CC2)C2CCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000726586686 1020490164 /nfs/dbraw/zinc/49/01/64/1020490164.db2.gz NKUGCEGYUYGAMJ-UHFFFAOYSA-N 1 1 358.398 2.728 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1 ZINC000931796559 1020590347 /nfs/dbraw/zinc/59/03/47/1020590347.db2.gz OGJOOOAFSOUKSC-UYAOXDASSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1 ZINC000931796559 1020590354 /nfs/dbraw/zinc/59/03/54/1020590354.db2.gz OGJOOOAFSOUKSC-UYAOXDASSA-N 1 1 364.405 2.999 20 5 FFBDMO COc1cc([C@H](C)NCc2ccnc(OCC[NH+](C)C)c2)cc([N+](=O)[O-])c1 ZINC000903131398 1020694043 /nfs/dbraw/zinc/69/40/43/1020694043.db2.gz RWIFCAQWQUUBBU-AWEZNQCLSA-N 1 1 374.441 2.790 20 5 FFBDMO COc1cc2c(cc1OC)C1(CCC1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000932087513 1020700427 /nfs/dbraw/zinc/70/04/27/1020700427.db2.gz PFUBDGUODWKOLQ-UHFFFAOYSA-N 1 1 372.425 2.746 20 5 FFBDMO COc1ccccc1NC(=O)[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000932631424 1020856107 /nfs/dbraw/zinc/85/61/07/1020856107.db2.gz DJACROHTVDIJAV-OAHLLOKOSA-N 1 1 370.409 2.849 20 5 FFBDMO COc1ccccc1NC(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000932631424 1020856114 /nfs/dbraw/zinc/85/61/14/1020856114.db2.gz DJACROHTVDIJAV-OAHLLOKOSA-N 1 1 370.409 2.849 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])nc1 ZINC000934343791 1021203365 /nfs/dbraw/zinc/20/33/65/1021203365.db2.gz PLYVPNHFKIJCRI-RHSMWYFYSA-N 1 1 373.409 2.575 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000778734537 1022293446 /nfs/dbraw/zinc/29/34/46/1022293446.db2.gz QMLAVLCCIIODTD-UHFFFAOYSA-N 1 1 368.340 2.946 20 5 FFBDMO O=C1N(C[NH+]2CCC(OCC3CC3)CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752794093 1023205163 /nfs/dbraw/zinc/20/51/63/1023205163.db2.gz UFIOWMCGWPVBTL-UHFFFAOYSA-N 1 1 374.441 2.685 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1CN(C)CC[N@@H+]1C ZINC001120960109 1023544486 /nfs/dbraw/zinc/54/44/86/1023544486.db2.gz QUJIQTBXFLJSOU-BLLLJJGKSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1CN(C)CC[N@H+]1C ZINC001120960109 1023544491 /nfs/dbraw/zinc/54/44/91/1023544491.db2.gz QUJIQTBXFLJSOU-BLLLJJGKSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1C[N@H+](C)CCN1C ZINC001120960109 1023544498 /nfs/dbraw/zinc/54/44/98/1023544498.db2.gz QUJIQTBXFLJSOU-BLLLJJGKSA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H]1C[N@@H+](C)CCN1C ZINC001120960109 1023544506 /nfs/dbraw/zinc/54/45/06/1023544506.db2.gz QUJIQTBXFLJSOU-BLLLJJGKSA-N 1 1 361.471 2.765 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000755835391 1023642420 /nfs/dbraw/zinc/64/24/20/1023642420.db2.gz YQWGSEWGNRSYRX-GOEBONIOSA-N 1 1 372.425 2.879 20 5 FFBDMO C[C@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CCCC[N@H+]1Cc1ccccc1 ZINC000755917311 1023650692 /nfs/dbraw/zinc/65/06/92/1023650692.db2.gz WDEKIYBECVAUET-LJQANCHMSA-N 1 1 372.425 2.779 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N(C)[C@@H]1CC[N@@H+](CC)C[C@@H]1C ZINC001121698218 1023933919 /nfs/dbraw/zinc/93/39/19/1023933919.db2.gz CVHSMZVGPNHNLK-QWHCGFSZSA-N 1 1 362.434 2.633 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)[C@H]2C1 ZINC001123705343 1023949830 /nfs/dbraw/zinc/94/98/30/1023949830.db2.gz MLSLFPTUOFHCQX-WBAXXEDZSA-N 1 1 358.442 2.609 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000758333644 1024049193 /nfs/dbraw/zinc/04/91/93/1024049193.db2.gz IBKWGNVHDYLNJH-KDOFPFPSSA-N 1 1 372.469 2.798 20 5 FFBDMO CC(C)(C)CC[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540350 1024885405 /nfs/dbraw/zinc/88/54/05/1024885405.db2.gz DKEYPQDVYFMOAK-HZPDHXFCSA-N 1 1 353.507 2.942 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC12CCCCC2 ZINC001141153740 1025535141 /nfs/dbraw/zinc/53/51/41/1025535141.db2.gz QHDLZWJXURCGNW-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000837432738 1025801496 /nfs/dbraw/zinc/80/14/96/1025801496.db2.gz XYPLEVHGMVDDAL-MRXNPFEDSA-N 1 1 360.414 2.751 20 5 FFBDMO Cc1nn(CN2CC[N@@H+](Cc3ccccc3)C[C@@H](C)C2)c(C)c1[N+](=O)[O-] ZINC000840135361 1026975830 /nfs/dbraw/zinc/97/58/30/1026975830.db2.gz OHECVOYNLOHJRO-OAHLLOKOSA-N 1 1 357.458 2.820 20 5 FFBDMO CO[C@@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144138 1026983064 /nfs/dbraw/zinc/98/30/64/1026983064.db2.gz YBMMCERSHIOICV-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144138 1026983068 /nfs/dbraw/zinc/98/30/68/1026983068.db2.gz YBMMCERSHIOICV-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3ccncn3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000840170365 1026996360 /nfs/dbraw/zinc/99/63/60/1026996360.db2.gz LZVXLAIEUXAXOO-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[N@@H+](C(C)C)[C@@H](C)C1 ZINC001158493585 1027043646 /nfs/dbraw/zinc/04/36/46/1027043646.db2.gz ARDKHXGTCSUEBV-NSHDSACASA-N 1 1 370.837 2.739 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CCCCC(F)(F)F)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097841 1027589234 /nfs/dbraw/zinc/58/92/34/1027589234.db2.gz LJAXFCYUAUOVIN-ZIAGYGMSSA-N 1 1 363.380 2.523 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CCCCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097841 1027589250 /nfs/dbraw/zinc/58/92/50/1027589250.db2.gz LJAXFCYUAUOVIN-ZIAGYGMSSA-N 1 1 363.380 2.523 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CCCCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097841 1027589263 /nfs/dbraw/zinc/58/92/63/1027589263.db2.gz LJAXFCYUAUOVIN-ZIAGYGMSSA-N 1 1 363.380 2.523 20 5 FFBDMO CCc1ccccc1CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001160107912 1027595238 /nfs/dbraw/zinc/59/52/38/1027595238.db2.gz YGFKHJKHFVRIPM-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO CCc1ccccc1CC[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160107912 1027595254 /nfs/dbraw/zinc/59/52/54/1027595254.db2.gz YGFKHJKHFVRIPM-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO CCc1ccccc1CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160107912 1027595265 /nfs/dbraw/zinc/59/52/65/1027595265.db2.gz YGFKHJKHFVRIPM-WOJBJXKFSA-N 1 1 371.481 2.595 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC(C)(C)CC(=O)N2CCCC2)ncc1[N+](=O)[O-] ZINC001160292905 1027662562 /nfs/dbraw/zinc/66/25/62/1027662562.db2.gz YJAZVABVLCWFOD-JXMROGBWSA-N 1 1 361.446 2.725 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc(C(=O)OCC)cc([N+](=O)[O-])c1 ZINC001160312333 1027668725 /nfs/dbraw/zinc/66/87/25/1027668725.db2.gz BEBFDUTXZBILPZ-CYBMUJFWSA-N 1 1 365.430 2.622 20 5 FFBDMO Cc1nn(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c(C)c1[N+](=O)[O-] ZINC000795711872 1027924482 /nfs/dbraw/zinc/92/44/82/1027924482.db2.gz TUFIEQTYIGXKRQ-FQEVSTJZSA-N 1 1 369.469 2.964 20 5 FFBDMO CC1(C)CC(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)C1 ZINC000957547966 1028324654 /nfs/dbraw/zinc/32/46/54/1028324654.db2.gz VSTCKPGABVCIJZ-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO CC[N@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713087 1028580974 /nfs/dbraw/zinc/58/09/74/1028580974.db2.gz LFGPZRXGMLXZEI-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713087 1028580984 /nfs/dbraw/zinc/58/09/84/1028580984.db2.gz LFGPZRXGMLXZEI-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@H+](Cc1ccccc1F)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713087 1028580991 /nfs/dbraw/zinc/58/09/91/1028580991.db2.gz LFGPZRXGMLXZEI-SJLPKXTDSA-N 1 1 363.433 2.551 20 5 FFBDMO CO[C@H](C[NH+]1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1)c1ccccc1 ZINC001155705645 1028862621 /nfs/dbraw/zinc/86/26/21/1028862621.db2.gz JKWRONOEZUVNIY-QGZVFWFLSA-N 1 1 360.389 2.639 20 5 FFBDMO [NH3+][C@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CCC1(F)F ZINC001164327318 1029247331 /nfs/dbraw/zinc/24/73/31/1029247331.db2.gz NBSBVEFIWKMCSM-ZDUSSCGKSA-N 1 1 352.316 2.969 20 5 FFBDMO Cn1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)cc([N+](=O)[O-])c1=O ZINC001164491801 1029296961 /nfs/dbraw/zinc/29/69/61/1029296961.db2.gz GKNLCTLIEWJBHX-KBAYOESNSA-N 1 1 368.437 2.616 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N1C[C@H]2[C@@H](CC[N@H+]2Cc2ccccc2)C1 ZINC001165089417 1029380159 /nfs/dbraw/zinc/38/01/59/1029380159.db2.gz UNOIPYHBRCXXLH-HOCLYGCPSA-N 1 1 374.828 2.592 20 5 FFBDMO CCc1cc(NCc2ccc(N)[nH+]c2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001156980871 1029431187 /nfs/dbraw/zinc/43/11/87/1029431187.db2.gz NPXQBDUEIXNBGB-UHFFFAOYSA-N 1 1 364.409 2.934 20 5 FFBDMO Cc1cc(N2C[C@H]3CCC[N@H+](C)[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001157270521 1029530597 /nfs/dbraw/zinc/53/05/97/1029530597.db2.gz FQNLTHLAWWVORS-WBVHZDCISA-N 1 1 353.426 2.891 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CCOC[C@H]2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001157502931 1029599003 /nfs/dbraw/zinc/59/90/03/1029599003.db2.gz ZGCBRQUZFVUUTF-GFOMBABLSA-N 1 1 368.437 2.970 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782509786 1029725474 /nfs/dbraw/zinc/72/54/74/1029725474.db2.gz QVRDQORDRXMNDS-UONOGXRCSA-N 1 1 366.437 2.867 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782509786 1029725480 /nfs/dbraw/zinc/72/54/80/1029725480.db2.gz QVRDQORDRXMNDS-UONOGXRCSA-N 1 1 366.437 2.867 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@@]2(O)CCc3ccccc32)c2cc([N+](=O)[O-])ccc12 ZINC000842626738 1030850021 /nfs/dbraw/zinc/85/00/21/1030850021.db2.gz XPGYWLWZCZXPDY-FQEVSTJZSA-N 1 1 366.421 2.976 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796719262 1030894972 /nfs/dbraw/zinc/89/49/72/1030894972.db2.gz YMOGDEHYAHNBMT-IRXDYDNUSA-N 1 1 365.430 2.617 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C12CCC2 ZINC000832208858 1034631739 /nfs/dbraw/zinc/63/17/39/1034631739.db2.gz DLDVAIHUFVGTLP-CVEARBPZSA-N 1 1 365.405 2.952 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@@H](Oc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001226763741 1034826399 /nfs/dbraw/zinc/82/63/99/1034826399.db2.gz BCTKCNWJRJUWFZ-HOCLYGCPSA-N 1 1 363.414 2.667 20 5 FFBDMO Cc1ccc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])n1 ZINC001227221517 1034973685 /nfs/dbraw/zinc/97/36/85/1034973685.db2.gz AYYFUHBBGUIHEK-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001139628009 1035183755 /nfs/dbraw/zinc/18/37/55/1035183755.db2.gz KTHVJMSMIFABEU-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO Oc1cnc(N2CC[NH+](Cc3ccc4ccc5cccnc5c4n3)CC2)nc1 ZINC001232226837 1035505915 /nfs/dbraw/zinc/50/59/15/1035505915.db2.gz YRPABGHOHVIDKP-UHFFFAOYSA-N 1 1 372.432 2.601 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)nc1Cl ZINC001228938428 1036417091 /nfs/dbraw/zinc/41/70/91/1036417091.db2.gz PGMYKRXTSJBTFE-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO COC(=O)c1ccc(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)cc1[N+](=O)[O-] ZINC001234056066 1036897418 /nfs/dbraw/zinc/89/74/18/1036897418.db2.gz CCMJTSUZQNKPCC-DZGCQCFKSA-N 1 1 371.393 2.991 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cnc3ccc(=O)n4c5ccccc5c2c34)C1 ZINC001234710148 1037150666 /nfs/dbraw/zinc/15/06/66/1037150666.db2.gz GYAPQMDYEOACTF-CQSZACIVSA-N 1 1 363.417 2.538 20 5 FFBDMO Cc1csc2nc(C)c(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)n12 ZINC001207128325 1037172340 /nfs/dbraw/zinc/17/23/40/1037172340.db2.gz CAJVOVGRMLGMIJ-QGZVFWFLSA-N 1 1 360.439 2.918 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H]4COC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256093776 1038378931 /nfs/dbraw/zinc/37/89/31/1038378931.db2.gz QPUCFKRHTTUJKT-CABCVRRESA-N 1 1 361.442 2.541 20 5 FFBDMO COc1cc(N2CCC([N@@H+](CCCO)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256099349 1038384579 /nfs/dbraw/zinc/38/45/79/1038384579.db2.gz ONUNWEUZUJQZSR-UHFFFAOYSA-N 1 1 351.447 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H](N(C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101206 1038385116 /nfs/dbraw/zinc/38/51/16/1038385116.db2.gz CAIQRLPEQCLSQX-SFHVURJKSA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@H]([N@H+](C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101206 1038385132 /nfs/dbraw/zinc/38/51/32/1038385132.db2.gz CAIQRLPEQCLSQX-SFHVURJKSA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@H]([N@@H+](C)C4CC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101206 1038385144 /nfs/dbraw/zinc/38/51/44/1038385144.db2.gz CAIQRLPEQCLSQX-SFHVURJKSA-N 1 1 374.485 2.741 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(F)c(F)cc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258136613 1039216112 /nfs/dbraw/zinc/21/61/12/1039216112.db2.gz CBNYXXVSYIIBFN-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO C[C@@H]1CC[C@H](C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)NC1 ZINC001246108306 1039246711 /nfs/dbraw/zinc/24/67/11/1039246711.db2.gz UVYGIGRMYHQSQD-TZMCWYRMSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@@H]1CC[C@H](CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[NH2+]C1 ZINC001246108306 1039246715 /nfs/dbraw/zinc/24/67/15/1039246715.db2.gz UVYGIGRMYHQSQD-TZMCWYRMSA-N 1 1 368.428 2.820 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001246898295 1039525398 /nfs/dbraw/zinc/52/53/98/1039525398.db2.gz YIVGWNOLHRKMLZ-BRWVUGGUSA-N 1 1 357.571 2.798 20 5 FFBDMO C[Si](C)(C)CCOCN[C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001246898295 1039525405 /nfs/dbraw/zinc/52/54/05/1039525405.db2.gz YIVGWNOLHRKMLZ-BRWVUGGUSA-N 1 1 357.571 2.798 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@@H+]1CCO)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001210683433 1039668766 /nfs/dbraw/zinc/66/87/66/1039668766.db2.gz UCIFTXSDARGSGU-AWEZNQCLSA-N 1 1 372.425 2.716 20 5 FFBDMO Cn1cncc1C[C@@H]([NH3+])c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247311305 1039703088 /nfs/dbraw/zinc/70/30/88/1039703088.db2.gz LNEIKIRXDAKFLN-OAHLLOKOSA-N 1 1 371.404 2.809 20 5 FFBDMO Cn1c[nH+]cc1C[C@@H](N)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247311305 1039703104 /nfs/dbraw/zinc/70/31/04/1039703104.db2.gz LNEIKIRXDAKFLN-OAHLLOKOSA-N 1 1 371.404 2.809 20 5 FFBDMO COc1cnc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c(C)c1 ZINC001248207299 1040172599 /nfs/dbraw/zinc/17/25/99/1040172599.db2.gz CHGADSBQPSLDJS-CQSZACIVSA-N 1 1 355.354 2.599 20 5 FFBDMO Cn1cc2cccc(-c3noc([C@H]([NH3+])Cc4cccc([N+](=O)[O-])c4)n3)c2n1 ZINC001248208171 1040172888 /nfs/dbraw/zinc/17/28/88/1040172888.db2.gz JZZOWFJYZSJMOS-OAHLLOKOSA-N 1 1 364.365 2.774 20 5 FFBDMO [NH3+][C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc3ccnn32)no1 ZINC001248212192 1040173607 /nfs/dbraw/zinc/17/36/07/1040173607.db2.gz MLKBQCTZSFGABF-AWEZNQCLSA-N 1 1 350.338 2.535 20 5 FFBDMO COC(=O)c1ccc2c(c1)CC[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594431 1040821456 /nfs/dbraw/zinc/82/14/56/1040821456.db2.gz QWBIMSMIGAYEMJ-IBGZPJMESA-N 1 1 352.390 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254595675 1040826001 /nfs/dbraw/zinc/82/60/01/1040826001.db2.gz XXSSWIDLHLTGIE-NCOADZHNSA-N 1 1 359.426 2.517 20 5 FFBDMO COc1ccc(O[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254612161 1040842122 /nfs/dbraw/zinc/84/21/22/1040842122.db2.gz VOQVWGVIPOALTC-FUHWJXTLSA-N 1 1 355.394 2.619 20 5 FFBDMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001538762448 1070488235 /nfs/dbraw/zinc/48/82/35/1070488235.db2.gz PDRPQQUEMUGYNC-SNVBAGLBSA-N 1 1 367.793 2.521 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001318839155 1044904579 /nfs/dbraw/zinc/90/45/79/1044904579.db2.gz UVUHAEKOLNFHOV-ZNMIVQPWSA-N 1 1 360.458 2.986 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486398 1045169387 /nfs/dbraw/zinc/16/93/87/1045169387.db2.gz KLKXXXRBUIYVHV-QAPCUYQASA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486398 1045169391 /nfs/dbraw/zinc/16/93/91/1045169391.db2.gz KLKXXXRBUIYVHV-QAPCUYQASA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cc(N[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001319503944 1045176520 /nfs/dbraw/zinc/17/65/20/1045176520.db2.gz BAMCOCMZSBXSQV-SJCJKPOMSA-N 1 1 353.426 2.677 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001319574569 1045201046 /nfs/dbraw/zinc/20/10/46/1045201046.db2.gz ZUYHLWHXKXHYIN-ZWKOTPCHSA-N 1 1 372.400 2.979 20 5 FFBDMO O=C(NCC[NH+]1CC=CC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC001319612790 1045214089 /nfs/dbraw/zinc/21/40/89/1045214089.db2.gz STLQVWUXOVQDST-UHFFFAOYSA-N 1 1 366.421 2.809 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001320174764 1045362482 /nfs/dbraw/zinc/36/24/82/1045362482.db2.gz BKKMEVDGQUJSSA-ROUUACIJSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001320174764 1045362485 /nfs/dbraw/zinc/36/24/85/1045362485.db2.gz BKKMEVDGQUJSSA-ROUUACIJSA-N 1 1 372.400 2.951 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001320713600 1045453772 /nfs/dbraw/zinc/45/37/72/1045453772.db2.gz YEKSSSZCXBVEFY-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001320713600 1045453774 /nfs/dbraw/zinc/45/37/74/1045453774.db2.gz YEKSSSZCXBVEFY-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC001320760966 1045462337 /nfs/dbraw/zinc/46/23/37/1045462337.db2.gz NBQXYEOIGYKCMR-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC001322221607 1046001931 /nfs/dbraw/zinc/00/19/31/1046001931.db2.gz HJAFDULSYLSOLF-QAPCUYQASA-N 1 1 374.437 2.906 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002990 1046302884 /nfs/dbraw/zinc/30/28/84/1046302884.db2.gz IDOBFSIUZPKMAH-YJBOKZPZSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002990 1046302890 /nfs/dbraw/zinc/30/28/90/1046302890.db2.gz IDOBFSIUZPKMAH-YJBOKZPZSA-N 1 1 373.384 2.918 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001328186924 1048216246 /nfs/dbraw/zinc/21/62/46/1048216246.db2.gz VQDPJYAFXWPNNW-WBVHZDCISA-N 1 1 373.388 2.883 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cc2ccccc2o1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001332707590 1048518047 /nfs/dbraw/zinc/51/80/47/1048518047.db2.gz NLOQJIHSSLJFOT-IAGOWNOFSA-N 1 1 359.426 2.767 20 5 FFBDMO CC(C)N(CC[N@H+](C)Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001332707590 1048518057 /nfs/dbraw/zinc/51/80/57/1048518057.db2.gz NLOQJIHSSLJFOT-IAGOWNOFSA-N 1 1 359.426 2.767 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001332707590 1048518066 /nfs/dbraw/zinc/51/80/66/1048518066.db2.gz NLOQJIHSSLJFOT-IAGOWNOFSA-N 1 1 359.426 2.767 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@H]2CCC[N@@H+](CC)C2)ccc1[N+](=O)[O-] ZINC001333506553 1048948381 /nfs/dbraw/zinc/94/83/81/1048948381.db2.gz HHNBXZVUJHKYOK-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H]1c1ccc(F)cc1 ZINC001333709470 1049069574 /nfs/dbraw/zinc/06/95/74/1049069574.db2.gz MLIOSXFIIGTDBY-DOTOQJQBSA-N 1 1 358.373 2.690 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1COC(=O)c1ccn(-c2cc[nH+]cc2)n1 ZINC001339726156 1050155731 /nfs/dbraw/zinc/15/57/31/1050155731.db2.gz RNEPDAUGNBXMPQ-UHFFFAOYSA-N 1 1 354.322 2.541 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001303800972 1051450608 /nfs/dbraw/zinc/45/06/08/1051450608.db2.gz KHPOSVGFDNCRIL-GDBMZVCRSA-N 1 1 360.458 2.654 20 5 FFBDMO C[C@@H](c1nnc(N(C)C[C@@H]2CCCC[N@H+]2Cc2ccccc2)n1C)[N+](=O)[O-] ZINC001341360215 1051718851 /nfs/dbraw/zinc/71/88/51/1051718851.db2.gz OLBRMCXTUFOWKT-RDJZCZTQSA-N 1 1 372.473 2.644 20 5 FFBDMO CC1(C)C[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC001345007202 1052195250 /nfs/dbraw/zinc/19/52/50/1052195250.db2.gz QMSGGBUVXGNRKV-RDJZCZTQSA-N 1 1 362.426 2.918 20 5 FFBDMO CC1(C)C[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC001345007202 1052195253 /nfs/dbraw/zinc/19/52/53/1052195253.db2.gz QMSGGBUVXGNRKV-RDJZCZTQSA-N 1 1 362.426 2.918 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC001343520072 1052279561 /nfs/dbraw/zinc/27/95/61/1052279561.db2.gz MCCQWHGPGXVAEK-GASCZTMLSA-N 1 1 368.817 2.587 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](O)[C@H]4CCCC[C@H]43)n2)cc1 ZINC001308025787 1052386408 /nfs/dbraw/zinc/38/64/08/1052386408.db2.gz RDBQAIUMVZKSNR-XHSDSOJGSA-N 1 1 358.398 2.770 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[nH]c1C(C)C ZINC001308720881 1052491097 /nfs/dbraw/zinc/49/10/97/1052491097.db2.gz DBYRRDPVNGAZSC-UHFFFAOYSA-N 1 1 371.397 2.999 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348236245 1054564096 /nfs/dbraw/zinc/56/40/96/1054564096.db2.gz XVODROPMVNWIQR-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348236245 1054564109 /nfs/dbraw/zinc/56/41/09/1054564109.db2.gz XVODROPMVNWIQR-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348236246 1054565126 /nfs/dbraw/zinc/56/51/26/1054565126.db2.gz XVODROPMVNWIQR-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348236246 1054565137 /nfs/dbraw/zinc/56/51/37/1054565137.db2.gz XVODROPMVNWIQR-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+]2C)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001338769632 1055797425 /nfs/dbraw/zinc/79/74/25/1055797425.db2.gz LYHWXDFKMAYDCW-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@H]2CCC[N@H+]2C)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001338769632 1055797436 /nfs/dbraw/zinc/79/74/36/1055797436.db2.gz LYHWXDFKMAYDCW-MRXNPFEDSA-N 1 1 356.430 2.659 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC001545105636 1071733667 /nfs/dbraw/zinc/73/36/67/1071733667.db2.gz MSGPALLXPWJZKR-HIFRSBDPSA-N 1 1 354.410 2.869 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3NC)CC[NH2+]2)cc1 ZINC001448456029 1058779378 /nfs/dbraw/zinc/77/93/78/1058779378.db2.gz XAEYQAQXWNXDSZ-LJQANCHMSA-N 1 1 368.437 2.986 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483120 1060121511 /nfs/dbraw/zinc/12/15/11/1060121511.db2.gz YOPUFPMYXUHPKC-YJBOKZPZSA-N 1 1 355.442 2.832 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1 ZINC000848582451 1060311005 /nfs/dbraw/zinc/31/10/05/1060311005.db2.gz LOWCVSKYLOZNLF-UHFFFAOYSA-N 1 1 368.340 2.703 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC001458449384 1060593663 /nfs/dbraw/zinc/59/36/63/1060593663.db2.gz ZYQUOXVUJHYSCE-LBPRGKRZSA-N 1 1 364.833 2.741 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2C)C1 ZINC001458546969 1060619472 /nfs/dbraw/zinc/61/94/72/1060619472.db2.gz KGCNKGKIKYXGIE-GOSISDBHSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2C)C1 ZINC001458546969 1060619479 /nfs/dbraw/zinc/61/94/79/1060619479.db2.gz KGCNKGKIKYXGIE-GOSISDBHSA-N 1 1 356.426 2.920 20 5 FFBDMO C[C@@H]1[C@H](Nc2c3ccc(Br)cc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001458615557 1060634380 /nfs/dbraw/zinc/63/43/80/1060634380.db2.gz RWBAJUOLWPVNOH-BXKDBHETSA-N 1 1 365.231 2.832 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000848783912 1060689663 /nfs/dbraw/zinc/68/96/63/1060689663.db2.gz GKAJAKWLSTVLHX-KBPBESRZSA-N 1 1 364.402 2.733 20 5 FFBDMO COc1ccc(C[C@@H]2CC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001459656058 1060788352 /nfs/dbraw/zinc/78/83/52/1060788352.db2.gz OTECNLBVYGBCKH-IRXDYDNUSA-N 1 1 372.421 2.660 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O)(c2ccnn2C)CC1 ZINC001460719374 1061074656 /nfs/dbraw/zinc/07/46/56/1061074656.db2.gz DEPIVBIZABTKFP-UHFFFAOYSA-N 1 1 374.441 2.599 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001460817053 1061112482 /nfs/dbraw/zinc/11/24/82/1061112482.db2.gz KTRZWVDWIUKMBO-SFHVURJKSA-N 1 1 356.382 2.678 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@H]1CC[N@H+](CC)C1 ZINC001546421461 1061119593 /nfs/dbraw/zinc/11/95/93/1061119593.db2.gz GQOVFKFOXIWXBA-HNNXBMFYSA-N 1 1 372.473 2.727 20 5 FFBDMO O=C(CC[N@H+]1CCc2cc(O)ccc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC001460977521 1061175534 /nfs/dbraw/zinc/17/55/34/1061175534.db2.gz OSFRAOXLWVMMGD-UHFFFAOYSA-N 1 1 359.357 2.826 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c(S(N)(=O)=O)c1)c1ccccc1[N+](=O)[O-] ZINC001461730620 1061390515 /nfs/dbraw/zinc/39/05/15/1061390515.db2.gz NOVLTERBZBYTON-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1 ZINC001522551307 1062210177 /nfs/dbraw/zinc/21/01/77/1062210177.db2.gz PHWQDWQERHOZRK-DUVNUKRYSA-N 1 1 351.834 2.637 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001479476663 1062451645 /nfs/dbraw/zinc/45/16/45/1062451645.db2.gz NAPCDZOZGWIFTF-NVXWUHKLSA-N 1 1 360.458 2.826 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CCC[N@@H+]2CC(C)C)c([N+](=O)[O-])c1 ZINC001465291124 1063040640 /nfs/dbraw/zinc/04/06/40/1063040640.db2.gz JZANQTJUSQSLCT-KRWDZBQOSA-N 1 1 362.474 2.942 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001439615591 1063185835 /nfs/dbraw/zinc/18/58/35/1063185835.db2.gz VJOJTNSNHUWDAD-ZDUSSCGKSA-N 1 1 366.437 2.602 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC001439615591 1063185842 /nfs/dbraw/zinc/18/58/42/1063185842.db2.gz VJOJTNSNHUWDAD-ZDUSSCGKSA-N 1 1 366.437 2.602 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H]1C ZINC001466104121 1063326538 /nfs/dbraw/zinc/32/65/38/1063326538.db2.gz VAGHXYMPEHMTSO-CQSZACIVSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H]1C ZINC001466104121 1063326558 /nfs/dbraw/zinc/32/65/58/1063326558.db2.gz VAGHXYMPEHMTSO-CQSZACIVSA-N 1 1 354.410 2.823 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH2+][C@H]2Cc3cccc(O)c3C2)o1 ZINC001473380023 1065251027 /nfs/dbraw/zinc/25/10/27/1065251027.db2.gz OFVORKMHHYFBTO-LBPRGKRZSA-N 1 1 352.350 2.607 20 5 FFBDMO CCOC(=O)CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)C ZINC001473593455 1065294057 /nfs/dbraw/zinc/29/40/57/1065294057.db2.gz XHUUHOORKCNIAN-UHFFFAOYSA-N 1 1 369.393 2.726 20 5 FFBDMO COc1nscc1C[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001473827709 1065380124 /nfs/dbraw/zinc/38/01/24/1065380124.db2.gz BGZCSQMTAJXZAZ-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1nscc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001473827709 1065380137 /nfs/dbraw/zinc/38/01/37/1065380137.db2.gz BGZCSQMTAJXZAZ-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001473906609 1065416471 /nfs/dbraw/zinc/41/64/71/1065416471.db2.gz LAYXJLUCAFIPEO-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC001474373085 1065506003 /nfs/dbraw/zinc/50/60/03/1065506003.db2.gz XZPAPIHKCROZFK-UHFFFAOYSA-N 1 1 367.405 2.940 20 5 FFBDMO NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 ZINC001474726334 1065591231 /nfs/dbraw/zinc/59/12/31/1065591231.db2.gz KXXFCTFPXZNXLQ-WFASDCNBSA-N 1 1 357.332 2.701 20 5 FFBDMO Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])C2)c1 ZINC001557759644 1075885665 /nfs/dbraw/zinc/88/56/65/1075885665.db2.gz BIVQONSKYAQROW-OAHLLOKOSA-N 1 1 371.441 2.754 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090370 1076224567 /nfs/dbraw/zinc/22/45/67/1076224567.db2.gz RJRGRXNMCQNGHW-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001560090370 1076224571 /nfs/dbraw/zinc/22/45/71/1076224571.db2.gz RJRGRXNMCQNGHW-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001560231534 1076252213 /nfs/dbraw/zinc/25/22/13/1076252213.db2.gz VOTVAXITULAFLJ-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]1(CO)c1ccccc1 ZINC001560231534 1076252218 /nfs/dbraw/zinc/25/22/18/1076252218.db2.gz VOTVAXITULAFLJ-FQEVSTJZSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)cc1[N+](=O)[O-] ZINC001561946187 1076451308 /nfs/dbraw/zinc/45/13/08/1076451308.db2.gz ZFQCWNHCDMEZFP-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)n1 ZINC001566426210 1076959249 /nfs/dbraw/zinc/95/92/49/1076959249.db2.gz JMOALRNHUMZGAU-DOTOQJQBSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)n1 ZINC001566426210 1076959252 /nfs/dbraw/zinc/95/92/52/1076959252.db2.gz JMOALRNHUMZGAU-DOTOQJQBSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001568403233 1077090495 /nfs/dbraw/zinc/09/04/95/1077090495.db2.gz BUVIZYJBASOANS-UHFFFAOYSA-N 1 1 351.366 2.601 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C ZINC001586370758 1079613592 /nfs/dbraw/zinc/61/35/92/1079613592.db2.gz LHTHYIIXTJIVCQ-NDBYEHHHSA-N 1 1 369.849 2.955 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000144364018 206139077 /nfs/dbraw/zinc/13/90/77/206139077.db2.gz ICAFRERHFPMZMS-BUPRPMBJSA-N 1 1 351.406 2.889 20 5 FFBDMO O=c1[nH]cnc2cc(N3CC[NH+](Cc4ccccc4)CC3)c([N+](=O)[O-])cc21 ZINC000005582108 249306273 /nfs/dbraw/zinc/30/62/73/249306273.db2.gz HHGGLAUHOPDFDF-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000117794050 250363049 /nfs/dbraw/zinc/36/30/49/250363049.db2.gz DOFIQFWGZJCEDW-ZDUSSCGKSA-N 1 1 351.834 2.924 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000264603989 251321618 /nfs/dbraw/zinc/32/16/18/251321618.db2.gz KWXGZPMKONXLMZ-OAHLLOKOSA-N 1 1 371.441 2.665 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398030 251345246 /nfs/dbraw/zinc/34/52/46/251345246.db2.gz FHHSJYSHPAQTLG-KGLIPLIRSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398030 251345249 /nfs/dbraw/zinc/34/52/49/251345249.db2.gz FHHSJYSHPAQTLG-KGLIPLIRSA-N 1 1 357.414 2.833 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O ZINC000272283279 252000413 /nfs/dbraw/zinc/00/04/13/252000413.db2.gz DFVQPWLHNPQSPO-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O ZINC000272283279 252000417 /nfs/dbraw/zinc/00/04/17/252000417.db2.gz DFVQPWLHNPQSPO-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO COc1cc(C[NH2+]Cc2cnn(C)c2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000272390273 252026259 /nfs/dbraw/zinc/02/62/59/252026259.db2.gz IVAXKMSDSULEES-UHFFFAOYSA-N 1 1 370.356 2.579 20 5 FFBDMO O=C(NC1CC[NH+](CCc2ccccc2)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000272487113 252051032 /nfs/dbraw/zinc/05/10/32/252051032.db2.gz BVXUVONAZLXCIN-UHFFFAOYSA-N 1 1 369.421 2.737 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)[C@@H]2C1 ZINC000272697275 252105466 /nfs/dbraw/zinc/10/54/66/252105466.db2.gz YATUKULQLRCZTN-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1cc(N2CC[C@@H](CN3CCOCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272881445 252154958 /nfs/dbraw/zinc/15/49/58/252154958.db2.gz VQVXYNHCLTZCFQ-HNNXBMFYSA-N 1 1 356.426 2.610 20 5 FFBDMO O=C(C[NH+]1CCC(CCCO)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000273056195 252203267 /nfs/dbraw/zinc/20/32/67/252203267.db2.gz ZJVVAQTWVIWXSB-UHFFFAOYSA-N 1 1 355.822 2.671 20 5 FFBDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354371 256092491 /nfs/dbraw/zinc/09/24/91/256092491.db2.gz UXUBZKUKVUXJBM-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354371 256092492 /nfs/dbraw/zinc/09/24/92/256092492.db2.gz UXUBZKUKVUXJBM-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276884865 256139728 /nfs/dbraw/zinc/13/97/28/256139728.db2.gz FJVCKZHFGQDPHA-NSHDSACASA-N 1 1 367.365 2.865 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276884865 256139730 /nfs/dbraw/zinc/13/97/30/256139730.db2.gz FJVCKZHFGQDPHA-NSHDSACASA-N 1 1 367.365 2.865 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277294283 256181463 /nfs/dbraw/zinc/18/14/63/256181463.db2.gz OLOMPFPPBVRGPJ-UHFFFAOYSA-N 1 1 367.203 2.682 20 5 FFBDMO C[C@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@@]1=O ZINC000277305712 256182681 /nfs/dbraw/zinc/18/26/81/256182681.db2.gz UKXJSCDRORFKEX-CANCMXDXSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@@]1=O ZINC000277305712 256182682 /nfs/dbraw/zinc/18/26/82/256182682.db2.gz UKXJSCDRORFKEX-CANCMXDXSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNCc2cc([N+](=O)[O-])ccc2OC(F)F)CCCO1 ZINC000277983718 256263816 /nfs/dbraw/zinc/26/38/16/256263816.db2.gz UBQFEEOIVGIAGN-ZDUSSCGKSA-N 1 1 373.400 2.787 20 5 FFBDMO COCCOc1ccccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000278724748 256341964 /nfs/dbraw/zinc/34/19/64/256341964.db2.gz PVZURDBPTYLJLQ-UHFFFAOYSA-N 1 1 356.382 2.786 20 5 FFBDMO CCOc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278118 257029004 /nfs/dbraw/zinc/02/90/04/257029004.db2.gz BQJNSIFOAPUCIZ-QWHCGFSZSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278118 257029005 /nfs/dbraw/zinc/02/90/05/257029005.db2.gz BQJNSIFOAPUCIZ-QWHCGFSZSA-N 1 1 362.348 2.986 20 5 FFBDMO CN(CCCN(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)Cc1ccco1 ZINC000286732784 257051991 /nfs/dbraw/zinc/05/19/91/257051991.db2.gz RSSGEWYUOKTVJK-UHFFFAOYSA-N 1 1 371.397 2.658 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2ccncc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000289344296 257275815 /nfs/dbraw/zinc/27/58/15/257275815.db2.gz MFOUAUNSBZYIQL-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2ccncc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000289344296 257275816 /nfs/dbraw/zinc/27/58/16/257275816.db2.gz MFOUAUNSBZYIQL-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCOC(C)(C)C1 ZINC000289672322 257293226 /nfs/dbraw/zinc/29/32/26/257293226.db2.gz GAHKTYBHZUEHLE-AWEZNQCLSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])C2 ZINC000289939928 257307472 /nfs/dbraw/zinc/30/74/72/257307472.db2.gz CKEJNRBBBLNABC-OAHLLOKOSA-N 1 1 371.441 2.589 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000289944443 257307814 /nfs/dbraw/zinc/30/78/14/257307814.db2.gz VQNGXYQNMCMPRL-LSDHHAIUSA-N 1 1 352.431 2.614 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F ZINC000289557541 257287054 /nfs/dbraw/zinc/28/70/54/257287054.db2.gz UVJYOSIECOUMMU-ZDUSSCGKSA-N 1 1 359.348 2.528 20 5 FFBDMO Cc1ncsc1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000289586925 257288619 /nfs/dbraw/zinc/28/86/19/257288619.db2.gz RUBQMHYXGPWOCW-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@](CO)(c4ccccc4)C3)nc2c1 ZINC000291150210 257388066 /nfs/dbraw/zinc/38/80/66/257388066.db2.gz AGORILMIDXXXQI-LJQANCHMSA-N 1 1 353.378 2.872 20 5 FFBDMO CC[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000301237680 258036494 /nfs/dbraw/zinc/03/64/94/258036494.db2.gz IKYJOVDTVOXMDE-AAEUAGOBSA-N 1 1 372.263 2.639 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000299683957 258016573 /nfs/dbraw/zinc/01/65/73/258016573.db2.gz XEKQDQTYGADMJN-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO C[N@@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000302836584 258112005 /nfs/dbraw/zinc/11/20/05/258112005.db2.gz WQIPTEMABNWIEN-SUMWQHHRSA-N 1 1 374.351 2.773 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000302836584 258112006 /nfs/dbraw/zinc/11/20/06/258112006.db2.gz WQIPTEMABNWIEN-SUMWQHHRSA-N 1 1 374.351 2.773 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@H]1C ZINC000301854742 258070532 /nfs/dbraw/zinc/07/05/32/258070532.db2.gz CIMDWRUNRRLFTO-KGLIPLIRSA-N 1 1 351.447 2.663 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591161 258166220 /nfs/dbraw/zinc/16/62/20/258166220.db2.gz OFOIEFKJNMPXSK-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591161 258166221 /nfs/dbraw/zinc/16/62/21/258166221.db2.gz OFOIEFKJNMPXSK-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000331570117 258191277 /nfs/dbraw/zinc/19/12/77/258191277.db2.gz PTRRBQQOVBXQKE-NSHDSACASA-N 1 1 353.369 2.549 20 5 FFBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NC1CCCCC1 ZINC000331985843 258209002 /nfs/dbraw/zinc/20/90/02/258209002.db2.gz LEPRALDUCJTJLU-UHFFFAOYSA-N 1 1 361.442 2.887 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@H](C)O1 ZINC000331727543 258198127 /nfs/dbraw/zinc/19/81/27/258198127.db2.gz YOGNZKXCYQVWNT-STQMWFEESA-N 1 1 374.441 2.694 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[NH+](CCCO)CC1 ZINC000060372380 132304162 /nfs/dbraw/zinc/30/41/62/132304162.db2.gz RZKQDFYROFZAOV-UHFFFAOYSA-N 1 1 367.755 2.771 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H](C)[N@H+]1C ZINC000408170893 513013738 /nfs/dbraw/zinc/01/37/38/513013738.db2.gz WJINTNLNXACYOQ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000408170893 513013740 /nfs/dbraw/zinc/01/37/40/513013740.db2.gz WJINTNLNXACYOQ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@H]2C)c1[N+](=O)[O-] ZINC000373068274 512156196 /nfs/dbraw/zinc/15/61/96/512156196.db2.gz FEGRBZVMEYUVQO-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@H]2C)c1[N+](=O)[O-] ZINC000373068274 512156199 /nfs/dbraw/zinc/15/61/99/512156199.db2.gz FEGRBZVMEYUVQO-CQSZACIVSA-N 1 1 371.441 2.617 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](c2ccccc2)C1 ZINC000032313888 506241245 /nfs/dbraw/zinc/24/12/45/506241245.db2.gz RZSNWLFJHUURRB-KRWDZBQOSA-N 1 1 365.393 2.600 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](c2ccccc2)C1 ZINC000032313888 506241251 /nfs/dbraw/zinc/24/12/51/506241251.db2.gz RZSNWLFJHUURRB-KRWDZBQOSA-N 1 1 365.393 2.600 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2ccccc2)CC1 ZINC000032723371 506283951 /nfs/dbraw/zinc/28/39/51/506283951.db2.gz LPDTVSXNXXXJBW-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO CNC(=O)c1ccc(NCCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000053558654 506405479 /nfs/dbraw/zinc/40/54/79/506405479.db2.gz OXUUJMIJSFRAFO-UHFFFAOYSA-N 1 1 368.437 2.815 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000375350571 512280255 /nfs/dbraw/zinc/28/02/55/512280255.db2.gz XFIPMKVRAYPXBJ-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000041967153 506573930 /nfs/dbraw/zinc/57/39/30/506573930.db2.gz HXOZRAJDLMSHFJ-UHFFFAOYSA-N 1 1 351.447 2.590 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000054548130 506576448 /nfs/dbraw/zinc/57/64/48/506576448.db2.gz PUPDRQYNHLGWKR-STQMWFEESA-N 1 1 350.419 2.604 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](c3ccnc(N)n3)C2)ccc1[N+](=O)[O-] ZINC000366990969 512285418 /nfs/dbraw/zinc/28/54/18/512285418.db2.gz VVHTWLOPVSHRDS-AWEZNQCLSA-N 1 1 357.414 2.576 20 5 FFBDMO Cc1ccc(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000043148053 506708960 /nfs/dbraw/zinc/70/89/60/506708960.db2.gz KKIVHZADLCFMNF-ZIAGYGMSSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1c(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000043347437 506736663 /nfs/dbraw/zinc/73/66/63/506736663.db2.gz AZGYFPAOBAMYKB-STQMWFEESA-N 1 1 364.446 2.913 20 5 FFBDMO COc1ccc(CC[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000067309198 506824205 /nfs/dbraw/zinc/82/42/05/506824205.db2.gz HNEXUDAXTNVWRT-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO C[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000044491689 506850646 /nfs/dbraw/zinc/85/06/46/506850646.db2.gz OUHMKLSPOBTLST-JTQLQIEISA-N 1 1 351.453 2.894 20 5 FFBDMO C[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000044491689 506850656 /nfs/dbraw/zinc/85/06/56/506850656.db2.gz OUHMKLSPOBTLST-JTQLQIEISA-N 1 1 351.453 2.894 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NCC[N@H+]1CCc2ccccc2C1 ZINC000045076712 506914705 /nfs/dbraw/zinc/91/47/05/506914705.db2.gz VGDMEVBJYUUXSC-UHFFFAOYSA-N 1 1 368.437 2.571 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000056168277 506952939 /nfs/dbraw/zinc/95/29/39/506952939.db2.gz LMBOFUVLFJHPMG-WFASDCNBSA-N 1 1 372.400 2.881 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)c1 ZINC000067797274 507012553 /nfs/dbraw/zinc/01/25/53/507012553.db2.gz ZIAIQQZFMDSEJQ-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCOc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000015102543 507019746 /nfs/dbraw/zinc/01/97/46/507019746.db2.gz XYKDHEJWENOTSN-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCOc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000015102543 507019756 /nfs/dbraw/zinc/01/97/56/507019756.db2.gz XYKDHEJWENOTSN-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000068126791 507120766 /nfs/dbraw/zinc/12/07/66/507120766.db2.gz RGFWHCWBCGAQMP-LBPRGKRZSA-N 1 1 352.410 2.558 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)NCc1ccc([N+](=O)[O-])cc1 ZINC000057005313 507144447 /nfs/dbraw/zinc/14/44/47/507144447.db2.gz LHFUKQJPWBAMCZ-UHFFFAOYSA-N 1 1 368.437 2.842 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC000057348892 507244896 /nfs/dbraw/zinc/24/48/96/507244896.db2.gz NQNMGQUYQUGNBG-HNNXBMFYSA-N 1 1 352.394 2.923 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000022610965 507301765 /nfs/dbraw/zinc/30/17/65/507301765.db2.gz DPKLXXCSFFMACS-UHFFFAOYSA-N 1 1 353.422 2.872 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000069091052 507405017 /nfs/dbraw/zinc/40/50/17/507405017.db2.gz BQWYHWQQGUFGSW-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO COc1ccc(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000025634192 507517030 /nfs/dbraw/zinc/51/70/30/507517030.db2.gz PIKVUANGLSAJLL-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4nc(C5CC5)no4)C3)nc2c1 ZINC000375470703 512347316 /nfs/dbraw/zinc/34/73/16/512347316.db2.gz OUOIQIZYHSGMNX-LLVKDONJSA-N 1 1 355.354 2.986 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4nc(C5CC5)no4)C3)nc2c1 ZINC000375470703 512347319 /nfs/dbraw/zinc/34/73/19/512347319.db2.gz OUOIQIZYHSGMNX-LLVKDONJSA-N 1 1 355.354 2.986 20 5 FFBDMO Cc1ccc(C)c(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000026483433 507592082 /nfs/dbraw/zinc/59/20/82/507592082.db2.gz RDTAZZQKTQVDHW-UHFFFAOYSA-N 1 1 356.426 2.808 20 5 FFBDMO C[N@H+](CCOc1cccc(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373514 507650762 /nfs/dbraw/zinc/65/07/62/507650762.db2.gz JKAGRXQIIJRESR-UHFFFAOYSA-N 1 1 363.801 2.858 20 5 FFBDMO C[N@@H+](CCOc1cccc(Cl)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373514 507650766 /nfs/dbraw/zinc/65/07/66/507650766.db2.gz JKAGRXQIIJRESR-UHFFFAOYSA-N 1 1 363.801 2.858 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000028049767 507706921 /nfs/dbraw/zinc/70/69/21/507706921.db2.gz LRPSBJAMQDMWKY-UHFFFAOYSA-N 1 1 355.460 2.528 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000063483196 507736364 /nfs/dbraw/zinc/73/63/64/507736364.db2.gz GSDNUJYFUHSYFS-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000063483196 507736370 /nfs/dbraw/zinc/73/63/70/507736370.db2.gz GSDNUJYFUHSYFS-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOc1ccccc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051426303 507770198 /nfs/dbraw/zinc/77/01/98/507770198.db2.gz DUNNWAKVJIEYNG-KRWDZBQOSA-N 1 1 360.410 2.865 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1S(C)(=O)=O ZINC000089512711 507844438 /nfs/dbraw/zinc/84/44/38/507844438.db2.gz NOAGUJXZVOUGRB-GFCCVEGCSA-N 1 1 364.423 2.858 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](Cc3nccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004206 507900373 /nfs/dbraw/zinc/90/03/73/507900373.db2.gz NZCVAFPRVALXHZ-OAHLLOKOSA-N 1 1 374.441 2.670 20 5 FFBDMO Cc1ccc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000073304951 507912362 /nfs/dbraw/zinc/91/23/62/507912362.db2.gz QXVUNTBKRXLDRR-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO Cn1cccc1[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000073641888 507941593 /nfs/dbraw/zinc/94/15/93/507941593.db2.gz WWRCTXKNLFVVMV-KRWDZBQOSA-N 1 1 354.410 2.660 20 5 FFBDMO Cn1cccc1[C@@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000073641888 507941597 /nfs/dbraw/zinc/94/15/97/507941597.db2.gz WWRCTXKNLFVVMV-KRWDZBQOSA-N 1 1 354.410 2.660 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000110353427 508023250 /nfs/dbraw/zinc/02/32/50/508023250.db2.gz NZNVYASHWSGXEM-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+](CC(N)=O)CC(C)C)o2)c([N+](=O)[O-])c1 ZINC000092011600 508032846 /nfs/dbraw/zinc/03/28/46/508032846.db2.gz ZHPAVOUHTRPJMF-UHFFFAOYSA-N 1 1 361.398 2.807 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000110870483 508051855 /nfs/dbraw/zinc/05/18/55/508051855.db2.gz JMUBXJPRPLMVKZ-UHFFFAOYSA-N 1 1 373.457 2.646 20 5 FFBDMO O=C(NCCCCC[NH+]1CCCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000111039930 508066325 /nfs/dbraw/zinc/06/63/25/508066325.db2.gz XSOHLBQIFSYHIR-UHFFFAOYSA-N 1 1 359.430 2.857 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)C2 ZINC000080715122 508096912 /nfs/dbraw/zinc/09/69/12/508096912.db2.gz LMDTVVCAZMVRGV-MQVJKMGUSA-N 1 1 358.442 2.914 20 5 FFBDMO Cc1c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000080717917 508097690 /nfs/dbraw/zinc/09/76/90/508097690.db2.gz LJDSBFXCHZHQQN-YHWZYXNKSA-N 1 1 362.386 2.557 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000080959611 508117329 /nfs/dbraw/zinc/11/73/29/508117329.db2.gz AKDWPACILQYNDU-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO O=C(CN1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000080960606 508117758 /nfs/dbraw/zinc/11/77/58/508117758.db2.gz FKIXFGCXKWKVPR-LLVKDONJSA-N 1 1 363.805 2.789 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000075890498 508141470 /nfs/dbraw/zinc/14/14/70/508141470.db2.gz RVUJLTUVDUEBSB-GOSISDBHSA-N 1 1 363.458 2.679 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000093360915 508142529 /nfs/dbraw/zinc/14/25/29/508142529.db2.gz KIVSVJYDWSRQQQ-ZDUSSCGKSA-N 1 1 373.409 2.821 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1OC ZINC000093534464 508148432 /nfs/dbraw/zinc/14/84/32/508148432.db2.gz BGNCGWSNMSMHMG-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(N4CCCC4)nc3)C2)nc1 ZINC000093534387 508148577 /nfs/dbraw/zinc/14/85/77/508148577.db2.gz DBEAXHSHVDWARC-INIZCTEOSA-N 1 1 368.441 2.671 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081293432 508157680 /nfs/dbraw/zinc/15/76/80/508157680.db2.gz XQXDFOIRTYHXGF-INIZCTEOSA-N 1 1 361.442 2.744 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H](C[N@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000081631984 508199637 /nfs/dbraw/zinc/19/96/37/508199637.db2.gz PJMRTFCQDHBBQA-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000081631984 508199638 /nfs/dbraw/zinc/19/96/38/508199638.db2.gz PJMRTFCQDHBBQA-QGZVFWFLSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1ccccc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112654656 508205928 /nfs/dbraw/zinc/20/59/28/508205928.db2.gz BOFUMBBLBGSZQA-GJZGRUSLSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1ccccc1NC(=O)[C@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112654656 508205932 /nfs/dbraw/zinc/20/59/32/508205932.db2.gz BOFUMBBLBGSZQA-GJZGRUSLSA-N 1 1 369.425 2.812 20 5 FFBDMO CC(C)[C@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000112658255 508206408 /nfs/dbraw/zinc/20/64/08/508206408.db2.gz FXIKNICGZKXMMY-IBGZPJMESA-N 1 1 371.437 2.713 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486603 508213001 /nfs/dbraw/zinc/21/30/01/508213001.db2.gz VSCBCKWICVFMOP-ZBFHGGJFSA-N 1 1 371.441 2.583 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000076492408 508213382 /nfs/dbraw/zinc/21/33/82/508213382.db2.gz OHJAWPTUODUMSX-CJNGLKHVSA-N 1 1 351.472 2.876 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CCc2sccc2C1 ZINC000087168766 508340563 /nfs/dbraw/zinc/34/05/63/508340563.db2.gz HLIAISGTQNUZGQ-UHFFFAOYSA-N 1 1 359.451 2.763 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCc2sccc2C1 ZINC000087168766 508340566 /nfs/dbraw/zinc/34/05/66/508340566.db2.gz HLIAISGTQNUZGQ-UHFFFAOYSA-N 1 1 359.451 2.763 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000115519847 508405433 /nfs/dbraw/zinc/40/54/33/508405433.db2.gz MDRRMUXPDSOOCU-UHFFFAOYSA-N 1 1 372.263 2.640 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000121766292 508413666 /nfs/dbraw/zinc/41/36/66/508413666.db2.gz AMXWYLXBAYOXQI-LLVKDONJSA-N 1 1 368.231 2.571 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000121766440 508413678 /nfs/dbraw/zinc/41/36/78/508413678.db2.gz AMXWYLXBAYOXQI-NSHDSACASA-N 1 1 368.231 2.571 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)c1 ZINC000152280970 508415046 /nfs/dbraw/zinc/41/50/46/508415046.db2.gz KBNAVHRAMPMIFJ-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152280970 508415049 /nfs/dbraw/zinc/41/50/49/508415049.db2.gz KBNAVHRAMPMIFJ-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1 ZINC000152280970 508415053 /nfs/dbraw/zinc/41/50/53/508415053.db2.gz KBNAVHRAMPMIFJ-HOCLYGCPSA-N 1 1 357.414 2.503 20 5 FFBDMO CCC[C@H]1CN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000121795265 508420656 /nfs/dbraw/zinc/42/06/56/508420656.db2.gz MBRJACAAXVOYHZ-INIZCTEOSA-N 1 1 351.447 2.536 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000156620768 508451786 /nfs/dbraw/zinc/45/17/86/508451786.db2.gz CDVJBGKBCXQYCM-XJKSGUPXSA-N 1 1 371.441 2.521 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000156713640 508466330 /nfs/dbraw/zinc/46/63/30/508466330.db2.gz ZPETXEOFMMNZPV-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000152738029 508505510 /nfs/dbraw/zinc/50/55/10/508505510.db2.gz JGDWDJRHRYZJLL-INIZCTEOSA-N 1 1 358.442 2.753 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)[NH+](C)C ZINC000122397905 508528773 /nfs/dbraw/zinc/52/87/73/508528773.db2.gz GPAYDJNGZNWVLZ-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO CN(C(=O)C[N@@H+](C[C@H]1CCCO1)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000152967904 508534902 /nfs/dbraw/zinc/53/49/02/508534902.db2.gz CUFVSVQDHXGQGE-GOSISDBHSA-N 1 1 361.442 2.981 20 5 FFBDMO CN(C(=O)C[N@@H+](C[C@@H]1CCCO1)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000152967835 508535120 /nfs/dbraw/zinc/53/51/20/508535120.db2.gz CUFVSVQDHXGQGE-SFHVURJKSA-N 1 1 361.442 2.981 20 5 FFBDMO CCC[C@@H](NCCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000128085814 508545847 /nfs/dbraw/zinc/54/58/47/508545847.db2.gz QFLZIPXNGUPZHW-FUHWJXTLSA-N 1 1 362.474 2.613 20 5 FFBDMO CC[N@@H+](CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000116763597 508557429 /nfs/dbraw/zinc/55/74/29/508557429.db2.gz HZGXTGXYCPPWJY-UHFFFAOYSA-N 1 1 357.838 2.864 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000134918859 508575287 /nfs/dbraw/zinc/57/52/87/508575287.db2.gz SPTFVWARVUCHDM-GOEBONIOSA-N 1 1 369.421 2.996 20 5 FFBDMO O=C(C[NH+]1CCC(C2CCOCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000153578735 508601418 /nfs/dbraw/zinc/60/14/18/508601418.db2.gz AMXVVVRCWBSAFE-UHFFFAOYSA-N 1 1 373.453 2.623 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968671 508688839 /nfs/dbraw/zinc/68/88/39/508688839.db2.gz OXZJUFYRMICVNM-ROUUACIJSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968671 508688841 /nfs/dbraw/zinc/68/88/41/508688841.db2.gz OXZJUFYRMICVNM-ROUUACIJSA-N 1 1 373.453 2.763 20 5 FFBDMO O=C(CC[N@@H+]1CCOC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000375597032 512412431 /nfs/dbraw/zinc/41/24/31/512412431.db2.gz JMXSMAFECXJRKF-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000375597032 512412434 /nfs/dbraw/zinc/41/24/34/512412434.db2.gz JMXSMAFECXJRKF-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000154086293 508713899 /nfs/dbraw/zinc/71/38/99/508713899.db2.gz DTQKPJAORGWDIM-ZBFHGGJFSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000136985977 508730126 /nfs/dbraw/zinc/73/01/26/508730126.db2.gz MISDRGJQTNXAOT-ZBFHGGJFSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000136985977 508730131 /nfs/dbraw/zinc/73/01/31/508730131.db2.gz MISDRGJQTNXAOT-ZBFHGGJFSA-N 1 1 365.430 2.617 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000137507161 508758002 /nfs/dbraw/zinc/75/80/02/508758002.db2.gz QWMWUBHEIMJBLQ-UKRRQHHQSA-N 1 1 371.441 2.663 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137527409 508759110 /nfs/dbraw/zinc/75/91/10/508759110.db2.gz AGYDHZJKODIEMD-QAPCUYQASA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000123977783 508766392 /nfs/dbraw/zinc/76/63/92/508766392.db2.gz GICDPHFVCUAYNX-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1Br ZINC000119476463 508803235 /nfs/dbraw/zinc/80/32/35/508803235.db2.gz IMEAKYDXKDLWFJ-JTQLQIEISA-N 1 1 368.231 2.571 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000144317224 508837178 /nfs/dbraw/zinc/83/71/78/508837178.db2.gz BKVSKLKRIXHOCY-SNVBAGLBSA-N 1 1 373.331 2.502 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000119677202 508841957 /nfs/dbraw/zinc/84/19/57/508841957.db2.gz UYOOUKDRAJTEKV-BEFAXECRSA-N 1 1 369.421 2.610 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000131116377 508889789 /nfs/dbraw/zinc/88/97/89/508889789.db2.gz PURLVOVOLNCZFX-AWEZNQCLSA-N 1 1 356.426 2.752 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000155082956 508919254 /nfs/dbraw/zinc/91/92/54/508919254.db2.gz SUNBLNHTUSFDNZ-QAPCUYQASA-N 1 1 360.458 2.730 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3[C@H](C)C[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000155287666 508967904 /nfs/dbraw/zinc/96/79/04/508967904.db2.gz WGMPRIVJHRMKPO-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3[C@H](C)C[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000155287666 508967906 /nfs/dbraw/zinc/96/79/06/508967906.db2.gz WGMPRIVJHRMKPO-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000160699741 509021908 /nfs/dbraw/zinc/02/19/08/509021908.db2.gz GIHHPMAPXBKZJJ-GFCCVEGCSA-N 1 1 356.220 2.571 20 5 FFBDMO O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)Nc1cccc([N+](=O)[O-])c1 ZINC000151546057 509040782 /nfs/dbraw/zinc/04/07/82/509040782.db2.gz PVYCDZPYCSCHOI-GOSISDBHSA-N 1 1 355.394 2.824 20 5 FFBDMO O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)Nc1cccc([N+](=O)[O-])c1 ZINC000151546057 509040785 /nfs/dbraw/zinc/04/07/85/509040785.db2.gz PVYCDZPYCSCHOI-GOSISDBHSA-N 1 1 355.394 2.824 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000126127085 509065399 /nfs/dbraw/zinc/06/53/99/509065399.db2.gz XBFQCQFMSFUGFT-MRXNPFEDSA-N 1 1 360.458 2.783 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000121007194 509108127 /nfs/dbraw/zinc/10/81/27/509108127.db2.gz AQQSGDRHZLQPAI-GWCFXTLKSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000156054568 509117906 /nfs/dbraw/zinc/11/79/06/509117906.db2.gz RMYBAGITEGPTSQ-INIZCTEOSA-N 1 1 364.446 2.772 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCSC1 ZINC000121159227 509141581 /nfs/dbraw/zinc/14/15/81/509141581.db2.gz MRHYOICRBYSOMX-SNVBAGLBSA-N 1 1 374.260 2.733 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCSC1 ZINC000121159227 509141585 /nfs/dbraw/zinc/14/15/85/509141585.db2.gz MRHYOICRBYSOMX-SNVBAGLBSA-N 1 1 374.260 2.733 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000185493316 509203673 /nfs/dbraw/zinc/20/36/73/509203673.db2.gz ICUSCWJVCUCTDD-GFCCVEGCSA-N 1 1 360.439 2.638 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172831496 509260397 /nfs/dbraw/zinc/26/03/97/509260397.db2.gz CCRCEJKFRBYMPV-OAHLLOKOSA-N 1 1 371.441 2.727 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000266944796 509270802 /nfs/dbraw/zinc/27/08/02/509270802.db2.gz SIDKHURHZWKAPR-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000179122029 509273409 /nfs/dbraw/zinc/27/34/09/509273409.db2.gz SUMCGIJVVPVERK-AWEZNQCLSA-N 1 1 359.382 2.820 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)C(C)C)cc1SC ZINC000264056664 509308780 /nfs/dbraw/zinc/30/87/80/509308780.db2.gz CAIMFBILUMAORL-UHFFFAOYSA-N 1 1 355.460 2.785 20 5 FFBDMO C[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000185697386 509310899 /nfs/dbraw/zinc/31/08/99/509310899.db2.gz ZUKWNLUWLYRZKR-LSDHHAIUSA-N 1 1 360.458 2.776 20 5 FFBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000248472219 509336620 /nfs/dbraw/zinc/33/66/20/509336620.db2.gz WAMOLBFHFJLFSY-WBVHZDCISA-N 1 1 357.410 2.875 20 5 FFBDMO CCOC(=O)C[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000182672709 509362832 /nfs/dbraw/zinc/36/28/32/509362832.db2.gz ZHGKZLSGISNYOV-ZDUSSCGKSA-N 1 1 351.403 2.505 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccc(C(F)(F)F)c3)CC2)n1 ZINC000176190406 509368584 /nfs/dbraw/zinc/36/85/84/509368584.db2.gz AVJYIGGEBVJZRL-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)CCO1 ZINC000163420104 509374829 /nfs/dbraw/zinc/37/48/29/509374829.db2.gz ZHEYENUVIQEZRU-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO CCC[N@@H+]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236810084 509508702 /nfs/dbraw/zinc/50/87/02/509508702.db2.gz CYFKHYCLJLOUJM-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236810084 509508707 /nfs/dbraw/zinc/50/87/07/509508707.db2.gz CYFKHYCLJLOUJM-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179880239 509658077 /nfs/dbraw/zinc/65/80/77/509658077.db2.gz HWVFKGMVRIWHDC-CYBMUJFWSA-N 1 1 374.384 2.984 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000173598911 509668135 /nfs/dbraw/zinc/66/81/35/509668135.db2.gz QELPZMXCFXLOMK-CQSZACIVSA-N 1 1 356.426 2.939 20 5 FFBDMO COc1ccc(OC)c([C@@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193050771 509755353 /nfs/dbraw/zinc/75/53/53/509755353.db2.gz BYKQOHPAXDWLIG-CYBMUJFWSA-N 1 1 373.409 2.926 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000268186529 509802992 /nfs/dbraw/zinc/80/29/92/509802992.db2.gz WCQPBZVYHTYZJF-YPMHNXCESA-N 1 1 354.838 2.872 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000176994399 509807020 /nfs/dbraw/zinc/80/70/20/509807020.db2.gz UCJVLNLSSKNFSA-UHFFFAOYSA-N 1 1 361.442 2.841 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000268510966 509979467 /nfs/dbraw/zinc/97/94/67/509979467.db2.gz WOQUWPXJLMZBJK-SECBINFHSA-N 1 1 352.192 2.859 20 5 FFBDMO CC(C)(CNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000180709466 510065439 /nfs/dbraw/zinc/06/54/39/510065439.db2.gz AVIKDANXQBWZEZ-UHFFFAOYSA-N 1 1 368.437 2.744 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)Nc1ccncc1[N+](=O)[O-] ZINC000193874799 510109919 /nfs/dbraw/zinc/10/99/19/510109919.db2.gz NVGZTFVBZWGRBW-OAHLLOKOSA-N 1 1 355.398 2.633 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000245727719 510111316 /nfs/dbraw/zinc/11/13/16/510111316.db2.gz DWEBMEDYAGHEMA-TZMCWYRMSA-N 1 1 360.382 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@@H]3COCC[C@H]32)c1 ZINC000245727719 510111319 /nfs/dbraw/zinc/11/13/19/510111319.db2.gz DWEBMEDYAGHEMA-TZMCWYRMSA-N 1 1 360.382 2.903 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190466046 510146864 /nfs/dbraw/zinc/14/68/64/510146864.db2.gz PAGILDLQDKQPTD-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000180901292 510172765 /nfs/dbraw/zinc/17/27/65/510172765.db2.gz WANDDPSJVCAKDR-GFCCVEGCSA-N 1 1 363.414 2.564 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194013463 510174912 /nfs/dbraw/zinc/17/49/12/510174912.db2.gz UURJSBMBEHTZGR-LBPRGKRZSA-N 1 1 351.359 2.667 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194013463 510174921 /nfs/dbraw/zinc/17/49/21/510174921.db2.gz UURJSBMBEHTZGR-LBPRGKRZSA-N 1 1 351.359 2.667 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000177801543 510260044 /nfs/dbraw/zinc/26/00/44/510260044.db2.gz QJTUSRHTDMDTRK-CVEARBPZSA-N 1 1 358.442 2.868 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccccc2Cl)c1 ZINC000174740425 510285338 /nfs/dbraw/zinc/28/53/38/510285338.db2.gz JPGQVJPDOLUNSU-BBRMVZONSA-N 1 1 350.806 2.643 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccccc2NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000187518889 510311486 /nfs/dbraw/zinc/31/14/86/510311486.db2.gz ZQOYHSGKRSNSNM-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246192160 510351361 /nfs/dbraw/zinc/35/13/61/510351361.db2.gz UIOHIAQFRDTFHP-OLZOCXBDSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181384243 510382710 /nfs/dbraw/zinc/38/27/10/510382710.db2.gz HEQBQSQEXSRFFN-GFCCVEGCSA-N 1 1 352.387 2.858 20 5 FFBDMO CNC(=O)CC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000175021812 510441007 /nfs/dbraw/zinc/44/10/07/510441007.db2.gz NTZVSUAASBXTND-LBPRGKRZSA-N 1 1 373.413 2.554 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000178164490 510465685 /nfs/dbraw/zinc/46/56/85/510465685.db2.gz MCBWLWSWMAIHFV-HNNXBMFYSA-N 1 1 354.410 2.571 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606569 510481247 /nfs/dbraw/zinc/48/12/47/510481247.db2.gz QHLOSAZHFDPERQ-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606569 510481251 /nfs/dbraw/zinc/48/12/51/510481251.db2.gz QHLOSAZHFDPERQ-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269606569 510481258 /nfs/dbraw/zinc/48/12/58/510481258.db2.gz QHLOSAZHFDPERQ-HNNXBMFYSA-N 1 1 371.441 2.788 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc1)[NH+]1CCOCC1 ZINC000178194047 510483087 /nfs/dbraw/zinc/48/30/87/510483087.db2.gz QLKULJCMGKFYRD-ZDUSSCGKSA-N 1 1 370.409 2.823 20 5 FFBDMO CN(C)c1noc([C@H]2CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000194928846 510594763 /nfs/dbraw/zinc/59/47/63/510594763.db2.gz GDOHAWULFYCOEM-PXTSUWAFSA-N 1 1 357.414 2.937 20 5 FFBDMO CN(C)c1noc([C@@H]2CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000194928831 510595179 /nfs/dbraw/zinc/59/51/79/510595179.db2.gz GDOHAWULFYCOEM-SBJJXXPASA-N 1 1 357.414 2.937 20 5 FFBDMO C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000246692275 510620310 /nfs/dbraw/zinc/62/03/10/510620310.db2.gz JPBTZHVVUBAOGU-CVEARBPZSA-N 1 1 363.461 2.915 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000246692275 510620313 /nfs/dbraw/zinc/62/03/13/510620313.db2.gz JPBTZHVVUBAOGU-CVEARBPZSA-N 1 1 363.461 2.915 20 5 FFBDMO C[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000181884116 510640081 /nfs/dbraw/zinc/64/00/81/510640081.db2.gz ADNWJXGLHOOMJL-GOSISDBHSA-N 1 1 374.462 2.858 20 5 FFBDMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000181884116 510640089 /nfs/dbraw/zinc/64/00/89/510640089.db2.gz ADNWJXGLHOOMJL-GOSISDBHSA-N 1 1 374.462 2.858 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC000178577410 510671757 /nfs/dbraw/zinc/67/17/57/510671757.db2.gz IBRLIRPYGIHSIH-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188280843 510686927 /nfs/dbraw/zinc/68/69/27/510686927.db2.gz DEUCYHUQCXSIIG-HXUWFJFHSA-N 1 1 355.438 2.664 20 5 FFBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000188294600 510693722 /nfs/dbraw/zinc/69/37/22/510693722.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188294600 510693726 /nfs/dbraw/zinc/69/37/26/510693726.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1ccc([N+](=O)[O-])cc1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188294600 510693733 /nfs/dbraw/zinc/69/37/33/510693733.db2.gz VWAKRLKPMDSNCZ-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO Cc1ccc(NCCCNC(=O)CCNc2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000172400935 510709051 /nfs/dbraw/zinc/70/90/51/510709051.db2.gz PIBZJQAHUSQVHJ-UHFFFAOYSA-N 1 1 357.414 2.719 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000185298452 510795215 /nfs/dbraw/zinc/79/52/15/510795215.db2.gz LNEGVGVUBPTELS-LJQANCHMSA-N 1 1 368.437 2.939 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000247032404 510809758 /nfs/dbraw/zinc/80/97/58/510809758.db2.gz ZVUUJJYWPSQMHX-IEBWSBKVSA-N 1 1 371.437 2.911 20 5 FFBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000247071009 510825180 /nfs/dbraw/zinc/82/51/80/510825180.db2.gz IWOGOPDOCXJNGW-GOEBONIOSA-N 1 1 360.458 2.654 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2CCCc2ccccc2)c1 ZINC000247342018 510857834 /nfs/dbraw/zinc/85/78/34/510857834.db2.gz XPQLDRBKMVNVKR-IEBWSBKVSA-N 1 1 358.442 2.640 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000360321068 510896032 /nfs/dbraw/zinc/89/60/32/510896032.db2.gz BPOZYCVWOUNEFB-HNNXBMFYSA-N 1 1 370.409 2.502 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000360321068 510896038 /nfs/dbraw/zinc/89/60/38/510896038.db2.gz BPOZYCVWOUNEFB-HNNXBMFYSA-N 1 1 370.409 2.502 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCc2sccc2C1 ZINC000282461911 510988921 /nfs/dbraw/zinc/98/89/21/510988921.db2.gz MYPKDDGTGFDOCE-UHFFFAOYSA-N 1 1 359.451 2.716 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCc2sccc2C1 ZINC000282461911 510988927 /nfs/dbraw/zinc/98/89/27/510988927.db2.gz MYPKDDGTGFDOCE-UHFFFAOYSA-N 1 1 359.451 2.716 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000282528098 511013566 /nfs/dbraw/zinc/01/35/66/511013566.db2.gz UQQRQBLDISEAGO-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000282528098 511013570 /nfs/dbraw/zinc/01/35/70/511013570.db2.gz UQQRQBLDISEAGO-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)C2)C1 ZINC000294372812 511042819 /nfs/dbraw/zinc/04/28/19/511042819.db2.gz ZMWQYUFARXSWCG-IBGZPJMESA-N 1 1 358.442 2.727 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000279408200 511073279 /nfs/dbraw/zinc/07/32/79/511073279.db2.gz XBLXCHDOPRWBKL-ZYHUDNBSSA-N 1 1 357.813 2.871 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2SCCOC)CC1 ZINC000271096748 511081753 /nfs/dbraw/zinc/08/17/53/511081753.db2.gz WDTLMHZIQZNSSP-UHFFFAOYSA-N 1 1 367.471 2.501 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294593245 511113816 /nfs/dbraw/zinc/11/38/16/511113816.db2.gz QSJUATDPTCRGAM-JTQLQIEISA-N 1 1 357.332 2.828 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000279683101 511175879 /nfs/dbraw/zinc/17/58/79/511175879.db2.gz AOOFZRIUNKMCQG-ABAIWWIYSA-N 1 1 369.824 2.873 20 5 FFBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)n[nH]1 ZINC000271585843 511254778 /nfs/dbraw/zinc/25/47/78/511254778.db2.gz DPTFIIPILFZWIY-UHFFFAOYSA-N 1 1 358.398 2.872 20 5 FFBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)[nH]n1 ZINC000271585843 511254785 /nfs/dbraw/zinc/25/47/85/511254785.db2.gz DPTFIIPILFZWIY-UHFFFAOYSA-N 1 1 358.398 2.872 20 5 FFBDMO Cc1cccnc1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000295115336 511287520 /nfs/dbraw/zinc/28/75/20/511287520.db2.gz WPYFOSXBNXVRRR-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291678542 511294493 /nfs/dbraw/zinc/29/44/93/511294493.db2.gz CCGRDFZDNIAUAR-CJNGLKHVSA-N 1 1 354.410 2.570 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](C)(O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000280096576 511334170 /nfs/dbraw/zinc/33/41/70/511334170.db2.gz OULBBORONVCRMF-KRWDZBQOSA-N 1 1 374.384 2.984 20 5 FFBDMO CN1CC[NH+](CCCNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000298775738 511407222 /nfs/dbraw/zinc/40/72/22/511407222.db2.gz FYOGJYUCTOUSLV-UHFFFAOYSA-N 1 1 362.477 2.755 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292058710 511448926 /nfs/dbraw/zinc/44/89/26/511448926.db2.gz BMTHXDYRJZGVAW-LSDHHAIUSA-N 1 1 360.458 2.728 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000295596110 511455395 /nfs/dbraw/zinc/45/53/95/511455395.db2.gz MQQRKZDHJZIJCL-LJQANCHMSA-N 1 1 359.426 2.502 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)C2)C1 ZINC000292106807 511467920 /nfs/dbraw/zinc/46/79/20/511467920.db2.gz IOXSROHFCFGVOS-OAHLLOKOSA-N 1 1 354.248 2.885 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292177833 511494610 /nfs/dbraw/zinc/49/46/10/511494610.db2.gz FCFRFFZZVNAQOS-KRWDZBQOSA-N 1 1 366.849 2.528 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000292556908 511642083 /nfs/dbraw/zinc/64/20/83/511642083.db2.gz XRLQPALCEKWILU-FUHWJXTLSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000292556908 511642085 /nfs/dbraw/zinc/64/20/85/511642085.db2.gz XRLQPALCEKWILU-FUHWJXTLSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000281157866 511741594 /nfs/dbraw/zinc/74/15/94/511741594.db2.gz CHELTEWVFGWGKW-HOTGVXAUSA-N 1 1 363.458 2.861 20 5 FFBDMO Cc1nc(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)ccc1[N+](=O)[O-] ZINC000284563796 511773363 /nfs/dbraw/zinc/77/33/63/511773363.db2.gz GDNJQMPREIKURF-KBXCAEBGSA-N 1 1 358.446 2.551 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)c1 ZINC000350338570 511782152 /nfs/dbraw/zinc/78/21/52/511782152.db2.gz JQMHROLUCRMZET-YJBOKZPZSA-N 1 1 374.397 2.969 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)n1 ZINC000312597579 511785897 /nfs/dbraw/zinc/78/58/97/511785897.db2.gz FIHSRZPESIZCOC-DZGCQCFKSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313072430 511787945 /nfs/dbraw/zinc/78/79/45/511787945.db2.gz VPYPMRJWGUBJNJ-GDBMZVCRSA-N 1 1 368.437 2.817 20 5 FFBDMO CCC(=O)c1ccc(N2CC[N@H+](C3CCOCC3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000281433444 511845864 /nfs/dbraw/zinc/84/58/64/511845864.db2.gz JNIRBJNTYUIFIB-CQSZACIVSA-N 1 1 361.442 2.877 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000366198521 511895952 /nfs/dbraw/zinc/89/59/52/511895952.db2.gz VFHPDRTWFUQDCD-INIZCTEOSA-N 1 1 354.410 2.632 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000364060077 511936350 /nfs/dbraw/zinc/93/63/50/511936350.db2.gz KOSYAPMQVMJUBH-QGZVFWFLSA-N 1 1 372.469 2.895 20 5 FFBDMO NC(=O)c1ccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c([N+](=O)[O-])c1 ZINC000281780929 511965012 /nfs/dbraw/zinc/96/50/12/511965012.db2.gz DVDSLFHWSMLRKJ-CQSZACIVSA-N 1 1 369.425 2.611 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(-c3ccccc3C[NH+]3CCOCC3)n2)o1 ZINC000351142225 511965253 /nfs/dbraw/zinc/96/52/53/511965253.db2.gz DNAFZHATGXZUPN-UHFFFAOYSA-N 1 1 356.338 2.737 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000411419844 512628094 /nfs/dbraw/zinc/62/80/94/512628094.db2.gz PJVYOAXWXWGYDR-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000411419844 512628099 /nfs/dbraw/zinc/62/80/99/512628099.db2.gz PJVYOAXWXWGYDR-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000411419844 512628104 /nfs/dbraw/zinc/62/81/04/512628104.db2.gz PJVYOAXWXWGYDR-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@@H]1CCO ZINC000411706577 512770832 /nfs/dbraw/zinc/77/08/32/512770832.db2.gz XRISDWQHKPBDLC-CQSZACIVSA-N 1 1 365.430 2.559 20 5 FFBDMO CNc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000380467297 512873287 /nfs/dbraw/zinc/87/32/87/512873287.db2.gz QGUCLXUUMAPSQZ-QGZVFWFLSA-N 1 1 368.437 2.983 20 5 FFBDMO Cc1nnc([C@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)[nH]1 ZINC000412041365 512925950 /nfs/dbraw/zinc/92/59/50/512925950.db2.gz MQCSJAVKHJNDTI-AWEZNQCLSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1n[nH]c([C@H]2CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000412041365 512925953 /nfs/dbraw/zinc/92/59/53/512925953.db2.gz MQCSJAVKHJNDTI-AWEZNQCLSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1n[nH]c([C@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000412041365 512925956 /nfs/dbraw/zinc/92/59/56/512925956.db2.gz MQCSJAVKHJNDTI-AWEZNQCLSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1nc([C@H]2CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n[nH]1 ZINC000412041365 512925958 /nfs/dbraw/zinc/92/59/58/512925958.db2.gz MQCSJAVKHJNDTI-AWEZNQCLSA-N 1 1 368.397 2.708 20 5 FFBDMO Cc1nc([C@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n[nH]1 ZINC000412041365 512925960 /nfs/dbraw/zinc/92/59/60/512925960.db2.gz MQCSJAVKHJNDTI-AWEZNQCLSA-N 1 1 368.397 2.708 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412059484 512936764 /nfs/dbraw/zinc/93/67/64/512936764.db2.gz CMANAABZGOXUGT-SFHVURJKSA-N 1 1 363.414 2.507 20 5 FFBDMO O=C(CC[N@H+]1CCOCC2(CCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000370444589 512938374 /nfs/dbraw/zinc/93/83/74/512938374.db2.gz MNZKMJNMBUVNIW-UHFFFAOYSA-N 1 1 351.378 2.565 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075630 512994940 /nfs/dbraw/zinc/99/49/40/512994940.db2.gz ZQSCELOCRODPTN-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000408075630 512994947 /nfs/dbraw/zinc/99/49/47/512994947.db2.gz ZQSCELOCRODPTN-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C3CCOCC3)C2)c([N+](=O)[O-])cc1OC ZINC000370722209 513069923 /nfs/dbraw/zinc/06/99/23/513069923.db2.gz SGHPPXFKXZSJKB-CQSZACIVSA-N 1 1 350.415 2.861 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2OCC)C1 ZINC000439883652 513203731 /nfs/dbraw/zinc/20/37/31/513203731.db2.gz PVYIJTMXTQJAQM-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H](C)C1 ZINC000450459020 513204308 /nfs/dbraw/zinc/20/43/08/513204308.db2.gz VTXBGMDCMNBDQZ-STQMWFEESA-N 1 1 362.455 2.610 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](O)CO ZINC000421410200 513253401 /nfs/dbraw/zinc/25/34/01/513253401.db2.gz OUQQRPDBTGXFLO-CYBMUJFWSA-N 1 1 350.440 2.887 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000429012728 513253511 /nfs/dbraw/zinc/25/35/11/513253511.db2.gz VBJJGKZGCYJVBE-CPUCHLNUSA-N 1 1 371.441 2.807 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429024027 513259597 /nfs/dbraw/zinc/25/95/97/513259597.db2.gz GKGYHMQRHGBYCR-JLJPHGGASA-N 1 1 360.458 2.504 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000429046937 513268397 /nfs/dbraw/zinc/26/83/97/513268397.db2.gz XZRLEYMNYUZBCT-YQQAZPJKSA-N 1 1 363.458 2.644 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000418103852 513373834 /nfs/dbraw/zinc/37/38/34/513373834.db2.gz JQNWRFLYYKRYDL-MRXNPFEDSA-N 1 1 372.377 2.508 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)CC2)CCO1 ZINC000413073870 513426909 /nfs/dbraw/zinc/42/69/09/513426909.db2.gz IUAIADYQSGHWRD-LLVKDONJSA-N 1 1 374.363 2.698 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)N1CCCC1 ZINC000435055928 513500094 /nfs/dbraw/zinc/50/00/94/513500094.db2.gz DOACJJKDYDLOMI-CYBMUJFWSA-N 1 1 358.398 2.570 20 5 FFBDMO O=C([C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)N1CCCC1 ZINC000435055928 513500103 /nfs/dbraw/zinc/50/01/03/513500103.db2.gz DOACJJKDYDLOMI-CYBMUJFWSA-N 1 1 358.398 2.570 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441193833 513509848 /nfs/dbraw/zinc/50/98/48/513509848.db2.gz IAIWETVOMLRVAV-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000441285140 513530191 /nfs/dbraw/zinc/53/01/91/513530191.db2.gz YDDVSBAZDRSZPW-QWHCGFSZSA-N 1 1 366.849 2.796 20 5 FFBDMO COCCC[N@@H+](CCOC)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425401791 513547195 /nfs/dbraw/zinc/54/71/95/513547195.db2.gz FJVKXMNFHAGAAW-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H](n4ccnn4)C3)co2)cc1 ZINC000425506464 513608075 /nfs/dbraw/zinc/60/80/75/513608075.db2.gz LKQWLJJWCZNRJK-INIZCTEOSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](n4ccnn4)C3)co2)cc1 ZINC000425506464 513608080 /nfs/dbraw/zinc/60/80/80/513608080.db2.gz LKQWLJJWCZNRJK-INIZCTEOSA-N 1 1 354.370 2.678 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC000425631743 513670916 /nfs/dbraw/zinc/67/09/16/513670916.db2.gz BYSHJHRWMXAXOP-GXFFZTMASA-N 1 1 370.356 2.754 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451342294 513688415 /nfs/dbraw/zinc/68/84/15/513688415.db2.gz MKJQLUNJDGLUNP-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO CNC(=O)c1ccc(N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000413539040 513705114 /nfs/dbraw/zinc/70/51/14/513705114.db2.gz YLEHCBDCAKPNQA-HNNXBMFYSA-N 1 1 368.437 2.665 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](Oc3ccccc3)C2)c1 ZINC000419311418 513771992 /nfs/dbraw/zinc/77/19/92/513771992.db2.gz CWQQAUXEAIFCSC-FXAWDEMLSA-N 1 1 372.421 2.878 20 5 FFBDMO COc1cc(CN2CCC([C@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000430935359 513785333 /nfs/dbraw/zinc/78/53/33/513785333.db2.gz PSFOOMAPZWFJCE-JTQLQIEISA-N 1 1 359.373 2.764 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCSC[C@H]1C1CCC1 ZINC000419375387 513791332 /nfs/dbraw/zinc/79/13/32/513791332.db2.gz QLKWRPRVJPFHIR-HOCLYGCPSA-N 1 1 352.456 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@H]3CCCS(=O)(=O)C3)C2)cc1 ZINC000451551210 513827187 /nfs/dbraw/zinc/82/71/87/513827187.db2.gz TWGUDNAGOYWUIQ-GDBMZVCRSA-N 1 1 352.456 2.599 20 5 FFBDMO CCOCC[N@@H+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@H]1C ZINC000436385157 513842365 /nfs/dbraw/zinc/84/23/65/513842365.db2.gz FRVYPLIANGQXGI-LLVKDONJSA-N 1 1 362.352 2.556 20 5 FFBDMO CCOCC[N@H+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@H]1C ZINC000436385157 513842370 /nfs/dbraw/zinc/84/23/70/513842370.db2.gz FRVYPLIANGQXGI-LLVKDONJSA-N 1 1 362.352 2.556 20 5 FFBDMO C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448703566 513854338 /nfs/dbraw/zinc/85/43/38/513854338.db2.gz BYEXIWITJSVDGP-CABCVRRESA-N 1 1 361.442 2.794 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCC[C@H](C)C1 ZINC000448706583 513857020 /nfs/dbraw/zinc/85/70/20/513857020.db2.gz ZIGMNKISNLXKOM-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000426269210 513891227 /nfs/dbraw/zinc/89/12/27/513891227.db2.gz FLHCNXDTAFIRQD-LLVKDONJSA-N 1 1 374.363 2.849 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000451690949 513911998 /nfs/dbraw/zinc/91/19/98/513911998.db2.gz ARPFUZJBYWCGBP-XUWVNRHRSA-N 1 1 361.442 2.713 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000426889824 514068241 /nfs/dbraw/zinc/06/82/41/514068241.db2.gz OWLRKTMWIAORAP-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420344288 514102729 /nfs/dbraw/zinc/10/27/29/514102729.db2.gz SNZJELLNLMEZPY-ARFHVFGLSA-N 1 1 360.458 2.552 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000432193678 514123056 /nfs/dbraw/zinc/12/30/56/514123056.db2.gz WRZPZZHQCOLBQO-MRXNPFEDSA-N 1 1 363.458 2.766 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1c1ccccc1 ZINC000452007829 514130421 /nfs/dbraw/zinc/13/04/21/514130421.db2.gz RMIQNYZRBPAJDX-DLBZAZTESA-N 1 1 370.405 2.992 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1c1ccccc1 ZINC000452007834 514131348 /nfs/dbraw/zinc/13/13/48/514131348.db2.gz RMIQNYZRBPAJDX-IRXDYDNUSA-N 1 1 370.405 2.992 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]1[NH2+]CCc2ccccc21 ZINC000423431318 514140748 /nfs/dbraw/zinc/14/07/48/514140748.db2.gz QJRMJGWVOOYDCS-LIRRHRJNSA-N 1 1 368.437 2.789 20 5 FFBDMO CC(C)(C)[C@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000420454111 514152827 /nfs/dbraw/zinc/15/28/27/514152827.db2.gz VSRVXXLKBYLBGH-JTQLQIEISA-N 1 1 370.258 2.553 20 5 FFBDMO C[C@]12C[N@@H+](CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000452041579 514156220 /nfs/dbraw/zinc/15/62/20/514156220.db2.gz JTCQTRAYJFRDOR-RJAOAUJVSA-N 1 1 373.409 2.630 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559718 514180183 /nfs/dbraw/zinc/18/01/83/514180183.db2.gz PLAGVGZQYPHOBL-OXQOHEQNSA-N 1 1 371.437 2.538 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559718 514180185 /nfs/dbraw/zinc/18/01/85/514180185.db2.gz PLAGVGZQYPHOBL-OXQOHEQNSA-N 1 1 371.437 2.538 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000427357025 514192925 /nfs/dbraw/zinc/19/29/25/514192925.db2.gz KQKUPZXHXIIODL-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000427369805 514195429 /nfs/dbraw/zinc/19/54/29/514195429.db2.gz KVOPLQJVLPTLGJ-CABCVRRESA-N 1 1 371.441 2.546 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000427369805 514195435 /nfs/dbraw/zinc/19/54/35/514195435.db2.gz KVOPLQJVLPTLGJ-CABCVRRESA-N 1 1 371.441 2.546 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cc1[N+](=O)[O-] ZINC000449452307 514215853 /nfs/dbraw/zinc/21/58/53/514215853.db2.gz UHIKSMVXWOIAMV-ASKKUZCQSA-N 1 1 372.421 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c2c(c1)COCO2 ZINC000449455049 514215988 /nfs/dbraw/zinc/21/59/88/514215988.db2.gz QEBYSMRJMBFYSK-KSZLIROESA-N 1 1 362.426 2.977 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000444444963 514231066 /nfs/dbraw/zinc/23/10/66/514231066.db2.gz GEBCQPSKLWESIQ-SNVBAGLBSA-N 1 1 354.370 2.611 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000452181764 514236167 /nfs/dbraw/zinc/23/61/67/514236167.db2.gz JPGIVEWQERUMPZ-JTOWHCCKSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000452181764 514236174 /nfs/dbraw/zinc/23/61/74/514236174.db2.gz JPGIVEWQERUMPZ-JTOWHCCKSA-N 1 1 363.458 2.906 20 5 FFBDMO C[C@@H]1C[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn21 ZINC000449575627 514260203 /nfs/dbraw/zinc/26/02/03/514260203.db2.gz YKFRZCHVHMFVQJ-WBMJQRKESA-N 1 1 352.398 2.987 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714800 514302142 /nfs/dbraw/zinc/30/21/42/514302142.db2.gz FFOGYDJAUAXLSD-BXUZGUMPSA-N 1 1 357.332 2.974 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714800 514302149 /nfs/dbraw/zinc/30/21/49/514302149.db2.gz FFOGYDJAUAXLSD-BXUZGUMPSA-N 1 1 357.332 2.974 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N[C@@H](C[NH+]3CCOCC3)c3ccccc3)nc2c1 ZINC000427981437 514365584 /nfs/dbraw/zinc/36/55/84/514365584.db2.gz CZHBFDBQKRHRNB-SFHVURJKSA-N 1 1 367.409 2.957 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@H](O)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000433073328 514371999 /nfs/dbraw/zinc/37/19/99/514371999.db2.gz FPXFFHUFYWYMKA-MRXNPFEDSA-N 1 1 360.410 2.518 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000428227134 514425622 /nfs/dbraw/zinc/42/56/22/514425622.db2.gz JCACDVNXHIVQIF-GOSISDBHSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000428227134 514425628 /nfs/dbraw/zinc/42/56/28/514425628.db2.gz JCACDVNXHIVQIF-GOSISDBHSA-N 1 1 371.462 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+](CCO)[C@@H]3CCCSC3)co2)cc1 ZINC000439001869 514481763 /nfs/dbraw/zinc/48/17/63/514481763.db2.gz FEAJMWWIOFNJJU-MRXNPFEDSA-N 1 1 363.439 2.940 20 5 FFBDMO Cn1c(C(=O)N2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000461434745 514617123 /nfs/dbraw/zinc/61/71/23/514617123.db2.gz ZCIHLPUNTABPJA-SJORKVTESA-N 1 1 368.437 2.527 20 5 FFBDMO COc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000475322092 514618157 /nfs/dbraw/zinc/61/81/57/514618157.db2.gz ZLPGCZZRRRIZPX-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475319787 514618634 /nfs/dbraw/zinc/61/86/34/514618634.db2.gz UVXUCPRDAAVANC-GOSISDBHSA-N 1 1 369.421 2.707 20 5 FFBDMO Cn1ccnc1[C@@H](NCCCC[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000453405248 514623742 /nfs/dbraw/zinc/62/37/42/514623742.db2.gz QEUUKCSQUMXSSB-SFHVURJKSA-N 1 1 357.458 2.882 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000461544214 514651004 /nfs/dbraw/zinc/65/10/04/514651004.db2.gz ILMJHIHNUUYTMH-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)ccc1[N+](=O)[O-] ZINC000489140994 514726714 /nfs/dbraw/zinc/72/67/14/514726714.db2.gz REJTYNGNMXVTFG-AWEZNQCLSA-N 1 1 357.414 2.521 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc([N+](=O)[O-])c1C ZINC000479885311 514758778 /nfs/dbraw/zinc/75/87/78/514758778.db2.gz JSGYVRLFSCVSIP-HNNXBMFYSA-N 1 1 361.442 2.716 20 5 FFBDMO COc1cc(C[NH+]2CCC(CCN3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000489228688 514761227 /nfs/dbraw/zinc/76/12/27/514761227.db2.gz WDAYJQIRNHPITF-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO O=[N+]([O-])c1cccc(OCCN(CC[NH+]2CCOCC2)c2ccccc2)c1 ZINC000471172948 514782471 /nfs/dbraw/zinc/78/24/71/514782471.db2.gz NMFGTTWXHWWFJI-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO Cc1cc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c(F)cc1[N+](=O)[O-] ZINC000461935081 514794884 /nfs/dbraw/zinc/79/48/84/514794884.db2.gz JEIWHEJIIIXGNJ-XYPWUTKMSA-N 1 1 362.449 2.790 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N(C)C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1 ZINC000480174385 514863830 /nfs/dbraw/zinc/86/38/30/514863830.db2.gz YLYVJQSGZAHXRG-RDJZCZTQSA-N 1 1 358.446 2.644 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000485074471 514902410 /nfs/dbraw/zinc/90/24/10/514902410.db2.gz NYFFTTGVCHWFHD-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000485074471 514902419 /nfs/dbraw/zinc/90/24/19/514902419.db2.gz NYFFTTGVCHWFHD-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1=CC[N@@H+](C)CC1 ZINC000467218879 514944816 /nfs/dbraw/zinc/94/48/16/514944816.db2.gz RFUHTSLNJAMYJP-LLVKDONJSA-N 1 1 352.822 2.698 20 5 FFBDMO Cc1ccc(CN2CC[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)C2=O)cc1 ZINC000480472522 514970946 /nfs/dbraw/zinc/97/09/46/514970946.db2.gz VWNAMWTXFGCCHQ-SFHVURJKSA-N 1 1 357.385 2.933 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000498705636 515032417 /nfs/dbraw/zinc/03/24/17/515032417.db2.gz ITAIVZWCIDWYJH-HZPDHXFCSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H]3CCC[C@H]3OC(F)F)n2)cc1 ZINC000503526642 515070988 /nfs/dbraw/zinc/07/09/88/515070988.db2.gz QHSLHJHIGMTCRD-VXGBXAGGSA-N 1 1 354.313 2.895 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000456342149 515110157 /nfs/dbraw/zinc/11/01/57/515110157.db2.gz FPFCTTZAPVJYDX-CQSZACIVSA-N 1 1 357.414 2.541 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000467810751 515130446 /nfs/dbraw/zinc/13/04/46/515130446.db2.gz GPHAXUGSZKJVRF-SMDDNHRTSA-N 1 1 367.833 2.616 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000456368916 515134612 /nfs/dbraw/zinc/13/46/12/515134612.db2.gz FPOOEKADFBPYNT-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000481154766 515227982 /nfs/dbraw/zinc/22/79/82/515227982.db2.gz NJFVGFORLZZKFN-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000481154766 515227989 /nfs/dbraw/zinc/22/79/89/515227989.db2.gz NJFVGFORLZZKFN-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419500 515316647 /nfs/dbraw/zinc/31/66/47/515316647.db2.gz GDCFYXNUQKWXCG-GJZGRUSLSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419500 515316657 /nfs/dbraw/zinc/31/66/57/515316657.db2.gz GDCFYXNUQKWXCG-GJZGRUSLSA-N 1 1 356.426 2.668 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000486102470 515334625 /nfs/dbraw/zinc/33/46/25/515334625.db2.gz DJLYGFJHXBQMHQ-LBPRGKRZSA-N 1 1 367.471 2.787 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H]2CCCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510160090 515456345 /nfs/dbraw/zinc/45/63/45/515456345.db2.gz OGEDUZRKHFCYDW-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510160090 515456351 /nfs/dbraw/zinc/45/63/51/515456351.db2.gz OGEDUZRKHFCYDW-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000510443603 515543527 /nfs/dbraw/zinc/54/35/27/515543527.db2.gz OQVWYEKAOYPNME-BXKDBHETSA-N 1 1 370.247 2.878 20 5 FFBDMO COc1cccc([C@@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC[N@H+]2C2CC2)c1 ZINC000482047136 515557665 /nfs/dbraw/zinc/55/76/65/515557665.db2.gz WAZRZHZECOTURE-CRAIPNDOSA-N 1 1 370.409 2.639 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000457085474 515637797 /nfs/dbraw/zinc/63/77/97/515637797.db2.gz HMTLROHPKWJDDX-LBPRGKRZSA-N 1 1 357.357 2.751 20 5 FFBDMO CC(=O)N[C@H](C)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000482498787 515697112 /nfs/dbraw/zinc/69/71/12/515697112.db2.gz CFUHFXSCVSLLKO-LLVKDONJSA-N 1 1 371.384 2.933 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494040589 515718832 /nfs/dbraw/zinc/71/88/32/515718832.db2.gz YDJCFHMSDKABAH-DNVCBOLYSA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494040590 515719132 /nfs/dbraw/zinc/71/91/32/515719132.db2.gz YDJCFHMSDKABAH-HNAYVOBHSA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@H](C(=O)NC(=O)Nc1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511060994 515762046 /nfs/dbraw/zinc/76/20/46/515762046.db2.gz WHZIIFVLKSHTCP-CQSZACIVSA-N 1 1 370.409 2.806 20 5 FFBDMO C[C@H](C(=O)NC(=O)Nc1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511060994 515762054 /nfs/dbraw/zinc/76/20/54/515762054.db2.gz WHZIIFVLKSHTCP-CQSZACIVSA-N 1 1 370.409 2.806 20 5 FFBDMO C[C@@H](C(=O)NCc1ccc(F)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511066483 515763563 /nfs/dbraw/zinc/76/35/63/515763563.db2.gz REXIGJFTKFSMRG-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511066483 515763568 /nfs/dbraw/zinc/76/35/68/515763568.db2.gz REXIGJFTKFSMRG-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000482702155 515775795 /nfs/dbraw/zinc/77/57/95/515775795.db2.gz APQNRXADSANDLC-AWEZNQCLSA-N 1 1 366.425 2.745 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000487294875 515818874 /nfs/dbraw/zinc/81/88/74/515818874.db2.gz DIVWMEMFYSOYHX-GDBMZVCRSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000511422351 515897791 /nfs/dbraw/zinc/89/77/91/515897791.db2.gz SYOVYRZKHQWZSE-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474217731 515939514 /nfs/dbraw/zinc/93/95/14/515939514.db2.gz YJPJYIPUBBDESF-KRWDZBQOSA-N 1 1 368.437 2.740 20 5 FFBDMO CC(C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC(C)(C)C ZINC000501032742 515944059 /nfs/dbraw/zinc/94/40/59/515944059.db2.gz BSKPGXBMDBJVGG-UHFFFAOYSA-N 1 1 365.430 2.976 20 5 FFBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC(C)(C)C ZINC000501032742 515944067 /nfs/dbraw/zinc/94/40/67/515944067.db2.gz BSKPGXBMDBJVGG-UHFFFAOYSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000487838944 516000525 /nfs/dbraw/zinc/00/05/25/516000525.db2.gz OGNRVOFGNIAEHK-BXUZGUMPSA-N 1 1 354.838 2.573 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@@H]1C ZINC000495473974 516175461 /nfs/dbraw/zinc/17/54/61/516175461.db2.gz KSTISRNWMBNZTH-LSDHHAIUSA-N 1 1 371.441 2.725 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000507470138 516219193 /nfs/dbraw/zinc/21/91/93/516219193.db2.gz TXTKTYVFQAQGLF-UKRRQHHQSA-N 1 1 357.414 2.616 20 5 FFBDMO CC(C)(C)[C@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000507688767 516283638 /nfs/dbraw/zinc/28/36/38/516283638.db2.gz OVKLOUQDGKSZKT-INIZCTEOSA-N 1 1 371.441 2.521 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nccn3-c3ccccc3)CC2)n1 ZINC000488799340 516310938 /nfs/dbraw/zinc/31/09/38/516310938.db2.gz MBEBKQBRDBUNSN-UHFFFAOYSA-N 1 1 352.398 2.814 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000497532611 516325483 /nfs/dbraw/zinc/32/54/83/516325483.db2.gz KVSLPGIUFSFICB-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000497532611 516325484 /nfs/dbraw/zinc/32/54/84/516325484.db2.gz KVSLPGIUFSFICB-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](COC(F)F)C3)n2)cc1 ZINC000512805884 516365569 /nfs/dbraw/zinc/36/55/69/516365569.db2.gz NLDPNBBOFHDQHF-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](COC(F)F)C3)n2)cc1 ZINC000512805884 516365579 /nfs/dbraw/zinc/36/55/79/516365579.db2.gz NLDPNBBOFHDQHF-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCO2 ZINC000523609572 516519564 /nfs/dbraw/zinc/51/95/64/516519564.db2.gz ZLFRYBZFEJDTAP-UHFFFAOYSA-N 1 1 374.393 2.851 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@@H](C)C1 ZINC000558022816 516555263 /nfs/dbraw/zinc/55/52/63/516555263.db2.gz JOASVHSDNGZAEJ-ZJNRKIDTSA-N 1 1 356.426 2.878 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000540475104 516571016 /nfs/dbraw/zinc/57/10/16/516571016.db2.gz DTGHIBCAKRHPBN-KRWDZBQOSA-N 1 1 361.373 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CC[C@H]4CCCCO4)CC3)nc2c1 ZINC000547832572 516588882 /nfs/dbraw/zinc/58/88/82/516588882.db2.gz JUIJDZRTICCPDO-MRXNPFEDSA-N 1 1 373.457 2.942 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCn1cc(Br)cn1 ZINC000554749584 516618257 /nfs/dbraw/zinc/61/82/57/516618257.db2.gz SEYGNLURXOHBFN-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCn1cc(Br)cn1 ZINC000554749584 516618265 /nfs/dbraw/zinc/61/82/65/516618265.db2.gz SEYGNLURXOHBFN-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000513460545 516633423 /nfs/dbraw/zinc/63/34/23/516633423.db2.gz PTTUOUJZHKVSMS-UHFFFAOYSA-N 1 1 354.313 2.521 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240939 516656991 /nfs/dbraw/zinc/65/69/91/516656991.db2.gz TXNUUGRFVJVYRV-QWRGUYRKSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240939 516656999 /nfs/dbraw/zinc/65/69/99/516656999.db2.gz TXNUUGRFVJVYRV-QWRGUYRKSA-N 1 1 357.863 2.891 20 5 FFBDMO CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000531882892 516690933 /nfs/dbraw/zinc/69/09/33/516690933.db2.gz SVZJBCALNGHKNK-UHFFFAOYSA-N 1 1 354.410 2.726 20 5 FFBDMO CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000531882892 516690941 /nfs/dbraw/zinc/69/09/41/516690941.db2.gz SVZJBCALNGHKNK-UHFFFAOYSA-N 1 1 354.410 2.726 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551402253 516693157 /nfs/dbraw/zinc/69/31/57/516693157.db2.gz ZZGNKEGQHUJOKN-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551402253 516693165 /nfs/dbraw/zinc/69/31/65/516693165.db2.gz ZZGNKEGQHUJOKN-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000551402253 516693173 /nfs/dbraw/zinc/69/31/73/516693173.db2.gz ZZGNKEGQHUJOKN-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N[C@H](C)C[NH+]2CCN(c3ccccn3)CC2)c1 ZINC000524688790 516789964 /nfs/dbraw/zinc/78/99/64/516789964.db2.gz SSKPAHGXYMFOTK-OAHLLOKOSA-N 1 1 371.441 2.621 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1SC ZINC000518899236 516813855 /nfs/dbraw/zinc/81/38/55/516813855.db2.gz RCCPVXAERCGWQQ-GFCCVEGCSA-N 1 1 365.455 2.634 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000524881123 516859593 /nfs/dbraw/zinc/85/95/93/516859593.db2.gz UTVCOVPJZIOBRY-YOEHRIQHSA-N 1 1 371.441 2.725 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)nc1OCc1ccccc1 ZINC000558649126 516860328 /nfs/dbraw/zinc/86/03/28/516860328.db2.gz LHDHHQRSGDGPEY-INIZCTEOSA-N 1 1 368.437 2.887 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000551794909 516875133 /nfs/dbraw/zinc/87/51/33/516875133.db2.gz ATLQSDNWVICGJV-SFHVURJKSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000551794909 516875140 /nfs/dbraw/zinc/87/51/40/516875140.db2.gz ATLQSDNWVICGJV-SFHVURJKSA-N 1 1 357.385 2.733 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000525040928 516901261 /nfs/dbraw/zinc/90/12/61/516901261.db2.gz VIQGSLLLMHTHOU-LRDDRELGSA-N 1 1 362.455 2.808 20 5 FFBDMO Cc1cnc(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000548346398 516921184 /nfs/dbraw/zinc/92/11/84/516921184.db2.gz VAZHMCOTPZXNEI-WMLDXEAASA-N 1 1 358.446 2.551 20 5 FFBDMO Cc1ccc([C@H](CC(=O)OC(C)C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000541201165 516926855 /nfs/dbraw/zinc/92/68/55/516926855.db2.gz BUDVWAWWQCRTSR-HNNXBMFYSA-N 1 1 360.414 2.809 20 5 FFBDMO CC[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000532388409 516947674 /nfs/dbraw/zinc/94/76/74/516947674.db2.gz YUSYVRDKAUGTGX-MRXNPFEDSA-N 1 1 354.410 2.557 20 5 FFBDMO COC(=O)c1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000537126365 517048211 /nfs/dbraw/zinc/04/82/11/517048211.db2.gz NXNBOFZNEPDOPN-LBPRGKRZSA-N 1 1 357.366 2.671 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)CCC[N@@H+](C)Cc1ccco1 ZINC000552058584 517054778 /nfs/dbraw/zinc/05/47/78/517054778.db2.gz PZMKCEQLHWALFR-UHFFFAOYSA-N 1 1 374.441 2.889 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H](n3cc(CO)nn3)C2)cc1[N+](=O)[O-] ZINC000552110254 517084662 /nfs/dbraw/zinc/08/46/62/517084662.db2.gz DGMIITYDKYVJBZ-INIZCTEOSA-N 1 1 359.430 2.639 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](n3cc(CO)nn3)C2)cc1[N+](=O)[O-] ZINC000552110254 517084670 /nfs/dbraw/zinc/08/46/70/517084670.db2.gz DGMIITYDKYVJBZ-INIZCTEOSA-N 1 1 359.430 2.639 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000552274508 517173600 /nfs/dbraw/zinc/17/36/00/517173600.db2.gz XRICHCTYSYLOPL-IHWMJMDHSA-N 1 1 352.456 2.755 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](CS(C)(=O)=O)C1 ZINC000552274508 517173604 /nfs/dbraw/zinc/17/36/04/517173604.db2.gz XRICHCTYSYLOPL-IHWMJMDHSA-N 1 1 352.456 2.755 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCN3CCOC[C@@H]3C2)s1 ZINC000541761089 517202205 /nfs/dbraw/zinc/20/22/05/517202205.db2.gz XLSGVLCHXZQGQF-AWEZNQCLSA-N 1 1 359.451 2.840 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)[NH+]1CCOCC1 ZINC000541785712 517215444 /nfs/dbraw/zinc/21/54/44/517215444.db2.gz FPXCBXQMJIAVQD-AWEZNQCLSA-N 1 1 368.409 2.602 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000532988301 517238343 /nfs/dbraw/zinc/23/83/43/517238343.db2.gz ACCDSAPUAUPOAG-STQMWFEESA-N 1 1 368.865 2.991 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000520441904 517394728 /nfs/dbraw/zinc/39/47/28/517394728.db2.gz BYUVFUPLCGZVRE-CXAGYDPISA-N 1 1 354.410 2.626 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000533385999 517436700 /nfs/dbraw/zinc/43/67/00/517436700.db2.gz AUUYXDVLILCJJY-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000533385999 517436710 /nfs/dbraw/zinc/43/67/10/517436710.db2.gz AUUYXDVLILCJJY-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO C[C@](O)(C1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545931858 517443222 /nfs/dbraw/zinc/44/32/22/517443222.db2.gz MGFCHFNLKORFES-HNNXBMFYSA-N 1 1 362.348 2.999 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1C ZINC000533447356 517468345 /nfs/dbraw/zinc/46/83/45/517468345.db2.gz GKHCPFIEUZOVQO-XJKSGUPXSA-N 1 1 359.430 2.949 20 5 FFBDMO COc1ccc([C@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1Br ZINC000538167231 517490270 /nfs/dbraw/zinc/49/02/70/517490270.db2.gz IUBVSTBEMUSCLJ-VIFPVBQESA-N 1 1 369.219 2.950 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCc1c(F)cccc1F)c1ccccc1[N+](=O)[O-] ZINC000538225094 517514521 /nfs/dbraw/zinc/51/45/21/517514521.db2.gz UBALFWFQBIBJIF-LBPRGKRZSA-N 1 1 363.364 2.883 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NC1CCCCC1 ZINC000538281011 517538764 /nfs/dbraw/zinc/53/87/64/517538764.db2.gz YPXYLJAJEGKXHN-QWHCGFSZSA-N 1 1 362.430 2.792 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000553170901 517557009 /nfs/dbraw/zinc/55/70/09/517557009.db2.gz FNIZTSWMQUHKQK-CQSZACIVSA-N 1 1 359.430 2.588 20 5 FFBDMO C[NH+](C)CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000521056576 517596702 /nfs/dbraw/zinc/59/67/02/517596702.db2.gz SCRIURRJXHYTIM-UHFFFAOYSA-N 1 1 359.430 2.808 20 5 FFBDMO C[C@H]1C[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000553446421 517718906 /nfs/dbraw/zinc/71/89/06/517718906.db2.gz FQIIDKXWSVQGCJ-ZFWWWQNUSA-N 1 1 354.410 2.769 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000538953270 517862368 /nfs/dbraw/zinc/86/23/68/517862368.db2.gz LLPOWUZHYXZLGN-QWRGUYRKSA-N 1 1 359.373 2.729 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000521921515 517901660 /nfs/dbraw/zinc/90/16/60/517901660.db2.gz CWFSUPSELZCMCH-OAHLLOKOSA-N 1 1 363.458 2.990 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])cc2OC(F)F)C1 ZINC000546895717 517912017 /nfs/dbraw/zinc/91/20/17/517912017.db2.gz IMBOIIFSFXWOBK-ZDUSSCGKSA-N 1 1 359.373 2.965 20 5 FFBDMO C[N@@H+](Cc1nc2ccccc2o1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543138673 517928436 /nfs/dbraw/zinc/92/84/36/517928436.db2.gz JACMWAKTXCKIEL-CYBMUJFWSA-N 1 1 357.366 2.608 20 5 FFBDMO C[N@H+](Cc1nc2ccccc2o1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543138673 517928447 /nfs/dbraw/zinc/92/84/47/517928447.db2.gz JACMWAKTXCKIEL-CYBMUJFWSA-N 1 1 357.366 2.608 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534541959 517933628 /nfs/dbraw/zinc/93/36/28/517933628.db2.gz OHBRVTCBMCASLH-MRXNPFEDSA-N 1 1 355.394 2.910 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534541959 517933634 /nfs/dbraw/zinc/93/36/34/517933634.db2.gz OHBRVTCBMCASLH-MRXNPFEDSA-N 1 1 355.394 2.910 20 5 FFBDMO Cc1nn(C)c(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)c1[N+](=O)[O-] ZINC000539331699 517997854 /nfs/dbraw/zinc/99/78/54/517997854.db2.gz YLRPITPJTZSYNK-UHFFFAOYSA-N 1 1 357.414 2.526 20 5 FFBDMO CNc1c(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000563723421 518090612 /nfs/dbraw/zinc/09/06/12/518090612.db2.gz LLXIWPARXGVGSX-UHFFFAOYSA-N 1 1 360.414 2.824 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522828818 518167503 /nfs/dbraw/zinc/16/75/03/518167503.db2.gz MMLNNUNWKKXVOG-QGZVFWFLSA-N 1 1 354.410 2.518 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000564003678 518265513 /nfs/dbraw/zinc/26/55/13/518265513.db2.gz UFEAVOLNFZVPMV-WBVHZDCISA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000564003673 518266167 /nfs/dbraw/zinc/26/61/67/518266167.db2.gz UFEAVOLNFZVPMV-NVXWUHKLSA-N 1 1 369.421 2.753 20 5 FFBDMO CCc1cc(NC[C@@H](C)[N@@H+](C)C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000567097662 518350327 /nfs/dbraw/zinc/35/03/27/518350327.db2.gz HSHULQGGDOWBCW-CYBMUJFWSA-N 1 1 355.442 2.931 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CCCc2[nH]cnc21 ZINC000570144397 518461279 /nfs/dbraw/zinc/46/12/79/518461279.db2.gz CDHUGONXTGWDQT-CYBMUJFWSA-N 1 1 353.382 2.578 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000576192022 518472252 /nfs/dbraw/zinc/47/22/52/518472252.db2.gz MBSPUHHYEDTVPF-AWEZNQCLSA-N 1 1 366.437 2.714 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000570237834 518509714 /nfs/dbraw/zinc/50/97/14/518509714.db2.gz MPBKRKRRYPBSND-NSHDSACASA-N 1 1 370.247 2.832 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc(Br)c1C ZINC000570237834 518509718 /nfs/dbraw/zinc/50/97/18/518509718.db2.gz MPBKRKRRYPBSND-NSHDSACASA-N 1 1 370.247 2.832 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CCC(CCC[N@@H+](C)CCOC)CC1 ZINC000576306933 518526880 /nfs/dbraw/zinc/52/68/80/518526880.db2.gz QOPUOOHLVYDWDR-UHFFFAOYSA-N 1 1 367.494 2.694 20 5 FFBDMO O=C(c1ccccc1)N1CC[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000582015250 518547352 /nfs/dbraw/zinc/54/73/52/518547352.db2.gz FQTQEVUGPRZGTA-HNNXBMFYSA-N 1 1 366.421 2.510 20 5 FFBDMO O=C(c1ccccc1)N1CC[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000582015250 518547356 /nfs/dbraw/zinc/54/73/56/518547356.db2.gz FQTQEVUGPRZGTA-HNNXBMFYSA-N 1 1 366.421 2.510 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2cnn(C(C)C)c2)c([N+](=O)[O-])c1 ZINC000582208147 518636619 /nfs/dbraw/zinc/63/66/19/518636619.db2.gz JNPUNRNILFGFGS-GFCCVEGCSA-N 1 1 361.402 2.670 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000582275671 518672226 /nfs/dbraw/zinc/67/22/26/518672226.db2.gz QXZNMCWYGVDBLD-HNNXBMFYSA-N 1 1 354.410 2.751 20 5 FFBDMO C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC000582329516 518698674 /nfs/dbraw/zinc/69/86/74/518698674.db2.gz VIVALWDXEGVTEJ-NSHDSACASA-N 1 1 355.341 2.870 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)Cc3c([N+](=O)[O-])ncn3C)C2)s1 ZINC000565051389 518762595 /nfs/dbraw/zinc/76/25/95/518762595.db2.gz MVBRMWYSMVGFLL-AWEZNQCLSA-N 1 1 363.487 2.652 20 5 FFBDMO C[C@@]1(NC(=O)Cc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000565063702 518770050 /nfs/dbraw/zinc/77/00/50/518770050.db2.gz DXECCKJDSVIROV-HXUWFJFHSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c(C)cc1[N+](=O)[O-] ZINC000567916157 518783339 /nfs/dbraw/zinc/78/33/39/518783339.db2.gz LNJOQACYXYVJCZ-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CS(=O)(=O)c1ccc(F)c(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000577191880 518958822 /nfs/dbraw/zinc/95/88/22/518958822.db2.gz ZKYIIBFOPMFOBF-INIZCTEOSA-N 1 1 364.398 2.915 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H]4CC[N@@H+](C)[C@@H]4C3)cc2[N+](=O)[O-])CC1 ZINC000574372954 519120679 /nfs/dbraw/zinc/12/06/79/519120679.db2.gz VULFUYPQDLPDSL-QFBILLFUSA-N 1 1 372.469 2.607 20 5 FFBDMO CN(Cc1ccccc1F)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580348511 519129249 /nfs/dbraw/zinc/12/92/49/519129249.db2.gz LPNWQOYWDUINEX-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO CN(Cc1ccccc1F)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000580348511 519129259 /nfs/dbraw/zinc/12/92/59/519129259.db2.gz LPNWQOYWDUINEX-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H](C)C1 ZINC000590174898 519167530 /nfs/dbraw/zinc/16/75/30/519167530.db2.gz DFXCIZNUWNMRSN-NWDGAFQWSA-N 1 1 361.364 2.501 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000590386534 519212686 /nfs/dbraw/zinc/21/26/86/519212686.db2.gz ATDZRQUJBNKZMG-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000565995814 519236917 /nfs/dbraw/zinc/23/69/17/519236917.db2.gz UNEHZQSEJXFOTD-MRXNPFEDSA-N 1 1 373.457 2.743 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)CCC[N@@H+](C)Cc1ccco1 ZINC000566025395 519253250 /nfs/dbraw/zinc/25/32/50/519253250.db2.gz NVDYJVBCICEHKT-UHFFFAOYSA-N 1 1 374.441 2.889 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000574650893 519262879 /nfs/dbraw/zinc/26/28/79/519262879.db2.gz KZRWQEXYTPKLNH-CYBMUJFWSA-N 1 1 354.426 2.713 20 5 FFBDMO CC[C@H](C)[NH2+][C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000580793376 519361345 /nfs/dbraw/zinc/36/13/45/519361345.db2.gz DXCGASLDEZDDQD-NHYWBVRUSA-N 1 1 371.397 2.923 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])c1 ZINC000578382812 519563141 /nfs/dbraw/zinc/56/31/41/519563141.db2.gz UQVGQCXKSPDUFT-UHFFFAOYSA-N 1 1 359.430 2.870 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)c(Cl)c1 ZINC000594616489 520057609 /nfs/dbraw/zinc/05/76/09/520057609.db2.gz DBKDRRJGSXOLAM-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)c(Cl)c1 ZINC000594616489 520057615 /nfs/dbraw/zinc/05/76/15/520057615.db2.gz DBKDRRJGSXOLAM-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C(C)(C)C ZINC000603140901 520103394 /nfs/dbraw/zinc/10/33/94/520103394.db2.gz CIYAQJHQBMUHBG-INIZCTEOSA-N 1 1 372.425 2.651 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597605159 520132794 /nfs/dbraw/zinc/13/27/94/520132794.db2.gz NJKWFHVXFNWQBD-AWEZNQCLSA-N 1 1 369.849 2.960 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000608866592 520148274 /nfs/dbraw/zinc/14/82/74/520148274.db2.gz BCGAIWOJTZGTCD-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccc(O)cc2CC1 ZINC000608866592 520148288 /nfs/dbraw/zinc/14/82/88/520148288.db2.gz BCGAIWOJTZGTCD-ZDUSSCGKSA-N 1 1 355.394 2.728 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000594790573 520158017 /nfs/dbraw/zinc/15/80/17/520158017.db2.gz NHBWGDCKLUZWNV-ZDUSSCGKSA-N 1 1 369.487 2.556 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000600298745 520188784 /nfs/dbraw/zinc/18/87/84/520188784.db2.gz LXVMHHDYERSQOW-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000600298745 520188798 /nfs/dbraw/zinc/18/87/98/520188798.db2.gz LXVMHHDYERSQOW-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)C2 ZINC000597715602 520192942 /nfs/dbraw/zinc/19/29/42/520192942.db2.gz NMWXEUPJBSFSAS-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO Cc1nccn1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132911 520206989 /nfs/dbraw/zinc/20/69/89/520206989.db2.gz PKRNTMOHDVIYGM-IYARVYRRSA-N 1 1 358.442 2.905 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000592155874 520232789 /nfs/dbraw/zinc/23/27/89/520232789.db2.gz SMDBOKALXSKZBW-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)c1ncnc2sc([N+](=O)[O-])cc21 ZINC000603403081 520250313 /nfs/dbraw/zinc/25/03/13/520250313.db2.gz UNYIJXPVYYQFPB-UHFFFAOYSA-N 1 1 372.454 2.953 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)CCCC[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000603407234 520251926 /nfs/dbraw/zinc/25/19/26/520251926.db2.gz RFROPJORGDIWPN-UHFFFAOYSA-N 1 1 351.451 2.609 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)C(=O)NCC2 ZINC000595034546 520264264 /nfs/dbraw/zinc/26/42/64/520264264.db2.gz XURRHHONKQJOTJ-GFCCVEGCSA-N 1 1 355.394 2.740 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595056350 520272669 /nfs/dbraw/zinc/27/26/69/520272669.db2.gz FOPMTLYOKMYXIM-DOTOQJQBSA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000597854445 520284756 /nfs/dbraw/zinc/28/47/56/520284756.db2.gz HWHSYSGVYGTMFG-CQSZACIVSA-N 1 1 358.442 2.786 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1OC ZINC000597859346 520286225 /nfs/dbraw/zinc/28/62/25/520286225.db2.gz VBSAJZRPLOTJST-GFCCVEGCSA-N 1 1 365.430 2.605 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000597860547 520288953 /nfs/dbraw/zinc/28/89/53/520288953.db2.gz OHXLKGUOHDBTAV-LLVKDONJSA-N 1 1 353.394 2.593 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000609441058 520311385 /nfs/dbraw/zinc/31/13/85/520311385.db2.gz AOPMLTVOUJBVIB-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597924396 520326234 /nfs/dbraw/zinc/32/62/34/520326234.db2.gz QSIGJBBKHSKHCK-ZDUSSCGKSA-N 1 1 372.425 2.511 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000609673407 520402848 /nfs/dbraw/zinc/40/28/48/520402848.db2.gz GVPOVVXVGKLYMF-OKILXGFUSA-N 1 1 369.487 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)n2)cc1 ZINC000592492985 520417246 /nfs/dbraw/zinc/41/72/46/520417246.db2.gz LAFKKPKJURYOSQ-HZPDHXFCSA-N 1 1 371.441 2.856 20 5 FFBDMO COc1cc(-c2cccc(C[NH+]3CCN(C(C)=O)CC3)c2)cc([N+](=O)[O-])c1 ZINC000600794605 520473711 /nfs/dbraw/zinc/47/37/11/520473711.db2.gz RIINJJLDIHXRAZ-UHFFFAOYSA-N 1 1 369.421 2.935 20 5 FFBDMO CCOc1cc(C[NH2+][C@H](c2cnn(C)c2)C2(CO)CCC2)ccc1[N+](=O)[O-] ZINC000595496001 520507878 /nfs/dbraw/zinc/50/78/78/520507878.db2.gz XCNYAIBTTBCYLO-GOSISDBHSA-N 1 1 374.441 2.721 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000592752261 520559448 /nfs/dbraw/zinc/55/94/48/520559448.db2.gz CMNBARVQBNXSHH-HNNXBMFYSA-N 1 1 371.441 2.654 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000592765555 520567085 /nfs/dbraw/zinc/56/70/85/520567085.db2.gz LIZYMWNHGDRVEX-NSHDSACASA-N 1 1 360.370 2.730 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000610200267 520576280 /nfs/dbraw/zinc/57/62/80/520576280.db2.gz WOBIBWXIASNXCM-ABAIWWIYSA-N 1 1 363.443 2.501 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000610359984 520650196 /nfs/dbraw/zinc/65/01/96/520650196.db2.gz GZBDHCHWULFIHR-NVXWUHKLSA-N 1 1 356.426 2.635 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1 ZINC000601136448 520653821 /nfs/dbraw/zinc/65/38/21/520653821.db2.gz RZXMHYRWHYIIJS-UHFFFAOYSA-N 1 1 354.426 2.704 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1NCc1ccccc1C[N@@H+]1CCC[C@@H]1CO ZINC000601140442 520655562 /nfs/dbraw/zinc/65/55/62/520655562.db2.gz ZAHXCTZGBFEOMT-MRXNPFEDSA-N 1 1 360.389 2.698 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508674 520666627 /nfs/dbraw/zinc/66/66/27/520666627.db2.gz HFDUSSPZVHMPSR-KRWDZBQOSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+]2CCc3nc(-c4ccccc4)sc3C2)n1 ZINC000595714370 520668425 /nfs/dbraw/zinc/66/84/25/520668425.db2.gz TWOWQFYMWVNVBC-UHFFFAOYSA-N 1 1 355.423 2.973 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCc3nc(-c4ccccc4)sc3C2)n1 ZINC000595714370 520668436 /nfs/dbraw/zinc/66/84/36/520668436.db2.gz TWOWQFYMWVNVBC-UHFFFAOYSA-N 1 1 355.423 2.973 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601183973 520677104 /nfs/dbraw/zinc/67/71/04/520677104.db2.gz IOTNCSYCLRXHOO-OAHLLOKOSA-N 1 1 368.315 2.648 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000598562034 520708756 /nfs/dbraw/zinc/70/87/56/520708756.db2.gz RZOCLYSISHAXNM-CYBMUJFWSA-N 1 1 365.405 2.594 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@@H](CC)CO1 ZINC000593058090 520716297 /nfs/dbraw/zinc/71/62/97/520716297.db2.gz JAMFXVQJTJECKV-ZFWWWQNUSA-N 1 1 365.430 2.821 20 5 FFBDMO CC(C)(O)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCOCC1 ZINC000610543163 520731793 /nfs/dbraw/zinc/73/17/93/520731793.db2.gz ZVWXIKJCYPLWMP-UHFFFAOYSA-N 1 1 352.431 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](CCN2CCOCC2)CC2CC2)c(Cl)c1 ZINC000595808546 520739605 /nfs/dbraw/zinc/73/96/05/520739605.db2.gz NTNDGYYPFMMLQM-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCN2CCOCC2)CC2CC2)c(Cl)c1 ZINC000595808546 520739617 /nfs/dbraw/zinc/73/96/17/520739617.db2.gz NTNDGYYPFMMLQM-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000595837667 520758537 /nfs/dbraw/zinc/75/85/37/520758537.db2.gz QOIUZUNWOKMXCL-CYBMUJFWSA-N 1 1 361.398 2.774 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](C2CCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000595837667 520758543 /nfs/dbraw/zinc/75/85/43/520758543.db2.gz QOIUZUNWOKMXCL-CYBMUJFWSA-N 1 1 361.398 2.774 20 5 FFBDMO Cc1ccc(CNC(=O)c2c(F)cccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000601422590 520782295 /nfs/dbraw/zinc/78/22/95/520782295.db2.gz ULONMWHEANPPDH-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOCC3(CCCC3)C2)c([N+](=O)[O-])c1 ZINC000614222587 520856046 /nfs/dbraw/zinc/85/60/46/520856046.db2.gz FJXKDZYNDGAGSI-UHFFFAOYSA-N 1 1 350.415 2.875 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@H]1Cc1ccccc1 ZINC000593321325 520908491 /nfs/dbraw/zinc/90/84/91/520908491.db2.gz IFFNGXFZDKEFEP-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@H]1Cc1ccccc1 ZINC000593321325 520908494 /nfs/dbraw/zinc/90/84/94/520908494.db2.gz IFFNGXFZDKEFEP-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO Cc1cc(NCCCN2CCN(c3cc[nH+]cc3)CC2)c([N+](=O)[O-])s1 ZINC000596099012 520910439 /nfs/dbraw/zinc/91/04/39/520910439.db2.gz WGYINTBCISWWMD-UHFFFAOYSA-N 1 1 361.471 2.984 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)c1 ZINC000593323950 520910756 /nfs/dbraw/zinc/91/07/56/520910756.db2.gz UJBZSLXPBTWVQZ-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)c1 ZINC000593323950 520910765 /nfs/dbraw/zinc/91/07/65/520910765.db2.gz UJBZSLXPBTWVQZ-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000593324094 520911554 /nfs/dbraw/zinc/91/15/54/520911554.db2.gz WCJFLOPVQSBKOH-IBGZPJMESA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000593324094 520911558 /nfs/dbraw/zinc/91/15/58/520911558.db2.gz WCJFLOPVQSBKOH-IBGZPJMESA-N 1 1 353.422 2.902 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)C(C)(C)CN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000598912670 520913569 /nfs/dbraw/zinc/91/35/69/520913569.db2.gz ILQAGHVDQOPEDD-UHFFFAOYSA-N 1 1 371.441 2.833 20 5 FFBDMO Cc1cc(N2CCC(Nc3c(Cl)cncc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000596151388 520940797 /nfs/dbraw/zinc/94/07/97/520940797.db2.gz JOKXEQKBELJIFV-UHFFFAOYSA-N 1 1 362.821 2.553 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593409384 520972434 /nfs/dbraw/zinc/97/24/34/520972434.db2.gz URAZENQLWPQKQP-OKILXGFUSA-N 1 1 351.422 2.761 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088201 520979063 /nfs/dbraw/zinc/97/90/63/520979063.db2.gz JJFJFIKISMFWLI-HZPDHXFCSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088201 520979072 /nfs/dbraw/zinc/97/90/72/520979072.db2.gz JJFJFIKISMFWLI-HZPDHXFCSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000611092119 520981224 /nfs/dbraw/zinc/98/12/24/520981224.db2.gz JDHZPBLESAPXLX-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000599021173 520986258 /nfs/dbraw/zinc/98/62/58/520986258.db2.gz SEPUVXNDGFCWTD-SFHVURJKSA-N 1 1 360.458 2.844 20 5 FFBDMO CN1Cc2ccccc2[C@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611134197 521003006 /nfs/dbraw/zinc/00/30/06/521003006.db2.gz PEIBNBQRERUXFK-MRXNPFEDSA-N 1 1 355.394 2.642 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068654 521012254 /nfs/dbraw/zinc/01/22/54/521012254.db2.gz BNBJUDSRHMLNCF-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO Cc1nc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)ccc1[N+](=O)[O-] ZINC000593496580 521032281 /nfs/dbraw/zinc/03/22/81/521032281.db2.gz SNBAZHDMXYKIDF-MOPGFXCFSA-N 1 1 368.437 2.778 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)[C@H](Cc2ccccc2)C1 ZINC000593504852 521037067 /nfs/dbraw/zinc/03/70/67/521037067.db2.gz RTIQELCCAYCXJR-QGZVFWFLSA-N 1 1 363.421 2.901 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C(F)F)CC1 ZINC000601971036 521049136 /nfs/dbraw/zinc/04/91/36/521049136.db2.gz ABRZHGJWFBJRMF-CQSZACIVSA-N 1 1 357.357 2.588 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c(Cl)c1 ZINC000596423728 521063456 /nfs/dbraw/zinc/06/34/56/521063456.db2.gz OORYDRCPOFEEFQ-OAHLLOKOSA-N 1 1 362.817 2.822 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596424609 521065237 /nfs/dbraw/zinc/06/52/37/521065237.db2.gz UCUZJDHYNCLPOS-OAHLLOKOSA-N 1 1 362.817 2.822 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274366 521073320 /nfs/dbraw/zinc/07/33/20/521073320.db2.gz HMPWKKVXTRWEGE-GFCCVEGCSA-N 1 1 364.398 2.530 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611274366 521073322 /nfs/dbraw/zinc/07/33/22/521073322.db2.gz HMPWKKVXTRWEGE-GFCCVEGCSA-N 1 1 364.398 2.530 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000596477543 521091554 /nfs/dbraw/zinc/09/15/54/521091554.db2.gz AUIDCIPJSCHFEH-CYBMUJFWSA-N 1 1 362.430 2.904 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](NC[C@H]2CCC[N@@H+]2CCCO)C(F)(F)F)cc1 ZINC000593713127 521169836 /nfs/dbraw/zinc/16/98/36/521169836.db2.gz UXAFWIIPHFVWOZ-HUUCEWRRSA-N 1 1 361.364 2.635 20 5 FFBDMO CCO[C@@H](C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1)C1CC1 ZINC000599371676 521180923 /nfs/dbraw/zinc/18/09/23/521180923.db2.gz PEPOTCLLMOYNOP-SFHVURJKSA-N 1 1 373.457 2.798 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000611522876 521200794 /nfs/dbraw/zinc/20/07/94/521200794.db2.gz IJKGQUPMDJYLFU-XNHLSEOASA-N 1 1 358.486 2.899 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1Cc2ccc(O)cc2C1 ZINC000599536721 521281672 /nfs/dbraw/zinc/28/16/72/521281672.db2.gz PRNQGAGZTMGMMO-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2ccc(O)cc2C1 ZINC000599536721 521281679 /nfs/dbraw/zinc/28/16/79/521281679.db2.gz PRNQGAGZTMGMMO-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599567844 521304043 /nfs/dbraw/zinc/30/40/43/521304043.db2.gz POBTVZMUECJYRO-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987344 521331111 /nfs/dbraw/zinc/33/11/11/521331111.db2.gz NOTFAJDNIONUEG-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](c3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000593987344 521331121 /nfs/dbraw/zinc/33/11/21/521331121.db2.gz NOTFAJDNIONUEG-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])n1 ZINC000602481692 521369944 /nfs/dbraw/zinc/36/99/44/521369944.db2.gz CTQRBOLFCYRHCI-IEBWSBKVSA-N 1 1 369.469 2.815 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602496028 521379144 /nfs/dbraw/zinc/37/91/44/521379144.db2.gz ZLHUQLSQBLKOOB-GFCCVEGCSA-N 1 1 359.348 2.914 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594095524 521400511 /nfs/dbraw/zinc/40/05/11/521400511.db2.gz XPDZSYJUOUSVOM-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594095524 521400518 /nfs/dbraw/zinc/40/05/18/521400518.db2.gz XPDZSYJUOUSVOM-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602717344 521493851 /nfs/dbraw/zinc/49/38/51/521493851.db2.gz XYBFEOUTATWUDR-UHFFFAOYSA-N 1 1 369.347 2.669 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597093945 521499207 /nfs/dbraw/zinc/49/92/07/521499207.db2.gz CYBVNAUCLLCZOB-ZYHUDNBSSA-N 1 1 353.810 2.579 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)c1ccco1 ZINC000597094139 521500135 /nfs/dbraw/zinc/50/01/35/521500135.db2.gz LOLOBKNFSIEZSM-GFCCVEGCSA-N 1 1 367.793 2.848 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599834808 521502837 /nfs/dbraw/zinc/50/28/37/521502837.db2.gz ICYOAOYHYMCXGI-UHFFFAOYSA-N 1 1 366.381 2.998 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](Cn4ccnn4)C3)o2)cc1 ZINC000597172750 521554731 /nfs/dbraw/zinc/55/47/31/521554731.db2.gz BYZWXFHSAPASLB-CQSZACIVSA-N 1 1 353.382 2.968 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@@](C)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597181030 521559612 /nfs/dbraw/zinc/55/96/12/521559612.db2.gz ZHWFSAWUDMIQCY-LJQANCHMSA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@@](C)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597181030 521559617 /nfs/dbraw/zinc/55/96/17/521559617.db2.gz ZHWFSAWUDMIQCY-LJQANCHMSA-N 1 1 356.426 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CC[NH+]([C@H]4CCOC4)CC3)o2)c1 ZINC000597202544 521571672 /nfs/dbraw/zinc/57/16/72/521571672.db2.gz DWZIFSMYGNGXEL-KRWDZBQOSA-N 1 1 357.410 2.761 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@](O)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597203912 521572665 /nfs/dbraw/zinc/57/26/65/521572665.db2.gz ANWGPEJWZWTFEK-IBGZPJMESA-N 1 1 356.426 2.732 20 5 FFBDMO COCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1 ZINC000485396634 561318283 /nfs/dbraw/zinc/31/82/83/561318283.db2.gz XOWUVJNAFBNZOZ-OAHLLOKOSA-N 1 1 360.389 2.929 20 5 FFBDMO Cc1cc(NC(=O)C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)no1 ZINC000491144334 561443398 /nfs/dbraw/zinc/44/33/98/561443398.db2.gz ZAOUDTIEKHPOLX-UHFFFAOYSA-N 1 1 362.361 2.881 20 5 FFBDMO C[NH+](C)CCn1ccc(=NC(=O)c2c([N+](=O)[O-])cccc2C(F)(F)F)[nH]1 ZINC000517782421 562098065 /nfs/dbraw/zinc/09/80/65/562098065.db2.gz LMCRQKJTCSJZBK-UHFFFAOYSA-N 1 1 371.319 2.624 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000826170118 608564347 /nfs/dbraw/zinc/56/43/47/608564347.db2.gz OTVXFCYIMORAIC-LLVKDONJSA-N 1 1 354.370 2.634 20 5 FFBDMO COc1ccc(-c2nn[nH]n2)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000826184025 608564600 /nfs/dbraw/zinc/56/46/00/608564600.db2.gz IHMMSFPNDBXNMD-LLVKDONJSA-N 1 1 354.370 2.634 20 5 FFBDMO C[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000824648955 609314600 /nfs/dbraw/zinc/31/46/00/609314600.db2.gz JZBURIHZBFYHHJ-GXTWGEPZSA-N 1 1 371.445 2.840 20 5 FFBDMO Cc1cnc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)c([N+](=O)[O-])c1 ZINC001164649069 719307258 /nfs/dbraw/zinc/30/72/58/719307258.db2.gz TWABAAYNGUKYJO-UHFFFAOYSA-N 1 1 358.446 2.700 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721710 720334498 /nfs/dbraw/zinc/33/44/98/720334498.db2.gz DBOXSGZSFROOPK-CABCVRRESA-N 1 1 359.817 2.891 20 5 FFBDMO CCC[C@@H]1CN(c2ccc([N+](=O)[O-])cc2COC)CC[N@H+]1CCOC ZINC000162458199 728945377 /nfs/dbraw/zinc/94/53/77/728945377.db2.gz MOBZJVNHXVWTOD-QGZVFWFLSA-N 1 1 351.447 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000091672677 728460944 /nfs/dbraw/zinc/46/09/44/728460944.db2.gz YTOONPZCDIWBCI-NEPJUHHUSA-N 1 1 356.220 2.632 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1F ZINC000093002858 728473076 /nfs/dbraw/zinc/47/30/76/728473076.db2.gz RATZDHMMJFDJSX-ZDUSSCGKSA-N 1 1 373.450 2.537 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)COCc1ccco1 ZINC000120764725 728615053 /nfs/dbraw/zinc/61/50/53/728615053.db2.gz CTWGCJVNRMFIBV-AWEZNQCLSA-N 1 1 354.790 2.851 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)COCc1ccco1 ZINC000120764725 728615055 /nfs/dbraw/zinc/61/50/55/728615055.db2.gz CTWGCJVNRMFIBV-AWEZNQCLSA-N 1 1 354.790 2.851 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000132272522 728724050 /nfs/dbraw/zinc/72/40/50/728724050.db2.gz MIGFUFWFQFKQJW-CYBMUJFWSA-N 1 1 373.450 2.585 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000174440779 729072001 /nfs/dbraw/zinc/07/20/01/729072001.db2.gz JDPSEPJJXGCFPS-UHFFFAOYSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000174864267 729081524 /nfs/dbraw/zinc/08/15/24/729081524.db2.gz NNYUZMXWPYUWLB-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000174864267 729081527 /nfs/dbraw/zinc/08/15/27/729081527.db2.gz NNYUZMXWPYUWLB-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000175640032 729099147 /nfs/dbraw/zinc/09/91/47/729099147.db2.gz PAWGOBCZFQFAQN-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1cccc(Br)c1[N+](=O)[O-] ZINC000856728637 730350950 /nfs/dbraw/zinc/35/09/50/730350950.db2.gz XCUIOPURIVIRTB-NSHDSACASA-N 1 1 358.236 2.880 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000856799202 730358487 /nfs/dbraw/zinc/35/84/87/730358487.db2.gz AUGGSWOJWQQVNV-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000861349815 730602915 /nfs/dbraw/zinc/60/29/15/730602915.db2.gz VUJIKWNTCMTFHF-MEDUHNTESA-N 1 1 354.428 2.583 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000925138530 738481245 /nfs/dbraw/zinc/48/12/45/738481245.db2.gz HINXVWRCUKEHSD-UKRRQHHQSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1n[nH]cc1Br ZINC000866269943 731045460 /nfs/dbraw/zinc/04/54/60/731045460.db2.gz PCSZALFPHQUQIT-MRVPVSSYSA-N 1 1 357.183 2.940 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000868424157 731291016 /nfs/dbraw/zinc/29/10/16/731291016.db2.gz YEBCHJHPKVUUBA-NSHDSACASA-N 1 1 372.263 2.745 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@@H+]1CCCO ZINC000872074963 731726846 /nfs/dbraw/zinc/72/68/46/731726846.db2.gz KZMFBUCGGWYIEK-ZFWWWQNUSA-N 1 1 353.488 2.814 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@H+]1CCCO ZINC000872074963 731726851 /nfs/dbraw/zinc/72/68/51/731726851.db2.gz KZMFBUCGGWYIEK-ZFWWWQNUSA-N 1 1 353.488 2.814 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000874830730 732104755 /nfs/dbraw/zinc/10/47/55/732104755.db2.gz SSOOZDBWODIGQO-KBPBESRZSA-N 1 1 355.797 2.625 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879962150 732810132 /nfs/dbraw/zinc/81/01/32/732810132.db2.gz MJOOOUCBUDSFCJ-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879962150 732810138 /nfs/dbraw/zinc/81/01/38/732810138.db2.gz MJOOOUCBUDSFCJ-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000782031406 738681748 /nfs/dbraw/zinc/68/17/48/738681748.db2.gz HLGRLJASVIBDBQ-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@H](C[N@@H+](C)CC)C2)ccc1[N+](=O)[O-] ZINC000888834752 734103744 /nfs/dbraw/zinc/10/37/44/734103744.db2.gz PSKLQOVGECGRHK-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1Cl ZINC000928081284 738817332 /nfs/dbraw/zinc/81/73/32/738817332.db2.gz RMDPXSJXZXNBBR-ZFWWWQNUSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cc1Cl ZINC000928081284 738817338 /nfs/dbraw/zinc/81/73/38/738817338.db2.gz RMDPXSJXZXNBBR-ZFWWWQNUSA-N 1 1 369.874 2.866 20 5 FFBDMO COc1c(O)ccc(CN2CCC(CCC[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC000892120997 734517317 /nfs/dbraw/zinc/51/73/17/734517317.db2.gz QHOATGAORFIGPN-UHFFFAOYSA-N 1 1 351.447 2.863 20 5 FFBDMO Nc1ccc(N2CCN(c3nc4ccc([N+](=O)[O-])cc4s3)CC2)c[nH+]1 ZINC000731902772 734704490 /nfs/dbraw/zinc/70/44/90/734704490.db2.gz MXDJIOWJJWCLEZ-UHFFFAOYSA-N 1 1 356.411 2.508 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000733894197 734856624 /nfs/dbraw/zinc/85/66/24/734856624.db2.gz ZDJSKSQSCYCQRZ-OAHLLOKOSA-N 1 1 352.866 2.853 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000733894197 734856627 /nfs/dbraw/zinc/85/66/27/734856627.db2.gz ZDJSKSQSCYCQRZ-OAHLLOKOSA-N 1 1 352.866 2.853 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735491018 734948101 /nfs/dbraw/zinc/94/81/01/734948101.db2.gz ZZJIATBZBNXKPU-STQMWFEESA-N 1 1 369.849 2.611 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)COC(=O)N1 ZINC000896394748 735152419 /nfs/dbraw/zinc/15/24/19/735152419.db2.gz FSJLNRIASNBVPG-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO CC[NH+](CC)Cc1cn(Cc2cc([N+](=O)[O-])ccc2Br)nn1 ZINC000900595666 735666280 /nfs/dbraw/zinc/66/62/80/735666280.db2.gz KHYTXSXCBOVDQU-UHFFFAOYSA-N 1 1 368.235 2.839 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000749561892 735731674 /nfs/dbraw/zinc/73/16/74/735731674.db2.gz QOYJDUBXPUOMQY-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]CCS(=O)(=O)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903082314 736027428 /nfs/dbraw/zinc/02/74/28/736027428.db2.gz YHXQBIYDTVWSHN-CYBMUJFWSA-N 1 1 364.423 2.728 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[N@H+]1C1CC1 ZINC000756952437 736376099 /nfs/dbraw/zinc/37/60/99/736376099.db2.gz SUAXAALEMUZGQS-PWSUYJOCSA-N 1 1 352.822 2.673 20 5 FFBDMO COc1cc(Cn2cc(C[N@@H+](C)C(C)(C)C)nn2)c([N+](=O)[O-])cc1F ZINC000905807712 736401272 /nfs/dbraw/zinc/40/12/72/736401272.db2.gz MWEDXCSPXSMZCN-UHFFFAOYSA-N 1 1 351.382 2.613 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000762968597 736888652 /nfs/dbraw/zinc/88/86/52/736888652.db2.gz OWWKDALYIVNLOP-LLVKDONJSA-N 1 1 350.400 2.631 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@H]1CCC[N@H+]1C1CCCC1 ZINC000911476065 737203232 /nfs/dbraw/zinc/20/32/32/737203232.db2.gz MDVDEHIPTMNRDZ-OAHLLOKOSA-N 1 1 353.369 2.896 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC000766615578 737245962 /nfs/dbraw/zinc/24/59/62/737245962.db2.gz FHLSQHFTMPPMOJ-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC000766615578 737245965 /nfs/dbraw/zinc/24/59/65/737245965.db2.gz FHLSQHFTMPPMOJ-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000913538177 737417186 /nfs/dbraw/zinc/41/71/86/737417186.db2.gz VQPNKJZIOIEXQH-OKILXGFUSA-N 1 1 358.423 2.637 20 5 FFBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000913538177 737417189 /nfs/dbraw/zinc/41/71/89/737417189.db2.gz VQPNKJZIOIEXQH-OKILXGFUSA-N 1 1 358.423 2.637 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000769141860 737500445 /nfs/dbraw/zinc/50/04/45/737500445.db2.gz NITRCCSPDXNQTL-RKDXNWHRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000769141860 737500447 /nfs/dbraw/zinc/50/04/47/737500447.db2.gz NITRCCSPDXNQTL-RKDXNWHRSA-N 1 1 374.210 2.661 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999711 737588807 /nfs/dbraw/zinc/58/88/07/737588807.db2.gz FRNRHPJTZLIGFO-WMZOPIPTSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999711 737588808 /nfs/dbraw/zinc/58/88/08/737588808.db2.gz FRNRHPJTZLIGFO-WMZOPIPTSA-N 1 1 350.415 2.826 20 5 FFBDMO C[N@H+](CC(=O)OCCSc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000774346537 737982309 /nfs/dbraw/zinc/98/23/09/737982309.db2.gz VXCDKPCYFOTIQJ-CYBMUJFWSA-N 1 1 356.469 2.667 20 5 FFBDMO C[N@@H+](CC(=O)OCCSc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1 ZINC000774346537 737982317 /nfs/dbraw/zinc/98/23/17/737982317.db2.gz VXCDKPCYFOTIQJ-CYBMUJFWSA-N 1 1 356.469 2.667 20 5 FFBDMO CCOC(=O)CC[N@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CC1 ZINC000774627713 738007042 /nfs/dbraw/zinc/00/70/42/738007042.db2.gz SPBBBACZEIVVDW-UHFFFAOYSA-N 1 1 366.805 2.973 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C1CC1 ZINC000774627713 738007045 /nfs/dbraw/zinc/00/70/45/738007045.db2.gz SPBBBACZEIVVDW-UHFFFAOYSA-N 1 1 366.805 2.973 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774635465 738007762 /nfs/dbraw/zinc/00/77/62/738007762.db2.gz ITSXENFWCFKNBY-GFCCVEGCSA-N 1 1 351.838 2.829 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639364 738008198 /nfs/dbraw/zinc/00/81/98/738008198.db2.gz VTBSTNQAUKYLHA-GFCCVEGCSA-N 1 1 368.821 2.540 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639364 738008202 /nfs/dbraw/zinc/00/82/02/738008202.db2.gz VTBSTNQAUKYLHA-GFCCVEGCSA-N 1 1 368.821 2.540 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000922643843 738178574 /nfs/dbraw/zinc/17/85/74/738178574.db2.gz BVYCFPQPSSROPY-VBNZEHGJSA-N 1 1 364.471 2.535 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCOC3CCSCC3)CC2)c1 ZINC000929271182 738963426 /nfs/dbraw/zinc/96/34/26/738963426.db2.gz VPXBCARZUYGWAG-UHFFFAOYSA-N 1 1 351.472 2.629 20 5 FFBDMO CC(C)[N@H+](CCOCCO)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930357771 739093502 /nfs/dbraw/zinc/09/35/02/739093502.db2.gz CWHIBKFFVYMWIE-UHFFFAOYSA-N 1 1 361.236 2.577 20 5 FFBDMO CC(C)[N@@H+](CCOCCO)Cc1cc([N+](=O)[O-])ccc1Br ZINC000930357771 739093506 /nfs/dbraw/zinc/09/35/06/739093506.db2.gz CWHIBKFFVYMWIE-UHFFFAOYSA-N 1 1 361.236 2.577 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790543035 739467799 /nfs/dbraw/zinc/46/77/99/739467799.db2.gz OMBZVEKWQTXFBA-LLVKDONJSA-N 1 1 357.813 2.920 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCSC[C@H]1C1CC1 ZINC000933913505 739704122 /nfs/dbraw/zinc/70/41/22/739704122.db2.gz HWCZPLLZOUORBP-HNNXBMFYSA-N 1 1 365.455 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCSC[C@H]1C1CC1 ZINC000933913505 739704123 /nfs/dbraw/zinc/70/41/23/739704123.db2.gz HWCZPLLZOUORBP-HNNXBMFYSA-N 1 1 365.455 2.759 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC000935775861 740009180 /nfs/dbraw/zinc/00/91/80/740009180.db2.gz NQFFTMUAPWOXQA-SECBINFHSA-N 1 1 358.801 2.526 20 5 FFBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804809214 740906629 /nfs/dbraw/zinc/90/66/29/740906629.db2.gz SCVQLIBBOYLZSN-DGCLKSJQSA-N 1 1 359.348 2.913 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)c(F)c1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985432339 741395388 /nfs/dbraw/zinc/39/53/88/741395388.db2.gz ZSOQXOOZNVFVIR-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)c(F)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432339 741395392 /nfs/dbraw/zinc/39/53/92/741395392.db2.gz ZSOQXOOZNVFVIR-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)c(F)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432339 741395395 /nfs/dbraw/zinc/39/53/95/741395395.db2.gz ZSOQXOOZNVFVIR-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO COC[C@@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174059 741685033 /nfs/dbraw/zinc/68/50/33/741685033.db2.gz OYBCONBTXWTWKG-CPUCHLNUSA-N 1 1 350.415 2.631 20 5 FFBDMO COC[C@@H](C)[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174059 741685035 /nfs/dbraw/zinc/68/50/35/741685035.db2.gz OYBCONBTXWTWKG-CPUCHLNUSA-N 1 1 350.415 2.631 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2cc3ccccc3s2)CC1 ZINC000996429608 741991378 /nfs/dbraw/zinc/99/13/78/741991378.db2.gz QFQQLLIDCAPKRR-HZPDHXFCSA-N 1 1 359.451 2.647 20 5 FFBDMO C[N@H+]1CC[C@@H](CC(=O)N[C@@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)C1 ZINC000823593503 742942318 /nfs/dbraw/zinc/94/23/18/742942318.db2.gz AJJUJGDKKLMHSZ-XPTSAGLGSA-N 1 1 363.311 2.795 20 5 FFBDMO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CS1(=O)=O ZINC000827163978 743524048 /nfs/dbraw/zinc/52/40/48/743524048.db2.gz ALWWTXKBLMVTBT-GZMMTYOYSA-N 1 1 367.254 2.957 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000830019988 745295421 /nfs/dbraw/zinc/29/54/21/745295421.db2.gz AEFLQVVWDGXYRQ-ZIAGYGMSSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000830019988 745295425 /nfs/dbraw/zinc/29/54/25/745295425.db2.gz AEFLQVVWDGXYRQ-ZIAGYGMSSA-N 1 1 367.496 2.626 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@]2(CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000832347684 745681485 /nfs/dbraw/zinc/68/14/85/745681485.db2.gz AHMXFYZKECPNCY-KRWDZBQOSA-N 1 1 351.378 2.565 20 5 FFBDMO C[C@H]1CN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+](C2CC2)C1 ZINC000838514883 746655924 /nfs/dbraw/zinc/65/59/24/746655924.db2.gz WPYLBPIJMXLKRS-GFCCVEGCSA-N 1 1 366.849 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1CN1CCC2(C1)CC[NH2+]CC2 ZINC000843120173 747776644 /nfs/dbraw/zinc/77/66/44/747776644.db2.gz JLBNREPGTOTAMP-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO O=C(CN1CCC[C@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000843387122 747822000 /nfs/dbraw/zinc/82/20/00/747822000.db2.gz FEFXJYPLBQTVHU-STQMWFEESA-N 1 1 366.849 2.508 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(F)cc2C)CC1 ZINC000848482451 748938138 /nfs/dbraw/zinc/93/81/38/748938138.db2.gz MYTBYQQOGBSHHS-UHFFFAOYSA-N 1 1 373.450 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@H]3C[C@@]3(O)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000895651272 970809558 /nfs/dbraw/zinc/80/95/58/970809558.db2.gz ZDAVVLHWVOXKBE-OXQOHEQNSA-N 1 1 370.405 2.749 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190506 1013078420 /nfs/dbraw/zinc/07/84/20/1013078420.db2.gz VKPXWBYETPIZFF-IFXJQAMLSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190506 1013078436 /nfs/dbraw/zinc/07/84/36/1013078436.db2.gz VKPXWBYETPIZFF-IFXJQAMLSA-N 1 1 359.401 2.978 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759910042 971948216 /nfs/dbraw/zinc/94/82/16/971948216.db2.gz LILCASXRRCPVRS-OAHLLOKOSA-N 1 1 352.394 2.628 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000134883597 960091970 /nfs/dbraw/zinc/09/19/70/960091970.db2.gz LOJGNWBUKQNTKH-YJBOKZPZSA-N 1 1 353.422 2.917 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000134886727 960092820 /nfs/dbraw/zinc/09/28/20/960092820.db2.gz ZJZYVWCVHAPDSK-CJNGLKHVSA-N 1 1 354.410 2.691 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cc(C)n3)C2)cc1 ZINC001174844345 1013323375 /nfs/dbraw/zinc/32/33/75/1013323375.db2.gz WOHCIMYDSNRFRL-INIZCTEOSA-N 1 1 354.410 2.611 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001174975002 1013344738 /nfs/dbraw/zinc/34/47/38/1013344738.db2.gz IWNMSTUQBZPAKH-LBPRGKRZSA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001174975002 1013344746 /nfs/dbraw/zinc/34/47/46/1013344746.db2.gz IWNMSTUQBZPAKH-LBPRGKRZSA-N 1 1 362.361 2.623 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135240213 963858846 /nfs/dbraw/zinc/85/88/46/963858846.db2.gz WAQZPXZWILECNK-UHFFFAOYSA-N 1 1 365.389 2.855 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135240213 963858854 /nfs/dbraw/zinc/85/88/54/963858854.db2.gz WAQZPXZWILECNK-UHFFFAOYSA-N 1 1 365.389 2.855 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@](CO)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000894268813 964052673 /nfs/dbraw/zinc/05/26/73/964052673.db2.gz NISHSWFCPNLKAS-HXUWFJFHSA-N 1 1 372.421 2.835 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C ZINC001175390983 1013468435 /nfs/dbraw/zinc/46/84/35/1013468435.db2.gz UPWAULQUHBCLGL-UONOGXRCSA-N 1 1 367.446 2.815 20 5 FFBDMO CCOc1cccnc1N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001176155019 1013647318 /nfs/dbraw/zinc/64/73/18/1013647318.db2.gz UBDHIDKCADDIID-UHFFFAOYSA-N 1 1 356.426 2.753 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@@H+](C)CCN1C ZINC000895246128 968758312 /nfs/dbraw/zinc/75/83/12/968758312.db2.gz LRGZWYRJFHRBQU-CXAGYDPISA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CN(C)CC[N@@H+]1C ZINC000895246128 968758322 /nfs/dbraw/zinc/75/83/22/968758322.db2.gz LRGZWYRJFHRBQU-CXAGYDPISA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CN(C)CC[N@H+]1C ZINC000895246128 968758329 /nfs/dbraw/zinc/75/83/29/968758329.db2.gz LRGZWYRJFHRBQU-CXAGYDPISA-N 1 1 373.432 2.842 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897060586 973204800 /nfs/dbraw/zinc/20/48/00/973204800.db2.gz BKDZDDIATZEVTE-CQSZACIVSA-N 1 1 359.430 2.935 20 5 FFBDMO C[C@H](CNC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000897062349 973213095 /nfs/dbraw/zinc/21/30/95/973213095.db2.gz SVASZGLMLKLIBZ-HLLBOEOZSA-N 1 1 360.458 2.824 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000125624382 975088908 /nfs/dbraw/zinc/08/89/08/975088908.db2.gz XITYWDKTYAKGAL-HNNXBMFYSA-N 1 1 360.458 2.640 20 5 FFBDMO CC(C)CNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCC1 ZINC001167829653 976189263 /nfs/dbraw/zinc/18/92/63/976189263.db2.gz PNYKVSWLMMYCBI-UHFFFAOYSA-N 1 1 364.402 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000152204443 979133300 /nfs/dbraw/zinc/13/33/00/979133300.db2.gz DQUGJYCLARFOGL-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000152204443 979133307 /nfs/dbraw/zinc/13/33/07/979133307.db2.gz DQUGJYCLARFOGL-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000152204443 979133314 /nfs/dbraw/zinc/13/33/14/979133314.db2.gz DQUGJYCLARFOGL-AWEZNQCLSA-N 1 1 357.414 2.849 20 5 FFBDMO O=C(CC[NH2+][C@@H]1c2ccccc2OC[C@H]1F)Nc1ccccc1[N+](=O)[O-] ZINC000905535553 980458796 /nfs/dbraw/zinc/45/87/96/980458796.db2.gz BIRKGLPPQHVPHZ-FZKQIMNGSA-N 1 1 359.357 2.985 20 5 FFBDMO Cn1nnnc1C1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000877779411 1014726265 /nfs/dbraw/zinc/72/62/65/1014726265.db2.gz IABIEDJCDLQHEN-UHFFFAOYSA-N 1 1 370.335 2.517 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC000908259370 981401562 /nfs/dbraw/zinc/40/15/62/981401562.db2.gz UALMZBBQAJDFGQ-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC001212035579 981464210 /nfs/dbraw/zinc/46/42/10/981464210.db2.gz OUXXNONYDWJBML-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000878286178 1014966058 /nfs/dbraw/zinc/96/60/58/1014966058.db2.gz KIVJQCXFWCXKHH-IRXDYDNUSA-N 1 1 362.405 2.827 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000057778234 984518764 /nfs/dbraw/zinc/51/87/64/984518764.db2.gz DYHZSRBXCCTVIA-GOSISDBHSA-N 1 1 372.400 2.661 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000058276984 984571717 /nfs/dbraw/zinc/57/17/17/984571717.db2.gz YRCXORSBJYTFAU-HNNXBMFYSA-N 1 1 360.458 2.799 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764964112 984893083 /nfs/dbraw/zinc/89/30/83/984893083.db2.gz FHNFBWOENZMUQQ-OAHLLOKOSA-N 1 1 373.457 2.695 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173467126 985832233 /nfs/dbraw/zinc/83/22/33/985832233.db2.gz YENPSOLWHMOLIO-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173467126 985832246 /nfs/dbraw/zinc/83/22/46/985832246.db2.gz YENPSOLWHMOLIO-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO Cc1c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000063756322 986030501 /nfs/dbraw/zinc/03/05/01/986030501.db2.gz ZUIGOERPKCBCHM-NWDGAFQWSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000063758560 986031806 /nfs/dbraw/zinc/03/18/06/986031806.db2.gz JCRPMRWZUWLHJK-CYBMUJFWSA-N 1 1 364.402 2.745 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000152219032 987087292 /nfs/dbraw/zinc/08/72/92/987087292.db2.gz LJENJKSGYCDLLE-FQEVSTJZSA-N 1 1 366.421 2.951 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(-c2noc(-c3cc([N+](=O)[O-])cnc3C)n2)cn1 ZINC000761917652 987978601 /nfs/dbraw/zinc/97/86/01/987978601.db2.gz BKNLJPAVKLCSLO-UHFFFAOYSA-N 1 1 363.337 2.904 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589160 988764291 /nfs/dbraw/zinc/76/42/91/988764291.db2.gz JLZQMJBUKFBJDN-PIKOESSRSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589160 988764299 /nfs/dbraw/zinc/76/42/99/988764299.db2.gz JLZQMJBUKFBJDN-PIKOESSRSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589160 988764309 /nfs/dbraw/zinc/76/43/09/988764309.db2.gz JLZQMJBUKFBJDN-PIKOESSRSA-N 1 1 371.481 2.639 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]2CC1 ZINC000946589385 988765329 /nfs/dbraw/zinc/76/53/29/988765329.db2.gz WPFWSWBILYZPQJ-FCGDIQPGSA-N 1 1 361.486 2.713 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]2CC1 ZINC000946589385 988765339 /nfs/dbraw/zinc/76/53/39/988765339.db2.gz WPFWSWBILYZPQJ-FCGDIQPGSA-N 1 1 361.486 2.713 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]2CC1 ZINC000946589385 988765346 /nfs/dbraw/zinc/76/53/46/988765346.db2.gz WPFWSWBILYZPQJ-FCGDIQPGSA-N 1 1 361.486 2.713 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589448 988766094 /nfs/dbraw/zinc/76/60/94/988766094.db2.gz ZNMXLHLOOXWSAE-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589448 988766108 /nfs/dbraw/zinc/76/61/08/988766108.db2.gz ZNMXLHLOOXWSAE-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589448 988766117 /nfs/dbraw/zinc/76/61/17/988766117.db2.gz ZNMXLHLOOXWSAE-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589384 988766151 /nfs/dbraw/zinc/76/61/51/988766151.db2.gz WOGGVCZOXWZLIS-AJYBTWMASA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589384 988766158 /nfs/dbraw/zinc/76/61/58/988766158.db2.gz WOGGVCZOXWZLIS-AJYBTWMASA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1 ZINC000946589384 988766171 /nfs/dbraw/zinc/76/61/71/988766171.db2.gz WOGGVCZOXWZLIS-AJYBTWMASA-N 1 1 371.481 2.639 20 5 FFBDMO COc1cccc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000194334696 989211478 /nfs/dbraw/zinc/21/14/78/989211478.db2.gz ZHSYWNWDRDFVTL-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000194403973 989225042 /nfs/dbraw/zinc/22/50/42/989225042.db2.gz RFCDJIQGHGQMRU-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000194403973 989225049 /nfs/dbraw/zinc/22/50/49/989225049.db2.gz RFCDJIQGHGQMRU-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c([N+](=O)[O-])c1 ZINC000826109209 1015548646 /nfs/dbraw/zinc/54/86/46/1015548646.db2.gz UXAHECDOXRPZNB-IBGZPJMESA-N 1 1 361.442 2.623 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)cc1 ZINC000810052464 994679021 /nfs/dbraw/zinc/67/90/21/994679021.db2.gz ZJHXJMPPGANHTI-QUCCMNQESA-N 1 1 353.422 2.765 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495765 995571783 /nfs/dbraw/zinc/57/17/83/995571783.db2.gz XOOPITJFAOLCRZ-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495765 995571791 /nfs/dbraw/zinc/57/17/91/995571791.db2.gz XOOPITJFAOLCRZ-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000844925467 998232930 /nfs/dbraw/zinc/23/29/30/998232930.db2.gz QDGFJDYQEFRXIX-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000844925467 998232940 /nfs/dbraw/zinc/23/29/40/998232940.db2.gz QDGFJDYQEFRXIX-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO O=C1CCCCN1[C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000732807506 998780926 /nfs/dbraw/zinc/78/09/26/998780926.db2.gz PQCZVEVRTMTCDD-QGZVFWFLSA-N 1 1 361.442 2.841 20 5 FFBDMO CCOC(=O)[C@H]([NH3+])Cc1cn([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168969119 1000013547 /nfs/dbraw/zinc/01/35/47/1000013547.db2.gz CLIKJUZWJFSCSJ-FRFSOERESA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N1CC([C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169014445 1000015542 /nfs/dbraw/zinc/01/55/42/1000015542.db2.gz ZVDFNZMKEUNOPR-SQWLQELKSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]2(CC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169013965 1000015690 /nfs/dbraw/zinc/01/56/90/1000015690.db2.gz WYQQLNSUPPUZPK-VKJFTORMSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169011907 1000015713 /nfs/dbraw/zinc/01/57/13/1000015713.db2.gz NHCSVVAZHMBHEO-GJZGRUSLSA-N 1 1 353.463 2.907 20 5 FFBDMO COc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169019017 1000017409 /nfs/dbraw/zinc/01/74/09/1000017409.db2.gz GBCSMECDRHFJBD-XAUMDUMWSA-N 1 1 373.453 2.569 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](OCC3CC3)[C@@H]2Cc2cccnc2)C1 ZINC001169019034 1000017613 /nfs/dbraw/zinc/01/76/13/1000017613.db2.gz GKQHJOXLLLWKBB-FYQPLNBISA-N 1 1 359.470 2.939 20 5 FFBDMO CCN1CC[C@@]2(C[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2c2ccccc2)C1=O ZINC001169026670 1000018155 /nfs/dbraw/zinc/01/81/55/1000018155.db2.gz YNGVVWVEGYYIJR-ROPHOZQPSA-N 1 1 371.481 2.770 20 5 FFBDMO CC(=O)N1CC[C@]2(c3ccccc3)CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]12 ZINC001169024888 1000018219 /nfs/dbraw/zinc/01/82/19/1000018219.db2.gz RZHPPLDTBKZRMH-WLRLJWMZSA-N 1 1 371.481 2.696 20 5 FFBDMO CC(=O)N1CC[C@]2(c3ccccc3)CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]12 ZINC001169024886 1000018273 /nfs/dbraw/zinc/01/82/73/1000018273.db2.gz RZHPPLDTBKZRMH-NRDMVMEKSA-N 1 1 371.481 2.696 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC1(F)F ZINC001169046378 1000018539 /nfs/dbraw/zinc/01/85/39/1000018539.db2.gz LNWLJXXPSAKAPE-FRRDWIJNSA-N 1 1 363.405 2.666 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+](C2CC2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169048695 1000018655 /nfs/dbraw/zinc/01/86/55/1000018655.db2.gz APTKGIJMMDTWNL-VNQPRFMTSA-N 1 1 353.463 2.906 20 5 FFBDMO O=C1c2cccc(F)c2CN1[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169056295 1000019006 /nfs/dbraw/zinc/01/90/06/1000019006.db2.gz RGKAVOICKRGZRS-QLFBSQMISA-N 1 1 361.417 2.691 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C[C@H]1C ZINC001147743443 1000969182 /nfs/dbraw/zinc/96/91/82/1000969182.db2.gz WHNFEBQMYNFJOJ-CHWSQXEVSA-N 1 1 366.437 2.745 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001148387429 1001130634 /nfs/dbraw/zinc/13/06/34/1001130634.db2.gz CRGSMKCQTNVKAB-KUHUBIRLSA-N 1 1 368.437 2.817 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[NH+](C[C@H]3CCCO3)CC2)cccc1C(F)(F)F ZINC001184702818 1002687235 /nfs/dbraw/zinc/68/72/35/1002687235.db2.gz GRMIPQNBWSVFJJ-GFCCVEGCSA-N 1 1 359.348 2.915 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](Oc3ncncc3C)C2)c([N+](=O)[O-])c1 ZINC001170355006 1003122566 /nfs/dbraw/zinc/12/25/66/1003122566.db2.gz UIAJYXLOWWALAS-PBHICJAKSA-N 1 1 372.425 2.786 20 5 FFBDMO CCc1ncnc2c1CC[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341527 1003130564 /nfs/dbraw/zinc/13/05/64/1003130564.db2.gz QYTYRBBJRAPBGA-CQSZACIVSA-N 1 1 370.453 2.988 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000792875751 1003216970 /nfs/dbraw/zinc/21/69/70/1003216970.db2.gz JLSWVUUFNMBUIQ-GFCCVEGCSA-N 1 1 368.353 2.935 20 5 FFBDMO C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000804719819 1003801355 /nfs/dbraw/zinc/80/13/55/1003801355.db2.gz IPVKHZFPRGZMRQ-INIZCTEOSA-N 1 1 356.382 2.866 20 5 FFBDMO CCN(C)C(=O)OC[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805763146 1004138914 /nfs/dbraw/zinc/13/89/14/1004138914.db2.gz PUFOHAUYELQHDV-IRXDYDNUSA-N 1 1 365.430 2.571 20 5 FFBDMO CC[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1O ZINC001193002223 1004338405 /nfs/dbraw/zinc/33/84/05/1004338405.db2.gz LAVIBFZFVYCWPL-TVQRCGJNSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1O ZINC001193002223 1004338413 /nfs/dbraw/zinc/33/84/13/1004338413.db2.gz LAVIBFZFVYCWPL-TVQRCGJNSA-N 1 1 352.778 2.501 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685296 1004710108 /nfs/dbraw/zinc/71/01/08/1004710108.db2.gz IRRNZLKZUHUUEW-WMZOPIPTSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1[C@@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685296 1004710111 /nfs/dbraw/zinc/71/01/11/1004710111.db2.gz IRRNZLKZUHUUEW-WMZOPIPTSA-N 1 1 359.426 2.517 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776275094 1005341307 /nfs/dbraw/zinc/34/13/07/1005341307.db2.gz JGYXEPTUYHKUGR-MSOLQXFVSA-N 1 1 352.394 2.741 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077104 1005939772 /nfs/dbraw/zinc/93/97/72/1005939772.db2.gz OMMLBKFFGQGWMP-CHWSQXEVSA-N 1 1 366.418 2.723 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852077104 1005939773 /nfs/dbraw/zinc/93/97/73/1005939773.db2.gz OMMLBKFFGQGWMP-CHWSQXEVSA-N 1 1 366.418 2.723 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC001134279393 1006258366 /nfs/dbraw/zinc/25/83/66/1006258366.db2.gz NTPFJBMSVNEEBP-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC001134279393 1006258371 /nfs/dbraw/zinc/25/83/71/1006258371.db2.gz NTPFJBMSVNEEBP-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)nc1-c1ccccn1 ZINC000853517491 1006423195 /nfs/dbraw/zinc/42/31/95/1006423195.db2.gz VEVMZJRHZJRNFH-LESCRADOSA-N 1 1 371.441 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@@H](Oc4ccccc4)C3)n2)cc1 ZINC000853595356 1006467447 /nfs/dbraw/zinc/46/74/47/1006467447.db2.gz ZYOBOABFDXTECC-GOSISDBHSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](Oc4ccccc4)C3)n2)cc1 ZINC000853595356 1006467462 /nfs/dbraw/zinc/46/74/62/1006467462.db2.gz ZYOBOABFDXTECC-GOSISDBHSA-N 1 1 365.393 2.964 20 5 FFBDMO COC(=O)c1ccnc(N2CC[NH+]([C@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000882810593 1006513510 /nfs/dbraw/zinc/51/35/10/1006513510.db2.gz XHESGOWWUGPFDM-CQSZACIVSA-N 1 1 370.409 2.660 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC1)OCCCO2 ZINC000815155977 1006521887 /nfs/dbraw/zinc/52/18/87/1006521887.db2.gz PXCDCLJLFHCYMC-ZDUSSCGKSA-N 1 1 374.397 2.935 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162887 1032163673 /nfs/dbraw/zinc/16/36/73/1032163673.db2.gz YZXHORPIWLIYLZ-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162887 1032163680 /nfs/dbraw/zinc/16/36/80/1032163680.db2.gz YZXHORPIWLIYLZ-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO CO[C@H]1CCCC[C@@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093068 1006898031 /nfs/dbraw/zinc/89/80/31/1006898031.db2.gz ZSVKEDRVXUFXFL-BZSNNMDCSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@H]1CCCC[C@@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093068 1006898036 /nfs/dbraw/zinc/89/80/36/1006898036.db2.gz ZSVKEDRVXUFXFL-BZSNNMDCSA-N 1 1 362.426 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)c2c1 ZINC000776767237 1007055264 /nfs/dbraw/zinc/05/52/64/1007055264.db2.gz BONWHXGVLWWMPG-SFHVURJKSA-N 1 1 356.357 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@@](O)(c4ccc(F)cc4)C3)c2c1 ZINC000776767237 1007055283 /nfs/dbraw/zinc/05/52/83/1007055283.db2.gz BONWHXGVLWWMPG-SFHVURJKSA-N 1 1 356.357 2.635 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1OC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000816452135 1007061931 /nfs/dbraw/zinc/06/19/31/1007061931.db2.gz WQYQFXVNXJIXTJ-QAPCUYQASA-N 1 1 372.425 2.635 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000885880201 1007819504 /nfs/dbraw/zinc/81/95/04/1007819504.db2.gz ODIAPHIFMJJZJX-MRXNPFEDSA-N 1 1 361.442 2.503 20 5 FFBDMO N[C@@H](CCC[NH3+])Nc1nnc(-c2ccccc2[N+](=O)[O-])cc1C(F)(F)F ZINC001170898191 1007896614 /nfs/dbraw/zinc/89/66/14/1007896614.db2.gz BXVMUSGTUJTFPT-CYBMUJFWSA-N 1 1 370.335 2.506 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000819412347 1008141074 /nfs/dbraw/zinc/14/10/74/1008141074.db2.gz XFFNDLKOJDCEIF-HXUWFJFHSA-N 1 1 370.453 2.882 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])cc1OC ZINC000858011843 1008276888 /nfs/dbraw/zinc/27/68/88/1008276888.db2.gz RYJCEMITPFQYLP-HNNXBMFYSA-N 1 1 373.409 2.969 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])cc1OC ZINC000858011843 1008276891 /nfs/dbraw/zinc/27/68/91/1008276891.db2.gz RYJCEMITPFQYLP-HNNXBMFYSA-N 1 1 373.409 2.969 20 5 FFBDMO O=C(NCc1ccc(F)cc1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886048969 1008525644 /nfs/dbraw/zinc/52/56/44/1008525644.db2.gz CAMRMBBKKCLCKM-UHFFFAOYSA-N 1 1 372.400 2.657 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccc(OC)c(OC)c2OC)cc1[N+](=O)[O-] ZINC001177323367 1008564090 /nfs/dbraw/zinc/56/40/90/1008564090.db2.gz QUDIFBURFAGLMB-UHFFFAOYSA-N 1 1 362.382 2.919 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@](C)(O)c1ccccc1 ZINC000822515782 1008665103 /nfs/dbraw/zinc/66/51/03/1008665103.db2.gz FVRJTBLUUXXEMB-IBGZPJMESA-N 1 1 358.394 2.801 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](CO)c1ccccc1C ZINC000886433307 1008680261 /nfs/dbraw/zinc/68/02/61/1008680261.db2.gz GCOQXNDBWKXCLH-SFHVURJKSA-N 1 1 357.410 2.816 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](CO)c1ccccc1C ZINC000886433307 1008680265 /nfs/dbraw/zinc/68/02/65/1008680265.db2.gz GCOQXNDBWKXCLH-SFHVURJKSA-N 1 1 357.410 2.816 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 ZINC000860739199 1009132940 /nfs/dbraw/zinc/13/29/40/1009132940.db2.gz ILPHLSAGRXAOBF-OCCSQVGLSA-N 1 1 374.372 2.703 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@](C)(O)c1ccccc1 ZINC000823598039 1009135629 /nfs/dbraw/zinc/13/56/29/1009135629.db2.gz DYIWRENPYOIKBB-LJQANCHMSA-N 1 1 357.410 2.763 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000823913830 1009267214 /nfs/dbraw/zinc/26/72/14/1009267214.db2.gz FFLHCWQBRJHDEZ-HNNXBMFYSA-N 1 1 355.398 2.573 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000861353165 1009371106 /nfs/dbraw/zinc/37/11/06/1009371106.db2.gz MIMAULZURQFLHR-RDTXWAMCSA-N 1 1 366.414 2.648 20 5 FFBDMO COc1cccc(OC)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001179937542 1009498865 /nfs/dbraw/zinc/49/88/65/1009498865.db2.gz MOZOCRHFMOAADY-ZDUSSCGKSA-N 1 1 358.398 2.693 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000862142302 1009716524 /nfs/dbraw/zinc/71/65/24/1009716524.db2.gz XLQMXVDAAPOHSB-SOUVJXGZSA-N 1 1 371.437 2.976 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000862142302 1009716534 /nfs/dbraw/zinc/71/65/34/1009716534.db2.gz XLQMXVDAAPOHSB-SOUVJXGZSA-N 1 1 371.437 2.976 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1cc(F)ccc1[N+](=O)[O-] ZINC000794588366 1010392679 /nfs/dbraw/zinc/39/26/79/1010392679.db2.gz SSWWTSTVFBHJQT-OAHLLOKOSA-N 1 1 359.357 2.553 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261081 1010936364 /nfs/dbraw/zinc/93/63/64/1010936364.db2.gz MHIASBXITSYPTA-HOTGVXAUSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261081 1010936370 /nfs/dbraw/zinc/93/63/70/1010936370.db2.gz MHIASBXITSYPTA-HOTGVXAUSA-N 1 1 371.441 2.949 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121159971 1011024252 /nfs/dbraw/zinc/02/42/52/1011024252.db2.gz WARWWDLZBUJJCG-OAHLLOKOSA-N 1 1 373.457 2.839 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121159971 1011024256 /nfs/dbraw/zinc/02/42/56/1011024256.db2.gz WARWWDLZBUJJCG-OAHLLOKOSA-N 1 1 373.457 2.839 20 5 FFBDMO COc1ccc([C@H]2CCN(C(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000867954428 1011130843 /nfs/dbraw/zinc/13/08/43/1011130843.db2.gz MWGJIBRIUDSKGH-MGPUTAFESA-N 1 1 369.421 2.793 20 5 FFBDMO CN1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000867962524 1011133639 /nfs/dbraw/zinc/13/36/39/1011133639.db2.gz QFMQJVWAYLIICH-IBGZPJMESA-N 1 1 354.410 2.642 20 5 FFBDMO COc1ncnc2c1CC[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172915462 1012099026 /nfs/dbraw/zinc/09/90/26/1012099026.db2.gz NBDCRMVSFBYTQT-HNNXBMFYSA-N 1 1 354.410 2.699 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@@H](CO)CC3)CC2)c(F)c1 ZINC001173010004 1012179510 /nfs/dbraw/zinc/17/95/10/1012179510.db2.gz KPOCRVHABVHDQQ-CYBMUJFWSA-N 1 1 369.412 2.936 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000870138567 1012183859 /nfs/dbraw/zinc/18/38/59/1012183859.db2.gz MPWRKDMXMLWWRX-OINDORCXSA-N 1 1 367.405 2.790 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870139948 1012186693 /nfs/dbraw/zinc/18/66/93/1012186693.db2.gz ZFDURNFYWJICQG-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC[NH2+]2)cc1 ZINC000870143683 1012194419 /nfs/dbraw/zinc/19/44/19/1012194419.db2.gz WOVAUZSRBYIIBU-SFHVURJKSA-N 1 1 369.421 2.627 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2nccc(Cl)n2)c1F ZINC001173193759 1012335940 /nfs/dbraw/zinc/33/59/40/1012335940.db2.gz XBSKZQBYUFWBNM-VIFPVBQESA-N 1 1 354.769 2.907 20 5 FFBDMO COC(=O)C[C@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173194309 1012337449 /nfs/dbraw/zinc/33/74/49/1012337449.db2.gz ZHDMEUQWDABHGR-NWDGAFQWSA-N 1 1 354.378 2.559 20 5 FFBDMO CC[N@@H+]1C[C@H]2CN([C@@H](C)Cc3c(F)c(OC)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC001173193920 1012338494 /nfs/dbraw/zinc/33/84/94/1012338494.db2.gz SBGGLIQETRRLJM-MELADBBJSA-N 1 1 351.422 2.557 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2ccccn2)C1 ZINC001173237415 1012380989 /nfs/dbraw/zinc/38/09/89/1012380989.db2.gz JEWBJWPZLKOBFC-NVXWUHKLSA-N 1 1 368.437 2.815 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@H]([C@H]2CCCCO2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870955490 1012649785 /nfs/dbraw/zinc/64/97/85/1012649785.db2.gz YLTRSEMUOHINBG-POZUXBRTSA-N 1 1 361.442 2.576 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1 ZINC000748728675 1017579198 /nfs/dbraw/zinc/57/91/98/1017579198.db2.gz QVDRSMBQTWNHQK-ZDUSSCGKSA-N 1 1 364.402 2.582 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)cc1[N+](=O)[O-] ZINC000827748088 1018637114 /nfs/dbraw/zinc/63/71/14/1018637114.db2.gz WDUVXRQVYYSBRM-UHFFFAOYSA-N 1 1 364.421 2.500 20 5 FFBDMO C[N@@H+]1CCC[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000681997541 1018663911 /nfs/dbraw/zinc/66/39/11/1018663911.db2.gz VZTRNIZSAQRMBV-ZDUSSCGKSA-N 1 1 371.387 2.784 20 5 FFBDMO C[N@H+]1CCC[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000681997541 1018663913 /nfs/dbraw/zinc/66/39/13/1018663913.db2.gz VZTRNIZSAQRMBV-ZDUSSCGKSA-N 1 1 371.387 2.784 20 5 FFBDMO Cc1cnc(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000828806669 1032846302 /nfs/dbraw/zinc/84/63/02/1032846302.db2.gz BFKLVNJPPXIYEP-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO Cc1cnc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cn1 ZINC000828806669 1032846315 /nfs/dbraw/zinc/84/63/15/1032846315.db2.gz BFKLVNJPPXIYEP-IYARVYRRSA-N 1 1 356.426 2.999 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]Cc2cccc(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048607320 1020350644 /nfs/dbraw/zinc/35/06/44/1020350644.db2.gz AQQDTDPOWUWQGA-DTTOXWODSA-N 1 1 363.433 2.503 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1 ZINC000931307640 1020414045 /nfs/dbraw/zinc/41/40/45/1020414045.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931307640 1020414048 /nfs/dbraw/zinc/41/40/48/1020414048.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@]2(C)CN(C)C[C@@]2(C)C1 ZINC000931307640 1020414055 /nfs/dbraw/zinc/41/40/55/1020414055.db2.gz NOKLCXGXDPBTRT-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C(=O)OC(C)(C)C ZINC000828917413 1032904904 /nfs/dbraw/zinc/90/49/04/1032904904.db2.gz GNKMNPSRINAPKF-XOKHGSTOSA-N 1 1 364.442 2.928 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000800858635 1020603668 /nfs/dbraw/zinc/60/36/68/1020603668.db2.gz AXXFEGWXKJDUDK-CQSZACIVSA-N 1 1 354.414 2.824 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)COC(=O)N1 ZINC000932016178 1020666896 /nfs/dbraw/zinc/66/68/96/1020666896.db2.gz JJYNESCJPRKCDK-KDOFPFPSSA-N 1 1 363.414 2.574 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2nc3c(s2)CCC3)C1 ZINC000932192445 1020738442 /nfs/dbraw/zinc/73/84/42/1020738442.db2.gz XFJSELWAQURLBF-CYBMUJFWSA-N 1 1 374.466 2.581 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1c1ccnn1C ZINC000932266319 1020759464 /nfs/dbraw/zinc/75/94/64/1020759464.db2.gz PZCIKFNGGNGNSS-QGZVFWFLSA-N 1 1 357.414 2.802 20 5 FFBDMO CN(C)CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381662 1020815237 /nfs/dbraw/zinc/81/52/37/1020815237.db2.gz YJILUSYDGYZVSW-KSZLIROESA-N 1 1 372.473 2.953 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC2(CC1)C[C@H](O)c1ccccc1O2 ZINC000933065387 1020947393 /nfs/dbraw/zinc/94/73/93/1020947393.db2.gz IDKRVIAUDNIBRP-INIZCTEOSA-N 1 1 355.394 2.841 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000749802207 1021037413 /nfs/dbraw/zinc/03/74/13/1021037413.db2.gz MWFHOJSOUIGSSY-UHFFFAOYSA-N 1 1 367.450 2.559 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000749813464 1021043196 /nfs/dbraw/zinc/04/31/96/1021043196.db2.gz ZSFSKAMKKDDKDD-OAHLLOKOSA-N 1 1 365.430 2.915 20 5 FFBDMO O=c1oc2cc(O)ccc2c2oc3cc(O[C@H]4C[NH2+]CCOC4)ccc3c21 ZINC001218041943 1032967376 /nfs/dbraw/zinc/96/73/76/1032967376.db2.gz JNFKNYIIGGOLSU-ZDUSSCGKSA-N 1 1 367.357 2.765 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NCc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001116729472 1021380209 /nfs/dbraw/zinc/38/02/09/1021380209.db2.gz UBIRJTBONWWXCX-IYBDPMFKSA-N 1 1 370.453 2.941 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116861409 1021459123 /nfs/dbraw/zinc/45/91/23/1021459123.db2.gz MUDSJQGKUVOXRF-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116861409 1021459124 /nfs/dbraw/zinc/45/91/24/1021459124.db2.gz MUDSJQGKUVOXRF-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000041864696 1022115164 /nfs/dbraw/zinc/11/51/64/1022115164.db2.gz JZLRHLTVKVXBFE-ONWOKCAKSA-N 1 1 361.442 2.612 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1 ZINC000189961941 1023376765 /nfs/dbraw/zinc/37/67/65/1023376765.db2.gz CLEIPBMAMIHDEB-IBGZPJMESA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@@]1(O)CCc2ccccc21 ZINC000829377246 1033128274 /nfs/dbraw/zinc/12/82/74/1033128274.db2.gz SKRFWDPWAAUGIU-SFHVURJKSA-N 1 1 357.366 2.769 20 5 FFBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@@]1(O)CCc2ccccc21 ZINC000829377246 1033128283 /nfs/dbraw/zinc/12/82/83/1033128283.db2.gz SKRFWDPWAAUGIU-SFHVURJKSA-N 1 1 357.366 2.769 20 5 FFBDMO C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000755891978 1023647506 /nfs/dbraw/zinc/64/75/06/1023647506.db2.gz YYSQSKLHASXCTN-DOTOQJQBSA-N 1 1 372.425 2.635 20 5 FFBDMO C[C@@]1(COC(=O)Cn2ccc([N+](=O)[O-])n2)CCCC[N@H+]1Cc1ccccc1 ZINC000755914571 1023650341 /nfs/dbraw/zinc/65/03/41/1023650341.db2.gz FJOLOWABOBJESR-IBGZPJMESA-N 1 1 372.425 2.779 20 5 FFBDMO O=C(OC[C@H]1CC[N@H+]1C1CCOCC1)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC001123248115 1023707081 /nfs/dbraw/zinc/70/70/81/1023707081.db2.gz QCYDBDUMWVGCED-OAHLLOKOSA-N 1 1 360.366 2.751 20 5 FFBDMO CCC[C@@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000757610422 1023836987 /nfs/dbraw/zinc/83/69/87/1023836987.db2.gz MWSUHVDWGANHBP-AUUYWEPGSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000758998258 1024417431 /nfs/dbraw/zinc/41/74/31/1024417431.db2.gz AVMWGRSKXGWCEG-CYBMUJFWSA-N 1 1 360.414 2.689 20 5 FFBDMO C[C@@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000758998258 1024417437 /nfs/dbraw/zinc/41/74/37/1024417437.db2.gz AVMWGRSKXGWCEG-CYBMUJFWSA-N 1 1 360.414 2.689 20 5 FFBDMO O=C(N1CC[NH2+][C@@H](c2ccccc2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000837158888 1025624133 /nfs/dbraw/zinc/62/41/33/1025624133.db2.gz DNFRNIXSPXBEFJ-MRXNPFEDSA-N 1 1 361.348 2.860 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)OCC[C@@H]1CCCC[N@@H+]1C ZINC000838096679 1026203664 /nfs/dbraw/zinc/20/36/64/1026203664.db2.gz OUIGQQNGTWCTEA-LBPRGKRZSA-N 1 1 367.377 2.724 20 5 FFBDMO CN(C)C(=O)OC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000840091347 1026953017 /nfs/dbraw/zinc/95/30/17/1026953017.db2.gz VIOZSWCGSFFDNW-UHFFFAOYSA-N 1 1 373.413 2.578 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)n2)c1 ZINC000840114437 1026961916 /nfs/dbraw/zinc/96/19/16/1026961916.db2.gz IDYXXGVHKPOWCI-RCCFBDPRSA-N 1 1 371.441 2.826 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cnc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000840116296 1026962831 /nfs/dbraw/zinc/96/28/31/1026962831.db2.gz OAKLXBMMMKTGTO-GFIVTLFCSA-N 1 1 351.410 2.955 20 5 FFBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000840117172 1026964449 /nfs/dbraw/zinc/96/44/49/1026964449.db2.gz SKSGVOHMYIMWDP-DJIMGWMZSA-N 1 1 359.430 2.621 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CC[C@@H]([NH3+])[C@@H](F)C1 ZINC001160649336 1027786840 /nfs/dbraw/zinc/78/68/40/1027786840.db2.gz ITDLELACMWTOQD-HBMCJLEFSA-N 1 1 365.452 2.761 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795718179 1027965368 /nfs/dbraw/zinc/96/53/68/1027965368.db2.gz LDCSBMJLKCCMAX-OAHLLOKOSA-N 1 1 372.347 2.990 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795718179 1027965385 /nfs/dbraw/zinc/96/53/85/1027965385.db2.gz LDCSBMJLKCCMAX-OAHLLOKOSA-N 1 1 372.347 2.990 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000795718702 1027982149 /nfs/dbraw/zinc/98/21/49/1027982149.db2.gz MQISQWPOSNOVMY-HNNXBMFYSA-N 1 1 372.347 2.990 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000795718702 1027982164 /nfs/dbraw/zinc/98/21/64/1027982164.db2.gz MQISQWPOSNOVMY-HNNXBMFYSA-N 1 1 372.347 2.990 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000795754624 1028097770 /nfs/dbraw/zinc/09/77/70/1028097770.db2.gz ZGVGCABVKAEISN-UHFFFAOYSA-N 1 1 374.397 2.507 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC001161885283 1028349225 /nfs/dbraw/zinc/34/92/25/1028349225.db2.gz MFHONRRTWGICHW-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001154713355 1028419227 /nfs/dbraw/zinc/41/92/27/1028419227.db2.gz JPGIVEWQERUMPZ-ADAWSYLGSA-N 1 1 363.458 2.906 20 5 FFBDMO CC1(C)C[N@H+](CCNc2c3cccc(Cl)c3ncc2[N+](=O)[O-])CCO1 ZINC001162334396 1028505126 /nfs/dbraw/zinc/50/51/26/1028505126.db2.gz WMDHRKOUHJBSRV-UHFFFAOYSA-N 1 1 364.833 2.741 20 5 FFBDMO CC1(C)C[N@@H+](CCNc2c3cccc(Cl)c3ncc2[N+](=O)[O-])CCO1 ZINC001162334396 1028505135 /nfs/dbraw/zinc/50/51/35/1028505135.db2.gz WMDHRKOUHJBSRV-UHFFFAOYSA-N 1 1 364.833 2.741 20 5 FFBDMO CC[N@H+](Cc1cccc(F)c1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713052 1028582391 /nfs/dbraw/zinc/58/23/91/1028582391.db2.gz JEVRUYNFPUIFTK-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@@H+](Cc1cccc(F)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713052 1028582399 /nfs/dbraw/zinc/58/23/99/1028582399.db2.gz JEVRUYNFPUIFTK-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@H+](Cc1cccc(F)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713052 1028582410 /nfs/dbraw/zinc/58/24/10/1028582410.db2.gz JEVRUYNFPUIFTK-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC001162882186 1028692888 /nfs/dbraw/zinc/69/28/88/1028692888.db2.gz ZNODBLLIHWOJBW-HNNXBMFYSA-N 1 1 359.430 2.697 20 5 FFBDMO COc1cnc(N2CC[NH+](C[C@H](OC)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001155715411 1028866308 /nfs/dbraw/zinc/86/63/08/1028866308.db2.gz KGPOQLIOOPTJPY-SFHVURJKSA-N 1 1 372.425 2.508 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CCN(c3ccc(O)cc3)CC2)ncc1[N+](=O)[O-] ZINC001163817911 1029075756 /nfs/dbraw/zinc/07/57/56/1029075756.db2.gz DLZQZDHZDHIIHR-BQYQJAHWSA-N 1 1 369.425 2.554 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccccc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782485185 1029714932 /nfs/dbraw/zinc/71/49/32/1029714932.db2.gz YPEOHGBKVOAWQV-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCC2CCC3(CCC(=O)N3)CC2)ncc1[N+](=O)[O-] ZINC001158408831 1029822173 /nfs/dbraw/zinc/82/21/73/1029822173.db2.gz CRCFHWWCUAVUCT-UXBLZVDNSA-N 1 1 373.457 2.773 20 5 FFBDMO CC(C)(C)C[C@@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1 ZINC000782859783 1029839877 /nfs/dbraw/zinc/83/98/77/1029839877.db2.gz DFLZDOSXSOUARY-AWEZNQCLSA-N 1 1 363.462 2.670 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001142221308 1030180995 /nfs/dbraw/zinc/18/09/95/1030180995.db2.gz AFWKWANNAOEVMQ-UONOGXRCSA-N 1 1 351.422 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H]3[C@H]3CCCOC3)n2)cc1 ZINC000842613230 1030821517 /nfs/dbraw/zinc/82/15/17/1030821517.db2.gz BEIIXWLQJIEDCH-DOTOQJQBSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842620102 1030834367 /nfs/dbraw/zinc/83/43/67/1030834367.db2.gz YRTATGJDMZCBII-JKSUJKDBSA-N 1 1 374.441 2.685 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796715557 1030895313 /nfs/dbraw/zinc/89/53/13/1030895313.db2.gz GIGDVFVFWCVOJU-INIZCTEOSA-N 1 1 365.430 2.963 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)C1CC1 ZINC001535253558 1069752120 /nfs/dbraw/zinc/75/21/20/1069752120.db2.gz BEOCZGLABLEKNN-UHFFFAOYSA-N 1 1 356.426 2.934 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195193 1031692204 /nfs/dbraw/zinc/69/22/04/1031692204.db2.gz WRJASIOZGTZHPS-KBPBESRZSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195193 1031692212 /nfs/dbraw/zinc/69/22/12/1031692212.db2.gz WRJASIOZGTZHPS-KBPBESRZSA-N 1 1 370.409 2.815 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC001150361410 1031704339 /nfs/dbraw/zinc/70/43/39/1031704339.db2.gz REPFHUMKCJMDNP-KRWDZBQOSA-N 1 1 354.410 2.732 20 5 FFBDMO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C[N@H+]2C1 ZINC001150828042 1031789761 /nfs/dbraw/zinc/78/97/61/1031789761.db2.gz WEGAMYCAMSUKQV-BZPMIXESSA-N 1 1 351.834 2.985 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000830213653 1033515824 /nfs/dbraw/zinc/51/58/24/1033515824.db2.gz METVVYAREMXNNU-INIZCTEOSA-N 1 1 357.385 2.872 20 5 FFBDMO Cc1ccc(NCCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)[nH+]c1 ZINC001223991603 1033676157 /nfs/dbraw/zinc/67/61/57/1033676157.db2.gz FWSDFXKSLZTBLK-UHFFFAOYSA-N 1 1 363.805 2.863 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3N)sc2C1 ZINC001138181638 1033921426 /nfs/dbraw/zinc/92/14/26/1033921426.db2.gz YMUQIXZYZBGBBB-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cc3N)sc2C1 ZINC001138181638 1033921438 /nfs/dbraw/zinc/92/14/38/1033921438.db2.gz YMUQIXZYZBGBBB-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO O=C(CO[C@H]1CC[N@@H+](Cc2ccccc2)C1)OCc1ccc([N+](=O)[O-])cc1 ZINC001224985962 1034079907 /nfs/dbraw/zinc/07/99/07/1034079907.db2.gz BTDLQHXNUMBYBP-IBGZPJMESA-N 1 1 370.405 2.929 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000831572903 1034129513 /nfs/dbraw/zinc/12/95/13/1034129513.db2.gz XDRXJPKVSMQVLT-UPJWGTAASA-N 1 1 371.359 2.998 20 5 FFBDMO O=c1cc[nH]c(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1[N+](=O)[O-] ZINC001225664526 1034358847 /nfs/dbraw/zinc/35/88/47/1034358847.db2.gz QCENFWHHGIUHTC-HLLBOEOZSA-N 1 1 355.394 2.985 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001227188876 1034966635 /nfs/dbraw/zinc/96/66/35/1034966635.db2.gz YISSVNPXFFHKOG-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])CCCO1 ZINC000835081652 1035520574 /nfs/dbraw/zinc/52/05/74/1035520574.db2.gz AYDYUPZMHTWYRZ-HNNXBMFYSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCCO1 ZINC000835081652 1035520586 /nfs/dbraw/zinc/52/05/86/1035520586.db2.gz AYDYUPZMHTWYRZ-HNNXBMFYSA-N 1 1 365.430 2.710 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001536195324 1069934262 /nfs/dbraw/zinc/93/42/62/1069934262.db2.gz OFTRJFDECHSXDR-CQSZACIVSA-N 1 1 364.402 2.614 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001536195324 1069934273 /nfs/dbraw/zinc/93/42/73/1069934273.db2.gz OFTRJFDECHSXDR-CQSZACIVSA-N 1 1 364.402 2.614 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc(C)c(Br)cc2[N+](=O)[O-])C1 ZINC001228001768 1035861769 /nfs/dbraw/zinc/86/17/69/1035861769.db2.gz USXCKOYIFPZITE-LLVKDONJSA-N 1 1 359.220 2.765 20 5 FFBDMO COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1O[C@@H]1CCc2[nH+]ccn2C1 ZINC001228967111 1036439251 /nfs/dbraw/zinc/43/92/51/1036439251.db2.gz MVBKMQNEPMNFGU-SNVBAGLBSA-N 1 1 351.746 2.625 20 5 FFBDMO C[C@@H](Oc1cc([N+](=O)[O-])ccc1[O-])[C@H]1CN(Cc2ccccc2)CCO1 ZINC001229396692 1036649312 /nfs/dbraw/zinc/64/93/12/1036649312.db2.gz WPKKCSCERXZHIX-AUUYWEPGSA-N 1 1 358.394 2.969 20 5 FFBDMO C[C@H](C[NH+]1CCOCC1)Oc1cnc2ccc(=O)n3c4ccccc4c1c23 ZINC001234710841 1037150695 /nfs/dbraw/zinc/15/06/95/1037150695.db2.gz MYXNYDABTUIFLO-CQSZACIVSA-N 1 1 363.417 2.538 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001537097845 1070119669 /nfs/dbraw/zinc/11/96/69/1070119669.db2.gz YLVWWSJLCRAZCN-WBVHZDCISA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCC4(COC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093485 1038379226 /nfs/dbraw/zinc/37/92/26/1038379226.db2.gz MLXAZVXVSLXJNK-UHFFFAOYSA-N 1 1 361.442 2.685 20 5 FFBDMO Cc1cc(N2CCOCC2)cc2nc(-c3ccc(N)c([N+](=O)[O-])c3)[nH]c21 ZINC001250953622 1038849978 /nfs/dbraw/zinc/84/99/78/1038849978.db2.gz INLNKGUFLOIZEB-UHFFFAOYSA-N 1 1 353.382 2.865 20 5 FFBDMO Cc1cc(N2CCOCC2)cc2[nH+]c(-c3ccc(N)c([N+](=O)[O-])c3)[nH]c21 ZINC001250953622 1038850008 /nfs/dbraw/zinc/85/00/08/1038850008.db2.gz INLNKGUFLOIZEB-UHFFFAOYSA-N 1 1 353.382 2.865 20 5 FFBDMO Cc1c(Cc2nnc(CC[NH+]3C[C@H](C)O[C@@H](C)C3)o2)cccc1[N+](=O)[O-] ZINC001258070587 1039152833 /nfs/dbraw/zinc/15/28/33/1039152833.db2.gz HJYGGCUKBXJXEK-STQMWFEESA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1Cc1nnc(CC[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC001258080211 1039157231 /nfs/dbraw/zinc/15/72/31/1039157231.db2.gz GLRVDWAVDKVLQD-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H](C)CC[C@@H]3CN)CC2)ccc1[N+](=O)[O-] ZINC001246555914 1039396208 /nfs/dbraw/zinc/39/62/08/1039396208.db2.gz INGQHGQDNATJBQ-RHSMWYFYSA-N 1 1 362.474 2.631 20 5 FFBDMO COc1cc(N2CCC(N3C[C@H](C)CC[C@@H]3C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001246555914 1039396221 /nfs/dbraw/zinc/39/62/21/1039396221.db2.gz INGQHGQDNATJBQ-RHSMWYFYSA-N 1 1 362.474 2.631 20 5 FFBDMO COc1nccc(C)c1-c1noc([C@@H]([NH3+])Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001248212339 1040174248 /nfs/dbraw/zinc/17/42/48/1040174248.db2.gz QTMZTFMCCZOZHZ-ZDUSSCGKSA-N 1 1 355.354 2.599 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001299674008 1040568339 /nfs/dbraw/zinc/56/83/39/1040568339.db2.gz DSOQXKRLXBOITI-BEFAXECRSA-N 1 1 366.421 2.524 20 5 FFBDMO COC(=O)[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC001254469660 1040736357 /nfs/dbraw/zinc/73/63/57/1040736357.db2.gz VJSBENDICWVRHH-SFHVURJKSA-N 1 1 361.442 2.885 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@](CO)(C(F)(F)F)C3)CC2)cc1 ZINC001254475084 1040742982 /nfs/dbraw/zinc/74/29/82/1040742982.db2.gz ZYFYDPZZQGBOCM-MRXNPFEDSA-N 1 1 373.375 2.810 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001254561858 1040798546 /nfs/dbraw/zinc/79/85/46/1040798546.db2.gz MXXGTEIHYXXHGI-FFZOFVMBSA-N 1 1 366.465 2.985 20 5 FFBDMO O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)N1CC1CC1 ZINC001254596241 1040825664 /nfs/dbraw/zinc/82/56/64/1040825664.db2.gz MVQJLLYJZUOCII-QYZOEREBSA-N 1 1 355.438 2.537 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cn(CC)nc21 ZINC001254597140 1040827962 /nfs/dbraw/zinc/82/79/62/1040827962.db2.gz UTUUDVGPXOABHV-IEBWSBKVSA-N 1 1 370.453 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCCN(Cc3ccncc3)CC1)C2 ZINC001254599744 1040829585 /nfs/dbraw/zinc/82/95/85/1040829585.db2.gz PRZNPGZAKOKYFZ-HXUWFJFHSA-N 1 1 352.438 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCC[N@H+](Cc3ccncc3)CC1)C2 ZINC001254599744 1040829597 /nfs/dbraw/zinc/82/95/97/1040829597.db2.gz PRZNPGZAKOKYFZ-HXUWFJFHSA-N 1 1 352.438 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCC[N@@H+](Cc3ccncc3)CC1)C2 ZINC001254599744 1040829611 /nfs/dbraw/zinc/82/96/11/1040829611.db2.gz PRZNPGZAKOKYFZ-HXUWFJFHSA-N 1 1 352.438 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CCn3ncc(Br)c3C1)C2 ZINC001254610173 1040839793 /nfs/dbraw/zinc/83/97/93/1040839793.db2.gz HRMMRGGFRJNGHT-ZDUSSCGKSA-N 1 1 363.215 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCn3ncc(Br)c3C1)C2 ZINC001254610173 1040839812 /nfs/dbraw/zinc/83/98/12/1040839812.db2.gz HRMMRGGFRJNGHT-ZDUSSCGKSA-N 1 1 363.215 2.537 20 5 FFBDMO CC[N@H+]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[C@@H](C)C1 ZINC001312638189 1044148036 /nfs/dbraw/zinc/14/80/36/1044148036.db2.gz PUNPQYZDONMPCJ-NSHDSACASA-N 1 1 374.363 2.849 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001320713598 1045453893 /nfs/dbraw/zinc/45/38/93/1045453893.db2.gz YEKSSSZCXBVEFY-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001320713598 1045453897 /nfs/dbraw/zinc/45/38/97/1045453897.db2.gz YEKSSSZCXBVEFY-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001324939955 1046296801 /nfs/dbraw/zinc/29/68/01/1046296801.db2.gz BURRXQQOQIEMFK-RDJZCZTQSA-N 1 1 359.430 2.680 20 5 FFBDMO Cc1cc(F)cc(C(=O)N2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)c1[N+](=O)[O-] ZINC001540113714 1070767653 /nfs/dbraw/zinc/76/76/53/1070767653.db2.gz UFNYYIWKCAHRKX-KDURUIRLSA-N 1 1 361.417 2.990 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC001540836703 1071013106 /nfs/dbraw/zinc/01/31/06/1071013106.db2.gz GTGURESEGWZUSN-SFHVURJKSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@H+]1C1CCCC1 ZINC001540836702 1071015199 /nfs/dbraw/zinc/01/51/99/1071015199.db2.gz GTGURESEGWZUSN-GOSISDBHSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001329985907 1048993063 /nfs/dbraw/zinc/99/30/63/1048993063.db2.gz QSPBKULENHWZAL-CYBMUJFWSA-N 1 1 355.398 2.845 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CCN(C[C@@H]2CCCO2)CC1 ZINC001333680208 1049050434 /nfs/dbraw/zinc/05/04/34/1049050434.db2.gz NDXYMZZMPGJMQL-INIZCTEOSA-N 1 1 353.850 2.981 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])[C@@H](C)C1 ZINC001333706602 1049067927 /nfs/dbraw/zinc/06/79/27/1049067927.db2.gz KAQGKDNDLBUIAW-DZGCQCFKSA-N 1 1 358.442 2.613 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001301878150 1051008853 /nfs/dbraw/zinc/00/88/53/1051008853.db2.gz BMAFVEBQPORVRG-PBHICJAKSA-N 1 1 368.437 2.817 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001301878153 1051009588 /nfs/dbraw/zinc/00/95/88/1051009588.db2.gz BMAFVEBQPORVRG-YOEHRIQHSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)c(N)c([N+](=O)[O-])c1 ZINC001301954340 1051018335 /nfs/dbraw/zinc/01/83/35/1051018335.db2.gz YNPSNNVDIWRRFN-MRXNPFEDSA-N 1 1 354.410 2.581 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC001343003610 1051620121 /nfs/dbraw/zinc/62/01/21/1051620121.db2.gz XPZIXRHBRPDCEL-QZTJIDSGSA-N 1 1 360.458 2.796 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC001343003612 1051620399 /nfs/dbraw/zinc/62/03/99/1051620399.db2.gz XPZIXRHBRPDCEL-ROUUACIJSA-N 1 1 360.458 2.796 20 5 FFBDMO CCC(=O)c1ccc(N[C@@H]2CCc3c([nH+]c(C)n3CCO)C2)c([N+](=O)[O-])c1 ZINC001307157064 1052259964 /nfs/dbraw/zinc/25/99/64/1052259964.db2.gz QLWFHIWUIXNFCL-CQSZACIVSA-N 1 1 372.425 2.654 20 5 FFBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cnn(Cc2ccccc2)c1 ZINC001307609389 1052326723 /nfs/dbraw/zinc/32/67/23/1052326723.db2.gz XRVKONJBHRHMIE-UHFFFAOYSA-N 1 1 368.441 2.947 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC001307655708 1052331533 /nfs/dbraw/zinc/33/15/33/1052331533.db2.gz LPTHWEOKCSMPKD-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC001307655708 1052331540 /nfs/dbraw/zinc/33/15/40/1052331540.db2.gz LPTHWEOKCSMPKD-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC001307655708 1052331549 /nfs/dbraw/zinc/33/15/49/1052331549.db2.gz LPTHWEOKCSMPKD-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC001307655710 1052332035 /nfs/dbraw/zinc/33/20/35/1052332035.db2.gz LPTHWEOKCSMPKD-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC001307655710 1052332040 /nfs/dbraw/zinc/33/20/40/1052332040.db2.gz LPTHWEOKCSMPKD-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC001307655710 1052332043 /nfs/dbraw/zinc/33/20/43/1052332043.db2.gz LPTHWEOKCSMPKD-LJQANCHMSA-N 1 1 368.437 2.912 20 5 FFBDMO CCC(C)(C)CC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC001307851177 1052356968 /nfs/dbraw/zinc/35/69/68/1052356968.db2.gz LTWYDGNEFHPHKV-UHFFFAOYSA-N 1 1 357.476 2.631 20 5 FFBDMO CC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001308029729 1052387357 /nfs/dbraw/zinc/38/73/57/1052387357.db2.gz RGVKJISEVIKUPT-SFHVURJKSA-N 1 1 358.394 2.937 20 5 FFBDMO CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001308029729 1052387360 /nfs/dbraw/zinc/38/73/60/1052387360.db2.gz RGVKJISEVIKUPT-SFHVURJKSA-N 1 1 358.394 2.937 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](c1ccccn1)C1CC1 ZINC001308100113 1052406263 /nfs/dbraw/zinc/40/62/63/1052406263.db2.gz VYHZQXIUZFJMQB-SFHVURJKSA-N 1 1 356.382 2.678 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOc3ccccc3[C@H]2CO)cc1 ZINC001308105252 1052407325 /nfs/dbraw/zinc/40/73/25/1052407325.db2.gz JDXVTFZTUKAAPV-GOSISDBHSA-N 1 1 358.394 2.792 20 5 FFBDMO O=C1N[C@@H](C2CC[NH+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)CO1 ZINC001308126202 1052412697 /nfs/dbraw/zinc/41/26/97/1052412697.db2.gz UUIFMVMJIQGDMN-MRXNPFEDSA-N 1 1 372.381 2.570 20 5 FFBDMO Cc1nnc(N(C)CCc2cccc([N+](=O)[O-])c2)n1CC[N@H+](C)C(C)C ZINC001543163310 1071399669 /nfs/dbraw/zinc/39/96/69/1071399669.db2.gz RNQLEXYVIZCZRW-UHFFFAOYSA-N 1 1 360.462 2.514 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@](O)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001348233359 1054561580 /nfs/dbraw/zinc/56/15/80/1054561580.db2.gz BPEKOZWDQIDOEN-HXUWFJFHSA-N 1 1 369.421 2.541 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@](O)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001348233359 1054561599 /nfs/dbraw/zinc/56/15/99/1054561599.db2.gz BPEKOZWDQIDOEN-HXUWFJFHSA-N 1 1 369.421 2.541 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000847254991 1055322439 /nfs/dbraw/zinc/32/24/39/1055322439.db2.gz IGNYBJMAUCTYED-HUUCEWRRSA-N 1 1 364.421 2.547 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000847445704 1055791693 /nfs/dbraw/zinc/79/16/93/1055791693.db2.gz DMJNCSPGKWHZEB-SJLPKXTDSA-N 1 1 358.442 2.679 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)N2CCc3c2ccc([N+](=O)[O-])c3F)C1 ZINC001544010821 1071580594 /nfs/dbraw/zinc/58/05/94/1071580594.db2.gz HLVZSDSPBPMVKX-KRWDZBQOSA-N 1 1 353.369 2.836 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)c1ccco1 ZINC001350753295 1055923397 /nfs/dbraw/zinc/92/33/97/1055923397.db2.gz KBJLWZSLPXFNER-HNNXBMFYSA-N 1 1 368.393 2.956 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CCC[N@H+]2Cc2ccccc21 ZINC001357702159 1055988268 /nfs/dbraw/zinc/98/82/68/1055988268.db2.gz RQHKDABPVJOJEV-KRWDZBQOSA-N 1 1 367.405 2.985 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])c4ccccc43)C2)CC1 ZINC001353245320 1056224268 /nfs/dbraw/zinc/22/42/68/1056224268.db2.gz LBTHZCOGCUYLSZ-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])[C@H]2C1 ZINC001339317273 1056324226 /nfs/dbraw/zinc/32/42/26/1056324226.db2.gz MFLUBWLKUGMFDL-CORIIIEPSA-N 1 1 351.834 2.637 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC001544296745 1071624065 /nfs/dbraw/zinc/62/40/65/1071624065.db2.gz FWSPIJRISFMBLC-QGZVFWFLSA-N 1 1 368.437 2.940 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001339414465 1056429281 /nfs/dbraw/zinc/42/92/81/1056429281.db2.gz NKOMRNIPRSXVCS-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001339414465 1056429289 /nfs/dbraw/zinc/42/92/89/1056429289.db2.gz NKOMRNIPRSXVCS-OAHLLOKOSA-N 1 1 374.397 2.953 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC001452585054 1059253637 /nfs/dbraw/zinc/25/36/37/1059253637.db2.gz XWHODHRUQUIVNJ-BETUJISGSA-N 1 1 369.849 2.958 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000848481639 1060118945 /nfs/dbraw/zinc/11/89/45/1060118945.db2.gz BBVNPTUNUFXBNZ-LMMKCTJWSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000848485390 1060126569 /nfs/dbraw/zinc/12/65/69/1060126569.db2.gz ZEPPZTISUKZNTK-PKOBYXMFSA-N 1 1 373.453 2.617 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](CN1CC[C@@H](c3ccc([N+](=O)[O-])cc3)C1=O)C2 ZINC000848486930 1060133984 /nfs/dbraw/zinc/13/39/84/1060133984.db2.gz NVYTXDKDECWDPL-FDYSRKEFSA-N 1 1 373.453 2.759 20 5 FFBDMO CCOC1(C)CC[NH+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848488076 1060135299 /nfs/dbraw/zinc/13/52/99/1060135299.db2.gz AJGPCHYZEWWJBH-KRWDZBQOSA-N 1 1 361.442 2.759 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848496904 1060167454 /nfs/dbraw/zinc/16/74/54/1060167454.db2.gz HPNTWFDOIYGTAS-RTBURBONSA-N 1 1 373.453 2.902 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H](OC2CCC2)C1 ZINC000848496904 1060167464 /nfs/dbraw/zinc/16/74/64/1060167464.db2.gz HPNTWFDOIYGTAS-RTBURBONSA-N 1 1 373.453 2.902 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]21 ZINC000848585180 1060313451 /nfs/dbraw/zinc/31/34/51/1060313451.db2.gz MVHKJARKJBATEW-SWLSCSKDSA-N 1 1 369.368 2.509 20 5 FFBDMO C[C@H]([N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)(C)O ZINC001460127268 1060901906 /nfs/dbraw/zinc/90/19/06/1060901906.db2.gz VFVSNOYOSNZORR-VIFPVBQESA-N 1 1 354.794 2.889 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC2 ZINC001460742452 1061083884 /nfs/dbraw/zinc/08/38/84/1061083884.db2.gz CVBHBOCOBZLUBS-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC2 ZINC001460742452 1061083899 /nfs/dbraw/zinc/08/38/99/1061083899.db2.gz CVBHBOCOBZLUBS-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC001460890161 1061140140 /nfs/dbraw/zinc/14/01/40/1061140140.db2.gz NESILOLCTSASSK-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC001460890161 1061140147 /nfs/dbraw/zinc/14/01/47/1061140147.db2.gz NESILOLCTSASSK-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001460898447 1061144221 /nfs/dbraw/zinc/14/42/21/1061144221.db2.gz GLEXBSLUEGSIJD-ZUZCIYMTSA-N 1 1 355.847 2.872 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001460898447 1061144228 /nfs/dbraw/zinc/14/42/28/1061144228.db2.gz GLEXBSLUEGSIJD-ZUZCIYMTSA-N 1 1 355.847 2.872 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])s1 ZINC001463989560 1062368380 /nfs/dbraw/zinc/36/83/80/1062368380.db2.gz ALFIUUSRQRULCW-UHFFFAOYSA-N 1 1 373.500 2.604 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[N@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])s1 ZINC001463989560 1062368404 /nfs/dbraw/zinc/36/84/04/1062368404.db2.gz ALFIUUSRQRULCW-UHFFFAOYSA-N 1 1 373.500 2.604 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001438843571 1063052422 /nfs/dbraw/zinc/05/24/22/1063052422.db2.gz RULPCWZTZGOARV-LBPRGKRZSA-N 1 1 374.363 2.626 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@H]1C(C)(C)C ZINC001469617981 1064180352 /nfs/dbraw/zinc/18/03/52/1064180352.db2.gz JXICDJVEMZOLBC-NSHDSACASA-N 1 1 372.828 2.772 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@H]1C(C)(C)C ZINC001469617981 1064180356 /nfs/dbraw/zinc/18/03/56/1064180356.db2.gz JXICDJVEMZOLBC-NSHDSACASA-N 1 1 372.828 2.772 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@@H](O)CC2)o1 ZINC001473513144 1065276166 /nfs/dbraw/zinc/27/61/66/1065276166.db2.gz NSEBHENDGLBQKN-LLVKDONJSA-N 1 1 352.778 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@@H](O)CC2)o1 ZINC001473513144 1065276175 /nfs/dbraw/zinc/27/61/75/1065276175.db2.gz NSEBHENDGLBQKN-LLVKDONJSA-N 1 1 352.778 2.645 20 5 FFBDMO C[C@@]([NH3+])(C(=O)Nc1cc(F)c(F)c(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC001576085170 1078193765 /nfs/dbraw/zinc/19/37/65/1078193765.db2.gz JKGJPANJGZFDQJ-HNNXBMFYSA-N 1 1 357.263 2.964 20 5 FFBDMO Cn1cc(CN2C[C@]3(C)C[N@@H+](Cc4ccccc4)C[C@]3(C)C2)c([N+](=O)[O-])n1 ZINC001473718103 1065330257 /nfs/dbraw/zinc/33/02/57/1065330257.db2.gz FCISOGRZAFEJFH-BGYRXZFFSA-N 1 1 369.469 2.672 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ncccc1C ZINC001473879789 1065402910 /nfs/dbraw/zinc/40/29/10/1065402910.db2.gz MPNUVFLTTAYWDE-QWHCGFSZSA-N 1 1 358.398 2.985 20 5 FFBDMO Cn1c[nH+]c2c1ccc1c2CCCN1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001473881829 1065403924 /nfs/dbraw/zinc/40/39/24/1065403924.db2.gz NETFYMURQYFKAU-SFHVURJKSA-N 1 1 352.394 2.968 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NCc3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC001474303327 1065489646 /nfs/dbraw/zinc/48/96/46/1065489646.db2.gz XNAXUKMPBYDCHP-ZKYQVNSYSA-N 1 1 354.248 2.787 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NCc3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC001474303325 1065490123 /nfs/dbraw/zinc/49/01/23/1065490123.db2.gz XNAXUKMPBYDCHP-SUHUHFCYSA-N 1 1 354.248 2.787 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2N)cc1)[NH+]1CCOCC1 ZINC001585567030 1079476036 /nfs/dbraw/zinc/47/60/36/1079476036.db2.gz LPISKBNIVYOSFO-ZDUSSCGKSA-N 1 1 370.409 2.823 20 5 FFBDMO CCc1cc(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559199999 1076134228 /nfs/dbraw/zinc/13/42/28/1076134228.db2.gz JGYRDIFVZMNFSN-RHSMWYFYSA-N 1 1 353.426 2.755 20 5 FFBDMO CCOC(=O)N1CC[C@H]([NH2+]Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001560444923 1076273695 /nfs/dbraw/zinc/27/36/95/1076273695.db2.gz HEJHDXOMFWRKRP-JTQLQIEISA-N 1 1 372.219 2.678 20 5 FFBDMO COC(=O)c1c[nH]c(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c1C1CC1 ZINC001560705682 1076293085 /nfs/dbraw/zinc/29/30/85/1076293085.db2.gz OSYGGYYQPVCIFP-UHFFFAOYSA-N 1 1 359.382 2.885 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1F ZINC001567641675 1077040335 /nfs/dbraw/zinc/04/03/35/1077040335.db2.gz OTCLXOIKRBBAJI-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1F ZINC001567641675 1077040340 /nfs/dbraw/zinc/04/03/40/1077040340.db2.gz OTCLXOIKRBBAJI-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1F ZINC001567641675 1077040343 /nfs/dbraw/zinc/04/03/43/1077040343.db2.gz OTCLXOIKRBBAJI-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590050736 1080979952 /nfs/dbraw/zinc/97/99/52/1080979952.db2.gz OMVDNBFKSNMSAH-SJKOYZFVSA-N 1 1 368.397 2.501 20 5 FFBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590075516 1080991355 /nfs/dbraw/zinc/99/13/55/1080991355.db2.gz FVLNMOACUZUYKS-GFCCVEGCSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590164679 1081063376 /nfs/dbraw/zinc/06/33/76/1081063376.db2.gz GSTNLWMTUYNFGI-KWQFWETISA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC001590188082 1081078119 /nfs/dbraw/zinc/07/81/19/1081078119.db2.gz PRDVKQCJBVROLQ-XQQFMLRXSA-N 1 1 359.434 2.553 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590187834 1081078448 /nfs/dbraw/zinc/07/84/48/1081078448.db2.gz NXFKVPCKFCDPGJ-BETUJISGSA-N 1 1 359.434 2.555 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000368867768 512110482 /nfs/dbraw/zinc/11/04/82/512110482.db2.gz JWXPNZHHGRZFPS-QGZVFWFLSA-N 1 1 361.398 2.870 20 5 FFBDMO CCC(=O)N1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000104675606 250181574 /nfs/dbraw/zinc/18/15/74/250181574.db2.gz RYIZVCZKOVBDRQ-UHFFFAOYSA-N 1 1 372.425 2.737 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC[C@H]2CCOC2)CC1 ZINC000132011657 251036644 /nfs/dbraw/zinc/03/66/44/251036644.db2.gz CMRMIQSLBZALEZ-AWEZNQCLSA-N 1 1 350.415 2.621 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+](CCCN2CCOCC2)Cc2ccncc2)c1 ZINC000272391664 252027552 /nfs/dbraw/zinc/02/75/52/252027552.db2.gz GVFDBBHRTLPZFB-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCN2CCOCC2)Cc2ccncc2)c1 ZINC000272391664 252027556 /nfs/dbraw/zinc/02/75/56/252027556.db2.gz GVFDBBHRTLPZFB-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@H]2C1 ZINC000272496047 252052836 /nfs/dbraw/zinc/05/28/36/252052836.db2.gz VCVCVOZYXSYEMY-GWCFXTLKSA-N 1 1 370.356 2.754 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272510456 252056624 /nfs/dbraw/zinc/05/66/24/252056624.db2.gz IWLHHDHJBGLMTL-QUCCMNQESA-N 1 1 366.421 2.915 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272527028 252060985 /nfs/dbraw/zinc/06/09/85/252060985.db2.gz MGGNGMVKISUEHY-CRAIPNDOSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1cc(CN2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000272634390 252085902 /nfs/dbraw/zinc/08/59/02/252085902.db2.gz NOMHMQKGRILEIG-RISCZKNCSA-N 1 1 371.384 2.731 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C1=CC[N@@H+](C)CC1 ZINC000273007126 252188990 /nfs/dbraw/zinc/18/89/90/252188990.db2.gz RVPCVIVXTHVHMW-HNNXBMFYSA-N 1 1 372.469 2.965 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1 ZINC000273446847 252308029 /nfs/dbraw/zinc/30/80/29/252308029.db2.gz NYTGETGAKGPJJX-LLVKDONJSA-N 1 1 370.377 2.998 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCC[C@@H](C)C1 ZINC000276125740 256074340 /nfs/dbraw/zinc/07/43/40/256074340.db2.gz ZQFDCJFJUMTMNU-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCC[C@@H](C)C1 ZINC000276125740 256074342 /nfs/dbraw/zinc/07/43/42/256074342.db2.gz ZQFDCJFJUMTMNU-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277278308 256179998 /nfs/dbraw/zinc/17/99/98/256179998.db2.gz BBLKLQCEJXVCLZ-AWEZNQCLSA-N 1 1 364.446 2.834 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000277615580 256217711 /nfs/dbraw/zinc/21/77/11/256217711.db2.gz QJNXZEXHPGOQDY-ZIAGYGMSSA-N 1 1 361.442 2.986 20 5 FFBDMO Nc1c(F)c(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000278399616 256308184 /nfs/dbraw/zinc/30/81/84/256308184.db2.gz MUKSWTQYDMJIPV-OAHLLOKOSA-N 1 1 374.416 2.885 20 5 FFBDMO CCc1nn(C)c(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1[N+](=O)[O-] ZINC000278568462 256325865 /nfs/dbraw/zinc/32/58/65/256325865.db2.gz BPCZXWKRMIRXEJ-UHFFFAOYSA-N 1 1 358.446 2.808 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000278330127 256300004 /nfs/dbraw/zinc/30/00/04/256300004.db2.gz FUSMTUZQBDMXCC-CYBMUJFWSA-N 1 1 373.409 2.666 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000279166303 256388972 /nfs/dbraw/zinc/38/89/72/256388972.db2.gz QHSRBOHCSHIUES-AWEZNQCLSA-N 1 1 369.780 2.942 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1nc2ccccc2cc1[N+](=O)[O-] ZINC000278874268 256357175 /nfs/dbraw/zinc/35/71/75/256357175.db2.gz VPMSVSANUSSOKS-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@H+](CC(=O)Nc4ccc([N+](=O)[O-])cc4Cl)[C@H]1[C@H]3C2 ZINC000286735052 257052429 /nfs/dbraw/zinc/05/24/29/257052429.db2.gz XWFPNENRNFDXHU-YOCWQBDXSA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CC(=O)Nc4ccc([N+](=O)[O-])cc4Cl)[C@H]1[C@H]3C2 ZINC000286735052 257052430 /nfs/dbraw/zinc/05/24/30/257052430.db2.gz XWFPNENRNFDXHU-YOCWQBDXSA-N 1 1 365.817 2.542 20 5 FFBDMO Nc1ccc(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])c1 ZINC000287628068 257099487 /nfs/dbraw/zinc/09/94/87/257099487.db2.gz GZYWZKFBBOMQFA-QGZVFWFLSA-N 1 1 356.426 2.880 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](c3ccncc3)C2)c1 ZINC000289358050 257276576 /nfs/dbraw/zinc/27/65/76/257276576.db2.gz NVOMIBKVQJTHOR-AEFFLSMTSA-N 1 1 357.410 2.609 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000289788055 257299337 /nfs/dbraw/zinc/29/93/37/257299337.db2.gz HPPIEDVKQAPGIL-OAHLLOKOSA-N 1 1 354.370 2.597 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000289788055 257299338 /nfs/dbraw/zinc/29/93/38/257299338.db2.gz HPPIEDVKQAPGIL-OAHLLOKOSA-N 1 1 354.370 2.597 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H]3C[N@H+]4CCC[C@@H]4CO3)no2)c1 ZINC000289969618 257309229 /nfs/dbraw/zinc/30/92/29/257309229.db2.gz ZZAMAFLBWWOUBQ-ABAIWWIYSA-N 1 1 360.370 2.579 20 5 FFBDMO C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000290347661 257327354 /nfs/dbraw/zinc/32/73/54/257327354.db2.gz IRZCFRZZBCFTEV-BXUZGUMPSA-N 1 1 368.821 2.575 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]([NH+]2CCOCC2)[C@H]1C ZINC000290533278 257339262 /nfs/dbraw/zinc/33/92/62/257339262.db2.gz XMXKHWZEKFIPNT-GDBMZVCRSA-N 1 1 362.430 2.539 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295237866 257622864 /nfs/dbraw/zinc/62/28/64/257622864.db2.gz ZXCGTEABBPGYAX-NOZJJQNGSA-N 1 1 357.332 2.826 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@]1(C)CCCO ZINC000299646492 258013389 /nfs/dbraw/zinc/01/33/89/258013389.db2.gz KSPVYYGIHBNWNO-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1CC(C)(C)O ZINC000302517670 258104488 /nfs/dbraw/zinc/10/44/88/258104488.db2.gz WAMZHCUPSCWCJD-OAHLLOKOSA-N 1 1 370.453 2.938 20 5 FFBDMO COC(=O)c1cnc(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000302784772 258110726 /nfs/dbraw/zinc/11/07/26/258110726.db2.gz UZJICVUEICXLSL-LBPRGKRZSA-N 1 1 350.419 2.699 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[C@H]1[NH+]1CCOCC1 ZINC000301884156 258072683 /nfs/dbraw/zinc/07/26/83/258072683.db2.gz YNMILGVVSDEXPU-MAUKXSAKSA-N 1 1 368.437 2.814 20 5 FFBDMO CC[C@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000302022638 258082754 /nfs/dbraw/zinc/08/27/54/258082754.db2.gz ORBSVYMQNHZYLG-GJZGRUSLSA-N 1 1 358.442 2.733 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000331124115 258178007 /nfs/dbraw/zinc/17/80/07/258178007.db2.gz HEWLUVJYLCLMPO-CJNGLKHVSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000331124115 258178008 /nfs/dbraw/zinc/17/80/08/258178008.db2.gz HEWLUVJYLCLMPO-CJNGLKHVSA-N 1 1 351.472 2.874 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000332656361 258239417 /nfs/dbraw/zinc/23/94/17/258239417.db2.gz JQUOXJYLIIKZTB-YPMHNXCESA-N 1 1 360.439 2.931 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1 ZINC000370945258 512146760 /nfs/dbraw/zinc/14/67/60/512146760.db2.gz UACDKDMVABIFKG-LBPRGKRZSA-N 1 1 359.361 2.951 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1SC ZINC000368971036 512162706 /nfs/dbraw/zinc/16/27/06/512162706.db2.gz YSXUKZUSMLIWEH-LBPRGKRZSA-N 1 1 365.455 2.636 20 5 FFBDMO COCC[C@@H]1CCCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000375103319 512163696 /nfs/dbraw/zinc/16/36/96/512163696.db2.gz CCTHYSRELDNCTL-HNNXBMFYSA-N 1 1 361.442 2.623 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000065881509 506384988 /nfs/dbraw/zinc/38/49/88/506384988.db2.gz NLKCSASIIDEXIT-WBVHZDCISA-N 1 1 368.437 2.958 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000053546179 506402614 /nfs/dbraw/zinc/40/26/14/506402614.db2.gz ULKLTFRVSNWGAS-UHFFFAOYSA-N 1 1 363.337 2.613 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000053721427 506435931 /nfs/dbraw/zinc/43/59/31/506435931.db2.gz WYFYAXIHQBTPIL-CQSZACIVSA-N 1 1 357.414 2.804 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CCc2ccccc2)CC1 ZINC000054149082 506501128 /nfs/dbraw/zinc/50/11/28/506501128.db2.gz PKILCZHDXOPHPC-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000054645705 506595181 /nfs/dbraw/zinc/59/51/81/506595181.db2.gz GJLMYMOKBIUQEG-GOSISDBHSA-N 1 1 368.437 2.711 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)[NH+]1CCOCC1 ZINC000067162308 506779272 /nfs/dbraw/zinc/77/92/72/506779272.db2.gz CVQWPFNQQSZQHO-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1ccc(C(=O)N2CC[NH+](CCc3cccs3)CC2)cc1[N+](=O)[O-] ZINC000055643026 506811630 /nfs/dbraw/zinc/81/16/30/506811630.db2.gz XUTAOFGISBXTIJ-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CCc2cccs2)CC1 ZINC000055643959 506811686 /nfs/dbraw/zinc/81/16/86/506811686.db2.gz DGTIJIYQWCUTBE-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067379429 506851963 /nfs/dbraw/zinc/85/19/63/506851963.db2.gz VATUFGODFSETGS-VQIMIIECSA-N 1 1 366.421 2.887 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000067379429 506851969 /nfs/dbraw/zinc/85/19/69/506851969.db2.gz VATUFGODFSETGS-VQIMIIECSA-N 1 1 366.421 2.887 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000047147921 507272721 /nfs/dbraw/zinc/27/27/21/507272721.db2.gz QQEHUXYIZRTSEZ-UONOGXRCSA-N 1 1 351.472 2.924 20 5 FFBDMO CC(=O)N(C)C1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000068577018 507277379 /nfs/dbraw/zinc/27/73/79/507277379.db2.gz UYRRRDISLCPSJD-LBPRGKRZSA-N 1 1 373.413 2.649 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Nc2cccc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000057778193 507327559 /nfs/dbraw/zinc/32/75/59/507327559.db2.gz AQILZEARDPVHIZ-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO Cc1ccc(CN(CC[NH+](C)C)C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)o1 ZINC000068936184 507364839 /nfs/dbraw/zinc/36/48/39/507364839.db2.gz XGUSSKORDATMIY-UHFFFAOYSA-N 1 1 371.397 2.577 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000023713806 507368609 /nfs/dbraw/zinc/36/86/09/507368609.db2.gz QSWSFPFSDLKWAQ-KRWDZBQOSA-N 1 1 357.410 2.565 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000068974617 507373874 /nfs/dbraw/zinc/37/38/74/507373874.db2.gz QKJQESICTNPPCA-INIZCTEOSA-N 1 1 374.485 2.658 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000375465380 512343302 /nfs/dbraw/zinc/34/33/02/512343302.db2.gz IGJLCMBWTGEASU-ZDUSSCGKSA-N 1 1 371.397 2.673 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2C1 ZINC000026156245 507561808 /nfs/dbraw/zinc/56/18/08/507561808.db2.gz GWVSNTJVMQGUHR-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO COc1ccc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000026356441 507580826 /nfs/dbraw/zinc/58/08/26/507580826.db2.gz QJXZFUPKYMLICH-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000060962016 507588156 /nfs/dbraw/zinc/58/81/56/507588156.db2.gz QATAYYHSGXJJMP-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051049561 507727637 /nfs/dbraw/zinc/72/76/37/507727637.db2.gz NQLVPFXVEBTJCG-HOTGVXAUSA-N 1 1 363.458 2.990 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000063490196 507738969 /nfs/dbraw/zinc/73/89/69/507738969.db2.gz WASDLXFSMVWUSB-KGLIPLIRSA-N 1 1 351.472 2.922 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000028791033 507743134 /nfs/dbraw/zinc/74/31/34/507743134.db2.gz JKXYNEBZJAYJBG-UHFFFAOYSA-N 1 1 353.422 2.524 20 5 FFBDMO COc1ccc(OCC[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000029057714 507755711 /nfs/dbraw/zinc/75/57/11/507755711.db2.gz IYRHVOJSNHPGKD-UHFFFAOYSA-N 1 1 373.409 2.577 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000029057714 507755713 /nfs/dbraw/zinc/75/57/13/507755713.db2.gz IYRHVOJSNHPGKD-UHFFFAOYSA-N 1 1 373.409 2.577 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000063822406 507773785 /nfs/dbraw/zinc/77/37/85/507773785.db2.gz RGFWHCWBCGAQMP-GFCCVEGCSA-N 1 1 352.410 2.558 20 5 FFBDMO Cc1cc(NCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)ccc1[N+](=O)[O-] ZINC000052242227 507803989 /nfs/dbraw/zinc/80/39/89/507803989.db2.gz DFWZLHBBAJLLFU-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000072860146 507865702 /nfs/dbraw/zinc/86/57/02/507865702.db2.gz DSEGCQSEGMBDPR-STQMWFEESA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(OCCCO)CC3)co2)cc1 ZINC000089909479 507882081 /nfs/dbraw/zinc/88/20/81/507882081.db2.gz IISBWVLHWFNGOX-UHFFFAOYSA-N 1 1 361.398 2.613 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108300927 507885235 /nfs/dbraw/zinc/88/52/35/507885235.db2.gz AXRNLILVZLCVSU-CQSZACIVSA-N 1 1 372.450 2.932 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000108336559 507887865 /nfs/dbraw/zinc/88/78/65/507887865.db2.gz BSYAUIIRFYCGIO-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](C[C@@H]2CCCO2)[C@@H]2CCSC2)c1 ZINC000089952824 507889963 /nfs/dbraw/zinc/88/99/63/507889963.db2.gz QWJHXIDGNVROHU-WBVHZDCISA-N 1 1 352.456 2.960 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](C[C@H]2CCCO2)[C@@H]2CCSC2)c1 ZINC000089952825 507890075 /nfs/dbraw/zinc/89/00/75/507890075.db2.gz QWJHXIDGNVROHU-NVXWUHKLSA-N 1 1 352.456 2.960 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000090553059 507927387 /nfs/dbraw/zinc/92/73/87/507927387.db2.gz OVDZKYVDXPJBPT-CQSZACIVSA-N 1 1 368.393 2.777 20 5 FFBDMO O=C(NC1CC1)c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000091479617 507988830 /nfs/dbraw/zinc/98/88/30/507988830.db2.gz RLUDJKKWXRLYNZ-ZDUSSCGKSA-N 1 1 355.398 2.594 20 5 FFBDMO O=C(C[N@@H+](CCO)[C@@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074312463 508010400 /nfs/dbraw/zinc/01/04/00/508010400.db2.gz CDUSRSVDWMXZRM-GOSISDBHSA-N 1 1 369.421 2.905 20 5 FFBDMO O=C(C[N@H+](CCO)[C@@H]1CCCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074312463 508010401 /nfs/dbraw/zinc/01/04/01/508010401.db2.gz CDUSRSVDWMXZRM-GOSISDBHSA-N 1 1 369.421 2.905 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000074325842 508012848 /nfs/dbraw/zinc/01/28/48/508012848.db2.gz KLPQJQGKXFJDJO-AWEZNQCLSA-N 1 1 356.426 2.880 20 5 FFBDMO COc1ccc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000110353446 508023023 /nfs/dbraw/zinc/02/30/23/508023023.db2.gz PSNHYSYYQQJESQ-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC[C@@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000110652056 508039746 /nfs/dbraw/zinc/03/97/46/508039746.db2.gz KQLWXKXSDWELGB-OAGGEKHMSA-N 1 1 374.485 2.759 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000080230700 508054452 /nfs/dbraw/zinc/05/44/52/508054452.db2.gz ZEJJLJIALRSMQQ-UKRRQHHQSA-N 1 1 369.425 2.554 20 5 FFBDMO COc1cc(C[N@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OC(F)F ZINC000111281260 508085964 /nfs/dbraw/zinc/08/59/64/508085964.db2.gz QOUMLXWETLJGOO-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OC(F)F ZINC000111281260 508085967 /nfs/dbraw/zinc/08/59/67/508085967.db2.gz QOUMLXWETLJGOO-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1[nH]nc(C)c1[N+](=O)[O-] ZINC000075323732 508097258 /nfs/dbraw/zinc/09/72/58/508097258.db2.gz BIOGCIAWQDVYCU-INIZCTEOSA-N 1 1 371.441 2.611 20 5 FFBDMO CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000075323732 508097261 /nfs/dbraw/zinc/09/72/61/508097261.db2.gz BIOGCIAWQDVYCU-INIZCTEOSA-N 1 1 371.441 2.611 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000075323732 508097262 /nfs/dbraw/zinc/09/72/62/508097262.db2.gz BIOGCIAWQDVYCU-INIZCTEOSA-N 1 1 371.441 2.611 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000075639807 508125172 /nfs/dbraw/zinc/12/51/72/508125172.db2.gz YEZMFLWGVJWQRN-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075752837 508132851 /nfs/dbraw/zinc/13/28/51/508132851.db2.gz BQNUUJUJPRPIIS-SNRMKQJTSA-N 1 1 358.442 2.934 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415467 508203903 /nfs/dbraw/zinc/20/39/03/508203903.db2.gz LOSZGBVWWFEITB-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415467 508203905 /nfs/dbraw/zinc/20/39/05/508203905.db2.gz LOSZGBVWWFEITB-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076481261 508212100 /nfs/dbraw/zinc/21/21/00/508212100.db2.gz YHKBHFBNURRJNA-DYVFJYSZSA-N 1 1 360.458 2.971 20 5 FFBDMO O=C(C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1)N1CCCC1 ZINC000083132883 508237184 /nfs/dbraw/zinc/23/71/84/508237184.db2.gz GSNRYXYMISRTMC-UHFFFAOYSA-N 1 1 358.398 2.570 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])c(N)n3)cc2)C1 ZINC000076750672 508250621 /nfs/dbraw/zinc/25/06/21/508250621.db2.gz XXHSBDXOLBNEGY-ZDUSSCGKSA-N 1 1 356.430 2.811 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000101957282 508261844 /nfs/dbraw/zinc/26/18/44/508261844.db2.gz SRZPGBUJYOCIIF-UHFFFAOYSA-N 1 1 360.439 2.932 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645231 508333320 /nfs/dbraw/zinc/33/33/20/508333320.db2.gz KDDUBHJUJBLKTA-MRXNPFEDSA-N 1 1 354.410 2.693 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645229 508333609 /nfs/dbraw/zinc/33/36/09/508333609.db2.gz KDDUBHJUJBLKTA-INIZCTEOSA-N 1 1 354.410 2.693 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087135535 508339132 /nfs/dbraw/zinc/33/91/32/508339132.db2.gz ARCLBQHASRDIHD-HUUCEWRRSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088546076 508375814 /nfs/dbraw/zinc/37/58/14/508375814.db2.gz NQQOSWKNJGWQQL-CYBMUJFWSA-N 1 1 357.414 2.504 20 5 FFBDMO Cc1cc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cc([N+](=O)[O-])c1 ZINC000121863651 508435532 /nfs/dbraw/zinc/43/55/32/508435532.db2.gz WSYVSNBYNVSLDE-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO COc1ccc(NC(=O)C[NH+]2CCc3ccccc3CC2)c([N+](=O)[O-])c1 ZINC000116299406 508495827 /nfs/dbraw/zinc/49/58/27/508495827.db2.gz AVTYWUBJEBAKGM-UHFFFAOYSA-N 1 1 355.394 2.643 20 5 FFBDMO O=C(CCN1CCC[C@@H]([NH+]2CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000157289347 508547338 /nfs/dbraw/zinc/54/73/38/508547338.db2.gz YXQNRIWIENUYGN-QGZVFWFLSA-N 1 1 360.458 2.874 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3nc4ccccc4[nH]3)CC2)cc1 ZINC000128606541 508617375 /nfs/dbraw/zinc/61/73/75/508617375.db2.gz BYZOAXHESDWWIH-UHFFFAOYSA-N 1 1 365.437 2.831 20 5 FFBDMO O=c1[nH]c2ccccc2cc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866991 508688945 /nfs/dbraw/zinc/68/89/45/508688945.db2.gz QZBYQPNDDNEYND-OAHLLOKOSA-N 1 1 365.393 2.518 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002365 508696209 /nfs/dbraw/zinc/69/62/09/508696209.db2.gz MCSVMBMEFQLVLZ-ZWKOTPCHSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002365 508696212 /nfs/dbraw/zinc/69/62/12/508696212.db2.gz MCSVMBMEFQLVLZ-ZWKOTPCHSA-N 1 1 373.453 2.763 20 5 FFBDMO Cn1cc([C@@H](O)C[C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000371454786 512411835 /nfs/dbraw/zinc/41/18/35/512411835.db2.gz BDYRCVCGEJAXLU-MJGOQNOKSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1ccc(CCNc2ncnc3c2cnn3-c2cc[nH+]cc2)cc1 ZINC000119097386 508724653 /nfs/dbraw/zinc/72/46/53/508724653.db2.gz HZCORORSVBUQRE-UHFFFAOYSA-N 1 1 361.365 2.773 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C[C@@H](O)c1cnn(C)c1 ZINC000371458236 512413313 /nfs/dbraw/zinc/41/33/13/512413313.db2.gz JXSAAUQJQXIBIB-FUHWJXTLSA-N 1 1 374.441 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000137448923 508756151 /nfs/dbraw/zinc/75/61/51/508756151.db2.gz NUKCPRRANSFZRA-GDBMZVCRSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137495379 508758720 /nfs/dbraw/zinc/75/87/20/508758720.db2.gz MRNWPIYBWQNBGX-HIFRSBDPSA-N 1 1 354.410 2.570 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)c1[N+](=O)[O-] ZINC000154314462 508759191 /nfs/dbraw/zinc/75/91/91/508759191.db2.gz NTLZNCNLOBYAEV-CYBMUJFWSA-N 1 1 351.451 2.511 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)cc1[N+](=O)[O-] ZINC000159067593 508788223 /nfs/dbraw/zinc/78/82/23/508788223.db2.gz PSPPSIBUDBTRKY-AWEZNQCLSA-N 1 1 357.414 2.909 20 5 FFBDMO CC(C)(C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccc(F)cc1 ZINC000154478301 508792817 /nfs/dbraw/zinc/79/28/17/508792817.db2.gz JLOGCRHUFZETOU-UHFFFAOYSA-N 1 1 363.393 2.670 20 5 FFBDMO C[C@@H]([NH2+]C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCC1)c1ccccc1 ZINC000154506106 508798067 /nfs/dbraw/zinc/79/80/67/508798067.db2.gz MIFIOHUHFZMEML-CYBMUJFWSA-N 1 1 357.414 2.711 20 5 FFBDMO CC[N@H+](CCc1nccs1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000159156314 508800769 /nfs/dbraw/zinc/80/07/69/508800769.db2.gz IAQYHPLMZKWDLW-UHFFFAOYSA-N 1 1 360.439 2.505 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000159156314 508800773 /nfs/dbraw/zinc/80/07/73/508800773.db2.gz IAQYHPLMZKWDLW-UHFFFAOYSA-N 1 1 360.439 2.505 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cn1 ZINC000371464077 512418034 /nfs/dbraw/zinc/41/80/34/512418034.db2.gz OEDCMBAJGZXRLT-XJKSGUPXSA-N 1 1 371.397 2.558 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119566048 508819838 /nfs/dbraw/zinc/81/98/38/508819838.db2.gz GRXYTVPNVQIYRM-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000119566048 508819840 /nfs/dbraw/zinc/81/98/40/508819840.db2.gz GRXYTVPNVQIYRM-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO NC(=O)c1csc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000130742385 508839719 /nfs/dbraw/zinc/83/97/19/508839719.db2.gz IZEBRTVOVBCURS-UHFFFAOYSA-N 1 1 361.423 2.799 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000119677331 508841921 /nfs/dbraw/zinc/84/19/21/508841921.db2.gz UYOOUKDRAJTEKV-KXBFYZLASA-N 1 1 369.421 2.610 20 5 FFBDMO C[C@]1(CNC(=O)c2c(N)cccc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000154829736 508864978 /nfs/dbraw/zinc/86/49/78/508864978.db2.gz UEVCYVVGOYZDLU-HXUWFJFHSA-N 1 1 368.437 2.962 20 5 FFBDMO CN(C)c1cccc(C[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000159806166 508893585 /nfs/dbraw/zinc/89/35/85/508893585.db2.gz LPVVYZZYYAHKAX-UHFFFAOYSA-N 1 1 356.426 2.756 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000159806166 508893589 /nfs/dbraw/zinc/89/35/89/508893589.db2.gz LPVVYZZYYAHKAX-UHFFFAOYSA-N 1 1 356.426 2.756 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150881882 508914496 /nfs/dbraw/zinc/91/44/96/508914496.db2.gz MTBJXIAWVFNEMS-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150881882 508914501 /nfs/dbraw/zinc/91/45/01/508914501.db2.gz MTBJXIAWVFNEMS-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000155285078 508966317 /nfs/dbraw/zinc/96/63/17/508966317.db2.gz VATHLDJGPPGPSZ-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000160367894 508976702 /nfs/dbraw/zinc/97/67/02/508976702.db2.gz VDGBPRIOWPZZNA-IBGZPJMESA-N 1 1 353.422 2.961 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000160367894 508976704 /nfs/dbraw/zinc/97/67/04/508976704.db2.gz VDGBPRIOWPZZNA-IBGZPJMESA-N 1 1 353.422 2.961 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000120515762 509012040 /nfs/dbraw/zinc/01/20/40/509012040.db2.gz DFZJZDLJTLWHAW-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000132564275 509045716 /nfs/dbraw/zinc/04/57/16/509045716.db2.gz UTSSFONKQHVLMI-CYBMUJFWSA-N 1 1 369.425 2.672 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000172750699 509213683 /nfs/dbraw/zinc/21/36/83/509213683.db2.gz VBSXKKJNHSZQGT-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1c(C)noc1C ZINC000182409923 509223520 /nfs/dbraw/zinc/22/35/20/509223520.db2.gz OHHMCRILDLZXFK-OAHLLOKOSA-N 1 1 358.398 2.830 20 5 FFBDMO C[C@@H](O)C[NH+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000188724517 509231572 /nfs/dbraw/zinc/23/15/72/509231572.db2.gz UMYQJSLLMJHVDC-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H](O)CN1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000188724517 509231579 /nfs/dbraw/zinc/23/15/79/509231579.db2.gz UMYQJSLLMJHVDC-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000248122458 509239867 /nfs/dbraw/zinc/23/98/67/509239867.db2.gz FWXBQMVUJQFKKJ-IIDMSEBBSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000248122458 509239870 /nfs/dbraw/zinc/23/98/70/509239870.db2.gz FWXBQMVUJQFKKJ-IIDMSEBBSA-N 1 1 363.458 2.677 20 5 FFBDMO Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000182448432 509242307 /nfs/dbraw/zinc/24/23/07/509242307.db2.gz UFZKQIPDPCWEQC-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)n2)c1 ZINC000266901440 509249763 /nfs/dbraw/zinc/24/97/63/509249763.db2.gz GSUWBODCTWHPPK-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)n2)c1 ZINC000266901440 509249773 /nfs/dbraw/zinc/24/97/73/509249773.db2.gz GSUWBODCTWHPPK-ZDUSSCGKSA-N 1 1 354.370 2.748 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000248182121 509257726 /nfs/dbraw/zinc/25/77/26/509257726.db2.gz WPNPIWPFMAVVIH-RHSMWYFYSA-N 1 1 358.442 2.725 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000179115311 509270665 /nfs/dbraw/zinc/27/06/65/509270665.db2.gz IBMBRSMXNJWZTA-ROUUACIJSA-N 1 1 354.410 2.839 20 5 FFBDMO COCCC[N@@H+](CCOC)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000264152773 509353898 /nfs/dbraw/zinc/35/38/98/509353898.db2.gz DECXUBNYTPXLDT-UHFFFAOYSA-N 1 1 363.414 2.777 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185867042 509396319 /nfs/dbraw/zinc/39/63/19/509396319.db2.gz ZJKUZQHDPDTWDC-INIZCTEOSA-N 1 1 372.469 2.970 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248741057 509461946 /nfs/dbraw/zinc/46/19/46/509461946.db2.gz PWACOEKXJVXMIV-CRAIPNDOSA-N 1 1 352.431 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(CNC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000192357626 509479859 /nfs/dbraw/zinc/47/98/59/509479859.db2.gz FWPNEMPFRIDJBM-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000264374012 509488856 /nfs/dbraw/zinc/48/88/56/509488856.db2.gz DCNMCKJSZFXKHP-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO Cc1[nH+]ccn1CCCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000173311061 509523148 /nfs/dbraw/zinc/52/31/48/509523148.db2.gz QOWUTSTYIUWJEU-UHFFFAOYSA-N 1 1 372.834 2.512 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000189362985 509540055 /nfs/dbraw/zinc/54/00/55/509540055.db2.gz PXMLXKOHTIVWDT-ZDUSSCGKSA-N 1 1 350.419 2.556 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000164858838 509541122 /nfs/dbraw/zinc/54/11/22/509541122.db2.gz LDCHBDWANIIMNK-NSHDSACASA-N 1 1 353.806 2.688 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)sc(=O)n2C ZINC000192549702 509551368 /nfs/dbraw/zinc/55/13/68/509551368.db2.gz XHXRQAPDWQEEFB-UHFFFAOYSA-N 1 1 359.407 2.807 20 5 FFBDMO Cc1ccccc1NC(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173464066 509618391 /nfs/dbraw/zinc/61/83/91/509618391.db2.gz OVFAWLVXQXVXJX-OAHLLOKOSA-N 1 1 369.425 2.813 20 5 FFBDMO CC(=O)c1ccccc1OCC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173468429 509618732 /nfs/dbraw/zinc/61/87/32/509618732.db2.gz NGSCFLFLDBNQHX-HNNXBMFYSA-N 1 1 370.409 2.758 20 5 FFBDMO CC(=O)c1ccccc1OCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173468429 509618738 /nfs/dbraw/zinc/61/87/38/509618738.db2.gz NGSCFLFLDBNQHX-HNNXBMFYSA-N 1 1 370.409 2.758 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000176704173 509649663 /nfs/dbraw/zinc/64/96/63/509649663.db2.gz OCMGRWQQVOUTFJ-BOWTUIMFSA-N 1 1 361.442 2.614 20 5 FFBDMO NC(=O)c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192958614 509714907 /nfs/dbraw/zinc/71/49/07/509714907.db2.gz JJORMVYTWDPCSW-OAHLLOKOSA-N 1 1 354.410 2.628 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268045689 509733720 /nfs/dbraw/zinc/73/37/20/509733720.db2.gz ZKIQKUSCJINTAH-MWLCHTKSSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H](c1ccccc1)[NH+](C)C ZINC000186493537 509737918 /nfs/dbraw/zinc/73/79/18/509737918.db2.gz HNTLQSQNYFOSAQ-KPZWWZAWSA-N 1 1 367.409 2.892 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268108152 509760016 /nfs/dbraw/zinc/76/00/16/509760016.db2.gz GDBGPBFXHSNRHW-NHYWBVRUSA-N 1 1 354.838 2.730 20 5 FFBDMO CC(C)C[C@@H]1C(=O)NCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189825371 509773047 /nfs/dbraw/zinc/77/30/47/509773047.db2.gz QNYRMJVAETUQRL-MRXNPFEDSA-N 1 1 372.425 2.639 20 5 FFBDMO CC(C)C[C@@H]1C(=O)NCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189825371 509773054 /nfs/dbraw/zinc/77/30/54/509773054.db2.gz QNYRMJVAETUQRL-MRXNPFEDSA-N 1 1 372.425 2.639 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CCN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000186582715 509783371 /nfs/dbraw/zinc/78/33/71/509783371.db2.gz GTDPFUTXZYAOTC-JKSUJKDBSA-N 1 1 364.490 2.670 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000268186523 509803478 /nfs/dbraw/zinc/80/34/78/509803478.db2.gz WCQPBZVYHTYZJF-DGCLKSJQSA-N 1 1 354.838 2.872 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177006927 509814399 /nfs/dbraw/zinc/81/43/99/509814399.db2.gz FOPLBCHOLWRVGR-UHFFFAOYSA-N 1 1 360.414 2.864 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268243064 509832357 /nfs/dbraw/zinc/83/23/57/509832357.db2.gz ZYXKUDGMCNSSNL-UHFFFAOYSA-N 1 1 351.794 2.643 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000189936254 509838090 /nfs/dbraw/zinc/83/80/90/509838090.db2.gz STSHOZNOURCABY-OAHLLOKOSA-N 1 1 365.474 2.659 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)Nc1ccncc1[N+](=O)[O-] ZINC000183568068 509865462 /nfs/dbraw/zinc/86/54/62/509865462.db2.gz IFQYUPKPIDASPE-HNNXBMFYSA-N 1 1 355.398 2.776 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019850 509916574 /nfs/dbraw/zinc/91/65/74/509916574.db2.gz AMTNCQZPQKAXQW-MONCILHSSA-N 1 1 358.486 2.710 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000177191301 509927568 /nfs/dbraw/zinc/92/75/68/509927568.db2.gz NQGONUUNNDROGC-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245453902 509944856 /nfs/dbraw/zinc/94/48/56/509944856.db2.gz ROSABGVFFJKBRH-YJBOKZPZSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585527 509978102 /nfs/dbraw/zinc/97/81/02/509978102.db2.gz WMGFXUMCOKJTJF-KBPBESRZSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585527 509978107 /nfs/dbraw/zinc/97/81/07/509978107.db2.gz WMGFXUMCOKJTJF-KBPBESRZSA-N 1 1 357.414 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000193585222 509978243 /nfs/dbraw/zinc/97/82/43/509978243.db2.gz UJWKSWITMCCXQM-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585222 509978249 /nfs/dbraw/zinc/97/82/49/509978249.db2.gz UJWKSWITMCCXQM-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585222 509978255 /nfs/dbraw/zinc/97/82/55/509978255.db2.gz UJWKSWITMCCXQM-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)C[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183917578 510037090 /nfs/dbraw/zinc/03/70/90/510037090.db2.gz PVMHQIFIAZJMAA-NSHDSACASA-N 1 1 364.427 2.734 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)C[C@H](C)c2nccs2)c([N+](=O)[O-])c1 ZINC000183917578 510037094 /nfs/dbraw/zinc/03/70/94/510037094.db2.gz PVMHQIFIAZJMAA-NSHDSACASA-N 1 1 364.427 2.734 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000261727536 510043188 /nfs/dbraw/zinc/04/31/88/510043188.db2.gz FNAXXUDTKYIINK-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO Cc1cnc(C(C)(C)[NH2+][C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000183968064 510063676 /nfs/dbraw/zinc/06/36/76/510063676.db2.gz RXTDZFRTKKXCAP-CQSZACIVSA-N 1 1 360.439 2.990 20 5 FFBDMO CN(C(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000245659463 510067564 /nfs/dbraw/zinc/06/75/64/510067564.db2.gz FLPSSRKCXPXHIF-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO CN(C(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000245659463 510067567 /nfs/dbraw/zinc/06/75/67/510067567.db2.gz FLPSSRKCXPXHIF-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000261962529 510130165 /nfs/dbraw/zinc/13/01/65/510130165.db2.gz MOVKPACPNMIMMY-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000174483957 510136210 /nfs/dbraw/zinc/13/62/10/510136210.db2.gz ZGLUNMPBMODJLI-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000262002877 510146088 /nfs/dbraw/zinc/14/60/88/510146088.db2.gz QAQUHBJIAGKIQN-GOSISDBHSA-N 1 1 372.400 2.709 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]21 ZINC000268936686 510146590 /nfs/dbraw/zinc/14/65/90/510146590.db2.gz OYIYIXGCKYHACO-MLGOLLRUSA-N 1 1 366.849 2.874 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000177612780 510160709 /nfs/dbraw/zinc/16/07/09/510160709.db2.gz QALQTFSUYHSXFB-HNNXBMFYSA-N 1 1 360.458 2.778 20 5 FFBDMO C[C@H]1OCC[NH2+][C@@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000262078513 510170386 /nfs/dbraw/zinc/17/03/86/510170386.db2.gz CFRCEBKQEOOLJV-PXAZEXFGSA-N 1 1 357.366 2.703 20 5 FFBDMO C[N@@H+](CC1(O)CCCCCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000187334775 510202995 /nfs/dbraw/zinc/20/29/95/510202995.db2.gz GMBOROZRGHIBRZ-QGZVFWFLSA-N 1 1 361.442 2.717 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1cccc2[nH]ccc21 ZINC000177737726 510226797 /nfs/dbraw/zinc/22/67/97/510226797.db2.gz DXUXNZHNXRESGQ-OAHLLOKOSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COc1cccc2[nH]ccc21 ZINC000177737726 510226801 /nfs/dbraw/zinc/22/68/01/510226801.db2.gz DXUXNZHNXRESGQ-OAHLLOKOSA-N 1 1 355.394 2.948 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000194137263 510233157 /nfs/dbraw/zinc/23/31/57/510233157.db2.gz ZONAVUPGKRJEEL-UHFFFAOYSA-N 1 1 353.422 2.985 20 5 FFBDMO CCc1oc2ccccc2c1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174693827 510255518 /nfs/dbraw/zinc/25/55/18/510255518.db2.gz ZJVRHAOEABHOID-AWEZNQCLSA-N 1 1 358.398 2.593 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])C1CC1 ZINC000187457926 510277726 /nfs/dbraw/zinc/27/77/26/510277726.db2.gz QCQZNXZHKOJSAX-SFHVURJKSA-N 1 1 368.437 2.817 20 5 FFBDMO C[C@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@@H+](C)Cc1ccccc1 ZINC000181228521 510311492 /nfs/dbraw/zinc/31/14/92/510311492.db2.gz MWEOAZPNIUBPAL-CYBMUJFWSA-N 1 1 371.393 2.574 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000266080274 510397428 /nfs/dbraw/zinc/39/74/28/510397428.db2.gz MLUQCPLTWUBHKU-UHFFFAOYSA-N 1 1 355.398 2.651 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000269500622 510438045 /nfs/dbraw/zinc/43/80/45/510438045.db2.gz YZNNMEUJDBGTSA-OAHLLOKOSA-N 1 1 371.441 2.836 20 5 FFBDMO Nc1c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000178148390 510458882 /nfs/dbraw/zinc/45/88/82/510458882.db2.gz XFVMWDQFKGYFJI-HNNXBMFYSA-N 1 1 358.398 2.727 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000269622780 510488346 /nfs/dbraw/zinc/48/83/46/510488346.db2.gz FBYJPIVYQSFUOX-LLVKDONJSA-N 1 1 374.340 2.732 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000269622780 510488350 /nfs/dbraw/zinc/48/83/50/510488350.db2.gz FBYJPIVYQSFUOX-LLVKDONJSA-N 1 1 374.340 2.732 20 5 FFBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000175116217 510489467 /nfs/dbraw/zinc/48/94/67/510489467.db2.gz DDDWLHPUNDTHLB-LPHOPBHVSA-N 1 1 359.426 2.900 20 5 FFBDMO C[C@H](CCN1CC[NH+](C)CC1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000184828260 510535130 /nfs/dbraw/zinc/53/51/30/510535130.db2.gz SNWIGLQBPDTSIX-GFCCVEGCSA-N 1 1 358.389 2.634 20 5 FFBDMO CC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000184920796 510584476 /nfs/dbraw/zinc/58/44/76/510584476.db2.gz NVZHOHKJGLTWAX-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000184920796 510584483 /nfs/dbraw/zinc/58/44/83/510584483.db2.gz NVZHOHKJGLTWAX-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172176522 510584669 /nfs/dbraw/zinc/58/46/69/510584669.db2.gz VHGJMEXQXDGHKK-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1 ZINC000194923732 510593934 /nfs/dbraw/zinc/59/39/34/510593934.db2.gz VMBSXRJOZDGKAK-UHFFFAOYSA-N 1 1 354.410 2.565 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000194927836 510594645 /nfs/dbraw/zinc/59/46/45/510594645.db2.gz YEONQQICJSZRAO-LJQANCHMSA-N 1 1 361.442 2.765 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000194934771 510598337 /nfs/dbraw/zinc/59/83/37/510598337.db2.gz RHBLDVSUCUMGOO-KRWDZBQOSA-N 1 1 370.471 2.650 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000194934771 510598341 /nfs/dbraw/zinc/59/83/41/510598341.db2.gz RHBLDVSUCUMGOO-KRWDZBQOSA-N 1 1 370.471 2.650 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000178563899 510664953 /nfs/dbraw/zinc/66/49/53/510664953.db2.gz CHSMWWFRFNXGFL-KRWDZBQOSA-N 1 1 358.394 2.704 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000178563899 510664960 /nfs/dbraw/zinc/66/49/60/510664960.db2.gz CHSMWWFRFNXGFL-KRWDZBQOSA-N 1 1 358.394 2.704 20 5 FFBDMO CC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000172541811 510781402 /nfs/dbraw/zinc/78/14/02/510781402.db2.gz YZQUDROFSWJNQW-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000182193841 510807093 /nfs/dbraw/zinc/80/70/93/510807093.db2.gz LDQAQDAADJNGLO-SFHVURJKSA-N 1 1 370.405 2.829 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000185347234 510816999 /nfs/dbraw/zinc/81/69/99/510816999.db2.gz OKHNZCHOVZVKHZ-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC[N@H+](CCc1ccccc1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182213904 510817437 /nfs/dbraw/zinc/81/74/37/510817437.db2.gz MIEKHCZRWFKQFU-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO CC[N@@H+](CCc1ccccc1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182213904 510817441 /nfs/dbraw/zinc/81/74/41/510817441.db2.gz MIEKHCZRWFKQFU-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248091 510832879 /nfs/dbraw/zinc/83/28/79/510832879.db2.gz XRIQBWMFKKWUMI-BBRMVZONSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248091 510832884 /nfs/dbraw/zinc/83/28/84/510832884.db2.gz XRIQBWMFKKWUMI-BBRMVZONSA-N 1 1 364.833 2.927 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000182310683 510848727 /nfs/dbraw/zinc/84/87/27/510848727.db2.gz TXYPQWZVIARCMB-LLVKDONJSA-N 1 1 369.874 2.941 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000247259812 510854415 /nfs/dbraw/zinc/85/44/15/510854415.db2.gz DYWIUZWJTYFHGC-KSSFIOAISA-N 1 1 371.441 2.583 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000247260224 510854556 /nfs/dbraw/zinc/85/45/56/510854556.db2.gz XPECEGDJMIGYJN-LPHOPBHVSA-N 1 1 369.469 2.911 20 5 FFBDMO C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H](C)[N@H+]1C ZINC000293861363 510878527 /nfs/dbraw/zinc/87/85/27/510878527.db2.gz BEBRYTXPUOJAFG-IYBDPMFKSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)C[C@H](C)[N@@H+]1C ZINC000293861363 510878533 /nfs/dbraw/zinc/87/85/33/510878533.db2.gz BEBRYTXPUOJAFG-IYBDPMFKSA-N 1 1 363.461 2.706 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000285415683 510897564 /nfs/dbraw/zinc/89/75/64/510897564.db2.gz DIMAHPCRGTWKSC-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](N2CCCC2)C[C@@H]1C ZINC000285415683 510897569 /nfs/dbraw/zinc/89/75/69/510897569.db2.gz DIMAHPCRGTWKSC-RDJZCZTQSA-N 1 1 360.458 2.790 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC000285490835 510927711 /nfs/dbraw/zinc/92/77/11/510927711.db2.gz MHHDXJSKQXEVHG-UHFFFAOYSA-N 1 1 350.415 2.873 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000364631363 510982652 /nfs/dbraw/zinc/98/26/52/510982652.db2.gz OKAIYIUKYGUQPN-GFCCVEGCSA-N 1 1 373.413 2.533 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000361067451 510988071 /nfs/dbraw/zinc/98/80/71/510988071.db2.gz NADYXNLPAFHAKC-WDEREUQCSA-N 1 1 355.341 2.553 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CN1CCN(C)CC1 ZINC000271024203 511060842 /nfs/dbraw/zinc/06/08/42/511060842.db2.gz AYHQGVKDHWTBTM-CVEARBPZSA-N 1 1 366.531 2.691 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3ccncn3)C2)cccc1[N+](=O)[O-] ZINC000361652378 511074018 /nfs/dbraw/zinc/07/40/18/511074018.db2.gz LRHVKCNGMVBKEC-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000271127074 511090906 /nfs/dbraw/zinc/09/09/06/511090906.db2.gz PHTAYJIRZSITNS-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO CC(C)N1CC[NH+](C2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)CC1 ZINC000361799797 511096613 /nfs/dbraw/zinc/09/66/13/511096613.db2.gz RUGSLKVIUDUKKT-UHFFFAOYSA-N 1 1 350.438 2.729 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cn1 ZINC000362141269 511139466 /nfs/dbraw/zinc/13/94/66/511139466.db2.gz YQVKKSDSFVISFR-UHFFFAOYSA-N 1 1 367.365 2.892 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000279716831 511188514 /nfs/dbraw/zinc/18/85/14/511188514.db2.gz INFUBNLXAWDBFO-OLZOCXBDSA-N 1 1 353.394 2.688 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000365006291 511202537 /nfs/dbraw/zinc/20/25/37/511202537.db2.gz VTTWMPAVRRAUPO-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000294968325 511238057 /nfs/dbraw/zinc/23/80/57/511238057.db2.gz NBWUTBOXBWTPRN-PBHICJAKSA-N 1 1 361.442 2.746 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000294968339 511238389 /nfs/dbraw/zinc/23/83/89/511238389.db2.gz NBWUTBOXBWTPRN-YOEHRIQHSA-N 1 1 361.442 2.746 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000298327322 511246876 /nfs/dbraw/zinc/24/68/76/511246876.db2.gz RELLLHJUVUDSTI-ZBFHGGJFSA-N 1 1 369.368 2.909 20 5 FFBDMO COCc1ccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000271694559 511291083 /nfs/dbraw/zinc/29/10/83/511291083.db2.gz FZCLJHCTXSSRGJ-AWEZNQCLSA-N 1 1 357.410 2.708 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccncn2)CC1 ZINC000298521087 511314149 /nfs/dbraw/zinc/31/41/49/511314149.db2.gz VTRVQMWRHQVMRB-ZDUSSCGKSA-N 1 1 355.398 2.591 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC000298744305 511395761 /nfs/dbraw/zinc/39/57/61/511395761.db2.gz SIQLNNHXYGRFKA-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccc1OC ZINC000298764382 511402744 /nfs/dbraw/zinc/40/27/44/511402744.db2.gz ZVIULCSKSYBJAP-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000291975657 511414009 /nfs/dbraw/zinc/41/40/09/511414009.db2.gz YEFJODWDSSQEFR-HIFRSBDPSA-N 1 1 371.441 2.663 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)o2)cc1 ZINC000292045535 511444102 /nfs/dbraw/zinc/44/41/02/511444102.db2.gz BAVGCLSYMRIHBV-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)o2)cc1 ZINC000292045535 511444107 /nfs/dbraw/zinc/44/41/07/511444107.db2.gz BAVGCLSYMRIHBV-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO COc1ccccc1CNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292093316 511462240 /nfs/dbraw/zinc/46/22/40/511462240.db2.gz HCCUDVXMCDTJBF-UHFFFAOYSA-N 1 1 357.410 2.745 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000280558390 511510955 /nfs/dbraw/zinc/51/09/55/511510955.db2.gz UTOULCANDSLATP-XHDPSFHLSA-N 1 1 369.824 2.873 20 5 FFBDMO Cc1c(NC(=O)N2CCC[N@H+](C)CC2)cc(Br)cc1[N+](=O)[O-] ZINC000280814963 511613134 /nfs/dbraw/zinc/61/31/34/511613134.db2.gz SRJKYDLIRXRLHT-UHFFFAOYSA-N 1 1 371.235 2.835 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000363582748 511640477 /nfs/dbraw/zinc/64/04/77/511640477.db2.gz KFJDCFBVTZACGN-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000284217794 511646701 /nfs/dbraw/zinc/64/67/01/511646701.db2.gz TUDLWNLDNCTKQN-RKVPGOIHSA-N 1 1 364.490 2.965 20 5 FFBDMO O=C(c1cc(N2CCC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363636491 511671904 /nfs/dbraw/zinc/67/19/04/511671904.db2.gz BXCCSGVQVFTAAW-MRXNPFEDSA-N 1 1 358.442 2.505 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(c3ncc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000292865942 511751312 /nfs/dbraw/zinc/75/13/12/511751312.db2.gz SQGYAHIJVDYEDZ-AWEZNQCLSA-N 1 1 355.236 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC4(CC3)OCCCO4)co2)cc1 ZINC000292924837 511773134 /nfs/dbraw/zinc/77/31/34/511773134.db2.gz GLZJFIGVNYUWEW-UHFFFAOYSA-N 1 1 359.382 2.979 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]2CO1 ZINC000281268263 511782125 /nfs/dbraw/zinc/78/21/25/511782125.db2.gz NONJMLLWTTXKGT-DOMZBBRYSA-N 1 1 357.366 2.785 20 5 FFBDMO CC(C)(CCC(=O)NC[C@H]1CSCC[N@H+]1Cc1ccccc1)[N+](=O)[O-] ZINC000296590629 511809743 /nfs/dbraw/zinc/80/97/43/511809743.db2.gz FLPRUHGULRHLLT-INIZCTEOSA-N 1 1 365.499 2.556 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000363871244 511820787 /nfs/dbraw/zinc/82/07/87/511820787.db2.gz AQIFNVZBWZQERG-ZDUSSCGKSA-N 1 1 360.439 2.693 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)Cc1ccccc1 ZINC000293277247 511905139 /nfs/dbraw/zinc/90/51/39/511905139.db2.gz JNLNQCKDUPJOIG-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)Cc1ccccc1 ZINC000293277247 511905146 /nfs/dbraw/zinc/90/51/46/511905146.db2.gz JNLNQCKDUPJOIG-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000297143049 512035717 /nfs/dbraw/zinc/03/57/17/512035717.db2.gz NTMSYWZUSXDQFB-SFHVURJKSA-N 1 1 369.469 2.749 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000360037883 512065554 /nfs/dbraw/zinc/06/55/54/512065554.db2.gz SEHBFYYRSKOHCV-ZBFHGGJFSA-N 1 1 371.397 2.521 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000285310789 512073430 /nfs/dbraw/zinc/07/34/30/512073430.db2.gz MVLNUKQFWFLNMB-UHFFFAOYSA-N 1 1 372.450 2.690 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293819608 512091599 /nfs/dbraw/zinc/09/15/99/512091599.db2.gz OXMOMDDHJHKGML-UHFFFAOYSA-N 1 1 356.304 2.939 20 5 FFBDMO Cn1ccnc1[C@@H](NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000367438463 512499018 /nfs/dbraw/zinc/49/90/18/512499018.db2.gz NCVCKZYCPROHEL-SFHVURJKSA-N 1 1 366.425 2.740 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000369677354 512549801 /nfs/dbraw/zinc/54/98/01/512549801.db2.gz WQSNFSRIVFZFKY-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000411283469 512562012 /nfs/dbraw/zinc/56/20/12/512562012.db2.gz YWDDEOAGNFFLQC-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](c4ccncn4)C3)o2)cc1 ZINC000373932652 512577715 /nfs/dbraw/zinc/57/77/15/512577715.db2.gz IQHWWTYMSNMRBG-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4ccncn4)C3)o2)cc1 ZINC000373932652 512577720 /nfs/dbraw/zinc/57/77/20/512577720.db2.gz IQHWWTYMSNMRBG-CQSZACIVSA-N 1 1 366.381 2.814 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2CSC)c([N+](=O)[O-])c1 ZINC000411318125 512578257 /nfs/dbraw/zinc/57/82/57/512578257.db2.gz DHEHHBVNLFXBAO-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2CCn3c[nH+]cc3C2)n1 ZINC000371888127 512619287 /nfs/dbraw/zinc/61/92/87/512619287.db2.gz MNDRSCVZDOESRB-GFCCVEGCSA-N 1 1 354.370 2.559 20 5 FFBDMO Cc1c(F)cccc1NC(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000411478507 512655415 /nfs/dbraw/zinc/65/54/15/512655415.db2.gz KQJWTHXTARGXAW-UHFFFAOYSA-N 1 1 358.373 2.824 20 5 FFBDMO O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cn1 ZINC000372010479 512677405 /nfs/dbraw/zinc/67/74/05/512677405.db2.gz ORWPZRJOYMDHMJ-ALOPSCKCSA-N 1 1 366.421 2.915 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CC(N2CCCCC2)C1 ZINC000370131673 512783351 /nfs/dbraw/zinc/78/33/51/512783351.db2.gz LANIQWLLXSTZHN-NXVRBGIVSA-N 1 1 360.458 2.918 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC1CC([NH+]2CCCCC2)C1 ZINC000370131673 512783356 /nfs/dbraw/zinc/78/33/56/512783356.db2.gz LANIQWLLXSTZHN-NXVRBGIVSA-N 1 1 360.458 2.918 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)c1 ZINC000378491498 512787202 /nfs/dbraw/zinc/78/72/02/512787202.db2.gz GXSVOIRQMMANJA-KDOFPFPSSA-N 1 1 362.405 2.561 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000372296208 512801903 /nfs/dbraw/zinc/80/19/03/512801903.db2.gz CYSIPBJOWCAPHK-HNNXBMFYSA-N 1 1 354.366 2.524 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000372296208 512801911 /nfs/dbraw/zinc/80/19/11/512801911.db2.gz CYSIPBJOWCAPHK-HNNXBMFYSA-N 1 1 354.366 2.524 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000378563072 512825840 /nfs/dbraw/zinc/82/58/40/512825840.db2.gz RPNPHXGVQGCEDT-RYQLBKOJSA-N 1 1 355.442 2.634 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@](CO)(c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000368262186 512870007 /nfs/dbraw/zinc/87/00/07/512870007.db2.gz WLHONXZMTAIFCH-FQEVSTJZSA-N 1 1 369.421 2.559 20 5 FFBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000412017524 512913500 /nfs/dbraw/zinc/91/35/00/512913500.db2.gz ZVXFYNROHFGSCH-GBESFXJTSA-N 1 1 358.442 2.810 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062531 512938548 /nfs/dbraw/zinc/93/85/48/512938548.db2.gz ASDYPLZYKSHJOQ-QWRGUYRKSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000412062531 512938551 /nfs/dbraw/zinc/93/85/51/512938551.db2.gz ASDYPLZYKSHJOQ-QWRGUYRKSA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086826 512995790 /nfs/dbraw/zinc/99/57/90/512995790.db2.gz LVYSHOUMLWQLML-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408086826 512995795 /nfs/dbraw/zinc/99/57/95/512995795.db2.gz LVYSHOUMLWQLML-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374797685 513009263 /nfs/dbraw/zinc/00/92/63/513009263.db2.gz FUSIWKIWWUYVAW-GDBMZVCRSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374865751 513044930 /nfs/dbraw/zinc/04/49/30/513044930.db2.gz SMBUCWNPFOYTFH-YOEHRIQHSA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C3CCOCC3)C2)c([N+](=O)[O-])cc1OC ZINC000370722207 513070041 /nfs/dbraw/zinc/07/00/41/513070041.db2.gz SGHPPXFKXZSJKB-AWEZNQCLSA-N 1 1 350.415 2.861 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@@H](c2[nH+]ccn2C)C1 ZINC000450410387 513183034 /nfs/dbraw/zinc/18/30/34/513183034.db2.gz YVBHDYFBKMGFNB-GFCCVEGCSA-N 1 1 353.382 2.879 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000429140481 513289744 /nfs/dbraw/zinc/28/97/44/513289744.db2.gz ZLRRLQCJKISWIF-ZBFHGGJFSA-N 1 1 358.394 2.618 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000429208767 513305764 /nfs/dbraw/zinc/30/57/64/513305764.db2.gz MLFPGMKLAKEHSR-CQSZACIVSA-N 1 1 372.425 2.882 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434422802 513320447 /nfs/dbraw/zinc/32/04/47/513320447.db2.gz BTXUNJJPXFDNRU-HNNXBMFYSA-N 1 1 351.834 2.924 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000446724217 513324676 /nfs/dbraw/zinc/32/46/76/513324676.db2.gz YOYRUSUELMFLGY-AZUAARDMSA-N 1 1 356.422 2.998 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000415634572 513356896 /nfs/dbraw/zinc/35/68/96/513356896.db2.gz SXAHQXZAUYHLGJ-MRXNPFEDSA-N 1 1 374.372 2.921 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000421706637 513378391 /nfs/dbraw/zinc/37/83/91/513378391.db2.gz VINZUDIPRDGDCW-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2ccnc(NC[C@]3([NH+]4CCOCC4)CCSC3)c2c1 ZINC000413073655 513426768 /nfs/dbraw/zinc/42/67/68/513426768.db2.gz OYHPLSSEXLAIRF-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO C[C@@H]1Cc2c([nH+]cn2CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1C ZINC000450994361 513446732 /nfs/dbraw/zinc/44/67/32/513446732.db2.gz CHHGGETVZDHPRK-QWHCGFSZSA-N 1 1 354.410 2.751 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413215360 513525153 /nfs/dbraw/zinc/52/51/53/513525153.db2.gz AIRCFYWBPIWZDL-UHFFFAOYSA-N 1 1 354.426 2.704 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425420515 513554989 /nfs/dbraw/zinc/55/49/89/513554989.db2.gz MQDSDBQEBRGTQA-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000430201045 513586670 /nfs/dbraw/zinc/58/66/70/513586670.db2.gz BWBCISSAYLLLNN-YJBOKZPZSA-N 1 1 365.474 2.830 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@H](C)c2cccnc2)CC1 ZINC000430228614 513592864 /nfs/dbraw/zinc/59/28/64/513592864.db2.gz SNSGDEFWDOHSRY-OAHLLOKOSA-N 1 1 356.426 2.877 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1 ZINC000435634959 513646052 /nfs/dbraw/zinc/64/60/52/513646052.db2.gz DNENSLWVKRKDIH-INIZCTEOSA-N 1 1 367.471 2.670 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@@H]1[C@H]1CCCOC1 ZINC000451295495 513659159 /nfs/dbraw/zinc/65/91/59/513659159.db2.gz DNSUSYFKQVRWJG-BMGDILEWSA-N 1 1 364.442 2.744 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](CCO)c1cccc(C(F)(F)F)c1 ZINC000451301019 513661945 /nfs/dbraw/zinc/66/19/45/513661945.db2.gz BFGAGYUHULWQEB-GFCCVEGCSA-N 1 1 358.320 2.560 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000448036420 513662220 /nfs/dbraw/zinc/66/22/20/513662220.db2.gz YAPMBEQFDOXGEE-KRWDZBQOSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000430537037 513679010 /nfs/dbraw/zinc/67/90/10/513679010.db2.gz KDCWSOJKGAZDRL-INIZCTEOSA-N 1 1 371.437 2.919 20 5 FFBDMO C[C@@]12C[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451360679 513700235 /nfs/dbraw/zinc/70/02/35/513700235.db2.gz FQIBKBPCPQMUSI-RPWFAHAXSA-N 1 1 353.422 2.628 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000431493218 513911484 /nfs/dbraw/zinc/91/14/84/513911484.db2.gz AYTZPEXLFDBALX-CABZTGNLSA-N 1 1 356.220 2.570 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOc2ccccc21 ZINC000451709424 513929278 /nfs/dbraw/zinc/92/92/78/513929278.db2.gz BYANTPYMQMPNHQ-QGZVFWFLSA-N 1 1 355.394 2.796 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](CO)CC(C)(C)C)cccc1[N+](=O)[O-] ZINC000451783591 513978847 /nfs/dbraw/zinc/97/88/47/513978847.db2.gz SBNZDSWSMCFBPC-CQSZACIVSA-N 1 1 351.447 2.961 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2nccc(C(F)(F)F)n2)n1 ZINC000414239683 514017213 /nfs/dbraw/zinc/01/72/13/514017213.db2.gz LGLDBJPDBVWQCZ-QWRGUYRKSA-N 1 1 370.335 2.874 20 5 FFBDMO CC(C)(C)[C@@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000420454114 514152710 /nfs/dbraw/zinc/15/27/10/514152710.db2.gz VSRVXXLKBYLBGH-SNVBAGLBSA-N 1 1 370.258 2.553 20 5 FFBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000420620217 514203939 /nfs/dbraw/zinc/20/39/39/514203939.db2.gz ZUSKVANZZQUXEY-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO C[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CCCC1 ZINC000432488590 514208329 /nfs/dbraw/zinc/20/83/29/514208329.db2.gz GJMSYXUEOZZNHO-UHFFFAOYSA-N 1 1 372.425 2.512 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc(OC)c1[N+](=O)[O-])CCC(F)(F)F ZINC000444402692 514220335 /nfs/dbraw/zinc/22/03/35/514220335.db2.gz FEIUBQJMIBFAOR-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC000437962777 514277486 /nfs/dbraw/zinc/27/74/86/514277486.db2.gz MRGJXXCSPLZUOT-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423940576 514298412 /nfs/dbraw/zinc/29/84/12/514298412.db2.gz CFWBAZMCWZYILS-GOSISDBHSA-N 1 1 354.410 2.900 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000449752404 514335743 /nfs/dbraw/zinc/33/57/43/514335743.db2.gz FLCCBPCRBFGKJY-IAGOWNOFSA-N 1 1 370.405 2.992 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000432983613 514342272 /nfs/dbraw/zinc/34/22/72/514342272.db2.gz KBAZXPWJRFDEJX-CQSZACIVSA-N 1 1 350.419 2.526 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000433061604 514365830 /nfs/dbraw/zinc/36/58/30/514365830.db2.gz PQFGRPFPDBWVKO-SFHVURJKSA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420948799 514397497 /nfs/dbraw/zinc/39/74/97/514397497.db2.gz OFFBVIJLQQBHDI-CHWSQXEVSA-N 1 1 362.348 2.999 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2C[C@]2(F)c2ccccc2)cc1[N+](=O)[O-] ZINC000424187277 514409291 /nfs/dbraw/zinc/40/92/91/514409291.db2.gz AQJGNEYCJVOVQA-HKUYNNGSSA-N 1 1 374.368 2.874 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000449968955 514446279 /nfs/dbraw/zinc/44/62/79/514446279.db2.gz CKIGKHBGWRNEDT-XJKSGUPXSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@@H]1C ZINC000449968955 514446284 /nfs/dbraw/zinc/44/62/84/514446284.db2.gz CKIGKHBGWRNEDT-XJKSGUPXSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@@H]1C ZINC000449968955 514446286 /nfs/dbraw/zinc/44/62/86/514446286.db2.gz CKIGKHBGWRNEDT-XJKSGUPXSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@@H](C)C1 ZINC000449990727 514456091 /nfs/dbraw/zinc/45/60/91/514456091.db2.gz XCZKLNOJLSTKLW-GOEBONIOSA-N 1 1 371.441 2.583 20 5 FFBDMO C[NH+](C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)c1ccc(F)cc1 ZINC000439108738 514494872 /nfs/dbraw/zinc/49/48/72/514494872.db2.gz UDQKIAKZQJCGRE-MRXNPFEDSA-N 1 1 371.372 2.519 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000452838265 514511465 /nfs/dbraw/zinc/51/14/65/514511465.db2.gz FNQMBRHMXHZJOE-AWEZNQCLSA-N 1 1 358.398 2.664 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450262391 514570792 /nfs/dbraw/zinc/57/07/92/514570792.db2.gz MYTWWYJPKABOGK-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1cc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000475322091 514618958 /nfs/dbraw/zinc/61/89/58/514618958.db2.gz ZLPGCZZRRRIZPX-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cn1ccnc1[C@@H](NCCCC[N@@H+](C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000453387065 514619060 /nfs/dbraw/zinc/61/90/60/514619060.db2.gz ATUDIZWPNXCLGL-SFHVURJKSA-N 1 1 357.458 2.882 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000461638656 514679821 /nfs/dbraw/zinc/67/98/21/514679821.db2.gz XLRPCKHYXYNOCL-AWEZNQCLSA-N 1 1 373.457 2.846 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000475567493 514717217 /nfs/dbraw/zinc/71/72/17/514717217.db2.gz RUPJVAXXZGYEJN-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cc([N+](=O)[O-])ccc1C ZINC000502711010 514749378 /nfs/dbraw/zinc/74/93/78/514749378.db2.gz GVMVDPQYRQVQNA-INIZCTEOSA-N 1 1 369.487 2.836 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000489416116 514836511 /nfs/dbraw/zinc/83/65/11/514836511.db2.gz YYMHWPAUFUCVHA-RLFYNMQTSA-N 1 1 360.458 2.509 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000471413384 514875415 /nfs/dbraw/zinc/87/54/15/514875415.db2.gz XXXCQYISTUZLSB-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000462160208 514917398 /nfs/dbraw/zinc/91/73/98/514917398.db2.gz UPJYDKACXWLFAS-AUUYWEPGSA-N 1 1 371.412 2.913 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000462160210 514917943 /nfs/dbraw/zinc/91/79/43/514917943.db2.gz UPJYDKACXWLFAS-IFXJQAMLSA-N 1 1 371.412 2.913 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471541107 514923834 /nfs/dbraw/zinc/92/38/34/514923834.db2.gz WGYHZSCFNVJYJW-CQSZACIVSA-N 1 1 354.838 2.603 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C[C@@H]21 ZINC000456160374 514990859 /nfs/dbraw/zinc/99/08/59/514990859.db2.gz GNVVNJPZYNFYKI-MFKMUULPSA-N 1 1 355.847 2.503 20 5 FFBDMO C[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[NH+]1CCOCC1 ZINC000485419492 515034062 /nfs/dbraw/zinc/03/40/62/515034062.db2.gz TZOWTUUBEIWACY-UONOGXRCSA-N 1 1 374.416 2.739 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000467710926 515088872 /nfs/dbraw/zinc/08/88/72/515088872.db2.gz OUFNTROXSZXOKS-XPTSAGLGSA-N 1 1 368.231 2.570 20 5 FFBDMO CNc1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000462781608 515241701 /nfs/dbraw/zinc/24/17/01/515241701.db2.gz YWCUOZMBVPHEBY-XJKSGUPXSA-N 1 1 358.442 2.725 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1CCOC ZINC000499426756 515317851 /nfs/dbraw/zinc/31/78/51/515317851.db2.gz FQGURXSFCAQXRW-HNNXBMFYSA-N 1 1 374.441 2.649 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000509793313 515325546 /nfs/dbraw/zinc/32/55/46/515325546.db2.gz HTXYOWCEJMTAPE-AWEZNQCLSA-N 1 1 369.487 2.692 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490843 515347477 /nfs/dbraw/zinc/34/74/77/515347477.db2.gz HAYHZHZHALWEST-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490843 515347487 /nfs/dbraw/zinc/34/74/87/515347487.db2.gz HAYHZHZHALWEST-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000468456738 515366560 /nfs/dbraw/zinc/36/65/60/515366560.db2.gz IONUGPFPMVSVHU-KRWDZBQOSA-N 1 1 358.442 2.786 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000499713065 515422465 /nfs/dbraw/zinc/42/24/65/515422465.db2.gz NFAFDRQMNGXHMR-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468719589 515485997 /nfs/dbraw/zinc/48/59/97/515485997.db2.gz ZQLILVZMXYAMEH-OAHLLOKOSA-N 1 1 369.487 2.921 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468719589 515486002 /nfs/dbraw/zinc/48/60/02/515486002.db2.gz ZQLILVZMXYAMEH-OAHLLOKOSA-N 1 1 369.487 2.921 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)CCc1cccc(Br)c1 ZINC000463419448 515486829 /nfs/dbraw/zinc/48/68/29/515486829.db2.gz XEHUEKRNAMBXNE-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)CCc1cccc(Br)c1 ZINC000463419448 515486839 /nfs/dbraw/zinc/48/68/39/515486839.db2.gz XEHUEKRNAMBXNE-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473158353 515520772 /nfs/dbraw/zinc/52/07/72/515520772.db2.gz GRAXHDRPTRPLTG-CYBMUJFWSA-N 1 1 355.803 2.571 20 5 FFBDMO O=C(NCc1ccc(C[NH+]2CCCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505479710 515548981 /nfs/dbraw/zinc/54/89/81/515548981.db2.gz JXYSENYYOMYJNR-UHFFFAOYSA-N 1 1 355.394 2.826 20 5 FFBDMO CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OCC)c2)CC[N@H+]1CCOC ZINC000492718728 515557716 /nfs/dbraw/zinc/55/77/16/515557716.db2.gz BMTRCONAQVWMHJ-QGZVFWFLSA-N 1 1 365.474 2.926 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505572426 515590239 /nfs/dbraw/zinc/59/02/39/515590239.db2.gz KCWAQIARPVJFID-GOSISDBHSA-N 1 1 368.437 2.742 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000500109343 515593630 /nfs/dbraw/zinc/59/36/30/515593630.db2.gz BOAADLOSVQQJQH-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO Cn1cc(C[N@@H+]2CCCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)cn1 ZINC000493180526 515607678 /nfs/dbraw/zinc/60/76/78/515607678.db2.gz LGVSEAPTTAEHPN-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO Cn1cc(C[N@H+]2CCCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)cn1 ZINC000493180526 515607688 /nfs/dbraw/zinc/60/76/88/515607688.db2.gz LGVSEAPTTAEHPN-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457102725 515649820 /nfs/dbraw/zinc/64/98/20/515649820.db2.gz AHPCYGKCXZDWTM-CQSZACIVSA-N 1 1 369.849 2.958 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)c1 ZINC000459568213 515656388 /nfs/dbraw/zinc/65/63/88/515656388.db2.gz BDYUYHIEOBTUQP-ROUUACIJSA-N 1 1 356.426 2.770 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)c1 ZINC000459568210 515657653 /nfs/dbraw/zinc/65/76/53/515657653.db2.gz BDYUYHIEOBTUQP-QZTJIDSGSA-N 1 1 356.426 2.770 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000482382608 515664013 /nfs/dbraw/zinc/66/40/13/515664013.db2.gz FNYWTHKRVXZSEC-IYBDPMFKSA-N 1 1 363.458 2.848 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486994090 515711751 /nfs/dbraw/zinc/71/17/51/515711751.db2.gz FLFRIKZZMVIBDA-OAHLLOKOSA-N 1 1 368.865 2.964 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486994089 515711839 /nfs/dbraw/zinc/71/18/39/515711839.db2.gz FLFRIKZZMVIBDA-HNNXBMFYSA-N 1 1 368.865 2.964 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C(C)(C)C1 ZINC000500489760 515737455 /nfs/dbraw/zinc/73/74/55/515737455.db2.gz DMTNGZIVNJJJRF-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C(C)(C)C1 ZINC000500489760 515737462 /nfs/dbraw/zinc/73/74/62/515737462.db2.gz DMTNGZIVNJJJRF-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000500900119 515900091 /nfs/dbraw/zinc/90/00/91/515900091.db2.gz HYWGBDIMDWKDJE-ZBFHGGJFSA-N 1 1 371.441 2.626 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](CCc2cccs2)CC1 ZINC000511694875 516003562 /nfs/dbraw/zinc/00/35/62/516003562.db2.gz DPWHRKRODHXZQW-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@@H]1C ZINC000487959909 516053247 /nfs/dbraw/zinc/05/32/47/516053247.db2.gz SJHNMFFPFCZGFS-WMLDXEAASA-N 1 1 361.442 2.621 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000460203429 516067261 /nfs/dbraw/zinc/06/72/61/516067261.db2.gz IZLRHPQMCCAQAQ-MRXNPFEDSA-N 1 1 356.430 2.546 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000488028080 516085380 /nfs/dbraw/zinc/08/53/80/516085380.db2.gz SGOHGLFXGBDLPN-MPGHIAIKSA-N 1 1 360.458 2.509 20 5 FFBDMO C[C@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC000501540230 516146780 /nfs/dbraw/zinc/14/67/80/516146780.db2.gz YVLAJYWKCWZAKZ-LSDHHAIUSA-N 1 1 363.462 2.569 20 5 FFBDMO COc1ccnc(N2CC[NH+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000470177749 516163664 /nfs/dbraw/zinc/16/36/64/516163664.db2.gz FOIPZWPGYWZWIS-QINSGFPZSA-N 1 1 369.425 2.619 20 5 FFBDMO CCC1CCC([N@@H+](CCO)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000488234545 516168925 /nfs/dbraw/zinc/16/89/25/516168925.db2.gz PVYWCAZCDLOVGH-UHFFFAOYSA-N 1 1 363.458 2.821 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000488271829 516182353 /nfs/dbraw/zinc/18/23/53/516182353.db2.gz JMNYVXJYLUBXAQ-ZDUSSCGKSA-N 1 1 368.865 2.822 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000488383472 516210203 /nfs/dbraw/zinc/21/02/03/516210203.db2.gz KNFUWARYXGUCJV-STQMWFEESA-N 1 1 368.865 2.915 20 5 FFBDMO O=C(CC[N@H+](CCO)Cc1cccc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000501875981 516252632 /nfs/dbraw/zinc/25/26/32/516252632.db2.gz LKUWUTUHRKPHLG-UHFFFAOYSA-N 1 1 361.373 2.557 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815825 516371787 /nfs/dbraw/zinc/37/17/87/516371787.db2.gz DWQUWLJUTUHQPE-NWDGAFQWSA-N 1 1 357.357 2.791 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815825 516371793 /nfs/dbraw/zinc/37/17/93/516371793.db2.gz DWQUWLJUTUHQPE-NWDGAFQWSA-N 1 1 357.357 2.791 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021363 516403875 /nfs/dbraw/zinc/40/38/75/516403875.db2.gz POZUSESLYGQYFS-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000540021363 516403879 /nfs/dbraw/zinc/40/38/79/516403879.db2.gz POZUSESLYGQYFS-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[C@H](C)C1 ZINC000561146061 516407117 /nfs/dbraw/zinc/40/71/17/516407117.db2.gz OYOWIJVKSRXZPO-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)[C@H](C)C1 ZINC000561146061 516407127 /nfs/dbraw/zinc/40/71/27/516407127.db2.gz OYOWIJVKSRXZPO-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000547764845 516548544 /nfs/dbraw/zinc/54/85/44/516548544.db2.gz DKXCZVXABLOYHB-KRWDZBQOSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000547764845 516548551 /nfs/dbraw/zinc/54/85/51/516548551.db2.gz DKXCZVXABLOYHB-KRWDZBQOSA-N 1 1 354.410 2.623 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(F)cc1 ZINC000540476642 516573293 /nfs/dbraw/zinc/57/32/93/516573293.db2.gz BTKSHCGQLGXNFJ-QGZVFWFLSA-N 1 1 361.373 2.958 20 5 FFBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NCc1ccccc1 ZINC000540479724 516574532 /nfs/dbraw/zinc/57/45/32/516574532.db2.gz WIGXQUITRVIYAQ-KBPBESRZSA-N 1 1 370.409 2.660 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1Cc2ccccc2C1 ZINC000513444016 516627181 /nfs/dbraw/zinc/62/71/81/516627181.db2.gz QVUUEIRXJRMMIN-UHFFFAOYSA-N 1 1 351.406 2.583 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3ccc4c(c3)OCCO4)CC2)c1 ZINC000531778308 516635587 /nfs/dbraw/zinc/63/55/87/516635587.db2.gz PEOBBPVNVTUXJD-UHFFFAOYSA-N 1 1 369.421 2.997 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000554834242 516655810 /nfs/dbraw/zinc/65/58/10/516655810.db2.gz AIUWRXPWLHDKOZ-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000554834242 516655816 /nfs/dbraw/zinc/65/58/16/516655816.db2.gz AIUWRXPWLHDKOZ-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO Cc1nn(CCC(=O)N(C)CC[N@@H+](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000524448847 516723419 /nfs/dbraw/zinc/72/34/19/516723419.db2.gz PVXNIIMBJORGOT-UHFFFAOYSA-N 1 1 365.478 2.521 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000544392827 516739732 /nfs/dbraw/zinc/73/97/32/516739732.db2.gz BFBMFHMWOUIOFE-GXSJLCMTSA-N 1 1 357.252 2.980 20 5 FFBDMO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760310 516763329 /nfs/dbraw/zinc/76/33/29/516763329.db2.gz RPIFADDBMHLFRI-QAPCUYQASA-N 1 1 373.457 2.952 20 5 FFBDMO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760310 516763332 /nfs/dbraw/zinc/76/33/32/516763332.db2.gz RPIFADDBMHLFRI-QAPCUYQASA-N 1 1 373.457 2.952 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000551583041 516771721 /nfs/dbraw/zinc/77/17/21/516771721.db2.gz JEKBYPQWYZFOPG-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000544597138 516828032 /nfs/dbraw/zinc/82/80/32/516828032.db2.gz PUXHSOIKKXHYPN-UHFFFAOYSA-N 1 1 360.391 2.905 20 5 FFBDMO CC[C@@H](C)[C@@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847116 516956385 /nfs/dbraw/zinc/95/63/85/516956385.db2.gz RWTLQNRVAJETRE-KDOFPFPSSA-N 1 1 370.457 2.825 20 5 FFBDMO CC[C@@H](C)[C@@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847116 516956397 /nfs/dbraw/zinc/95/63/97/516956397.db2.gz RWTLQNRVAJETRE-KDOFPFPSSA-N 1 1 370.457 2.825 20 5 FFBDMO COc1ccc(CC(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1[N+](=O)[O-] ZINC000525290919 516996664 /nfs/dbraw/zinc/99/66/64/516996664.db2.gz DVUAOCIHOUMHPJ-CVEARBPZSA-N 1 1 361.442 2.620 20 5 FFBDMO O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000544941321 516997184 /nfs/dbraw/zinc/99/71/84/516997184.db2.gz WGODUNJTQHQILG-HNNXBMFYSA-N 1 1 370.409 2.891 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454601 517044769 /nfs/dbraw/zinc/04/47/69/517044769.db2.gz JREOXJYWGZABQM-KXBFYZLASA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454601 517044780 /nfs/dbraw/zinc/04/47/80/517044780.db2.gz JREOXJYWGZABQM-KXBFYZLASA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000562399790 517081836 /nfs/dbraw/zinc/08/18/36/517081836.db2.gz JFHBXFGVTYQVRW-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccccc1 ZINC000532707326 517105633 /nfs/dbraw/zinc/10/56/33/517105633.db2.gz WIYPWRLWRZBVQW-OAHLLOKOSA-N 1 1 355.398 2.505 20 5 FFBDMO Cc1nc(N2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000532826344 517161103 /nfs/dbraw/zinc/16/11/03/517161103.db2.gz QPMOZSHNLNHWNP-UHFFFAOYSA-N 1 1 362.455 2.869 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552252767 517162775 /nfs/dbraw/zinc/16/27/75/517162775.db2.gz WQSOGEXHGRHCKE-HKUYNNGSSA-N 1 1 366.421 2.783 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552254474 517164218 /nfs/dbraw/zinc/16/42/18/517164218.db2.gz GHSOOFHKVVSOIX-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2 ZINC000532950066 517218154 /nfs/dbraw/zinc/21/81/54/517218154.db2.gz WGRLCWJHGKTPBB-UHFFFAOYSA-N 1 1 355.394 2.651 20 5 FFBDMO COc1ccc2c(c1)CCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2 ZINC000532950066 517218167 /nfs/dbraw/zinc/21/81/67/517218167.db2.gz WGRLCWJHGKTPBB-UHFFFAOYSA-N 1 1 355.394 2.651 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969883 517228348 /nfs/dbraw/zinc/22/83/48/517228348.db2.gz IDOFYNKBHPYXSB-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969883 517228351 /nfs/dbraw/zinc/22/83/51/517228351.db2.gz IDOFYNKBHPYXSB-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000520093102 517272391 /nfs/dbraw/zinc/27/23/91/517272391.db2.gz HBHXLNIIDITDDJ-KRWDZBQOSA-N 1 1 368.437 2.788 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)n1 ZINC000541935030 517299766 /nfs/dbraw/zinc/29/97/66/517299766.db2.gz HKEODWNFEOMPIZ-QZTJIDSGSA-N 1 1 370.453 2.902 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000541935058 517300115 /nfs/dbraw/zinc/30/01/15/517300115.db2.gz BPAXRBXKUCJQLU-IRXDYDNUSA-N 1 1 356.426 2.654 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COc1cccc2[nH]ccc21 ZINC000548934232 517312317 /nfs/dbraw/zinc/31/23/17/517312317.db2.gz XFPXIEAISVUTKJ-QGZVFWFLSA-N 1 1 369.421 2.990 20 5 FFBDMO Cn1c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000520349063 517356279 /nfs/dbraw/zinc/35/62/79/517356279.db2.gz OSFUNOITEBFKSB-ALOPSCKCSA-N 1 1 368.437 2.859 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000552913328 517439970 /nfs/dbraw/zinc/43/99/70/517439970.db2.gz HIXLDTCXDZKAPA-KRWDZBQOSA-N 1 1 357.410 2.913 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000552984699 517464135 /nfs/dbraw/zinc/46/41/35/517464135.db2.gz AWWFMQJXGKSHOA-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000552984699 517464141 /nfs/dbraw/zinc/46/41/41/517464141.db2.gz AWWFMQJXGKSHOA-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000538317645 517561264 /nfs/dbraw/zinc/56/12/64/517561264.db2.gz MKKXGUFXKSFNQI-UHFFFAOYSA-N 1 1 366.421 2.825 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N2CC[NH+](Cc3ccsc3)CC2)s1 ZINC000553242204 517596851 /nfs/dbraw/zinc/59/68/51/517596851.db2.gz MQJNUVMNMBZAPD-UHFFFAOYSA-N 1 1 361.452 2.983 20 5 FFBDMO C[N@@H+](CCCNc1ncnc2cccc([N+](=O)[O-])c21)Cc1ccccc1 ZINC000542520915 517609083 /nfs/dbraw/zinc/60/90/83/517609083.db2.gz OKMWEMNTAPUQQS-UHFFFAOYSA-N 1 1 351.410 2.894 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000556740398 517620053 /nfs/dbraw/zinc/62/00/53/517620053.db2.gz WXHKFOYOMDOGLK-SNVBAGLBSA-N 1 1 371.235 2.821 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Cc1cccc([N+](=O)[O-])c1C ZINC000563108034 517663902 /nfs/dbraw/zinc/66/39/02/517663902.db2.gz SVBRMXIQPDZAEI-SFHVURJKSA-N 1 1 369.421 2.627 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000546589419 517742027 /nfs/dbraw/zinc/74/20/27/517742027.db2.gz SDBHZINZBGZWRY-UHFFFAOYSA-N 1 1 367.833 2.785 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CC2 ZINC000563248666 517769068 /nfs/dbraw/zinc/76/90/68/517769068.db2.gz GWFSLBZDNUULIB-OAHLLOKOSA-N 1 1 354.410 2.853 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000521769873 517849990 /nfs/dbraw/zinc/84/99/90/517849990.db2.gz FNKCTWHSTMVGJZ-VXGBXAGGSA-N 1 1 367.833 2.616 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC000538943875 517856363 /nfs/dbraw/zinc/85/63/63/517856363.db2.gz XNTXFSOIFXFYRS-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC000538943875 517856374 /nfs/dbraw/zinc/85/63/74/517856374.db2.gz XNTXFSOIFXFYRS-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000516826134 517858907 /nfs/dbraw/zinc/85/89/07/517858907.db2.gz OROYAWHIIAEYGA-FZKQIMNGSA-N 1 1 373.457 2.600 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000560595092 517918175 /nfs/dbraw/zinc/91/81/75/517918175.db2.gz NTMBYKNMHUZJOB-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000560595092 517918182 /nfs/dbraw/zinc/91/81/82/517918182.db2.gz NTMBYKNMHUZJOB-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO Cc1c(C[N@@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000550225476 517937277 /nfs/dbraw/zinc/93/72/77/517937277.db2.gz IFYYETDCXRWACT-LJQANCHMSA-N 1 1 353.422 2.836 20 5 FFBDMO Cc1c(C[N@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000550225476 517937286 /nfs/dbraw/zinc/93/72/86/517937286.db2.gz IFYYETDCXRWACT-LJQANCHMSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[N@H+](CCOC)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000553930520 517975893 /nfs/dbraw/zinc/97/58/93/517975893.db2.gz XTADDSUMRGEMCB-UHFFFAOYSA-N 1 1 364.427 2.625 20 5 FFBDMO CC[N@@H+](CCOC)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000553930520 517975898 /nfs/dbraw/zinc/97/58/98/517975898.db2.gz XTADDSUMRGEMCB-UHFFFAOYSA-N 1 1 364.427 2.625 20 5 FFBDMO COC(=O)c1cccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000539381393 518017890 /nfs/dbraw/zinc/01/78/90/518017890.db2.gz WAAYKDJFMOOPDT-LBPRGKRZSA-N 1 1 357.366 2.671 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(F)cc1 ZINC000539378555 518018263 /nfs/dbraw/zinc/01/82/63/518018263.db2.gz FTYVCGIBMIGTDF-KRWDZBQOSA-N 1 1 361.373 2.958 20 5 FFBDMO CCC[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000539422492 518040641 /nfs/dbraw/zinc/04/06/41/518040641.db2.gz PZDYQEXFMHQXCC-GOSISDBHSA-N 1 1 357.458 2.778 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])[C@H](C)C1 ZINC000557534565 518061084 /nfs/dbraw/zinc/06/10/84/518061084.db2.gz FGZCAGCBDXXYNA-CQSZACIVSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])[C@H](C)C1 ZINC000557534565 518061090 /nfs/dbraw/zinc/06/10/90/518061090.db2.gz FGZCAGCBDXXYNA-CQSZACIVSA-N 1 1 354.410 2.823 20 5 FFBDMO COCC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccco1 ZINC000543458486 518102578 /nfs/dbraw/zinc/10/25/78/518102578.db2.gz ADRNSDKELRTGOH-ZDUSSCGKSA-N 1 1 363.370 2.502 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000539821196 518169003 /nfs/dbraw/zinc/16/90/03/518169003.db2.gz MXMMNNVEKKKTTH-LJQANCHMSA-N 1 1 355.394 2.957 20 5 FFBDMO CC(C)Oc1nc(N(C)CC(C)(C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000576172044 518463863 /nfs/dbraw/zinc/46/38/63/518463863.db2.gz BPNASFJTDSZYNI-UHFFFAOYSA-N 1 1 366.462 2.572 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000576192023 518472907 /nfs/dbraw/zinc/47/29/07/518472907.db2.gz MBSPUHHYEDTVPF-CQSZACIVSA-N 1 1 366.437 2.714 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000576311167 518529800 /nfs/dbraw/zinc/52/98/00/518529800.db2.gz UXNGGODZYUERSZ-QGZVFWFLSA-N 1 1 361.442 2.891 20 5 FFBDMO O=C(C[N@H+]1CCCCC[C@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000585754960 518586281 /nfs/dbraw/zinc/58/62/81/518586281.db2.gz YUUGEWKLRLNOCI-ZDUSSCGKSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@H]1CCO)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000585754960 518586288 /nfs/dbraw/zinc/58/62/88/518586288.db2.gz YUUGEWKLRLNOCI-ZDUSSCGKSA-N 1 1 355.822 2.814 20 5 FFBDMO CC[N@H+](Cc1ccncc1)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000576551608 518648342 /nfs/dbraw/zinc/64/83/42/518648342.db2.gz GJRYNMCTMVGFLY-UHFFFAOYSA-N 1 1 359.382 2.564 20 5 FFBDMO CC[N@@H+](Cc1ccncc1)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1 ZINC000576551608 518648345 /nfs/dbraw/zinc/64/83/45/518648345.db2.gz GJRYNMCTMVGFLY-UHFFFAOYSA-N 1 1 359.382 2.564 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000576558066 518649687 /nfs/dbraw/zinc/64/96/87/518649687.db2.gz VVLCYMOWIPUJFL-SFHVURJKSA-N 1 1 358.442 2.998 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000570597061 518685724 /nfs/dbraw/zinc/68/57/24/518685724.db2.gz QCYGTKNBIZMJGL-RHSMWYFYSA-N 1 1 373.457 2.821 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000570597061 518685731 /nfs/dbraw/zinc/68/57/31/518685731.db2.gz QCYGTKNBIZMJGL-RHSMWYFYSA-N 1 1 373.457 2.821 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C[N@H+]1C1CC1 ZINC000582311531 518692821 /nfs/dbraw/zinc/69/28/21/518692821.db2.gz PCEAFIZSXZNNDI-QWHCGFSZSA-N 1 1 364.421 2.608 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCC1(F)F ZINC000582329515 518698362 /nfs/dbraw/zinc/69/83/62/518698362.db2.gz VIVALWDXEGVTEJ-LLVKDONJSA-N 1 1 355.341 2.870 20 5 FFBDMO O=[N+]([O-])c1cncc(Cl)c1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000589108125 518917306 /nfs/dbraw/zinc/91/73/06/518917306.db2.gz NOKQEAVNCWPPJC-UHFFFAOYSA-N 1 1 362.817 2.509 20 5 FFBDMO Cc1c(Cc2nc([C@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303316 519014390 /nfs/dbraw/zinc/01/43/90/519014390.db2.gz MYKGBQAVLHSVNX-QAPCUYQASA-N 1 1 358.398 2.803 20 5 FFBDMO Cc1c(Cc2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000577303316 519014396 /nfs/dbraw/zinc/01/43/96/519014396.db2.gz MYKGBQAVLHSVNX-QAPCUYQASA-N 1 1 358.398 2.803 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](CCO)c2ccccc2)c1 ZINC000589499798 519019203 /nfs/dbraw/zinc/01/92/03/519019203.db2.gz CYFDNVUDOJNODA-QGZVFWFLSA-N 1 1 358.394 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](CCO)c2ccccc2)c1 ZINC000589499798 519019212 /nfs/dbraw/zinc/01/92/12/519019212.db2.gz CYFDNVUDOJNODA-QGZVFWFLSA-N 1 1 358.394 2.937 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(OC)cc2)CC1 ZINC000571318747 519036593 /nfs/dbraw/zinc/03/65/93/519036593.db2.gz MSRLRUOXGAKQDX-UHFFFAOYSA-N 1 1 373.457 2.841 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c1 ZINC000589737654 519074272 /nfs/dbraw/zinc/07/42/72/519074272.db2.gz FUOPERCTVOCWLE-HXUWFJFHSA-N 1 1 370.405 2.517 20 5 FFBDMO C[C@@H]1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000568582043 519109609 /nfs/dbraw/zinc/10/96/09/519109609.db2.gz VAWWGDBTBJMJIS-LBPRGKRZSA-N 1 1 357.414 2.554 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(c3c(Br)cncc3[N+](=O)[O-])C2)C1 ZINC000590141901 519160314 /nfs/dbraw/zinc/16/03/14/519160314.db2.gz HLTHUOCHUXTVGM-AWEZNQCLSA-N 1 1 355.236 2.674 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590926382 519438163 /nfs/dbraw/zinc/43/81/63/519438163.db2.gz OGIPBPXYRCMRHV-FUHWJXTLSA-N 1 1 360.458 2.968 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000581141061 519544195 /nfs/dbraw/zinc/54/41/95/519544195.db2.gz UPHDIIGMYOWNSR-HNNXBMFYSA-N 1 1 368.393 2.777 20 5 FFBDMO C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000566564338 519554038 /nfs/dbraw/zinc/55/40/38/519554038.db2.gz OPFOFJRQQRLBIO-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000566564338 519554049 /nfs/dbraw/zinc/55/40/49/519554049.db2.gz OPFOFJRQQRLBIO-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000566564338 519554056 /nfs/dbraw/zinc/55/40/56/519554056.db2.gz OPFOFJRQQRLBIO-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000581184672 519564885 /nfs/dbraw/zinc/56/48/85/519564885.db2.gz DZGUJEWQXHNUFQ-JTQLQIEISA-N 1 1 353.806 2.931 20 5 FFBDMO O=[N+]([O-])c1cc(CNC2CC[NH+]([C@H]3CCOC3)CC2)cc(C(F)(F)F)c1 ZINC000594501403 520004305 /nfs/dbraw/zinc/00/43/05/520004305.db2.gz UTKLGQSAUARXII-HNNXBMFYSA-N 1 1 373.375 2.957 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000597605701 520132726 /nfs/dbraw/zinc/13/27/26/520132726.db2.gz SAGQLQMGLWTENS-GFCCVEGCSA-N 1 1 357.357 2.753 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000600224900 520136782 /nfs/dbraw/zinc/13/67/82/520136782.db2.gz RTYXBMZOOJNLSK-LJQANCHMSA-N 1 1 370.453 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1C ZINC000594793071 520159286 /nfs/dbraw/zinc/15/92/86/520159286.db2.gz UETZBILHRXJKET-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(Cn2cc(C[NH+]3CCCC3)nn2)c1 ZINC000603230712 520171133 /nfs/dbraw/zinc/17/11/33/520171133.db2.gz FGMORSJMERZIOU-UHFFFAOYSA-N 1 1 355.320 2.849 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)Cn1ccc3cc([N+](=O)[O-])ccc31)CC2 ZINC000612850122 520184492 /nfs/dbraw/zinc/18/44/92/520184492.db2.gz PJEVJFOCKWZJMX-UHFFFAOYSA-N 1 1 356.426 2.636 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000600300122 520189191 /nfs/dbraw/zinc/18/91/91/520189191.db2.gz XZIFCIIVTXPTGX-QGZVFWFLSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000600300122 520189197 /nfs/dbraw/zinc/18/91/97/520189197.db2.gz XZIFCIIVTXPTGX-QGZVFWFLSA-N 1 1 355.394 2.608 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C2 ZINC000597711917 520192234 /nfs/dbraw/zinc/19/22/34/520192234.db2.gz XMOFMDGRZANGEL-QGZVFWFLSA-N 1 1 369.368 2.754 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCOCC(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132967 520207617 /nfs/dbraw/zinc/20/76/17/520207617.db2.gz QHBWODUEUSQNMY-SHTZXODSSA-N 1 1 358.385 2.982 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)C(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132199 520207640 /nfs/dbraw/zinc/20/76/40/520207640.db2.gz BCOYCRCUVGDBNJ-YDHLFZDLSA-N 1 1 362.348 2.624 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)C(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132199 520207646 /nfs/dbraw/zinc/20/76/46/520207646.db2.gz BCOYCRCUVGDBNJ-YDHLFZDLSA-N 1 1 362.348 2.624 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C(=O)NCc1ccccc1 ZINC000595006252 520253378 /nfs/dbraw/zinc/25/33/78/520253378.db2.gz HSDPCWZNAHDMMO-KBPBESRZSA-N 1 1 357.410 2.959 20 5 FFBDMO Cn1ccnc1[C@@H](N[C@@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595056353 520272305 /nfs/dbraw/zinc/27/23/05/520272305.db2.gz FOPMTLYOKMYXIM-WBVHZDCISA-N 1 1 357.458 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597855649 520283971 /nfs/dbraw/zinc/28/39/71/520283971.db2.gz UIEKUYDYJJWXMU-AWEZNQCLSA-N 1 1 371.441 2.631 20 5 FFBDMO CCOc1ccc([C@@H](C)NC2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106580 520297298 /nfs/dbraw/zinc/29/72/98/520297298.db2.gz VKZIXAQCNATUIO-RHSMWYFYSA-N 1 1 363.458 2.897 20 5 FFBDMO COc1ccc(COCC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000609385157 520300777 /nfs/dbraw/zinc/30/07/77/520300777.db2.gz UVEJELKZIKQHSG-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO CN1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)Cc2ccccc21 ZINC000609448950 520315331 /nfs/dbraw/zinc/31/53/31/520315331.db2.gz BAHPUHPOJNKGMD-IBGZPJMESA-N 1 1 366.421 2.652 20 5 FFBDMO CN1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)Cc2ccccc21 ZINC000609448950 520315337 /nfs/dbraw/zinc/31/53/37/520315337.db2.gz BAHPUHPOJNKGMD-IBGZPJMESA-N 1 1 366.421 2.652 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCc2ccccc2-n2cc[nH+]c2C)c1[N+](=O)[O-] ZINC000609476760 520323668 /nfs/dbraw/zinc/32/36/68/520323668.db2.gz JPWRMGRWDCZFAH-UHFFFAOYSA-N 1 1 368.397 2.695 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000609489453 520329688 /nfs/dbraw/zinc/32/96/88/520329688.db2.gz NWFSIEQLNBMCGE-HNNXBMFYSA-N 1 1 363.458 2.990 20 5 FFBDMO CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CC[N@@H+](C)C1 ZINC000597945598 520343892 /nfs/dbraw/zinc/34/38/92/520343892.db2.gz JLGTWAUTTLSRTR-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000597944999 520344069 /nfs/dbraw/zinc/34/40/69/520344069.db2.gz GETLWDZNSRNFKO-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C([C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)N1CCCC1 ZINC000609552837 520355520 /nfs/dbraw/zinc/35/55/20/520355520.db2.gz FBVCQJOEXQGRCI-MRXNPFEDSA-N 1 1 361.442 2.698 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000603929292 520407103 /nfs/dbraw/zinc/40/71/03/520407103.db2.gz JAVSISHMAUACRI-OAHLLOKOSA-N 1 1 354.410 2.641 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609730672 520416714 /nfs/dbraw/zinc/41/67/14/520416714.db2.gz GIPFGBBZIHKSFK-CYBMUJFWSA-N 1 1 369.849 2.864 20 5 FFBDMO CCC(CC)C(=O)N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000604012159 520426349 /nfs/dbraw/zinc/42/63/49/520426349.db2.gz DDAKVFVHSHWQFV-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595404365 520449162 /nfs/dbraw/zinc/44/91/62/520449162.db2.gz WTTIOLWTSYXLCL-UHFFFAOYSA-N 1 1 364.465 2.724 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](CN1CCOCC1)c1ccccc1 ZINC000595412224 520453030 /nfs/dbraw/zinc/45/30/30/520453030.db2.gz WKCLOAGJWIJVQL-GOSISDBHSA-N 1 1 359.401 2.897 20 5 FFBDMO CN(Cc1ccc(F)cc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000595448404 520477765 /nfs/dbraw/zinc/47/77/65/520477765.db2.gz KBBFLSIEVXGRGF-HXUWFJFHSA-N 1 1 373.428 2.803 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000604198252 520483527 /nfs/dbraw/zinc/48/35/27/520483527.db2.gz DUUHUTNHUIFPFG-MRXNPFEDSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000598195846 520486735 /nfs/dbraw/zinc/48/67/35/520486735.db2.gz UPDPVYQBEMYTOM-KRWDZBQOSA-N 1 1 353.422 2.984 20 5 FFBDMO COC(=O)c1ccc2[nH]c(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)nc2c1 ZINC000595477473 520497138 /nfs/dbraw/zinc/49/71/38/520497138.db2.gz UDTSEPIVOUFJJJ-UHFFFAOYSA-N 1 1 368.393 2.932 20 5 FFBDMO COC(=O)c1ccc2[nH]c(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)nc2c1 ZINC000595477473 520497147 /nfs/dbraw/zinc/49/71/47/520497147.db2.gz UDTSEPIVOUFJJJ-UHFFFAOYSA-N 1 1 368.393 2.932 20 5 FFBDMO COc1cc(C[NH2+][C@H](c2cccnc2)C(C)(C)CO)c([N+](=O)[O-])cc1F ZINC000595499867 520509331 /nfs/dbraw/zinc/50/93/31/520509331.db2.gz OLWSPFCZQUQIBJ-QGZVFWFLSA-N 1 1 363.389 2.987 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595522866 520527172 /nfs/dbraw/zinc/52/71/72/520527172.db2.gz PARLTDQONGQDIG-MRXNPFEDSA-N 1 1 360.458 2.559 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000604446402 520564643 /nfs/dbraw/zinc/56/46/43/520564643.db2.gz LUXNZRHNOVOPBV-OLZOCXBDSA-N 1 1 369.849 2.864 20 5 FFBDMO Cn1c(C(=O)N2CCC([N@H+]3CCc4ccccc4C3)CC2)ccc1[N+](=O)[O-] ZINC000604482560 520573348 /nfs/dbraw/zinc/57/33/48/520573348.db2.gz PYEFHBZITJRPSI-UHFFFAOYSA-N 1 1 368.437 2.596 20 5 FFBDMO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)C(=O)OC(C)(C)C ZINC000595599640 520582957 /nfs/dbraw/zinc/58/29/57/520582957.db2.gz ARAUUAUAYLYRSF-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)C(=O)OC(C)(C)C ZINC000595599640 520582963 /nfs/dbraw/zinc/58/29/63/520582963.db2.gz ARAUUAUAYLYRSF-CYBMUJFWSA-N 1 1 365.430 2.976 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(c3ncc(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000601101657 520636110 /nfs/dbraw/zinc/63/61/10/520636110.db2.gz RJANRTNPQHDNFL-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO O=C([C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1)N1CCCC1 ZINC000601115542 520644079 /nfs/dbraw/zinc/64/40/79/520644079.db2.gz IDMXXBZEXDNJAD-CQSZACIVSA-N 1 1 354.410 2.982 20 5 FFBDMO Cc1ccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000601116798 520644258 /nfs/dbraw/zinc/64/42/58/520644258.db2.gz WZBRBHTYYHOSPJ-UHFFFAOYSA-N 1 1 352.387 2.606 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000610359986 520650249 /nfs/dbraw/zinc/65/02/49/520650249.db2.gz GZBDHCHWULFIHR-WBVHZDCISA-N 1 1 356.426 2.635 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000601132594 520652040 /nfs/dbraw/zinc/65/20/40/520652040.db2.gz KHESSUQUQOAREJ-CMPLNLGQSA-N 1 1 373.379 2.800 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 ZINC000610367709 520652623 /nfs/dbraw/zinc/65/26/23/520652623.db2.gz YFQIZWBNNYADKX-UHFFFAOYSA-N 1 1 374.393 2.885 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598507882 520667321 /nfs/dbraw/zinc/66/73/21/520667321.db2.gz DILZMBKDUWLFHF-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598507882 520667333 /nfs/dbraw/zinc/66/73/33/520667333.db2.gz DILZMBKDUWLFHF-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO Cn1ccnc1[C@@H]1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601172930 520672554 /nfs/dbraw/zinc/67/25/54/520672554.db2.gz LRKWYSDGWYVSST-PXAZEXFGSA-N 1 1 353.382 2.631 20 5 FFBDMO C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000593028120 520693794 /nfs/dbraw/zinc/69/37/94/520693794.db2.gz CUDZHXKAUSYCEP-CQSZACIVSA-N 1 1 371.412 2.839 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595756242 520701877 /nfs/dbraw/zinc/70/18/77/520701877.db2.gz FRMFUYJNALOUCD-PXAZEXFGSA-N 1 1 372.368 2.716 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557344 520703865 /nfs/dbraw/zinc/70/38/65/520703865.db2.gz FDQVQAVFOQOAOX-MRXNPFEDSA-N 1 1 373.453 2.796 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000598559430 520705637 /nfs/dbraw/zinc/70/56/37/520705637.db2.gz HHFRKMIDMBBVIP-CQSZACIVSA-N 1 1 356.426 2.928 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000598562525 520708552 /nfs/dbraw/zinc/70/85/52/520708552.db2.gz VVYUUDFFOQRPOY-AWEZNQCLSA-N 1 1 356.426 2.928 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595786254 520723580 /nfs/dbraw/zinc/72/35/80/520723580.db2.gz HDASYRNGCNDLSF-IPELMVKDSA-N 1 1 373.453 2.981 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610572528 520744682 /nfs/dbraw/zinc/74/46/82/520744682.db2.gz DUWRDFGBEAZDSK-GFCCVEGCSA-N 1 1 368.231 2.571 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581033 520748277 /nfs/dbraw/zinc/74/82/77/520748277.db2.gz ZHPOFMSOOYJRTK-FMKPAKJESA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581033 520748280 /nfs/dbraw/zinc/74/82/80/520748280.db2.gz ZHPOFMSOOYJRTK-FMKPAKJESA-N 1 1 374.441 2.810 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H](C)O1 ZINC000610581033 520748284 /nfs/dbraw/zinc/74/82/84/520748284.db2.gz ZHPOFMSOOYJRTK-FMKPAKJESA-N 1 1 374.441 2.810 20 5 FFBDMO COC(=O)c1ccnc(N2CCC(Oc3cc[nH+]cc3C)CC2)c1[N+](=O)[O-] ZINC000598620346 520748566 /nfs/dbraw/zinc/74/85/66/520748566.db2.gz BTIINEWAADBLLN-UHFFFAOYSA-N 1 1 372.381 2.528 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(F)cc2C(N)=O)CC1 ZINC000598647303 520759667 /nfs/dbraw/zinc/75/96/67/520759667.db2.gz IKBHBGLNXYOXOT-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO CC(C)C[N@H+](Cc1cccc(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000598647794 520760599 /nfs/dbraw/zinc/76/05/99/520760599.db2.gz JDBKJBOWPJIULK-KRWDZBQOSA-N 1 1 366.849 2.964 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595869491 520779317 /nfs/dbraw/zinc/77/93/17/520779317.db2.gz DLKDUKGQIDYTCR-DIFFPNOSSA-N 1 1 374.384 2.698 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900781 520806153 /nfs/dbraw/zinc/80/61/53/520806153.db2.gz LDZAMUXLZMYIFT-GDBMZVCRSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000593188213 520811956 /nfs/dbraw/zinc/81/19/56/520811956.db2.gz YXEYODZNLONPBX-RRFJBIMHSA-N 1 1 360.458 2.748 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)C1(c3ccc([N+](=O)[O-])cc3)CCC1)C2 ZINC000601614578 520866120 /nfs/dbraw/zinc/86/61/20/520866120.db2.gz XIOOIUNLWAMPQR-IBGZPJMESA-N 1 1 357.454 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945209 520912399 /nfs/dbraw/zinc/91/23/99/520912399.db2.gz SQLPIECGDSEDIQ-GJZGRUSLSA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945209 520912407 /nfs/dbraw/zinc/91/24/07/520912407.db2.gz SQLPIECGDSEDIQ-GJZGRUSLSA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNc3cc[nH]c(=O)c3[N+](=O)[O-])CC2)oc1C ZINC000596124701 520927193 /nfs/dbraw/zinc/92/71/93/520927193.db2.gz YVSFHNITKUJHMW-UHFFFAOYSA-N 1 1 361.402 2.624 20 5 FFBDMO COc1cc(C[NH2+]C[C@@H](n2cccn2)C(F)(F)F)c([N+](=O)[O-])cc1OC ZINC000598989933 520963798 /nfs/dbraw/zinc/96/37/98/520963798.db2.gz WKTQWRPYJKGFDY-CQSZACIVSA-N 1 1 374.319 2.702 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000611072244 520971607 /nfs/dbraw/zinc/97/16/07/520971607.db2.gz BGZNFYROGILDKC-GOEBONIOSA-N 1 1 359.426 2.579 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088199 520978326 /nfs/dbraw/zinc/97/83/26/520978326.db2.gz JJFJFIKISMFWLI-CVEARBPZSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088199 520978333 /nfs/dbraw/zinc/97/83/33/520978333.db2.gz JJFJFIKISMFWLI-CVEARBPZSA-N 1 1 374.485 2.997 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000596243051 520990701 /nfs/dbraw/zinc/99/07/01/520990701.db2.gz FONXUZCBHQCNJP-KRWDZBQOSA-N 1 1 367.833 2.957 20 5 FFBDMO CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1cc[nH]c(=O)c1[N+](=O)[O-] ZINC000596270744 521002735 /nfs/dbraw/zinc/00/27/35/521002735.db2.gz HLNRYEVYQPFKBF-NVXWUHKLSA-N 1 1 372.425 2.644 20 5 FFBDMO CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)[C@H](C)C1 ZINC000596270236 521003155 /nfs/dbraw/zinc/00/31/55/521003155.db2.gz XEXRNDBWEPWCPW-LLVKDONJSA-N 1 1 355.822 2.955 20 5 FFBDMO Cc1nc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000593496581 521031915 /nfs/dbraw/zinc/03/19/15/521031915.db2.gz SNBAZHDMXYKIDF-OALUTQOASA-N 1 1 368.437 2.778 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000601969702 521049504 /nfs/dbraw/zinc/04/95/04/521049504.db2.gz DWMAOAGNFYAJKZ-NVXWUHKLSA-N 1 1 352.337 2.774 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599164068 521066501 /nfs/dbraw/zinc/06/65/01/521066501.db2.gz IZSNLCWXTMPLQS-LLVKDONJSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599164068 521066507 /nfs/dbraw/zinc/06/65/07/521066507.db2.gz IZSNLCWXTMPLQS-LLVKDONJSA-N 1 1 355.236 2.603 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599203664 521084677 /nfs/dbraw/zinc/08/46/77/521084677.db2.gz MWGRARRCXPQFSM-GOSISDBHSA-N 1 1 360.458 2.796 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599203757 521085905 /nfs/dbraw/zinc/08/59/05/521085905.db2.gz POODYXFDEQOCSJ-QGZVFWFLSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1 ZINC000611400584 521137295 /nfs/dbraw/zinc/13/72/95/521137295.db2.gz SBCPKEVXXQRDEQ-DOMZBBRYSA-N 1 1 367.471 2.544 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1 ZINC000611400584 521137302 /nfs/dbraw/zinc/13/73/02/521137302.db2.gz SBCPKEVXXQRDEQ-DOMZBBRYSA-N 1 1 367.471 2.544 20 5 FFBDMO CC1(C)Cc2n[nH]cc2C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000596596762 521154248 /nfs/dbraw/zinc/15/42/48/521154248.db2.gz FFSZJALFZZBJLY-UHFFFAOYSA-N 1 1 357.414 2.731 20 5 FFBDMO COc1cc(C[NH2+]Cc2cc(C)n[nH]2)c([N+](=O)[O-])cc1OCC(F)F ZINC000611520547 521200285 /nfs/dbraw/zinc/20/02/85/521200285.db2.gz QOOJJSIZPQWQKN-UHFFFAOYSA-N 1 1 356.329 2.569 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(CO)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560805 521218931 /nfs/dbraw/zinc/21/89/31/521218931.db2.gz BKILJEATBOQXIR-IBGZPJMESA-N 1 1 366.421 2.742 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](OC(F)F)C2)c([N+](=O)[O-])c1 ZINC000611577758 521233085 /nfs/dbraw/zinc/23/30/85/521233085.db2.gz KRZUYVRLPSNVTL-LBPRGKRZSA-N 1 1 373.356 2.636 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000611583185 521236756 /nfs/dbraw/zinc/23/67/56/521236756.db2.gz LWRPCQVLPSZLNQ-STQMWFEESA-N 1 1 363.462 2.824 20 5 FFBDMO C[C@H]1C[C@@H](N(C)Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000602472323 521362949 /nfs/dbraw/zinc/36/29/49/521362949.db2.gz DZEJDPCQHDCLRZ-YJBOKZPZSA-N 1 1 357.458 2.813 20 5 FFBDMO COC(=O)[C@@](C)(NCCCCn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000599652941 521363004 /nfs/dbraw/zinc/36/30/04/521363004.db2.gz OAZFWKWGYXGXEV-SFHVURJKSA-N 1 1 360.414 2.558 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000596899115 521366929 /nfs/dbraw/zinc/36/69/29/521366929.db2.gz BSSJJSSPAIMOEH-NSHDSACASA-N 1 1 371.235 2.963 20 5 FFBDMO C/C=C/C[C@@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690293 521404525 /nfs/dbraw/zinc/40/45/25/521404525.db2.gz NCVDAMHDZIGTGG-YWVDXFKGSA-N 1 1 361.398 2.940 20 5 FFBDMO C/C=C/C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690293 521404529 /nfs/dbraw/zinc/40/45/29/521404529.db2.gz NCVDAMHDZIGTGG-YWVDXFKGSA-N 1 1 361.398 2.940 20 5 FFBDMO CN(C)CC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(C)(C)C ZINC000602547344 521405340 /nfs/dbraw/zinc/40/53/40/521405340.db2.gz SRFRAWGELSWACC-KRWDZBQOSA-N 1 1 363.506 2.915 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000599695330 521407497 /nfs/dbraw/zinc/40/74/97/521407497.db2.gz LLIWGTHXZWPBLP-BTTYYORXSA-N 1 1 363.414 2.585 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000594198653 521464359 /nfs/dbraw/zinc/46/43/59/521464359.db2.gz UIHDLABNHTWJSU-QWHCGFSZSA-N 1 1 369.368 2.943 20 5 FFBDMO Cn1cc(C[NH2+]C2(c3ccc(Br)cc3)CC2)c([N+](=O)[O-])n1 ZINC000602803393 521542601 /nfs/dbraw/zinc/54/26/01/521542601.db2.gz YJGAOQGUVRXLKH-UHFFFAOYSA-N 1 1 351.204 2.870 20 5 FFBDMO COc1cc(C[NH+]2CC([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000619432177 521564518 /nfs/dbraw/zinc/56/45/18/521564518.db2.gz CMCOIPVZJUFWAY-LLVKDONJSA-N 1 1 372.368 2.716 20 5 FFBDMO CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000615942195 521583994 /nfs/dbraw/zinc/58/39/94/521583994.db2.gz FOPLJHPTFOYUKH-OAHLLOKOSA-N 1 1 352.866 2.853 20 5 FFBDMO CN(c1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000615942195 521583997 /nfs/dbraw/zinc/58/39/97/521583997.db2.gz FOPLJHPTFOYUKH-OAHLLOKOSA-N 1 1 352.866 2.853 20 5 FFBDMO COc1cc(C[N@H+](C)C2(CO)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000597254846 521598586 /nfs/dbraw/zinc/59/85/86/521598586.db2.gz MIKFDGDQSYYQEO-UHFFFAOYSA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@@H+](C)C2(CO)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000597254846 521598589 /nfs/dbraw/zinc/59/85/89/521598589.db2.gz MIKFDGDQSYYQEO-UHFFFAOYSA-N 1 1 364.320 2.501 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CCC[N@H+](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000619541083 521758942 /nfs/dbraw/zinc/75/89/42/521758942.db2.gz FEQICVJHIFCANR-NSHDSACASA-N 1 1 371.235 2.881 20 5 FFBDMO COc1ccc2c(c1)OCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000619810470 521883947 /nfs/dbraw/zinc/88/39/47/521883947.db2.gz YTHHUJGYPOHJKE-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc2c(c1)OCC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000619810470 521883955 /nfs/dbraw/zinc/88/39/55/521883955.db2.gz YTHHUJGYPOHJKE-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc(-c3nn[nH]n3)s2)c1 ZINC000823640080 606772262 /nfs/dbraw/zinc/77/22/62/606772262.db2.gz RHDSMEMDNAYQRX-UHFFFAOYSA-N 1 1 350.791 2.780 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001164625860 719087462 /nfs/dbraw/zinc/08/74/62/719087462.db2.gz HESZIOCQDDWPKB-IEBWSBKVSA-N 1 1 368.437 2.637 20 5 FFBDMO COc1cc(C)nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164722585 720373724 /nfs/dbraw/zinc/37/37/24/720373724.db2.gz DOOAIGWTLNLREM-HOTGVXAUSA-N 1 1 369.425 2.555 20 5 FFBDMO CCc1nn(C)cc1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162216749 728941083 /nfs/dbraw/zinc/94/10/83/728941083.db2.gz UWEUOKUDVGUXRM-UHFFFAOYSA-N 1 1 353.220 2.943 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000106868999 728513144 /nfs/dbraw/zinc/51/31/44/728513144.db2.gz NGSDSQLADDYYBO-CYBMUJFWSA-N 1 1 351.403 2.573 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000106868999 728513146 /nfs/dbraw/zinc/51/31/46/728513146.db2.gz NGSDSQLADDYYBO-CYBMUJFWSA-N 1 1 351.403 2.573 20 5 FFBDMO COCCC[N@@H+](CCOC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000123002951 728653985 /nfs/dbraw/zinc/65/39/85/728653985.db2.gz PMKRDAARBDZZAP-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000130206818 728715869 /nfs/dbraw/zinc/71/58/69/728715869.db2.gz IMGCUKWFUPICDL-UHFFFAOYSA-N 1 1 351.447 2.536 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CCCO1 ZINC000172180796 729020951 /nfs/dbraw/zinc/02/09/51/729020951.db2.gz YCCBXQNIQNYFJT-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H]1CCCO1 ZINC000172180796 729020953 /nfs/dbraw/zinc/02/09/53/729020953.db2.gz YCCBXQNIQNYFJT-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)ON=C(N)[C@@H]1C[N@H+](C(C)C)CCO1 ZINC000779651016 738474804 /nfs/dbraw/zinc/47/48/04/738474804.db2.gz BTSWGFDUOHBACY-BBRMVZONSA-N 1 1 350.419 2.572 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)ON=C(N)[C@@H]1C[N@@H+](C(C)C)CCO1 ZINC000779651016 738474805 /nfs/dbraw/zinc/47/48/05/738474805.db2.gz BTSWGFDUOHBACY-BBRMVZONSA-N 1 1 350.419 2.572 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000861340142 730600643 /nfs/dbraw/zinc/60/06/43/730600643.db2.gz FFZMUYULNXRSIX-HACGYAERSA-N 1 1 368.455 2.728 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000861340489 730601032 /nfs/dbraw/zinc/60/10/32/730601032.db2.gz HYSXHYBICRLLNI-WBMJQRKESA-N 1 1 354.428 2.583 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000925139038 738481118 /nfs/dbraw/zinc/48/11/18/738481118.db2.gz JDIPKXYXUQBFHD-ZFWWWQNUSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000861786956 730641541 /nfs/dbraw/zinc/64/15/41/730641541.db2.gz WBAZALGNFUXAHC-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)cc1C ZINC000769899943 737581429 /nfs/dbraw/zinc/58/14/29/737581429.db2.gz NUIPRUCVNYTIQL-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(NCC[N@@H+]2CCc3sccc3C2)cc1F ZINC000865461222 730958297 /nfs/dbraw/zinc/95/82/97/730958297.db2.gz YJXGOOMEUBYZLY-UHFFFAOYSA-N 1 1 351.403 2.758 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(NCC[N@H+]2CCc3sccc3C2)cc1F ZINC000865461222 730958299 /nfs/dbraw/zinc/95/82/99/730958299.db2.gz YJXGOOMEUBYZLY-UHFFFAOYSA-N 1 1 351.403 2.758 20 5 FFBDMO C[NH+]1CCN(C2CCN(c3cc(Cl)c(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000866211896 731041242 /nfs/dbraw/zinc/04/12/42/731041242.db2.gz ABSOORLECAAGQY-UHFFFAOYSA-N 1 1 356.829 2.604 20 5 FFBDMO C[C@@H](N[C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872036524 731722940 /nfs/dbraw/zinc/72/29/40/731722940.db2.gz TVSPWSXVCHGJPE-ZIAGYGMSSA-N 1 1 350.438 2.553 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000874838224 732106377 /nfs/dbraw/zinc/10/63/77/732106377.db2.gz OJLIFQPRFAEFHP-KGLIPLIRSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000877742366 732422287 /nfs/dbraw/zinc/42/22/87/732422287.db2.gz DABYVQCXJPUQLD-GXTWGEPZSA-N 1 1 354.248 2.883 20 5 FFBDMO C[N@H+]1CCN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1(C)C ZINC000878550974 732552968 /nfs/dbraw/zinc/55/29/68/732552968.db2.gz IRXNACLQOAADHC-UHFFFAOYSA-N 1 1 365.821 2.824 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000878943486 732619035 /nfs/dbraw/zinc/61/90/35/732619035.db2.gz GTMAWIDEYVWBED-CABCVRRESA-N 1 1 361.364 2.587 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000882328053 733209619 /nfs/dbraw/zinc/20/96/19/733209619.db2.gz KJGBOLVLXFOSHU-UHFFFAOYSA-N 1 1 355.460 2.619 20 5 FFBDMO C[C@@H]1COCC[N@@H+]1C1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000882539992 733241494 /nfs/dbraw/zinc/24/14/94/733241494.db2.gz HFURWORKMOEZMJ-GFCCVEGCSA-N 1 1 362.455 2.894 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000882539992 733241497 /nfs/dbraw/zinc/24/14/97/733241497.db2.gz HFURWORKMOEZMJ-GFCCVEGCSA-N 1 1 362.455 2.894 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000886201776 733759165 /nfs/dbraw/zinc/75/91/65/733759165.db2.gz QQNJSUXFTBDGEB-HNNXBMFYSA-N 1 1 366.215 2.750 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC000888834671 734103807 /nfs/dbraw/zinc/10/38/07/734103807.db2.gz NIAFELPEYCXJAV-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100784 738824095 /nfs/dbraw/zinc/82/40/95/738824095.db2.gz ZNOCHFUPYWPBMH-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100784 738824097 /nfs/dbraw/zinc/82/40/97/738824097.db2.gz ZNOCHFUPYWPBMH-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO NC(=O)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000784069627 738859733 /nfs/dbraw/zinc/85/97/33/738859733.db2.gz NJUBTVUEDYXQBK-HNNXBMFYSA-N 1 1 351.765 2.574 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC3(CCOCC3)[C@H]2C(C)C)c1[N+](=O)[O-] ZINC000894919508 734936747 /nfs/dbraw/zinc/93/67/47/734936747.db2.gz IQPAOBBOLCVZGB-QGZVFWFLSA-N 1 1 350.415 2.946 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)c1 ZINC000735492941 734948444 /nfs/dbraw/zinc/94/84/44/734948444.db2.gz LAQMCCXBDVMMPW-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@H]2CN2CCOCC2)c1 ZINC000735492941 734948447 /nfs/dbraw/zinc/94/84/47/734948447.db2.gz LAQMCCXBDVMMPW-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CCCC[C@H]2C[NH+]2CCOCC2)c1 ZINC000735492941 734948451 /nfs/dbraw/zinc/94/84/51/734948451.db2.gz LAQMCCXBDVMMPW-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=C(C[NH+]1CCC([C@H]2CCOC2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000784342141 738880809 /nfs/dbraw/zinc/88/08/09/738880809.db2.gz ORHSGVUMSRJXPX-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558409 735730943 /nfs/dbraw/zinc/73/09/43/735730943.db2.gz JAQWYGMYISJDEA-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558409 735730949 /nfs/dbraw/zinc/73/09/49/735730949.db2.gz JAQWYGMYISJDEA-CHWSQXEVSA-N 1 1 367.833 2.935 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2Br)C[C@H]1C ZINC000758905888 736531002 /nfs/dbraw/zinc/53/10/02/736531002.db2.gz XSWFEOQEBHEQQW-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507848 736741431 /nfs/dbraw/zinc/74/14/31/736741431.db2.gz ZDAUBYQAZIHWLU-TZMCWYRMSA-N 1 1 369.849 2.611 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000763309458 736926427 /nfs/dbraw/zinc/92/64/27/736926427.db2.gz XOAYBXLNYMUCKQ-QGZVFWFLSA-N 1 1 362.499 2.918 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000763977328 736983622 /nfs/dbraw/zinc/98/36/22/736983622.db2.gz IANQIAVNAKHSMS-WMLDXEAASA-N 1 1 350.415 2.598 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000765203341 737095431 /nfs/dbraw/zinc/09/54/31/737095431.db2.gz CAYBWGUBQJUMGP-HNNXBMFYSA-N 1 1 353.369 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000766205921 737207437 /nfs/dbraw/zinc/20/74/37/737207437.db2.gz ATHJAKXEQPTYRY-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000766205921 737207441 /nfs/dbraw/zinc/20/74/41/737207441.db2.gz ATHJAKXEQPTYRY-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO CCC[C@@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000766700065 737253716 /nfs/dbraw/zinc/25/37/16/737253716.db2.gz LVORTAAJBYWNAO-MRXNPFEDSA-N 1 1 366.487 2.724 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000767124204 737294749 /nfs/dbraw/zinc/29/47/49/737294749.db2.gz XROIDMXJSJUGTM-ZDUSSCGKSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000767124204 737294751 /nfs/dbraw/zinc/29/47/51/737294751.db2.gz XROIDMXJSJUGTM-ZDUSSCGKSA-N 1 1 369.849 2.821 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C[C@@]2(C)C1 ZINC000913269361 737389744 /nfs/dbraw/zinc/38/97/44/737389744.db2.gz BUBNRQXFHBDLSS-IYBDPMFKSA-N 1 1 355.797 2.801 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000770687271 737653108 /nfs/dbraw/zinc/65/31/08/737653108.db2.gz HONKFXBQUIVYRH-LBPRGKRZSA-N 1 1 355.803 2.571 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNc1nc2sccn2c1[N+](=O)[O-] ZINC000774537578 737998876 /nfs/dbraw/zinc/99/88/76/737998876.db2.gz VUDNDZOOLJUMQY-UHFFFAOYSA-N 1 1 355.383 2.805 20 5 FFBDMO COC(=O)CC[N@@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C(C)C ZINC000774634324 738007167 /nfs/dbraw/zinc/00/71/67/738007167.db2.gz DPGYYEPPBFMPOO-UHFFFAOYSA-N 1 1 354.794 2.829 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776590749 738212293 /nfs/dbraw/zinc/21/22/93/738212293.db2.gz KGAMYCXIJCWFLW-RHSMWYFYSA-N 1 1 350.415 2.684 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785727804 738991785 /nfs/dbraw/zinc/99/17/85/738991785.db2.gz JJSBUHAGSFYVKN-QWRGUYRKSA-N 1 1 369.805 2.603 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(C(=O)Nc3ccc(Br)c([N+](=O)[O-])c3)[C@@H]2C1 ZINC000930544028 739124543 /nfs/dbraw/zinc/12/45/43/739124543.db2.gz KBCUNSGVONOXSC-TVQRCGJNSA-N 1 1 369.219 2.525 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)COC(=O)N1 ZINC000932027455 739376810 /nfs/dbraw/zinc/37/68/10/739376810.db2.gz YYNMYTAULGCCFM-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)COC(=O)N1 ZINC000932094060 739385394 /nfs/dbraw/zinc/38/53/94/739385394.db2.gz SJCZYKUCSXVCBN-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO COCC[N@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@H]1CC[C@@H](C)C1 ZINC000790475951 739459622 /nfs/dbraw/zinc/45/96/22/739459622.db2.gz CLGOLXZNKPNJBP-MNOVXSKESA-N 1 1 361.240 2.648 20 5 FFBDMO COCC[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@H]1CC[C@@H](C)C1 ZINC000790475951 739459627 /nfs/dbraw/zinc/45/96/27/739459627.db2.gz CLGOLXZNKPNJBP-MNOVXSKESA-N 1 1 361.240 2.648 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)s1 ZINC000932666211 739488488 /nfs/dbraw/zinc/48/84/88/739488488.db2.gz FTVYYXVLZVOFSY-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)s1 ZINC000932666211 739488490 /nfs/dbraw/zinc/48/84/90/739488490.db2.gz FTVYYXVLZVOFSY-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000791119951 739531208 /nfs/dbraw/zinc/53/12/08/739531208.db2.gz UMNSKZAYYSLEEG-HNNXBMFYSA-N 1 1 368.455 2.587 20 5 FFBDMO CCO[C@H]1CC[N@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000932969583 739548005 /nfs/dbraw/zinc/54/80/05/739548005.db2.gz LYAIGXRKBOUBLI-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO CCO[C@H]1CC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000932969583 739548008 /nfs/dbraw/zinc/54/80/08/739548008.db2.gz LYAIGXRKBOUBLI-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO Cn1cc([C@@H]2CSCCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000933980294 739714683 /nfs/dbraw/zinc/71/46/83/739714683.db2.gz DUAZNKAZYXJXSF-KRWDZBQOSA-N 1 1 362.455 2.887 20 5 FFBDMO O=C1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])CCCCCN1 ZINC000934151734 739736403 /nfs/dbraw/zinc/73/64/03/739736403.db2.gz DEHQWXPDBVTAEP-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO O=C1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])CCCCCN1 ZINC000934151734 739736404 /nfs/dbraw/zinc/73/64/04/739736404.db2.gz DEHQWXPDBVTAEP-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334719 739767839 /nfs/dbraw/zinc/76/78/39/739767839.db2.gz FSIZCLPIOXMAJD-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334719 739767840 /nfs/dbraw/zinc/76/78/40/739767840.db2.gz FSIZCLPIOXMAJD-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H](N1CCOCC1)C(F)(F)F ZINC000796514375 740149189 /nfs/dbraw/zinc/14/91/89/740149189.db2.gz JXFUDYPVRLCQAF-ZDUSSCGKSA-N 1 1 367.755 2.601 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=S)NC[C@H]1CCC[N@H+]1CC ZINC000798374633 740326381 /nfs/dbraw/zinc/32/63/81/740326381.db2.gz WKMQDIBWWBGUNC-CYBMUJFWSA-N 1 1 352.460 2.764 20 5 FFBDMO CC(C)(C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000805611487 740991114 /nfs/dbraw/zinc/99/11/14/740991114.db2.gz BECLMYPQDKKZPT-UHFFFAOYSA-N 1 1 369.805 2.604 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2cc3ccccc3s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983652233 741246506 /nfs/dbraw/zinc/24/65/06/741246506.db2.gz AEJXIQMCXMYETI-UIBBOPPKSA-N 1 1 359.451 2.551 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)C1 ZINC000809916385 741360565 /nfs/dbraw/zinc/36/05/65/741360565.db2.gz IOSYEIQHKOGWNX-GFCCVEGCSA-N 1 1 370.837 2.727 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000811866176 741569043 /nfs/dbraw/zinc/56/90/43/741569043.db2.gz DILZDRRYGUOTBE-LLVKDONJSA-N 1 1 354.407 2.836 20 5 FFBDMO COCCC[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171279 741684577 /nfs/dbraw/zinc/68/45/77/741684577.db2.gz HXYNRLANYPYDHV-PBHICJAKSA-N 1 1 350.415 2.775 20 5 FFBDMO COCCC[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171279 741684579 /nfs/dbraw/zinc/68/45/79/741684579.db2.gz HXYNRLANYPYDHV-PBHICJAKSA-N 1 1 350.415 2.775 20 5 FFBDMO COCCC[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171280 741684641 /nfs/dbraw/zinc/68/46/41/741684641.db2.gz HXYNRLANYPYDHV-YOEHRIQHSA-N 1 1 350.415 2.775 20 5 FFBDMO COCCC[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171280 741684643 /nfs/dbraw/zinc/68/46/43/741684643.db2.gz HXYNRLANYPYDHV-YOEHRIQHSA-N 1 1 350.415 2.775 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1Cl ZINC000814908938 741873947 /nfs/dbraw/zinc/87/39/47/741873947.db2.gz HQJPWHOJSCOHQO-QGZVFWFLSA-N 1 1 367.833 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2c(F)cc(F)cc2F)c1 ZINC000819332992 742376038 /nfs/dbraw/zinc/37/60/38/742376038.db2.gz DNCQXJMHIFCLNC-LBPRGKRZSA-N 1 1 356.300 2.542 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)C2 ZINC000821026026 742578665 /nfs/dbraw/zinc/57/86/65/742578665.db2.gz OUQNOOQKPJGNTC-INIZCTEOSA-N 1 1 370.812 2.527 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]CC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326144 743511735 /nfs/dbraw/zinc/51/17/35/743511735.db2.gz UGMMTFKFRXEPNL-BRSBDYLESA-N 1 1 351.491 2.887 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000827247192 743541804 /nfs/dbraw/zinc/54/18/04/743541804.db2.gz VKLGSWYNABMJFB-ZWNOBZJWSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827286687 743548736 /nfs/dbraw/zinc/54/87/36/743548736.db2.gz HXMGZOPXZXTHMY-WCQYABFASA-N 1 1 369.874 2.893 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3c([N+](=O)[O-])cc(C(F)(F)F)cc3[N+](=O)[O-])C[C@@H]21 ZINC000828987396 745150721 /nfs/dbraw/zinc/15/07/21/745150721.db2.gz CLGRKZMBDQWTSR-PELKAZGASA-N 1 1 360.292 2.662 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H](CCCO)C1 ZINC000832784320 745754624 /nfs/dbraw/zinc/75/46/24/745754624.db2.gz YSZYNHSUOFWDHF-VXGBXAGGSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H](CCCO)C1 ZINC000832784320 745754629 /nfs/dbraw/zinc/75/46/29/745754629.db2.gz YSZYNHSUOFWDHF-VXGBXAGGSA-N 1 1 355.822 2.670 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)[C@H]1CCCO1 ZINC000839589579 746864955 /nfs/dbraw/zinc/86/49/55/746864955.db2.gz HWELQJXWZBIQRZ-DGCLKSJQSA-N 1 1 359.220 2.641 20 5 FFBDMO CCCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000844146465 747978542 /nfs/dbraw/zinc/97/85/42/747978542.db2.gz OFFQXTBPNCCDEB-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000846930011 748577954 /nfs/dbraw/zinc/57/79/54/748577954.db2.gz PKOIQMTWLBZVOD-HNNXBMFYSA-N 1 1 351.834 2.985 20 5 FFBDMO COC(=O)c1nc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)ccc1Cl ZINC000850516790 749379179 /nfs/dbraw/zinc/37/91/79/749379179.db2.gz YMAQCZOHDITMEX-SECBINFHSA-N 1 1 364.789 2.863 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1CCO ZINC000852463427 749867439 /nfs/dbraw/zinc/86/74/39/749867439.db2.gz VXGXOPGPQGRJQD-BLLLJJGKSA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1cc(S(=O)(=O)Nc2ccc(C[NH+](C)C)cc2F)c([N+](=O)[O-])s1 ZINC000601960357 845986144 /nfs/dbraw/zinc/98/61/44/845986144.db2.gz SNNXOKNBZZIYHF-UHFFFAOYSA-N 1 1 373.431 2.966 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266634 971206278 /nfs/dbraw/zinc/20/62/78/971206278.db2.gz SDWBLSUVVNNLHX-DOTOQJQBSA-N 1 1 357.410 2.844 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266634 971206281 /nfs/dbraw/zinc/20/62/81/971206281.db2.gz SDWBLSUVVNNLHX-DOTOQJQBSA-N 1 1 357.410 2.844 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000896736036 971683706 /nfs/dbraw/zinc/68/37/06/971683706.db2.gz RHCCTQBCSPEDPM-KRWDZBQOSA-N 1 1 361.442 2.837 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759910041 971948470 /nfs/dbraw/zinc/94/84/70/971948470.db2.gz LILCASXRRCPVRS-HNNXBMFYSA-N 1 1 352.394 2.628 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2C)CC1 ZINC001266386542 960196758 /nfs/dbraw/zinc/19/67/58/960196758.db2.gz JOXRONSQIBGSFU-RTBURBONSA-N 1 1 359.470 2.863 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2CCC[N@@H+]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000825648599 1013356126 /nfs/dbraw/zinc/35/61/26/1013356126.db2.gz VIKNWFHCNQIQOQ-QGZVFWFLSA-N 1 1 354.410 2.579 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000825648599 1013356135 /nfs/dbraw/zinc/35/61/35/1013356135.db2.gz VIKNWFHCNQIQOQ-QGZVFWFLSA-N 1 1 354.410 2.579 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](c1ccccc1)N1CC[NH+](C)CC1 ZINC000728466831 966152791 /nfs/dbraw/zinc/15/27/91/966152791.db2.gz STANHPDXEYTEQX-LJQANCHMSA-N 1 1 369.421 2.797 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(F)ccc1Cl ZINC001267257595 967495431 /nfs/dbraw/zinc/49/54/31/967495431.db2.gz MZZXXJDJXCAUCW-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(F)ccc1Cl ZINC001267257595 967495440 /nfs/dbraw/zinc/49/54/40/967495440.db2.gz MZZXXJDJXCAUCW-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(F)ccc1Cl ZINC001267257595 967495464 /nfs/dbraw/zinc/49/54/64/967495464.db2.gz MZZXXJDJXCAUCW-GDBMZVCRSA-N 1 1 371.840 2.861 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(C)cccc1Cl ZINC001267314924 967823089 /nfs/dbraw/zinc/82/30/89/967823089.db2.gz WBNKJIHFIJDHGU-CZUORRHYSA-N 1 1 353.850 2.642 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@@H]1C ZINC000892642115 969676653 /nfs/dbraw/zinc/67/66/53/969676653.db2.gz MCCIZUKRRRHABF-UONOGXRCSA-N 1 1 358.442 2.756 20 5 FFBDMO C[C@H](CNC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000897062350 973213866 /nfs/dbraw/zinc/21/38/66/973213866.db2.gz SVASZGLMLKLIBZ-INMHGKMJSA-N 1 1 360.458 2.824 20 5 FFBDMO CC[C@@H](C(=O)[O-])[N@@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001603498506 973457128 /nfs/dbraw/zinc/45/71/28/973457128.db2.gz JEGSCXDIOUUGIZ-SFHVURJKSA-N 1 1 363.458 2.644 20 5 FFBDMO C[N@@H+](Cc1ccc(C(F)F)cc1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985426211 974054475 /nfs/dbraw/zinc/05/44/75/974054475.db2.gz NEMXRTAJKCUZIK-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO C[N@H+](Cc1ccc(C(F)F)cc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426211 974054488 /nfs/dbraw/zinc/05/44/88/974054488.db2.gz NEMXRTAJKCUZIK-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO C[N@@H+](Cc1ccc(C(F)F)cc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426211 974054494 /nfs/dbraw/zinc/05/44/94/974054494.db2.gz NEMXRTAJKCUZIK-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000981136834 976263619 /nfs/dbraw/zinc/26/36/19/976263619.db2.gz IDPIXQXPQNJSTH-UYAOXDASSA-N 1 1 367.449 2.848 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000981136834 976263623 /nfs/dbraw/zinc/26/36/23/976263623.db2.gz IDPIXQXPQNJSTH-UYAOXDASSA-N 1 1 367.449 2.848 20 5 FFBDMO Cc1ccc2ccccc2c1C[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000981136834 976263627 /nfs/dbraw/zinc/26/36/27/976263627.db2.gz IDPIXQXPQNJSTH-UYAOXDASSA-N 1 1 367.449 2.848 20 5 FFBDMO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCCN(Cc4ccccc4)C3)C2)c1 ZINC000876988549 1014441562 /nfs/dbraw/zinc/44/15/62/1014441562.db2.gz GFEZVDCPZVIGJX-LMDPOFIKSA-N 1 1 369.469 2.997 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[nH+]1 ZINC000126250001 977997706 /nfs/dbraw/zinc/99/77/06/977997706.db2.gz KGRDVMIZUDCGLY-UHFFFAOYSA-N 1 1 355.398 2.714 20 5 FFBDMO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000877168439 1014496183 /nfs/dbraw/zinc/49/61/83/1014496183.db2.gz UJBNMZSALXHTEE-SVUBNXHSSA-N 1 1 369.469 2.995 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687930 1014681666 /nfs/dbraw/zinc/68/16/66/1014681666.db2.gz NXOZDLCCOBCNAC-IAGOWNOFSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])Cc3cccnc3N2C1 ZINC000877687930 1014681672 /nfs/dbraw/zinc/68/16/72/1014681672.db2.gz NXOZDLCCOBCNAC-IAGOWNOFSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688777 1014682123 /nfs/dbraw/zinc/68/21/23/1014682123.db2.gz VVSITRAYMJBBJG-MSOLQXFVSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@H]1C[C@@H]2C[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688777 1014682127 /nfs/dbraw/zinc/68/21/27/1014682127.db2.gz VVSITRAYMJBBJG-MSOLQXFVSA-N 1 1 368.437 2.908 20 5 FFBDMO CCCCCCNC(=O)[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000878020660 1014816226 /nfs/dbraw/zinc/81/62/26/1014816226.db2.gz TZKWWCHBCUEXSN-MRXNPFEDSA-N 1 1 365.478 2.508 20 5 FFBDMO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000760464024 982419849 /nfs/dbraw/zinc/41/98/49/982419849.db2.gz WULIXASJFBYJQZ-ACJLOTCBSA-N 1 1 353.382 2.560 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@@H]21 ZINC000878351588 1014997691 /nfs/dbraw/zinc/99/76/91/1014997691.db2.gz SIZLKAVLBYDZKN-GWCFXTLKSA-N 1 1 370.356 2.754 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)c1C ZINC000913478044 984277570 /nfs/dbraw/zinc/27/75/70/984277570.db2.gz BHTYVRLHZYECRX-MRXNPFEDSA-N 1 1 355.394 2.704 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)NCC(C)C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764865667 984748719 /nfs/dbraw/zinc/74/87/19/984748719.db2.gz WTYDXMIPGQPTJM-UHFFFAOYSA-N 1 1 373.457 2.695 20 5 FFBDMO CCOc1cc(N2CC[NH+](CC(OCC)OCC)CC2)ccc1[N+](=O)[O-] ZINC000796467825 1015124590 /nfs/dbraw/zinc/12/45/90/1015124590.db2.gz XZGSWMIBIWIRRT-UHFFFAOYSA-N 1 1 367.446 2.515 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000323971232 986388984 /nfs/dbraw/zinc/38/89/84/986388984.db2.gz CBLAKALVQIYVEF-OAHLLOKOSA-N 1 1 368.437 2.771 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000324062827 986608435 /nfs/dbraw/zinc/60/84/35/986608435.db2.gz WQPVFDSIHIBCIK-HNNXBMFYSA-N 1 1 368.437 2.771 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913684377 986823105 /nfs/dbraw/zinc/82/31/05/986823105.db2.gz RYGYSEGZVDVAKL-ROUUACIJSA-N 1 1 351.406 2.623 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1ccc(F)c(Cl)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001486367717 987276019 /nfs/dbraw/zinc/27/60/19/987276019.db2.gz CHWVGYFTABMYDZ-CZUORRHYSA-N 1 1 371.840 2.813 20 5 FFBDMO C[C@@H]1CC2(CCC2)C[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000762145598 988144797 /nfs/dbraw/zinc/14/47/97/988144797.db2.gz WEZHBWAPYGZWID-CYBMUJFWSA-N 1 1 358.398 2.585 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000763108936 989046633 /nfs/dbraw/zinc/04/66/33/989046633.db2.gz MQIXVRGWXNIXSO-UHFFFAOYSA-N 1 1 372.425 2.950 20 5 FFBDMO O=[N+]([O-])c1cnn(C[N@@H+](CCCOc2ccccc2)C2CCOCC2)c1 ZINC000766032201 989279088 /nfs/dbraw/zinc/27/90/88/989279088.db2.gz SIBBORNHQVFERR-UHFFFAOYSA-N 1 1 360.414 2.699 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000919521048 990663702 /nfs/dbraw/zinc/66/37/02/990663702.db2.gz ALWMKMCSKJZBRO-CQSZACIVSA-N 1 1 361.398 2.590 20 5 FFBDMO Cc1cc(C)cc([C@@H](O)C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665352 993255406 /nfs/dbraw/zinc/25/54/06/993255406.db2.gz VCKYFGMYZQNWQK-WMZOPIPTSA-N 1 1 356.426 2.826 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000811769108 995237946 /nfs/dbraw/zinc/23/79/46/995237946.db2.gz QOUCQLFWIOUQJH-UHFFFAOYSA-N 1 1 366.418 2.980 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC001133014940 995256400 /nfs/dbraw/zinc/25/64/00/995256400.db2.gz PTILXJQQPVWTFJ-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812853529 995555870 /nfs/dbraw/zinc/55/58/70/995555870.db2.gz RMXSKMQXOFANBL-MOXGXCLJSA-N 1 1 374.437 2.779 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825124333 997221968 /nfs/dbraw/zinc/22/19/68/997221968.db2.gz NQWZFYFMVFLMPV-DAYGRLMNSA-N 1 1 363.458 2.503 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000803855722 1016243635 /nfs/dbraw/zinc/24/36/35/1016243635.db2.gz KCOIRJAAAWLCOO-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000803855288 1016245995 /nfs/dbraw/zinc/24/59/95/1016245995.db2.gz FIFZPROCHFYMEO-DZGCQCFKSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@H](C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741015317 999702446 /nfs/dbraw/zinc/70/24/46/999702446.db2.gz ADSASBOKVPBLPS-FRRDWIJNSA-N 1 1 364.398 2.766 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC000741014931 999702574 /nfs/dbraw/zinc/70/25/74/999702574.db2.gz SGIFIKMKPPVJNT-KRWDZBQOSA-N 1 1 363.414 2.505 20 5 FFBDMO COc1ccc([C@@H]2[C@H](COC(=O)c3cc([N+](=O)[O-])cn3C)CC[N@H+]2C)cc1 ZINC000741120632 999709548 /nfs/dbraw/zinc/70/95/48/999709548.db2.gz JFJQTYCFIOZLFU-KBXCAEBGSA-N 1 1 373.409 2.792 20 5 FFBDMO CC(C)C1CC[NH+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000742169641 999760828 /nfs/dbraw/zinc/76/08/28/999760828.db2.gz UUUWLCNVNMTUEK-UHFFFAOYSA-N 1 1 360.414 2.689 20 5 FFBDMO O=[N+]([O-])c1cn(CN2CCC[N@H+](C3CCCC3)CC2)nc1-c1ccncc1 ZINC000742151918 999761850 /nfs/dbraw/zinc/76/18/50/999761850.db2.gz BGNOFBBWESFEPD-UHFFFAOYSA-N 1 1 370.457 2.761 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000742411775 999772808 /nfs/dbraw/zinc/77/28/08/999772808.db2.gz VNVOZHWPKPXAGR-UHFFFAOYSA-N 1 1 357.414 2.884 20 5 FFBDMO CC(C)(C)c1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC001086363163 999870166 /nfs/dbraw/zinc/87/01/66/999870166.db2.gz FPFMFHBGXIVTRN-VDHUWJSZSA-N 1 1 359.470 2.634 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C[C@H]1CNC(=O)OC(C)(C)C ZINC001169006445 1000015035 /nfs/dbraw/zinc/01/50/35/1000015035.db2.gz IHVGHETWZLSZTQ-KLHDSHLOSA-N 1 1 355.479 2.915 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)CN1c1cccc(F)c1 ZINC001169018878 1000017163 /nfs/dbraw/zinc/01/71/63/1000017163.db2.gz CWPGKPOHYMLZIA-OGWOLHLISA-N 1 1 361.417 2.700 20 5 FFBDMO Cc1cccc(CN2CC[C@]3(CC[N@H+]([C@@H]4CC[C@H](C[N+](=O)[O-])C4)C3)C2=O)c1 ZINC001169020617 1000017447 /nfs/dbraw/zinc/01/74/47/1000017447.db2.gz JOJPMQHSHLIOGU-QKNQBKEWSA-N 1 1 371.481 2.865 20 5 FFBDMO CCOCc1nn(CC2CC2)c2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169024574 1000018098 /nfs/dbraw/zinc/01/80/98/1000018098.db2.gz XFCKRTPOOVYIKZ-JKSUJKDBSA-N 1 1 362.474 2.633 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)C1 ZINC001169026969 1000018315 /nfs/dbraw/zinc/01/83/15/1000018315.db2.gz ZKMNCYJJLSMMCP-VUHPKUFZSA-N 1 1 361.442 2.529 20 5 FFBDMO CCC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC(C)(C)C ZINC001169092585 1000022161 /nfs/dbraw/zinc/02/21/61/1000022161.db2.gz VFAYEJHETRWGOR-UHFFFAOYSA-N 1 1 365.430 2.977 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC(C)(C)C ZINC001169092585 1000022164 /nfs/dbraw/zinc/02/21/64/1000022164.db2.gz VFAYEJHETRWGOR-UHFFFAOYSA-N 1 1 365.430 2.977 20 5 FFBDMO C[N@@H+]1CCc2c(Nc3cccn(CC4CC4)c3=O)ccc([N+](=O)[O-])c2C1 ZINC001169454935 1000049272 /nfs/dbraw/zinc/04/92/72/1000049272.db2.gz POAVQCVSTXDVOA-UHFFFAOYSA-N 1 1 354.410 2.898 20 5 FFBDMO C[N@H+]1CCc2c(Nc3cccn(CC4CC4)c3=O)ccc([N+](=O)[O-])c2C1 ZINC001169454935 1000049274 /nfs/dbraw/zinc/04/92/74/1000049274.db2.gz POAVQCVSTXDVOA-UHFFFAOYSA-N 1 1 354.410 2.898 20 5 FFBDMO COc1cc(C[NH+]2CCC(N(C)CC(F)F)CC2)c([N+](=O)[O-])cc1OC ZINC000769511095 1000537875 /nfs/dbraw/zinc/53/78/75/1000537875.db2.gz SNSVHPRCHLJUQD-UHFFFAOYSA-N 1 1 373.400 2.773 20 5 FFBDMO CC(C)[N@@H+](C[C@H](O)COc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000770044650 1000663410 /nfs/dbraw/zinc/66/34/10/1000663410.db2.gz RHXJSRSMLDLSKA-AZUAARDMSA-N 1 1 374.437 2.779 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC001147493644 1000905149 /nfs/dbraw/zinc/90/51/49/1000905149.db2.gz FHABEAJJXGEPBL-DOMZBBRYSA-N 1 1 353.850 2.979 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000771845736 1001213958 /nfs/dbraw/zinc/21/39/58/1001213958.db2.gz ILNPWVYYNDDKOH-UHFFFAOYSA-N 1 1 372.303 2.774 20 5 FFBDMO C[C@H]1CN(c2ccccc2F)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493283 1002094223 /nfs/dbraw/zinc/09/42/23/1002094223.db2.gz GCXWMAJEWIYCAL-IFXJQAMLSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@H]1CN(c2ccccc2F)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000789493283 1002094232 /nfs/dbraw/zinc/09/42/32/1002094232.db2.gz GCXWMAJEWIYCAL-IFXJQAMLSA-N 1 1 359.401 2.978 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CC[C@H](C)C1 ZINC000790481343 1002389614 /nfs/dbraw/zinc/38/96/14/1002389614.db2.gz XLQFWMLJUBXTEO-HOCLYGCPSA-N 1 1 359.430 2.948 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791208349 1002617650 /nfs/dbraw/zinc/61/76/50/1002617650.db2.gz HIPICOKYZPVVDL-QWHCGFSZSA-N 1 1 366.437 2.650 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@](CO)(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334072 1003118044 /nfs/dbraw/zinc/11/80/44/1003118044.db2.gz AQDHMWNORGSYOC-IAQYHMDHSA-N 1 1 362.348 2.781 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC3CC2(C(=O)N2CCCC2)C3)c([N+](=O)[O-])c1 ZINC001170338474 1003128305 /nfs/dbraw/zinc/12/83/05/1003128305.db2.gz BIVTYXOTNTVSFF-BQTBQCLESA-N 1 1 373.453 2.621 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345816 1003131447 /nfs/dbraw/zinc/13/14/47/1003131447.db2.gz MBWXYLOHGZJFMV-UKRRQHHQSA-N 1 1 350.415 2.810 20 5 FFBDMO CCCNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCCC1 ZINC000792874485 1003215307 /nfs/dbraw/zinc/21/53/07/1003215307.db2.gz WCYPMCQPPSRMGZ-UHFFFAOYSA-N 1 1 364.402 2.822 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001050325673 1016967887 /nfs/dbraw/zinc/96/78/87/1016967887.db2.gz KIMILXIZBRVXAK-NXWXRZEISA-N 1 1 359.470 2.733 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)nc1 ZINC000851843677 1005917203 /nfs/dbraw/zinc/91/72/03/1005917203.db2.gz LLAIYWUHAAAMDH-CYBMUJFWSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)nc1 ZINC000851843677 1005917205 /nfs/dbraw/zinc/91/72/05/1005917205.db2.gz LLAIYWUHAAAMDH-CYBMUJFWSA-N 1 1 361.333 2.724 20 5 FFBDMO CO[C@@H]1CC[C@H]([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000851935797 1005924287 /nfs/dbraw/zinc/92/42/87/1005924287.db2.gz SNPUZCUKLCVTRN-DZGCQCFKSA-N 1 1 359.430 2.551 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]12 ZINC000852497652 1006055273 /nfs/dbraw/zinc/05/52/73/1006055273.db2.gz XHRRMYZCUHZKEY-MLHJIOFPSA-N 1 1 362.426 2.682 20 5 FFBDMO Cc1ccccc1CCC[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001050520501 1017037841 /nfs/dbraw/zinc/03/78/41/1017037841.db2.gz QMQJPDPQRFPIPI-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000747958774 1006353538 /nfs/dbraw/zinc/35/35/38/1006353538.db2.gz DCUPAQWZJPIDEX-ZIAGYGMSSA-N 1 1 367.450 2.559 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499102 1006415276 /nfs/dbraw/zinc/41/52/76/1006415276.db2.gz IRNCLZAGVWWQEH-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@]1(C)C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499102 1006415283 /nfs/dbraw/zinc/41/52/83/1006415283.db2.gz IRNCLZAGVWWQEH-MAUKXSAKSA-N 1 1 359.430 2.946 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](C3CCOCC3)C2)nc1-c1ccccn1 ZINC000853505256 1006419623 /nfs/dbraw/zinc/41/96/23/1006419623.db2.gz UBXHSWNEROHJGU-OAHLLOKOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000853569740 1006449451 /nfs/dbraw/zinc/44/94/51/1006449451.db2.gz ARSSUAKCBWTVRW-DZGCQCFKSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000853569740 1006449457 /nfs/dbraw/zinc/44/94/57/1006449457.db2.gz ARSSUAKCBWTVRW-DZGCQCFKSA-N 1 1 361.398 2.741 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)nc1-c1ccncc1 ZINC000853624126 1006482457 /nfs/dbraw/zinc/48/24/57/1006482457.db2.gz WUUYOYRGLLCHHK-KDURUIRLSA-N 1 1 369.425 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)nc1-c1ccncc1 ZINC000853624126 1006482463 /nfs/dbraw/zinc/48/24/63/1006482463.db2.gz WUUYOYRGLLCHHK-KDURUIRLSA-N 1 1 369.425 2.703 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000853746404 1006523360 /nfs/dbraw/zinc/52/33/60/1006523360.db2.gz IIFXUBRIPRECCJ-JTQLQIEISA-N 1 1 366.374 2.574 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(N2CCNC2=O)cc1 ZINC000883281868 1006729358 /nfs/dbraw/zinc/72/93/58/1006729358.db2.gz AYQRUGVZBBFGDN-UHFFFAOYSA-N 1 1 370.409 2.813 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000855161195 1007141764 /nfs/dbraw/zinc/14/17/64/1007141764.db2.gz MTOSTBSWMXMXQX-LBPRGKRZSA-N 1 1 355.385 2.923 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000855290061 1007249546 /nfs/dbraw/zinc/24/95/46/1007249546.db2.gz YINBQNKWJKUEPA-GFCCVEGCSA-N 1 1 364.402 2.722 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000817183246 1007465504 /nfs/dbraw/zinc/46/55/04/1007465504.db2.gz YSWKEYQZTFNIOV-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC000884547143 1007476214 /nfs/dbraw/zinc/47/62/14/1007476214.db2.gz CKVUGMRJYZTEAQ-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2nccn2CCc2ccccc2)c1 ZINC000819140118 1008041241 /nfs/dbraw/zinc/04/12/41/1008041241.db2.gz JJWDDXTYEGYFEN-LJQANCHMSA-N 1 1 366.421 2.857 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000858177994 1008318422 /nfs/dbraw/zinc/31/84/22/1008318422.db2.gz JGXUNECFEXWKLX-QGZVFWFLSA-N 1 1 371.437 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000820673872 1008359518 /nfs/dbraw/zinc/35/95/18/1008359518.db2.gz MOSFXFRDPPSMBT-GASCZTMLSA-N 1 1 363.458 2.831 20 5 FFBDMO COc1cc(C)cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1OC ZINC000886174662 1008598890 /nfs/dbraw/zinc/59/88/90/1008598890.db2.gz GIXRJWVXXVGMOP-LJQANCHMSA-N 1 1 360.410 2.918 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)O[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000117093304 1008759071 /nfs/dbraw/zinc/75/90/71/1008759071.db2.gz BPWLBXLIQUDPOD-GOSISDBHSA-N 1 1 356.378 2.791 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1 ZINC000823057591 1008886112 /nfs/dbraw/zinc/88/61/12/1008886112.db2.gz VHOLOOGLBKJUGY-CQSZACIVSA-N 1 1 361.442 2.537 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@](O)(c2ccnn2C)C3)cc1[N+](=O)[O-] ZINC000887053810 1009002111 /nfs/dbraw/zinc/00/21/11/1009002111.db2.gz DCCJQDRRLNKPBT-MNZLEMJZSA-N 1 1 356.426 2.651 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 ZINC000860739198 1009132960 /nfs/dbraw/zinc/13/29/60/1009132960.db2.gz ILPHLSAGRXAOBF-JSGCOSHPSA-N 1 1 374.372 2.703 20 5 FFBDMO C[C@H](COC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1c1ccncc1)[N+](=O)[O-] ZINC000860777045 1009148463 /nfs/dbraw/zinc/14/84/63/1009148463.db2.gz JTXZMJZLOGHGSA-AYOQOUSVSA-N 1 1 369.421 2.506 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000823945750 1009288858 /nfs/dbraw/zinc/28/88/58/1009288858.db2.gz VQFHDYUTRUKTQK-MRXNPFEDSA-N 1 1 369.425 2.568 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000823945750 1009288865 /nfs/dbraw/zinc/28/88/65/1009288865.db2.gz VQFHDYUTRUKTQK-MRXNPFEDSA-N 1 1 369.425 2.568 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000824008510 1009292914 /nfs/dbraw/zinc/29/29/14/1009292914.db2.gz PXFILSRWBNEJTM-UHFFFAOYSA-N 1 1 369.425 2.835 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)COCCO ZINC001181795183 1010248668 /nfs/dbraw/zinc/24/86/68/1010248668.db2.gz SAYIBSOLMNXJMI-UHFFFAOYSA-N 1 1 353.422 2.710 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCCN2c2cc[nH+]c3ccc([N+](=O)[O-])cc32)cn1 ZINC000865650284 1010835600 /nfs/dbraw/zinc/83/56/00/1010835600.db2.gz BDCCKEMGXVAXHG-IFXJQAMLSA-N 1 1 367.409 2.969 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H](C[C@@H]4CCOC4)C3)n2)cc1 ZINC000773267714 1011006117 /nfs/dbraw/zinc/00/61/17/1011006117.db2.gz VFCMKUPLRCLRQM-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000867914688 1011118861 /nfs/dbraw/zinc/11/88/61/1011118861.db2.gz OUOKCXODBRQJCC-MRXNPFEDSA-N 1 1 371.412 2.915 20 5 FFBDMO COc1ccccc1[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867944160 1011126694 /nfs/dbraw/zinc/12/66/94/1011126694.db2.gz QJFDSJCKYKPKDA-JLTOFOAXSA-N 1 1 369.421 2.793 20 5 FFBDMO C[N@@H+]1CCc2c(NC(C)(C)CC(=O)N3CCCC3)ccc([N+](=O)[O-])c2C1 ZINC001171493594 1011343940 /nfs/dbraw/zinc/34/39/40/1011343940.db2.gz IUSDSBOBPIFJBX-UHFFFAOYSA-N 1 1 360.458 2.786 20 5 FFBDMO C[N@H+]1CCc2c(NC(C)(C)CC(=O)N3CCCC3)ccc([N+](=O)[O-])c2C1 ZINC001171493594 1011343953 /nfs/dbraw/zinc/34/39/53/1011343953.db2.gz IUSDSBOBPIFJBX-UHFFFAOYSA-N 1 1 360.458 2.786 20 5 FFBDMO C[C@H]1CC[C@@H](CO)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009339 1012178595 /nfs/dbraw/zinc/17/85/95/1012178595.db2.gz BHHSUEARBCVSLM-QWHCGFSZSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)CO1 ZINC001173013509 1012183563 /nfs/dbraw/zinc/18/35/63/1012183563.db2.gz AIDKCMQEXQWAPW-VXGBXAGGSA-N 1 1 355.385 2.951 20 5 FFBDMO CO[C@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014578 1012184359 /nfs/dbraw/zinc/18/43/59/1012184359.db2.gz SRMJRQDDWYOSQK-AWEZNQCLSA-N 1 1 355.385 2.953 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@H](CCO)C3)CC2)c(F)c1 ZINC001173014756 1012184717 /nfs/dbraw/zinc/18/47/17/1012184717.db2.gz AJHCZPMAVNHGSB-CYBMUJFWSA-N 1 1 369.412 2.936 20 5 FFBDMO C[N@@H+](CCC1OCCO1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015237 1012187482 /nfs/dbraw/zinc/18/74/82/1012187482.db2.gz NEBOJGRCZOLJLE-UHFFFAOYSA-N 1 1 371.384 2.537 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3CCOCC34CC4)CC2)c(F)c1 ZINC001173015896 1012187728 /nfs/dbraw/zinc/18/77/28/1012187728.db2.gz WEQAYBRWTUENSL-UHFFFAOYSA-N 1 1 353.369 2.707 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCOCC34CC4)CC2)c(F)c1 ZINC001173015896 1012187733 /nfs/dbraw/zinc/18/77/33/1012187733.db2.gz WEQAYBRWTUENSL-UHFFFAOYSA-N 1 1 353.369 2.707 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2nccnc2Cl)c1F ZINC001173177096 1012318611 /nfs/dbraw/zinc/31/86/11/1012318611.db2.gz OIJAVNHGPGPWBL-SECBINFHSA-N 1 1 354.769 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)CCc2noc(C)n2)c1F ZINC001173182844 1012326711 /nfs/dbraw/zinc/32/67/11/1012326711.db2.gz UVAZKFURORKQCR-SNVBAGLBSA-N 1 1 352.366 2.539 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c1F ZINC001173193634 1012335240 /nfs/dbraw/zinc/33/52/40/1012335240.db2.gz UUKXOQOHLAZBSF-STQMWFEESA-N 1 1 368.405 2.901 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1F ZINC001173195428 1012337728 /nfs/dbraw/zinc/33/77/28/1012337728.db2.gz FXVJPGYCSGUWHB-HEHGZKQESA-N 1 1 351.422 2.700 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H](n3cncn3)C2)c1F ZINC001173197301 1012340013 /nfs/dbraw/zinc/34/00/13/1012340013.db2.gz SNYUXSOBIQAYQX-CHWSQXEVSA-N 1 1 363.393 2.602 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173198021 1012340507 /nfs/dbraw/zinc/34/05/07/1012340507.db2.gz XLHNYBCZBGNHFY-QWHCGFSZSA-N 1 1 368.405 2.949 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)Cc2ccccc2)CC1 ZINC001173233379 1012363153 /nfs/dbraw/zinc/36/31/53/1012363153.db2.gz VZXMAPRBYMKWLX-KRWDZBQOSA-N 1 1 367.449 2.913 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)c2ccccc2)CC1 ZINC001173229490 1012364237 /nfs/dbraw/zinc/36/42/37/1012364237.db2.gz VDYVBMXVTNXJRX-INIZCTEOSA-N 1 1 353.422 2.984 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)N2CCCC2)C1 ZINC001173238496 1012386819 /nfs/dbraw/zinc/38/68/19/1012386819.db2.gz TXPAJMXWWWPRSH-NVXWUHKLSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000901329901 1018970706 /nfs/dbraw/zinc/97/07/06/1018970706.db2.gz NNQWYEMNSHQRIY-MRXNPFEDSA-N 1 1 362.474 2.578 20 5 FFBDMO C[NH+]1CCN(Cc2cc(-c3ccc(N4CCCC4)c([N+](=O)[O-])c3)no2)CC1 ZINC000901397637 1019042128 /nfs/dbraw/zinc/04/21/28/1019042128.db2.gz BAKFEUQDYJBWIM-UHFFFAOYSA-N 1 1 371.441 2.597 20 5 FFBDMO O=[N+]([O-])c1cc(-c2cc(C[N@@H+]3CCC[C@H]3CO)on2)ccc1N1CCCC1 ZINC000901398616 1019043654 /nfs/dbraw/zinc/04/36/54/1019043654.db2.gz WSKUKYGJMIFTLM-HNNXBMFYSA-N 1 1 372.425 2.807 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000802008044 1019615920 /nfs/dbraw/zinc/61/59/20/1019615920.db2.gz VMXPBXKDRDYSFI-SOXMVSPVSA-N 1 1 356.426 2.772 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1Nc1cccc2c1CC[N@@H+](CC(C)(C)O)C2 ZINC000480116757 1019908817 /nfs/dbraw/zinc/90/88/17/1019908817.db2.gz KOFJVBSEBLNUII-UHFFFAOYSA-N 1 1 373.457 2.992 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C/c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525093 1020275179 /nfs/dbraw/zinc/27/51/79/1020275179.db2.gz KRXNECZUUGADBP-ZTCKFTSBSA-N 1 1 369.465 2.724 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C/C=C/c1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525093 1020275190 /nfs/dbraw/zinc/27/51/90/1020275190.db2.gz KRXNECZUUGADBP-ZTCKFTSBSA-N 1 1 369.465 2.724 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2C/C=C/c1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525093 1020275202 /nfs/dbraw/zinc/27/52/02/1020275202.db2.gz KRXNECZUUGADBP-ZTCKFTSBSA-N 1 1 369.465 2.724 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)c1 ZINC000931795687 1020589929 /nfs/dbraw/zinc/58/99/29/1020589929.db2.gz IAXGMIUNLUDZFS-AZUAARDMSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)c1 ZINC000931795687 1020589936 /nfs/dbraw/zinc/58/99/36/1020589936.db2.gz IAXGMIUNLUDZFS-AZUAARDMSA-N 1 1 364.405 2.999 20 5 FFBDMO Cn1ccc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000932140145 1020720970 /nfs/dbraw/zinc/72/09/70/1020720970.db2.gz WMJFJQLUBDBIFL-ZDUSSCGKSA-N 1 1 358.398 2.574 20 5 FFBDMO CN(C)CC[C@H]([NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381664 1020815732 /nfs/dbraw/zinc/81/57/32/1020815732.db2.gz YJILUSYDGYZVSW-RCCFBDPRSA-N 1 1 372.473 2.953 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)CC1 ZINC000749271623 1020911441 /nfs/dbraw/zinc/91/14/41/1020911441.db2.gz JGBQFVKJIQNZMJ-UHFFFAOYSA-N 1 1 362.474 2.903 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000749675146 1021018701 /nfs/dbraw/zinc/01/87/01/1021018701.db2.gz XMMIQRTVESFAEI-NRFANRHFSA-N 1 1 369.465 2.925 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2Cc3ncccc3N3CCC[C@H]3C2)c1 ZINC000934491441 1021259578 /nfs/dbraw/zinc/25/95/78/1021259578.db2.gz SPHGXZQDLHFUNK-QFBILLFUSA-N 1 1 354.410 2.508 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934844352 1021426593 /nfs/dbraw/zinc/42/65/93/1021426593.db2.gz YZIPSESVWNNVGW-JKSUJKDBSA-N 1 1 361.442 2.696 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000778773908 1022354037 /nfs/dbraw/zinc/35/40/37/1022354037.db2.gz XBDLEJPYKBMUMO-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO CC1(C)CC(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1 ZINC001039486026 1022763249 /nfs/dbraw/zinc/76/32/49/1022763249.db2.gz YCGYSXAOPWJZQC-QZTJIDSGSA-N 1 1 363.502 2.791 20 5 FFBDMO CC1(C)CC(C[N@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1 ZINC001039486026 1022763264 /nfs/dbraw/zinc/76/32/64/1022763264.db2.gz YCGYSXAOPWJZQC-QZTJIDSGSA-N 1 1 363.502 2.791 20 5 FFBDMO CC1(C)CC(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1 ZINC001039486026 1022763277 /nfs/dbraw/zinc/76/32/77/1022763277.db2.gz YCGYSXAOPWJZQC-QZTJIDSGSA-N 1 1 363.502 2.791 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000751935430 1022982497 /nfs/dbraw/zinc/98/24/97/1022982497.db2.gz VXNLYOZSQXXCAF-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001122803269 1023483995 /nfs/dbraw/zinc/48/39/95/1023483995.db2.gz WWWUHVQWZOUNSC-PBHICJAKSA-N 1 1 372.425 2.554 20 5 FFBDMO CC(C)[N@@H+](CCO)CC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC001120959095 1023544270 /nfs/dbraw/zinc/54/42/70/1023544270.db2.gz FPSPJXXCGWMRBA-UHFFFAOYSA-N 1 1 356.854 2.562 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC001121700264 1023934631 /nfs/dbraw/zinc/93/46/31/1023934631.db2.gz UNTHOXWKJXLOKU-PMPSAXMXSA-N 1 1 364.494 2.727 20 5 FFBDMO COc1cc(C(=O)OCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000837315048 1025720167 /nfs/dbraw/zinc/72/01/67/1025720167.db2.gz KJSVTYDSCAWKKO-UHFFFAOYSA-N 1 1 374.393 2.901 20 5 FFBDMO COC(=O)c1cc(C(=O)OC[C@H]2CCCC[N@H+]2C(C)C)cc([N+](=O)[O-])c1 ZINC000837342877 1025734649 /nfs/dbraw/zinc/73/46/49/1025734649.db2.gz CBJIKTHIMXYQGR-OAHLLOKOSA-N 1 1 364.398 2.801 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)c1 ZINC000246569146 1026274093 /nfs/dbraw/zinc/27/40/93/1026274093.db2.gz LVMMOPYPBKELBB-UXHICEINSA-N 1 1 356.422 2.901 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@H]1c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839635011 1026769123 /nfs/dbraw/zinc/76/91/23/1026769123.db2.gz FMAWLLVNTAXMMV-QAPCUYQASA-N 1 1 373.384 2.870 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C12CCC2 ZINC000840140138 1026980270 /nfs/dbraw/zinc/98/02/70/1026980270.db2.gz MFGKZCZRBIYKIO-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO CC(C)OCCOC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000840147408 1026984930 /nfs/dbraw/zinc/98/49/30/1026984930.db2.gz WRXRJVGASIFQKS-UHFFFAOYSA-N 1 1 362.430 2.808 20 5 FFBDMO CC(C)[N@@H+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C[C@@H]1C ZINC001158495331 1027043545 /nfs/dbraw/zinc/04/35/45/1027043545.db2.gz LJEDBBPWAIMQEZ-QMMMGPOBSA-N 1 1 367.759 2.976 20 5 FFBDMO CC(C)[N@H+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C[C@@H]1C ZINC001158495331 1027043552 /nfs/dbraw/zinc/04/35/52/1027043552.db2.gz LJEDBBPWAIMQEZ-QMMMGPOBSA-N 1 1 367.759 2.976 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000248055084 1027376386 /nfs/dbraw/zinc/37/63/86/1027376386.db2.gz OFPGUDORLRVHRG-YJBOKZPZSA-N 1 1 354.410 2.661 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001160097003 1027587833 /nfs/dbraw/zinc/58/78/33/1027587833.db2.gz DQKMCUZPZKNLIX-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160097003 1027587845 /nfs/dbraw/zinc/58/78/45/1027587845.db2.gz DQKMCUZPZKNLIX-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160097003 1027587858 /nfs/dbraw/zinc/58/78/58/1027587858.db2.gz DQKMCUZPZKNLIX-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCN2CC[C@H]2C1 ZINC001161423672 1028164638 /nfs/dbraw/zinc/16/46/38/1028164638.db2.gz JDXKGHLVZXSWIQ-AVRDEDQJSA-N 1 1 359.473 2.779 20 5 FFBDMO Cc1cc(N2CC([C@H]([NH3+])C(=O)OC(C)(C)C)C2)nc2ccc([N+](=O)[O-])cc12 ZINC001163117096 1028806046 /nfs/dbraw/zinc/80/60/46/1028806046.db2.gz BJJZBYFIFKFDLH-KRWDZBQOSA-N 1 1 372.425 2.557 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12 ZINC001156316647 1029141276 /nfs/dbraw/zinc/14/12/76/1029141276.db2.gz HIXCKAVUGPEHOW-QGPMSJSTSA-N 1 1 353.426 2.895 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC001165108652 1029394807 /nfs/dbraw/zinc/39/48/07/1029394807.db2.gz ORIQFIFCZGYSRC-CQSZACIVSA-N 1 1 354.838 2.723 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC001165113226 1029399829 /nfs/dbraw/zinc/39/98/29/1029399829.db2.gz PKPWBAHSYZZCOM-HNNXBMFYSA-N 1 1 371.441 2.618 20 5 FFBDMO C[C@@H]1C[N@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@@H]2CCCC[C@H]21 ZINC000782278100 1029637888 /nfs/dbraw/zinc/63/78/88/1029637888.db2.gz TWJJDWQQKIFWBA-UHOFOFEASA-N 1 1 358.398 2.880 20 5 FFBDMO C[C@@H]1C[N@@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@@H]2CCCC[C@H]21 ZINC000782278100 1029637889 /nfs/dbraw/zinc/63/78/89/1029637889.db2.gz TWJJDWQQKIFWBA-UHOFOFEASA-N 1 1 358.398 2.880 20 5 FFBDMO Cc1nc([C@H]2CCCCN2c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)no1 ZINC001166717508 1030493106 /nfs/dbraw/zinc/49/31/06/1030493106.db2.gz PWVGLXDBTFZNQG-RCQQVGEISA-N 1 1 358.402 2.945 20 5 FFBDMO C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C[C@](C)(O)c1ccccc1 ZINC000842628122 1030850975 /nfs/dbraw/zinc/85/09/75/1030850975.db2.gz VHCQXCKNKGFLIT-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C[C@](C)(O)c1ccccc1 ZINC000842628122 1030851001 /nfs/dbraw/zinc/85/10/01/1030851001.db2.gz VHCQXCKNKGFLIT-IBGZPJMESA-N 1 1 367.409 2.650 20 5 FFBDMO C[C@]1(CNc2ccc3ncc([N+](=O)[O-])n3n2)CC[N@@H+](Cc2ccccc2)C1 ZINC000798400801 1031391804 /nfs/dbraw/zinc/39/18/04/1031391804.db2.gz DDQPCCUMGBANHA-LJQANCHMSA-N 1 1 366.425 2.962 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000843475038 1031418761 /nfs/dbraw/zinc/41/87/61/1031418761.db2.gz WPAXNALIPHXOEH-VEGGFIAOSA-N 1 1 367.405 2.790 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC001150780202 1031784073 /nfs/dbraw/zinc/78/40/73/1031784073.db2.gz BIELIBQOGYBYJP-LBPRGKRZSA-N 1 1 352.822 2.577 20 5 FFBDMO CCc1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001115530586 1031786262 /nfs/dbraw/zinc/78/62/62/1031786262.db2.gz FVAGAQDFWHSTSQ-QZTJIDSGSA-N 1 1 359.470 2.823 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001205635193 1031891214 /nfs/dbraw/zinc/89/12/14/1031891214.db2.gz DGPNSILWLOJYFV-UHFFFAOYSA-N 1 1 358.373 2.914 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2C)CC[N@@H+]1CCOC ZINC001151375672 1031937785 /nfs/dbraw/zinc/93/77/85/1031937785.db2.gz IISIWGURMKZUSC-AWEZNQCLSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2C)CC[N@H+]1CCOC ZINC001151375672 1031937791 /nfs/dbraw/zinc/93/77/91/1031937791.db2.gz IISIWGURMKZUSC-AWEZNQCLSA-N 1 1 367.421 2.615 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1cc([N+](=O)[O-])ccc1F ZINC000831164322 1033975222 /nfs/dbraw/zinc/97/52/22/1033975222.db2.gz BTQJKKYMSBJTQX-XKQJLSEDSA-N 1 1 365.405 2.688 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1OC[C@H]1C[N@H+](Cc2ccccc2)CCCO1 ZINC001225492056 1034278536 /nfs/dbraw/zinc/27/85/36/1034278536.db2.gz VELIDUNONZVJDA-QGZVFWFLSA-N 1 1 358.394 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1OC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001225492056 1034278551 /nfs/dbraw/zinc/27/85/51/1034278551.db2.gz VELIDUNONZVJDA-QGZVFWFLSA-N 1 1 358.394 2.970 20 5 FFBDMO CO[C@@H]1CC[N@H+](CCOc2cc([N+](=O)[O-])c(F)cc2Br)C1 ZINC001225754191 1034396690 /nfs/dbraw/zinc/39/66/90/1034396690.db2.gz VBHUJCCVIVCBSF-SECBINFHSA-N 1 1 363.183 2.596 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc([N+](=O)[O-])c(F)cc2Br)C1 ZINC001225754191 1034396697 /nfs/dbraw/zinc/39/66/97/1034396697.db2.gz VBHUJCCVIVCBSF-SECBINFHSA-N 1 1 363.183 2.596 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2COCC[N@H+](Cc3ccccc3)C2)c1 ZINC001226448119 1034690716 /nfs/dbraw/zinc/69/07/16/1034690716.db2.gz VWALSASUOIBGKH-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c1 ZINC001226448119 1034690720 /nfs/dbraw/zinc/69/07/20/1034690720.db2.gz VWALSASUOIBGKH-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N[C@@H]1C[NH2+]CC[C@H]1F ZINC001221365925 1034692294 /nfs/dbraw/zinc/69/22/94/1034692294.db2.gz JQRSYEXOYRXNEG-QHAWAJNXSA-N 1 1 365.452 2.679 20 5 FFBDMO CC[N@@H+](CCN1CCOCC1)Cc1ccc2ccc3cccnc3c2n1 ZINC001232221679 1035503594 /nfs/dbraw/zinc/50/35/94/1035503594.db2.gz CMPKNDRNOLQZOK-UHFFFAOYSA-N 1 1 350.466 2.937 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001536194303 1069933921 /nfs/dbraw/zinc/93/39/21/1069933921.db2.gz IZVWJGMTCIXHLX-MRXNPFEDSA-N 1 1 358.442 2.807 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)[n-]1 ZINC001228240614 1036009999 /nfs/dbraw/zinc/00/99/99/1036009999.db2.gz RHMMMERVYQWFOF-HNNXBMFYSA-N 1 1 366.377 2.897 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@H]2CC[N@H+](Cc3ccccc3)C2)[nH]1 ZINC001228240614 1036010017 /nfs/dbraw/zinc/01/00/17/1036010017.db2.gz RHMMMERVYQWFOF-HNNXBMFYSA-N 1 1 366.377 2.897 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)[nH]1 ZINC001228240614 1036010038 /nfs/dbraw/zinc/01/00/38/1036010038.db2.gz RHMMMERVYQWFOF-HNNXBMFYSA-N 1 1 366.377 2.897 20 5 FFBDMO O=c1[n-]c(C2CC2)nc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606285 1036201745 /nfs/dbraw/zinc/20/17/45/1036201745.db2.gz OHELFRXAJZBXRH-CQSZACIVSA-N 1 1 356.382 2.621 20 5 FFBDMO O=c1[nH]c(C2CC2)nc(O[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606285 1036201760 /nfs/dbraw/zinc/20/17/60/1036201760.db2.gz OHELFRXAJZBXRH-CQSZACIVSA-N 1 1 356.382 2.621 20 5 FFBDMO O=c1[nH]c(C2CC2)nc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001228606285 1036201774 /nfs/dbraw/zinc/20/17/74/1036201774.db2.gz OHELFRXAJZBXRH-CQSZACIVSA-N 1 1 356.382 2.621 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3c4cccnc4ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001233783857 1036761346 /nfs/dbraw/zinc/76/13/46/1036761346.db2.gz AGIVBLWFNYINJU-RPLLJCPNSA-N 1 1 371.393 2.689 20 5 FFBDMO CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1 ZINC001234410130 1037025056 /nfs/dbraw/zinc/02/50/56/1037025056.db2.gz NFYJFMXQCKOHPV-CCWDJLKJSA-N 1 1 362.426 2.810 20 5 FFBDMO CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C(C)C)C2)c1 ZINC001234411411 1037025481 /nfs/dbraw/zinc/02/54/81/1037025481.db2.gz SLSKPWDKLNVWJQ-OAHLLOKOSA-N 1 1 350.415 2.952 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2nc3c[nH]cc([N+](=O)[O-])c-3n2)C1 ZINC001230231709 1037163854 /nfs/dbraw/zinc/16/38/54/1037163854.db2.gz QDTVAZSPLRWHKD-STQMWFEESA-N 1 1 368.397 2.866 20 5 FFBDMO CC1(C)CC[NH2+]C[C@@H]1NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246323292 1039313015 /nfs/dbraw/zinc/31/30/15/1039313015.db2.gz AFJVVZSKEVJZQD-INIZCTEOSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@H+](C)CCO1 ZINC001210683678 1039669065 /nfs/dbraw/zinc/66/90/65/1039669065.db2.gz YFJSMLFZAPECRX-SJCJKPOMSA-N 1 1 358.398 2.589 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@@H+](C)CCO1 ZINC001210683678 1039669072 /nfs/dbraw/zinc/66/90/72/1039669072.db2.gz YFJSMLFZAPECRX-SJCJKPOMSA-N 1 1 358.398 2.589 20 5 FFBDMO CN1CC[NH+](CCc2nc(-c3ccc4ccc5cccnc5c4n3)no2)CC1 ZINC001247447964 1039755722 /nfs/dbraw/zinc/75/57/22/1039755722.db2.gz HBGFDNKCENRDCV-UHFFFAOYSA-N 1 1 374.448 2.623 20 5 FFBDMO C[N@@H+]1CCc2c(sc(Nc3ccc(F)c([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001211190680 1039985125 /nfs/dbraw/zinc/98/51/25/1039985125.db2.gz ZNWPIHCSQUNNMJ-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO C[N@H+]1CCc2c(sc(Nc3ccc(F)c([N+](=O)[O-])c3)c2C(N)=O)C1 ZINC001211190680 1039985137 /nfs/dbraw/zinc/98/51/37/1039985137.db2.gz ZNWPIHCSQUNNMJ-UHFFFAOYSA-N 1 1 350.375 2.626 20 5 FFBDMO [NH3+][C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3c(c2)OCO3)no1 ZINC001248210546 1040174813 /nfs/dbraw/zinc/17/48/13/1040174813.db2.gz SDHXKWWKWDUDRU-ZDUSSCGKSA-N 1 1 354.322 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCC(F)(F)[C@H](CO)C3)CC2)cc1 ZINC001254475717 1040743118 /nfs/dbraw/zinc/74/31/18/1040743118.db2.gz ILGNJYMKOIUGGQ-ZDUSSCGKSA-N 1 1 355.385 2.513 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480400 1040747203 /nfs/dbraw/zinc/74/72/03/1040747203.db2.gz FOMNERXSVRBTRY-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO CC(C)C(=O)N1CC[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC[C@H]21 ZINC001254596122 1040825275 /nfs/dbraw/zinc/82/52/75/1040825275.db2.gz OWCVHDZHTZBVLR-ATZDWAIDSA-N 1 1 357.454 2.641 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccccc2)CC[N@@H+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254606163 1040835442 /nfs/dbraw/zinc/83/54/42/1040835442.db2.gz FNDBIWPIECUXNX-FOIQADDNSA-N 1 1 365.433 2.909 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccccc2)CC[N@H+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254606163 1040835455 /nfs/dbraw/zinc/83/54/55/1040835455.db2.gz FNDBIWPIECUXNX-FOIQADDNSA-N 1 1 365.433 2.909 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CC[C@@H](SC)C1 ZINC001319541073 1045188219 /nfs/dbraw/zinc/18/82/19/1045188219.db2.gz LTGIBLHBTVUFFE-WCQYABFASA-N 1 1 353.444 2.758 20 5 FFBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC001319886237 1045295181 /nfs/dbraw/zinc/29/51/81/1045295181.db2.gz XTGSCNBGGBVPOE-UHFFFAOYSA-N 1 1 365.393 2.647 20 5 FFBDMO C[N@H+](Cc1ccc(C(N)=O)cc1)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC001319886237 1045295184 /nfs/dbraw/zinc/29/51/84/1045295184.db2.gz XTGSCNBGGBVPOE-UHFFFAOYSA-N 1 1 365.393 2.647 20 5 FFBDMO COc1ccccc1C1([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCC1 ZINC001320618087 1045438447 /nfs/dbraw/zinc/43/84/47/1045438447.db2.gz MPXZGXWVNIPPSP-UHFFFAOYSA-N 1 1 355.394 2.871 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2sccc2Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282608047 1045955957 /nfs/dbraw/zinc/95/59/57/1045955957.db2.gz VOVKOENUYGKVAR-DGCLKSJQSA-N 1 1 371.890 2.975 20 5 FFBDMO CN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@@H+]1CC=CCC1)C1CC1 ZINC001298117436 1050381520 /nfs/dbraw/zinc/38/15/20/1050381520.db2.gz AULLBKULZFYQMW-UHFFFAOYSA-N 1 1 368.441 2.714 20 5 FFBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001301803840 1050989454 /nfs/dbraw/zinc/98/94/54/1050989454.db2.gz QYWQGKGRGXCQIW-CQSZACIVSA-N 1 1 361.785 2.741 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC001303540294 1051379194 /nfs/dbraw/zinc/37/91/94/1051379194.db2.gz OQYBTJCQUBSPOW-GFCCVEGCSA-N 1 1 365.405 2.831 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001303800974 1051450442 /nfs/dbraw/zinc/45/04/42/1051450442.db2.gz KHPOSVGFDNCRIL-GOEBONIOSA-N 1 1 360.458 2.654 20 5 FFBDMO CCn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(C)Cc1ccccc1[N+](=O)[O-] ZINC001342998734 1051614849 /nfs/dbraw/zinc/61/48/49/1051614849.db2.gz BOIAKXXDGXTOBP-HNNXBMFYSA-N 1 1 358.446 2.652 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001307133550 1052255602 /nfs/dbraw/zinc/25/56/02/1052255602.db2.gz JTFWECZERUSXSX-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO CN(CCCN(C)c1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC[NH+](C)C ZINC001307133550 1052255611 /nfs/dbraw/zinc/25/56/11/1052255611.db2.gz JTFWECZERUSXSX-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO COc1cc(OC)c(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 ZINC001308207135 1052431904 /nfs/dbraw/zinc/43/19/04/1052431904.db2.gz CPPRDKMLDSGFNX-UHFFFAOYSA-N 1 1 362.382 2.919 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC001309282173 1052590954 /nfs/dbraw/zinc/59/09/54/1052590954.db2.gz GNOFPCSTKQAUKZ-GUTXKFCHSA-N 1 1 369.487 2.548 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001344498443 1052802644 /nfs/dbraw/zinc/80/26/44/1052802644.db2.gz ZHAMGHPNCCWPER-ZDUSSCGKSA-N 1 1 362.430 2.942 20 5 FFBDMO Cc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000847253266 1055321258 /nfs/dbraw/zinc/32/12/58/1055321258.db2.gz ABGUWEGCRWYPIG-LSDHHAIUSA-N 1 1 362.386 2.558 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC(Oc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC001353085518 1056064955 /nfs/dbraw/zinc/06/49/55/1056064955.db2.gz JVAGQZQVGXCRHZ-HXUWFJFHSA-N 1 1 369.421 2.839 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](C(=O)Oc2cccc([N+](=O)[O-])c2)[C@@H](c2cnn(C)c2)C1 ZINC000849487696 1056872711 /nfs/dbraw/zinc/87/27/11/1056872711.db2.gz FBLCPNPGHVWRPG-QZTJIDSGSA-N 1 1 372.425 2.748 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@@H+](C)CCN1C ZINC001517886779 1058189156 /nfs/dbraw/zinc/18/91/56/1058189156.db2.gz BEPPJRRCCDGVEF-SCLBCKFNSA-N 1 1 371.441 2.504 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOC[C@@H]1CCCO1 ZINC001200602123 1058749559 /nfs/dbraw/zinc/74/95/59/1058749559.db2.gz VSHDWGNVFRNXRM-NSHDSACASA-N 1 1 359.220 2.643 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000848350283 1059835366 /nfs/dbraw/zinc/83/53/66/1059835366.db2.gz PKPHJIKXXXAMEX-HKUYNNGSSA-N 1 1 372.469 2.942 20 5 FFBDMO CCC[N@H+]1CCC[C@@H](C(=O)NCCCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC001455683232 1059867931 /nfs/dbraw/zinc/86/79/31/1059867931.db2.gz WHAMGSQRPAQELX-CQSZACIVSA-N 1 1 373.457 2.642 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc(N3CCC[N@H+](C)CC3)cc2)n1 ZINC001516241763 1060013296 /nfs/dbraw/zinc/01/32/96/1060013296.db2.gz RHGJGDLTALFOOS-UHFFFAOYSA-N 1 1 369.425 2.692 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491415 1060148387 /nfs/dbraw/zinc/14/83/87/1060148387.db2.gz WAFSMCSKRMOCFM-ZWKOTPCHSA-N 1 1 361.442 2.615 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCCO1 ZINC000848491415 1060148399 /nfs/dbraw/zinc/14/83/99/1060148399.db2.gz WAFSMCSKRMOCFM-ZWKOTPCHSA-N 1 1 361.442 2.615 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1 ZINC000848582080 1060309687 /nfs/dbraw/zinc/30/96/87/1060309687.db2.gz GGLDSZQPDDDVNT-LLVKDONJSA-N 1 1 368.340 2.524 20 5 FFBDMO O=C(OCc1cc(O)ccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000848778092 1060675146 /nfs/dbraw/zinc/67/51/46/1060675146.db2.gz VJCIWRHNVIUPNB-OAHLLOKOSA-N 1 1 356.378 2.866 20 5 FFBDMO O=C(OCc1cc(O)ccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000848778092 1060675153 /nfs/dbraw/zinc/67/51/53/1060675153.db2.gz VJCIWRHNVIUPNB-OAHLLOKOSA-N 1 1 356.378 2.866 20 5 FFBDMO CC1(CO)CC[NH+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1 ZINC001459907755 1060844242 /nfs/dbraw/zinc/84/42/42/1060844242.db2.gz LCLBDEPYMCFECB-UHFFFAOYSA-N 1 1 366.805 2.893 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCN(CC(C)(F)F)CC1 ZINC001460839524 1061124018 /nfs/dbraw/zinc/12/40/18/1061124018.db2.gz BVLLENSRHZODDP-UHFFFAOYSA-N 1 1 370.400 2.505 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001461267014 1061272644 /nfs/dbraw/zinc/27/26/44/1061272644.db2.gz FKZWNYNJEPOVJD-JHJVBQTASA-N 1 1 369.849 2.957 20 5 FFBDMO CN(C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1 ZINC001476363986 1061398306 /nfs/dbraw/zinc/39/83/06/1061398306.db2.gz YDMVXKIXEOJPTN-NSHDSACASA-N 1 1 371.235 2.915 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(-c3nc(C)no3)cc2)c1[N+](=O)[O-] ZINC001462048876 1061489143 /nfs/dbraw/zinc/48/91/43/1061489143.db2.gz KYLXQZTZWRLBHI-UHFFFAOYSA-N 1 1 370.365 2.957 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)n1 ZINC001527774962 1061617845 /nfs/dbraw/zinc/61/78/45/1061617845.db2.gz KPOPZGLELNDYGN-UHFFFAOYSA-N 1 1 355.398 2.532 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)OCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001436562759 1062736746 /nfs/dbraw/zinc/73/67/46/1062736746.db2.gz SOVCQGDGGANUOB-UHFFFAOYSA-N 1 1 358.379 2.967 20 5 FFBDMO CC1(C)CCC(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)CC1 ZINC001495160334 1063452133 /nfs/dbraw/zinc/45/21/33/1063452133.db2.gz FTOHVZPOTRXQIS-HZPDHXFCSA-N 1 1 351.491 2.887 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO ZINC001472895672 1065168956 /nfs/dbraw/zinc/16/89/56/1065168956.db2.gz BUYBLRPOUXIUHI-NWDGAFQWSA-N 1 1 360.241 2.937 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@@H](C)c1ccccc1 ZINC001473293747 1065236608 /nfs/dbraw/zinc/23/66/08/1065236608.db2.gz YRAUETLPMLCHCC-AWEZNQCLSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)[C@@H](C)c1ccccc1 ZINC001473293747 1065236611 /nfs/dbraw/zinc/23/66/11/1065236611.db2.gz YRAUETLPMLCHCC-AWEZNQCLSA-N 1 1 373.409 2.597 20 5 FFBDMO C[C@H](c1ncccn1)[N@@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001473363851 1065248575 /nfs/dbraw/zinc/24/85/75/1065248575.db2.gz FUJYNIGUMWBURE-CYBMUJFWSA-N 1 1 367.413 2.534 20 5 FFBDMO C[C@H](c1ncccn1)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001473363851 1065248584 /nfs/dbraw/zinc/24/85/84/1065248584.db2.gz FUJYNIGUMWBURE-CYBMUJFWSA-N 1 1 367.413 2.534 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001473764632 1065350761 /nfs/dbraw/zinc/35/07/61/1065350761.db2.gz OBBNSSACESFZHZ-MRXNPFEDSA-N 1 1 355.398 2.941 20 5 FFBDMO O=C(CC[N@H+]1CCCC[C@@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001473764632 1065350770 /nfs/dbraw/zinc/35/07/70/1065350770.db2.gz OBBNSSACESFZHZ-MRXNPFEDSA-N 1 1 355.398 2.941 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1ccc2c(c1)OCO2 ZINC001473802696 1065369122 /nfs/dbraw/zinc/36/91/22/1065369122.db2.gz UTLVBGQBLLONRP-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC4(CC3)C[C@@H](O)CCO4)co2)cc1 ZINC001473820760 1065377794 /nfs/dbraw/zinc/37/77/94/1065377794.db2.gz FSASHVKHTGTMNM-KRWDZBQOSA-N 1 1 373.409 2.756 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](c3cnccn3)C2)cccc1[N+](=O)[O-] ZINC001473833573 1065383347 /nfs/dbraw/zinc/38/33/47/1065383347.db2.gz MCTCTDAMAVBFEZ-CQSZACIVSA-N 1 1 355.398 2.511 20 5 FFBDMO C[C@H]([NH3+])c1nc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC001576177465 1078202103 /nfs/dbraw/zinc/20/21/03/1078202103.db2.gz UAVXYZTZNKPSPQ-QMMMGPOBSA-N 1 1 354.819 2.697 20 5 FFBDMO Cn1c[nH+]c2c1ccc1c2CCCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001473881828 1065404392 /nfs/dbraw/zinc/40/43/92/1065404392.db2.gz NETFYMURQYFKAU-GOSISDBHSA-N 1 1 352.394 2.968 20 5 FFBDMO COC(=O)[C@@H](C)Oc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC001474391393 1065510301 /nfs/dbraw/zinc/51/03/01/1065510301.db2.gz KCOFZXBIXDJXEU-CYBMUJFWSA-N 1 1 374.393 2.834 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001474834555 1065620420 /nfs/dbraw/zinc/62/04/20/1065620420.db2.gz NENKCEXUSSJMJW-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001556870293 1075783244 /nfs/dbraw/zinc/78/32/44/1075783244.db2.gz NBHQHYOYGHQXRC-HNNXBMFYSA-N 1 1 373.457 2.690 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001585629530 1079482284 /nfs/dbraw/zinc/48/22/84/1079482284.db2.gz XCSLMYUZUBDOIK-UONOGXRCSA-N 1 1 354.410 2.687 20 5 FFBDMO CN(C)C(=O)C[NH+]1CCC(Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 ZINC001559097230 1076124922 /nfs/dbraw/zinc/12/49/22/1076124922.db2.gz PZFRARGFDVHYHF-UHFFFAOYSA-N 1 1 374.363 2.578 20 5 FFBDMO CC(C)CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC001559482279 1076165724 /nfs/dbraw/zinc/16/57/24/1076165724.db2.gz YJQAAAFRIAVTJB-UHFFFAOYSA-N 1 1 374.485 2.754 20 5 FFBDMO CC(C)[C@@H](CC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)NC(=O)OC(C)(C)C ZINC001559571164 1076174353 /nfs/dbraw/zinc/17/43/53/1076174353.db2.gz MKXOVQXBMKCUSN-CQSZACIVSA-N 1 1 369.466 2.663 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC001560077493 1076222520 /nfs/dbraw/zinc/22/25/20/1076222520.db2.gz ODUGDNFBXCDJTP-IUODEOHRSA-N 1 1 354.248 2.883 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cc([N+](=O)[O-])ccc3Br)CC[C@@H]21 ZINC001560077422 1076222599 /nfs/dbraw/zinc/22/25/99/1076222599.db2.gz KRUCUCPVRVOOQV-NHYWBVRUSA-N 1 1 354.248 2.883 20 5 FFBDMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001560102300 1076227168 /nfs/dbraw/zinc/22/71/68/1076227168.db2.gz KKNHMLWYWQKLOU-GOSISDBHSA-N 1 1 366.364 2.965 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)NCCC1=CCCCC1 ZINC001560168614 1076240467 /nfs/dbraw/zinc/24/04/67/1076240467.db2.gz QNLAHEUGNSGFEW-UHFFFAOYSA-N 1 1 361.442 2.912 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)NCCC1=CCCCC1 ZINC001560168614 1076240470 /nfs/dbraw/zinc/24/04/70/1076240470.db2.gz QNLAHEUGNSGFEW-UHFFFAOYSA-N 1 1 361.442 2.912 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001566156248 1076926725 /nfs/dbraw/zinc/92/67/25/1076926725.db2.gz PBIWKWBJJOVVTJ-ZDUSSCGKSA-N 1 1 366.849 2.825 20 5 FFBDMO C[C@H](Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001589978293 1080916236 /nfs/dbraw/zinc/91/62/36/1080916236.db2.gz MCVLCTFSSBJPEB-GXTWGEPZSA-N 1 1 371.445 2.840 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCn2cccc2[C@H]1C ZINC000026264505 249341424 /nfs/dbraw/zinc/34/14/24/249341424.db2.gz AFIXYEBPUQYILP-CYBMUJFWSA-N 1 1 358.398 2.810 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000093907165 250049955 /nfs/dbraw/zinc/04/99/55/250049955.db2.gz DVEZCVFXPLQWDZ-INIZCTEOSA-N 1 1 363.458 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c(Cl)c1 ZINC000106891455 250297014 /nfs/dbraw/zinc/29/70/14/250297014.db2.gz KMNCGBLZVOKQAA-LLVKDONJSA-N 1 1 373.862 2.543 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000153326557 251125386 /nfs/dbraw/zinc/12/53/86/251125386.db2.gz UGCUCPJIVDHMLR-HOCLYGCPSA-N 1 1 359.426 2.692 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272308490 252006324 /nfs/dbraw/zinc/00/63/24/252006324.db2.gz HVWZZFZYSNDXKK-UHFFFAOYSA-N 1 1 352.341 2.740 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@H](O)COCCOC(C)C ZINC000272283973 252000078 /nfs/dbraw/zinc/00/00/78/252000078.db2.gz FUQFVNRXNGFUSA-RDJZCZTQSA-N 1 1 354.447 2.699 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272510453 252056247 /nfs/dbraw/zinc/05/62/47/252056247.db2.gz IWLHHDHJBGLMTL-ICSRJNTNSA-N 1 1 366.421 2.915 20 5 FFBDMO Cn1cc(CN2CC[C@H]3CC[N@@H+](C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084950 /nfs/dbraw/zinc/08/49/50/252084950.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@H]3CCN(C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084952 /nfs/dbraw/zinc/08/49/52/252084952.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 1 1 355.442 2.521 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]3CCN(C)C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000272625530 252084955 /nfs/dbraw/zinc/08/49/55/252084955.db2.gz MKHXDKGSVHEZJN-RDTXWAMCSA-N 1 1 355.442 2.521 20 5 FFBDMO COc1ccc(NC(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000272839424 252145104 /nfs/dbraw/zinc/14/51/04/252145104.db2.gz OFYRIOAQWSGLCD-AWEZNQCLSA-N 1 1 350.419 2.942 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)Cc3ccccc3[N+](=O)[O-])sc2C1 ZINC000273049243 252200985 /nfs/dbraw/zinc/20/09/85/252200985.db2.gz QRDVDBGLGWULRW-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)Cc3ccccc3[N+](=O)[O-])sc2C1 ZINC000273049243 252200989 /nfs/dbraw/zinc/20/09/89/252200989.db2.gz QRDVDBGLGWULRW-UHFFFAOYSA-N 1 1 360.439 2.999 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000276340533 256091509 /nfs/dbraw/zinc/09/15/09/256091509.db2.gz SGKGHZYEOJULGB-CQSZACIVSA-N 1 1 369.487 2.778 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)[C@H]2C1 ZINC000277262021 256177809 /nfs/dbraw/zinc/17/78/09/256177809.db2.gz LMAHMWCHWYPUNE-MFKMUULPSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277278312 256179936 /nfs/dbraw/zinc/17/99/36/256179936.db2.gz BBLKLQCEJXVCLZ-CQSZACIVSA-N 1 1 364.446 2.834 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000285777959 257004312 /nfs/dbraw/zinc/00/43/12/257004312.db2.gz TYRACKDVVOXCLY-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1 ZINC000285777959 257004313 /nfs/dbraw/zinc/00/43/13/257004313.db2.gz TYRACKDVVOXCLY-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO COc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc2c1OCCO2 ZINC000278577952 256327118 /nfs/dbraw/zinc/32/71/18/256327118.db2.gz CUTWWEOLINZAHX-UHFFFAOYSA-N 1 1 370.365 2.541 20 5 FFBDMO CN(C)C(=O)c1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[nH]1 ZINC000278306979 256297800 /nfs/dbraw/zinc/29/78/00/256297800.db2.gz AOXHGPLMARHQFQ-UHFFFAOYSA-N 1 1 370.331 2.933 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(c3cc(C(F)(F)C(F)(F)F)ncc3[N+](=O)[O-])C[C@H]2C1 ZINC000278804832 256349785 /nfs/dbraw/zinc/34/97/85/256349785.db2.gz RNULFIISLMGDCC-DTORHVGOSA-N 1 1 366.290 2.642 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000286597367 257044974 /nfs/dbraw/zinc/04/49/74/257044974.db2.gz QWENXVPZSBEMTG-VNIGLLLESA-N 1 1 359.426 2.587 20 5 FFBDMO CC(=O)c1cc(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)ccc1[N+](=O)[O-] ZINC000286912496 257061617 /nfs/dbraw/zinc/06/16/17/257061617.db2.gz PPOFEFNRGURPNQ-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000301075348 258023231 /nfs/dbraw/zinc/02/32/31/258023231.db2.gz GDEXBDKDABDXTP-LLVKDONJSA-N 1 1 352.391 2.590 20 5 FFBDMO Cc1nn(C)c(NCc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301287973 258040079 /nfs/dbraw/zinc/04/00/79/258040079.db2.gz PBYZLMPMXCINGM-OKILXGFUSA-N 1 1 373.457 2.858 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302151069 258091086 /nfs/dbraw/zinc/09/10/86/258091086.db2.gz BOIIIVQNUUNRFL-UKRRQHHQSA-N 1 1 352.398 2.570 20 5 FFBDMO C[C@@H]1CN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000302480142 258103337 /nfs/dbraw/zinc/10/33/37/258103337.db2.gz GJYYEGBJRVHUBO-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1cc(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301616916 258059211 /nfs/dbraw/zinc/05/92/11/258059211.db2.gz CFRJPVCATVDKSW-UXHICEINSA-N 1 1 353.422 2.993 20 5 FFBDMO Cc1cc(N2C[C@@H]3[C@H](C2)OCC[N@H+]3Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301616916 258059212 /nfs/dbraw/zinc/05/92/12/258059212.db2.gz CFRJPVCATVDKSW-UXHICEINSA-N 1 1 353.422 2.993 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302012229 258081579 /nfs/dbraw/zinc/08/15/79/258081579.db2.gz WUYJVVKFCZPNTM-MRXNPFEDSA-N 1 1 366.425 2.596 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000302027091 258082666 /nfs/dbraw/zinc/08/26/66/258082666.db2.gz HDXAWDXUYXMICH-GJZGRUSLSA-N 1 1 358.446 2.728 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000330691304 258168579 /nfs/dbraw/zinc/16/85/79/258168579.db2.gz BCWRWYNUVGNVTC-WBVHZDCISA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000330836935 258171553 /nfs/dbraw/zinc/17/15/53/258171553.db2.gz TWHIDYZCBKOKAP-ZYHUDNBSSA-N 1 1 357.863 2.939 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000331124117 258177820 /nfs/dbraw/zinc/17/78/20/258177820.db2.gz HEWLUVJYLCLMPO-XJKSGUPXSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000331124117 258177821 /nfs/dbraw/zinc/17/78/21/258177821.db2.gz HEWLUVJYLCLMPO-XJKSGUPXSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000331124116 258177954 /nfs/dbraw/zinc/17/79/54/258177954.db2.gz HEWLUVJYLCLMPO-CZUORRHYSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000331124116 258177955 /nfs/dbraw/zinc/17/79/55/258177955.db2.gz HEWLUVJYLCLMPO-CZUORRHYSA-N 1 1 351.472 2.874 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)cc1SC ZINC000331138719 258178027 /nfs/dbraw/zinc/17/80/27/258178027.db2.gz LIRNKPLSSZTQDK-AWEZNQCLSA-N 1 1 367.471 2.738 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000331973200 258208276 /nfs/dbraw/zinc/20/82/76/258208276.db2.gz SROKMVAHTWEEME-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H]2CCCC[N@@H+]2C[C@H]1C ZINC000332007016 258209639 /nfs/dbraw/zinc/20/96/39/258209639.db2.gz JJQONTLPJIUVJF-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000373059802 512152887 /nfs/dbraw/zinc/15/28/87/512152887.db2.gz RQGIGUCZTSIZPG-JTQLQIEISA-N 1 1 366.219 2.870 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000052861544 506265959 /nfs/dbraw/zinc/26/59/59/506265959.db2.gz SMCYCGFNZFJFQF-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)n1 ZINC000052861544 506265971 /nfs/dbraw/zinc/26/59/71/506265971.db2.gz SMCYCGFNZFJFQF-ZDUSSCGKSA-N 1 1 370.369 2.716 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000377267921 512193430 /nfs/dbraw/zinc/19/34/30/512193430.db2.gz RBYPAFAHIIOIJY-AWEZNQCLSA-N 1 1 357.414 2.537 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000369066566 512211189 /nfs/dbraw/zinc/21/11/89/512211189.db2.gz RUBOLJVQMZJRKS-OAHLLOKOSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000377347244 512226274 /nfs/dbraw/zinc/22/62/74/512226274.db2.gz QVJKBELFWPQPOR-GUYCJALGSA-N 1 1 355.394 2.693 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CC[N@@H+](C)C1CCCCC1 ZINC000065971495 506402810 /nfs/dbraw/zinc/40/28/10/506402810.db2.gz CZGMSKVVKPKMAF-UHFFFAOYSA-N 1 1 369.487 2.788 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c1)CC2 ZINC000375345224 512278571 /nfs/dbraw/zinc/27/85/71/512278571.db2.gz MOBNDEKSVOYVAO-UHFFFAOYSA-N 1 1 372.469 2.895 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000054224893 506517892 /nfs/dbraw/zinc/51/78/92/506517892.db2.gz OJGRFUAPHZESPR-GOEBONIOSA-N 1 1 354.410 2.864 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])CC1 ZINC000041621007 506536814 /nfs/dbraw/zinc/53/68/14/506536814.db2.gz VFTSQHXOAJQLQB-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO C[N@H+](CCOc1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374712 506850860 /nfs/dbraw/zinc/85/08/60/506850860.db2.gz PLAIKAKSMWFOKV-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO C[N@@H+](CCOc1ccccc1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067374712 506850862 /nfs/dbraw/zinc/85/08/62/506850862.db2.gz PLAIKAKSMWFOKV-SFHVURJKSA-N 1 1 355.394 2.711 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000067416670 506870960 /nfs/dbraw/zinc/87/09/60/506870960.db2.gz NCQMMKBHDKALIM-GXTWGEPZSA-N 1 1 373.413 2.554 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000067416670 506870968 /nfs/dbraw/zinc/87/09/68/506870968.db2.gz NCQMMKBHDKALIM-GXTWGEPZSA-N 1 1 373.413 2.554 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000056067417 506923378 /nfs/dbraw/zinc/92/33/78/506923378.db2.gz NKLBFXLIHVXYLD-GASCZTMLSA-N 1 1 369.487 2.631 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000056166418 506953773 /nfs/dbraw/zinc/95/37/73/506953773.db2.gz YYZAXKSQEAJIRI-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)c1c[nH]c2cc([N+](=O)[O-])ccc21 ZINC000056166418 506953780 /nfs/dbraw/zinc/95/37/80/506953780.db2.gz YYZAXKSQEAJIRI-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000068133233 507123609 /nfs/dbraw/zinc/12/36/09/507123609.db2.gz GTGNBEMJSWIWOO-CQSZACIVSA-N 1 1 357.414 2.562 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000018110278 507139437 /nfs/dbraw/zinc/13/94/37/507139437.db2.gz MVQINBWCHGPWAB-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N[C@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])CC1 ZINC000057553081 507286629 /nfs/dbraw/zinc/28/66/29/507286629.db2.gz BWLVYBSLJGBGNL-INIZCTEOSA-N 1 1 372.469 2.798 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N[C@@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000057553084 507287001 /nfs/dbraw/zinc/28/70/01/507287001.db2.gz GVPSXJRMWYOTOL-GOEBONIOSA-N 1 1 372.469 2.798 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccccn2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000371324480 512330970 /nfs/dbraw/zinc/33/09/70/512330970.db2.gz XPPQZJCGORPBFD-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)C1CCCCC1 ZINC000068900680 507354982 /nfs/dbraw/zinc/35/49/82/507354982.db2.gz MWZLZPRDHWWKAU-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CC(=O)Nc1ccccc1 ZINC000047593101 507362649 /nfs/dbraw/zinc/36/26/49/507362649.db2.gz QRCXVCPXLJQSHH-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC(=O)Nc1ccccc1 ZINC000047593101 507362654 /nfs/dbraw/zinc/36/26/54/507362654.db2.gz QRCXVCPXLJQSHH-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1sc2nc(C[NH+]3CCCC3)nc(-n3ccc([N+](=O)[O-])n3)c2c1C ZINC000050931419 507719297 /nfs/dbraw/zinc/71/92/97/507719297.db2.gz LBFJTKMVFLGRMA-UHFFFAOYSA-N 1 1 358.427 2.998 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000071862571 507721358 /nfs/dbraw/zinc/72/13/58/507721358.db2.gz ROISKPZMIQUSSF-MRXNPFEDSA-N 1 1 353.382 2.504 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000052036932 507794977 /nfs/dbraw/zinc/79/49/77/507794977.db2.gz BGEIZLOHXSGISS-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO COc1ccc(C[NH+]2CCC(C(=O)Nc3cc(C)on3)CC2)cc1[N+](=O)[O-] ZINC000052403322 507807896 /nfs/dbraw/zinc/80/78/96/507807896.db2.gz ALUXZMMAMMISDQ-UHFFFAOYSA-N 1 1 374.397 2.751 20 5 FFBDMO CC(=O)Nc1cccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665055 507840392 /nfs/dbraw/zinc/84/03/92/507840392.db2.gz QRURRDVHZYQUME-MRXNPFEDSA-N 1 1 355.398 2.635 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000108340217 507888925 /nfs/dbraw/zinc/88/89/25/507888925.db2.gz ZKHITWLDVKQRJE-MRXNPFEDSA-N 1 1 363.461 2.613 20 5 FFBDMO C[N@@H+](CCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])C1CCCCC1 ZINC000074159183 507992847 /nfs/dbraw/zinc/99/28/47/507992847.db2.gz LQUMAZQZXSRSKP-UHFFFAOYSA-N 1 1 359.430 2.898 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000074321143 508011899 /nfs/dbraw/zinc/01/18/99/508011899.db2.gz CJUAHTVHEHZEJP-MRXNPFEDSA-N 1 1 370.453 2.740 20 5 FFBDMO Nc1nc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000110596722 508036076 /nfs/dbraw/zinc/03/60/76/508036076.db2.gz KSZYVVJPBLNGOR-GOOCMWNKSA-N 1 1 354.414 2.575 20 5 FFBDMO O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000092188698 508048567 /nfs/dbraw/zinc/04/85/67/508048567.db2.gz OSGKDJDYUMMCKY-AWEZNQCLSA-N 1 1 370.409 2.844 20 5 FFBDMO Cc1ccc(CN2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000092664999 508092157 /nfs/dbraw/zinc/09/21/57/508092157.db2.gz UHXZMDPRMYOJGV-HDICACEKSA-N 1 1 360.502 2.894 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN[C@@H](c2nnc[nH]2)c2ccccc2)cc1 ZINC000375527137 512377935 /nfs/dbraw/zinc/37/79/35/512377935.db2.gz WNGGNQZJQFIYFE-QGZVFWFLSA-N 1 1 353.382 2.861 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000081128770 508141109 /nfs/dbraw/zinc/14/11/09/508141109.db2.gz BTCBUMCFSZEHCP-SFHVURJKSA-N 1 1 369.421 2.707 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(OC)c1 ZINC000093534204 508147774 /nfs/dbraw/zinc/14/77/74/508147774.db2.gz MZDVABBPVPHMCF-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO COc1cc(CN(C)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000093660036 508151485 /nfs/dbraw/zinc/15/14/85/508151485.db2.gz PZHMXOKANRCAEN-OAHLLOKOSA-N 1 1 351.447 2.918 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000081361906 508166994 /nfs/dbraw/zinc/16/69/94/508166994.db2.gz MCICGGSLEZTPSU-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000081569391 508191681 /nfs/dbraw/zinc/19/16/81/508191681.db2.gz LPKVKOWWGCWCQG-AWEZNQCLSA-N 1 1 359.430 2.809 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081633406 508199616 /nfs/dbraw/zinc/19/96/16/508199616.db2.gz MIZFRBOZLUOBJE-GOEBONIOSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1ccc(CC[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000077359493 508305092 /nfs/dbraw/zinc/30/50/92/508305092.db2.gz JUDWBRZEMVOEPL-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000103605672 508319076 /nfs/dbraw/zinc/31/90/76/508319076.db2.gz VAFARXHKTGBACI-MRXNPFEDSA-N 1 1 360.458 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCN(C(C)C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000114774769 508346268 /nfs/dbraw/zinc/34/62/68/508346268.db2.gz QCPJBMJUVKPIDX-MRXNPFEDSA-N 1 1 373.409 2.962 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000115274693 508380319 /nfs/dbraw/zinc/38/03/19/508380319.db2.gz SIQAKKVFOIKCFY-RHSMWYFYSA-N 1 1 363.458 2.770 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ncccc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000088751360 508381896 /nfs/dbraw/zinc/38/18/96/508381896.db2.gz SPAXHJKSNWQSRM-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccncc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000088751561 508382306 /nfs/dbraw/zinc/38/23/06/508382306.db2.gz PGEPNFUNNCCUTB-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000106787610 508404505 /nfs/dbraw/zinc/40/45/05/508404505.db2.gz UKQFHYFEZWTSNZ-OAHLLOKOSA-N 1 1 358.442 2.916 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CC[NH+](C3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000115723845 508431833 /nfs/dbraw/zinc/43/18/33/508431833.db2.gz QPMAXKNEPSMEKL-UHFFFAOYSA-N 1 1 363.462 2.607 20 5 FFBDMO C[NH+]1CCN(C(=O)Cc2cccc(NCc3csc([N+](=O)[O-])c3)c2)CC1 ZINC000152444268 508447735 /nfs/dbraw/zinc/44/77/35/508447735.db2.gz CKXOGKJSADBXBC-UHFFFAOYSA-N 1 1 374.466 2.585 20 5 FFBDMO Nc1ccc(F)c(NC(=O)CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153300894 508568971 /nfs/dbraw/zinc/56/89/71/508568971.db2.gz UITHJZNVIBJQTR-UHFFFAOYSA-N 1 1 358.373 2.703 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3C(=O)N(C)C)o2)c([N+](=O)[O-])c1 ZINC000122685171 508572132 /nfs/dbraw/zinc/57/21/32/508572132.db2.gz LYBQIDKZMIVMGF-MRXNPFEDSA-N 1 1 373.409 2.916 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCc1nccs1 ZINC000157544058 508580010 /nfs/dbraw/zinc/58/00/10/508580010.db2.gz SFBWTFXDKZWSMN-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CSC[C@@H]1CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000135484921 508611554 /nfs/dbraw/zinc/61/15/54/508611554.db2.gz SDNLLFSPTILDPG-ZDUSSCGKSA-N 1 1 351.428 2.720 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000128727904 508635148 /nfs/dbraw/zinc/63/51/48/508635148.db2.gz FWZXESUWEIKOQK-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCC[N@@H+](C)C1 ZINC000153769524 508644783 /nfs/dbraw/zinc/64/47/83/508644783.db2.gz SWCIJRVGOKGHDG-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO CC(C)c1[nH+]ccn1CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000118773984 508671348 /nfs/dbraw/zinc/67/13/48/508671348.db2.gz FCYQMJFJOBDBSY-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000123376380 508677272 /nfs/dbraw/zinc/67/72/72/508677272.db2.gz KXTSVZCLAPTQKP-UHFFFAOYSA-N 1 1 361.489 2.508 20 5 FFBDMO CN(C(=O)[C@H](c1ccccc1)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000158306728 508686390 /nfs/dbraw/zinc/68/63/90/508686390.db2.gz OYYXXUMCZYXSFZ-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(-n4cccn4)cc3)C2)nc1 ZINC000118866494 508688886 /nfs/dbraw/zinc/68/88/86/508688886.db2.gz LWOUHMXXDLSYNZ-INIZCTEOSA-N 1 1 364.409 2.862 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968589 508688921 /nfs/dbraw/zinc/68/89/21/508688921.db2.gz OXZJUFYRMICVNM-ZWKOTPCHSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C12CCC2 ZINC000153968589 508688923 /nfs/dbraw/zinc/68/89/23/508688923.db2.gz OXZJUFYRMICVNM-ZWKOTPCHSA-N 1 1 373.453 2.763 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000136646523 508705745 /nfs/dbraw/zinc/70/57/45/508705745.db2.gz ROZSPSDEWBKNOY-AWEZNQCLSA-N 1 1 358.442 2.809 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1cnn(C)c1 ZINC000371458234 512413643 /nfs/dbraw/zinc/41/36/43/512413643.db2.gz JXSAAUQJQXIBIB-AEFFLSMTSA-N 1 1 374.441 2.815 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000137485092 508758551 /nfs/dbraw/zinc/75/85/51/508758551.db2.gz OEGGFTCSDLVUIT-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124187929 508794660 /nfs/dbraw/zinc/79/46/60/508794660.db2.gz HEOHYKIAKFFWAO-ZYHUDNBSSA-N 1 1 370.247 2.912 20 5 FFBDMO O=C1C[C@@H]([N@@H+]2CC[C@@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000119720621 508850534 /nfs/dbraw/zinc/85/05/34/508850534.db2.gz WEZVYEOCVWHMDJ-CRAIPNDOSA-N 1 1 365.389 2.716 20 5 FFBDMO O=C1C[C@@H]([N@H+]2CC[C@@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000119720621 508850537 /nfs/dbraw/zinc/85/05/37/508850537.db2.gz WEZVYEOCVWHMDJ-CRAIPNDOSA-N 1 1 365.389 2.716 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Br)s1 ZINC000159729104 508881533 /nfs/dbraw/zinc/88/15/33/508881533.db2.gz GDUPNEGCYVNIDH-UHFFFAOYSA-N 1 1 372.244 2.713 20 5 FFBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159731156 508881448 /nfs/dbraw/zinc/88/14/48/508881448.db2.gz RYLFLCDLDVSQKT-KRWDZBQOSA-N 1 1 373.409 2.611 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Br)s1 ZINC000159729104 508881531 /nfs/dbraw/zinc/88/15/31/508881531.db2.gz GDUPNEGCYVNIDH-UHFFFAOYSA-N 1 1 372.244 2.713 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NCC[N@@H+]1CCc2sccc2C1 ZINC000150771902 508890305 /nfs/dbraw/zinc/89/03/05/508890305.db2.gz MPKKSIVMTCTJSC-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NCC[N@H+]1CCc2sccc2C1 ZINC000150771902 508890308 /nfs/dbraw/zinc/89/03/08/508890308.db2.gz MPKKSIVMTCTJSC-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OC(F)F ZINC000159869306 508903449 /nfs/dbraw/zinc/90/34/49/508903449.db2.gz ZSFNGCBDQBEYJN-MFKMUULPSA-N 1 1 360.357 2.798 20 5 FFBDMO Cc1cccc([C@@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000160461799 508990891 /nfs/dbraw/zinc/99/08/91/508990891.db2.gz BHKXMOHPAVYXME-LPHOPBHVSA-N 1 1 357.410 2.875 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000160491794 508994874 /nfs/dbraw/zinc/99/48/74/508994874.db2.gz NTDYGWTULWEGOR-SCRDCRAPSA-N 1 1 354.838 2.721 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000160491794 508994875 /nfs/dbraw/zinc/99/48/75/508994875.db2.gz NTDYGWTULWEGOR-SCRDCRAPSA-N 1 1 354.838 2.721 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1Cl ZINC000132430789 509030768 /nfs/dbraw/zinc/03/07/68/509030768.db2.gz XJRFHQHRCMURQZ-UHFFFAOYSA-N 1 1 364.627 2.692 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000161555383 509128500 /nfs/dbraw/zinc/12/85/00/509128500.db2.gz VVNHFVYHTOAJMJ-JTQLQIEISA-N 1 1 368.231 2.571 20 5 FFBDMO COc1c(C)c[nH+]c(Cn2c(C)nc([N+](=O)[O-])c2Br)c1C ZINC000126874781 509141433 /nfs/dbraw/zinc/14/14/33/509141433.db2.gz HZFZZABEZVIKJJ-UHFFFAOYSA-N 1 1 355.192 2.931 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC000156295594 509156416 /nfs/dbraw/zinc/15/64/16/509156416.db2.gz UOELGPPXCJWVSU-AGUYFDCRSA-N 1 1 354.410 2.888 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)n1 ZINC000191830950 509200700 /nfs/dbraw/zinc/20/07/00/509200700.db2.gz XPFYLUJHBHVSMF-HNNXBMFYSA-N 1 1 371.441 2.548 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000172788269 509236094 /nfs/dbraw/zinc/23/60/94/509236094.db2.gz CMUMGVASWYOMED-INIZCTEOSA-N 1 1 374.485 2.999 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000248124619 509239578 /nfs/dbraw/zinc/23/95/78/509239578.db2.gz VEOXTEQXXPKOMN-UGSOOPFHSA-N 1 1 356.426 2.561 20 5 FFBDMO COc1cccc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000185644268 509282010 /nfs/dbraw/zinc/28/20/10/509282010.db2.gz LQSIKEJQBMTIQD-HOTGVXAUSA-N 1 1 357.410 2.651 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]2CCCC[C@@H]12 ZINC000248411193 509304996 /nfs/dbraw/zinc/30/49/96/509304996.db2.gz DNILVSZDFQBVSC-DYEKYZERSA-N 1 1 361.398 2.773 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000176280012 509418110 /nfs/dbraw/zinc/41/81/10/509418110.db2.gz UBHJHXDLEJKOET-HOTGVXAUSA-N 1 1 362.474 2.894 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000264357376 509478744 /nfs/dbraw/zinc/47/87/44/509478744.db2.gz YCACXMYSSGXKIK-HNNXBMFYSA-N 1 1 359.451 2.951 20 5 FFBDMO COC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000192384096 509496585 /nfs/dbraw/zinc/49/65/85/509496585.db2.gz RUVDLTLAFIBJLP-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000248837789 509505486 /nfs/dbraw/zinc/50/54/86/509505486.db2.gz DQQMDZWZZPSJDO-RHSMWYFYSA-N 1 1 369.421 2.854 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](C)[NH+]1CCN(c2ccccc2)CC1 ZINC000192495615 509539400 /nfs/dbraw/zinc/53/94/00/509539400.db2.gz JUEBPDSOEQLBOE-OAHLLOKOSA-N 1 1 372.473 2.742 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183014974 509548167 /nfs/dbraw/zinc/54/81/67/509548167.db2.gz LQRMGJATSBQXRF-UONOGXRCSA-N 1 1 367.471 2.526 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000248945920 509550539 /nfs/dbraw/zinc/55/05/39/509550539.db2.gz ZGWNKOIOHPAFKS-FZKQIMNGSA-N 1 1 354.410 2.549 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000248950443 509551676 /nfs/dbraw/zinc/55/16/76/509551676.db2.gz ZSWZCAYWMOWPDA-CRAIPNDOSA-N 1 1 368.437 2.915 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000249003683 509570034 /nfs/dbraw/zinc/57/00/34/509570034.db2.gz IURMUFVGYSUBAH-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000249003683 509570043 /nfs/dbraw/zinc/57/00/43/509570043.db2.gz IURMUFVGYSUBAH-NWDGAFQWSA-N 1 1 353.444 2.758 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000176706406 509651162 /nfs/dbraw/zinc/65/11/62/509651162.db2.gz YJWPKLKWSKVAFI-HNNXBMFYSA-N 1 1 354.410 2.571 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCCO1)C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173578947 509657637 /nfs/dbraw/zinc/65/76/37/509657637.db2.gz LIZSGBHEFAANLD-GOSISDBHSA-N 1 1 373.453 2.908 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000249689500 509736811 /nfs/dbraw/zinc/73/68/11/509736811.db2.gz WMGFXUMCOKJTJF-UONOGXRCSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000249689500 509736818 /nfs/dbraw/zinc/73/68/18/509736818.db2.gz WMGFXUMCOKJTJF-UONOGXRCSA-N 1 1 357.414 2.833 20 5 FFBDMO NC(=O)[C@H](c1ccccc1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799436 509785114 /nfs/dbraw/zinc/78/51/14/509785114.db2.gz RCCFPISMTRVHJK-SFHVURJKSA-N 1 1 355.394 2.665 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180184440 509797888 /nfs/dbraw/zinc/79/78/88/509797888.db2.gz ZWZPPBVFCLROJZ-APWZRJJASA-N 1 1 354.410 2.568 20 5 FFBDMO O=C1OCC[C@]12CCC[N@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186752663 509889341 /nfs/dbraw/zinc/88/93/41/509889341.db2.gz IFTYIEYRNBDZPU-GOSISDBHSA-N 1 1 357.366 2.574 20 5 FFBDMO O=C1OCC[C@]12CCC[N@@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186752663 509889348 /nfs/dbraw/zinc/88/93/48/509889348.db2.gz IFTYIEYRNBDZPU-GOSISDBHSA-N 1 1 357.366 2.574 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)c1 ZINC000245438545 509932248 /nfs/dbraw/zinc/93/22/48/509932248.db2.gz FLFJHNSUQVVGGW-HKUYNNGSSA-N 1 1 356.426 2.694 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000193585179 509978188 /nfs/dbraw/zinc/97/81/88/509978188.db2.gz RKSIJNZFSDSPTI-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585179 509978194 /nfs/dbraw/zinc/97/81/94/509978194.db2.gz RKSIJNZFSDSPTI-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585179 509978199 /nfs/dbraw/zinc/97/81/99/509978199.db2.gz RKSIJNZFSDSPTI-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000174254731 510024789 /nfs/dbraw/zinc/02/47/89/510024789.db2.gz LQBQSQUNRHHSGN-FUHWJXTLSA-N 1 1 360.458 2.794 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000193766300 510057889 /nfs/dbraw/zinc/05/78/89/510057889.db2.gz XRXKHKNBSYWOIO-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245743937 510121541 /nfs/dbraw/zinc/12/15/41/510121541.db2.gz XSOBULNJHPURNJ-DYVFJYSZSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245743937 510121549 /nfs/dbraw/zinc/12/15/49/510121549.db2.gz XSOBULNJHPURNJ-DYVFJYSZSA-N 1 1 357.414 2.621 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1Br ZINC000265757249 510212204 /nfs/dbraw/zinc/21/22/04/510212204.db2.gz JHWQPNODCMDALK-KBPBESRZSA-N 1 1 368.231 2.714 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](CCCc3ccccc3)C2)c1 ZINC000245929009 510213109 /nfs/dbraw/zinc/21/31/09/510213109.db2.gz IPEAQTFDEDSXDG-AZUAARDMSA-N 1 1 372.469 2.887 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C2 ZINC000174682855 510248818 /nfs/dbraw/zinc/24/88/18/510248818.db2.gz QEAXHJGQGWWNOQ-DOTOQJQBSA-N 1 1 372.469 2.894 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)[C@H](N2CCOCC2)C1 ZINC000246328446 510429508 /nfs/dbraw/zinc/42/95/08/510429508.db2.gz DLIYXHHXNCPSQT-CRAIPNDOSA-N 1 1 363.458 2.535 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@H](Cc2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000181534082 510459105 /nfs/dbraw/zinc/45/91/05/510459105.db2.gz ARRVEHHCYXTNDL-LJQANCHMSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](Cc2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000181534082 510459113 /nfs/dbraw/zinc/45/91/13/510459113.db2.gz ARRVEHHCYXTNDL-LJQANCHMSA-N 1 1 369.421 2.867 20 5 FFBDMO C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181540753 510463037 /nfs/dbraw/zinc/46/30/37/510463037.db2.gz OYXSVIOISWLUPG-HUUCEWRRSA-N 1 1 361.442 2.743 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000269598619 510477619 /nfs/dbraw/zinc/47/76/19/510477619.db2.gz LYFGOYNQZBMBGB-UHFFFAOYSA-N 1 1 350.806 2.844 20 5 FFBDMO Cc1cc(C(=O)NC2CCN(c3cc(C)[nH+]c(C)n3)CC2)cc([N+](=O)[O-])c1 ZINC000178192613 510482286 /nfs/dbraw/zinc/48/22/86/510482286.db2.gz FWVMUWUOLNIPKN-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000246544592 510545574 /nfs/dbraw/zinc/54/55/74/510545574.db2.gz GNXDJCMMWUPCKO-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2OCCC[C@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000246544592 510545582 /nfs/dbraw/zinc/54/55/82/510545582.db2.gz GNXDJCMMWUPCKO-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000175272302 510562967 /nfs/dbraw/zinc/56/29/67/510562967.db2.gz LQLQVJSWUHLARN-UKRRQHHQSA-N 1 1 371.441 2.663 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000194925834 510593773 /nfs/dbraw/zinc/59/37/73/510593773.db2.gz RTWRVCGQHPOWQM-FUHWJXTLSA-N 1 1 352.431 2.616 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197679 510595398 /nfs/dbraw/zinc/59/53/98/510595398.db2.gz MCOLVTOKXHLXRB-KBPBESRZSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197679 510595403 /nfs/dbraw/zinc/59/54/03/510595403.db2.gz MCOLVTOKXHLXRB-KBPBESRZSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197679 510595411 /nfs/dbraw/zinc/59/54/11/510595411.db2.gz MCOLVTOKXHLXRB-KBPBESRZSA-N 1 1 363.462 2.607 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000191320500 510604546 /nfs/dbraw/zinc/60/45/46/510604546.db2.gz HUTNOPUNUSEOKR-HNNXBMFYSA-N 1 1 364.446 2.690 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000181884036 510639989 /nfs/dbraw/zinc/63/99/89/510639989.db2.gz YHXLUNLNINXNMU-QZTJIDSGSA-N 1 1 356.422 2.824 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000178526016 510647893 /nfs/dbraw/zinc/64/78/93/510647893.db2.gz DICCWHPYECPDED-ZDUSSCGKSA-N 1 1 374.397 2.808 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000178526016 510647901 /nfs/dbraw/zinc/64/79/01/510647901.db2.gz DICCWHPYECPDED-ZDUSSCGKSA-N 1 1 374.397 2.808 20 5 FFBDMO CN(Cc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188302676 510698306 /nfs/dbraw/zinc/69/83/06/510698306.db2.gz IDESMPKPADQVRQ-FQEVSTJZSA-N 1 1 355.438 2.664 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178645449 510702569 /nfs/dbraw/zinc/70/25/69/510702569.db2.gz CIZIAWCSKCELNT-OAHLLOKOSA-N 1 1 355.442 2.592 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000246906154 510737319 /nfs/dbraw/zinc/73/73/19/510737319.db2.gz VOVZGNMBHUQSRW-MAUKXSAKSA-N 1 1 363.458 2.770 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182078867 510744208 /nfs/dbraw/zinc/74/42/08/510744208.db2.gz XERQZXMGVORIAV-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)n1 ZINC000191657782 510775453 /nfs/dbraw/zinc/77/54/53/510775453.db2.gz GNAZTXOIZJDIJB-GFCCVEGCSA-N 1 1 368.397 2.796 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172584031 510805471 /nfs/dbraw/zinc/80/54/71/510805471.db2.gz JQHRUCIKXWEMFA-HNNXBMFYSA-N 1 1 360.458 2.872 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000247110259 510837057 /nfs/dbraw/zinc/83/70/57/510837057.db2.gz DWXKROFEJHXYPI-JQWIXIFHSA-N 1 1 370.356 2.897 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182310506 510848041 /nfs/dbraw/zinc/84/80/41/510848041.db2.gz ZFZUGZPRSDHBBG-LLVKDONJSA-N 1 1 357.863 2.798 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247302642 510856106 /nfs/dbraw/zinc/85/61/06/510856106.db2.gz UVHXXHFGUIQRJF-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000247302642 510856107 /nfs/dbraw/zinc/85/61/07/510856107.db2.gz UVHXXHFGUIQRJF-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000247302642 510856108 /nfs/dbraw/zinc/85/61/08/510856108.db2.gz UVHXXHFGUIQRJF-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000247302642 510856109 /nfs/dbraw/zinc/85/61/09/510856109.db2.gz UVHXXHFGUIQRJF-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000247334914 510857658 /nfs/dbraw/zinc/85/76/58/510857658.db2.gz VSMYRLNAXWWUJV-CABCVRRESA-N 1 1 371.441 2.610 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c1 ZINC000247342030 510857762 /nfs/dbraw/zinc/85/77/62/510857762.db2.gz XPQLDRBKMVNVKR-PKOBYXMFSA-N 1 1 358.442 2.640 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000247539911 510865114 /nfs/dbraw/zinc/86/51/14/510865114.db2.gz PAHTYBFDNHQLLF-FRFSOERESA-N 1 1 354.472 2.941 20 5 FFBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000247643343 510867594 /nfs/dbraw/zinc/86/75/94/510867594.db2.gz OQFHSYQTYHQBBW-WMLDXEAASA-N 1 1 357.414 2.703 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])cc2)C1 ZINC000270726925 510963570 /nfs/dbraw/zinc/96/35/70/510963570.db2.gz BKVKIVYQZLPGTO-ZDUSSCGKSA-N 1 1 357.414 2.813 20 5 FFBDMO Cc1noc([C@H]2CCCC[N@@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000285595060 510970770 /nfs/dbraw/zinc/97/07/70/510970770.db2.gz JIXWTOGIVPPAMY-OAHLLOKOSA-N 1 1 359.386 2.842 20 5 FFBDMO Cc1noc([C@H]2CCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])n1 ZINC000285595060 510970775 /nfs/dbraw/zinc/97/07/75/510970775.db2.gz JIXWTOGIVPPAMY-OAHLLOKOSA-N 1 1 359.386 2.842 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000282428774 510974102 /nfs/dbraw/zinc/97/41/02/510974102.db2.gz JWWZOMVXTZNSCD-ZDUSSCGKSA-N 1 1 359.348 2.811 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000361066458 510988961 /nfs/dbraw/zinc/98/89/61/510988961.db2.gz AJELTLQOJCATDL-UHFFFAOYSA-N 1 1 366.425 2.658 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC000361204184 511012662 /nfs/dbraw/zinc/01/26/62/511012662.db2.gz NCJBCYLTIILBQF-MJGOQNOKSA-N 1 1 357.385 2.838 20 5 FFBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC2(CCOCC2)O1 ZINC000279066517 511018883 /nfs/dbraw/zinc/01/88/83/511018883.db2.gz ABLDQHGAAATZPN-HNNXBMFYSA-N 1 1 350.415 2.634 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000279288557 511032548 /nfs/dbraw/zinc/03/25/48/511032548.db2.gz MDFOMBQMZIJHLJ-KBPBESRZSA-N 1 1 355.797 2.673 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000297711930 511043473 /nfs/dbraw/zinc/04/34/73/511043473.db2.gz NCQZDGJOIKIUTH-RISCZKNCSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000279381559 511063605 /nfs/dbraw/zinc/06/36/05/511063605.db2.gz VAFJGJCBGCYDKB-KOLCDFICSA-N 1 1 355.797 2.671 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H]2CCCC[C@@H]21 ZINC000297802756 511072688 /nfs/dbraw/zinc/07/26/88/511072688.db2.gz HYUZMUFZFQQSIT-HOTGVXAUSA-N 1 1 363.414 2.575 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2ccncn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000361652485 511074915 /nfs/dbraw/zinc/07/49/15/511074915.db2.gz MHVUQRXZZQGWRM-AWEZNQCLSA-N 1 1 355.398 2.593 20 5 FFBDMO NC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000271397125 511190492 /nfs/dbraw/zinc/19/04/92/511190492.db2.gz VALGQBBVAGVOHL-JTQLQIEISA-N 1 1 364.789 2.751 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CCN([C@H]2CCC[C@H]2O)CC1)C1CC1 ZINC000271454074 511210271 /nfs/dbraw/zinc/21/02/71/511210271.db2.gz FAVGCHHYVXISQP-SESVDKBCSA-N 1 1 373.497 2.883 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CCN([C@H]2CCC[C@@H]2O)CC1)C1CC1 ZINC000271454073 511210464 /nfs/dbraw/zinc/21/04/64/511210464.db2.gz FAVGCHHYVXISQP-JBACZVJFSA-N 1 1 373.497 2.883 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000295086472 511278222 /nfs/dbraw/zinc/27/82/22/511278222.db2.gz WEHRWERVOHPAFS-OAHLLOKOSA-N 1 1 361.442 2.748 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959624 511281859 /nfs/dbraw/zinc/28/18/59/511281859.db2.gz YEYKZPVPGPSUAS-DEYYWGMASA-N 1 1 350.415 2.762 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959624 511281864 /nfs/dbraw/zinc/28/18/64/511281864.db2.gz YEYKZPVPGPSUAS-DEYYWGMASA-N 1 1 350.415 2.762 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000271722281 511300544 /nfs/dbraw/zinc/30/05/44/511300544.db2.gz RQXMAFVWIOUPGR-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO COCc1ccccc1CNC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271786137 511324611 /nfs/dbraw/zinc/32/46/11/511324611.db2.gz TWBIDRORUGWFNH-CQSZACIVSA-N 1 1 357.410 2.708 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+](C2CC2)C1 ZINC000295532757 511436813 /nfs/dbraw/zinc/43/68/13/511436813.db2.gz JTDXJORELXNKSC-ZDUSSCGKSA-N 1 1 369.425 2.541 20 5 FFBDMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000292033330 511438871 /nfs/dbraw/zinc/43/88/71/511438871.db2.gz XTPINXZOGLAXEJ-MRXNPFEDSA-N 1 1 365.477 3.000 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000283628527 511441655 /nfs/dbraw/zinc/44/16/55/511441655.db2.gz BIOLIBLHERHIFN-GJYPPUQNSA-N 1 1 354.410 2.682 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)c2cc(C[NH+]3CCCC3)on2)cc1[N+](=O)[O-] ZINC000292127765 511475993 /nfs/dbraw/zinc/47/59/93/511475993.db2.gz NRSVWCSYMRIGSR-CYBMUJFWSA-N 1 1 358.398 2.978 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000299086645 511509864 /nfs/dbraw/zinc/50/98/64/511509864.db2.gz SWHGESNOULEQPW-JKSUJKDBSA-N 1 1 358.442 2.552 20 5 FFBDMO COc1cc(C(=O)NCCCNc2ccc(C)c[nH+]2)c([N+](=O)[O-])cc1F ZINC000295855834 511536511 /nfs/dbraw/zinc/53/65/11/511536511.db2.gz OABSRSZDOSQUOE-UHFFFAOYSA-N 1 1 362.361 2.678 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363416271 511537055 /nfs/dbraw/zinc/53/70/55/511537055.db2.gz BHAQXWSBQOZYKC-SJLPKXTDSA-N 1 1 360.458 2.844 20 5 FFBDMO COc1ccc(C[NH2+][C@H](C)CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000273584435 511541404 /nfs/dbraw/zinc/54/14/04/511541404.db2.gz NKMRMPZDCAPIHF-CYBMUJFWSA-N 1 1 364.423 2.555 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000299222118 511555973 /nfs/dbraw/zinc/55/59/73/511555973.db2.gz IOJFTQSEYZHURT-DOTOQJQBSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000365633340 511571321 /nfs/dbraw/zinc/57/13/21/511571321.db2.gz VHESNDUSEWTSCE-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284060452 511592332 /nfs/dbraw/zinc/59/23/32/511592332.db2.gz QZQZDSCGRVEUCF-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284060452 511592335 /nfs/dbraw/zinc/59/23/35/511592335.db2.gz QZQZDSCGRVEUCF-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO CCn1cc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000296106285 511621707 /nfs/dbraw/zinc/62/17/07/511621707.db2.gz QESXMAXJRJENQV-JTQLQIEISA-N 1 1 351.794 2.754 20 5 FFBDMO Cc1cc(NC2CC[NH+]([C@@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000363663802 511692408 /nfs/dbraw/zinc/69/24/08/511692408.db2.gz GKVXXWNHLGDLEH-MRXNPFEDSA-N 1 1 356.426 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccccn4)CC3)nc2c1 ZINC000274091374 511716897 /nfs/dbraw/zinc/71/68/97/511716897.db2.gz RUJJCHGDFJORFG-UHFFFAOYSA-N 1 1 352.398 2.578 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]2CO1 ZINC000281155709 511740665 /nfs/dbraw/zinc/74/06/65/511740665.db2.gz FTXSFPMKEJQARX-CJNGLKHVSA-N 1 1 357.366 2.785 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000363778444 511762835 /nfs/dbraw/zinc/76/28/35/511762835.db2.gz MYXAMROOEGVPDG-HOCLYGCPSA-N 1 1 354.410 2.881 20 5 FFBDMO C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313072433 511787426 /nfs/dbraw/zinc/78/74/26/511787426.db2.gz VPYPMRJWGUBJNJ-ZBFHGGJFSA-N 1 1 368.437 2.817 20 5 FFBDMO CNc1ccc(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350389707 511799128 /nfs/dbraw/zinc/79/91/28/511799128.db2.gz MDCYXRGYSAKSPY-PBHICJAKSA-N 1 1 359.386 2.612 20 5 FFBDMO COC(=O)[C@@H]1CC12CC[NH+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC2 ZINC000274336356 511799483 /nfs/dbraw/zinc/79/94/83/511799483.db2.gz SMTREPSXEZNIGK-LBPRGKRZSA-N 1 1 352.362 2.518 20 5 FFBDMO C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+](C2CC2)C1 ZINC000296683149 511851848 /nfs/dbraw/zinc/85/18/48/511851848.db2.gz IRLGDIIKDMJVIH-ZDUSSCGKSA-N 1 1 357.414 2.561 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000364053264 511932218 /nfs/dbraw/zinc/93/22/18/511932218.db2.gz GRIDTLDJXYXCTE-HKUYNNGSSA-N 1 1 369.421 2.782 20 5 FFBDMO Cc1cc(F)c(NC(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)cc1[N+](=O)[O-] ZINC000296889519 511938328 /nfs/dbraw/zinc/93/83/28/511938328.db2.gz XAEBJXOJILTJCY-QGZVFWFLSA-N 1 1 350.394 2.992 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ncc([N+](=O)[O-])cc1Br)CC2 ZINC000367640907 512596104 /nfs/dbraw/zinc/59/61/04/512596104.db2.gz AUXXSRZTPJLDRL-UHFFFAOYSA-N 1 1 355.236 2.817 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000375984531 512601631 /nfs/dbraw/zinc/60/16/31/512601631.db2.gz MGKOCZZMQZXYSO-IBGZPJMESA-N 1 1 368.437 2.655 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000375984531 512601633 /nfs/dbraw/zinc/60/16/33/512601633.db2.gz MGKOCZZMQZXYSO-IBGZPJMESA-N 1 1 368.437 2.655 20 5 FFBDMO COC[C@H]1CCCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000372087434 512710221 /nfs/dbraw/zinc/71/02/21/512710221.db2.gz CXUATCJSVLAMHQ-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000372087434 512710224 /nfs/dbraw/zinc/71/02/24/512710224.db2.gz CXUATCJSVLAMHQ-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](n2cc(Cl)cn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000367984368 512751080 /nfs/dbraw/zinc/75/10/80/512751080.db2.gz AZRJIJNNFHOYJQ-HNNXBMFYSA-N 1 1 363.805 2.720 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3C)CC[NH2+]2)cc1 ZINC000374320360 512764714 /nfs/dbraw/zinc/76/47/14/512764714.db2.gz IDSHNRBVUXYSFG-GOSISDBHSA-N 1 1 354.410 2.647 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)c1 ZINC000378491505 512788679 /nfs/dbraw/zinc/78/86/79/512788679.db2.gz GXSVOIRQMMANJA-RDTXWAMCSA-N 1 1 362.405 2.561 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000368071224 512789919 /nfs/dbraw/zinc/78/99/19/512789919.db2.gz TVGZBLYBHYOHIK-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000368071224 512789924 /nfs/dbraw/zinc/78/99/24/512789924.db2.gz TVGZBLYBHYOHIK-INIZCTEOSA-N 1 1 355.822 2.527 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc(=O)[nH]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000378511444 512798533 /nfs/dbraw/zinc/79/85/33/512798533.db2.gz MKONYCXNGYDPKR-UHFFFAOYSA-N 1 1 370.409 2.549 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000374410672 512820450 /nfs/dbraw/zinc/82/04/50/512820450.db2.gz IJTMQHOQSSECKJ-AGIUHOORSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H]([C@H]2CCOC2)C1 ZINC000374410672 512820455 /nfs/dbraw/zinc/82/04/55/512820455.db2.gz IJTMQHOQSSECKJ-AGIUHOORSA-N 1 1 367.833 2.934 20 5 FFBDMO CC(C)(O)C[N@H+]1CCc2c(cccc2NC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000368169592 512829503 /nfs/dbraw/zinc/82/95/03/512829503.db2.gz XJOWOVKFAMCQAT-UHFFFAOYSA-N 1 1 369.421 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC([C@@H]4CCOC4)CC3)n2)cc1 ZINC000368272062 512876048 /nfs/dbraw/zinc/87/60/48/512876048.db2.gz KXHVFNWUGJEXHR-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000382009666 512876607 /nfs/dbraw/zinc/87/66/07/512876607.db2.gz MTXQVNILKBBGJS-CJNGLKHVSA-N 1 1 354.410 2.570 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCc2[nH]c(C(C)C)nc2C1 ZINC000372453327 512883582 /nfs/dbraw/zinc/88/35/82/512883582.db2.gz CGDLZHRCVVRHHT-GFCCVEGCSA-N 1 1 372.425 2.871 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2ccnc(N)n2)C1 ZINC000374553071 512888801 /nfs/dbraw/zinc/88/88/01/512888801.db2.gz VPCVIMMRBFIXLX-ZDUSSCGKSA-N 1 1 357.414 2.576 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]2CCCCN12 ZINC000374591065 512906141 /nfs/dbraw/zinc/90/61/41/512906141.db2.gz FYAFROCLMZSBAP-HOTGVXAUSA-N 1 1 372.450 2.961 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC([C@@H]4CCOC4)CC3)n2)c1 ZINC000374624745 512923324 /nfs/dbraw/zinc/92/33/24/512923324.db2.gz QSHWKVVLLHYMRC-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000412064327 512939876 /nfs/dbraw/zinc/93/98/76/512939876.db2.gz JVCIFIPEDBOPOU-SFHVURJKSA-N 1 1 363.414 2.507 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000412081964 512950579 /nfs/dbraw/zinc/95/05/79/512950579.db2.gz WZMHVSBCBBSTAI-CQSZACIVSA-N 1 1 352.435 2.625 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](Cc3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000368486955 512970680 /nfs/dbraw/zinc/97/06/80/512970680.db2.gz QQBVPLKRRPHBGG-APWZRJJASA-N 1 1 366.421 2.660 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000374821482 513021692 /nfs/dbraw/zinc/02/16/92/513021692.db2.gz CFRKMSDOLNUJGA-OAHLLOKOSA-N 1 1 357.414 2.964 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000408217947 513024099 /nfs/dbraw/zinc/02/40/99/513024099.db2.gz GOKMZJJVMQWLQY-IJEWVQPXSA-N 1 1 367.471 2.621 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000450410390 513182990 /nfs/dbraw/zinc/18/29/90/513182990.db2.gz YVBHDYFBKMGFNB-LBPRGKRZSA-N 1 1 353.382 2.879 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000421417657 513256227 /nfs/dbraw/zinc/25/62/27/513256227.db2.gz HTXKGHBVSPSHDH-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000421417657 513256233 /nfs/dbraw/zinc/25/62/33/513256233.db2.gz HTXKGHBVSPSHDH-UHFFFAOYSA-N 1 1 353.422 3.000 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000434179932 513257261 /nfs/dbraw/zinc/25/72/61/513257261.db2.gz ACJPQMYKJDAQLI-CYBMUJFWSA-N 1 1 351.451 2.826 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429022032 513257402 /nfs/dbraw/zinc/25/74/02/513257402.db2.gz RBXIZWHAVKIKAC-DHSIGJKJSA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044410 513265835 /nfs/dbraw/zinc/26/58/35/513265835.db2.gz UHWNZPVDCTYUHB-SPYBWZPUSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044410 513265842 /nfs/dbraw/zinc/26/58/42/513265842.db2.gz UHWNZPVDCTYUHB-SPYBWZPUSA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429044410 513265847 /nfs/dbraw/zinc/26/58/47/513265847.db2.gz UHWNZPVDCTYUHB-SPYBWZPUSA-N 1 1 374.485 2.894 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@H]3Cc4cccc(O)c4C3)o2)cc1 ZINC000429224970 513309577 /nfs/dbraw/zinc/30/95/77/513309577.db2.gz CJLBYIVRNAILJV-ZDUSSCGKSA-N 1 1 352.350 2.607 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434446855 513325919 /nfs/dbraw/zinc/32/59/19/513325919.db2.gz RGFTXHAOGZUYTH-QGZVFWFLSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434446852 513326423 /nfs/dbraw/zinc/32/64/23/513326423.db2.gz RGFTXHAOGZUYTH-KRWDZBQOSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@H]2CCCN(c3c(C)cccc3[N+](=O)[O-])C2)CC1 ZINC000450777965 513336845 /nfs/dbraw/zinc/33/68/45/513336845.db2.gz SZYQVHOBVVWYLD-GOSISDBHSA-N 1 1 374.485 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H]3Cc4cccc(O)c4C3)n2)cc1 ZINC000429317633 513338590 /nfs/dbraw/zinc/33/85/90/513338590.db2.gz OMWCGRNRFQUQBW-CYBMUJFWSA-N 1 1 352.350 2.607 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@H+]1C ZINC000421711379 513382892 /nfs/dbraw/zinc/38/28/92/513382892.db2.gz ONQPRGNPWHPNSF-LLVKDONJSA-N 1 1 370.247 2.832 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413029550 513394156 /nfs/dbraw/zinc/39/41/56/513394156.db2.gz GIAUFYSXLSXLJO-LBPRGKRZSA-N 1 1 362.352 2.777 20 5 FFBDMO C[C@@H]1CN(c2cccc3cnccc32)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000447383383 513459767 /nfs/dbraw/zinc/45/97/67/513459767.db2.gz KNLDMBDYDGXMKR-OAHLLOKOSA-N 1 1 366.425 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000441198861 513509416 /nfs/dbraw/zinc/50/94/16/513509416.db2.gz CKNMIHOWRKERCW-CABCVRRESA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)n2)c1 ZINC000441197550 513510234 /nfs/dbraw/zinc/51/02/34/513510234.db2.gz AXLDZGXMWAWUJV-CABCVRRESA-N 1 1 358.398 2.893 20 5 FFBDMO C[C@@H](O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)Cc1ccc(Cl)cc1 ZINC000441241249 513518338 /nfs/dbraw/zinc/51/83/38/513518338.db2.gz SEVWBJZAGDCATF-ZIAGYGMSSA-N 1 1 366.849 2.759 20 5 FFBDMO Cc1ccc(N2CCC(Nc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)[nH+]c1 ZINC000447684879 513542472 /nfs/dbraw/zinc/54/24/72/513542472.db2.gz FOBVFLVKMPKMGJ-UHFFFAOYSA-N 1 1 352.398 2.677 20 5 FFBDMO COc1cc(CN2CCC([C@@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435369856 513567510 /nfs/dbraw/zinc/56/75/10/513567510.db2.gz NEJRZHSRACFVMI-LLVKDONJSA-N 1 1 373.400 2.807 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc2c(c1)NC(=O)CO2 ZINC000430192352 513583854 /nfs/dbraw/zinc/58/38/54/513583854.db2.gz BNCLDJIFKXQREE-NSHDSACASA-N 1 1 357.366 2.785 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000430211261 513588067 /nfs/dbraw/zinc/58/80/67/513588067.db2.gz XHOPTXFDWRHADD-IIDMSEBBSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 ZINC000430211261 513588075 /nfs/dbraw/zinc/58/80/75/513588075.db2.gz XHOPTXFDWRHADD-IIDMSEBBSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000416207900 513645333 /nfs/dbraw/zinc/64/53/33/513645333.db2.gz WWKNEKBQOKXPCG-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451298219 513661076 /nfs/dbraw/zinc/66/10/76/513661076.db2.gz VSHXRUJEBKWYDO-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451343682 513689796 /nfs/dbraw/zinc/68/97/96/513689796.db2.gz OSIQADPCXAQWBR-NCXUSEDFSA-N 1 1 373.453 2.716 20 5 FFBDMO CC[C@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000436383807 513843040 /nfs/dbraw/zinc/84/30/40/513843040.db2.gz CQYGDFZZULFUCH-NSHDSACASA-N 1 1 362.352 2.556 20 5 FFBDMO CC[C@H]1CN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000436383807 513843046 /nfs/dbraw/zinc/84/30/46/513843046.db2.gz CQYGDFZZULFUCH-NSHDSACASA-N 1 1 362.352 2.556 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCCC[C@H]1C ZINC000448699172 513852890 /nfs/dbraw/zinc/85/28/90/513852890.db2.gz SMHIYWVZXWZRMW-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@H]4C3)n2)c1 ZINC000451707782 513926767 /nfs/dbraw/zinc/92/67/67/513926767.db2.gz NBZMPBUJMVLERT-IVMMDQJWSA-N 1 1 358.398 2.628 20 5 FFBDMO CN(C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000448963916 513996764 /nfs/dbraw/zinc/99/67/64/513996764.db2.gz UGZLVEKDHBLLFB-LBPRGKRZSA-N 1 1 357.332 2.922 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420344291 514103229 /nfs/dbraw/zinc/10/32/29/514103229.db2.gz SNZJELLNLMEZPY-XHSDSOJGSA-N 1 1 360.458 2.552 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451981009 514108584 /nfs/dbraw/zinc/10/85/84/514108584.db2.gz RUNOMMRMMFRRTK-QGZVFWFLSA-N 1 1 365.455 2.761 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451981009 514108594 /nfs/dbraw/zinc/10/85/94/514108594.db2.gz RUNOMMRMMFRRTK-QGZVFWFLSA-N 1 1 365.455 2.761 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000451984732 514110858 /nfs/dbraw/zinc/11/08/58/514110858.db2.gz VZLMQGBGVMBCEB-KRWDZBQOSA-N 1 1 365.455 2.761 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@]3(CCSC3)C2)c([N+](=O)[O-])c1 ZINC000451984732 514110864 /nfs/dbraw/zinc/11/08/64/514110864.db2.gz VZLMQGBGVMBCEB-KRWDZBQOSA-N 1 1 365.455 2.761 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000420466919 514160455 /nfs/dbraw/zinc/16/04/55/514160455.db2.gz XPTHZCVDLJPTRI-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000444246216 514165834 /nfs/dbraw/zinc/16/58/34/514165834.db2.gz YOIKVBYCHSLHQY-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H](CCO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000444246216 514165844 /nfs/dbraw/zinc/16/58/44/514165844.db2.gz YOIKVBYCHSLHQY-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1c(CC(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000423610328 514181919 /nfs/dbraw/zinc/18/19/19/514181919.db2.gz LUWNFFWAQVQCLA-GOSISDBHSA-N 1 1 357.385 2.758 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420602872 514197214 /nfs/dbraw/zinc/19/72/14/514197214.db2.gz OWQXDYKJQUIUHL-CABCVRRESA-N 1 1 360.458 2.785 20 5 FFBDMO Cc1cc(CNc2c(C(N)=O)cccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000420635732 514210321 /nfs/dbraw/zinc/21/03/21/514210321.db2.gz LTTJXBUBSNPLSD-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO CN(C)C(=O)C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 ZINC000444674738 514289428 /nfs/dbraw/zinc/28/94/28/514289428.db2.gz LFJUCRDJWOOYLO-INIZCTEOSA-N 1 1 367.409 2.780 20 5 FFBDMO C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000432988501 514342439 /nfs/dbraw/zinc/34/24/39/514342439.db2.gz JCSGCQLQUNFEIE-JTQLQIEISA-N 1 1 367.203 2.877 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000427910112 514344608 /nfs/dbraw/zinc/34/46/08/514344608.db2.gz WVUXZQSHUCQPMZ-CVEARBPZSA-N 1 1 354.410 2.517 20 5 FFBDMO O=C(NC[C@@H](c1ccccc1)[NH+]1CCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000427910273 514345121 /nfs/dbraw/zinc/34/51/21/514345121.db2.gz AYKCYFISWPXBRS-SFHVURJKSA-N 1 1 355.394 2.867 20 5 FFBDMO Cn1cc(CNCC[N@H+]2CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449781584 514351727 /nfs/dbraw/zinc/35/17/27/514351727.db2.gz IQSVHIUOHWUHRQ-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO Cn1cc(C[NH2+]CCN2CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449781584 514351736 /nfs/dbraw/zinc/35/17/36/514351736.db2.gz IQSVHIUOHWUHRQ-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420938480 514387684 /nfs/dbraw/zinc/38/76/84/514387684.db2.gz AWYVRSDJBZDBOM-JSGCOSHPSA-N 1 1 362.348 2.999 20 5 FFBDMO CC(C)OC[C@H](CO)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000433144826 514398472 /nfs/dbraw/zinc/39/84/72/514398472.db2.gz DLQHQMJSACDSTE-INIZCTEOSA-N 1 1 363.414 2.510 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000421034562 514449312 /nfs/dbraw/zinc/44/93/12/514449312.db2.gz YSAKRWMPWLRACV-CQSZACIVSA-N 1 1 363.439 2.566 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCn4c[nH+]cc4C3)n2)c2c1NCCC2 ZINC000453233594 514575487 /nfs/dbraw/zinc/57/54/87/514575487.db2.gz HVKWCQOFXGYGNI-NSHDSACASA-N 1 1 366.381 2.929 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000479472499 514597002 /nfs/dbraw/zinc/59/70/02/514597002.db2.gz IFWGGFXNXWTGLM-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CCCC1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461409859 514602289 /nfs/dbraw/zinc/60/22/89/514602289.db2.gz YISYRIZLBYXWSH-KRWDZBQOSA-N 1 1 359.426 2.723 20 5 FFBDMO CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475305354 514610105 /nfs/dbraw/zinc/61/01/05/514610105.db2.gz NPLLDKRTQSZKKE-GOSISDBHSA-N 1 1 353.422 2.870 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000461628635 514675227 /nfs/dbraw/zinc/67/52/27/514675227.db2.gz SNZJWGMPWUNRIC-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470977523 514704393 /nfs/dbraw/zinc/70/43/93/514704393.db2.gz WWDZHLGMIBQDLG-ZBFHGGJFSA-N 1 1 360.458 2.586 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000475578742 514720474 /nfs/dbraw/zinc/72/04/74/514720474.db2.gz CJKPCKBISJMOFD-MRXNPFEDSA-N 1 1 373.409 2.822 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000475578742 514720485 /nfs/dbraw/zinc/72/04/85/514720485.db2.gz CJKPCKBISJMOFD-MRXNPFEDSA-N 1 1 373.409 2.822 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000508344529 514748883 /nfs/dbraw/zinc/74/88/83/514748883.db2.gz QWLLNOZHKWMIGO-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)c2ccc(Cl)cc2)c(F)c1 ZINC000479921939 514777211 /nfs/dbraw/zinc/77/72/11/514777211.db2.gz VCLMBNFQAZOPAO-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[C@H](C)C1 ZINC000484855047 514815910 /nfs/dbraw/zinc/81/59/10/514815910.db2.gz GLUZLZDUXSJTQR-GOEBONIOSA-N 1 1 361.442 2.621 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@@H](C)C1 ZINC000480202534 514878334 /nfs/dbraw/zinc/87/83/34/514878334.db2.gz YKWMZEATXDKHEY-KBPBESRZSA-N 1 1 351.447 2.663 20 5 FFBDMO C[NH+](C)CCCOc1cccc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)c1 ZINC000476034857 514891602 /nfs/dbraw/zinc/89/16/02/514891602.db2.gz QFBVCYBJYSYFLC-UHFFFAOYSA-N 1 1 359.382 2.883 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])nn1C ZINC000476059066 514901908 /nfs/dbraw/zinc/90/19/08/514901908.db2.gz FUZPFNQQSKIUIE-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO COc1c(C(=O)NC2CCN(c3ccc(C)c[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000476138120 514926545 /nfs/dbraw/zinc/92/65/45/514926545.db2.gz FZNDYSDJEMFJAS-UHFFFAOYSA-N 1 1 370.409 2.706 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1 ZINC000498522642 514945366 /nfs/dbraw/zinc/94/53/66/514945366.db2.gz LQYCXJIXLVEMNS-UHFFFAOYSA-N 1 1 362.474 2.977 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H]1C ZINC000498555472 514966183 /nfs/dbraw/zinc/96/61/83/514966183.db2.gz QTCVJEMRQKOVCQ-HZPDHXFCSA-N 1 1 374.485 2.752 20 5 FFBDMO C[C@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485418658 515034077 /nfs/dbraw/zinc/03/40/77/515034077.db2.gz VBQGAGFYWLMKDH-CQSZACIVSA-N 1 1 374.416 2.953 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000476474788 515063199 /nfs/dbraw/zinc/06/31/99/515063199.db2.gz ZWGNJUUNZLUDNM-WBVHZDCISA-N 1 1 355.394 2.779 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000485599295 515106240 /nfs/dbraw/zinc/10/62/40/515106240.db2.gz LXOQHFQAJSXHQI-LLVKDONJSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000485599296 515106873 /nfs/dbraw/zinc/10/68/73/515106873.db2.gz LXOQHFQAJSXHQI-NSHDSACASA-N 1 1 369.368 2.943 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3NC)sc2C1 ZINC000462903945 515292211 /nfs/dbraw/zinc/29/22/11/515292211.db2.gz UFEWWJRTORLPQE-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cccc([N+](=O)[O-])c3NC)sc2C1 ZINC000462903945 515292215 /nfs/dbraw/zinc/29/22/15/515292215.db2.gz UFEWWJRTORLPQE-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000486269624 515410659 /nfs/dbraw/zinc/41/06/59/515410659.db2.gz NAVSUVJIOIHQLH-ZDUSSCGKSA-N 1 1 368.865 2.822 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000486517926 515521830 /nfs/dbraw/zinc/52/18/30/515521830.db2.gz WTKNWHIYZMPCJM-INIZCTEOSA-N 1 1 368.865 2.772 20 5 FFBDMO CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])c(OCC)c2)CC[N@H+]1CCOC ZINC000492718727 515557846 /nfs/dbraw/zinc/55/78/46/515557846.db2.gz BMTRCONAQVWMHJ-KRWDZBQOSA-N 1 1 365.474 2.926 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000500122175 515598304 /nfs/dbraw/zinc/59/83/04/515598304.db2.gz OALMKLUFYQOBMM-NWDGAFQWSA-N 1 1 367.471 2.880 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000457081581 515633699 /nfs/dbraw/zinc/63/36/99/515633699.db2.gz DGAPUWDNYQDLQR-AWEZNQCLSA-N 1 1 351.422 2.953 20 5 FFBDMO O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505759434 515659940 /nfs/dbraw/zinc/65/99/40/515659940.db2.gz ZTZIMMHQKYDILF-SFHVURJKSA-N 1 1 355.394 2.867 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000494006101 515710890 /nfs/dbraw/zinc/71/08/90/515710890.db2.gz GEEPOXXILYVORV-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO CNc1nc(C(=O)NCc2ccccc2C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000454769890 515731253 /nfs/dbraw/zinc/73/12/53/515731253.db2.gz KFLJKEZVCUYPMR-UHFFFAOYSA-N 1 1 371.441 2.802 20 5 FFBDMO C[N@H+](Cc1cccc2[nH]ccc21)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000494104634 515734540 /nfs/dbraw/zinc/73/45/40/515734540.db2.gz DXNAGXKBYCWCBK-INIZCTEOSA-N 1 1 355.394 2.948 20 5 FFBDMO COc1ccccc1N1CC[C@@H]([N@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O ZINC000511074138 515767623 /nfs/dbraw/zinc/76/76/23/515767623.db2.gz SVKRWDOISXGEBE-GOSISDBHSA-N 1 1 369.421 2.883 20 5 FFBDMO COc1ccccc1N1CC[C@@H]([N@@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O ZINC000511074138 515767632 /nfs/dbraw/zinc/76/76/32/515767632.db2.gz SVKRWDOISXGEBE-GOSISDBHSA-N 1 1 369.421 2.883 20 5 FFBDMO CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478383222 515801345 /nfs/dbraw/zinc/80/13/45/515801345.db2.gz JMONFOPDSXUNRH-SFHVURJKSA-N 1 1 370.384 2.662 20 5 FFBDMO C[N@@H+](CCOc1ccc(Br)cc1)CCn1ccc([N+](=O)[O-])n1 ZINC000478421964 515816605 /nfs/dbraw/zinc/81/66/05/515816605.db2.gz BHFILJQJRXYASS-UHFFFAOYSA-N 1 1 369.219 2.565 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000494605301 515895641 /nfs/dbraw/zinc/89/56/41/515895641.db2.gz SMJHQLZCZFJXMU-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO CNc1nc(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000455215787 516046832 /nfs/dbraw/zinc/04/68/32/516046832.db2.gz WGIWGPBHEUJMQR-HZSPNIEDSA-N 1 1 361.446 2.509 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCCOC2)O1 ZINC000483357928 516049485 /nfs/dbraw/zinc/04/94/85/516049485.db2.gz QOFSOYZXHQKIRY-GOSISDBHSA-N 1 1 350.415 2.634 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@H](C)[N@@H+](CC)C[C@@H]1C ZINC000460215056 516071690 /nfs/dbraw/zinc/07/16/90/516071690.db2.gz PXTNQDGXPKFQNH-KBPBESRZSA-N 1 1 358.446 2.792 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000512206928 516198761 /nfs/dbraw/zinc/19/87/61/516198761.db2.gz LCSRXDVDCBILPE-UHFFFAOYSA-N 1 1 374.445 2.600 20 5 FFBDMO Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CCO2 ZINC000512294132 516226338 /nfs/dbraw/zinc/22/63/38/516226338.db2.gz VYSVWHBIQIGBDI-QGZVFWFLSA-N 1 1 358.394 2.538 20 5 FFBDMO Cc1ccc2c(c1)C[N@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CCO2 ZINC000512294132 516226350 /nfs/dbraw/zinc/22/63/50/516226350.db2.gz VYSVWHBIQIGBDI-QGZVFWFLSA-N 1 1 358.394 2.538 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H](OC)[C@@H](OC)C3)o2)c([N+](=O)[O-])c1 ZINC000488549075 516257367 /nfs/dbraw/zinc/25/73/67/516257367.db2.gz VFVKHAQYWAAGGV-HDICACEKSA-N 1 1 362.382 2.709 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1)CC1CC1 ZINC000540031973 516408147 /nfs/dbraw/zinc/40/81/47/516408147.db2.gz BJQDQMXMFFJGGM-UHFFFAOYSA-N 1 1 360.458 2.964 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000557765886 516426689 /nfs/dbraw/zinc/42/66/89/516426689.db2.gz NKKYDBQTHDGYFR-NSHDSACASA-N 1 1 357.252 2.769 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000557877165 516484039 /nfs/dbraw/zinc/48/40/39/516484039.db2.gz AKYCUOJHBRQFFU-HZPDHXFCSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000558025813 516556081 /nfs/dbraw/zinc/55/60/81/516556081.db2.gz PJABPCLXYPXXEH-ZOBUZTSGSA-N 1 1 361.442 2.552 20 5 FFBDMO CCc1ccc([C@H]2CCC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000513400943 516607325 /nfs/dbraw/zinc/60/73/25/516607325.db2.gz IGAWCINNALTFLK-HKUYNNGSSA-N 1 1 358.442 2.594 20 5 FFBDMO CC(=O)NCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccsc1 ZINC000554823267 516652562 /nfs/dbraw/zinc/65/25/62/516652562.db2.gz GDVCVAZDVHHWRM-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO CC(=O)NCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccsc1 ZINC000554823267 516652567 /nfs/dbraw/zinc/65/25/67/516652567.db2.gz GDVCVAZDVHHWRM-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000544240938 516656358 /nfs/dbraw/zinc/65/63/58/516656358.db2.gz TXNUUGRFVJVYRV-MNOVXSKESA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000544240938 516656365 /nfs/dbraw/zinc/65/63/65/516656365.db2.gz TXNUUGRFVJVYRV-MNOVXSKESA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554849180 516661866 /nfs/dbraw/zinc/66/18/66/516661866.db2.gz WOSVXKXRKNJTMX-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO CC[C@@H](C(=O)OC)N1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000554869126 516672839 /nfs/dbraw/zinc/67/28/39/516672839.db2.gz PQBSOKWAXIDXEV-XOVFHRFOSA-N 1 1 361.442 2.567 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@@H](C)C1 ZINC000561762683 516758023 /nfs/dbraw/zinc/75/80/23/516758023.db2.gz PTYKIIXRYKWZSH-OGHNNQOOSA-N 1 1 356.426 2.878 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(CC)CC ZINC000536426736 516759350 /nfs/dbraw/zinc/75/93/50/516759350.db2.gz OYUBRDZAQUSDQY-HZPDHXFCSA-N 1 1 351.447 2.672 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)n1 ZINC000541004454 516826315 /nfs/dbraw/zinc/82/63/15/516826315.db2.gz CBOAXEPLKXDMPR-QGZVFWFLSA-N 1 1 356.426 2.785 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541014509 516830962 /nfs/dbraw/zinc/83/09/62/516830962.db2.gz SNBILQHBBHLWEM-LLVKDONJSA-N 1 1 357.357 2.800 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000544612080 516836950 /nfs/dbraw/zinc/83/69/50/516836950.db2.gz OXYOUQUFKAYBGS-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[nH+]1 ZINC000541036529 516841065 /nfs/dbraw/zinc/84/10/65/516841065.db2.gz NCUHFRCKMDFQHM-UHFFFAOYSA-N 1 1 366.324 2.742 20 5 FFBDMO C[C@@H](C(=O)NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000519062489 516872701 /nfs/dbraw/zinc/87/27/01/516872701.db2.gz YXEGNPXYDUZUNO-OWCLPIDISA-N 1 1 363.458 2.704 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212111 516905090 /nfs/dbraw/zinc/90/50/90/516905090.db2.gz BGRPBSFYODNNDO-LLVKDONJSA-N 1 1 357.357 2.610 20 5 FFBDMO COc1ccccc1[C@@H](C)NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558739774 516922208 /nfs/dbraw/zinc/92/22/08/516922208.db2.gz UNPNGWOLUSZUCF-OAHLLOKOSA-N 1 1 371.437 2.955 20 5 FFBDMO COc1ccccc1[C@@H](C)NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558739774 516922218 /nfs/dbraw/zinc/92/22/18/516922218.db2.gz UNPNGWOLUSZUCF-OAHLLOKOSA-N 1 1 371.437 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000555463076 516935010 /nfs/dbraw/zinc/93/50/10/516935010.db2.gz XQDHSWFMNHBRRS-HDICACEKSA-N 1 1 353.422 2.864 20 5 FFBDMO O=[N+]([O-])c1ccc(O)cc1CN1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000555463076 516935015 /nfs/dbraw/zinc/93/50/15/516935015.db2.gz XQDHSWFMNHBRRS-HDICACEKSA-N 1 1 353.422 2.864 20 5 FFBDMO COc1cc(OCC(=O)Nc2ccc3nc(C)[nH]c3c2)ccc1[N+](=O)[O-] ZINC000532440042 516981769 /nfs/dbraw/zinc/98/17/69/516981769.db2.gz DIRFDJAIXUXGTE-UHFFFAOYSA-N 1 1 356.338 2.806 20 5 FFBDMO COc1ccc(OCC[N@H+](Cc2ccccc2)C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000525274436 516990493 /nfs/dbraw/zinc/99/04/93/516990493.db2.gz KBORMWSIPOZHLJ-OAHLLOKOSA-N 1 1 360.410 2.865 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000551968624 516996212 /nfs/dbraw/zinc/99/62/12/516996212.db2.gz PLJXGHFDTXIEAP-UHFFFAOYSA-N 1 1 370.434 2.573 20 5 FFBDMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1ccc(OCC(F)(F)F)nc1)CC2 ZINC000514691574 517007349 /nfs/dbraw/zinc/00/73/49/517007349.db2.gz JKSTUBYNRIMATP-UHFFFAOYSA-N 1 1 368.315 2.884 20 5 FFBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1ccc(OCC(F)(F)F)nc1)CC2 ZINC000514691574 517007358 /nfs/dbraw/zinc/00/73/58/517007358.db2.gz JKSTUBYNRIMATP-UHFFFAOYSA-N 1 1 368.315 2.884 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000548613458 517087991 /nfs/dbraw/zinc/08/79/91/517087991.db2.gz ZCBOZAWVCYTRRW-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccccc1 ZINC000532707325 517107300 /nfs/dbraw/zinc/10/73/00/517107300.db2.gz WIYPWRLWRZBVQW-HNNXBMFYSA-N 1 1 355.398 2.505 20 5 FFBDMO COc1cc(C[NH2+]C(C)(C)c2cnn(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000545293354 517156882 /nfs/dbraw/zinc/15/68/82/517156882.db2.gz UMZBKPFCZRWVGF-UHFFFAOYSA-N 1 1 370.356 2.963 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000559425464 517248131 /nfs/dbraw/zinc/24/81/31/517248131.db2.gz MHRNVMRQXWUZQV-SFHVURJKSA-N 1 1 360.414 2.875 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000537615559 517259736 /nfs/dbraw/zinc/25/97/36/517259736.db2.gz YEBSVMGZIFETFK-IBGZPJMESA-N 1 1 355.394 2.957 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000537825259 517363309 /nfs/dbraw/zinc/36/33/09/517363309.db2.gz USPXUNHUTAEPOP-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CCC4(CCCCC4)O3)CC2)cn1 ZINC000526964538 517415011 /nfs/dbraw/zinc/41/50/11/517415011.db2.gz GQUZNJGZOQTWRH-QGZVFWFLSA-N 1 1 360.458 2.994 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000520975357 517566441 /nfs/dbraw/zinc/56/64/41/517566441.db2.gz RYRWOCMEBHRTCE-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]([NH2+]Cc1ccccc1)c1ccco1 ZINC000553214995 517580441 /nfs/dbraw/zinc/58/04/41/517580441.db2.gz RHZKZYUCZBKTKC-INIZCTEOSA-N 1 1 368.393 2.787 20 5 FFBDMO O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000546266017 517621420 /nfs/dbraw/zinc/62/14/20/517621420.db2.gz WZNOYFKRSUHBHV-HNNXBMFYSA-N 1 1 370.409 2.891 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000542807053 517754513 /nfs/dbraw/zinc/75/45/13/517754513.db2.gz INOGYJQJGKYLBX-MRXNPFEDSA-N 1 1 363.801 2.987 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCc1c[nH]c3ccc([N+](=O)[O-])cc13)CC2 ZINC000563265223 517779371 /nfs/dbraw/zinc/77/93/71/517779371.db2.gz VRXLFMHRDVIZIG-CQSZACIVSA-N 1 1 367.409 2.502 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000534249419 517805632 /nfs/dbraw/zinc/80/56/32/517805632.db2.gz OVJBCIAYKNNNDE-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)c1c[nH]c2cccc([N+](=O)[O-])c21 ZINC000534249419 517805641 /nfs/dbraw/zinc/80/56/41/517805641.db2.gz OVJBCIAYKNNNDE-UHFFFAOYSA-N 1 1 370.434 2.926 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000563302297 517807061 /nfs/dbraw/zinc/80/70/61/517807061.db2.gz GJHOHUXRCIWTHJ-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)s1)c1cccc([N+](=O)[O-])c1 ZINC000557263282 517940652 /nfs/dbraw/zinc/94/06/52/517940652.db2.gz ZOECSZDWQKSNGJ-LLVKDONJSA-N 1 1 369.468 2.757 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000560744588 518000010 /nfs/dbraw/zinc/00/00/10/518000010.db2.gz PBHOZWWDXVQOGI-ZDUSSCGKSA-N 1 1 367.421 2.618 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](OCc3c(C)noc3C)C2)ccc1[N+](=O)[O-] ZINC000547295064 518063075 /nfs/dbraw/zinc/06/30/75/518063075.db2.gz RZASKNJXEZEICX-HNNXBMFYSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](OCc3c(C)noc3C)C2)ccc1[N+](=O)[O-] ZINC000547295064 518063083 /nfs/dbraw/zinc/06/30/83/518063083.db2.gz RZASKNJXEZEICX-HNNXBMFYSA-N 1 1 361.398 2.999 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC000543436239 518091336 /nfs/dbraw/zinc/09/13/36/518091336.db2.gz NORWCLXHVNEPMG-UHFFFAOYSA-N 1 1 366.381 2.822 20 5 FFBDMO C[N@@H+](CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)Cc1ccccc1 ZINC000534967141 518102370 /nfs/dbraw/zinc/10/23/70/518102370.db2.gz DMAQFJCJCJFMFZ-UHFFFAOYSA-N 1 1 352.394 2.938 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000547421414 518131209 /nfs/dbraw/zinc/13/12/09/518131209.db2.gz DXXOWBCDIGGVOL-QGZVFWFLSA-N 1 1 358.442 2.820 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522828817 518167240 /nfs/dbraw/zinc/16/72/40/518167240.db2.gz MMLNNUNWKKXVOG-KRWDZBQOSA-N 1 1 354.410 2.518 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](CCc2cn[nH]c2)CC1 ZINC000564294346 518382926 /nfs/dbraw/zinc/38/29/26/518382926.db2.gz UPABNFNZAQRQJO-UHFFFAOYSA-N 1 1 369.347 2.701 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000579026172 518486175 /nfs/dbraw/zinc/48/61/75/518486175.db2.gz LYVFFDAPHJETRB-GOSISDBHSA-N 1 1 371.441 2.727 20 5 FFBDMO Cc1c(Br)c(N[C@H]2CCc3c[nH+]cn3C2)ncc1[N+](=O)[O-] ZINC000588067776 518714462 /nfs/dbraw/zinc/71/44/62/518714462.db2.gz PAASGKVEUFRAIJ-VIFPVBQESA-N 1 1 352.192 2.684 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000582859142 518957430 /nfs/dbraw/zinc/95/74/30/518957430.db2.gz SRMPIDWTWDLWAQ-LBPRGKRZSA-N 1 1 374.384 2.842 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1c(F)cccc1Cl ZINC000565476880 518974395 /nfs/dbraw/zinc/97/43/95/518974395.db2.gz YVSDNYGREXAYHC-LLVKDONJSA-N 1 1 354.765 2.917 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000577338972 519028656 /nfs/dbraw/zinc/02/86/56/519028656.db2.gz FKVNDYPICYXYEN-KUHUBIRLSA-N 1 1 369.421 2.904 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000589615736 519043270 /nfs/dbraw/zinc/04/32/70/519043270.db2.gz SQLWLMUCUXSLBS-LBPRGKRZSA-N 1 1 356.854 2.819 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000583057226 519053241 /nfs/dbraw/zinc/05/32/41/519053241.db2.gz LDXZDONIXGXTSP-UWVGGRQHSA-N 1 1 358.345 2.800 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000583057227 519053827 /nfs/dbraw/zinc/05/38/27/519053827.db2.gz LDXZDONIXGXTSP-VHSXEESVSA-N 1 1 358.345 2.800 20 5 FFBDMO CN(C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000565685445 519079779 /nfs/dbraw/zinc/07/97/79/519079779.db2.gz XFGMNILTYRGIHP-NSHDSACASA-N 1 1 357.332 2.922 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000583232106 519140424 /nfs/dbraw/zinc/14/04/24/519140424.db2.gz VAHGXHGJKFEXOL-LLVKDONJSA-N 1 1 357.357 2.909 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000577817211 519268492 /nfs/dbraw/zinc/26/84/92/519268492.db2.gz BQLOOBGJXZKEDJ-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO Cc1nc2ccccn2c(=O)c1CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000580678164 519295842 /nfs/dbraw/zinc/29/58/42/519295842.db2.gz ICCJCTPMVORFJQ-UHFFFAOYSA-N 1 1 364.405 2.512 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCn1cc(Br)cn1 ZINC000569031421 519340532 /nfs/dbraw/zinc/34/05/32/519340532.db2.gz SLINJXWSGXAPFO-UHFFFAOYSA-N 1 1 369.219 2.565 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1)C(N)=O ZINC000590747517 519346332 /nfs/dbraw/zinc/34/63/32/519346332.db2.gz COEHBKHLAAMURM-HNNXBMFYSA-N 1 1 363.458 2.977 20 5 FFBDMO Cc1cc(CNC(=O)NCc2cccc([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000569058388 519351643 /nfs/dbraw/zinc/35/16/43/519351643.db2.gz JLGJTKZLSVXBQH-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@H]2C)cc1OC ZINC000590762377 519355643 /nfs/dbraw/zinc/35/56/43/519355643.db2.gz WIQXFXLIXQKYTB-WOSRLPQWSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@H]2C)cc1OC ZINC000590762377 519355654 /nfs/dbraw/zinc/35/56/54/519355654.db2.gz WIQXFXLIXQKYTB-WOSRLPQWSA-N 1 1 352.431 2.983 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212778 519477167 /nfs/dbraw/zinc/47/71/67/519477167.db2.gz XKUQWNROOHHBDT-CQSZACIVSA-N 1 1 366.425 2.993 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)c1 ZINC000566429321 519488164 /nfs/dbraw/zinc/48/81/64/519488164.db2.gz SNYLECDLDHUMCB-JKSUJKDBSA-N 1 1 357.410 2.527 20 5 FFBDMO Cc1c(Br)c(=O)n(CC[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000566498008 519522033 /nfs/dbraw/zinc/52/20/33/519522033.db2.gz RSKKTOADKZRVJB-PHIMTYICSA-N 1 1 372.263 2.805 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000581141063 519543675 /nfs/dbraw/zinc/54/36/75/519543675.db2.gz UPHDIIGMYOWNSR-OAHLLOKOSA-N 1 1 368.393 2.777 20 5 FFBDMO CO[C@H](C)C[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000581161082 519550540 /nfs/dbraw/zinc/55/05/40/519550540.db2.gz ZDYWDAMBGCASAV-SECBINFHSA-N 1 1 364.183 2.666 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000581213264 519578912 /nfs/dbraw/zinc/57/89/12/519578912.db2.gz YBGNYAITGNVNLH-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)CN(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000581260619 519603231 /nfs/dbraw/zinc/60/32/31/519603231.db2.gz JTOZDDKPEJLFMS-JTQLQIEISA-N 1 1 365.352 2.584 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000591750370 520023429 /nfs/dbraw/zinc/02/34/29/520023429.db2.gz QGCNAHKJMDGHDV-VIFPVBQESA-N 1 1 374.290 2.681 20 5 FFBDMO C[C@]1(CO)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@]1(C)CO ZINC000600204459 520122267 /nfs/dbraw/zinc/12/22/67/520122267.db2.gz PSDXLGGUHTXATR-KDURUIRLSA-N 1 1 360.410 2.668 20 5 FFBDMO CCOc1cc(NC(=O)NCC[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1OCC ZINC000608795341 520132469 /nfs/dbraw/zinc/13/24/69/520132469.db2.gz QMDYUNMOQVYSSQ-UHFFFAOYSA-N 1 1 368.434 2.854 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597606073 520132668 /nfs/dbraw/zinc/13/26/68/520132668.db2.gz UGJOWSRXPGSRPW-OCCSQVGLSA-N 1 1 369.849 2.958 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1Cn1cc(C[NH+]2CCCC2)nn1 ZINC000603242184 520177911 /nfs/dbraw/zinc/17/79/11/520177911.db2.gz ZLPONPWGFBBOAH-UHFFFAOYSA-N 1 1 366.219 2.593 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)C(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132198 520207077 /nfs/dbraw/zinc/20/70/77/520207077.db2.gz BCOYCRCUVGDBNJ-UMVBOHGHSA-N 1 1 362.348 2.624 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)C(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132198 520207084 /nfs/dbraw/zinc/20/70/84/520207084.db2.gz BCOYCRCUVGDBNJ-UMVBOHGHSA-N 1 1 362.348 2.624 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)NCc2ccccc2)C1 ZINC000592155634 520232352 /nfs/dbraw/zinc/23/23/52/520232352.db2.gz RASDWRULICACTF-INIZCTEOSA-N 1 1 369.421 2.742 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000592183117 520250454 /nfs/dbraw/zinc/25/04/54/520250454.db2.gz CYFWGPRXDQOUMT-NHYWBVRUSA-N 1 1 359.348 2.965 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 ZINC000592188895 520254729 /nfs/dbraw/zinc/25/47/29/520254729.db2.gz UWPQXAWUOYXXKM-MSOLQXFVSA-N 1 1 354.410 2.546 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600470964 520278900 /nfs/dbraw/zinc/27/89/00/520278900.db2.gz QGPMQYSPWXFOLQ-LBPRGKRZSA-N 1 1 353.369 2.549 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600470963 520279293 /nfs/dbraw/zinc/27/92/93/520279293.db2.gz QGPMQYSPWXFOLQ-GFCCVEGCSA-N 1 1 353.369 2.549 20 5 FFBDMO C[C@H]1C[N@H+](C)CCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609450196 520317782 /nfs/dbraw/zinc/31/77/82/520317782.db2.gz IQXQSKJDRAMXMV-NSHDSACASA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609450196 520317790 /nfs/dbraw/zinc/31/77/90/520317790.db2.gz IQXQSKJDRAMXMV-NSHDSACASA-N 1 1 374.363 2.578 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000597925400 520326481 /nfs/dbraw/zinc/32/64/81/520326481.db2.gz OMRXELAHDOEVAO-INIZCTEOSA-N 1 1 374.485 2.800 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000609509298 520337012 /nfs/dbraw/zinc/33/70/12/520337012.db2.gz NMUUMCBCYDROIU-RISCZKNCSA-N 1 1 367.833 2.711 20 5 FFBDMO CCN(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597946614 520344639 /nfs/dbraw/zinc/34/46/39/520344639.db2.gz QPKKVLYJOVBYPM-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000609545878 520353480 /nfs/dbraw/zinc/35/34/80/520353480.db2.gz QZCVDDBAURIGFN-AWEZNQCLSA-N 1 1 369.487 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCCOCC(F)(F)F)CC2)s1 ZINC000609560576 520358226 /nfs/dbraw/zinc/35/82/26/520358226.db2.gz PKDIHAYQONPTKS-UHFFFAOYSA-N 1 1 353.366 2.747 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCc3nsc4ccccc34)CC2)cn1 ZINC000595288613 520387818 /nfs/dbraw/zinc/38/78/18/520387818.db2.gz QFGXEQKOGZJUIP-UHFFFAOYSA-N 1 1 369.450 2.964 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609731664 520416372 /nfs/dbraw/zinc/41/63/72/520416372.db2.gz HOWOVHWYTCSVTD-CYBMUJFWSA-N 1 1 369.849 2.817 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609731937 520416432 /nfs/dbraw/zinc/41/64/32/520416432.db2.gz QLADZQFQJRRKLK-LBPRGKRZSA-N 1 1 355.822 2.570 20 5 FFBDMO Cc1noc(C[NH+]2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000595408957 520452114 /nfs/dbraw/zinc/45/21/14/520452114.db2.gz GEADRISCKSQQEY-AWEZNQCLSA-N 1 1 362.430 2.506 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2)C[C@H](C)O1 ZINC000609974879 520494518 /nfs/dbraw/zinc/49/45/18/520494518.db2.gz CFKMHINDMPAFIG-OKILXGFUSA-N 1 1 372.425 2.795 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2)C[C@H](C)O1 ZINC000609974879 520494525 /nfs/dbraw/zinc/49/45/25/520494525.db2.gz CFKMHINDMPAFIG-OKILXGFUSA-N 1 1 372.425 2.795 20 5 FFBDMO CCOc1cc(NC(=O)N[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC ZINC000604230120 520495413 /nfs/dbraw/zinc/49/54/13/520495413.db2.gz SVJBGNIQYHEGND-LBPRGKRZSA-N 1 1 366.418 2.608 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000598220481 520503304 /nfs/dbraw/zinc/50/33/04/520503304.db2.gz PSRPJZQBFHDQMI-LBPRGKRZSA-N 1 1 357.414 2.608 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000598220481 520503305 /nfs/dbraw/zinc/50/33/05/520503305.db2.gz PSRPJZQBFHDQMI-LBPRGKRZSA-N 1 1 357.414 2.608 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000598220481 520503306 /nfs/dbraw/zinc/50/33/06/520503306.db2.gz PSRPJZQBFHDQMI-LBPRGKRZSA-N 1 1 357.414 2.608 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341915 520564175 /nfs/dbraw/zinc/56/41/75/520564175.db2.gz IFQMAXHRPLDISZ-GFCCVEGCSA-N 1 1 357.863 2.941 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000598343161 520566722 /nfs/dbraw/zinc/56/67/22/520566722.db2.gz TWJLOFARBBCURJ-NSHDSACASA-N 1 1 370.247 2.880 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000604472359 520570842 /nfs/dbraw/zinc/57/08/42/520570842.db2.gz SRTKLUGZJMRHNO-INIZCTEOSA-N 1 1 356.426 2.575 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484454 520575539 /nfs/dbraw/zinc/57/55/39/520575539.db2.gz OXEBWQAPJBAMPL-HKUYNNGSSA-N 1 1 358.394 2.877 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](CO)Cc1ccccc1 ZINC000595599819 520582991 /nfs/dbraw/zinc/58/29/91/520582991.db2.gz ZMHVUMRXVFVKKX-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](CO)Cc1ccccc1 ZINC000595599819 520582999 /nfs/dbraw/zinc/58/29/99/520582999.db2.gz ZMHVUMRXVFVKKX-QGZVFWFLSA-N 1 1 368.393 2.680 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000601125233 520649339 /nfs/dbraw/zinc/64/93/39/520649339.db2.gz YPHNCXDQWWCMGL-LLVKDONJSA-N 1 1 361.368 2.515 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cccc2c1OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000601149826 520661721 /nfs/dbraw/zinc/66/17/21/520661721.db2.gz QCBSATYQWHTVRI-IBGZPJMESA-N 1 1 358.394 2.753 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1 ZINC000601157784 520665415 /nfs/dbraw/zinc/66/54/15/520665415.db2.gz FIJJSJOMIXKKLI-UHFFFAOYSA-N 1 1 358.324 2.694 20 5 FFBDMO Cn1ccnc1[C@@H]1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601172931 520671887 /nfs/dbraw/zinc/67/18/87/520671887.db2.gz LRKWYSDGWYVSST-SJCJKPOMSA-N 1 1 353.382 2.631 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598512068 520672351 /nfs/dbraw/zinc/67/23/51/520672351.db2.gz WNFYSZDEKSFVKB-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000598512068 520672359 /nfs/dbraw/zinc/67/23/59/520672359.db2.gz WNFYSZDEKSFVKB-MRXNPFEDSA-N 1 1 355.394 2.608 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000593031406 520695170 /nfs/dbraw/zinc/69/51/70/520695170.db2.gz VZWVNRARLRIRBC-HKUYNNGSSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1 ZINC000593031406 520695173 /nfs/dbraw/zinc/69/51/73/520695173.db2.gz VZWVNRARLRIRBC-HKUYNNGSSA-N 1 1 369.421 2.916 20 5 FFBDMO CC[C@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000593056653 520713846 /nfs/dbraw/zinc/71/38/46/520713846.db2.gz MNXHFGHDZQMWFB-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@@H]1Cc1ccccc1F ZINC000593080088 520729422 /nfs/dbraw/zinc/72/94/22/520729422.db2.gz DUAHSXIPFNYOMW-MRXNPFEDSA-N 1 1 359.401 2.993 20 5 FFBDMO Cc1cc(S(=O)(=O)N2C[C@H](C)[NH2+]Cc3ccccc32)c([N+](=O)[O-])s1 ZINC000601342389 520749160 /nfs/dbraw/zinc/74/91/60/520749160.db2.gz WOXJWJXWXQPRJL-JTQLQIEISA-N 1 1 367.452 2.652 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000595825710 520749594 /nfs/dbraw/zinc/74/95/94/520749594.db2.gz FVCQERGXTLSCMK-RTBURBONSA-N 1 1 371.437 2.545 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)c1 ZINC000595864298 520777251 /nfs/dbraw/zinc/77/72/51/520777251.db2.gz SEQNYZGNVSXFJL-HNNXBMFYSA-N 1 1 373.375 2.645 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CC1=CCSC1 ZINC000595887240 520794241 /nfs/dbraw/zinc/79/42/41/520794241.db2.gz CJIKSKQTEYMOLE-NSHDSACASA-N 1 1 351.428 2.535 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CC1=CCSC1 ZINC000595887240 520794251 /nfs/dbraw/zinc/79/42/51/520794251.db2.gz CJIKSKQTEYMOLE-NSHDSACASA-N 1 1 351.428 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900783 520805275 /nfs/dbraw/zinc/80/52/75/520805275.db2.gz LDZAMUXLZMYIFT-HOCLYGCPSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000593188464 520812459 /nfs/dbraw/zinc/81/24/59/520812459.db2.gz IAVSDAZCYPKBCI-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593320270 520908348 /nfs/dbraw/zinc/90/83/48/520908348.db2.gz CBEIHEJKJHGOSU-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593320270 520908352 /nfs/dbraw/zinc/90/83/52/520908352.db2.gz CBEIHEJKJHGOSU-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593321324 520908486 /nfs/dbraw/zinc/90/84/86/520908486.db2.gz IFFNGXFZDKEFEP-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593321324 520908488 /nfs/dbraw/zinc/90/84/88/520908488.db2.gz IFFNGXFZDKEFEP-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593320269 520908518 /nfs/dbraw/zinc/90/85/18/520908518.db2.gz CBEIHEJKJHGOSU-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593320269 520908523 /nfs/dbraw/zinc/90/85/23/520908523.db2.gz CBEIHEJKJHGOSU-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593321882 520908550 /nfs/dbraw/zinc/90/85/50/520908550.db2.gz JCGLLAHUZRPYRI-SFHVURJKSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593321882 520908554 /nfs/dbraw/zinc/90/85/54/520908554.db2.gz JCGLLAHUZRPYRI-SFHVURJKSA-N 1 1 353.422 2.523 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593467651 521013233 /nfs/dbraw/zinc/01/32/33/521013233.db2.gz CSMXBESHRDNJSU-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070069 521014796 /nfs/dbraw/zinc/01/47/96/521014796.db2.gz JWYAVICKUCSCLR-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CC[N@@H+]2C(C)(C)C)ncc1[N+](=O)[O-] ZINC000596309354 521021278 /nfs/dbraw/zinc/02/12/78/521021278.db2.gz ZIKAXZYBQYSJDY-JTQLQIEISA-N 1 1 357.252 2.767 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CC[N@H+]2C(C)(C)C)ncc1[N+](=O)[O-] ZINC000596309354 521021284 /nfs/dbraw/zinc/02/12/84/521021284.db2.gz ZIKAXZYBQYSJDY-JTQLQIEISA-N 1 1 357.252 2.767 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+]1Cc1ccc(OC)cc1 ZINC000599141180 521050781 /nfs/dbraw/zinc/05/07/81/521050781.db2.gz ZBZMRFKBXMWCSM-HNNXBMFYSA-N 1 1 359.430 2.815 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1Cc1ccc(OC)cc1 ZINC000599141180 521050791 /nfs/dbraw/zinc/05/07/91/521050791.db2.gz ZBZMRFKBXMWCSM-HNNXBMFYSA-N 1 1 359.430 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000596422128 521062386 /nfs/dbraw/zinc/06/23/86/521062386.db2.gz AQBBNCHZRUGIEE-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NCc1ccc(C[N@@H+]3CC[C@@H](O)C3)cc1)CCN2 ZINC000596424586 521065090 /nfs/dbraw/zinc/06/50/90/521065090.db2.gz SRCSDYZLNVEOHK-MRXNPFEDSA-N 1 1 368.437 2.742 20 5 FFBDMO CS(=O)(=O)c1ccc(N[C@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596479009 521092370 /nfs/dbraw/zinc/09/23/70/521092370.db2.gz RNAGXONTKHYTRW-ZDUSSCGKSA-N 1 1 367.471 2.817 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000611339295 521105681 /nfs/dbraw/zinc/10/56/81/521105681.db2.gz PKMVPAHAQHEHQA-IYBDPMFKSA-N 1 1 363.458 2.689 20 5 FFBDMO C[C@@H]1C[N@H+](CCOC2CCN(c3ccccc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000611339295 521105685 /nfs/dbraw/zinc/10/56/85/521105685.db2.gz PKMVPAHAQHEHQA-IYBDPMFKSA-N 1 1 363.458 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CCC([N@H+]4CC[C@H](O)C4)CC3)n2)cc1 ZINC000596539287 521121903 /nfs/dbraw/zinc/12/19/03/521121903.db2.gz OBZXUJRICGASOG-INIZCTEOSA-N 1 1 374.466 2.754 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000596558604 521131069 /nfs/dbraw/zinc/13/10/69/521131069.db2.gz RUEOZYSTKXPPRS-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596569704 521136517 /nfs/dbraw/zinc/13/65/17/521136517.db2.gz CQZXFQLNJGILRT-GFCCVEGCSA-N 1 1 369.263 2.708 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3sccc3[N+](=O)[O-])cc2)CC1 ZINC000611411685 521141552 /nfs/dbraw/zinc/14/15/52/521141552.db2.gz QQDCQQRSJYLPGH-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO COC1(CO)CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000618621293 521149068 /nfs/dbraw/zinc/14/90/68/521149068.db2.gz WGNOQGOXYLJRAD-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO CCN(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@@H+](CC)C1 ZINC000596600814 521158495 /nfs/dbraw/zinc/15/84/95/521158495.db2.gz LGKLWIJRFNJEJU-MRXNPFEDSA-N 1 1 373.457 2.744 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3nnc(N4CCCC4)cc3C2)cc1 ZINC000596619182 521169883 /nfs/dbraw/zinc/16/98/83/521169883.db2.gz SKGYPAVFDJJWGI-UHFFFAOYSA-N 1 1 353.426 2.586 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1Cc1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000611484799 521180890 /nfs/dbraw/zinc/18/08/90/521180890.db2.gz MVFYFVGNAGOUTQ-IBGZPJMESA-N 1 1 366.421 2.539 20 5 FFBDMO COC(=O)c1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000599433183 521219535 /nfs/dbraw/zinc/21/95/35/521219535.db2.gz CTHLXYIJOQDMQC-AWEZNQCLSA-N 1 1 356.382 2.551 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599437759 521223760 /nfs/dbraw/zinc/22/37/60/521223760.db2.gz LXFDJWFJGDSTSG-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[NH+](C2CCC2)CC1 ZINC000611615379 521250586 /nfs/dbraw/zinc/25/05/86/521250586.db2.gz VOHBHRNGUPMTCL-UHFFFAOYSA-N 1 1 355.341 2.507 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)CC2 ZINC000611660716 521269824 /nfs/dbraw/zinc/26/98/24/521269824.db2.gz MEXDQPGPCJUZGQ-UHFFFAOYSA-N 1 1 369.368 2.897 20 5 FFBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(OC)c1 ZINC000599598836 521322505 /nfs/dbraw/zinc/32/25/05/521322505.db2.gz ABMKCOKNRGENFS-NSHDSACASA-N 1 1 359.382 2.562 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2ccc(=O)[nH]n2)cccc1[N+](=O)[O-] ZINC000599642463 521353642 /nfs/dbraw/zinc/35/36/42/521353642.db2.gz VAGMHOWMBUOHKW-MRXNPFEDSA-N 1 1 371.397 2.565 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](OC2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000594026140 521357543 /nfs/dbraw/zinc/35/75/43/521357543.db2.gz DJDOLEAUZGSHSB-KRWDZBQOSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](OC2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000594026140 521357553 /nfs/dbraw/zinc/35/75/53/521357553.db2.gz DJDOLEAUZGSHSB-KRWDZBQOSA-N 1 1 359.426 2.517 20 5 FFBDMO COC(=O)c1csc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000602476192 521365649 /nfs/dbraw/zinc/36/56/49/521365649.db2.gz WDXLQPBJLXAMRA-LBPRGKRZSA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1csc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000602476192 521365659 /nfs/dbraw/zinc/36/56/59/521365659.db2.gz WDXLQPBJLXAMRA-LBPRGKRZSA-N 1 1 362.411 2.524 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccco1 ZINC000602513034 521388208 /nfs/dbraw/zinc/38/82/08/521388208.db2.gz YPUVXOLJGZYTGO-UHFFFAOYSA-N 1 1 357.288 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNC3CC[NH+](Cc4ccncc4)CC3)nc2c1 ZINC000602520220 521391619 /nfs/dbraw/zinc/39/16/19/521391619.db2.gz LGNVEAABVBFDLH-UHFFFAOYSA-N 1 1 367.409 2.885 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632105 521448432 /nfs/dbraw/zinc/44/84/32/521448432.db2.gz VOPBXQDGMXXZJO-LQJRIPTKSA-N 1 1 357.332 2.699 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602632105 521448441 /nfs/dbraw/zinc/44/84/41/521448441.db2.gz VOPBXQDGMXXZJO-LQJRIPTKSA-N 1 1 357.332 2.699 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCc3ccc4cn[nH]c4c3)CC2)cn1 ZINC000602650255 521457973 /nfs/dbraw/zinc/45/79/73/521457973.db2.gz CWXSRPNOYNMISI-UHFFFAOYSA-N 1 1 366.425 2.667 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594198648 521465041 /nfs/dbraw/zinc/46/50/41/521465041.db2.gz UGOKFLHPTHOFOL-HZPDHXFCSA-N 1 1 353.369 2.549 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000594198713 521465092 /nfs/dbraw/zinc/46/50/92/521465092.db2.gz VFPGQRSUYZPBKF-GOEBONIOSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252166 521472265 /nfs/dbraw/zinc/47/22/65/521472265.db2.gz FSSZCBBRBKFPHF-APHBMKBZSA-N 1 1 367.446 2.720 20 5 FFBDMO CN(C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000597093457 521499806 /nfs/dbraw/zinc/49/98/06/521499806.db2.gz VZTVLDMENGHCNT-FOSCPWQOSA-N 1 1 367.837 2.919 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@H+]1C ZINC000599835222 521502400 /nfs/dbraw/zinc/50/24/00/521502400.db2.gz KMODUVPAMWJKDI-KRWDZBQOSA-N 1 1 357.414 2.947 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000602783302 521528961 /nfs/dbraw/zinc/52/89/61/521528961.db2.gz OJYWCKPVCVCCKK-FNODVLLQSA-N 1 1 350.444 2.530 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594284312 521537227 /nfs/dbraw/zinc/53/72/27/521537227.db2.gz VQXCHRPTSIPMBW-FUHWJXTLSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)(C)OC(=O)[C@H](C1CC1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602816124 521550056 /nfs/dbraw/zinc/55/00/56/521550056.db2.gz AGXQYAMTFSGWAM-HNNXBMFYSA-N 1 1 350.419 2.549 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000615835652 521551458 /nfs/dbraw/zinc/55/14/58/521551458.db2.gz XVAUGACNKLJICN-QUHSPFQSSA-N 1 1 358.486 2.710 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC2 ZINC000615835204 521551919 /nfs/dbraw/zinc/55/19/19/521551919.db2.gz ZLUQZPUMJBGGSG-ZROIWOOFSA-N 1 1 354.410 2.633 20 5 FFBDMO CCn1nccc1C[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000597255048 521598060 /nfs/dbraw/zinc/59/80/60/521598060.db2.gz FRKXDUDEINQUTD-UHFFFAOYSA-N 1 1 370.356 2.754 20 5 FFBDMO COc1ccc2c(c1)OCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000619810439 521883674 /nfs/dbraw/zinc/88/36/74/521883674.db2.gz RLGPYUKIQONURM-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc2c(c1)OCC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000619810439 521883680 /nfs/dbraw/zinc/88/36/80/521883680.db2.gz RLGPYUKIQONURM-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO C[C@@H](C[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)(C)C ZINC000619844092 521901205 /nfs/dbraw/zinc/90/12/05/521901205.db2.gz QPMFKOGLGJFZOQ-AWEZNQCLSA-N 1 1 369.487 2.583 20 5 FFBDMO Nc1cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164627834 719083416 /nfs/dbraw/zinc/08/34/16/719083416.db2.gz RBRFFDBINKJHQH-MAUKXSAKSA-N 1 1 353.426 2.673 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637569 719238516 /nfs/dbraw/zinc/23/85/16/719238516.db2.gz WKEHKSUGUMAWMA-RNFRBKRXSA-N 1 1 353.732 2.586 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001164637569 719238518 /nfs/dbraw/zinc/23/85/18/719238518.db2.gz WKEHKSUGUMAWMA-RNFRBKRXSA-N 1 1 353.732 2.586 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[NH+](CCOc3ccccc3)CC2)c1 ZINC001165042490 721952221 /nfs/dbraw/zinc/95/22/21/721952221.db2.gz NFFUPGSYPBYCHH-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(N2CC[NH+](CCc3ccccn3)CC2)nc1Cl ZINC001165053509 722010951 /nfs/dbraw/zinc/01/09/51/722010951.db2.gz ILAOBYPZGUHNNS-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)c(Cl)nc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2 ZINC001164967270 722069685 /nfs/dbraw/zinc/06/96/85/722069685.db2.gz LPIXRUQFPQNBIP-PHIMTYICSA-N 1 1 373.240 2.596 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000154023692 728794231 /nfs/dbraw/zinc/79/42/31/728794231.db2.gz OCWKNYBHFMZISM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000154023692 728794236 /nfs/dbraw/zinc/79/42/36/728794236.db2.gz OCWKNYBHFMZISM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398300 735295653 /nfs/dbraw/zinc/29/56/53/735295653.db2.gz GJKNFXYTMSVZQY-WCQYABFASA-N 1 1 363.439 2.754 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398300 735295654 /nfs/dbraw/zinc/29/56/54/735295654.db2.gz GJKNFXYTMSVZQY-WCQYABFASA-N 1 1 363.439 2.754 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])c(Br)c2)cc[nH+]1 ZINC000112496037 728546112 /nfs/dbraw/zinc/54/61/12/728546112.db2.gz BZBILTWBYYSMOL-UHFFFAOYSA-N 1 1 372.200 2.862 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000130213972 728715914 /nfs/dbraw/zinc/71/59/14/728715914.db2.gz GAZQGQJZHNTSRE-CYBMUJFWSA-N 1 1 357.332 2.828 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCS[C@@H]4COCC[C@@H]43)c2)cc1 ZINC000131059377 728721413 /nfs/dbraw/zinc/72/14/13/728721413.db2.gz ITQKTLFWFMFDHM-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)c2)cc1 ZINC000131059377 728721414 /nfs/dbraw/zinc/72/14/14/728721414.db2.gz ITQKTLFWFMFDHM-DLBZAZTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@H](O)c3ccc(Cl)cc3)C2)nc1 ZINC000173462999 729047722 /nfs/dbraw/zinc/04/77/22/729047722.db2.gz HSMKHPHUIUAFNR-HOCLYGCPSA-N 1 1 362.817 2.863 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000173638896 729051305 /nfs/dbraw/zinc/05/13/05/729051305.db2.gz UCOMXGQWRGVYJA-CQSZACIVSA-N 1 1 368.865 2.993 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174832056 729081243 /nfs/dbraw/zinc/08/12/43/729081243.db2.gz NTWDXWOLEGRLSC-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO CCN1CC[NH+](CCCNc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856723361 730350045 /nfs/dbraw/zinc/35/00/45/730350045.db2.gz OUCHQFOILZZJFY-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000856800461 730358674 /nfs/dbraw/zinc/35/86/74/730358674.db2.gz YRHLBEPRIMBKSM-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C ZINC000860097547 730476070 /nfs/dbraw/zinc/47/60/70/730476070.db2.gz PMPRABNXDOIWDL-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](C)NC(=O)OC(C)(C)C ZINC000860097547 730476071 /nfs/dbraw/zinc/47/60/71/730476071.db2.gz PMPRABNXDOIWDL-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)c1cc(SC)ccc1[N+](=O)[O-] ZINC000861033557 730569135 /nfs/dbraw/zinc/56/91/35/730569135.db2.gz NKBRPUWANRWVAM-LBPRGKRZSA-N 1 1 354.428 2.584 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000863031087 730744460 /nfs/dbraw/zinc/74/44/60/730744460.db2.gz CRCZRSJRMHTKRE-HNNXBMFYSA-N 1 1 353.369 2.820 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)CN1CCN(C)CC1 ZINC000872030847 731722569 /nfs/dbraw/zinc/72/25/69/731722569.db2.gz CQXDEILGHXSOIL-CABCVRRESA-N 1 1 366.531 2.851 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000874839384 732106389 /nfs/dbraw/zinc/10/63/89/732106389.db2.gz VUGGBBUYMZQSCG-KBPBESRZSA-N 1 1 368.231 2.666 20 5 FFBDMO CO[C@H]1C[C@@H]([N@H+](C)Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878602536 732562949 /nfs/dbraw/zinc/56/29/49/732562949.db2.gz XBFMCZNOQKZJHD-PHIMTYICSA-N 1 1 352.778 2.907 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878602536 732562954 /nfs/dbraw/zinc/56/29/54/732562954.db2.gz XBFMCZNOQKZJHD-PHIMTYICSA-N 1 1 352.778 2.907 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000879561705 732724137 /nfs/dbraw/zinc/72/41/37/732724137.db2.gz SLWYFZSPQIARIF-OLZOCXBDSA-N 1 1 365.455 2.617 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000879963045 732810395 /nfs/dbraw/zinc/81/03/95/732810395.db2.gz DBZCZJQITDSPFC-GFCCVEGCSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880145542 732855598 /nfs/dbraw/zinc/85/55/98/732855598.db2.gz NXGYNJICFJDGNS-GHMZBOCLSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880145542 732855600 /nfs/dbraw/zinc/85/56/00/732855600.db2.gz NXGYNJICFJDGNS-GHMZBOCLSA-N 1 1 355.822 2.668 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000880435213 732907563 /nfs/dbraw/zinc/90/75/63/732907563.db2.gz KGUYBUYTQIPRKJ-GXTWGEPZSA-N 1 1 359.220 2.593 20 5 FFBDMO COc1c(O)ccc(CN2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000891745367 734471030 /nfs/dbraw/zinc/47/10/30/734471030.db2.gz HFAGQOCTWUBBRF-UHFFFAOYSA-N 1 1 351.447 2.861 20 5 FFBDMO COc1c(O)ccc(CN2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000891745367 734471031 /nfs/dbraw/zinc/47/10/31/734471031.db2.gz HFAGQOCTWUBBRF-UHFFFAOYSA-N 1 1 351.447 2.861 20 5 FFBDMO C[C@H](C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928092561 738821012 /nfs/dbraw/zinc/82/10/12/738821012.db2.gz SZWPUUGGPHAJCN-XZJROXQQSA-N 1 1 367.446 2.533 20 5 FFBDMO CC(C)[C@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000892534960 734570524 /nfs/dbraw/zinc/57/05/24/734570524.db2.gz BNCOOJZJDCADAH-KRWDZBQOSA-N 1 1 354.882 2.610 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])ccc1OCCO ZINC000892641880 734584341 /nfs/dbraw/zinc/58/43/41/734584341.db2.gz YLPRBOLNOUWIFA-UHFFFAOYSA-N 1 1 366.801 2.918 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000893601815 734725333 /nfs/dbraw/zinc/72/53/33/734725333.db2.gz JLIOJJYXIARYQW-GJZGRUSLSA-N 1 1 352.822 2.626 20 5 FFBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC(C[NH+]2CCOCC2)C1 ZINC000893943862 734775638 /nfs/dbraw/zinc/77/56/38/734775638.db2.gz TYSGSYRDLMFGGX-UHFFFAOYSA-N 1 1 362.817 2.565 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@H]2CCC[N@H+]3CCSC[C@@H]23)s1 ZINC000895570237 735025616 /nfs/dbraw/zinc/02/56/16/735025616.db2.gz RPMCMYZRWRQWEZ-QWRGUYRKSA-N 1 1 351.457 2.591 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000739437469 735051696 /nfs/dbraw/zinc/05/16/96/735051696.db2.gz MJXKHTOALNHBRD-QGZVFWFLSA-N 1 1 364.515 2.866 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)C1CC1 ZINC000895875667 735068049 /nfs/dbraw/zinc/06/80/49/735068049.db2.gz SMJUZTJTLDUKSN-UHFFFAOYSA-N 1 1 350.177 2.865 20 5 FFBDMO CCN1CCC[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C1=O ZINC000896729532 735181628 /nfs/dbraw/zinc/18/16/28/735181628.db2.gz PZKGPZIUQQSJDE-JTQLQIEISA-N 1 1 362.249 2.519 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000755032025 736228112 /nfs/dbraw/zinc/22/81/12/736228112.db2.gz VSWWZQHQZMGIBL-SNVBAGLBSA-N 1 1 371.235 2.915 20 5 FFBDMO Cc1cc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cnc1Cl ZINC000757955203 736439644 /nfs/dbraw/zinc/43/96/44/736439644.db2.gz DAAATIQXGXYWBY-UHFFFAOYSA-N 1 1 369.830 2.515 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000906939491 736562706 /nfs/dbraw/zinc/56/27/06/736562706.db2.gz DCYFEJVQROUMRH-DGCLKSJQSA-N 1 1 351.834 2.922 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760874715 736676465 /nfs/dbraw/zinc/67/64/65/736676465.db2.gz ZFEHTEQBSXZQSV-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507844 736741213 /nfs/dbraw/zinc/74/12/13/736741213.db2.gz ZDAUBYQAZIHWLU-JSGCOSHPSA-N 1 1 369.849 2.611 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC000766557948 737241919 /nfs/dbraw/zinc/24/19/19/737241919.db2.gz WYPLRSMUTRQNOJ-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000768100854 737397916 /nfs/dbraw/zinc/39/79/16/737397916.db2.gz DFSOZXIAKWMJTG-OAGGEKHMSA-N 1 1 365.499 2.918 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000768100854 737397919 /nfs/dbraw/zinc/39/79/19/737397919.db2.gz DFSOZXIAKWMJTG-OAGGEKHMSA-N 1 1 365.499 2.918 20 5 FFBDMO O=C1OC[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000769483189 737534585 /nfs/dbraw/zinc/53/45/85/737534585.db2.gz GVQYZHQSXZGNGO-AWEZNQCLSA-N 1 1 359.407 2.960 20 5 FFBDMO O=C1OC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000769483189 737534588 /nfs/dbraw/zinc/53/45/88/737534588.db2.gz GVQYZHQSXZGNGO-AWEZNQCLSA-N 1 1 359.407 2.960 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000921806126 738047821 /nfs/dbraw/zinc/04/78/21/738047821.db2.gz IYJPYGBXHDGTAL-JGGQBBKZSA-N 1 1 364.471 2.535 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879940 738134943 /nfs/dbraw/zinc/13/49/43/738134943.db2.gz MGIHIWQYJBXFGN-STQMWFEESA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879940 738134946 /nfs/dbraw/zinc/13/49/46/738134946.db2.gz MGIHIWQYJBXFGN-STQMWFEESA-N 1 1 356.806 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(CN2CCC3(CC[NH2+]C3)CC2)c1 ZINC000923358126 738275193 /nfs/dbraw/zinc/27/51/93/738275193.db2.gz DDCCXPKEJSRGHE-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)[C@@H]2C1 ZINC000930767461 739159849 /nfs/dbraw/zinc/15/98/49/739159849.db2.gz GOKOQHWBMVSXDQ-TVQRCGJNSA-N 1 1 358.320 2.781 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000931335582 739247372 /nfs/dbraw/zinc/24/73/72/739247372.db2.gz XYGKAMFIFBCQKM-ZANVPECISA-N 1 1 369.219 2.525 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c([N+](=O)[O-])c1 ZINC000931915142 739352400 /nfs/dbraw/zinc/35/24/00/739352400.db2.gz UXDWQKJSDWTYJZ-ZDUSSCGKSA-N 1 1 361.295 2.560 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c([N+](=O)[O-])c1 ZINC000931915142 739352403 /nfs/dbraw/zinc/35/24/03/739352403.db2.gz UXDWQKJSDWTYJZ-ZDUSSCGKSA-N 1 1 361.295 2.560 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000790270648 739431347 /nfs/dbraw/zinc/43/13/47/739431347.db2.gz CQXNGUPSFIQIGW-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)s1 ZINC000932662380 739486711 /nfs/dbraw/zinc/48/67/11/739486711.db2.gz AOTXKXFKNJMRCG-SNVBAGLBSA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)s1 ZINC000932662380 739486712 /nfs/dbraw/zinc/48/67/12/739486712.db2.gz AOTXKXFKNJMRCG-SNVBAGLBSA-N 1 1 365.386 2.967 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000933715743 739678213 /nfs/dbraw/zinc/67/82/13/739678213.db2.gz NHRNHTMBMIORPA-SECBINFHSA-N 1 1 357.292 2.690 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000933715743 739678214 /nfs/dbraw/zinc/67/82/14/739678214.db2.gz NHRNHTMBMIORPA-SECBINFHSA-N 1 1 357.292 2.690 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934331825 739766793 /nfs/dbraw/zinc/76/67/93/739766793.db2.gz FRJZFJRVPHRMIU-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934331825 739766795 /nfs/dbraw/zinc/76/67/95/739766795.db2.gz FRJZFJRVPHRMIU-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934337317 739769277 /nfs/dbraw/zinc/76/92/77/739769277.db2.gz VVQBOZWHLDKCNF-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934337317 739769282 /nfs/dbraw/zinc/76/92/82/739769282.db2.gz VVQBOZWHLDKCNF-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO CN(C)[S@@](C)(=O)=NCC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000934751675 739832605 /nfs/dbraw/zinc/83/26/05/739832605.db2.gz ZZJORGCHPSOAIP-VWLOTQADSA-N 1 1 372.466 2.520 20 5 FFBDMO O=C(C[N@@H+]1CCOC[C@H](C2CCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000795288222 739997361 /nfs/dbraw/zinc/99/73/61/739997361.db2.gz HSBMFVYQRASZCD-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCOC[C@H](C2CCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000795288222 739997365 /nfs/dbraw/zinc/99/73/65/739997365.db2.gz HSBMFVYQRASZCD-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+]1CCCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804341769 740862117 /nfs/dbraw/zinc/86/21/17/740862117.db2.gz JRXMPZAMVVINAK-UHFFFAOYSA-N 1 1 368.865 2.629 20 5 FFBDMO CCN(CC)C(=O)C[N@H+]1CCCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804341769 740862119 /nfs/dbraw/zinc/86/21/19/740862119.db2.gz JRXMPZAMVVINAK-UHFFFAOYSA-N 1 1 368.865 2.629 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000809965215 741367478 /nfs/dbraw/zinc/36/74/78/741367478.db2.gz BBHDBFQGKYSDHA-ZDUSSCGKSA-N 1 1 360.241 2.808 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)C12CCCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000814667907 741855483 /nfs/dbraw/zinc/85/54/83/741855483.db2.gz UHVOCVTWOPQSJG-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO CCO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1n1cccn1 ZINC000815166953 741908318 /nfs/dbraw/zinc/90/83/18/741908318.db2.gz MXJVTHFXULKJHC-XHSDSOJGSA-N 1 1 350.806 2.953 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCO1 ZINC000815314223 741924500 /nfs/dbraw/zinc/92/45/00/741924500.db2.gz KLONPZJWRQQQBZ-INIZCTEOSA-N 1 1 353.394 2.809 20 5 FFBDMO C[N@H+](Cc1cccc(Cl)c1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964445 742824064 /nfs/dbraw/zinc/82/40/64/742824064.db2.gz IYQWTPSHYVNKJH-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@@H+](Cc1cccc(Cl)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964445 742824070 /nfs/dbraw/zinc/82/40/70/742824070.db2.gz IYQWTPSHYVNKJH-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@H+](Cc1cccc(Cl)c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964445 742824076 /nfs/dbraw/zinc/82/40/76/742824076.db2.gz IYQWTPSHYVNKJH-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccc(F)c2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034642339 742927356 /nfs/dbraw/zinc/92/73/56/742927356.db2.gz AZLIVVJFAFCPDL-RGCMKSIDSA-N 1 1 369.824 2.661 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000832142719 745644946 /nfs/dbraw/zinc/64/49/46/745644946.db2.gz YJWMCCCGOVVGEJ-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000832142719 745644950 /nfs/dbraw/zinc/64/49/50/745644950.db2.gz YJWMCCCGOVVGEJ-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCN(CC(F)(F)F)CC1 ZINC000832625341 745728613 /nfs/dbraw/zinc/72/86/13/745728613.db2.gz TZLUQDUZPLBGEP-HNNXBMFYSA-N 1 1 361.364 2.587 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000839502982 746841840 /nfs/dbraw/zinc/84/18/40/746841840.db2.gz IPAACYYQYLAQAY-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839584241 746863417 /nfs/dbraw/zinc/86/34/17/746863417.db2.gz RWTLVEKAWLIINE-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839584241 746863423 /nfs/dbraw/zinc/86/34/23/746863423.db2.gz RWTLVEKAWLIINE-INIZCTEOSA-N 1 1 355.822 2.814 20 5 FFBDMO COC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)[C@H]1CCCO1 ZINC000839589580 746864996 /nfs/dbraw/zinc/86/49/96/746864996.db2.gz HWELQJXWZBIQRZ-WCQYABFASA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000842163625 747536920 /nfs/dbraw/zinc/53/69/20/747536920.db2.gz QNUDVEZYRRAZIE-WDEREUQCSA-N 1 1 362.257 2.789 20 5 FFBDMO C[C@@H](CO)C1CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000844416410 748025205 /nfs/dbraw/zinc/02/52/05/748025205.db2.gz OEVBPZBHDYJYHE-NSHDSACASA-N 1 1 355.822 2.527 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[N@@H+](C)C(C)(C)C1 ZINC000846891743 748567633 /nfs/dbraw/zinc/56/76/33/748567633.db2.gz KRUBFSYOZHSADQ-LLVKDONJSA-N 1 1 354.838 2.601 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000848482172 748938103 /nfs/dbraw/zinc/93/81/03/748938103.db2.gz LDPIZVYBQNXNCJ-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000848482172 748938111 /nfs/dbraw/zinc/93/81/11/748938111.db2.gz LDPIZVYBQNXNCJ-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO COc1cc(CO[NH+]=C(N)[C@H]2C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000848523086 748949220 /nfs/dbraw/zinc/94/92/20/748949220.db2.gz ZOPQIFZNHDPSLD-SCZZXKLOSA-N 1 1 359.329 2.902 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851753527 749661512 /nfs/dbraw/zinc/66/15/12/749661512.db2.gz XZGGPSROGPKTOM-LBPRGKRZSA-N 1 1 354.407 2.580 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851753527 749661518 /nfs/dbraw/zinc/66/15/18/749661518.db2.gz XZGGPSROGPKTOM-LBPRGKRZSA-N 1 1 354.407 2.580 20 5 FFBDMO Cn1cc([C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000852074054 749767696 /nfs/dbraw/zinc/76/76/96/749767696.db2.gz PQBWKRWBJMVBOY-INIZCTEOSA-N 1 1 364.833 2.975 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CCO ZINC000852455084 749863365 /nfs/dbraw/zinc/86/33/65/749863365.db2.gz DMQMQMAVTHEEAA-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1CCO ZINC000852455084 749863370 /nfs/dbraw/zinc/86/33/70/749863370.db2.gz DMQMQMAVTHEEAA-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H](O)CC3(CCOCC3)C2)c1 ZINC000895721876 970891460 /nfs/dbraw/zinc/89/14/60/970891460.db2.gz MYMCNDWRPUSILN-AWEZNQCLSA-N 1 1 372.368 2.560 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@@H](O)CC3(CCOCC3)C2)c1 ZINC000895721876 970891468 /nfs/dbraw/zinc/89/14/68/970891468.db2.gz MYMCNDWRPUSILN-AWEZNQCLSA-N 1 1 372.368 2.560 20 5 FFBDMO CC(C)([C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(F)c(F)c1)[NH+]1CCCC1 ZINC000840415421 971265391 /nfs/dbraw/zinc/26/53/91/971265391.db2.gz IEAAKVIYGJWAQY-DAXOMENPSA-N 1 1 367.396 2.662 20 5 FFBDMO CC(C)([C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(F)c(F)c1)[NH+]1CCCC1 ZINC000840415425 971267819 /nfs/dbraw/zinc/26/78/19/971267819.db2.gz IEAAKVIYGJWAQY-WQVCFCJDSA-N 1 1 367.396 2.662 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)c([N+](=O)[O-])cc1OC ZINC000896492281 971510153 /nfs/dbraw/zinc/51/01/53/971510153.db2.gz OEVHISQNWTVWIL-CYBMUJFWSA-N 1 1 360.414 2.725 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000134886665 960093277 /nfs/dbraw/zinc/09/32/77/960093277.db2.gz ZJZYVWCVHAPDSK-XJKSGUPXSA-N 1 1 354.410 2.691 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872274725 1013195998 /nfs/dbraw/zinc/19/59/98/1013195998.db2.gz APKZNZULFQRJTK-WMZOPIPTSA-N 1 1 364.442 2.758 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Cc2nccs2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934334641 966292750 /nfs/dbraw/zinc/29/27/50/966292750.db2.gz DPEMISRPGBFEQH-CYBMUJFWSA-N 1 1 372.450 2.505 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Cc2nccs2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934334641 966292755 /nfs/dbraw/zinc/29/27/55/966292755.db2.gz DPEMISRPGBFEQH-CYBMUJFWSA-N 1 1 372.450 2.505 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2COc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001176531626 1013723040 /nfs/dbraw/zinc/72/30/40/1013723040.db2.gz BRXCMAHTNMVIPE-INIZCTEOSA-N 1 1 373.384 2.876 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[N@H+]1C1CC1 ZINC000177132674 969060746 /nfs/dbraw/zinc/06/07/46/969060746.db2.gz DIXHNCBAMZVSOI-LSDHHAIUSA-N 1 1 372.469 2.940 20 5 FFBDMO O=C(NCC[N@@H+](Cc1cc2ccccc2s1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001481169810 970299283 /nfs/dbraw/zinc/29/92/83/970299283.db2.gz YIAKKOXGENNCDS-HZPDHXFCSA-N 1 1 359.451 2.647 20 5 FFBDMO O=C(NCC[N@H+](Cc1cc2ccccc2s1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001481169810 970299289 /nfs/dbraw/zinc/29/92/89/970299289.db2.gz YIAKKOXGENNCDS-HZPDHXFCSA-N 1 1 359.451 2.647 20 5 FFBDMO O=C(NCC[N@@H+](Cc1cc2ccccc2s1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001481169810 970299292 /nfs/dbraw/zinc/29/92/92/970299292.db2.gz YIAKKOXGENNCDS-HZPDHXFCSA-N 1 1 359.451 2.647 20 5 FFBDMO O=C1N[C@@H](C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3OC(F)F)CC2)CO1 ZINC000897027955 973162304 /nfs/dbraw/zinc/16/23/04/973162304.db2.gz VPXDBWUGFPKUJD-CYBMUJFWSA-N 1 1 371.340 2.517 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192752119 975626006 /nfs/dbraw/zinc/62/60/06/975626006.db2.gz ZEINMMLMDHDSRH-ZBFHGGJFSA-N 1 1 369.421 2.996 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(F)c1 ZINC000876873084 1014407132 /nfs/dbraw/zinc/40/71/32/1014407132.db2.gz VLWMPLVHEHGFEQ-DQPZFDDXSA-N 1 1 370.388 2.747 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CCCCC(F)(F)F)CC1 ZINC001481998392 977905629 /nfs/dbraw/zinc/90/56/29/977905629.db2.gz UXRGSQBYSUDSPS-ZIAGYGMSSA-N 1 1 365.396 2.603 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126244638 977998312 /nfs/dbraw/zinc/99/83/12/977998312.db2.gz OPTXAPGLTMZHHX-LLVKDONJSA-N 1 1 364.402 2.724 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000905678737 980487536 /nfs/dbraw/zinc/48/75/36/980487536.db2.gz QDULSDYNOOHLIO-ZDUSSCGKSA-N 1 1 373.310 2.972 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@]3(CC(F)(F)C3(F)F)C2)c2ncc([N+](=O)[O-])cc12 ZINC000905678737 980487539 /nfs/dbraw/zinc/48/75/39/980487539.db2.gz QDULSDYNOOHLIO-ZDUSSCGKSA-N 1 1 373.310 2.972 20 5 FFBDMO COc1ccc(CN[C@H]2C[C@H]([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000906518518 980674828 /nfs/dbraw/zinc/67/48/28/980674828.db2.gz ZHUJXHQUZUTLCE-WKILWMFISA-N 1 1 357.410 2.762 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687739 1014679834 /nfs/dbraw/zinc/67/98/34/1014679834.db2.gz LLVDIZIDJPNMAV-ROUUACIJSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687739 1014679839 /nfs/dbraw/zinc/67/98/39/1014679839.db2.gz LLVDIZIDJPNMAV-ROUUACIJSA-N 1 1 354.410 2.599 20 5 FFBDMO COc1cc(C[NH2+]Cc2cnn(CC3CCC3)c2)c([N+](=O)[O-])cc1OC ZINC000897433514 980780817 /nfs/dbraw/zinc/78/08/17/980780817.db2.gz YAFAKMOCLGOZMC-UHFFFAOYSA-N 1 1 360.414 2.898 20 5 FFBDMO Nc1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc2ccccc2c1[N+](=O)[O-] ZINC000907789954 981294378 /nfs/dbraw/zinc/29/43/78/981294378.db2.gz MPKOVUJBALDRFU-JKSUJKDBSA-N 1 1 372.400 2.589 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000878163347 1014893723 /nfs/dbraw/zinc/89/37/23/1014893723.db2.gz QJLAMHGXSSYYLS-UONOGXRCSA-N 1 1 359.430 2.949 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878259046 1014953377 /nfs/dbraw/zinc/95/33/77/1014953377.db2.gz XYNQIUFVOSGHPH-ZFWWWQNUSA-N 1 1 359.430 2.807 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@@H]21 ZINC000878351592 1014997745 /nfs/dbraw/zinc/99/77/45/1014997745.db2.gz SIZLKAVLBYDZKN-MFKMUULPSA-N 1 1 370.356 2.754 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC([C@H]3CCOC3)CC2)o1 ZINC000878402945 1015026763 /nfs/dbraw/zinc/02/67/63/1015026763.db2.gz SJLMMEOGZKAWRD-AWEZNQCLSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000157922843 984704806 /nfs/dbraw/zinc/70/48/06/984704806.db2.gz FAAFPBCWOMPSSE-WOJBJXKFSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000157922843 984704812 /nfs/dbraw/zinc/70/48/12/984704812.db2.gz FAAFPBCWOMPSSE-WOJBJXKFSA-N 1 1 356.422 2.962 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123198 984969241 /nfs/dbraw/zinc/96/92/41/984969241.db2.gz HLDMTKPPCNBRGJ-HZPDHXFCSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123198 984969248 /nfs/dbraw/zinc/96/92/48/984969248.db2.gz HLDMTKPPCNBRGJ-HZPDHXFCSA-N 1 1 363.414 2.986 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000765795038 985859810 /nfs/dbraw/zinc/85/98/10/985859810.db2.gz DQUPNFUDPUDLQT-QGZVFWFLSA-N 1 1 372.469 2.942 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000193980884 989124029 /nfs/dbraw/zinc/12/40/29/989124029.db2.gz HVZPYPCJSUWIFC-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000194334710 989212081 /nfs/dbraw/zinc/21/20/81/989212081.db2.gz ZHSYWNWDRDFVTL-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154264435 990111071 /nfs/dbraw/zinc/11/10/71/990111071.db2.gz GBAXXMSLKISJGD-PBHICJAKSA-N 1 1 363.458 2.503 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1 ZINC000195447283 990942664 /nfs/dbraw/zinc/94/26/64/990942664.db2.gz WCNAXSIALRUDED-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])c(F)c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000711789540 991168634 /nfs/dbraw/zinc/16/86/34/991168634.db2.gz QFLBRBLAGILZAT-HXUWFJFHSA-N 1 1 373.428 2.803 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2cc(F)cc(F)c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001485450498 991943474 /nfs/dbraw/zinc/94/34/74/991943474.db2.gz CESZEJARAUTZDQ-HZPDHXFCSA-N 1 1 367.396 2.539 20 5 FFBDMO Cc1nn(CN2CCC[N@H+](C3CCCC3)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749956627 992196249 /nfs/dbraw/zinc/19/62/49/992196249.db2.gz YDHIHLOVONTMNL-UHFFFAOYSA-N 1 1 358.446 2.556 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000747648455 994967377 /nfs/dbraw/zinc/96/73/77/994967377.db2.gz IGYDXBZNYWYWMY-LJQANCHMSA-N 1 1 372.469 2.650 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001132801140 995144218 /nfs/dbraw/zinc/14/42/18/995144218.db2.gz JVPGUTLUPTXHAX-HLLBOEOZSA-N 1 1 374.485 2.901 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC001133014939 995256076 /nfs/dbraw/zinc/25/60/76/995256076.db2.gz PTILXJQQPVWTFJ-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812851782 995554032 /nfs/dbraw/zinc/55/40/32/995554032.db2.gz ZAOFRHXBPWJBEL-SYNHAJSKSA-N 1 1 374.437 2.779 20 5 FFBDMO Cc1cc(C)c(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(=O)[nH]1 ZINC000813170544 995632155 /nfs/dbraw/zinc/63/21/55/995632155.db2.gz HLYUOFYYOSJKLD-INIZCTEOSA-N 1 1 371.393 2.744 20 5 FFBDMO Cc1cc(C)c(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(=O)[nH]1 ZINC000813170544 995632161 /nfs/dbraw/zinc/63/21/61/995632161.db2.gz HLYUOFYYOSJKLD-INIZCTEOSA-N 1 1 371.393 2.744 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)OCc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000727747502 995939911 /nfs/dbraw/zinc/93/99/11/995939911.db2.gz XRLYJYUBAIREBZ-LJQANCHMSA-N 1 1 369.421 2.627 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1CC3(CCC3)C1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264989 1015996080 /nfs/dbraw/zinc/99/60/80/1015996080.db2.gz YPMNKKCZRXTUQK-RTBURBONSA-N 1 1 369.465 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CC1CC3(CCC3)C1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264989 1015996087 /nfs/dbraw/zinc/99/60/87/1015996087.db2.gz YPMNKKCZRXTUQK-RTBURBONSA-N 1 1 369.465 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CC1CC3(CCC3)C1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264989 1015996092 /nfs/dbraw/zinc/99/60/92/1015996092.db2.gz YPMNKKCZRXTUQK-RTBURBONSA-N 1 1 369.465 2.864 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC001143982580 997895354 /nfs/dbraw/zinc/89/53/54/997895354.db2.gz UEIQWZJAOCBROY-TXEJJXNPSA-N 1 1 367.471 2.880 20 5 FFBDMO C[C@@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)[C@H]1CCNC(=O)OC(C)(C)C ZINC000844731418 998129480 /nfs/dbraw/zinc/12/94/80/998129480.db2.gz SMQQXUYJECAUBL-HIFRSBDPSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)[C@H]1CCNC(=O)OC(C)(C)C ZINC000844731418 998129489 /nfs/dbraw/zinc/12/94/89/998129489.db2.gz SMQQXUYJECAUBL-HIFRSBDPSA-N 1 1 367.450 2.764 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)[C@H]1CCCO1 ZINC001119856257 998359977 /nfs/dbraw/zinc/35/99/77/998359977.db2.gz PGVSTCNUTUTPOY-ZIAGYGMSSA-N 1 1 359.220 2.641 20 5 FFBDMO Cc1cccc(C)c1C[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001000154956 1016249679 /nfs/dbraw/zinc/24/96/79/1016249679.db2.gz PZNWBJPLECIBBO-IEBWSBKVSA-N 1 1 371.481 2.829 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c(C)c1 ZINC001000152317 1016247665 /nfs/dbraw/zinc/24/76/65/1016247665.db2.gz CWVZJMXJZBWKKL-RTBURBONSA-N 1 1 371.481 2.829 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000733301988 998951098 /nfs/dbraw/zinc/95/10/98/998951098.db2.gz FYEQBDLHSHKHFI-CQSZACIVSA-N 1 1 366.418 2.980 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1CN[C@@]1(CO)CCC[N@@H+](Cc2ccccc2)C1 ZINC000734000831 999169807 /nfs/dbraw/zinc/16/98/07/999169807.db2.gz XXNKLPMJOPNEAN-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@]1(CO)CCCN(Cc2ccccc2)C1 ZINC000734000831 999169810 /nfs/dbraw/zinc/16/98/10/999169810.db2.gz XXNKLPMJOPNEAN-FQEVSTJZSA-N 1 1 373.428 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@@H](n4ccnc4)C3)c2)cc1 ZINC000738159231 999621992 /nfs/dbraw/zinc/62/19/92/999621992.db2.gz REGVOSDXTUMUKO-GOSISDBHSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H](n4ccnc4)C3)c2)cc1 ZINC000738159231 999621995 /nfs/dbraw/zinc/62/19/95/999621995.db2.gz REGVOSDXTUMUKO-GOSISDBHSA-N 1 1 352.398 2.949 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1CCCCCC1 ZINC000741031285 999701340 /nfs/dbraw/zinc/70/13/40/999701340.db2.gz OJTBGVFKPKYDGU-CYBMUJFWSA-N 1 1 374.397 2.953 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153631 999761928 /nfs/dbraw/zinc/76/19/28/999761928.db2.gz RFNIHZPWTIBTSA-JKSUJKDBSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153631 999761930 /nfs/dbraw/zinc/76/19/30/999761930.db2.gz RFNIHZPWTIBTSA-JKSUJKDBSA-N 1 1 359.430 2.946 20 5 FFBDMO CCc1cc(NCC[N@H+]2CCC[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000742424717 999773542 /nfs/dbraw/zinc/77/35/42/999773542.db2.gz CEIFXBNIRQUXNO-AWEZNQCLSA-N 1 1 355.442 2.932 20 5 FFBDMO Cc1c(C(=O)NCCn2cc[nH+]c2C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000744400098 999855152 /nfs/dbraw/zinc/85/51/52/999855152.db2.gz GVHHJCKYPYRQDZ-UHFFFAOYSA-N 1 1 361.358 2.561 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011965 1000015623 /nfs/dbraw/zinc/01/56/23/1000015623.db2.gz NYYQCMDXDIIWTO-LVQVYYBASA-N 1 1 353.463 2.621 20 5 FFBDMO CCOC(=O)C[N@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038239 1000016599 /nfs/dbraw/zinc/01/65/99/1000016599.db2.gz XIBAIIKFMDZTGD-CVEARBPZSA-N 1 1 350.415 2.506 20 5 FFBDMO CCOC(=O)C[N@@H+](Cc1ccc(OC)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169038239 1000016601 /nfs/dbraw/zinc/01/66/01/1000016601.db2.gz XIBAIIKFMDZTGD-CVEARBPZSA-N 1 1 350.415 2.506 20 5 FFBDMO Nc1ccc(Br)c2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2 ZINC001169038626 1000016995 /nfs/dbraw/zinc/01/69/95/1000016995.db2.gz JKRXFXNOTIKVGU-MNOVXSKESA-N 1 1 354.248 2.835 20 5 FFBDMO Cc1cccc(CN2CC[C@]3(CC[N@H+]([C@H]4CC[C@H](C[N+](=O)[O-])C4)C3)C2=O)c1 ZINC001169020616 1000017556 /nfs/dbraw/zinc/01/75/56/1000017556.db2.gz JOJPMQHSHLIOGU-IRFCIJBXSA-N 1 1 371.481 2.865 20 5 FFBDMO CCn1ncc2c1C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169021688 1000017671 /nfs/dbraw/zinc/01/76/71/1000017671.db2.gz PKYRZNXQZPFUHB-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO CCn1ncc2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COCC1CC1 ZINC001169021688 1000017672 /nfs/dbraw/zinc/01/76/72/1000017672.db2.gz PKYRZNXQZPFUHB-YESZJQIVSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCO[C@]3(CCCN(c4ccccc4)C3)C2)C1 ZINC001169023981 1000017792 /nfs/dbraw/zinc/01/77/92/1000017792.db2.gz WHIDRJRIFODCBI-RLLQIKCJSA-N 1 1 359.470 2.803 20 5 FFBDMO C[N@@H+](CCOC(=O)COc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000769042798 1000412461 /nfs/dbraw/zinc/41/24/61/1000412461.db2.gz FWTMABNDPGGCSQ-UHFFFAOYSA-N 1 1 362.357 2.788 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN([C@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000770501611 1000801980 /nfs/dbraw/zinc/80/19/80/1000801980.db2.gz RJYNWYPTEBZKJN-NRFANRHFSA-N 1 1 366.465 2.991 20 5 FFBDMO CN(CC(=O)O[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000772668173 1001440563 /nfs/dbraw/zinc/44/05/63/1001440563.db2.gz TVIWPVZLARWRHU-KRWDZBQOSA-N 1 1 369.421 2.849 20 5 FFBDMO Cc1c(CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469138 1001808818 /nfs/dbraw/zinc/80/88/18/1001808818.db2.gz NTVGKWYEVUOQEJ-UXHICEINSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1c(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cccc1[N+](=O)[O-] ZINC000788469138 1001808832 /nfs/dbraw/zinc/80/88/32/1001808832.db2.gz NTVGKWYEVUOQEJ-UXHICEINSA-N 1 1 369.465 2.876 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000791357561 1002678957 /nfs/dbraw/zinc/67/89/57/1002678957.db2.gz FATGOTAHRATQQU-GFCCVEGCSA-N 1 1 366.437 2.947 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](Oc3ncccn3)C2)c([N+](=O)[O-])c1 ZINC001170354850 1003122857 /nfs/dbraw/zinc/12/28/57/1003122857.db2.gz QGXXZYUAXYJQSO-WMLDXEAASA-N 1 1 372.425 2.868 20 5 FFBDMO COCC[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCN(C)CC1 ZINC001170342102 1003129962 /nfs/dbraw/zinc/12/99/62/1003129962.db2.gz MAKQEJLLQJLDNU-OAHLLOKOSA-N 1 1 365.474 2.577 20 5 FFBDMO CCO[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])[C@@H]2CCCO[C@H]12 ZINC001170341391 1003130458 /nfs/dbraw/zinc/13/04/58/1003130458.db2.gz QBWZUVHJNCIYOX-QVSURHGTSA-N 1 1 364.442 2.803 20 5 FFBDMO Cc1nn(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000772829089 1003311185 /nfs/dbraw/zinc/31/11/85/1003311185.db2.gz RESIOOOLWSYLKI-KDOFPFPSSA-N 1 1 370.457 2.554 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ncccn2)C1 ZINC001197864848 1004405161 /nfs/dbraw/zinc/40/51/61/1004405161.db2.gz QJEPOJMSHQQOCB-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccnn1C ZINC001198156096 1004513267 /nfs/dbraw/zinc/51/32/67/1004513267.db2.gz DZMHAABDPUCADD-INIZCTEOSA-N 1 1 373.413 2.503 20 5 FFBDMO CCN1CCN([C@H](C)C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001199257773 1004888102 /nfs/dbraw/zinc/88/81/02/1004888102.db2.gz HTUKHOZRJXEHLU-MRXNPFEDSA-N 1 1 372.469 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2CCC[N@@H+](Cc3ccccc3)CC2)cc1 ZINC000776274052 1005339183 /nfs/dbraw/zinc/33/91/83/1005339183.db2.gz GEWYUKWEYJWUKB-FQEVSTJZSA-N 1 1 355.438 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCN(Cc3ccccc3)CC2)cc1 ZINC000776274052 1005339186 /nfs/dbraw/zinc/33/91/86/1005339186.db2.gz GEWYUKWEYJWUKB-FQEVSTJZSA-N 1 1 355.438 2.836 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN(Cc3ccccc3)CC2)cc1 ZINC000776274052 1005339192 /nfs/dbraw/zinc/33/91/92/1005339192.db2.gz GEWYUKWEYJWUKB-FQEVSTJZSA-N 1 1 355.438 2.836 20 5 FFBDMO CCc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001050326295 1016970970 /nfs/dbraw/zinc/97/09/70/1016970970.db2.gz WKXQORFMPDDEHU-NCXUSEDFSA-N 1 1 359.470 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)nc1 ZINC000851843678 1005917294 /nfs/dbraw/zinc/91/72/94/1005917294.db2.gz LLAIYWUHAAAMDH-ZDUSSCGKSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)nc1 ZINC000851843678 1005917296 /nfs/dbraw/zinc/91/72/96/1005917296.db2.gz LLAIYWUHAAAMDH-ZDUSSCGKSA-N 1 1 361.333 2.724 20 5 FFBDMO CC(C)(CO)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccnc1 ZINC000852092290 1005940948 /nfs/dbraw/zinc/94/09/48/1005940948.db2.gz OYZHUIKEYGKZQV-INIZCTEOSA-N 1 1 360.370 2.747 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1 ZINC000776594143 1006010007 /nfs/dbraw/zinc/01/00/07/1006010007.db2.gz XADAPRKJODGROZ-VQTJNVASSA-N 1 1 356.422 2.901 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(N[C@H]3CC[N@H+](C4CCCCC4)C3)cc2N1 ZINC000853849796 1006555476 /nfs/dbraw/zinc/55/54/76/1006555476.db2.gz FDZVWMOMGQAEQH-LBPRGKRZSA-N 1 1 360.414 2.745 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1cc([N+](=O)[O-])ccc1F ZINC000854487260 1006853043 /nfs/dbraw/zinc/85/30/43/1006853043.db2.gz OEQFOEAIMWCBIJ-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO C/C(=C/C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000854571022 1006894442 /nfs/dbraw/zinc/89/44/42/1006894442.db2.gz SYAKQUHEVBLLGH-KGAUPUERSA-N 1 1 373.453 2.710 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[NH+]3CC=CC3)cc2[N+](=O)[O-])C1 ZINC001116195175 1032184297 /nfs/dbraw/zinc/18/42/97/1032184297.db2.gz FCHFEDCSBUTGDD-HOTGVXAUSA-N 1 1 372.469 2.679 20 5 FFBDMO C[C@@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000817288624 1007509479 /nfs/dbraw/zinc/50/94/79/1007509479.db2.gz JUFLLAHKEMXUEE-KMFMINBZSA-N 1 1 364.442 2.928 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856671003 1007942846 /nfs/dbraw/zinc/94/28/46/1007942846.db2.gz LHMDZBNEDXZTQD-SCLBCKFNSA-N 1 1 360.414 2.671 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(N(C)C(C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000858250170 1008333321 /nfs/dbraw/zinc/33/33/21/1008333321.db2.gz JJUJNOUHWFKIES-UHFFFAOYSA-N 1 1 373.409 2.885 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000858779850 1008421895 /nfs/dbraw/zinc/42/18/95/1008421895.db2.gz DNBRCAZBVJJPON-OAHLLOKOSA-N 1 1 360.414 2.980 20 5 FFBDMO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886020916 1008518192 /nfs/dbraw/zinc/51/81/92/1008518192.db2.gz KLRRBIBFHHDWJF-CYBMUJFWSA-N 1 1 374.363 2.613 20 5 FFBDMO COc1cc(OC)cc(OCCC[N@H+](C)Cc2cccnc2[N+](=O)[O-])c1 ZINC000886038122 1008521726 /nfs/dbraw/zinc/52/17/26/1008521726.db2.gz REFCXORVGPVSCC-UHFFFAOYSA-N 1 1 361.398 2.908 20 5 FFBDMO COc1cc(OC)cc(OCCC[N@@H+](C)Cc2cccnc2[N+](=O)[O-])c1 ZINC000886038122 1008521732 /nfs/dbraw/zinc/52/17/32/1008521732.db2.gz REFCXORVGPVSCC-UHFFFAOYSA-N 1 1 361.398 2.908 20 5 FFBDMO O=C(NCCc1cccs1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886054385 1008527622 /nfs/dbraw/zinc/52/76/22/1008527622.db2.gz AYMJZUABMCEQBM-UHFFFAOYSA-N 1 1 374.466 2.622 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@H+](Cc3cccnc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000886313731 1008631975 /nfs/dbraw/zinc/63/19/75/1008631975.db2.gz ALQZNAPGTYLLDV-KBXCAEBGSA-N 1 1 362.430 2.679 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000886313731 1008631986 /nfs/dbraw/zinc/63/19/86/1008631986.db2.gz ALQZNAPGTYLLDV-KBXCAEBGSA-N 1 1 362.430 2.679 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@](C)(O)c1ccccc1 ZINC000822516801 1008665211 /nfs/dbraw/zinc/66/52/11/1008665211.db2.gz QFFIKQSKETZGMB-IBGZPJMESA-N 1 1 358.394 2.706 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2c(Br)cccc2[N+](=O)[O-])c(C)[nH+]1 ZINC001178446701 1008977868 /nfs/dbraw/zinc/97/78/68/1008977868.db2.gz XDOGLWKQMSWJME-UHFFFAOYSA-N 1 1 353.176 2.627 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccccc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458666 1008994451 /nfs/dbraw/zinc/99/44/51/1008994451.db2.gz QTVWFACOJIBEIK-GDBMZVCRSA-N 1 1 353.850 2.771 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cccc2cccnc21)[C@@H]1CC1[N+](=O)[O-] ZINC001178458342 1008995389 /nfs/dbraw/zinc/99/53/89/1008995389.db2.gz BSTCREXJDGKEDM-QZTJIDSGSA-N 1 1 370.453 2.666 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861171995 1009290064 /nfs/dbraw/zinc/29/00/64/1009290064.db2.gz OXJASHBCTOBQGF-CQSZACIVSA-N 1 1 371.437 2.665 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000130193514 1009318378 /nfs/dbraw/zinc/31/83/78/1009318378.db2.gz HARQDLPDBWGYJG-UHFFFAOYSA-N 1 1 357.414 2.884 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCCC3(CC3)CC2)C1=O ZINC000863330883 1010179216 /nfs/dbraw/zinc/17/92/16/1010179216.db2.gz SSPOBIUNBITDNP-GOSISDBHSA-N 1 1 372.425 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(-n2cc(C[NH2+][C@@H]3CCCc4ccccc43)nn2)nc1 ZINC000864629556 1010533712 /nfs/dbraw/zinc/53/37/12/1010533712.db2.gz QIEDJIBCBFIYPZ-QGZVFWFLSA-N 1 1 350.382 2.738 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000773262173 1010946433 /nfs/dbraw/zinc/94/64/33/1010946433.db2.gz OCKFNFXBKXTPDA-HUUCEWRRSA-N 1 1 359.430 2.744 20 5 FFBDMO CCOc1ccc(CN(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867957356 1011131766 /nfs/dbraw/zinc/13/17/66/1011131766.db2.gz KCDHJHKAZSNFSS-IBGZPJMESA-N 1 1 357.410 2.826 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC[C@H]21 ZINC000868309206 1011239676 /nfs/dbraw/zinc/23/96/76/1011239676.db2.gz GWNGTNSAJGSUQM-SJLPKXTDSA-N 1 1 360.458 2.653 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@H]2CN1CC1CC1 ZINC001172904460 1012077051 /nfs/dbraw/zinc/07/70/51/1012077051.db2.gz NPDZDNNQLWCKGG-BJLQDIEVSA-N 1 1 369.465 2.642 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@@H]21 ZINC001172912325 1012125735 /nfs/dbraw/zinc/12/57/35/1012125735.db2.gz KTESXICHUNMFKP-AOIWGVFYSA-N 1 1 357.454 2.785 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870143901 1012195513 /nfs/dbraw/zinc/19/55/13/1012195513.db2.gz YTGYVRGGCOLVKA-LJQANCHMSA-N 1 1 369.421 2.709 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2NC(=O)c3ccccc32)c1F ZINC001173184244 1012329602 /nfs/dbraw/zinc/32/96/02/1012329602.db2.gz PELISYKERYTOLS-QGHHPUGFSA-N 1 1 359.357 2.705 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)OC(C)(C)C ZINC001173223112 1012354842 /nfs/dbraw/zinc/35/48/42/1012354842.db2.gz XXUNDXQHMGYGSY-VZEFYGNVSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)OC(C)(C)C ZINC001173223109 1012355055 /nfs/dbraw/zinc/35/50/55/1012355055.db2.gz XXUNDXQHMGYGSY-KKBVYLPWSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccncc2)CC1 ZINC001173225020 1012358614 /nfs/dbraw/zinc/35/86/14/1012358614.db2.gz AWEUAUXEIMYWGY-KRWDZBQOSA-N 1 1 354.454 2.781 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)[C@](C)(N)c2cccc([N+](=O)[O-])c2)C1 ZINC000870920328 1012636944 /nfs/dbraw/zinc/63/69/44/1012636944.db2.gz CTFQDUONBQXZMU-CAQIIQHBSA-N 1 1 374.485 2.633 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CNCC2(CCOCC2)C1)C1CC1 ZINC000925798141 1017851412 /nfs/dbraw/zinc/85/14/12/1017851412.db2.gz QRILWMIIILJEPR-QZTJIDSGSA-N 1 1 359.470 2.664 20 5 FFBDMO CC(C)Cc1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC001072725153 1020294122 /nfs/dbraw/zinc/29/41/22/1020294122.db2.gz JJNMLHOAFJXUEC-RTBURBONSA-N 1 1 371.481 2.585 20 5 FFBDMO CC(C)Cc1ccc(C[N@@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725153 1020294131 /nfs/dbraw/zinc/29/41/31/1020294131.db2.gz JJNMLHOAFJXUEC-RTBURBONSA-N 1 1 371.481 2.585 20 5 FFBDMO CC(C)Cc1ccc(C[N@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001072725153 1020294142 /nfs/dbraw/zinc/29/41/42/1020294142.db2.gz JJNMLHOAFJXUEC-RTBURBONSA-N 1 1 371.481 2.585 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000802658341 1020298966 /nfs/dbraw/zinc/29/89/66/1020298966.db2.gz VLIOFWFZDFVFJS-UHFFFAOYSA-N 1 1 373.365 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](Cc3nccs3)C2)nc1-c1ccccn1 ZINC000902649373 1020373184 /nfs/dbraw/zinc/37/31/84/1020373184.db2.gz JZUXFKSYZVOODA-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](Cc3nccs3)C2)nc1-c1ccccn1 ZINC000902649373 1020373193 /nfs/dbraw/zinc/37/31/93/1020373193.db2.gz JZUXFKSYZVOODA-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@H](Cc4nccs4)C3)n2)cc1 ZINC000902649531 1020374059 /nfs/dbraw/zinc/37/40/59/1020374059.db2.gz NZXPIKFJMCJMLN-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](Cc4nccs4)C3)n2)cc1 ZINC000902649531 1020374066 /nfs/dbraw/zinc/37/40/66/1020374066.db2.gz NZXPIKFJMCJMLN-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000828904060 1032898957 /nfs/dbraw/zinc/89/89/57/1032898957.db2.gz BFBSPVSJLMVKIF-CXAGYDPISA-N 1 1 365.405 2.954 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2c[nH]c3ncccc23)C1 ZINC000931373481 1020442514 /nfs/dbraw/zinc/44/25/14/1020442514.db2.gz ZZBULEURNUDEAP-CQSZACIVSA-N 1 1 354.414 2.856 20 5 FFBDMO CC(C)CC[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1 ZINC000726585017 1020489165 /nfs/dbraw/zinc/48/91/65/1020489165.db2.gz QDJGHPFFLMXZMQ-UHFFFAOYSA-N 1 1 360.414 2.831 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c2ncc([N+](=O)[O-])cc12 ZINC000800865571 1020609364 /nfs/dbraw/zinc/60/93/64/1020609364.db2.gz GGPRTNVHZSKVHJ-UHFFFAOYSA-N 1 1 370.369 2.688 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000800865399 1020609942 /nfs/dbraw/zinc/60/99/42/1020609942.db2.gz BENXTRIPUGMSOI-UHFFFAOYSA-N 1 1 355.354 2.985 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@]2(C)COC(=O)N2)C1 ZINC000932027430 1020673070 /nfs/dbraw/zinc/67/30/70/1020673070.db2.gz YJUYQKNGZWJLKY-KDOFPFPSSA-N 1 1 363.414 2.704 20 5 FFBDMO Cn1ccc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000932136781 1020715755 /nfs/dbraw/zinc/71/57/55/1020715755.db2.gz QGCKUDVNTKKESR-CQSZACIVSA-N 1 1 357.414 2.537 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932138799 1020718035 /nfs/dbraw/zinc/71/80/35/1020718035.db2.gz YUFULMLGUDTRJT-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932138799 1020718043 /nfs/dbraw/zinc/71/80/43/1020718043.db2.gz YUFULMLGUDTRJT-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[nH+]1 ZINC001116319433 1021165846 /nfs/dbraw/zinc/16/58/46/1021165846.db2.gz NNPFTKSKBKXPQR-CYBMUJFWSA-N 1 1 372.429 2.861 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[nH+]1 ZINC001116319433 1021165857 /nfs/dbraw/zinc/16/58/57/1021165857.db2.gz NNPFTKSKBKXPQR-CYBMUJFWSA-N 1 1 372.429 2.861 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001116380602 1021187982 /nfs/dbraw/zinc/18/79/82/1021187982.db2.gz ONZBGCFZZDQQRZ-HKUYNNGSSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001116380602 1021187983 /nfs/dbraw/zinc/18/79/83/1021187983.db2.gz ONZBGCFZZDQQRZ-HKUYNNGSSA-N 1 1 373.384 2.674 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934840511 1021424665 /nfs/dbraw/zinc/42/46/65/1021424665.db2.gz FXJOBENBFZHDIU-IRXDYDNUSA-N 1 1 373.453 2.623 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000156013728 1022314613 /nfs/dbraw/zinc/31/46/13/1022314613.db2.gz NCYMTMWQFOQITJ-CYBMUJFWSA-N 1 1 364.402 2.662 20 5 FFBDMO O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1C[NH+](CC1CC1)CC1CC1 ZINC000115514142 1022336760 /nfs/dbraw/zinc/33/67/60/1022336760.db2.gz DBJNVJUAPZICNE-UHFFFAOYSA-N 1 1 354.410 2.898 20 5 FFBDMO CC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808502 1022397357 /nfs/dbraw/zinc/39/73/57/1022397357.db2.gz DRDBXFBGOZIZDH-RHSMWYFYSA-N 1 1 365.405 2.730 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808502 1022397371 /nfs/dbraw/zinc/39/73/71/1022397371.db2.gz DRDBXFBGOZIZDH-RHSMWYFYSA-N 1 1 365.405 2.730 20 5 FFBDMO CCC[C@@H]1CN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC001121296129 1023692832 /nfs/dbraw/zinc/69/28/32/1023692832.db2.gz GBJYUWLQWPIVII-NVXWUHKLSA-N 1 1 372.473 2.644 20 5 FFBDMO CC[N@@H+](CCC1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC1)CC(C)C ZINC001121295861 1023692958 /nfs/dbraw/zinc/69/29/58/1023692958.db2.gz AJUZVZOYTKGJGT-HNNXBMFYSA-N 1 1 366.510 2.737 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000756980334 1023776469 /nfs/dbraw/zinc/77/64/69/1023776469.db2.gz PCTFKRMKNMTIKN-ZDUSSCGKSA-N 1 1 366.418 2.694 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@H+]1CCCO ZINC001218705050 1033291448 /nfs/dbraw/zinc/29/14/48/1033291448.db2.gz SPOHTYJOCRUMLS-LBPRGKRZSA-N 1 1 370.837 2.525 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000837178173 1025637450 /nfs/dbraw/zinc/63/74/50/1025637450.db2.gz WTFGNYRTIGEQLN-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO C[C@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000839646347 1026773117 /nfs/dbraw/zinc/77/31/17/1026773117.db2.gz IGNVDPJUTZBBEK-OXJNMPFZSA-N 1 1 355.438 2.835 20 5 FFBDMO CN(CCC[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000839654083 1026775996 /nfs/dbraw/zinc/77/59/96/1026775996.db2.gz FAEZVYJANZKIPN-MRXNPFEDSA-N 1 1 367.446 2.817 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C12CCC2 ZINC000840140147 1026979415 /nfs/dbraw/zinc/97/94/15/1026979415.db2.gz MFGKZCZRBIYKIO-JKSUJKDBSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1c(C(=O)OCC[C@H]2CCCC[N@@H+]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000840231145 1027013416 /nfs/dbraw/zinc/01/34/16/1027013416.db2.gz ZBGVVWRCCCKGIG-CQSZACIVSA-N 1 1 373.413 2.515 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC001160107603 1027595429 /nfs/dbraw/zinc/59/54/29/1027595429.db2.gz OYVDHLSFPYQEII-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001160107603 1027595438 /nfs/dbraw/zinc/59/54/38/1027595438.db2.gz OYVDHLSFPYQEII-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001160107603 1027595448 /nfs/dbraw/zinc/59/54/48/1027595448.db2.gz OYVDHLSFPYQEII-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(C)c1[N+](=O)[O-] ZINC000795690953 1027813441 /nfs/dbraw/zinc/81/34/41/1027813441.db2.gz BTNPHBLLINVNRF-FGTMMUONSA-N 1 1 356.426 2.870 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC001153807239 1028006695 /nfs/dbraw/zinc/00/66/95/1028006695.db2.gz DDDVOHQGIWGPNH-LBPRGKRZSA-N 1 1 357.357 2.799 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)ncnc2N1CC[N@H+]2CCc3ccccc3[C@@H]2C1 ZINC001155090610 1028574820 /nfs/dbraw/zinc/57/48/20/1028574820.db2.gz GVOIYCLASAHRPC-IBGZPJMESA-N 1 1 361.405 2.957 20 5 FFBDMO CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1cnc2ccc([N+](=O)[O-])cc2n1 ZINC001162877477 1028691615 /nfs/dbraw/zinc/69/16/15/1028691615.db2.gz GPWYLIBOKDHSES-INIZCTEOSA-N 1 1 359.430 2.697 20 5 FFBDMO COC(=O)c1ccnc(NCc2ccccc2-n2cc[nH+]c2C)c1[N+](=O)[O-] ZINC001163132537 1028818024 /nfs/dbraw/zinc/81/80/24/1028818024.db2.gz FBTMPUUOIRQGHP-UHFFFAOYSA-N 1 1 367.365 2.883 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC001155894205 1028963881 /nfs/dbraw/zinc/96/38/81/1028963881.db2.gz SHDSLIHJCBPEPE-JYYAWHABSA-N 1 1 374.485 2.900 20 5 FFBDMO Cc1cccc(N2CCN(c3cnc4cc([N+](=O)[O-])ccc4n3)CC2)[nH+]1 ZINC001163660148 1029012416 /nfs/dbraw/zinc/01/24/16/1029012416.db2.gz NXLLWGQFRJRHKF-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO Cc1cccc(N2CCN(c3ncnc4cc([N+](=O)[O-])ccc43)CC2)[nH+]1 ZINC001163660879 1029012909 /nfs/dbraw/zinc/01/29/09/1029012909.db2.gz VACRQVMQDYXRAA-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001163930659 1029118958 /nfs/dbraw/zinc/11/89/58/1029118958.db2.gz VINBHPCGSQBHGR-INIZCTEOSA-N 1 1 366.437 2.602 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001163930659 1029118968 /nfs/dbraw/zinc/11/89/68/1029118968.db2.gz VINBHPCGSQBHGR-INIZCTEOSA-N 1 1 366.437 2.602 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001156318188 1029143402 /nfs/dbraw/zinc/14/34/02/1029143402.db2.gz QBMZISQPEFCCKX-RCCFBDPRSA-N 1 1 368.437 2.859 20 5 FFBDMO COc1nc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ccc1[N+](=O)[O-] ZINC001165090375 1029379954 /nfs/dbraw/zinc/37/99/54/1029379954.db2.gz YTJKYOBRZMZPII-NVXWUHKLSA-N 1 1 354.410 2.709 20 5 FFBDMO Nc1nc(N2CCC([N@H+]3CCc4ccccc4C3)CC2)ccc1[N+](=O)[O-] ZINC001165151618 1029423510 /nfs/dbraw/zinc/42/35/10/1029423510.db2.gz WSXCROVKCLAUOF-UHFFFAOYSA-N 1 1 353.426 2.599 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)[C@@H]2CCCC[C@H]21 ZINC000782277749 1029637267 /nfs/dbraw/zinc/63/72/67/1029637267.db2.gz RUVBNDZSKGNWKI-XOKHGSTOSA-N 1 1 372.425 2.831 20 5 FFBDMO CSc1nc(Cl)c([N+](=O)[O-])c(N2CC[N@@H+](C)CC23CCCC3)n1 ZINC001158408212 1029820674 /nfs/dbraw/zinc/82/06/74/1029820674.db2.gz CMWLOJNAXQIKLG-UHFFFAOYSA-N 1 1 357.867 2.825 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)nc1-c1ccncc1 ZINC000842620349 1030835875 /nfs/dbraw/zinc/83/58/75/1030835875.db2.gz ZZKCNXDMRPBSTA-HOTGVXAUSA-N 1 1 357.414 2.702 20 5 FFBDMO COCC[C@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001204471223 1031303183 /nfs/dbraw/zinc/30/31/83/1031303183.db2.gz DXTHCYWFHMIQRM-OAHLLOKOSA-N 1 1 367.446 2.956 20 5 FFBDMO COCC[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001204471223 1031303204 /nfs/dbraw/zinc/30/32/04/1031303204.db2.gz DXTHCYWFHMIQRM-OAHLLOKOSA-N 1 1 367.446 2.956 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC001150361411 1031704469 /nfs/dbraw/zinc/70/44/69/1031704469.db2.gz REPFHUMKCJMDNP-QGZVFWFLSA-N 1 1 354.410 2.732 20 5 FFBDMO Cc1ccccc1[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[NH2+]1 ZINC001150361825 1031704709 /nfs/dbraw/zinc/70/47/09/1031704709.db2.gz XWJJQBGJPBSRDZ-SFHVURJKSA-N 1 1 368.437 2.878 20 5 FFBDMO COc1ncnc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1[N+](=O)[O-] ZINC000312976078 1033704196 /nfs/dbraw/zinc/70/41/96/1033704196.db2.gz KWCKSZVYKIQZBA-BZUAXINKSA-N 1 1 369.425 2.716 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccccc12)N[C@@H]1CCC[N@H+](CCCO)C1 ZINC001220437517 1034176843 /nfs/dbraw/zinc/17/68/43/1034176843.db2.gz DIPRONZYWOAIMA-CQSZACIVSA-N 1 1 372.425 2.716 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ccc(Br)c([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001225504676 1034281506 /nfs/dbraw/zinc/28/15/06/1034281506.db2.gz YQXTTXATNGUYNO-PCTYZZJISA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ccc(Br)c([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001225504676 1034281523 /nfs/dbraw/zinc/28/15/23/1034281523.db2.gz YQXTTXATNGUYNO-PCTYZZJISA-N 1 1 355.188 2.540 20 5 FFBDMO Cc1ccnc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC001226120325 1034534032 /nfs/dbraw/zinc/53/40/32/1034534032.db2.gz UBWILOLDGHQKJO-KRWDZBQOSA-N 1 1 357.410 2.968 20 5 FFBDMO CCOc1cccc(C[N@@H+](CCO)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000832660258 1034898463 /nfs/dbraw/zinc/89/84/63/1034898463.db2.gz STHVRCUDTUVFDD-LJQANCHMSA-N 1 1 360.410 2.521 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000835082041 1035518679 /nfs/dbraw/zinc/51/86/79/1035518679.db2.gz FMJDNZAJHCBPDJ-INIZCTEOSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCCO1 ZINC000835082041 1035518684 /nfs/dbraw/zinc/51/86/84/1035518684.db2.gz FMJDNZAJHCBPDJ-INIZCTEOSA-N 1 1 365.430 2.710 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227515536 1035593726 /nfs/dbraw/zinc/59/37/26/1035593726.db2.gz LSGDOUXCTDDICN-NSHDSACASA-N 1 1 362.411 2.777 20 5 FFBDMO Cc1nc(OC2CC[NH+](CCF)CC2)c(Br)cc1[N+](=O)[O-] ZINC001228621437 1036211464 /nfs/dbraw/zinc/21/14/64/1036211464.db2.gz SOBCIMPTFGHNQV-UHFFFAOYSA-N 1 1 362.199 2.873 20 5 FFBDMO C[C@H](Oc1ccc(C(=[NH2+])NO)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001229082431 1036490627 /nfs/dbraw/zinc/49/06/27/1036490627.db2.gz DZJVUKDGVOHMJY-QMMMGPOBSA-N 1 1 363.301 2.907 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229153052 1036526239 /nfs/dbraw/zinc/52/62/39/1036526239.db2.gz ZCGBZQNGBWTPOQ-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO Cc1nc(O[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229375858 1036638391 /nfs/dbraw/zinc/63/83/91/1036638391.db2.gz OOFZGKKGKNISQG-DOMZBBRYSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375858 1036638398 /nfs/dbraw/zinc/63/83/98/1036638398.db2.gz OOFZGKKGKNISQG-DOMZBBRYSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2C[N@H+](Cc3ccccc3)CC[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375858 1036638402 /nfs/dbraw/zinc/63/84/02/1036638402.db2.gz OOFZGKKGKNISQG-DOMZBBRYSA-N 1 1 358.398 2.688 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001229380735 1036643812 /nfs/dbraw/zinc/64/38/12/1036643812.db2.gz NWJIJAHQSHHGKS-JFILPPLUSA-N 1 1 354.790 2.794 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3c4cccnc4ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001233783859 1036761263 /nfs/dbraw/zinc/76/12/63/1036761263.db2.gz AGIVBLWFNYINJU-UHIXZJCNSA-N 1 1 371.393 2.689 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(N4CCCCC4)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001234364956 1037006247 /nfs/dbraw/zinc/00/62/47/1037006247.db2.gz YNLMMKHKSUFHHL-POZUXBRTSA-N 1 1 359.426 2.768 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cc(N4CCCCC4)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001234364956 1037006265 /nfs/dbraw/zinc/00/62/65/1037006265.db2.gz YNLMMKHKSUFHHL-POZUXBRTSA-N 1 1 359.426 2.768 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H]2CC[C@H](SC)C2)cc1[N+](=O)[O-] ZINC001255648831 1038101400 /nfs/dbraw/zinc/10/14/00/1038101400.db2.gz KNKDZHRVQCSYPC-KGLIPLIRSA-N 1 1 368.455 2.863 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC001208345694 1038235004 /nfs/dbraw/zinc/23/50/04/1038235004.db2.gz YGPXURCCNYRSCE-OCCSQVGLSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)[C@H]3CC[C@H](O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093039 1038379892 /nfs/dbraw/zinc/37/98/92/1038379892.db2.gz FDFUIJIKFMKHGK-CZIWCDLHSA-N 1 1 363.458 2.808 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](C)[C@](C)(O)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093090 1038380645 /nfs/dbraw/zinc/38/06/45/1038380645.db2.gz GGMMVOQKXNNIPI-AUUYWEPGSA-N 1 1 363.458 2.665 20 5 FFBDMO C[C@@H]1CC[C@@H](CN)[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569314 1039401092 /nfs/dbraw/zinc/40/10/92/1039401092.db2.gz OTIWZJASLGSYQN-OCCSQVGLSA-N 1 1 368.428 2.901 20 5 FFBDMO C[C@@H]1CC[C@@H](CN)[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001246569314 1039401098 /nfs/dbraw/zinc/40/10/98/1039401098.db2.gz OTIWZJASLGSYQN-OCCSQVGLSA-N 1 1 368.428 2.901 20 5 FFBDMO COc1ncc(Nc2cccc(F)c2N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC001210140075 1039402066 /nfs/dbraw/zinc/40/20/66/1039402066.db2.gz LDAPKYJMAQLUDZ-UHFFFAOYSA-N 1 1 361.377 2.633 20 5 FFBDMO COCOc1ccccc1-c1noc([C@@H]([NH3+])Cc2ccccc2[N+](=O)[O-])n1 ZINC001247665910 1039874764 /nfs/dbraw/zinc/87/47/64/1039874764.db2.gz LGZGAPXHIDNOCQ-AWEZNQCLSA-N 1 1 370.365 2.870 20 5 FFBDMO COC(=O)c1cccc2[nH+]cc(Nc3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)n21 ZINC001211290926 1040063717 /nfs/dbraw/zinc/06/37/17/1040063717.db2.gz NUFYDHUUUINJJF-UHFFFAOYSA-N 1 1 371.309 2.989 20 5 FFBDMO [NH3+][C@H](c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)C1Cc2ccccc2C1 ZINC001248253054 1040194165 /nfs/dbraw/zinc/19/41/65/1040194165.db2.gz VCJUXROUGSTLML-AWEZNQCLSA-N 1 1 355.329 2.594 20 5 FFBDMO C[C@]([NH3+])(Cc1ccc(F)cc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001249349940 1040694210 /nfs/dbraw/zinc/69/42/10/1040694210.db2.gz YEIYULYXWUIMOA-INIZCTEOSA-N 1 1 361.308 2.735 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479957 1040745700 /nfs/dbraw/zinc/74/57/00/1040745700.db2.gz RPMPTXODVJQXAR-LJQANCHMSA-N 1 1 361.442 2.839 20 5 FFBDMO Cc1noc(C[C@H]2C[C@H]3C[N@H+]([C@H](C)Cc4ccccc4[N+](=O)[O-])C[C@H]3O2)n1 ZINC001254559477 1040796782 /nfs/dbraw/zinc/79/67/82/1040796782.db2.gz YCZIQSSZCPURCD-BUIXCFAXSA-N 1 1 372.425 2.549 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1 ZINC001254594403 1040822139 /nfs/dbraw/zinc/82/21/39/1040822139.db2.gz QQTDNXRBEQTQIM-SOLBZPMBSA-N 1 1 373.453 2.861 20 5 FFBDMO CC(=O)N1CCCC[C@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594723 1040822960 /nfs/dbraw/zinc/82/29/60/1040822960.db2.gz HFDYZDJQMMYBOK-VQTJNVASSA-N 1 1 357.454 2.929 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cnn(CC)c21 ZINC001254594263 1040823110 /nfs/dbraw/zinc/82/31/10/1040823110.db2.gz CQTRVZGFUAQVAC-PKOBYXMFSA-N 1 1 370.453 2.914 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603065 1040831860 /nfs/dbraw/zinc/83/18/60/1040831860.db2.gz LGPRKSNSKSWTQX-PMACEKPBSA-N 1 1 359.470 2.637 20 5 FFBDMO O=C1c2ccccc2CN1[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611028 1040838810 /nfs/dbraw/zinc/83/88/10/1040838810.db2.gz ONIOULCSNNIAIB-OALUTQOASA-N 1 1 363.417 2.792 20 5 FFBDMO COc1ccc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254612159 1040842180 /nfs/dbraw/zinc/84/21/80/1040842180.db2.gz VOQVWGVIPOALTC-AEFFLSMTSA-N 1 1 355.394 2.619 20 5 FFBDMO CCn1c(C[NH+]2CCCC2)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001263012343 1042031782 /nfs/dbraw/zinc/03/17/82/1042031782.db2.gz HXMUBXZMZUYXRY-UHFFFAOYSA-N 1 1 370.457 2.971 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)CC1 ZINC001309634810 1043463471 /nfs/dbraw/zinc/46/34/71/1043463471.db2.gz USPAQYRYCVWZSD-UHFFFAOYSA-N 1 1 369.487 2.707 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001310077184 1043632772 /nfs/dbraw/zinc/63/27/72/1043632772.db2.gz KOLHVSPJSCXDBM-TZMCWYRMSA-N 1 1 370.862 2.950 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001310265024 1043659481 /nfs/dbraw/zinc/65/94/81/1043659481.db2.gz ZXARSYAFBUZUIB-GXTWGEPZSA-N 1 1 370.862 2.950 20 5 FFBDMO CCOc1cc(NC(=O)NCCNc2ccc(C)c[nH+]2)ccc1[N+](=O)[O-] ZINC001310944513 1043770303 /nfs/dbraw/zinc/77/03/03/1043770303.db2.gz BJGOMGXMXOYIIC-UHFFFAOYSA-N 1 1 359.386 2.931 20 5 FFBDMO COCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)C1 ZINC001311330583 1043890708 /nfs/dbraw/zinc/89/07/08/1043890708.db2.gz FUOAGXXNPHMHRJ-CYBMUJFWSA-N 1 1 358.398 2.590 20 5 FFBDMO c1nn(CC[NH+]2CCOCC2)cc1-c1cnc2c(ccc3cccnc32)c1 ZINC001240546102 1044383471 /nfs/dbraw/zinc/38/34/71/1044383471.db2.gz HJFLUUREGOBGEC-UHFFFAOYSA-N 1 1 359.433 2.979 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@@H]1CC[N@@H+](CC)C1 ZINC001313888348 1044437666 /nfs/dbraw/zinc/43/76/66/1044437666.db2.gz HCBSZLBBZSMDTM-CQSZACIVSA-N 1 1 358.446 2.651 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001320888733 1045488965 /nfs/dbraw/zinc/48/89/65/1045488965.db2.gz KONJCEUDEWETMK-WBVHZDCISA-N 1 1 374.437 2.906 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001320888731 1045489033 /nfs/dbraw/zinc/48/90/33/1045489033.db2.gz KONJCEUDEWETMK-NVXWUHKLSA-N 1 1 374.437 2.906 20 5 FFBDMO O=C(NCC[N@@H+](Cc1ccccc1)C1CCCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001323708289 1045691340 /nfs/dbraw/zinc/69/13/40/1045691340.db2.gz FJSTXBGRXOGCGZ-RTBURBONSA-N 1 1 359.470 2.993 20 5 FFBDMO O=C(NCC[N@H+](Cc1ccccc1)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001323708289 1045691346 /nfs/dbraw/zinc/69/13/46/1045691346.db2.gz FJSTXBGRXOGCGZ-RTBURBONSA-N 1 1 359.470 2.993 20 5 FFBDMO O=C(NCC[N@@H+](Cc1ccccc1)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001323708289 1045691354 /nfs/dbraw/zinc/69/13/54/1045691354.db2.gz FJSTXBGRXOGCGZ-RTBURBONSA-N 1 1 359.470 2.993 20 5 FFBDMO Cc1noc([C@H]([NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC001474763193 1045852110 /nfs/dbraw/zinc/85/21/10/1045852110.db2.gz ZHTAUKPMIISQOB-MEDUHNTESA-N 1 1 361.402 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccccc3N3CCCC3)CC2)cn1 ZINC001324716509 1046183567 /nfs/dbraw/zinc/18/35/67/1046183567.db2.gz LWZKFONXFXDKKR-UHFFFAOYSA-N 1 1 367.453 2.912 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1CC2(CCC2)C1)Cc1ccccc1 ZINC001325689621 1046611417 /nfs/dbraw/zinc/61/14/17/1046611417.db2.gz LZGPNYMTTWDBNW-RTBURBONSA-N 1 1 371.481 2.850 20 5 FFBDMO CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)c1nc([C@H]([NH3+])c2ccccc2)no1 ZINC001326173154 1046794467 /nfs/dbraw/zinc/79/44/67/1046794467.db2.gz PDZAKDQCXWEFJU-CHWSQXEVSA-N 1 1 371.401 2.631 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001328186923 1048215891 /nfs/dbraw/zinc/21/58/91/1048215891.db2.gz VQDPJYAFXWPNNW-RDJZCZTQSA-N 1 1 373.388 2.883 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC001292072410 1049101086 /nfs/dbraw/zinc/10/10/86/1049101086.db2.gz RGTMZRXYEHAKMQ-ZDUSSCGKSA-N 1 1 351.422 2.903 20 5 FFBDMO CCCC[N@@H+](C)CCn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001294214669 1049710131 /nfs/dbraw/zinc/71/01/31/1049710131.db2.gz KUVLYVWCHRUHTA-UHFFFAOYSA-N 1 1 372.473 2.789 20 5 FFBDMO Cc1[nH+]ccn1CCCSc1ccc([N+](=O)[O-])c(S(C)(=O)=O)c1 ZINC001345185179 1052307454 /nfs/dbraw/zinc/30/74/54/1052307454.db2.gz KPPUUJTWHLMOJF-UHFFFAOYSA-N 1 1 355.441 2.686 20 5 FFBDMO CCOC(=O)[C@@]1(F)C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1CC ZINC001308066121 1052398176 /nfs/dbraw/zinc/39/81/76/1052398176.db2.gz TYRQBUWWJJVQRM-SUMWQHHRSA-N 1 1 354.378 2.587 20 5 FFBDMO CCOC(=O)[C@@]1(F)C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1CC ZINC001308066121 1052398181 /nfs/dbraw/zinc/39/81/81/1052398181.db2.gz TYRQBUWWJJVQRM-SUMWQHHRSA-N 1 1 354.378 2.587 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOc3ccccc3[C@@H]2CO)cc1 ZINC001308105253 1052407233 /nfs/dbraw/zinc/40/72/33/1052407233.db2.gz JDXVTFZTUKAAPV-SFHVURJKSA-N 1 1 358.394 2.792 20 5 FFBDMO COc1cc(COC(=O)c2ccn(-c3cc[nH+]cc3)n2)c([N+](=O)[O-])cc1F ZINC001343823321 1052437918 /nfs/dbraw/zinc/43/79/18/1052437918.db2.gz OXWPPDIHVRGXKV-UHFFFAOYSA-N 1 1 372.312 2.680 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c([N+](=O)[O-])s1 ZINC001309015618 1052539224 /nfs/dbraw/zinc/53/92/24/1052539224.db2.gz CYGKFYPXRRDKIV-LLVKDONJSA-N 1 1 361.489 2.508 20 5 FFBDMO Cn1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C2CCCC2)n1 ZINC001335404793 1053342242 /nfs/dbraw/zinc/34/22/42/1053342242.db2.gz JDEPIGSYSOHUNS-UHFFFAOYSA-N 1 1 370.457 2.703 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1COC(=O)c1ccn(-c2cc[nH+]cc2)n1 ZINC001356070847 1055261390 /nfs/dbraw/zinc/26/13/90/1055261390.db2.gz BGNCSGITIFUOFT-UHFFFAOYSA-N 1 1 368.349 2.931 20 5 FFBDMO COC(=O)c1cc(N2CCC(c3c[nH+]cn3C)CC2)cc(C)c1[N+](=O)[O-] ZINC001338319499 1055416616 /nfs/dbraw/zinc/41/66/16/1055416616.db2.gz OIMHHCZVSGAISE-UHFFFAOYSA-N 1 1 358.398 2.807 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1CCC[N@@H+](CC)CC1 ZINC001339356123 1056364241 /nfs/dbraw/zinc/36/42/41/1056364241.db2.gz CFSSYKUMICGJLK-UHFFFAOYSA-N 1 1 358.446 2.714 20 5 FFBDMO CCN(c1nnc(C[N+](=O)[O-])n1CC)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001339454014 1056468904 /nfs/dbraw/zinc/46/89/04/1056468904.db2.gz FYQHAQQLYLLUFW-DOTOQJQBSA-N 1 1 372.473 2.737 20 5 FFBDMO C[C@@H](c1nnc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)n1C)[N+](=O)[O-] ZINC001339541936 1056564861 /nfs/dbraw/zinc/56/48/61/1056564861.db2.gz NGULZRXXTDXTFV-CABCVRRESA-N 1 1 364.494 2.634 20 5 FFBDMO Cc1ccc(NCCCNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH+]c1 ZINC000540627844 1056971440 /nfs/dbraw/zinc/97/14/40/1056971440.db2.gz LMPFHEUBSGTXHN-UHFFFAOYSA-N 1 1 372.425 2.994 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@H+](CC)C1CC1 ZINC001513796485 1058566845 /nfs/dbraw/zinc/56/68/45/1058566845.db2.gz XIPOTVIAAVCAAB-UHFFFAOYSA-N 1 1 372.473 2.869 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])C2)c1 ZINC001454307537 1059494134 /nfs/dbraw/zinc/49/41/34/1059494134.db2.gz CJVDAZOVADWSRN-QGZVFWFLSA-N 1 1 371.412 2.976 20 5 FFBDMO COc1cc(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)c([N+](=O)[O-])cc1F ZINC001520247800 1059531972 /nfs/dbraw/zinc/53/19/72/1059531972.db2.gz CNWZJYBGSRBEMP-UHFFFAOYSA-N 1 1 371.328 2.884 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C[C@@H]1C ZINC001520580856 1059829768 /nfs/dbraw/zinc/82/97/68/1059829768.db2.gz QZNSHTIHZBWFSC-QWHCGFSZSA-N 1 1 356.426 2.885 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])s2)nnc1N1CCC[N@H+](C(C)C)CC1 ZINC001520751016 1060034024 /nfs/dbraw/zinc/03/40/24/1060034024.db2.gz XCHHQOXICSGGKI-UHFFFAOYSA-N 1 1 364.475 2.855 20 5 FFBDMO COCC[N@@H+](CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000848477177 1060099389 /nfs/dbraw/zinc/09/93/89/1060099389.db2.gz MYTYSWNWQYDYRA-GOSISDBHSA-N 1 1 361.442 2.759 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@H]21 ZINC000848483114 1060121047 /nfs/dbraw/zinc/12/10/47/1060121047.db2.gz YOPUFPMYXUHPKC-CRAIPNDOSA-N 1 1 355.442 2.832 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000848484082 1060124481 /nfs/dbraw/zinc/12/44/81/1060124481.db2.gz FMXMQPILGKCBNV-SFHVURJKSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCOCC2(CCCC2)C1 ZINC000848484082 1060124485 /nfs/dbraw/zinc/12/44/85/1060124485.db2.gz FMXMQPILGKCBNV-SFHVURJKSA-N 1 1 373.453 2.761 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848486344 1060128892 /nfs/dbraw/zinc/12/88/92/1060128892.db2.gz GNTMVKVQEKEXAO-MRXNPFEDSA-N 1 1 371.441 2.654 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848487400 1060132948 /nfs/dbraw/zinc/13/29/48/1060132948.db2.gz RSMIVIFOQREFSK-INIZCTEOSA-N 1 1 371.441 2.797 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2[C@@H]2C[C@H]2C)C[C@H]1C ZINC001547710938 1071990516 /nfs/dbraw/zinc/99/05/16/1071990516.db2.gz QINNQVQIPAHICD-CKEIUWERSA-N 1 1 370.457 2.965 20 5 FFBDMO CC[C@@H](C[NH+]1CCOCC1)Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001458613614 1060634773 /nfs/dbraw/zinc/63/47/73/1060634773.db2.gz FACXWNJTCAYOCI-NSHDSACASA-N 1 1 365.821 2.714 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c(C)c1[N+](=O)[O-] ZINC001475269527 1061028696 /nfs/dbraw/zinc/02/86/96/1061028696.db2.gz KHFXWKQTNDYOED-HNNXBMFYSA-N 1 1 369.487 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](CO)c2ccccc2C)c1 ZINC001460780495 1061098780 /nfs/dbraw/zinc/09/87/80/1061098780.db2.gz XJONZGWQQVKPID-GOSISDBHSA-N 1 1 358.394 2.855 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](CO)c2ccccc2C)c1 ZINC001460780495 1061098795 /nfs/dbraw/zinc/09/87/95/1061098795.db2.gz XJONZGWQQVKPID-GOSISDBHSA-N 1 1 358.394 2.855 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2ncnc3cccc([N+](=O)[O-])c32)C[C@H](C)O1 ZINC000544394228 1061126433 /nfs/dbraw/zinc/12/64/33/1061126433.db2.gz PKCNOEMMXMFUDX-OKILXGFUSA-N 1 1 359.430 2.839 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC001528151331 1061776246 /nfs/dbraw/zinc/77/62/46/1061776246.db2.gz AQFKBSTXNSIMIA-RYQLBKOJSA-N 1 1 360.458 2.855 20 5 FFBDMO C[C@@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1[N+](=O)[O-] ZINC000774596805 1062076398 /nfs/dbraw/zinc/07/63/98/1062076398.db2.gz LNUYQQDDYIUSCK-WBMJQRKESA-N 1 1 370.365 2.959 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001493841277 1063235926 /nfs/dbraw/zinc/23/59/26/1063235926.db2.gz FPXFGMDWVCQWBA-CQSZACIVSA-N 1 1 370.457 2.936 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC001467081788 1063632107 /nfs/dbraw/zinc/63/21/07/1063632107.db2.gz MOMABAATODYELX-JTQLQIEISA-N 1 1 355.826 2.684 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C)n3)CC[NH2+]2)cc1 ZINC001467501696 1063761584 /nfs/dbraw/zinc/76/15/84/1063761584.db2.gz FSTZLQQBRJZHLE-SFHVURJKSA-N 1 1 354.410 2.647 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001471788488 1064789787 /nfs/dbraw/zinc/78/97/87/1064789787.db2.gz QLRSCQUMYKSWCB-UHFFFAOYSA-N 1 1 356.304 2.803 20 5 FFBDMO C[N@H+]1CC[C@H](C(=O)NCCNc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC001472487750 1065079157 /nfs/dbraw/zinc/07/91/57/1065079157.db2.gz VONZTEWYMBKTGI-OALUTQOASA-N 1 1 368.437 2.816 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCNc2cccc(C(F)(F)F)c2[N+](=O)[O-])C1 ZINC001472677747 1065125658 /nfs/dbraw/zinc/12/56/58/1065125658.db2.gz FXSPHZBMSAZNNX-LLVKDONJSA-N 1 1 374.363 2.613 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001472895673 1065169388 /nfs/dbraw/zinc/16/93/88/1065169388.db2.gz BUYBLRPOUXIUHI-RYUDHWBXSA-N 1 1 360.241 2.937 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001473906610 1065417068 /nfs/dbraw/zinc/41/70/68/1065417068.db2.gz LAYXJLUCAFIPEO-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1ccc2nc(NC(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)sc2n1 ZINC001579742170 1078673102 /nfs/dbraw/zinc/67/31/02/1078673102.db2.gz IQYZIELPUDXJRG-MRXNPFEDSA-N 1 1 357.395 2.721 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC001557849938 1075899461 /nfs/dbraw/zinc/89/94/61/1075899461.db2.gz QCURCRQLKLWAKJ-AWEZNQCLSA-N 1 1 351.834 2.924 20 5 FFBDMO C[C@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCCC1 ZINC001558321149 1075980999 /nfs/dbraw/zinc/98/09/99/1075980999.db2.gz JYOJFWGZICEZFL-LBPRGKRZSA-N 1 1 357.414 2.560 20 5 FFBDMO C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CCCC1 ZINC001558321149 1075981005 /nfs/dbraw/zinc/98/10/05/1075981005.db2.gz JYOJFWGZICEZFL-LBPRGKRZSA-N 1 1 357.414 2.560 20 5 FFBDMO C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCCC1 ZINC001558321149 1075981009 /nfs/dbraw/zinc/98/10/09/1075981009.db2.gz JYOJFWGZICEZFL-LBPRGKRZSA-N 1 1 357.414 2.560 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(n3ccnc3)CC2)o1 ZINC001559580405 1076175005 /nfs/dbraw/zinc/17/50/05/1076175005.db2.gz JVHKJGPLTPQKNN-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO COC[C@@]1(C(=O)OC(C)(C)C)CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001560059001 1076219460 /nfs/dbraw/zinc/21/94/60/1076219460.db2.gz KUIDOAUOZCVHFQ-GOSISDBHSA-N 1 1 368.405 2.914 20 5 FFBDMO COC[C@@]1(C(=O)OC(C)(C)C)CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001560059001 1076219465 /nfs/dbraw/zinc/21/94/65/1076219465.db2.gz KUIDOAUOZCVHFQ-GOSISDBHSA-N 1 1 368.405 2.914 20 5 FFBDMO CC1(C)CCC(C[N@@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)CC1 ZINC001566587698 1076969373 /nfs/dbraw/zinc/96/93/73/1076969373.db2.gz PCUUJTAMRMMITM-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO CC1(C)CCC(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)CC1 ZINC001566587698 1076969376 /nfs/dbraw/zinc/96/93/76/1076969376.db2.gz PCUUJTAMRMMITM-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO CC1(C)CCC(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)CC1 ZINC001566587698 1076969379 /nfs/dbraw/zinc/96/93/79/1076969379.db2.gz PCUUJTAMRMMITM-IAGOWNOFSA-N 1 1 351.491 2.839 20 5 FFBDMO C[N@H+](CCc1ccccc1)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC001567245555 1077007867 /nfs/dbraw/zinc/00/78/67/1077007867.db2.gz CMSNYHCGGFDUID-UHFFFAOYSA-N 1 1 353.382 2.584 20 5 FFBDMO C[N@@H+](CCc1ccccc1)CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC001567245555 1077007874 /nfs/dbraw/zinc/00/78/74/1077007874.db2.gz CMSNYHCGGFDUID-UHFFFAOYSA-N 1 1 353.382 2.584 20 5 FFBDMO Cc1ccccc1[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[NH2+]1 ZINC001586591169 1079653698 /nfs/dbraw/zinc/65/36/98/1079653698.db2.gz ZKIDRGGLMLIYFS-QGZVFWFLSA-N 1 1 373.384 2.594 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876319 1080824828 /nfs/dbraw/zinc/82/48/28/1080824828.db2.gz UUDLZRNMCHPRFI-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])o1)[NH+]1CCCC1 ZINC000023982252 249335470 /nfs/dbraw/zinc/33/54/70/249335470.db2.gz SXFPXWPHSAFJDT-CQSZACIVSA-N 1 1 359.382 2.763 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000093769973 250046215 /nfs/dbraw/zinc/04/62/15/250046215.db2.gz YVAVLNHUOHCSAY-HNNXBMFYSA-N 1 1 357.458 2.769 20 5 FFBDMO Cn1cc(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093614658 250039557 /nfs/dbraw/zinc/03/95/57/250039557.db2.gz OKYOGAMDWGOEFF-AEFFLSMTSA-N 1 1 355.442 2.664 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101911970 250092661 /nfs/dbraw/zinc/09/26/61/250092661.db2.gz UMOPWLZBHRXYIO-MRXNPFEDSA-N 1 1 363.458 2.992 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCS(=O)(=O)C3)o2)c(Cl)c1 ZINC000102420186 250109393 /nfs/dbraw/zinc/10/93/93/250109393.db2.gz HQALAELTYHETCG-SNVBAGLBSA-N 1 1 370.814 2.785 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC[C@@H]2CCOC2)CC1 ZINC000132011457 251037795 /nfs/dbraw/zinc/03/77/95/251037795.db2.gz CMRMIQSLBZALEZ-CQSZACIVSA-N 1 1 350.415 2.621 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000152952792 251085272 /nfs/dbraw/zinc/08/52/72/251085272.db2.gz PNKQJXYDRAMVGN-CYBMUJFWSA-N 1 1 354.410 2.890 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000153270215 251119896 /nfs/dbraw/zinc/11/98/96/251119896.db2.gz VEYIHSIALQBVGZ-CQSZACIVSA-N 1 1 369.425 2.527 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000153326478 251124975 /nfs/dbraw/zinc/12/49/75/251124975.db2.gz UGCUCPJIVDHMLR-GOEBONIOSA-N 1 1 359.426 2.692 20 5 FFBDMO COc1ccccc1CNC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271616978 251837885 /nfs/dbraw/zinc/83/78/85/251837885.db2.gz LXLDUYXFPDOPGR-ZIAGYGMSSA-N 1 1 357.410 2.959 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000272320107 252009289 /nfs/dbraw/zinc/00/92/89/252009289.db2.gz LPBJCKOYIDUSOZ-UHFFFAOYSA-N 1 1 357.357 2.753 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O ZINC000272295074 252004073 /nfs/dbraw/zinc/00/40/73/252004073.db2.gz FXBUIOXZWIOAQM-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O ZINC000272295074 252004077 /nfs/dbraw/zinc/00/40/77/252004077.db2.gz FXBUIOXZWIOAQM-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000272484265 252049762 /nfs/dbraw/zinc/04/97/62/252049762.db2.gz VKYKVTTUPGSIOZ-GFCCVEGCSA-N 1 1 366.849 2.574 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC000272496062 252053389 /nfs/dbraw/zinc/05/33/89/252053389.db2.gz VCVCVOZYXSYEMY-ZWNOBZJWSA-N 1 1 370.356 2.754 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(S(N)(=O)=O)c1 ZINC000272891929 252158936 /nfs/dbraw/zinc/15/89/36/252158936.db2.gz XYFZETIBZVAULZ-INIZCTEOSA-N 1 1 367.402 2.622 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000273084373 252211431 /nfs/dbraw/zinc/21/14/31/252211431.db2.gz BDNRSMLBCYDFGP-UHFFFAOYSA-N 1 1 355.847 2.718 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000273397652 252298291 /nfs/dbraw/zinc/29/82/91/252298291.db2.gz VVFOXDGKIUVCOQ-JKSUJKDBSA-N 1 1 372.421 2.833 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000273397649 252298477 /nfs/dbraw/zinc/29/84/77/252298477.db2.gz VVFOXDGKIUVCOQ-HZPDHXFCSA-N 1 1 372.421 2.833 20 5 FFBDMO O=C([C@@H]1CCC[N@H+]1C1CC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000279204723 256392857 /nfs/dbraw/zinc/39/28/57/256392857.db2.gz ONEKNMLPEMFHMO-SFHVURJKSA-N 1 1 359.426 2.591 20 5 FFBDMO COCCn1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278854850 256354710 /nfs/dbraw/zinc/35/47/10/256354710.db2.gz XGZDIQHWOSOVCV-UHFFFAOYSA-N 1 1 358.320 2.746 20 5 FFBDMO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1nc(C(F)(F)F)cs1 ZINC000278896750 256359777 /nfs/dbraw/zinc/35/97/77/256359777.db2.gz JLYHJJXUAUFJOC-MRVPVSSYSA-N 1 1 362.333 2.583 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1 ZINC000281682177 256653899 /nfs/dbraw/zinc/65/38/99/256653899.db2.gz USBQMQWRPAMMRB-JKSUJKDBSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1[C@@H]1CCCO1)Nc1cc([N+](=O)[O-])ccc1F ZINC000284656769 256941706 /nfs/dbraw/zinc/94/17/06/256941706.db2.gz GGFNXNNIDIKCNZ-CVEARBPZSA-N 1 1 351.378 2.706 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000284831625 256953634 /nfs/dbraw/zinc/95/36/34/256953634.db2.gz QKXOSVOXRIYEGU-CYBMUJFWSA-N 1 1 353.394 2.623 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000284831625 256953635 /nfs/dbraw/zinc/95/36/35/256953635.db2.gz QKXOSVOXRIYEGU-CYBMUJFWSA-N 1 1 353.394 2.623 20 5 FFBDMO CN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286139769 257022106 /nfs/dbraw/zinc/02/21/06/257022106.db2.gz HVEISAHPDZTRCB-MZBDJJRSSA-N 1 1 356.426 2.702 20 5 FFBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000286266433 257028510 /nfs/dbraw/zinc/02/85/10/257028510.db2.gz BLIZFBFGHRWWIY-ZDUSSCGKSA-N 1 1 353.394 2.623 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1C[NH+]1CCOCC1 ZINC000288220106 257161882 /nfs/dbraw/zinc/16/18/82/257161882.db2.gz VKQQPBZSSCIGND-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)c1 ZINC000289865335 257303653 /nfs/dbraw/zinc/30/36/53/257303653.db2.gz LLCWKZJGSBHRCI-AWEZNQCLSA-N 1 1 361.377 2.514 20 5 FFBDMO CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC(C)(C)C1 ZINC000289891443 257304994 /nfs/dbraw/zinc/30/49/94/257304994.db2.gz RVWXQYINTWCUKC-JKSUJKDBSA-N 1 1 352.431 2.614 20 5 FFBDMO Cc1cc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)cc(N2CCCC2)[nH+]1 ZINC000290328043 257326667 /nfs/dbraw/zinc/32/66/67/257326667.db2.gz JFPWGQVDBSZLIV-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C[N@@H+](C)C(C)C ZINC000291977296 257445116 /nfs/dbraw/zinc/44/51/16/257445116.db2.gz SREZSLQPKKJFJO-CYBMUJFWSA-N 1 1 369.487 2.792 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000295061712 257614339 /nfs/dbraw/zinc/61/43/39/257614339.db2.gz UCABMNUNCGZJAH-CYBMUJFWSA-N 1 1 366.437 2.604 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NCCCC[N@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-] ZINC000295408322 257631364 /nfs/dbraw/zinc/63/13/64/257631364.db2.gz CZNJHDBNQLXRHX-CYBMUJFWSA-N 1 1 369.849 2.523 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1OC ZINC000298764385 257939035 /nfs/dbraw/zinc/93/90/35/257939035.db2.gz ZVIULCSKSYBJAP-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000301121337 258026601 /nfs/dbraw/zinc/02/66/01/258026601.db2.gz WUTCWOYMYFXZFH-OAHLLOKOSA-N 1 1 369.425 2.555 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(c3ncc([N+](=O)[O-])cc3Cl)CC2)C[C@H](C)O1 ZINC000301274958 258039215 /nfs/dbraw/zinc/03/92/15/258039215.db2.gz LPGKXMGKVITGLZ-BETUJISGSA-N 1 1 368.865 2.969 20 5 FFBDMO Cc1c(C(=O)NCCC[N@H+](C)C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000299539014 258003815 /nfs/dbraw/zinc/00/38/15/258003815.db2.gz UBMBZMYOYUBZHG-UHFFFAOYSA-N 1 1 352.391 2.580 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@H]1C[N@H+](C)CCO1 ZINC000302155651 258091685 /nfs/dbraw/zinc/09/16/85/258091685.db2.gz DYJRXTADKFBQJB-RHSMWYFYSA-N 1 1 372.425 2.700 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[C@H]1C[N@@H+](C)CCO1 ZINC000302155651 258091687 /nfs/dbraw/zinc/09/16/87/258091687.db2.gz DYJRXTADKFBQJB-RHSMWYFYSA-N 1 1 372.425 2.700 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000302754114 258109649 /nfs/dbraw/zinc/10/96/49/258109649.db2.gz IANAVANBXGVGQX-CZUORRHYSA-N 1 1 370.409 2.709 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Br ZINC000317144147 258116031 /nfs/dbraw/zinc/11/60/31/258116031.db2.gz FOMPHKXUCMFDCN-GHMZBOCLSA-N 1 1 368.231 2.714 20 5 FFBDMO O=[N+]([O-])c1cnc(NCCc2cn3c([nH+]2)CCCC3)c(Br)c1 ZINC000301522035 258053911 /nfs/dbraw/zinc/05/39/11/258053911.db2.gz HGYRJPLOZHCWAO-UHFFFAOYSA-N 1 1 366.219 2.940 20 5 FFBDMO C[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1[NH+]1CCOCC1 ZINC000301566537 258056494 /nfs/dbraw/zinc/05/64/94/258056494.db2.gz KRDCMEHMLNQANL-XHDPSFHLSA-N 1 1 370.247 2.514 20 5 FFBDMO Cc1cnc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000301731036 258065480 /nfs/dbraw/zinc/06/54/80/258065480.db2.gz SLCAWAHEQKRRNU-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000301871484 258072167 /nfs/dbraw/zinc/07/21/67/258072167.db2.gz KLDXLFRYXUQKOJ-LSDHHAIUSA-N 1 1 362.817 2.691 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000330858436 258172217 /nfs/dbraw/zinc/17/22/17/258172217.db2.gz TUTXAFPTOUMJMD-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270755 258180969 /nfs/dbraw/zinc/18/09/69/258180969.db2.gz AROXMDPIOYREAL-SUNKGSAMSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270755 258180970 /nfs/dbraw/zinc/18/09/70/258180970.db2.gz AROXMDPIOYREAL-SUNKGSAMSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000331825447 258201777 /nfs/dbraw/zinc/20/17/77/258201777.db2.gz MXYBKXOLVQJHQR-DJIMGWMZSA-N 1 1 360.458 2.967 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C ZINC000331825451 258201927 /nfs/dbraw/zinc/20/19/27/258201927.db2.gz MXYBKXOLVQJHQR-PVAVHDDUSA-N 1 1 360.458 2.967 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000377776702 512445005 /nfs/dbraw/zinc/44/50/05/512445005.db2.gz HFWOULXORHIHEJ-MNOVXSKESA-N 1 1 368.231 2.714 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000065791750 506367025 /nfs/dbraw/zinc/36/70/25/506367025.db2.gz CAHKXFJFQOFKJT-KBPBESRZSA-N 1 1 369.487 2.698 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000371063015 512199341 /nfs/dbraw/zinc/19/93/41/512199341.db2.gz MQNMTFMQZGDEQC-HKUYNNGSSA-N 1 1 357.385 2.838 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000421708039 513379020 /nfs/dbraw/zinc/37/90/20/513379020.db2.gz YXVUESBTUSIATG-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H](c1cccs1)[NH+](C)C ZINC000042157636 506604680 /nfs/dbraw/zinc/60/46/80/506604680.db2.gz ZFMFHGIJKOQODA-ZDUSSCGKSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)[NH+](C)C ZINC000067130343 506764881 /nfs/dbraw/zinc/76/48/81/506764881.db2.gz SXGYPOIHJZESBO-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO COc1c(C)c[nH+]c(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1C ZINC000067227055 506795982 /nfs/dbraw/zinc/79/59/82/506795982.db2.gz DVPPFVNXKBIMLP-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)CC1 ZINC000044521453 506854534 /nfs/dbraw/zinc/85/45/34/506854534.db2.gz UIGHLOBJSHSNNT-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1C1CCCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000055927793 506889839 /nfs/dbraw/zinc/88/98/39/506889839.db2.gz KCGQRNYQLPNAQZ-AWEZNQCLSA-N 1 1 361.398 2.917 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000045313598 506949308 /nfs/dbraw/zinc/94/93/08/506949308.db2.gz FJCVWORFKYHYDT-SFHVURJKSA-N 1 1 356.426 2.736 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000057004566 507144886 /nfs/dbraw/zinc/14/48/86/507144886.db2.gz VTJFJOCBAGLVPS-HNNXBMFYSA-N 1 1 368.437 2.841 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000018769608 507151648 /nfs/dbraw/zinc/15/16/48/507151648.db2.gz CHRSNEGJQHACNW-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO Cc1nc(C[NH+]2CCC(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)cs1 ZINC000068308977 507181522 /nfs/dbraw/zinc/18/15/22/507181522.db2.gz GFXUBQGWHJGVKD-UHFFFAOYSA-N 1 1 374.466 2.888 20 5 FFBDMO O=C(CC[N@H+]1CC[C@]2(C1)CCCOC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000367073264 512324589 /nfs/dbraw/zinc/32/45/89/512324589.db2.gz JRTWVIGJZLFCLQ-KRWDZBQOSA-N 1 1 351.378 2.565 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)cc2)C1 ZINC000046934144 507226807 /nfs/dbraw/zinc/22/68/07/507226807.db2.gz SSBQBRYAJAYZAB-AWEZNQCLSA-N 1 1 357.414 2.662 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000021322164 507250424 /nfs/dbraw/zinc/25/04/24/507250424.db2.gz CVIACFRGFCGFSY-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO C[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000047213364 507286010 /nfs/dbraw/zinc/28/60/10/507286010.db2.gz PQWOJKFYCBQVLY-KGLIPLIRSA-N 1 1 351.472 2.924 20 5 FFBDMO Cc1c(C(=O)N2CCC[N@H+](C(C)C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000068776634 507319745 /nfs/dbraw/zinc/31/97/45/507319745.db2.gz GQVIRSNAHJFVFT-UHFFFAOYSA-N 1 1 364.402 2.676 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000057778184 507327153 /nfs/dbraw/zinc/32/71/53/507327153.db2.gz YQBUISGMDKOGAY-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO C[N@@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000068996828 507377525 /nfs/dbraw/zinc/37/75/25/507377525.db2.gz STWNNIQHJYFZLU-UHFFFAOYSA-N 1 1 355.460 2.675 20 5 FFBDMO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000026208188 507568333 /nfs/dbraw/zinc/56/83/33/507568333.db2.gz BQXGDWCVAOIAIZ-ZDUSSCGKSA-N 1 1 371.393 2.840 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000026208188 507568338 /nfs/dbraw/zinc/56/83/38/507568338.db2.gz BQXGDWCVAOIAIZ-ZDUSSCGKSA-N 1 1 371.393 2.840 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000026222712 507570070 /nfs/dbraw/zinc/57/00/70/507570070.db2.gz LZCZLJKVYZJBMI-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1[N+](=O)[O-] ZINC000026349325 507580638 /nfs/dbraw/zinc/58/06/38/507580638.db2.gz BHAJKLFJXFAAOH-UHFFFAOYSA-N 1 1 357.366 2.784 20 5 FFBDMO C[N@H+](CCOc1ccc(F)cc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027373338 507651741 /nfs/dbraw/zinc/65/17/41/507651741.db2.gz UDVNJTWCILBIOH-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO C[N@@H+](CCOc1ccc(F)cc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000027373338 507651747 /nfs/dbraw/zinc/65/17/47/507651747.db2.gz UDVNJTWCILBIOH-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000050029340 507653434 /nfs/dbraw/zinc/65/34/34/507653434.db2.gz XAMJLEZELYOHFP-LJQANCHMSA-N 1 1 368.437 2.788 20 5 FFBDMO C[N@H+](CCOc1ccc(F)cc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027682298 507677245 /nfs/dbraw/zinc/67/72/45/507677245.db2.gz SRJDNFDWVDOZTR-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO C[N@@H+](CCOc1ccc(F)cc1)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027682298 507677253 /nfs/dbraw/zinc/67/72/53/507677253.db2.gz SRJDNFDWVDOZTR-UHFFFAOYSA-N 1 1 373.384 2.634 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000063661078 507755773 /nfs/dbraw/zinc/75/57/73/507755773.db2.gz UGDSAINCVHMBLW-AWEZNQCLSA-N 1 1 359.430 2.744 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3c[nH]cn3)CC2)cccc1[N+](=O)[O-] ZINC000369341284 512359071 /nfs/dbraw/zinc/35/90/71/512359071.db2.gz CVEVSZOXXKVIEE-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000029852105 507793040 /nfs/dbraw/zinc/79/30/40/507793040.db2.gz MVYPYTJJXXMETL-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000029852105 507793042 /nfs/dbraw/zinc/79/30/42/507793042.db2.gz MVYPYTJJXXMETL-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=[N+]([O-])c1cccnc1NCCCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000052430650 507809250 /nfs/dbraw/zinc/80/92/50/507809250.db2.gz AQTASRWKWYFEGW-UHFFFAOYSA-N 1 1 369.469 3.000 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000072760395 507850276 /nfs/dbraw/zinc/85/02/76/507850276.db2.gz UIFXGQJETFQOFN-INIZCTEOSA-N 1 1 369.421 2.732 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1NCCCn1cc[nH+]c1C ZINC000078333620 507861221 /nfs/dbraw/zinc/86/12/21/507861221.db2.gz HRPIUBXOIJEWMI-UHFFFAOYSA-N 1 1 350.350 2.918 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000072859190 507865628 /nfs/dbraw/zinc/86/56/28/507865628.db2.gz KQDCVRBBWVQABV-KBPBESRZSA-N 1 1 359.430 2.979 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000078438228 507870903 /nfs/dbraw/zinc/87/09/03/507870903.db2.gz MPTHXZADSYNXEV-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000108094085 507877668 /nfs/dbraw/zinc/87/76/68/507877668.db2.gz KFRHWMZQTYVCMY-UHFFFAOYSA-N 1 1 351.357 2.683 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000108302696 507885219 /nfs/dbraw/zinc/88/52/19/507885219.db2.gz NKIVKLKHZGWEFA-CQSZACIVSA-N 1 1 372.450 2.932 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@H+](CC3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108423890 507894079 /nfs/dbraw/zinc/89/40/79/507894079.db2.gz OURWDBIULNLVJJ-QGZVFWFLSA-N 1 1 355.442 2.569 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@@H+](CC3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108423890 507894081 /nfs/dbraw/zinc/89/40/81/507894081.db2.gz OURWDBIULNLVJJ-QGZVFWFLSA-N 1 1 355.442 2.569 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000108505984 507899772 /nfs/dbraw/zinc/89/97/72/507899772.db2.gz ITIAGLHGQUUXEY-NSHDSACASA-N 1 1 370.356 2.802 20 5 FFBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O)CCC2 ZINC000090559553 507927411 /nfs/dbraw/zinc/92/74/11/507927411.db2.gz IYCDEAWVUOVRDJ-AWEZNQCLSA-N 1 1 362.455 2.785 20 5 FFBDMO CCc1nn(C)c(N2CC[C@@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000091729306 508005709 /nfs/dbraw/zinc/00/57/09/508005709.db2.gz IUTKYSYQLOWQAP-OAHLLOKOSA-N 1 1 357.458 2.992 20 5 FFBDMO O=C(C[N@H+](CCCO)[C@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074313070 508010403 /nfs/dbraw/zinc/01/04/03/508010403.db2.gz JXSGASKAFSZKNM-SFHVURJKSA-N 1 1 369.421 2.905 20 5 FFBDMO CCC[N@H+](CC(=O)NC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092381727 508066640 /nfs/dbraw/zinc/06/66/40/508066640.db2.gz LPTXSWWTLSABLV-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO CCC[N@@H+](CC(=O)NC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092381727 508066642 /nfs/dbraw/zinc/06/66/42/508066642.db2.gz LPTXSWWTLSABLV-UHFFFAOYSA-N 1 1 361.398 2.821 20 5 FFBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075885789 508139963 /nfs/dbraw/zinc/13/99/63/508139963.db2.gz BJEGOCFXEXRLHY-MJGOQNOKSA-N 1 1 360.458 2.804 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000081125933 508140335 /nfs/dbraw/zinc/14/03/35/508140335.db2.gz JMHKPAFLCLLWFG-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccccc1N1CCOCC1)CC2 ZINC000093338376 508140458 /nfs/dbraw/zinc/14/04/58/508140458.db2.gz LORQZJFJUBAHHW-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccccc1N1CCOCC1)CC2 ZINC000093338376 508140461 /nfs/dbraw/zinc/14/04/61/508140461.db2.gz LORQZJFJUBAHHW-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO Cc1ccc(-c2n[nH]cc2C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000093534286 508148346 /nfs/dbraw/zinc/14/83/46/508148346.db2.gz LDIJPAXMVLXAPM-CQSZACIVSA-N 1 1 368.397 2.968 20 5 FFBDMO CCc1nn(C)c(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000094155360 508171200 /nfs/dbraw/zinc/17/12/00/508171200.db2.gz XCNOAMIREJTZDV-MRXNPFEDSA-N 1 1 357.458 2.867 20 5 FFBDMO CC(C)[C@@H](CO)[N@@H+](Cc1ccccc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000112658252 508206460 /nfs/dbraw/zinc/20/64/60/508206460.db2.gz FXIKNICGZKXMMY-LJQANCHMSA-N 1 1 371.437 2.713 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076483621 508212137 /nfs/dbraw/zinc/21/21/37/508212137.db2.gz LMQMEQIDLOSVLI-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000102478847 508276411 /nfs/dbraw/zinc/27/64/11/508276411.db2.gz CZNLVLRAFNIOMF-LBPRGKRZSA-N 1 1 357.838 2.862 20 5 FFBDMO Cn1cc(C(=O)NCC[N@@H+](C)C2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000104574669 508338924 /nfs/dbraw/zinc/33/89/24/508338924.db2.gz BJXXFACULZDRLP-UHFFFAOYSA-N 1 1 371.441 2.600 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616513 508379541 /nfs/dbraw/zinc/37/95/41/508379541.db2.gz DXOAVSFATGKKAL-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000088616513 508379542 /nfs/dbraw/zinc/37/95/42/508379542.db2.gz DXOAVSFATGKKAL-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000156671328 508459910 /nfs/dbraw/zinc/45/99/10/508459910.db2.gz ZTLHAKWTCNYICR-QAPCUYQASA-N 1 1 368.437 2.643 20 5 FFBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000134247173 508513233 /nfs/dbraw/zinc/51/32/33/508513233.db2.gz IRJXCKHXGSZTJB-SGTLLEGYSA-N 1 1 355.394 2.518 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])c1 ZINC000122342402 508520077 /nfs/dbraw/zinc/52/00/77/508520077.db2.gz FLCKJRJFCIFRML-PBHICJAKSA-N 1 1 360.414 2.762 20 5 FFBDMO Cc1cc(C(=O)NCc2cccc(C[NH+]3CCOCC3)c2)cc([N+](=O)[O-])c1 ZINC000122499917 508545279 /nfs/dbraw/zinc/54/52/79/508545279.db2.gz SEWYOGIKAOWKBG-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](O)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000157692159 508598269 /nfs/dbraw/zinc/59/82/69/508598269.db2.gz WYGUVZARDRWROM-KRWDZBQOSA-N 1 1 358.394 2.749 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1N(CCC[NH+]1CCOCC1)Cc1ccncc1 ZINC000135453616 508607187 /nfs/dbraw/zinc/60/71/87/508607187.db2.gz ZIYLWIFUYAKSBH-UHFFFAOYSA-N 1 1 374.416 2.858 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000157904172 508629921 /nfs/dbraw/zinc/62/99/21/508629921.db2.gz DTFQBMSTOLGKIX-RDJZCZTQSA-N 1 1 372.421 2.833 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000153761521 508644273 /nfs/dbraw/zinc/64/42/73/508644273.db2.gz CMQABHQBRSROBL-ZDUSSCGKSA-N 1 1 363.414 2.505 20 5 FFBDMO CCOc1ccnc(N2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000135773938 508648750 /nfs/dbraw/zinc/64/87/50/508648750.db2.gz XKCLEXJYQVRRGI-UHFFFAOYSA-N 1 1 371.441 2.538 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000128961084 508664524 /nfs/dbraw/zinc/66/45/24/508664524.db2.gz OWVLWDARAPYHQQ-WBMJQRKESA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)c3[nH]ncc3[N+](=O)[O-])cc2)C1 ZINC000136245208 508681569 /nfs/dbraw/zinc/68/15/69/508681569.db2.gz NEPSVVIANQUMRX-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(CNC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)C1 ZINC000136245208 508681573 /nfs/dbraw/zinc/68/15/73/508681573.db2.gz NEPSVVIANQUMRX-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)C1 ZINC000136245208 508681577 /nfs/dbraw/zinc/68/15/77/508681577.db2.gz NEPSVVIANQUMRX-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO CC1CC[NH+](CCCCNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000123720541 508729460 /nfs/dbraw/zinc/72/94/60/508729460.db2.gz GVTPLSIJWCTOKD-UHFFFAOYSA-N 1 1 373.450 2.524 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000154266880 508748601 /nfs/dbraw/zinc/74/86/01/508748601.db2.gz HCPPXYHMOGMXAA-YGRLFVJLSA-N 1 1 370.247 2.816 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000129701376 508756287 /nfs/dbraw/zinc/75/62/87/508756287.db2.gz IIIICHQYQJUGKP-MRXNPFEDSA-N 1 1 363.458 2.536 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@H](C[NH+]2CCOCC2)C1 ZINC000129701376 508756291 /nfs/dbraw/zinc/75/62/91/508756291.db2.gz IIIICHQYQJUGKP-MRXNPFEDSA-N 1 1 363.458 2.536 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[NH+](C2CCCCC2)CC1 ZINC000154416468 508780291 /nfs/dbraw/zinc/78/02/91/508780291.db2.gz NKNDQLNPWQZWOH-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000159234178 508812226 /nfs/dbraw/zinc/81/22/26/508812226.db2.gz XWUABLDAYAZESK-MOPGFXCFSA-N 1 1 369.469 2.778 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000124321842 508814676 /nfs/dbraw/zinc/81/46/76/508814676.db2.gz LFHSQGZGOXFUBT-WBVHZDCISA-N 1 1 358.442 2.753 20 5 FFBDMO COC(=O)CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)C ZINC000143820784 508834163 /nfs/dbraw/zinc/83/41/63/508834163.db2.gz NAVLZYSMAZPSKT-UHFFFAOYSA-N 1 1 362.386 2.666 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000130730004 508837965 /nfs/dbraw/zinc/83/79/65/508837965.db2.gz OCEWOJOQKMLFTK-CJNGLKHVSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159517123 508852188 /nfs/dbraw/zinc/85/21/88/508852188.db2.gz AGNSKMHBZJTQLV-AAEUAGOBSA-N 1 1 360.439 2.804 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150925304 508923885 /nfs/dbraw/zinc/92/38/85/508923885.db2.gz WUIZCDYRMLWHAJ-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150925304 508923886 /nfs/dbraw/zinc/92/38/86/508923886.db2.gz WUIZCDYRMLWHAJ-GFCCVEGCSA-N 1 1 351.403 2.585 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000150964657 508931737 /nfs/dbraw/zinc/93/17/37/508931737.db2.gz WZQIXHKRJZNSQS-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000150964657 508931741 /nfs/dbraw/zinc/93/17/41/508931741.db2.gz WZQIXHKRJZNSQS-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000120223004 508953727 /nfs/dbraw/zinc/95/37/27/508953727.db2.gz HKTUSGXSJOUWRP-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000160710525 509023551 /nfs/dbraw/zinc/02/35/51/509023551.db2.gz JCGZICOKOHMMKG-KRWDZBQOSA-N 1 1 360.458 2.999 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1F ZINC000151566815 509045143 /nfs/dbraw/zinc/04/51/43/509045143.db2.gz GVVWTXHORXSRHT-CYBMUJFWSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1F ZINC000151566815 509045147 /nfs/dbraw/zinc/04/51/47/509045147.db2.gz GVVWTXHORXSRHT-CYBMUJFWSA-N 1 1 374.372 2.602 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1C[C@@H](C)O ZINC000120835873 509073912 /nfs/dbraw/zinc/07/39/12/509073912.db2.gz GTESIBBZRWAMNC-HIFRSBDPSA-N 1 1 364.446 2.521 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000133028040 509105876 /nfs/dbraw/zinc/10/58/76/509105876.db2.gz DWWLYCZPJGOVAX-CQSZACIVSA-N 1 1 350.806 2.988 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cn1 ZINC000133342040 509149610 /nfs/dbraw/zinc/14/96/10/509149610.db2.gz FUDODWFBKFOUCD-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000161962842 509166629 /nfs/dbraw/zinc/16/66/29/509166629.db2.gz RPGCZWWTELYEOC-AWEZNQCLSA-N 1 1 363.414 2.589 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000161962842 509166630 /nfs/dbraw/zinc/16/66/30/509166630.db2.gz RPGCZWWTELYEOC-AWEZNQCLSA-N 1 1 363.414 2.589 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000162087692 509172023 /nfs/dbraw/zinc/17/20/23/509172023.db2.gz JATZTQMGDJNWLQ-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1cn(-c2ccccc2)nn1 ZINC000185475205 509194978 /nfs/dbraw/zinc/19/49/78/509194978.db2.gz SBGCOJLHTJGJSB-CQSZACIVSA-N 1 1 353.382 2.905 20 5 FFBDMO Cc1cc(NC(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000195662116 509216425 /nfs/dbraw/zinc/21/64/25/509216425.db2.gz PLCBAGCFVYOEJN-INIZCTEOSA-N 1 1 364.446 2.772 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1c(C)noc1C ZINC000182409902 509223023 /nfs/dbraw/zinc/22/30/23/509223023.db2.gz OHHMCRILDLZXFK-HNNXBMFYSA-N 1 1 358.398 2.830 20 5 FFBDMO CC(C)C[NH+]1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000248234156 509263177 /nfs/dbraw/zinc/26/31/77/509263177.db2.gz LXVJISBKLFAVSW-CQSZACIVSA-N 1 1 351.472 2.876 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1 ZINC000191998063 509284648 /nfs/dbraw/zinc/28/46/48/509284648.db2.gz IPYKLTPENGBYQC-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000162733017 509289201 /nfs/dbraw/zinc/28/92/01/509289201.db2.gz UTALYLCUKGSOAO-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000162733017 509289207 /nfs/dbraw/zinc/28/92/07/509289207.db2.gz UTALYLCUKGSOAO-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000248438837 509320549 /nfs/dbraw/zinc/32/05/49/509320549.db2.gz CBWLAQRPRGMQBV-QZTJIDSGSA-N 1 1 356.422 2.899 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000162973266 509326483 /nfs/dbraw/zinc/32/64/83/509326483.db2.gz AYXOYYYVYTUQIH-LBPRGKRZSA-N 1 1 370.247 2.880 20 5 FFBDMO C[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000248465358 509334250 /nfs/dbraw/zinc/33/42/50/509334250.db2.gz RPKBFNANRJOYEG-COXVUDFISA-N 1 1 352.456 2.879 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H](CO)CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650032 509350676 /nfs/dbraw/zinc/35/06/76/509350676.db2.gz XXNOLVSIKLBXSV-WCQYABFASA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H](CO)CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650032 509350681 /nfs/dbraw/zinc/35/06/81/509350681.db2.gz XXNOLVSIKLBXSV-WCQYABFASA-N 1 1 374.384 2.983 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192182535 509390854 /nfs/dbraw/zinc/39/08/54/509390854.db2.gz IURMUFVGYSUBAH-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCS[C@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192182535 509390862 /nfs/dbraw/zinc/39/08/62/509390862.db2.gz IURMUFVGYSUBAH-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO Cc1cc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c(N)c([N+](=O)[O-])c1 ZINC000182824569 509443871 /nfs/dbraw/zinc/44/38/71/509443871.db2.gz MUCGNTFPBISQLZ-KBPBESRZSA-N 1 1 360.458 2.868 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1S(=O)(=O)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173310889 509522442 /nfs/dbraw/zinc/52/24/42/509522442.db2.gz LDRDBDJCSAZGJK-CYBMUJFWSA-N 1 1 363.439 2.696 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(CNc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000264472871 509548297 /nfs/dbraw/zinc/54/82/97/509548297.db2.gz OAKABYFVQHDDDZ-QGZVFWFLSA-N 1 1 368.437 2.904 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000183022451 509552985 /nfs/dbraw/zinc/55/29/85/509552985.db2.gz AIGUOKOHBCUSGD-GWCFXTLKSA-N 1 1 357.357 2.608 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000192924726 509701239 /nfs/dbraw/zinc/70/12/39/509701239.db2.gz JAVIABLFRQIMRP-QGZVFWFLSA-N 1 1 373.457 2.823 20 5 FFBDMO NC(=O)c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192958628 509713916 /nfs/dbraw/zinc/71/39/16/509713916.db2.gz JJORMVYTWDPCSW-HNNXBMFYSA-N 1 1 354.410 2.628 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000268148222 509779728 /nfs/dbraw/zinc/77/97/28/509779728.db2.gz WGCWSRCVFGRAFQ-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180175135 509794861 /nfs/dbraw/zinc/79/48/61/509794861.db2.gz KWFZLMWZPVVDJY-PXNSSMCTSA-N 1 1 368.437 2.958 20 5 FFBDMO COC[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000251522173 509810664 /nfs/dbraw/zinc/81/06/64/509810664.db2.gz CUEPSRLOYXNLML-BBRMVZONSA-N 1 1 361.398 2.528 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C[N@H+]1C1CC1 ZINC000177179040 509921245 /nfs/dbraw/zinc/92/12/45/509921245.db2.gz PAJMQTLKAIDHIC-KBPBESRZSA-N 1 1 358.442 2.550 20 5 FFBDMO COc1cc(C[NH+]2CCC(C)(CO)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000186913660 509947385 /nfs/dbraw/zinc/94/73/85/509947385.db2.gz TZBSLYKFWMMPLM-UHFFFAOYSA-N 1 1 374.384 2.842 20 5 FFBDMO Cc1ccc(CN(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190314996 510058403 /nfs/dbraw/zinc/05/84/03/510058403.db2.gz NVNMLFOJDSPQFH-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261938302 510121011 /nfs/dbraw/zinc/12/10/11/510121011.db2.gz KGOSQWLRBBTENV-KRWDZBQOSA-N 1 1 373.384 2.676 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245747710 510125134 /nfs/dbraw/zinc/12/51/34/510125134.db2.gz NEXZDZKYNBWMQE-MAUKXSAKSA-N 1 1 356.426 2.996 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000174513373 510151701 /nfs/dbraw/zinc/15/17/01/510151701.db2.gz UVTHSBHAPCDMCB-GFCCVEGCSA-N 1 1 367.471 2.739 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000262031320 510154363 /nfs/dbraw/zinc/15/43/63/510154363.db2.gz SIDCAUJDKQGLPG-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190482112 510155927 /nfs/dbraw/zinc/15/59/27/510155927.db2.gz UDDICBNIMIRRQW-RYUDHWBXSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190482112 510155932 /nfs/dbraw/zinc/15/59/32/510155932.db2.gz UDDICBNIMIRRQW-RYUDHWBXSA-N 1 1 353.444 2.615 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000245882418 510185194 /nfs/dbraw/zinc/18/51/94/510185194.db2.gz IITARBGUGPMJJC-XJKSGUPXSA-N 1 1 354.410 2.699 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)[NH2+]Cc2ccccc21 ZINC000262149907 510191956 /nfs/dbraw/zinc/19/19/56/510191956.db2.gz FWFLBFTTZCZWCS-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)[NH2+]Cc2ccccc21 ZINC000262240680 510218545 /nfs/dbraw/zinc/21/85/45/510218545.db2.gz PDOJDCXFSLKYKH-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO Cc1ccc(CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@H]2CCCO2)cc1 ZINC000174879560 510361625 /nfs/dbraw/zinc/36/16/25/510361625.db2.gz XFAAONUVLYDXPG-LJQANCHMSA-N 1 1 358.442 2.823 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000178176205 510472076 /nfs/dbraw/zinc/47/20/76/510472076.db2.gz NXNUQRAIOYXHHW-UHFFFAOYSA-N 1 1 360.458 2.905 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000181665628 510529123 /nfs/dbraw/zinc/52/91/23/510529123.db2.gz WMYFGMOJLOYCQK-MRXNPFEDSA-N 1 1 359.382 2.519 20 5 FFBDMO C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181664695 510529667 /nfs/dbraw/zinc/52/96/67/510529667.db2.gz WZQCCOGTNQAXCM-LSDHHAIUSA-N 1 1 361.442 2.743 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000181703295 510547377 /nfs/dbraw/zinc/54/73/77/510547377.db2.gz YLQQNQCSSMYJOR-INIZCTEOSA-N 1 1 359.382 2.519 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000172153989 510573144 /nfs/dbraw/zinc/57/31/44/510573144.db2.gz LARCQZWETCNAAC-HNNXBMFYSA-N 1 1 364.446 2.667 20 5 FFBDMO CC(C)C[C@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000191640011 510766683 /nfs/dbraw/zinc/76/66/83/510766683.db2.gz IJXXDFIIHACXOU-SFHVURJKSA-N 1 1 350.415 2.834 20 5 FFBDMO Cc1cnc([C@@H]([NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C2CC2)s1 ZINC000185295778 510793418 /nfs/dbraw/zinc/79/34/18/510793418.db2.gz UTDCENWJIOBVBL-KRWDZBQOSA-N 1 1 372.450 2.990 20 5 FFBDMO COC[C@@](C)(CCO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175847957 510822147 /nfs/dbraw/zinc/82/21/47/510822147.db2.gz UGGOYJBHMZSLCY-MRXNPFEDSA-N 1 1 351.428 2.595 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182235158 510826835 /nfs/dbraw/zinc/82/68/35/510826835.db2.gz ITWCBMQHPUMERF-NSHDSACASA-N 1 1 357.357 2.610 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178908412 510830083 /nfs/dbraw/zinc/83/00/83/510830083.db2.gz GREMLAUAWCLCLT-UHFFFAOYSA-N 1 1 361.442 2.588 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247425382 510860698 /nfs/dbraw/zinc/86/06/98/510860698.db2.gz OHJAWPTUODUMSX-XJKSGUPXSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000247454082 510861255 /nfs/dbraw/zinc/86/12/55/510861255.db2.gz QLJYHESONXMVPU-GOEBONIOSA-N 1 1 360.458 2.607 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N2CCC(N3CC[NH+](C(C)C)CC3)CC2)c1 ZINC000270514515 510892797 /nfs/dbraw/zinc/89/27/97/510892797.db2.gz XVCJBZRYFMTEFF-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO CN(Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285426176 510900934 /nfs/dbraw/zinc/90/09/34/510900934.db2.gz GZWRNGWMQZEZQY-XYPWUTKMSA-N 1 1 357.414 2.702 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000293927701 510901423 /nfs/dbraw/zinc/90/14/23/510901423.db2.gz QEAPJKNIYBVZHS-HNNXBMFYSA-N 1 1 357.332 2.781 20 5 FFBDMO Cc1cc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)nc(N2CCCC2)n1 ZINC000294066210 510945221 /nfs/dbraw/zinc/94/52/21/510945221.db2.gz HLYVYBBSKKDSCU-CYBMUJFWSA-N 1 1 356.430 2.726 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000364604031 510965531 /nfs/dbraw/zinc/96/55/31/510965531.db2.gz HIVMQIHWFVPVCV-GFCCVEGCSA-N 1 1 361.377 2.665 20 5 FFBDMO CC(C)(CCC(=O)N1CCC[N@H+](Cc2ccc(F)cc2)CC1)[N+](=O)[O-] ZINC000294219987 510994835 /nfs/dbraw/zinc/99/48/35/510994835.db2.gz ATJMDKZNUSMKFJ-UHFFFAOYSA-N 1 1 351.422 2.696 20 5 FFBDMO CC(C)(CCC(=O)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1)[N+](=O)[O-] ZINC000294219987 510994838 /nfs/dbraw/zinc/99/48/38/510994838.db2.gz ATJMDKZNUSMKFJ-UHFFFAOYSA-N 1 1 351.422 2.696 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000361650749 511074811 /nfs/dbraw/zinc/07/48/11/511074811.db2.gz AVBSYEKDDOJABC-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO C[C@H]1CCCC[N@@H+]1CCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271298664 511154427 /nfs/dbraw/zinc/15/44/27/511154427.db2.gz QKCZVWMMXKKEHW-NSHDSACASA-N 1 1 361.489 2.736 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000271298664 511154433 /nfs/dbraw/zinc/15/44/33/511154433.db2.gz QKCZVWMMXKKEHW-NSHDSACASA-N 1 1 361.489 2.736 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCn2cccc2[C@@H]1C ZINC000298083997 511170037 /nfs/dbraw/zinc/17/00/37/511170037.db2.gz JWWDSEJNNBVNQY-ZDUSSCGKSA-N 1 1 358.398 2.810 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000279683109 511176069 /nfs/dbraw/zinc/17/60/69/511176069.db2.gz AOOFZRIUNKMCQG-XHDPSFHLSA-N 1 1 369.824 2.873 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC[N@H+]1C ZINC000294934740 511226634 /nfs/dbraw/zinc/22/66/34/511226634.db2.gz LEVDQBITTNXWDI-WFASDCNBSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@@H+]1C ZINC000294934740 511226639 /nfs/dbraw/zinc/22/66/39/511226639.db2.gz LEVDQBITTNXWDI-WFASDCNBSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC[N@H+]1C ZINC000294934740 511226645 /nfs/dbraw/zinc/22/66/45/511226645.db2.gz LEVDQBITTNXWDI-WFASDCNBSA-N 1 1 357.414 2.540 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000294964765 511237071 /nfs/dbraw/zinc/23/70/71/511237071.db2.gz PRKLQVXGHXKSJH-GFCCVEGCSA-N 1 1 353.394 2.737 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccccc1[N+](=O)[O-] ZINC000271717498 511299508 /nfs/dbraw/zinc/29/95/08/511299508.db2.gz KFDIHMVAVFYAGD-GFCCVEGCSA-N 1 1 370.365 2.743 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)C2)C1 ZINC000295218975 511325633 /nfs/dbraw/zinc/32/56/33/511325633.db2.gz AWVIOTRYKHDNFQ-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291762547 511327680 /nfs/dbraw/zinc/32/76/80/511327680.db2.gz LGPMXEOESRVMEP-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291762547 511327684 /nfs/dbraw/zinc/32/76/84/511327684.db2.gz LGPMXEOESRVMEP-YWZLYKJASA-N 1 1 369.421 2.558 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000363097936 511352303 /nfs/dbraw/zinc/35/23/03/511352303.db2.gz RUKYGYOJSYWCCH-CVEARBPZSA-N 1 1 358.442 2.552 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000363099619 511352444 /nfs/dbraw/zinc/35/24/44/511352444.db2.gz WUANTXJMKLOOLW-MNOVXSKESA-N 1 1 370.356 2.945 20 5 FFBDMO Cc1cc(CNC(=O)CNc2ccccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000291938218 511398752 /nfs/dbraw/zinc/39/87/52/511398752.db2.gz PGGISTRSTUWZLF-UHFFFAOYSA-N 1 1 369.425 2.627 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000291945526 511401437 /nfs/dbraw/zinc/40/14/37/511401437.db2.gz PYUVLBSXAIHDND-WMZOPIPTSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000291945526 511401442 /nfs/dbraw/zinc/40/14/42/511401442.db2.gz PYUVLBSXAIHDND-WMZOPIPTSA-N 1 1 357.410 2.813 20 5 FFBDMO C[C@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295450090 511409129 /nfs/dbraw/zinc/40/91/29/511409129.db2.gz WNTXISWLMADCQG-CQSZACIVSA-N 1 1 359.426 2.500 20 5 FFBDMO C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+](C2CCC2)C1 ZINC000292077880 511457197 /nfs/dbraw/zinc/45/71/97/511457197.db2.gz DBMJHAIKDLJJRG-CQSZACIVSA-N 1 1 371.441 2.951 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000365490753 511483431 /nfs/dbraw/zinc/48/34/31/511483431.db2.gz XWTSSCWBIKPRSU-LBPRGKRZSA-N 1 1 370.356 2.898 20 5 FFBDMO CNC(=O)[C@]1(C)CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000280484333 511483649 /nfs/dbraw/zinc/48/36/49/511483649.db2.gz AHGBHRQFCMRISP-OAQYLSRUSA-N 1 1 350.418 2.904 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000272260127 511483936 /nfs/dbraw/zinc/48/39/36/511483936.db2.gz UYIVZEXPWSBZCG-IUODEOHRSA-N 1 1 355.385 2.875 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O ZINC000272267483 511485399 /nfs/dbraw/zinc/48/53/99/511485399.db2.gz AOUOGGRNOMSNKD-HZPDHXFCSA-N 1 1 350.415 2.690 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O ZINC000272267483 511485404 /nfs/dbraw/zinc/48/54/04/511485404.db2.gz AOUOGGRNOMSNKD-HZPDHXFCSA-N 1 1 350.415 2.690 20 5 FFBDMO O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc2ccccc2c2cccnc12 ZINC000363377099 511512790 /nfs/dbraw/zinc/51/27/90/511512790.db2.gz WRKNZRAVCLNKJA-IAGOWNOFSA-N 1 1 361.445 2.981 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3cccc(F)c3[N+](=O)[O-])cc2)CC1 ZINC000299174372 511540171 /nfs/dbraw/zinc/54/01/71/511540171.db2.gz ZZTMQOJGSARSND-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO O=C1[C@H]([NH+]2CCC(c3ccccn3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000363447985 511558583 /nfs/dbraw/zinc/55/85/83/511558583.db2.gz XECOZMUUJRLDRO-LJQANCHMSA-N 1 1 366.421 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3nncn3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000284081448 511598687 /nfs/dbraw/zinc/59/86/87/511598687.db2.gz LKQLUVHHUFKSFR-ZDUSSCGKSA-N 1 1 372.385 2.809 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000284081448 511598692 /nfs/dbraw/zinc/59/86/92/511598692.db2.gz LKQLUVHHUFKSFR-ZDUSSCGKSA-N 1 1 372.385 2.809 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)nc1 ZINC000274044783 511703624 /nfs/dbraw/zinc/70/36/24/511703624.db2.gz YDLIHYLRKMPFIM-FUHWJXTLSA-N 1 1 353.426 2.876 20 5 FFBDMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000302968866 511721408 /nfs/dbraw/zinc/72/14/08/511721408.db2.gz HXERPBCZMAQJET-CQSZACIVSA-N 1 1 367.427 2.549 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000292839336 511740483 /nfs/dbraw/zinc/74/04/83/511740483.db2.gz SBOFEZKJLWGODX-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000292839336 511740485 /nfs/dbraw/zinc/74/04/85/511740485.db2.gz SBOFEZKJLWGODX-ZDUSSCGKSA-N 1 1 364.423 2.721 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000296450741 511747763 /nfs/dbraw/zinc/74/77/63/511747763.db2.gz IQIPVKGUXWYONM-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450741 511747768 /nfs/dbraw/zinc/74/77/68/511747768.db2.gz IQIPVKGUXWYONM-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450741 511747772 /nfs/dbraw/zinc/74/77/72/511747772.db2.gz IQIPVKGUXWYONM-KSSFIOAISA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000296450747 511748371 /nfs/dbraw/zinc/74/83/71/511748371.db2.gz IQIPVKGUXWYONM-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450747 511748378 /nfs/dbraw/zinc/74/83/78/511748378.db2.gz IQIPVKGUXWYONM-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450747 511748385 /nfs/dbraw/zinc/74/83/85/511748385.db2.gz IQIPVKGUXWYONM-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000292980137 511794735 /nfs/dbraw/zinc/79/47/35/511794735.db2.gz HGUAIDSQIRRRBH-GOSISDBHSA-N 1 1 350.415 2.692 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000296687040 511853780 /nfs/dbraw/zinc/85/37/80/511853780.db2.gz JEGHRDQJNZEDBB-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C2CC2)C[C@H](C)C1 ZINC000296687040 511853782 /nfs/dbraw/zinc/85/37/82/511853782.db2.gz JEGHRDQJNZEDBB-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C2CC2)C[C@H](C)C1 ZINC000296687040 511853786 /nfs/dbraw/zinc/85/37/86/511853786.db2.gz JEGHRDQJNZEDBB-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000366141308 511863290 /nfs/dbraw/zinc/86/32/90/511863290.db2.gz BHVPSNVEHBNFQX-LRDDRELGSA-N 1 1 360.439 2.864 20 5 FFBDMO Cc1cc(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2ccnn2C)ncc1[N+](=O)[O-] ZINC000284802877 511876398 /nfs/dbraw/zinc/87/63/98/511876398.db2.gz IENLURBIYHSSJU-KBXCAEBGSA-N 1 1 358.446 2.551 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000274580738 511879252 /nfs/dbraw/zinc/87/92/52/511879252.db2.gz SGIOJASEKYRLAE-OAHLLOKOSA-N 1 1 359.430 2.513 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000293282849 511907207 /nfs/dbraw/zinc/90/72/07/511907207.db2.gz VODUOUGUIBMSAZ-GFCCVEGCSA-N 1 1 360.357 2.594 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000293282849 511907212 /nfs/dbraw/zinc/90/72/12/511907212.db2.gz VODUOUGUIBMSAZ-GFCCVEGCSA-N 1 1 360.357 2.594 20 5 FFBDMO CCC(=O)c1ccc(N2CC[C@@H](N3CC[NH+](C)CC3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000366430489 512020252 /nfs/dbraw/zinc/02/02/52/512020252.db2.gz NMSOXBARGMXMJL-NVXWUHKLSA-N 1 1 374.485 2.650 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)C2)C1 ZINC000366533838 512076340 /nfs/dbraw/zinc/07/63/40/512076340.db2.gz UNWNSBJODNRAGI-SFHVURJKSA-N 1 1 372.450 2.886 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000377917709 512511611 /nfs/dbraw/zinc/51/16/11/512511611.db2.gz RXYCEAYCDONAJL-QWHCGFSZSA-N 1 1 373.413 2.533 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028061 512630345 /nfs/dbraw/zinc/63/03/45/512630345.db2.gz VYVMGPPATCRFJP-IXDOHACOSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028061 512630347 /nfs/dbraw/zinc/63/03/47/512630347.db2.gz VYVMGPPATCRFJP-IXDOHACOSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028061 512630349 /nfs/dbraw/zinc/63/03/49/512630349.db2.gz VYVMGPPATCRFJP-IXDOHACOSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000374410675 512820810 /nfs/dbraw/zinc/82/08/10/512820810.db2.gz IJTMQHOQSSECKJ-JHJVBQTASA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1 ZINC000374410675 512820814 /nfs/dbraw/zinc/82/08/14/512820814.db2.gz IJTMQHOQSSECKJ-JHJVBQTASA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000411981814 512900805 /nfs/dbraw/zinc/90/08/05/512900805.db2.gz JDDKRISUDJXDSQ-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO Cc1ccnc(C2CC[NH+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000368328502 512901349 /nfs/dbraw/zinc/90/13/49/512901349.db2.gz PQDSZFBZROUNQP-AWEZNQCLSA-N 1 1 369.425 2.900 20 5 FFBDMO COC(=O)[C@@H]1CSCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000412071605 512943334 /nfs/dbraw/zinc/94/33/34/512943334.db2.gz JITKNIPXQUCQGR-AWEZNQCLSA-N 1 1 368.455 2.720 20 5 FFBDMO COC(=O)[C@@H]1CSCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000412071605 512943337 /nfs/dbraw/zinc/94/33/37/512943337.db2.gz JITKNIPXQUCQGR-AWEZNQCLSA-N 1 1 368.455 2.720 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c2c(c1)COCO2 ZINC000370719308 513069130 /nfs/dbraw/zinc/06/91/30/513069130.db2.gz KIMHEIPBLVKPSB-OAHLLOKOSA-N 1 1 355.394 2.921 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000370827327 513114540 /nfs/dbraw/zinc/11/45/40/513114540.db2.gz RXEMTLIWGAXAMB-CYBMUJFWSA-N 1 1 357.332 2.924 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000368848224 513121004 /nfs/dbraw/zinc/12/10/04/513121004.db2.gz VBGHIJQQJDMJDQ-KRWDZBQOSA-N 1 1 361.398 2.870 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)n[nH]1)CC2 ZINC000450579934 513259981 /nfs/dbraw/zinc/25/99/81/513259981.db2.gz MUUMLEADPFCEIB-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO C[N@@H+]1CCCC12CCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)CC2 ZINC000450579934 513259986 /nfs/dbraw/zinc/25/99/86/513259986.db2.gz MUUMLEADPFCEIB-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc(-c3ccc([N+](=O)[O-])cc3)[nH]n1)CC2 ZINC000450579934 513259991 /nfs/dbraw/zinc/25/99/91/513259991.db2.gz MUUMLEADPFCEIB-UHFFFAOYSA-N 1 1 369.425 2.685 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000434424051 513319846 /nfs/dbraw/zinc/31/98/46/513319846.db2.gz HLZVUZVVBVCJAP-KRWDZBQOSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413029549 513393709 /nfs/dbraw/zinc/39/37/09/513393709.db2.gz GIAUFYSXLSXLJO-GFCCVEGCSA-N 1 1 362.352 2.777 20 5 FFBDMO C[C@H](CN1CCOCC1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425466409 513581463 /nfs/dbraw/zinc/58/14/63/513581463.db2.gz ASXMYQPUWWFHCR-GFCCVEGCSA-N 1 1 372.263 2.510 20 5 FFBDMO C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425466409 513581465 /nfs/dbraw/zinc/58/14/65/513581465.db2.gz ASXMYQPUWWFHCR-GFCCVEGCSA-N 1 1 372.263 2.510 20 5 FFBDMO CN(C(=O)C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000425558451 513639540 /nfs/dbraw/zinc/63/95/40/513639540.db2.gz XQPKCVCLJFOORZ-IBGZPJMESA-N 1 1 373.453 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)cc1 ZINC000435629702 513643913 /nfs/dbraw/zinc/64/39/13/513643913.db2.gz USVMVVUQPHTKMQ-MRXNPFEDSA-N 1 1 367.471 2.670 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000447982648 513646840 /nfs/dbraw/zinc/64/68/40/513646840.db2.gz MFBVENCTYWPXNS-MRXNPFEDSA-N 1 1 364.446 2.523 20 5 FFBDMO C[N@H+]1CC[C@@H](CNC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000436070264 513752113 /nfs/dbraw/zinc/75/21/13/513752113.db2.gz VLVQYPKVCIBUJH-NSHDSACASA-N 1 1 371.387 2.641 20 5 FFBDMO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H](C)C[N@H+]1CCO ZINC000419340194 513783675 /nfs/dbraw/zinc/78/36/75/513783675.db2.gz NAYPZTJSWGAJKH-NEPJUHHUSA-N 1 1 361.364 2.501 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@@H]1C ZINC000451522737 513805178 /nfs/dbraw/zinc/80/51/78/513805178.db2.gz BRHLXPCNNKXSNP-XJKSGUPXSA-N 1 1 363.414 2.640 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436255189 513807927 /nfs/dbraw/zinc/80/79/27/513807927.db2.gz WPXDTLLJZKRRAH-KRWDZBQOSA-N 1 1 361.442 2.887 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@@H]3CCCS(=O)(=O)C3)C2)cc1 ZINC000451551213 513828454 /nfs/dbraw/zinc/82/84/54/513828454.db2.gz TWGUDNAGOYWUIQ-GOEBONIOSA-N 1 1 352.456 2.599 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000451566723 513837809 /nfs/dbraw/zinc/83/78/09/513837809.db2.gz OURZFUABTVMZFQ-MLGOLLRUSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000451566723 513837814 /nfs/dbraw/zinc/83/78/14/513837814.db2.gz OURZFUABTVMZFQ-MLGOLLRUSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000451566722 513837840 /nfs/dbraw/zinc/83/78/40/513837840.db2.gz OURZFUABTVMZFQ-LRDDRELGSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](OC)C(C)(C)C1 ZINC000451566722 513837845 /nfs/dbraw/zinc/83/78/45/513837845.db2.gz OURZFUABTVMZFQ-LRDDRELGSA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448780394 513896192 /nfs/dbraw/zinc/89/61/92/513896192.db2.gz JTEABVRVSHWLKH-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000413956762 513899815 /nfs/dbraw/zinc/89/98/15/513899815.db2.gz OHPJJCXFBZTTRM-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000413956762 513899822 /nfs/dbraw/zinc/89/98/22/513899822.db2.gz OHPJJCXFBZTTRM-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000431717971 513978156 /nfs/dbraw/zinc/97/81/56/513978156.db2.gz AYGHZFYFGMRCDJ-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@H]2CCCC[C@H]2O)CC1 ZINC000449183342 514103958 /nfs/dbraw/zinc/10/39/58/514103958.db2.gz FQWYKWQCZFJELI-UIAACRFSSA-N 1 1 361.486 2.883 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000420463279 514158280 /nfs/dbraw/zinc/15/82/80/514158280.db2.gz RSAUVKVFWHFMPF-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420581459 514190376 /nfs/dbraw/zinc/19/03/76/514190376.db2.gz GZLHVIRLYSEKAS-ZFWWWQNUSA-N 1 1 354.410 2.941 20 5 FFBDMO CN(c1c(C(N)=O)cccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000420606905 514198305 /nfs/dbraw/zinc/19/83/05/514198305.db2.gz YXXPRBSYWUMQIO-INIZCTEOSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000452120839 514204933 /nfs/dbraw/zinc/20/49/33/514204933.db2.gz JNTUOKHUXPMVJV-DAYGRLMNSA-N 1 1 373.453 2.746 20 5 FFBDMO CO[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H]1O ZINC000449570347 514257931 /nfs/dbraw/zinc/25/79/31/514257931.db2.gz HDEVKXZYGHFMQR-GDBMZVCRSA-N 1 1 352.774 2.700 20 5 FFBDMO CCc1ccc([C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[NH+](C)C)cc1 ZINC000427919944 514346739 /nfs/dbraw/zinc/34/67/39/514346739.db2.gz CKMZYKHHGAMOCJ-GOSISDBHSA-N 1 1 357.410 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C ZINC000444896553 514363321 /nfs/dbraw/zinc/36/33/21/514363321.db2.gz MMDNJTKMWZUHCW-QWHCGFSZSA-N 1 1 350.419 2.940 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000444909727 514366044 /nfs/dbraw/zinc/36/60/44/514366044.db2.gz ZIDPMVZZIGIGJF-BETUJISGSA-N 1 1 350.419 2.988 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C[C@@H]1C ZINC000449971136 514447559 /nfs/dbraw/zinc/44/75/59/514447559.db2.gz JSYSWFMKGGLGER-HOCLYGCPSA-N 1 1 371.441 2.725 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000450019509 514468223 /nfs/dbraw/zinc/46/82/23/514468223.db2.gz UXMYBHBYWSOYLN-MRXNPFEDSA-N 1 1 373.453 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@]1([NH+]2CCOCC2)CCSC1 ZINC000450270040 514573077 /nfs/dbraw/zinc/57/30/77/514573077.db2.gz PWJRHEJKYSYACU-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1nc(-c3ccccn3)n[nH]1)CCC2 ZINC000453364213 514609287 /nfs/dbraw/zinc/60/92/87/514609287.db2.gz QZRSOEYINYFFGP-OAHLLOKOSA-N 1 1 350.382 2.942 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000458201326 514622630 /nfs/dbraw/zinc/62/26/30/514622630.db2.gz WOFKZVXTETUMOG-MRXNPFEDSA-N 1 1 374.485 2.659 20 5 FFBDMO COc1cccc(N[C@H](C)C[NH+]2CCN(c3ccccn3)CC2)c1[N+](=O)[O-] ZINC000475385526 514642970 /nfs/dbraw/zinc/64/29/70/514642970.db2.gz FRNPZVYREPTBKJ-OAHLLOKOSA-N 1 1 371.441 2.621 20 5 FFBDMO CS[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1N1CCCC1 ZINC000484633175 514720860 /nfs/dbraw/zinc/72/08/60/514720860.db2.gz CRPBGFCFONKGCN-ZWKOTPCHSA-N 1 1 365.499 2.875 20 5 FFBDMO CS[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1N1CCCC1 ZINC000484633175 514720869 /nfs/dbraw/zinc/72/08/69/514720869.db2.gz CRPBGFCFONKGCN-ZWKOTPCHSA-N 1 1 365.499 2.875 20 5 FFBDMO CC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCc2ccccc2C1 ZINC000498038084 514733313 /nfs/dbraw/zinc/73/33/13/514733313.db2.gz JKNYNFLUWVKWQL-INIZCTEOSA-N 1 1 356.426 2.500 20 5 FFBDMO Cc1cc(N[C@@H](C)C[NH+]2CCN(C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461935083 514794811 /nfs/dbraw/zinc/79/48/11/514794811.db2.gz JERJGMQNQHCXHK-LBPRGKRZSA-N 1 1 360.380 2.970 20 5 FFBDMO Cc1cc(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)c(F)cc1[N+](=O)[O-] ZINC000461955354 514804251 /nfs/dbraw/zinc/80/42/51/514804251.db2.gz LMGMIMKMQCCPNC-OAHLLOKOSA-N 1 1 350.438 2.649 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000466923252 514829110 /nfs/dbraw/zinc/82/91/10/514829110.db2.gz JFNHNDHENWGVBG-RDTXWAMCSA-N 1 1 360.458 2.998 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000489416113 514837241 /nfs/dbraw/zinc/83/72/41/514837241.db2.gz YYMHWPAUFUCVHA-DAYGRLMNSA-N 1 1 360.458 2.509 20 5 FFBDMO O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000467103169 514900759 /nfs/dbraw/zinc/90/07/59/514900759.db2.gz VCHWKCNEUWTJJO-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000467409383 514998788 /nfs/dbraw/zinc/99/87/88/514998788.db2.gz WSBVLWHOGLXQKL-MNOVXSKESA-N 1 1 361.489 2.506 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000467409383 514998797 /nfs/dbraw/zinc/99/87/97/514998797.db2.gz WSBVLWHOGLXQKL-MNOVXSKESA-N 1 1 361.489 2.506 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC[NH+](CC)CC)Cc2ccccc2)c1[N+](=O)[O-] ZINC000485370995 515011438 /nfs/dbraw/zinc/01/14/38/515011438.db2.gz GXIFBVACJFPFAA-UHFFFAOYSA-N 1 1 373.457 2.865 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000503473112 515045796 /nfs/dbraw/zinc/04/57/96/515045796.db2.gz VNWNNCDGJIZKFD-OAHLLOKOSA-N 1 1 372.425 2.755 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000489977141 515055592 /nfs/dbraw/zinc/05/55/92/515055592.db2.gz DQZLDRMLMUXANS-VXGBXAGGSA-N 1 1 368.231 2.714 20 5 FFBDMO CSc1cccc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c1[N+](=O)[O-] ZINC000485514700 515068474 /nfs/dbraw/zinc/06/84/74/515068474.db2.gz LFXVULSFMNZNIP-UHFFFAOYSA-N 1 1 372.450 2.983 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000456342148 515110600 /nfs/dbraw/zinc/11/06/00/515110600.db2.gz FPFCTTZAPVJYDX-AWEZNQCLSA-N 1 1 357.414 2.541 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000498991528 515157691 /nfs/dbraw/zinc/15/76/91/515157691.db2.gz PEEPLKAZILSAQF-GWCFXTLKSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000498991528 515157698 /nfs/dbraw/zinc/15/76/98/515157698.db2.gz PEEPLKAZILSAQF-GWCFXTLKSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000476696909 515161911 /nfs/dbraw/zinc/16/19/11/515161911.db2.gz VVZAFWUDJXDZOG-YOEHRIQHSA-N 1 1 369.421 2.854 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000481039719 515184089 /nfs/dbraw/zinc/18/40/89/515184089.db2.gz OBDLGICHQJMMJN-HUUCEWRRSA-N 1 1 369.487 2.753 20 5 FFBDMO Cn1c(C(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000490512226 515234123 /nfs/dbraw/zinc/23/41/23/515234123.db2.gz CBJGNCRPOXSVNJ-LJQANCHMSA-N 1 1 356.426 2.718 20 5 FFBDMO CNc1c(C(=O)NCCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000462913616 515296559 /nfs/dbraw/zinc/29/65/59/515296559.db2.gz VBOZCDZWZXZWBS-UHFFFAOYSA-N 1 1 368.437 2.815 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510847 515354865 /nfs/dbraw/zinc/35/48/65/515354865.db2.gz NTGCSIJXIZNIIR-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510847 515354873 /nfs/dbraw/zinc/35/48/73/515354873.db2.gz NTGCSIJXIZNIIR-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000463072975 515359560 /nfs/dbraw/zinc/35/95/60/515359560.db2.gz XRMWKVZCZJRTED-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 ZINC000510089592 515430562 /nfs/dbraw/zinc/43/05/62/515430562.db2.gz WXABREHIBCKDLP-RTBURBONSA-N 1 1 358.442 2.596 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493443510 515633210 /nfs/dbraw/zinc/63/32/10/515633210.db2.gz SONUSNUPBNTFTP-OLZOCXBDSA-N 1 1 369.849 2.611 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[NH+](Cc4cccs4)CC3)nc2c1 ZINC000510776331 515664798 /nfs/dbraw/zinc/66/47/98/515664798.db2.gz HQANNFFMCQYTRK-UHFFFAOYSA-N 1 1 357.439 2.850 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1SC ZINC000457127124 515670957 /nfs/dbraw/zinc/67/09/57/515670957.db2.gz REJLBPMKJKUWPQ-LBPRGKRZSA-N 1 1 367.471 2.880 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000494006103 515711472 /nfs/dbraw/zinc/71/14/72/515711472.db2.gz GEEPOXXILYVORV-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO CCOc1ccc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000505899908 515717086 /nfs/dbraw/zinc/71/70/86/515717086.db2.gz VOLWOQBBEINPES-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000459721952 515769941 /nfs/dbraw/zinc/76/99/41/515769941.db2.gz UJMMQAKRNKKMQM-HNNXBMFYSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511138728 515800763 /nfs/dbraw/zinc/80/07/63/515800763.db2.gz OUOTWODQMDAUJP-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511138728 515800768 /nfs/dbraw/zinc/80/07/68/515800768.db2.gz OUOTWODQMDAUJP-ZDUSSCGKSA-N 1 1 371.393 2.825 20 5 FFBDMO CCN(C)C(=O)[C@H](C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000473998098 515836242 /nfs/dbraw/zinc/83/62/42/515836242.db2.gz ZTXXEKXDCKLOOF-LBPRGKRZSA-N 1 1 361.398 2.820 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000506479478 515892330 /nfs/dbraw/zinc/89/23/30/515892330.db2.gz XSKAZJISIMLFML-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000494669779 515918816 /nfs/dbraw/zinc/91/88/16/515918816.db2.gz CSIPEUQGRYEFIX-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c4ccccc4ncc3[N+](=O)[O-])CC2)CCO1 ZINC000488063183 516101472 /nfs/dbraw/zinc/10/14/72/516101472.db2.gz JGZLOBBVGVJYFT-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474779231 516191300 /nfs/dbraw/zinc/19/13/00/516191300.db2.gz FMJUDTFRAKUNSW-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000470359789 516218893 /nfs/dbraw/zinc/21/88/93/516218893.db2.gz UCXQFVGZYUKLJB-KRWDZBQOSA-N 1 1 362.474 2.947 20 5 FFBDMO CCOC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000488741183 516297579 /nfs/dbraw/zinc/29/75/79/516297579.db2.gz BLZCGOZKVSEBHT-HBUWYVDXSA-N 1 1 361.442 2.938 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000561153617 516412277 /nfs/dbraw/zinc/41/22/77/516412277.db2.gz FPRUCWBJWZQGDK-UKRRQHHQSA-N 1 1 354.410 2.941 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000536037554 516602677 /nfs/dbraw/zinc/60/26/77/516602677.db2.gz YJBQSDIAULAUFR-OAHLLOKOSA-N 1 1 371.393 2.529 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000536037554 516602686 /nfs/dbraw/zinc/60/26/86/516602686.db2.gz YJBQSDIAULAUFR-OAHLLOKOSA-N 1 1 371.393 2.529 20 5 FFBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544147274 516614100 /nfs/dbraw/zinc/61/41/00/516614100.db2.gz YSRSHCDXRVZLEY-RDJZCZTQSA-N 1 1 374.437 2.906 20 5 FFBDMO C[N@@H+](CCN1CCN(Cc2csc([N+](=O)[O-])c2)CC1)Cc1ccccc1 ZINC000513443733 516623897 /nfs/dbraw/zinc/62/38/97/516623897.db2.gz OUBLLVMQXJWTHK-UHFFFAOYSA-N 1 1 374.510 2.906 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000536158457 516657424 /nfs/dbraw/zinc/65/74/24/516657424.db2.gz RLCYRHCETANAEJ-SFHVURJKSA-N 1 1 362.474 2.947 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1ccc(F)cc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000561611900 516681037 /nfs/dbraw/zinc/68/10/37/516681037.db2.gz NZAJCLNISKQCPX-CQSZACIVSA-N 1 1 367.764 2.649 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000544298834 516687124 /nfs/dbraw/zinc/68/71/24/516687124.db2.gz GSDGHAAOEQYZJH-KBPBESRZSA-N 1 1 364.446 2.666 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccccc1O)c1ccc([N+](=O)[O-])cc1 ZINC000513703413 516725413 /nfs/dbraw/zinc/72/54/13/516725413.db2.gz VKUSYZSNQHYRJF-SFHVURJKSA-N 1 1 352.394 2.956 20 5 FFBDMO Cc1c(Br)c(N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)ncc1[N+](=O)[O-] ZINC000544395000 516739075 /nfs/dbraw/zinc/73/90/75/516739075.db2.gz SXENLPYTDSYSAG-NWDGAFQWSA-N 1 1 369.263 2.981 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCn1cc(Br)cn1 ZINC000561791955 516773502 /nfs/dbraw/zinc/77/35/02/516773502.db2.gz HDMUEZWOTJMYOD-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCn1cc(Br)cn1 ZINC000561791955 516773511 /nfs/dbraw/zinc/77/35/11/516773511.db2.gz HDMUEZWOTJMYOD-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000524716444 516800112 /nfs/dbraw/zinc/80/01/12/516800112.db2.gz LNGZGFYVSYLQMS-QGZVFWFLSA-N 1 1 370.453 2.918 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000532139250 516821832 /nfs/dbraw/zinc/82/18/32/516821832.db2.gz YIUHIKDHRICZKJ-OKILXGFUSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cn3)c2)C[C@H](C)O1 ZINC000532139250 516821837 /nfs/dbraw/zinc/82/18/37/516821837.db2.gz YIUHIKDHRICZKJ-OKILXGFUSA-N 1 1 370.409 2.851 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)C(=O)NCC2 ZINC000544599935 516831807 /nfs/dbraw/zinc/83/18/07/516831807.db2.gz RJZCDKGFLBYGMI-UHFFFAOYSA-N 1 1 355.394 2.569 20 5 FFBDMO NC(=O)c1ccc(N2CC[NH+](C/C=C\c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000536681686 516892263 /nfs/dbraw/zinc/89/22/63/516892263.db2.gz QYFQLIJZIIPWEP-HYXAFXHYSA-N 1 1 366.421 2.529 20 5 FFBDMO COc1ccccc1[C@H](C)NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558739773 516922924 /nfs/dbraw/zinc/92/29/24/516922924.db2.gz UNPNGWOLUSZUCF-HNNXBMFYSA-N 1 1 371.437 2.955 20 5 FFBDMO COc1ccccc1[C@H](C)NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558739773 516922935 /nfs/dbraw/zinc/92/29/35/516922935.db2.gz UNPNGWOLUSZUCF-HNNXBMFYSA-N 1 1 371.437 2.955 20 5 FFBDMO CN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000532583166 517046943 /nfs/dbraw/zinc/04/69/43/517046943.db2.gz VFWURGRWDVZEHR-QGZVFWFLSA-N 1 1 356.426 2.961 20 5 FFBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCN(C2CC2)C1 ZINC000532583166 517046951 /nfs/dbraw/zinc/04/69/51/517046951.db2.gz VFWURGRWDVZEHR-QGZVFWFLSA-N 1 1 356.426 2.961 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCN(C2CC2)C1 ZINC000532583166 517046960 /nfs/dbraw/zinc/04/69/60/517046960.db2.gz VFWURGRWDVZEHR-QGZVFWFLSA-N 1 1 356.426 2.961 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000562394714 517076961 /nfs/dbraw/zinc/07/69/61/517076961.db2.gz DTELQAWOAURUPR-QAPCUYQASA-N 1 1 363.458 2.561 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(N[C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2C1 ZINC000519620276 517083437 /nfs/dbraw/zinc/08/34/37/517083437.db2.gz YSGNWMFXJAVNHU-GOSISDBHSA-N 1 1 366.421 2.538 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(N[C@@H]3CCc4c3cccc4[N+](=O)[O-])cc2C1 ZINC000519620276 517083444 /nfs/dbraw/zinc/08/34/44/517083444.db2.gz YSGNWMFXJAVNHU-GOSISDBHSA-N 1 1 366.421 2.538 20 5 FFBDMO Cc1c(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cccc1[N+](=O)[O-] ZINC000552198735 517135382 /nfs/dbraw/zinc/13/53/82/517135382.db2.gz DRKDVVWUBQJDKG-MRXNPFEDSA-N 1 1 355.394 2.722 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969807 517228313 /nfs/dbraw/zinc/22/83/13/517228313.db2.gz BBXUUNWRKRCZMK-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000532969807 517228318 /nfs/dbraw/zinc/22/83/18/517228318.db2.gz BBXUUNWRKRCZMK-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000537613111 517256310 /nfs/dbraw/zinc/25/63/10/517256310.db2.gz CKSUWZGMGVUAPM-GDBMZVCRSA-N 1 1 356.426 2.574 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H]1C ZINC000520274583 517326978 /nfs/dbraw/zinc/32/69/78/517326978.db2.gz MRKPMEXVRJFTEY-KBXCAEBGSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1ccc(C[C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000515469985 517366267 /nfs/dbraw/zinc/36/62/67/517366267.db2.gz HPTIXRXXTYOQJS-QGZVFWFLSA-N 1 1 371.437 2.720 20 5 FFBDMO C[C@H]1CO[C@@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)C[N@@H+]1Cc1ccccc1 ZINC000545814672 517378214 /nfs/dbraw/zinc/37/82/14/517378214.db2.gz XZXQBCGLGFPTKV-BLLLJJGKSA-N 1 1 369.381 2.935 20 5 FFBDMO C[C@H]1CO[C@@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)C[N@H+]1Cc1ccccc1 ZINC000545814672 517378220 /nfs/dbraw/zinc/37/82/20/517378220.db2.gz XZXQBCGLGFPTKV-BLLLJJGKSA-N 1 1 369.381 2.935 20 5 FFBDMO CC(C)(CS(C)(=O)=O)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000545872302 517405127 /nfs/dbraw/zinc/40/51/27/517405127.db2.gz FRHNLZKRPGTRFV-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO CO[C@@H](C)C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C(C)C ZINC000533429080 517459189 /nfs/dbraw/zinc/45/91/89/517459189.db2.gz CAIOCYDPRXUQFW-ZDUSSCGKSA-N 1 1 351.403 2.638 20 5 FFBDMO COCC[N@@H+]1CC[C@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000520755794 517499552 /nfs/dbraw/zinc/49/95/52/517499552.db2.gz ADWPQIAMPXXJCU-KRWDZBQOSA-N 1 1 369.421 2.958 20 5 FFBDMO COCC[N@H+]1CC[C@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000520755794 517499561 /nfs/dbraw/zinc/49/95/61/517499561.db2.gz ADWPQIAMPXXJCU-KRWDZBQOSA-N 1 1 369.421 2.958 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000538229446 517514009 /nfs/dbraw/zinc/51/40/09/517514009.db2.gz PZNICBDCEUWOKN-UHFFFAOYSA-N 1 1 369.377 2.849 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000553162270 517551098 /nfs/dbraw/zinc/55/10/98/517551098.db2.gz LLGMGUPRJVUCBC-GFCCVEGCSA-N 1 1 360.439 2.638 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000563002138 517572249 /nfs/dbraw/zinc/57/22/49/517572249.db2.gz CFEXHXMGWRXRGM-SNVBAGLBSA-N 1 1 374.290 2.681 20 5 FFBDMO CCc1cc(N[C@@H]2CCc3[nH+]c[nH]c3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549519926 517597843 /nfs/dbraw/zinc/59/78/43/517597843.db2.gz DWUNMYIUABCNNO-CQSZACIVSA-N 1 1 364.409 2.729 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000533830645 517630623 /nfs/dbraw/zinc/63/06/23/517630623.db2.gz AXALLWSUAUHOGY-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000533830645 517630632 /nfs/dbraw/zinc/63/06/32/517630632.db2.gz AXALLWSUAUHOGY-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000516268486 517644331 /nfs/dbraw/zinc/64/43/31/517644331.db2.gz FEUYGQPSIDALPP-HNNXBMFYSA-N 1 1 364.448 2.805 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542781115 517736734 /nfs/dbraw/zinc/73/67/34/517736734.db2.gz IVLJWYNCAHAIOK-ZDUSSCGKSA-N 1 1 368.865 2.964 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2CO)cc1OC ZINC000542916530 517814081 /nfs/dbraw/zinc/81/40/81/517814081.db2.gz XNVYETBKFRGALE-HIFRSBDPSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2CO)cc1OC ZINC000542916530 517814089 /nfs/dbraw/zinc/81/40/89/517814089.db2.gz XNVYETBKFRGALE-HIFRSBDPSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1)CC1CC1 ZINC000538934964 517851175 /nfs/dbraw/zinc/85/11/75/517851175.db2.gz UHGJCKRYJPVZQM-UHFFFAOYSA-N 1 1 362.474 2.908 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000534516830 517923285 /nfs/dbraw/zinc/92/32/85/517923285.db2.gz VITWQEXIQBCVHF-GJZGRUSLSA-N 1 1 360.458 2.783 20 5 FFBDMO C[N@@H+](Cc1nc2ccccc2o1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543138674 517928379 /nfs/dbraw/zinc/92/83/79/517928379.db2.gz JACMWAKTXCKIEL-ZDUSSCGKSA-N 1 1 357.366 2.608 20 5 FFBDMO C[N@H+](Cc1nc2ccccc2o1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543138674 517928391 /nfs/dbraw/zinc/92/83/91/517928391.db2.gz JACMWAKTXCKIEL-ZDUSSCGKSA-N 1 1 357.366 2.608 20 5 FFBDMO CCOc1ccc2c(c1)CC[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC000543138965 517928777 /nfs/dbraw/zinc/92/87/77/517928777.db2.gz ILYNHQVTFJADOR-QGZVFWFLSA-N 1 1 372.421 2.792 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000522107261 517986659 /nfs/dbraw/zinc/98/66/59/517986659.db2.gz WNLFRMNXXWYGDQ-HNNXBMFYSA-N 1 1 360.458 2.973 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000534690265 518001951 /nfs/dbraw/zinc/00/19/51/518001951.db2.gz FUWRNLVIYNKVEC-SFHVURJKSA-N 1 1 368.437 2.711 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000550433215 518052806 /nfs/dbraw/zinc/05/28/06/518052806.db2.gz FQAFWZCGKCCHCR-GOSISDBHSA-N 1 1 360.414 2.875 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000550433215 518052815 /nfs/dbraw/zinc/05/28/15/518052815.db2.gz FQAFWZCGKCCHCR-GOSISDBHSA-N 1 1 360.414 2.875 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000522364765 518088278 /nfs/dbraw/zinc/08/82/78/518088278.db2.gz BJLIFOBMXLCTDQ-CXAGYDPISA-N 1 1 367.421 2.601 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)ncc1[N+](=O)[O-] ZINC000543436810 518091389 /nfs/dbraw/zinc/09/13/89/518091389.db2.gz SPPOWISHLQPKNZ-MNOVXSKESA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3CC[N@@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000543437172 518091535 /nfs/dbraw/zinc/09/15/35/518091535.db2.gz SAWBGHOSHTYCNP-ZYHUDNBSSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3CC[N@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000543437172 518091546 /nfs/dbraw/zinc/09/15/46/518091546.db2.gz SAWBGHOSHTYCNP-ZYHUDNBSSA-N 1 1 355.236 2.591 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000563747777 518104103 /nfs/dbraw/zinc/10/41/03/518104103.db2.gz QGRXAGPSNKACJA-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042403 518134004 /nfs/dbraw/zinc/13/40/04/518134004.db2.gz GJSXODSGSCKGIR-LSDHHAIUSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000535042403 518134008 /nfs/dbraw/zinc/13/40/08/518134008.db2.gz GJSXODSGSCKGIR-LSDHHAIUSA-N 1 1 356.426 2.668 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)c1 ZINC000543585130 518145773 /nfs/dbraw/zinc/14/57/73/518145773.db2.gz IEMWIDHXNWXJLH-IEBWSBKVSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@@H](C3CCCCC3)C2)c1 ZINC000543585130 518145777 /nfs/dbraw/zinc/14/57/77/518145777.db2.gz IEMWIDHXNWXJLH-IEBWSBKVSA-N 1 1 364.442 2.616 20 5 FFBDMO CNC(=O)c1ccc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000578944504 518445327 /nfs/dbraw/zinc/44/53/27/518445327.db2.gz GGTKNGCWZLMZRQ-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO CCCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113622 518529490 /nfs/dbraw/zinc/52/94/90/518529490.db2.gz UACVBLCPCXKJOH-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113622 518529493 /nfs/dbraw/zinc/52/94/93/518529493.db2.gz UACVBLCPCXKJOH-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000579113622 518529497 /nfs/dbraw/zinc/52/94/97/518529497.db2.gz UACVBLCPCXKJOH-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023203 518550672 /nfs/dbraw/zinc/55/06/72/518550672.db2.gz WQYDAQXKEKSYCX-WCQYABFASA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023203 518550679 /nfs/dbraw/zinc/55/06/79/518550679.db2.gz WQYDAQXKEKSYCX-WCQYABFASA-N 1 1 355.822 2.568 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]21 ZINC000585767622 518590294 /nfs/dbraw/zinc/59/02/94/518590294.db2.gz RBFJXEREKWLYBA-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000564753686 518597633 /nfs/dbraw/zinc/59/76/33/518597633.db2.gz GDFJLMDWBDALBV-PHIMTYICSA-N 1 1 370.247 2.912 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000573320659 518611025 /nfs/dbraw/zinc/61/10/25/518611025.db2.gz DMEHHNIXEZESCM-OAHLLOKOSA-N 1 1 368.393 2.777 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000570476727 518625052 /nfs/dbraw/zinc/62/50/52/518625052.db2.gz SSWQYEXZAXELSR-JXMROGBWSA-N 1 1 355.442 2.955 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000570538895 518657234 /nfs/dbraw/zinc/65/72/34/518657234.db2.gz RWIQQWLOHTZNFL-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000570538895 518657242 /nfs/dbraw/zinc/65/72/42/518657242.db2.gz RWIQQWLOHTZNFL-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000579393669 518659106 /nfs/dbraw/zinc/65/91/06/518659106.db2.gz OMOYKNZZQLOYQW-GFCCVEGCSA-N 1 1 357.863 2.893 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000579393669 518659109 /nfs/dbraw/zinc/65/91/09/518659109.db2.gz OMOYKNZZQLOYQW-GFCCVEGCSA-N 1 1 357.863 2.893 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)C(C)(C)C1 ZINC000567750840 518692083 /nfs/dbraw/zinc/69/20/83/518692083.db2.gz JQJLKOBPENKXQB-LLVKDONJSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)C(C)(C)C1 ZINC000567750840 518692090 /nfs/dbraw/zinc/69/20/90/518692090.db2.gz JQJLKOBPENKXQB-LLVKDONJSA-N 1 1 355.822 2.568 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000588034059 518706948 /nfs/dbraw/zinc/70/69/48/518706948.db2.gz AYYOVJUDPRNBJQ-AWEZNQCLSA-N 1 1 365.430 2.603 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000573752787 518817824 /nfs/dbraw/zinc/81/78/24/518817824.db2.gz ODEYWGPYLNZTRX-CQSZACIVSA-N 1 1 358.442 2.999 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000565323080 518898481 /nfs/dbraw/zinc/89/84/81/518898481.db2.gz MNZRHUASPOXUSX-HNNXBMFYSA-N 1 1 371.441 2.727 20 5 FFBDMO CSCC[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000589255594 518965515 /nfs/dbraw/zinc/96/55/15/518965515.db2.gz UUDQCRDNDSASIF-UHFFFAOYSA-N 1 1 366.224 2.994 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000589502640 519020248 /nfs/dbraw/zinc/02/02/48/519020248.db2.gz ATGGYAJOFFSSDW-OAHLLOKOSA-N 1 1 361.442 2.545 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@](CO)(c3ccccc3)C1)OCCO2 ZINC000589737663 519073484 /nfs/dbraw/zinc/07/34/84/519073484.db2.gz OTPCIJHSGJPTNB-FQEVSTJZSA-N 1 1 370.405 2.502 20 5 FFBDMO CN(C(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000565685444 519080131 /nfs/dbraw/zinc/08/01/31/519080131.db2.gz XFGMNILTYRGIHP-LLVKDONJSA-N 1 1 357.332 2.922 20 5 FFBDMO Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140275 519159330 /nfs/dbraw/zinc/15/93/30/519159330.db2.gz ODLNOKVGPNXAAQ-CABCVRRESA-N 1 1 359.348 2.831 20 5 FFBDMO O=c1c([N+](=O)[O-])cc2c(n1Cc1[nH+]ccn1Cc1ccccc1)CCCC2 ZINC000574916340 519403868 /nfs/dbraw/zinc/40/38/68/519403868.db2.gz KWGHTJVJCPVHLK-UHFFFAOYSA-N 1 1 364.405 2.928 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000581021819 519481914 /nfs/dbraw/zinc/48/19/14/519481914.db2.gz AJWNUFCJPHWNQS-CYBMUJFWSA-N 1 1 352.437 2.837 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)nc1 ZINC000591028408 519484389 /nfs/dbraw/zinc/48/43/89/519484389.db2.gz KSITUHKOHQHQPQ-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]1C ZINC000602848464 519924668 /nfs/dbraw/zinc/92/46/68/519924668.db2.gz VNCCRDVNUCOIGI-JSGCOSHPSA-N 1 1 352.435 2.542 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000594417293 519952245 /nfs/dbraw/zinc/95/22/45/519952245.db2.gz BKYCBSTXESAQEC-IRXDYDNUSA-N 1 1 370.409 2.595 20 5 FFBDMO Cc1ccc(CNc2ncnc3cccc([N+](=O)[O-])c32)c(N2CCCC2)[nH+]1 ZINC000612452017 519968607 /nfs/dbraw/zinc/96/86/07/519968607.db2.gz KQAPQSHPJNLZGN-UHFFFAOYSA-N 1 1 364.409 2.876 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000602916186 519970134 /nfs/dbraw/zinc/97/01/34/519970134.db2.gz KUMCBIHYKKQERD-LJQANCHMSA-N 1 1 370.409 2.600 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000602916186 519970141 /nfs/dbraw/zinc/97/01/41/519970141.db2.gz KUMCBIHYKKQERD-LJQANCHMSA-N 1 1 370.409 2.600 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000591985570 520120833 /nfs/dbraw/zinc/12/08/33/520120833.db2.gz LSQRZMNIXBAQQP-CVEARBPZSA-N 1 1 370.409 2.534 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCc4ccc(O)cc4CC3)n2)cc1 ZINC000608866595 520149544 /nfs/dbraw/zinc/14/95/44/520149544.db2.gz BZWFAKICKPWCKK-UHFFFAOYSA-N 1 1 366.377 2.951 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000600252557 520159541 /nfs/dbraw/zinc/15/95/41/520159541.db2.gz JSYLLJUVZJSINE-IBGZPJMESA-N 1 1 368.437 2.972 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000600299491 520188434 /nfs/dbraw/zinc/18/84/34/520188434.db2.gz UHYOJUREPCUWQD-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000600299491 520188442 /nfs/dbraw/zinc/18/84/42/520188442.db2.gz UHYOJUREPCUWQD-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000600311642 520199235 /nfs/dbraw/zinc/19/92/35/520199235.db2.gz BSXFWBURUHXYSU-CYBMUJFWSA-N 1 1 351.422 2.860 20 5 FFBDMO COC(=O)C1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CC1 ZINC000592133480 520209730 /nfs/dbraw/zinc/20/97/30/520209730.db2.gz VORNWQJQPSYULT-WKILWMFISA-N 1 1 362.426 2.654 20 5 FFBDMO Cc1ccc(C[N@@H+](CC(C)C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c(C)c1 ZINC000592138833 520213620 /nfs/dbraw/zinc/21/36/20/520213620.db2.gz KBNCLBOACKUHDY-IBGZPJMESA-N 1 1 360.458 2.927 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000603403913 520249551 /nfs/dbraw/zinc/24/95/51/520249551.db2.gz XEWPXMRRDOWVBK-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)CCCC[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000603407820 520251818 /nfs/dbraw/zinc/25/18/18/520251818.db2.gz YKNJSBRZJDCFQM-UHFFFAOYSA-N 1 1 351.451 2.779 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595049799 520269876 /nfs/dbraw/zinc/26/98/76/520269876.db2.gz OTESUQYCRXTNJU-IAGOWNOFSA-N 1 1 357.458 2.880 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000600470921 520279800 /nfs/dbraw/zinc/27/98/00/520279800.db2.gz JRBBCIKYCGJDFZ-GOSISDBHSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000600472761 520280733 /nfs/dbraw/zinc/28/07/33/520280733.db2.gz PXJXZBJMKUQIAD-CYBMUJFWSA-N 1 1 369.368 2.943 20 5 FFBDMO Cc1ccncc1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000595073941 520281504 /nfs/dbraw/zinc/28/15/04/520281504.db2.gz PONAXEKXRNBAGN-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1 ZINC000597853489 520282480 /nfs/dbraw/zinc/28/24/80/520282480.db2.gz AZPBODXGORVEGY-OAHLLOKOSA-N 1 1 363.458 2.909 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000597858492 520287002 /nfs/dbraw/zinc/28/70/02/520287002.db2.gz MDGXNYDSTQMDQS-LLVKDONJSA-N 1 1 357.357 2.799 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCCC[C@H]1C ZINC000609547788 520353751 /nfs/dbraw/zinc/35/37/51/520353751.db2.gz JIPGANJFJUELJK-OLZOCXBDSA-N 1 1 372.425 2.841 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000603929291 520407731 /nfs/dbraw/zinc/40/77/31/520407731.db2.gz JAVSISHMAUACRI-HNNXBMFYSA-N 1 1 354.410 2.641 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000609766497 520426261 /nfs/dbraw/zinc/42/62/61/520426261.db2.gz XIWMMXWTHROFSC-ZBFHGGJFSA-N 1 1 361.398 2.536 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604105759 520451728 /nfs/dbraw/zinc/45/17/28/520451728.db2.gz XQARYGNLMCUFGU-KBPBESRZSA-N 1 1 364.446 2.523 20 5 FFBDMO CC(C)(C)C(=O)N1CCC[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000595424453 520463053 /nfs/dbraw/zinc/46/30/53/520463053.db2.gz MSVZSDPJGYAHIC-AWEZNQCLSA-N 1 1 360.458 2.633 20 5 FFBDMO CC(C)(C)C(=O)N1CCC[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000595424453 520463059 /nfs/dbraw/zinc/46/30/59/520463059.db2.gz MSVZSDPJGYAHIC-AWEZNQCLSA-N 1 1 360.458 2.633 20 5 FFBDMO Cc1nc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c(C)o1 ZINC000595432853 520467976 /nfs/dbraw/zinc/46/79/76/520467976.db2.gz MFDOFUQGEWBOLJ-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO Cc1nc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c(C)o1 ZINC000595432853 520467988 /nfs/dbraw/zinc/46/79/88/520467988.db2.gz MFDOFUQGEWBOLJ-UHFFFAOYSA-N 1 1 370.413 2.788 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595446825 520475992 /nfs/dbraw/zinc/47/59/92/520475992.db2.gz IZSHHGPEMWFCBE-KRWDZBQOSA-N 1 1 354.410 2.669 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000598195758 520486543 /nfs/dbraw/zinc/48/65/43/520486543.db2.gz RLBZEKNEKOCHIA-FQEVSTJZSA-N 1 1 367.449 2.913 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000598196120 520487293 /nfs/dbraw/zinc/48/72/93/520487293.db2.gz ZUADRTRGMPBYCZ-KRWDZBQOSA-N 1 1 368.437 2.687 20 5 FFBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc3c(cc1[N+](=O)[O-])OCCO3)CCO2 ZINC000613423049 520494479 /nfs/dbraw/zinc/49/44/79/520494479.db2.gz QMHGPBHYYCFADV-HNNXBMFYSA-N 1 1 372.377 2.988 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996196 520500158 /nfs/dbraw/zinc/50/01/58/520500158.db2.gz XPVFFKARRNVCCO-CZUORRHYSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996196 520500163 /nfs/dbraw/zinc/50/01/63/520500163.db2.gz XPVFFKARRNVCCO-CZUORRHYSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000609996196 520500175 /nfs/dbraw/zinc/50/01/75/520500175.db2.gz XPVFFKARRNVCCO-CZUORRHYSA-N 1 1 371.441 2.751 20 5 FFBDMO COC(=O)C[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1ccncc1 ZINC000595486456 520502451 /nfs/dbraw/zinc/50/24/51/520502451.db2.gz NJIGNUGYOFCQLP-SFHVURJKSA-N 1 1 359.382 2.567 20 5 FFBDMO Cn1cc([C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000595491655 520506151 /nfs/dbraw/zinc/50/61/51/520506151.db2.gz DBJRJMHMVCRPGX-INIZCTEOSA-N 1 1 364.833 2.975 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000595518613 520524180 /nfs/dbraw/zinc/52/41/80/520524180.db2.gz BWDKNKRMHSMMEU-MRXNPFEDSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCOc2ccccc21 ZINC000595518613 520524191 /nfs/dbraw/zinc/52/41/91/520524191.db2.gz BWDKNKRMHSMMEU-MRXNPFEDSA-N 1 1 373.384 2.935 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000610100368 520540169 /nfs/dbraw/zinc/54/01/69/520540169.db2.gz WYQVHIKUZLVESH-ZWKOTPCHSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000610121992 520549467 /nfs/dbraw/zinc/54/94/67/520549467.db2.gz KYKRZNULXIGRAT-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000598342461 520566093 /nfs/dbraw/zinc/56/60/93/520566093.db2.gz NPOZNSVIIWDZIH-CYBMUJFWSA-N 1 1 360.439 2.932 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000610200268 520576228 /nfs/dbraw/zinc/57/62/28/520576228.db2.gz WOBIBWXIASNXCM-IAQYHMDHSA-N 1 1 363.443 2.501 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000595591548 520577460 /nfs/dbraw/zinc/57/74/60/520577460.db2.gz VSWDAYJOYQQSLB-ZDUSSCGKSA-N 1 1 374.363 2.897 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000595599811 520582470 /nfs/dbraw/zinc/58/24/70/520582470.db2.gz ZFTYVNPCFRWRCA-QGZVFWFLSA-N 1 1 371.437 2.767 20 5 FFBDMO COc1cc2c(cc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000601149197 520659837 /nfs/dbraw/zinc/65/98/37/520659837.db2.gz KPCTZQIDDKSBLL-ZUOKHONESA-N 1 1 372.421 2.924 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1cccc([N+](=O)[O-])c1 ZINC000601150001 520662048 /nfs/dbraw/zinc/66/20/48/520662048.db2.gz RRNLUZOBESUSNN-RDJZCZTQSA-N 1 1 363.439 2.900 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000598512469 520671529 /nfs/dbraw/zinc/67/15/29/520671529.db2.gz TVJOVJSCBZEOLL-QGZVFWFLSA-N 1 1 369.421 2.673 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]2N1 ZINC000595729201 520675431 /nfs/dbraw/zinc/67/54/31/520675431.db2.gz RCSNZQODRRLEAR-HZMBPMFUSA-N 1 1 357.332 2.714 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@@H]2N1 ZINC000595729201 520675440 /nfs/dbraw/zinc/67/54/40/520675440.db2.gz RCSNZQODRRLEAR-HZMBPMFUSA-N 1 1 357.332 2.714 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000610447523 520690687 /nfs/dbraw/zinc/69/06/87/520690687.db2.gz GRPOQGRBPOUWHV-DTORHVGOSA-N 1 1 360.258 2.854 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 ZINC000610447523 520690692 /nfs/dbraw/zinc/69/06/92/520690692.db2.gz GRPOQGRBPOUWHV-DTORHVGOSA-N 1 1 360.258 2.854 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000598605312 520736912 /nfs/dbraw/zinc/73/69/12/520736912.db2.gz BDQYJAZNMZSWNV-ZFWWWQNUSA-N 1 1 369.487 2.705 20 5 FFBDMO COC(=O)c1ccnc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598610425 520742013 /nfs/dbraw/zinc/74/20/13/520742013.db2.gz BNOQGGGIBQFWOX-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000610572529 520745118 /nfs/dbraw/zinc/74/51/18/520745118.db2.gz DUWRDFGBEAZDSK-LBPRGKRZSA-N 1 1 368.231 2.571 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Oc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595831572 520756517 /nfs/dbraw/zinc/75/65/17/520756517.db2.gz KBWBKOVABZZULZ-GOSISDBHSA-N 1 1 367.405 2.637 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Oc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595831572 520756524 /nfs/dbraw/zinc/75/65/24/520756524.db2.gz KBWBKOVABZZULZ-GOSISDBHSA-N 1 1 367.405 2.637 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593118340 520758395 /nfs/dbraw/zinc/75/83/95/520758395.db2.gz QKCQPTVOQWRWEX-OAHLLOKOSA-N 1 1 355.341 2.663 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901309 520808429 /nfs/dbraw/zinc/80/84/29/520808429.db2.gz VFKAADMCWJQREO-MRXNPFEDSA-N 1 1 360.458 2.553 20 5 FFBDMO C[NH+]1CCN(CCCCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596074937 520895851 /nfs/dbraw/zinc/89/58/51/520895851.db2.gz BRRADJUCFNBNDZ-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000596168165 520948088 /nfs/dbraw/zinc/94/80/88/520948088.db2.gz LVELVCSLTTZFKY-NWDGAFQWSA-N 1 1 367.833 2.955 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596218885 520976902 /nfs/dbraw/zinc/97/69/02/520976902.db2.gz NGNUZEYLAQDVMC-DYVFJYSZSA-N 1 1 354.410 2.626 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088124 520978083 /nfs/dbraw/zinc/97/80/83/520978083.db2.gz DHTZKLOWXVMMDT-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088124 520978091 /nfs/dbraw/zinc/97/80/91/520978091.db2.gz DHTZKLOWXVMMDT-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000611093892 520983136 /nfs/dbraw/zinc/98/31/36/520983136.db2.gz MHTIDANJOLBLOE-SNVBAGLBSA-N 1 1 358.345 2.754 20 5 FFBDMO C[C@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596236441 520988189 /nfs/dbraw/zinc/98/81/89/520988189.db2.gz VVAVVEVENPRDAN-GUYCJALGSA-N 1 1 354.410 2.769 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cccc(Cn2nc([N+](=O)[O-])cc2C)c1 ZINC000593447523 520997531 /nfs/dbraw/zinc/99/75/31/520997531.db2.gz DLOAIHZBIHQFHL-CQSZACIVSA-N 1 1 373.457 2.608 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596309323 521021848 /nfs/dbraw/zinc/02/18/48/521021848.db2.gz YNTAHTVWFMYDDY-JTQLQIEISA-N 1 1 361.489 2.592 20 5 FFBDMO Cc1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)c([N+](=O)[O-])c1 ZINC000593495813 521031291 /nfs/dbraw/zinc/03/12/91/521031291.db2.gz JWBDBRXAJQZSQV-MOPGFXCFSA-N 1 1 368.437 2.778 20 5 FFBDMO Cc1cc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC000593496674 521033391 /nfs/dbraw/zinc/03/33/91/521033391.db2.gz VRLFQICXLHGHHM-MOPGFXCFSA-N 1 1 368.437 2.778 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000599126987 521044005 /nfs/dbraw/zinc/04/40/05/521044005.db2.gz KTPDVFMWKLGPIR-CQSZACIVSA-N 1 1 362.430 2.985 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)n1 ZINC000596423585 521062468 /nfs/dbraw/zinc/06/24/68/521062468.db2.gz LSQGLPLXYPLPNT-QGZVFWFLSA-N 1 1 356.426 2.785 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000596422129 521063371 /nfs/dbraw/zinc/06/33/71/521063371.db2.gz AQBBNCHZRUGIEE-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CCC[N@H+](C3CCCC3)CC1)OCCO2 ZINC000611266762 521066666 /nfs/dbraw/zinc/06/66/66/521066666.db2.gz JRWPNNMWQSAGAN-UHFFFAOYSA-N 1 1 361.442 2.816 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599203665 521084643 /nfs/dbraw/zinc/08/46/43/521084643.db2.gz MWGRARRCXPQFSM-SFHVURJKSA-N 1 1 360.458 2.796 20 5 FFBDMO C[C@H](C[NH+]1CCC(C)CC1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000596488157 521096579 /nfs/dbraw/zinc/09/65/79/521096579.db2.gz NAKIFSBMEPVDPF-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350402 521112957 /nfs/dbraw/zinc/11/29/57/521112957.db2.gz LACVHEBUQMJPKX-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000611350402 521112967 /nfs/dbraw/zinc/11/29/67/521112967.db2.gz LACVHEBUQMJPKX-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735961 521182532 /nfs/dbraw/zinc/18/25/32/521182532.db2.gz AYJYDPNHUMBGQB-YSVLISHTSA-N 1 1 353.850 2.967 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000593735961 521182539 /nfs/dbraw/zinc/18/25/39/521182539.db2.gz AYJYDPNHUMBGQB-YSVLISHTSA-N 1 1 353.850 2.967 20 5 FFBDMO O=C(CC[N@H+]1CCc2nc(C3CC3)ncc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000599620213 521337053 /nfs/dbraw/zinc/33/70/53/521337053.db2.gz QXXBRAQNIMPYBJ-UHFFFAOYSA-N 1 1 367.409 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC[C@@H]([NH+]3CCOCC3)C2)c1 ZINC000594003038 521342666 /nfs/dbraw/zinc/34/26/66/521342666.db2.gz XXCJEUSETBHCJN-OAHLLOKOSA-N 1 1 373.375 2.910 20 5 FFBDMO CCN(Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000602448280 521351517 /nfs/dbraw/zinc/35/15/17/521351517.db2.gz ICMYMDCATPMEAJ-YJBOKZPZSA-N 1 1 357.458 2.986 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000599656831 521368739 /nfs/dbraw/zinc/36/87/39/521368739.db2.gz VPIMUCNSSPTQRZ-GZBFAFLISA-N 1 1 366.389 2.906 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000599656831 521368742 /nfs/dbraw/zinc/36/87/42/521368742.db2.gz VPIMUCNSSPTQRZ-GZBFAFLISA-N 1 1 366.389 2.906 20 5 FFBDMO COc1cc(C[N@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000594065508 521384202 /nfs/dbraw/zinc/38/42/02/521384202.db2.gz REZOSJGHUHETIN-SNVBAGLBSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000594065508 521384208 /nfs/dbraw/zinc/38/42/08/521384208.db2.gz REZOSJGHUHETIN-SNVBAGLBSA-N 1 1 360.357 2.593 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H](Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000619153825 521420878 /nfs/dbraw/zinc/42/08/78/521420878.db2.gz OQSPGDJJJKZWIG-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000619153825 521420886 /nfs/dbraw/zinc/42/08/86/521420886.db2.gz OQSPGDJJJKZWIG-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO COC[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@H]1CCCO1 ZINC000602642608 521453643 /nfs/dbraw/zinc/45/36/43/521453643.db2.gz DAHSZTWIEOFSLH-GHMZBOCLSA-N 1 1 365.249 2.702 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594200368 521466446 /nfs/dbraw/zinc/46/64/46/521466446.db2.gz LADIVLITZKLPOF-WMZOPIPTSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](OCc4ccccn4)C3)nc2c1 ZINC000602716684 521492781 /nfs/dbraw/zinc/49/27/81/521492781.db2.gz WPNJJYXGVHEJRQ-HNNXBMFYSA-N 1 1 354.366 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](OCc4ccccn4)C3)nc2c1 ZINC000602716684 521492792 /nfs/dbraw/zinc/49/27/92/521492792.db2.gz WPNJJYXGVHEJRQ-HNNXBMFYSA-N 1 1 354.366 2.922 20 5 FFBDMO Cc1ccc2[nH]c([C@H]3CCC[N@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)nc2c1 ZINC000602801611 521540337 /nfs/dbraw/zinc/54/03/37/521540337.db2.gz XKEOXHJSWKIPSM-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000602801611 521540343 /nfs/dbraw/zinc/54/03/43/521540343.db2.gz XKEOXHJSWKIPSM-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@H]3CCC[N@H+](Cc4cn(C)nc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000602801611 521540350 /nfs/dbraw/zinc/54/03/50/521540350.db2.gz XKEOXHJSWKIPSM-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](Cn4ccnn4)C3)o2)cc1 ZINC000597172748 521554626 /nfs/dbraw/zinc/55/46/26/521554626.db2.gz BYZWXFHSAPASLB-AWEZNQCLSA-N 1 1 353.382 2.968 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c([N+](=O)[O-])n1 ZINC000602825405 521555438 /nfs/dbraw/zinc/55/54/38/521555438.db2.gz SLOQMIALZQBOAL-KRWDZBQOSA-N 1 1 357.458 2.719 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCc2c(ncn2-c2ccc(C)cc2)C1 ZINC000602827678 521556636 /nfs/dbraw/zinc/55/66/36/521556636.db2.gz MJOVKKOSDGNCOE-UHFFFAOYSA-N 1 1 366.425 2.652 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2c(ncn2-c2ccc(C)cc2)C1 ZINC000602827678 521556647 /nfs/dbraw/zinc/55/66/47/521556647.db2.gz MJOVKKOSDGNCOE-UHFFFAOYSA-N 1 1 366.425 2.652 20 5 FFBDMO O=C1CC[C@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]2N1 ZINC000597205845 521573811 /nfs/dbraw/zinc/57/38/11/521573811.db2.gz LICKEDIRTPREGB-XJKSGUPXSA-N 1 1 372.450 2.819 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]2N1 ZINC000597205845 521573820 /nfs/dbraw/zinc/57/38/20/521573820.db2.gz LICKEDIRTPREGB-XJKSGUPXSA-N 1 1 372.450 2.819 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000824656552 609314367 /nfs/dbraw/zinc/31/43/67/609314367.db2.gz LPPUMYCNBDWLQN-CHWSQXEVSA-N 1 1 371.445 2.840 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1N1CC[C@@H]2[C@H]1CC[N@H+]2Cc1cccnc1 ZINC001164721713 720334275 /nfs/dbraw/zinc/33/42/75/720334275.db2.gz DBOXSGZSFROOPK-HUUCEWRRSA-N 1 1 359.817 2.891 20 5 FFBDMO COc1cc(C)nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164722586 720374124 /nfs/dbraw/zinc/37/41/24/720374124.db2.gz DOOAIGWTLNLREM-HZPDHXFCSA-N 1 1 369.425 2.555 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)c1 ZINC000153781830 728788148 /nfs/dbraw/zinc/78/81/48/728788148.db2.gz ILJFMETUAITTEA-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO NC(=O)C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCCC1 ZINC000123004665 728653966 /nfs/dbraw/zinc/65/39/66/728653966.db2.gz HPHDTLBYPSDVDZ-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CCCC1 ZINC000123004665 728653967 /nfs/dbraw/zinc/65/39/67/728653967.db2.gz HPHDTLBYPSDVDZ-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO CC(C)C[NH+]1CCC(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000129111537 728710383 /nfs/dbraw/zinc/71/03/83/728710383.db2.gz VRQYELILTHTQMN-UHFFFAOYSA-N 1 1 361.489 2.592 20 5 FFBDMO CCC[C@@H](OCC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860781105 730546505 /nfs/dbraw/zinc/54/65/05/730546505.db2.gz UPHGQZOOCPRJCD-DLBZAZTESA-N 1 1 350.415 2.918 20 5 FFBDMO CCC[C@@H](OCC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860781105 730546506 /nfs/dbraw/zinc/54/65/06/730546506.db2.gz UPHGQZOOCPRJCD-DLBZAZTESA-N 1 1 350.415 2.918 20 5 FFBDMO CCO[C@@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000860780981 730546548 /nfs/dbraw/zinc/54/65/48/730546548.db2.gz SOCQQWVBCBCHPX-DLBZAZTESA-N 1 1 350.415 2.773 20 5 FFBDMO CCO[C@@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000860780981 730546549 /nfs/dbraw/zinc/54/65/49/730546549.db2.gz SOCQQWVBCBCHPX-DLBZAZTESA-N 1 1 350.415 2.773 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000861032216 730568862 /nfs/dbraw/zinc/56/88/62/730568862.db2.gz KRYGYJZFZBMBQR-ZFWWWQNUSA-N 1 1 368.455 2.729 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1Cl ZINC000866205020 731040627 /nfs/dbraw/zinc/04/06/27/731040627.db2.gz IUDIKVAHRIGUDD-MFKMUULPSA-N 1 1 353.806 2.565 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)CN1CCN(C)CC1 ZINC000872034649 731722851 /nfs/dbraw/zinc/72/28/51/731722851.db2.gz QCLZUCJJCVLHTR-KBPBESRZSA-N 1 1 352.504 2.603 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000874825283 732104386 /nfs/dbraw/zinc/10/43/86/732104386.db2.gz ITZLMAKJJMOMKW-KGLIPLIRSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000874839385 732106305 /nfs/dbraw/zinc/10/63/05/732106305.db2.gz VUGGBBUYMZQSCG-KGLIPLIRSA-N 1 1 368.231 2.666 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000877436626 732361870 /nfs/dbraw/zinc/36/18/70/732361870.db2.gz VCGDEFSSAAIYQS-LBPRGKRZSA-N 1 1 359.348 2.712 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878444165 732533515 /nfs/dbraw/zinc/53/35/15/732533515.db2.gz XBWGYPXEJKZBEW-UHFFFAOYSA-N 1 1 365.821 2.824 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557761 732721911 /nfs/dbraw/zinc/72/19/11/732721911.db2.gz FKAFDIBRKVLDAX-WDEREUQCSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557761 732721913 /nfs/dbraw/zinc/72/19/13/732721913.db2.gz FKAFDIBRKVLDAX-WDEREUQCSA-N 1 1 355.847 2.872 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879561948 732724030 /nfs/dbraw/zinc/72/40/30/732724030.db2.gz XKXWIOBZDGXTBC-YNEHKIRRSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879561948 732724033 /nfs/dbraw/zinc/72/40/33/732724033.db2.gz XKXWIOBZDGXTBC-YNEHKIRRSA-N 1 1 365.455 2.615 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC000879574818 732727392 /nfs/dbraw/zinc/72/73/92/732727392.db2.gz GUKFXXPCEYUUOS-XHBSWPGZSA-N 1 1 366.849 2.601 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC3(CC2)COCCO3)c1 ZINC000880547322 732922989 /nfs/dbraw/zinc/92/29/89/732922989.db2.gz KTLYKRFSHANEJG-UHFFFAOYSA-N 1 1 360.332 2.995 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000883609033 733411291 /nfs/dbraw/zinc/41/12/91/733411291.db2.gz MRBTWRUJURRCTD-LBPRGKRZSA-N 1 1 360.336 2.507 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC000886613764 733809404 /nfs/dbraw/zinc/80/94/04/733809404.db2.gz DSANRCMTMRVISL-WFASDCNBSA-N 1 1 357.332 2.858 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC000888834672 734103850 /nfs/dbraw/zinc/10/38/50/734103850.db2.gz NIAFELPEYCXJAV-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO CC(C)C[N@@H+]1CCO[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731205825 734670839 /nfs/dbraw/zinc/67/08/39/734670839.db2.gz MWFOGFMBCLFNJZ-CYBMUJFWSA-N 1 1 350.444 2.973 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731205825 734670842 /nfs/dbraw/zinc/67/08/42/734670842.db2.gz MWFOGFMBCLFNJZ-CYBMUJFWSA-N 1 1 350.444 2.973 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804731 734766646 /nfs/dbraw/zinc/76/66/46/734766646.db2.gz DLOMMKCXDSOQNH-GFCCVEGCSA-N 1 1 361.471 2.785 20 5 FFBDMO C[NH+]1CCC(N2CC[C@@H](Nc3nc4ccc([N+](=O)[O-])cc4s3)C2)CC1 ZINC000732804731 734766650 /nfs/dbraw/zinc/76/66/50/734766650.db2.gz DLOMMKCXDSOQNH-GFCCVEGCSA-N 1 1 361.471 2.785 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC[N@@H+](C[C@@H]4CCCO4)CC3)sc2c1 ZINC000748272234 735632310 /nfs/dbraw/zinc/63/23/10/735632310.db2.gz MBHVYEDBRXIMAZ-AWEZNQCLSA-N 1 1 362.455 2.896 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000753094462 736036894 /nfs/dbraw/zinc/03/68/94/736036894.db2.gz DLOFZYXKEXBNPK-JTQLQIEISA-N 1 1 370.247 2.880 20 5 FFBDMO Cn1cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c(Br)n1 ZINC000903187864 736051516 /nfs/dbraw/zinc/05/15/16/736051516.db2.gz JAJKPLNPRUQIJG-GFCCVEGCSA-N 1 1 351.204 2.868 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903510917 736103985 /nfs/dbraw/zinc/10/39/85/736103985.db2.gz UNHNSJDIKXXJRB-CALCHBBNSA-N 1 1 364.877 2.649 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000755025990 736227733 /nfs/dbraw/zinc/22/77/33/736227733.db2.gz PZBUTWBLJZKKAX-MWLCHTKSSA-N 1 1 371.235 2.962 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000906876384 736554689 /nfs/dbraw/zinc/55/46/89/736554689.db2.gz TYLGUKZXSLEJLT-LBPRGKRZSA-N 1 1 366.849 2.634 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759911272 736603371 /nfs/dbraw/zinc/60/33/71/736603371.db2.gz SXHGVWYZOHYEKU-ZDUSSCGKSA-N 1 1 358.423 2.689 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)c2ccccc2N1 ZINC000759911272 736603373 /nfs/dbraw/zinc/60/33/73/736603373.db2.gz SXHGVWYZOHYEKU-ZDUSSCGKSA-N 1 1 358.423 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCCOCC(F)(F)F)CC2)c(F)c1 ZINC000919964454 737884806 /nfs/dbraw/zinc/88/48/06/737884806.db2.gz DOSWCBIQQHGJGR-UHFFFAOYSA-N 1 1 365.327 2.825 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)CC[C@H]21 ZINC000774640383 738008767 /nfs/dbraw/zinc/00/87/67/738008767.db2.gz RXUYTFNSPRDOGN-MLGOLLRUSA-N 1 1 363.849 2.972 20 5 FFBDMO CC(C)[C@H]1[N@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385381 738134852 /nfs/dbraw/zinc/13/48/52/738134852.db2.gz ASZDZKJNAYTHMH-BRSBDYLESA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@H]1[N@@H+](C)C[C@@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385381 738134855 /nfs/dbraw/zinc/13/48/55/738134855.db2.gz ASZDZKJNAYTHMH-BRSBDYLESA-N 1 1 367.877 2.818 20 5 FFBDMO CSc1cccc(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-] ZINC000777316323 738278180 /nfs/dbraw/zinc/27/81/80/738278180.db2.gz XRVDIFPTHJRICG-ZDUSSCGKSA-N 1 1 368.455 2.830 20 5 FFBDMO C[C@@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000923982871 738352927 /nfs/dbraw/zinc/35/29/27/738352927.db2.gz IYJPYGBXHDGTAL-INWMFGNUSA-N 1 1 364.471 2.535 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785728800 738991689 /nfs/dbraw/zinc/99/16/89/738991689.db2.gz JDYSBZSRINWGEL-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785728800 738991693 /nfs/dbraw/zinc/99/16/93/738991693.db2.gz JDYSBZSRINWGEL-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932024294 739376068 /nfs/dbraw/zinc/37/60/68/739376068.db2.gz IEMTYIBALDGTQC-WBMJQRKESA-N 1 1 353.806 2.959 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000790782169 739494635 /nfs/dbraw/zinc/49/46/35/739494635.db2.gz WNLDMCUOPIFINE-UHFFFAOYSA-N 1 1 363.805 2.780 20 5 FFBDMO C[C@H](C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[NH+]1CCCCCC1 ZINC000791938545 739618331 /nfs/dbraw/zinc/61/83/31/739618331.db2.gz MBPQVODAPMRPMA-GFCCVEGCSA-N 1 1 351.359 2.811 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@@H](C)C1 ZINC000933437410 739625231 /nfs/dbraw/zinc/62/52/31/739625231.db2.gz CJRZSJOAEAPYBI-CABZTGNLSA-N 1 1 372.828 2.772 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000933798679 739691303 /nfs/dbraw/zinc/69/13/03/739691303.db2.gz RPVXMHXMBCAFMU-CYBMUJFWSA-N 1 1 353.850 2.981 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CCCO2)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871473 739714424 /nfs/dbraw/zinc/71/44/24/739714424.db2.gz LPUOZHMMCUXXAW-CABCVRRESA-N 1 1 367.427 2.990 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCCO2)[C@@H]2CCSC2)c([N+](=O)[O-])c1 ZINC000792871473 739714428 /nfs/dbraw/zinc/71/44/28/739714428.db2.gz LPUOZHMMCUXXAW-CABCVRRESA-N 1 1 367.427 2.990 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792926870 739719601 /nfs/dbraw/zinc/71/96/01/739719601.db2.gz OIEPSTJTDVZZHS-CYBMUJFWSA-N 1 1 355.822 2.814 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2CC[C@@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119231 739732741 /nfs/dbraw/zinc/73/27/41/739732741.db2.gz WZXROGVBHCSWHZ-AAEUAGOBSA-N 1 1 360.357 2.857 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2CC[C@@H]2OC)c([N+](=O)[O-])cc1OCC(F)F ZINC000934119231 739732744 /nfs/dbraw/zinc/73/27/44/739732744.db2.gz WZXROGVBHCSWHZ-AAEUAGOBSA-N 1 1 360.357 2.857 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C[C@@H]2C1 ZINC000793928658 739827038 /nfs/dbraw/zinc/82/70/38/739827038.db2.gz UJJMHXZBCJQPBN-NEPJUHHUSA-N 1 1 369.874 2.750 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1 ZINC000795720598 740056049 /nfs/dbraw/zinc/05/60/49/740056049.db2.gz QQUFMHKJQTWNMV-AWEZNQCLSA-N 1 1 358.320 2.681 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1 ZINC000795720598 740056054 /nfs/dbraw/zinc/05/60/54/740056054.db2.gz QQUFMHKJQTWNMV-AWEZNQCLSA-N 1 1 358.320 2.681 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)OCc1cc([N+](=O)[O-])ccc1Cl ZINC000803513170 740807298 /nfs/dbraw/zinc/80/72/98/740807298.db2.gz PEEURRTVVPRDFR-UHFFFAOYSA-N 1 1 356.806 2.794 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809734942 741337915 /nfs/dbraw/zinc/33/79/15/741337915.db2.gz UCHAKRYLKIYCFT-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO COCCC[N@@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811482183 741528162 /nfs/dbraw/zinc/52/81/62/741528162.db2.gz HAGJGGFOMSKDSG-UHFFFAOYSA-N 1 1 350.246 2.960 20 5 FFBDMO COCCCN(C)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811482183 741528163 /nfs/dbraw/zinc/52/81/63/741528163.db2.gz HAGJGGFOMSKDSG-UHFFFAOYSA-N 1 1 350.246 2.960 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811502536 741530641 /nfs/dbraw/zinc/53/06/41/741530641.db2.gz XEJRNFMNUDHIIQ-GOSISDBHSA-N 1 1 351.422 2.808 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000815145704 741906856 /nfs/dbraw/zinc/90/68/56/741906856.db2.gz CDIIHXXUYJFURU-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000825275239 743238939 /nfs/dbraw/zinc/23/89/39/743238939.db2.gz BBNUXOLEJOVDFV-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CCC1(C)C ZINC000828299759 745052605 /nfs/dbraw/zinc/05/26/05/745052605.db2.gz KMOIZUIGONMWMY-UHFFFAOYSA-N 1 1 358.801 2.526 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1F)CCC(F)(F)F ZINC000834400669 745831420 /nfs/dbraw/zinc/83/14/20/745831420.db2.gz ZZHFEMDWSKSMRF-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO CCC(C)(C)OCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000838965201 746746444 /nfs/dbraw/zinc/74/64/44/746746444.db2.gz RHNJBMLEGPVGHE-INIZCTEOSA-N 1 1 350.415 2.918 20 5 FFBDMO CCC(C)(C)OCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000838965201 746746448 /nfs/dbraw/zinc/74/64/48/746746448.db2.gz RHNJBMLEGPVGHE-INIZCTEOSA-N 1 1 350.415 2.918 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](C2CCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839622247 746874097 /nfs/dbraw/zinc/87/40/97/746874097.db2.gz AXKQBXBEZIPQFQ-INIZCTEOSA-N 1 1 351.378 2.563 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000839640390 746878746 /nfs/dbraw/zinc/87/87/46/746878746.db2.gz KWAIYXYYHZBVAR-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO CO[C@@H](CC(C)C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367044 747580658 /nfs/dbraw/zinc/58/06/58/747580658.db2.gz RYZHWXIUKZWXBJ-IRXDYDNUSA-N 1 1 350.415 2.773 20 5 FFBDMO CO[C@@H](CC(C)C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367044 747580665 /nfs/dbraw/zinc/58/06/65/747580665.db2.gz RYZHWXIUKZWXBJ-IRXDYDNUSA-N 1 1 350.415 2.773 20 5 FFBDMO CCCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000843990977 747946286 /nfs/dbraw/zinc/94/62/86/747946286.db2.gz ZQFCNMZEDJQDRS-LBPRGKRZSA-N 1 1 357.813 2.873 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000844902201 748131759 /nfs/dbraw/zinc/13/17/59/748131759.db2.gz KZGIVXHBXUNEKP-SUYBPPKGSA-N 1 1 353.850 2.967 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3cc([N+](=O)[O-])ccc3Cl)C2)C1 ZINC000844902198 748132049 /nfs/dbraw/zinc/13/20/49/748132049.db2.gz KZGIVXHBXUNEKP-DXCKQFNASA-N 1 1 353.850 2.967 20 5 FFBDMO C[N@H+]1CC[C@@H](CCOC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000847825213 748790775 /nfs/dbraw/zinc/79/07/75/748790775.db2.gz PJVPZVFQOJHYKY-JTQLQIEISA-N 1 1 357.204 2.856 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CC1=CCCOC1 ZINC000852518026 749881855 /nfs/dbraw/zinc/88/18/55/749881855.db2.gz AZUCGITZBMHYER-NSHDSACASA-N 1 1 353.806 2.854 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1=CCCOC1 ZINC000852518026 749881867 /nfs/dbraw/zinc/88/18/67/749881867.db2.gz AZUCGITZBMHYER-NSHDSACASA-N 1 1 353.806 2.854 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895843988 970992289 /nfs/dbraw/zinc/99/22/89/970992289.db2.gz KWTSVFZGLBPDMO-MAUKXSAKSA-N 1 1 356.426 2.996 20 5 FFBDMO Cc1nn(CN(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000173514160 971162828 /nfs/dbraw/zinc/16/28/28/971162828.db2.gz WCDZVPNSPZYERJ-SFHVURJKSA-N 1 1 357.458 2.820 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])cc(Br)[n+]1[O-] ZINC001167753144 971721143 /nfs/dbraw/zinc/72/11/43/971721143.db2.gz LIRXDSOXYUABEF-NSHDSACASA-N 1 1 373.251 2.667 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000053682280 971842435 /nfs/dbraw/zinc/84/24/35/971842435.db2.gz SIRGNLMUTDQXCS-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000053682280 971842437 /nfs/dbraw/zinc/84/24/37/971842437.db2.gz SIRGNLMUTDQXCS-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000866846362 958885384 /nfs/dbraw/zinc/88/53/84/958885384.db2.gz CSLFNZWWYZZHSD-YOEHRIQHSA-N 1 1 361.417 2.752 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134885631 960093438 /nfs/dbraw/zinc/09/34/38/960093438.db2.gz WMJVYVJVXGRZTG-WBVHZDCISA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001174716777 1013286799 /nfs/dbraw/zinc/28/67/99/1013286799.db2.gz TVDKTCKFFUTPPQ-HWPZZCPQSA-N 1 1 366.805 2.749 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001174716777 1013286805 /nfs/dbraw/zinc/28/68/05/1013286805.db2.gz TVDKTCKFFUTPPQ-HWPZZCPQSA-N 1 1 366.805 2.749 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001174965642 1013354559 /nfs/dbraw/zinc/35/45/59/1013354559.db2.gz OVSYQKPZVHVTHO-NSHDSACASA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001174965642 1013354570 /nfs/dbraw/zinc/35/45/70/1013354570.db2.gz OVSYQKPZVHVTHO-NSHDSACASA-N 1 1 362.361 2.623 20 5 FFBDMO COc1cc(CN2CCC3(C2)CC[NH2+]CC3)c([N+](=O)[O-])cc1OC(F)F ZINC000262082595 963105217 /nfs/dbraw/zinc/10/52/17/963105217.db2.gz TYXMXONOAPXYQH-UHFFFAOYSA-N 1 1 371.384 2.780 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000843753548 965526131 /nfs/dbraw/zinc/52/61/31/965526131.db2.gz RNZCDDIUBKKMLQ-OAHLLOKOSA-N 1 1 371.441 2.654 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C2(CCCCC2)C1 ZINC000176237567 965591097 /nfs/dbraw/zinc/59/10/97/965591097.db2.gz JKBRDPMFQIBZMU-UHFFFAOYSA-N 1 1 362.386 2.594 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000843759527 965672993 /nfs/dbraw/zinc/67/29/93/965672993.db2.gz QYARXCONVJTBMM-TXEJJXNPSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000843759527 965672998 /nfs/dbraw/zinc/67/29/98/965672998.db2.gz QYARXCONVJTBMM-TXEJJXNPSA-N 1 1 367.421 2.660 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983655623 965675726 /nfs/dbraw/zinc/67/57/26/965675726.db2.gz UCIWWAJRJGPTSL-HUYLIWGRSA-N 1 1 371.481 2.994 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267314110 967819686 /nfs/dbraw/zinc/81/96/86/967819686.db2.gz ITUGVWXJYKUYJO-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267314110 967819700 /nfs/dbraw/zinc/81/97/00/967819700.db2.gz ITUGVWXJYKUYJO-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267314110 967819708 /nfs/dbraw/zinc/81/97/08/967819708.db2.gz ITUGVWXJYKUYJO-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050901258 968103994 /nfs/dbraw/zinc/10/39/94/968103994.db2.gz KIGRZDVNIPSQNU-CABCVRRESA-N 1 1 373.457 2.919 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C[C@H]1C ZINC000892642116 969676677 /nfs/dbraw/zinc/67/66/77/969676677.db2.gz MCCIZUKRRRHABF-ZIAGYGMSSA-N 1 1 358.442 2.756 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001267590851 969689321 /nfs/dbraw/zinc/68/93/21/969689321.db2.gz LGSSUGDVDBNSHU-ACJLOTCBSA-N 1 1 354.410 2.549 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000874850092 1013918299 /nfs/dbraw/zinc/91/82/99/1013918299.db2.gz NVRIIWQFORTVQY-RDJZCZTQSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1[N+](=O)[O-] ZINC000897060945 973205248 /nfs/dbraw/zinc/20/52/48/973205248.db2.gz DOSMQOGNWVHTEB-INMHGKMJSA-N 1 1 360.458 2.824 20 5 FFBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)C(=O)Nc1ccccc1 ZINC001168074378 974186124 /nfs/dbraw/zinc/18/61/24/974186124.db2.gz RHECGGVEZBMMPU-CQSZACIVSA-N 1 1 359.430 2.839 20 5 FFBDMO Cc1ccccc1CCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 ZINC000981763789 976764519 /nfs/dbraw/zinc/76/45/19/976764519.db2.gz LFPBTNPFYPOEFW-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccccc1CCC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981763789 976764529 /nfs/dbraw/zinc/76/45/29/976764529.db2.gz LFPBTNPFYPOEFW-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccccc1CCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000981763789 976764540 /nfs/dbraw/zinc/76/45/40/976764540.db2.gz LFPBTNPFYPOEFW-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1cc3ccccc3o1)C2 ZINC000981764999 976764899 /nfs/dbraw/zinc/76/48/99/976764899.db2.gz MNBVYCZJFZOEJD-IAGOWNOFSA-N 1 1 369.421 2.522 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](Cc1cc3ccccc3o1)C2 ZINC000981764999 976764909 /nfs/dbraw/zinc/76/49/09/976764909.db2.gz MNBVYCZJFZOEJD-IAGOWNOFSA-N 1 1 369.421 2.522 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](Cc1cc3ccccc3o1)C2 ZINC000981764999 976764919 /nfs/dbraw/zinc/76/49/19/976764919.db2.gz MNBVYCZJFZOEJD-IAGOWNOFSA-N 1 1 369.421 2.522 20 5 FFBDMO CNc1nccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001152053958 1032092818 /nfs/dbraw/zinc/09/28/18/1032092818.db2.gz ZFCSBAMVMSOLKL-AWEZNQCLSA-N 1 1 361.446 2.558 20 5 FFBDMO CCCN1CCC([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000128823633 979981706 /nfs/dbraw/zinc/98/17/06/979981706.db2.gz IXOXRMVKGOHGTD-UHFFFAOYSA-N 1 1 366.437 2.869 20 5 FFBDMO CCCN1CCC([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000128823633 979981710 /nfs/dbraw/zinc/98/17/10/979981710.db2.gz IXOXRMVKGOHGTD-UHFFFAOYSA-N 1 1 366.437 2.869 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)n1 ZINC000780396828 981290543 /nfs/dbraw/zinc/29/05/43/981290543.db2.gz DPBPYQAFNXKJGO-GOSISDBHSA-N 1 1 358.398 2.540 20 5 FFBDMO C[C@@H]1CC2(CC([NH2+][C@@H](c3nccn3C)c3ccc([N+](=O)[O-])cc3)C2)CO1 ZINC000897780626 982513890 /nfs/dbraw/zinc/51/38/90/982513890.db2.gz XYLFCOVGYHIWGR-LARMFPEUSA-N 1 1 356.426 2.965 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000898141956 982625933 /nfs/dbraw/zinc/62/59/33/982625933.db2.gz GWVPVYZZAGLDJX-SJLPKXTDSA-N 1 1 372.421 2.647 20 5 FFBDMO CN(c1ccc2ncccc2c1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000764144209 984314146 /nfs/dbraw/zinc/31/41/46/984314146.db2.gz WGSDXLCGQUABLB-MRXNPFEDSA-N 1 1 369.469 2.748 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000156448266 984332995 /nfs/dbraw/zinc/33/29/95/984332995.db2.gz PGTGQOLTQUKYKZ-JKSUJKDBSA-N 1 1 359.430 2.946 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)CC1 ZINC000878550157 1015096754 /nfs/dbraw/zinc/09/67/54/1015096754.db2.gz WMWQMTYUMDHOMQ-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+](C2CCC2)C1 ZINC000878644460 1015148576 /nfs/dbraw/zinc/14/85/76/1015148576.db2.gz WGXUECHHPIZZKG-CQSZACIVSA-N 1 1 371.441 2.951 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccc3ccccc3c2)CC1 ZINC000997776310 985736382 /nfs/dbraw/zinc/73/63/82/985736382.db2.gz MILLUGMLJDUTOU-WOJBJXKFSA-N 1 1 367.449 2.833 20 5 FFBDMO O=C(OC[C@@H]1CCC[N@@H+]1Cc1ccco1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000765970853 987704832 /nfs/dbraw/zinc/70/48/32/987704832.db2.gz WYRKUVOHJKEXDF-LBPRGKRZSA-N 1 1 374.349 2.738 20 5 FFBDMO O=C(OC[C@@H]1CCC[N@H+]1Cc1ccco1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000765970853 987704838 /nfs/dbraw/zinc/70/48/38/987704838.db2.gz WYRKUVOHJKEXDF-LBPRGKRZSA-N 1 1 374.349 2.738 20 5 FFBDMO COCCN(Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000879127556 1015375879 /nfs/dbraw/zinc/37/58/79/1015375879.db2.gz YEYANYQJCRMVPA-UHFFFAOYSA-N 1 1 369.437 2.533 20 5 FFBDMO Cn1cnc2cc(C[NH2+]Cc3cc4c(cc3[N+](=O)[O-])OCCO4)ccc21 ZINC000922483400 988629587 /nfs/dbraw/zinc/62/95/87/988629587.db2.gz XXZSQYAVMMKMRO-UHFFFAOYSA-N 1 1 354.366 2.543 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCc3ccccc3[N+](=O)[O-])CC2)[nH+]c1 ZINC000194169165 989173373 /nfs/dbraw/zinc/17/33/73/989173373.db2.gz SUAVUUYXQDCUMI-UHFFFAOYSA-N 1 1 354.410 2.831 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[NH+](Cc4ccsc4)CC3)cc2N1 ZINC000917019661 990095306 /nfs/dbraw/zinc/09/53/06/990095306.db2.gz QDHAOAUASDWWJU-UHFFFAOYSA-N 1 1 372.450 2.863 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cc1 ZINC001034815657 990275090 /nfs/dbraw/zinc/27/50/90/990275090.db2.gz AKHPLSYZELQASC-RTBURBONSA-N 1 1 353.422 2.566 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001034816962 990277681 /nfs/dbraw/zinc/27/76/81/990277681.db2.gz XCIHSPPZPOQVHR-RTBURBONSA-N 1 1 371.412 2.705 20 5 FFBDMO Cc1cc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cs1 ZINC001485450548 991943530 /nfs/dbraw/zinc/94/35/30/991943530.db2.gz JSJSQOCOPVSFOK-HUUCEWRRSA-N 1 1 351.472 2.630 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC4(CC3)COCCO4)co2)cc1 ZINC000880545806 1015868761 /nfs/dbraw/zinc/86/87/61/1015868761.db2.gz IQNVBVMRQYCPGI-UHFFFAOYSA-N 1 1 359.382 2.631 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)Cn2cc[nH+]c2C)cc1OC ZINC000810619337 994840672 /nfs/dbraw/zinc/84/06/72/994840672.db2.gz OPUACRWUYBOAAN-NSHDSACASA-N 1 1 363.370 2.753 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000810614911 994854801 /nfs/dbraw/zinc/85/48/01/994854801.db2.gz HTZQPKIIVKBLRD-ZDUSSCGKSA-N 1 1 358.398 2.945 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])O[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000810845911 994950823 /nfs/dbraw/zinc/95/08/23/994950823.db2.gz WBJPRYXIYDMPRV-ZFWWWQNUSA-N 1 1 363.370 2.606 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000747828591 995573833 /nfs/dbraw/zinc/57/38/33/995573833.db2.gz GVNYXLPGNJUNNK-CVEARBPZSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(COc1ccc(F)cc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170907 995632386 /nfs/dbraw/zinc/63/23/86/995632386.db2.gz NACXHMVNORSQDC-SFHVURJKSA-N 1 1 374.368 2.930 20 5 FFBDMO O=C(COc1ccc(F)cc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170907 995632390 /nfs/dbraw/zinc/63/23/90/995632390.db2.gz NACXHMVNORSQDC-SFHVURJKSA-N 1 1 374.368 2.930 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000823972904 996769863 /nfs/dbraw/zinc/76/98/63/996769863.db2.gz BEFQSXRBSWAFPD-BLLLJJGKSA-N 1 1 359.430 2.658 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)c1[N+](=O)[O-] ZINC000825170237 997234596 /nfs/dbraw/zinc/23/45/96/997234596.db2.gz UZXDFZXVPSJKAN-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000843904662 997504217 /nfs/dbraw/zinc/50/42/17/997504217.db2.gz ZHSCLGBNZXRBGK-HNNXBMFYSA-N 1 1 370.365 2.598 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000845735438 998641436 /nfs/dbraw/zinc/64/14/36/998641436.db2.gz XKSWZXMXBVWZNW-ZDUSSCGKSA-N 1 1 358.398 2.810 20 5 FFBDMO C[C@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000803856270 1016245500 /nfs/dbraw/zinc/24/55/00/1016245500.db2.gz OCICYLSQOLAGDK-DZGCQCFKSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000803859748 1016248694 /nfs/dbraw/zinc/24/86/94/1016248694.db2.gz VQSNJIRZDMNBQP-UONOGXRCSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@@H](OC(=O)[C@@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741033370 999701745 /nfs/dbraw/zinc/70/17/45/999701745.db2.gz QQODHQLKVIDNBD-ZIAGYGMSSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000741724496 999738776 /nfs/dbraw/zinc/73/87/76/999738776.db2.gz MRHRSZXEYXGMSZ-LSDHHAIUSA-N 1 1 360.458 2.798 20 5 FFBDMO O=C1CN(C[N@H+]2CCC3(CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000743389414 999816481 /nfs/dbraw/zinc/81/64/81/999816481.db2.gz AVLNIMOEKYUWRW-UHFFFAOYSA-N 1 1 358.398 2.587 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCC[NH+]1Cc2ccccc2C1 ZINC000744171621 999845845 /nfs/dbraw/zinc/84/58/45/999845845.db2.gz PPXXPDLOVIMRAL-UHFFFAOYSA-N 1 1 366.421 2.915 20 5 FFBDMO CCOC(=O)c1cc(C(=O)NCCn2cc[nH+]c2C(C)C)cc([N+](=O)[O-])c1 ZINC000744400133 999855292 /nfs/dbraw/zinc/85/52/92/999855292.db2.gz ICMDQKSWRACSGX-UHFFFAOYSA-N 1 1 374.397 2.521 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169035899 1000016638 /nfs/dbraw/zinc/01/66/38/1000016638.db2.gz MFILNIGVFBKUHA-HUUCEWRRSA-N 1 1 353.463 2.765 20 5 FFBDMO CCN1CC[C@@]2(C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2c2ccccc2)C1=O ZINC001169026671 1000018212 /nfs/dbraw/zinc/01/82/12/1000018212.db2.gz YNGVVWVEGYYIJR-SFFNPBHPSA-N 1 1 371.481 2.770 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC1(F)F ZINC001169046379 1000018558 /nfs/dbraw/zinc/01/85/58/1000018558.db2.gz LNWLJXXPSAKAPE-JHJVBQTASA-N 1 1 363.405 2.666 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]12 ZINC001169052555 1000018956 /nfs/dbraw/zinc/01/89/56/1000018956.db2.gz HFSXODWPLMEOLV-OXGONZEZSA-N 1 1 353.463 2.667 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C[C@@H]1C ZINC001147743446 1000969143 /nfs/dbraw/zinc/96/91/43/1000969143.db2.gz WHNFEBQMYNFJOJ-STQMWFEESA-N 1 1 366.437 2.745 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[NH+]([C@@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC001148140008 1001042408 /nfs/dbraw/zinc/04/24/08/1001042408.db2.gz HHHUJPRQVGVUPR-INIZCTEOSA-N 1 1 371.441 2.789 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[NH+]([C@@H](CC)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC001148140008 1001042411 /nfs/dbraw/zinc/04/24/11/1001042411.db2.gz HHHUJPRQVGVUPR-INIZCTEOSA-N 1 1 371.441 2.789 20 5 FFBDMO C/C(=C/C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785814308 1001488154 /nfs/dbraw/zinc/48/81/54/1001488154.db2.gz ACWOCUIEIIFOKC-KGAUPUERSA-N 1 1 373.453 2.710 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000789522667 1002107775 /nfs/dbraw/zinc/10/77/75/1002107775.db2.gz XEAYVZLITMPPDR-QGZVFWFLSA-N 1 1 371.441 2.797 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(c3nccs3)CC2)c([N+](=O)[O-])c1 ZINC001170326606 1003113229 /nfs/dbraw/zinc/11/32/29/1003113229.db2.gz AHGKVXMHGYRGOY-CYBMUJFWSA-N 1 1 362.455 2.813 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)n2)c1 ZINC000793747704 1003491402 /nfs/dbraw/zinc/49/14/02/1003491402.db2.gz SASRYPAKPLSFMY-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCOC[C@@H](C4CCC4)C3)n2)c1 ZINC000793747704 1003491405 /nfs/dbraw/zinc/49/14/05/1003491405.db2.gz SASRYPAKPLSFMY-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2cccc3ccccc32)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001401055 1016782092 /nfs/dbraw/zinc/78/20/92/1016782092.db2.gz XSSDLOANKYEARJ-WOJBJXKFSA-N 1 1 367.449 2.833 20 5 FFBDMO CC(C)(C)OC(=O)N[C@]12CCC[C@@H]1C[N@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC001196470066 1003779896 /nfs/dbraw/zinc/77/98/96/1003779896.db2.gz MMQYOLRHXZCJBX-KDOFPFPSSA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)N[C@]12CCC[C@@H]1C[N@@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC001196470066 1003779901 /nfs/dbraw/zinc/77/99/01/1003779901.db2.gz MMQYOLRHXZCJBX-KDOFPFPSSA-N 1 1 362.430 2.869 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001196773858 1003966544 /nfs/dbraw/zinc/96/65/44/1003966544.db2.gz UVECIKVIHAXGBK-ZIAGYGMSSA-N 1 1 365.430 2.961 20 5 FFBDMO COC(=O)CC1([NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CCC1 ZINC001192604119 1004213710 /nfs/dbraw/zinc/21/37/10/1004213710.db2.gz JVMPRSHKFWMOHH-UHFFFAOYSA-N 1 1 357.204 2.933 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Cl)cc(S(N)(=O)=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC001197660590 1004304505 /nfs/dbraw/zinc/30/45/05/1004304505.db2.gz OSFBSKQJAIIFJB-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](CCc2ccccc2)[C@@H]2CCOC2)cc1 ZINC000776590371 1006002731 /nfs/dbraw/zinc/00/27/31/1006002731.db2.gz DBYIJSHMEOJQNN-UXHICEINSA-N 1 1 356.422 2.962 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@H+](Cc3ccccc3C)CCO2)n1 ZINC001187362330 1006036301 /nfs/dbraw/zinc/03/63/01/1006036301.db2.gz VYDAVBZUFOXJGQ-KRWDZBQOSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+](Cc3ccccc3C)CCO2)n1 ZINC001187362330 1006036311 /nfs/dbraw/zinc/03/63/11/1006036311.db2.gz VYDAVBZUFOXJGQ-KRWDZBQOSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1cc(NCC[N@H+]2CCC(C)(C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001187862866 1006281256 /nfs/dbraw/zinc/28/12/56/1006281256.db2.gz VFPVOXRFMQNZTM-UHFFFAOYSA-N 1 1 355.442 2.926 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC001170755694 1006389927 /nfs/dbraw/zinc/38/99/27/1006389927.db2.gz KGKQSZVREPTXGJ-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CN(C(=O)OC(C)(C)C)C1 ZINC001170755694 1006389935 /nfs/dbraw/zinc/38/99/35/1006389935.db2.gz KGKQSZVREPTXGJ-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499101 1006415043 /nfs/dbraw/zinc/41/50/43/1006415043.db2.gz IRNCLZAGVWWQEH-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499101 1006415050 /nfs/dbraw/zinc/41/50/50/1006415050.db2.gz IRNCLZAGVWWQEH-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000853569741 1006451047 /nfs/dbraw/zinc/45/10/47/1006451047.db2.gz ARSSUAKCBWTVRW-HIFRSBDPSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000853569741 1006451053 /nfs/dbraw/zinc/45/10/53/1006451053.db2.gz ARSSUAKCBWTVRW-HIFRSBDPSA-N 1 1 361.398 2.741 20 5 FFBDMO COc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1[N+](=O)[O-] ZINC000775181827 1006641807 /nfs/dbraw/zinc/64/18/07/1006641807.db2.gz WNROWWUXISOWNJ-UHFFFAOYSA-N 1 1 357.326 2.678 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@@H]3COC4(CCCCC4)O3)CC2)c1 ZINC001190332118 1007587170 /nfs/dbraw/zinc/58/71/70/1007587170.db2.gz PRODSPPOUYVPNK-GOSISDBHSA-N 1 1 361.442 2.793 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)o1 ZINC001190436491 1007639412 /nfs/dbraw/zinc/63/94/12/1007639412.db2.gz GSGXWGIJNYYVEA-LBPRGKRZSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)o1 ZINC001190436491 1007639417 /nfs/dbraw/zinc/63/94/17/1007639417.db2.gz GSGXWGIJNYYVEA-LBPRGKRZSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOC3CC3)CC2)c(C(F)(F)F)c1 ZINC001190809324 1007772650 /nfs/dbraw/zinc/77/26/50/1007772650.db2.gz HWDLRKGMBJYBFV-UHFFFAOYSA-N 1 1 359.348 2.915 20 5 FFBDMO N[C@H](CCC[NH3+])Nc1nc2ccsc2c(Oc2cccc([N+](=O)[O-])c2)n1 ZINC001170897706 1007896189 /nfs/dbraw/zinc/89/61/89/1007896189.db2.gz JEDRDRBLSWCRBA-ZDUSSCGKSA-N 1 1 374.426 2.827 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000856677256 1007944318 /nfs/dbraw/zinc/94/43/18/1007944318.db2.gz NCTHIZYSVVPLQS-IFXJQAMLSA-N 1 1 374.441 2.979 20 5 FFBDMO Cc1cc(F)cc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000820079854 1008281580 /nfs/dbraw/zinc/28/15/80/1008281580.db2.gz WGGJUQNDWKKUHT-PIIMJCKOSA-N 1 1 369.396 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1F ZINC000859293191 1008498453 /nfs/dbraw/zinc/49/84/53/1008498453.db2.gz UPXPIPJOEFVTLN-IBGZPJMESA-N 1 1 360.385 2.888 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@]2(CO)CCOC2)cc1F ZINC000859293191 1008498454 /nfs/dbraw/zinc/49/84/54/1008498454.db2.gz UPXPIPJOEFVTLN-IBGZPJMESA-N 1 1 360.385 2.888 20 5 FFBDMO CCOC(=O)c1cc(C(=O)OCC[C@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1 ZINC000822043633 1008513393 /nfs/dbraw/zinc/51/33/93/1008513393.db2.gz KWHJLIAHSWQNKA-OAHLLOKOSA-N 1 1 364.398 2.803 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC3(CCOCC3)CC[C@H]2CO)cc1 ZINC000859519354 1008539716 /nfs/dbraw/zinc/53/97/16/1008539716.db2.gz MMEXGYNIWZOKOV-KRWDZBQOSA-N 1 1 364.442 2.617 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000137512873 1008616695 /nfs/dbraw/zinc/61/66/95/1008616695.db2.gz LBFADFHJRCWQJZ-HOCLYGCPSA-N 1 1 368.437 2.878 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000822516632 1008664926 /nfs/dbraw/zinc/66/49/26/1008664926.db2.gz OMEBLDOKHKZPJE-LJQANCHMSA-N 1 1 360.410 2.952 20 5 FFBDMO Cc1cc(=O)[nH]c(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000886656371 1008797655 /nfs/dbraw/zinc/79/76/55/1008797655.db2.gz BXRYMYYYTHUFLE-AWEZNQCLSA-N 1 1 357.414 2.590 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)c(C)[nH+]1 ZINC001178441508 1008975198 /nfs/dbraw/zinc/97/51/98/1008975198.db2.gz HZHDVNJIXCQHHJ-UHFFFAOYSA-N 1 1 371.166 2.766 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)c1C ZINC000890277733 1009107577 /nfs/dbraw/zinc/10/75/77/1009107577.db2.gz QPJICLBLQXOKPZ-AWEZNQCLSA-N 1 1 361.442 2.537 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@](C)(O)c1ccccc1 ZINC000823584067 1009120325 /nfs/dbraw/zinc/12/03/25/1009120325.db2.gz BPMITYVBLMVXST-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@](C)(O)c1ccccc1 ZINC000823584067 1009120332 /nfs/dbraw/zinc/12/03/32/1009120332.db2.gz BPMITYVBLMVXST-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823599454 1009135527 /nfs/dbraw/zinc/13/55/27/1009135527.db2.gz UKHQXQZBOFVSLE-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823599454 1009135535 /nfs/dbraw/zinc/13/55/35/1009135535.db2.gz UKHQXQZBOFVSLE-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO C/C(=C\C(=O)N1CCC([N@H+]2CCCOCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000861985019 1009647100 /nfs/dbraw/zinc/64/71/00/1009647100.db2.gz QQRCMXBTBCZAFH-FOCLMDBBSA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@H](C[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)NC(=O)OC(C)(C)C ZINC000863334917 1010182623 /nfs/dbraw/zinc/18/26/23/1010182623.db2.gz DXQNSSXXYSJNNM-GFCCVEGCSA-N 1 1 363.418 2.747 20 5 FFBDMO C[C@H](C[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21)NC(=O)OC(C)(C)C ZINC000863334917 1010182630 /nfs/dbraw/zinc/18/26/30/1010182630.db2.gz DXQNSSXXYSJNNM-GFCCVEGCSA-N 1 1 363.418 2.747 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@H+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C1 ZINC000794632678 1010447851 /nfs/dbraw/zinc/44/78/51/1010447851.db2.gz LAIIPAJATCPZIE-CYBMUJFWSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C1 ZINC000794632678 1010447859 /nfs/dbraw/zinc/44/78/59/1010447859.db2.gz LAIIPAJATCPZIE-CYBMUJFWSA-N 1 1 369.377 2.958 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC000865499487 1010800161 /nfs/dbraw/zinc/80/01/61/1010800161.db2.gz OUDLFIVNEDEKAC-HNNXBMFYSA-N 1 1 370.400 2.887 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C[C@@H]2CCOC2)CC1 ZINC000866270173 1010966997 /nfs/dbraw/zinc/96/69/97/1010966997.db2.gz SOQOJBIFWLFPHK-CABCVRRESA-N 1 1 365.449 2.755 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000866351900 1010981844 /nfs/dbraw/zinc/98/18/44/1010981844.db2.gz SMKRCOXTOJSCJB-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1ccnc1 ZINC000121676781 1011068632 /nfs/dbraw/zinc/06/86/32/1011068632.db2.gz OOZXQPLWAAWOJO-PBHICJAKSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1n1ccnc1 ZINC000121676781 1011068638 /nfs/dbraw/zinc/06/86/38/1011068638.db2.gz OOZXQPLWAAWOJO-PBHICJAKSA-N 1 1 367.413 2.590 20 5 FFBDMO CCOc1ccc(CN(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867957357 1011131745 /nfs/dbraw/zinc/13/17/45/1011131745.db2.gz KCDHJHKAZSNFSS-LJQANCHMSA-N 1 1 357.410 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](Oc3cnccn3)C1)CC2 ZINC001172914036 1012097946 /nfs/dbraw/zinc/09/79/46/1012097946.db2.gz YCBUBEMZOWCYPQ-SJLPKXTDSA-N 1 1 354.410 2.786 20 5 FFBDMO C[N@H+](Cc1ncccn1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009822 1012180094 /nfs/dbraw/zinc/18/00/94/1012180094.db2.gz HUCYRUXKOGMFTJ-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO C[N@@H+](Cc1ncccn1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009822 1012180107 /nfs/dbraw/zinc/18/01/07/1012180107.db2.gz HUCYRUXKOGMFTJ-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@H](CO)C3)CC2)c(F)c1 ZINC001173011416 1012181544 /nfs/dbraw/zinc/18/15/44/1012181544.db2.gz BPQDSJQZABUIIX-LBPRGKRZSA-N 1 1 355.385 2.546 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C)CC[NH2+]2)cc1 ZINC000870139249 1012187671 /nfs/dbraw/zinc/18/76/71/1012187671.db2.gz NXUWAVHTAHQWLB-SFHVURJKSA-N 1 1 355.394 2.699 20 5 FFBDMO CN(C)C[C@@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017840 1012189351 /nfs/dbraw/zinc/18/93/51/1012189351.db2.gz JYCGLCNLIXZISJ-AWEZNQCLSA-N 1 1 368.428 2.868 20 5 FFBDMO C[NH+](C)C[C@@H]1CCCN1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017840 1012189363 /nfs/dbraw/zinc/18/93/63/1012189363.db2.gz JYCGLCNLIXZISJ-AWEZNQCLSA-N 1 1 368.428 2.868 20 5 FFBDMO C[N@@H+](Cc1ccno1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018828 1012190106 /nfs/dbraw/zinc/19/01/06/1012190106.db2.gz FYNNOMMTDONEGM-UHFFFAOYSA-N 1 1 352.341 2.962 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC(F)(F)[C@H](CO)C2)c1F ZINC001173179410 1012321863 /nfs/dbraw/zinc/32/18/63/1012321863.db2.gz FMULNUFNLJJYQY-QWRGUYRKSA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC(F)(F)[C@H](CO)C2)c1F ZINC001173179410 1012321883 /nfs/dbraw/zinc/32/18/83/1012321883.db2.gz FMULNUFNLJJYQY-QWRGUYRKSA-N 1 1 362.348 2.623 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3C)c1F ZINC001173180579 1012324622 /nfs/dbraw/zinc/32/46/22/1012324622.db2.gz WWJZTVNGWUVQGB-YIYPIFLZSA-N 1 1 351.422 2.888 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ncc(Cl)cn2)c1F ZINC001173189738 1012333106 /nfs/dbraw/zinc/33/31/06/1012333106.db2.gz QHYQHVZKQRACCO-VIFPVBQESA-N 1 1 354.769 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@H](n3cncn3)C2)c1F ZINC001173197303 1012340436 /nfs/dbraw/zinc/34/04/36/1012340436.db2.gz SNYUXSOBIQAYQX-OLZOCXBDSA-N 1 1 363.393 2.602 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001173224144 1012358124 /nfs/dbraw/zinc/35/81/24/1012358124.db2.gz IPAXCWSIORWSAB-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1(C)C ZINC000773371930 1012458980 /nfs/dbraw/zinc/45/89/80/1012458980.db2.gz ZLHIKIWXNDYSPI-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1(C)C ZINC000773371930 1012458986 /nfs/dbraw/zinc/45/89/86/1012458986.db2.gz ZLHIKIWXNDYSPI-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO CC(=O)Oc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000123222653 1012487476 /nfs/dbraw/zinc/48/74/76/1012487476.db2.gz NFOSAZJNMCPSBU-HNNXBMFYSA-N 1 1 356.382 2.602 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347353 1017120254 /nfs/dbraw/zinc/12/02/54/1017120254.db2.gz VEZTZISNDZXGGM-BZUAXINKSA-N 1 1 374.485 2.853 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347353 1017120261 /nfs/dbraw/zinc/12/02/61/1017120261.db2.gz VEZTZISNDZXGGM-BZUAXINKSA-N 1 1 374.485 2.853 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347356 1017120583 /nfs/dbraw/zinc/12/05/83/1017120583.db2.gz VEZTZISNDZXGGM-XHSDSOJGSA-N 1 1 374.485 2.853 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347356 1017120587 /nfs/dbraw/zinc/12/05/87/1017120587.db2.gz VEZTZISNDZXGGM-XHSDSOJGSA-N 1 1 374.485 2.853 20 5 FFBDMO COC(=O)Cc1ccc(N2CCC(C[N@@H+](C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000827425672 1017987658 /nfs/dbraw/zinc/98/76/58/1017987658.db2.gz MYEYGILMOPDWTR-UHFFFAOYSA-N 1 1 363.458 2.867 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC[N@H+]1C ZINC000928440782 1018979299 /nfs/dbraw/zinc/97/92/99/1018979299.db2.gz KXNOHNBDRMBGSA-HWPZZCPQSA-N 1 1 371.387 2.782 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777735248 1019207983 /nfs/dbraw/zinc/20/79/83/1019207983.db2.gz XSGVUJYFWDBUIX-YJYMSZOUSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777735248 1019207995 /nfs/dbraw/zinc/20/79/95/1019207995.db2.gz XSGVUJYFWDBUIX-YJYMSZOUSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000801945343 1019529221 /nfs/dbraw/zinc/52/92/21/1019529221.db2.gz DRTQRYXJBARTJC-GFCCVEGCSA-N 1 1 360.389 2.566 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)CC[C@@H](O)c1ccccc1)C2 ZINC000930100623 1019869580 /nfs/dbraw/zinc/86/95/80/1019869580.db2.gz VQBYGNWNYISNTJ-YLJYHZDGSA-N 1 1 356.422 2.828 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(O)(Cc2ccccn2)CC1 ZINC000930988902 1020271394 /nfs/dbraw/zinc/27/13/94/1020271394.db2.gz FQGIYVFAPAGZHS-UHFFFAOYSA-N 1 1 357.410 2.568 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000900267426 1020318432 /nfs/dbraw/zinc/31/84/32/1020318432.db2.gz GDNYBYRLACELNA-MRXNPFEDSA-N 1 1 362.474 2.578 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(CN2CC[NH+](CCc3ccncc3)CC2)c(F)c1 ZINC000931343073 1020431419 /nfs/dbraw/zinc/43/14/19/1020431419.db2.gz YMMBBZHAWFQLME-UHFFFAOYSA-N 1 1 362.380 2.628 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000800866110 1020611224 /nfs/dbraw/zinc/61/12/24/1020611224.db2.gz SHAWWBPHPFYALH-UHFFFAOYSA-N 1 1 355.354 2.985 20 5 FFBDMO CC(C)C[N@H+](Cc1ccccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932450347 1020806461 /nfs/dbraw/zinc/80/64/61/1020806461.db2.gz ZOSDGTAYNHSLOA-KRWDZBQOSA-N 1 1 359.426 2.888 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](C2CCOCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000933081779 1020955422 /nfs/dbraw/zinc/95/54/22/1020955422.db2.gz OLSKJVJHBFDCIE-QGZVFWFLSA-N 1 1 373.453 2.623 20 5 FFBDMO Cc1cccc(NC[C@H]2CCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)n1 ZINC001116351686 1021175901 /nfs/dbraw/zinc/17/59/01/1021175901.db2.gz ISHFVUOFCWVLBW-MSOLQXFVSA-N 1 1 356.426 2.908 20 5 FFBDMO Cc1c(C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)cnn1-c1cc[nH+]cc1 ZINC001116462772 1021229882 /nfs/dbraw/zinc/22/98/82/1021229882.db2.gz IXYFRLSXXYXWHL-UHFFFAOYSA-N 1 1 363.377 2.995 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@]2(CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])C1 ZINC000934735519 1021379300 /nfs/dbraw/zinc/37/93/00/1021379300.db2.gz ZPYAHRANNKAWTR-SFHVURJKSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@]2(CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])C1 ZINC000934735519 1021379314 /nfs/dbraw/zinc/37/93/14/1021379314.db2.gz ZPYAHRANNKAWTR-SFHVURJKSA-N 1 1 362.430 2.965 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000934836884 1021421626 /nfs/dbraw/zinc/42/16/26/1021421626.db2.gz DVHAJHVNDJPWSD-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000934838193 1021421858 /nfs/dbraw/zinc/42/18/58/1021421858.db2.gz IZMORKOSZXDOPO-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934841627 1021425866 /nfs/dbraw/zinc/42/58/66/1021425866.db2.gz NBCALIFUCPDXJQ-IAGOWNOFSA-N 1 1 373.453 2.623 20 5 FFBDMO CCc1nc2c(c(OC3CCN(c4ccc([N+](=O)[O-])cc4)CC3)n1)C[NH2+]C2 ZINC001218192958 1033042019 /nfs/dbraw/zinc/04/20/19/1033042019.db2.gz OEHKRVAPNBYETG-UHFFFAOYSA-N 1 1 369.425 2.598 20 5 FFBDMO O=C1N(C[N@H+]2CCCC3(CCOCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752792166 1023205759 /nfs/dbraw/zinc/20/57/59/1023205759.db2.gz JFIWPFRXUVVREY-UHFFFAOYSA-N 1 1 374.441 2.687 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001122957994 1023573985 /nfs/dbraw/zinc/57/39/85/1023573985.db2.gz LBOKDAYSAUWKOT-WMLDXEAASA-N 1 1 372.425 2.554 20 5 FFBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000755790731 1023636560 /nfs/dbraw/zinc/63/65/60/1023636560.db2.gz QJFPWWIXWGQSPI-HNNXBMFYSA-N 1 1 352.398 2.639 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000755794482 1023637366 /nfs/dbraw/zinc/63/73/66/1023637366.db2.gz UAQLQAMHGBNCBB-OAHLLOKOSA-N 1 1 354.414 2.880 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000755794482 1023637369 /nfs/dbraw/zinc/63/73/69/1023637369.db2.gz UAQLQAMHGBNCBB-OAHLLOKOSA-N 1 1 354.414 2.880 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C3CC3)[C@H]2C1 ZINC001123705341 1023949697 /nfs/dbraw/zinc/94/96/97/1023949697.db2.gz MLSLFPTUOFHCQX-JCGIZDLHSA-N 1 1 358.442 2.609 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC001121791818 1024027703 /nfs/dbraw/zinc/02/77/03/1024027703.db2.gz LSVSDZFUOIXXBD-CYBMUJFWSA-N 1 1 374.445 2.777 20 5 FFBDMO C[C@@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000194641995 1024872141 /nfs/dbraw/zinc/87/21/41/1024872141.db2.gz HQXZHSRFHXMAAO-XHSDSOJGSA-N 1 1 360.458 2.505 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000837385759 1025763566 /nfs/dbraw/zinc/76/35/66/1025763566.db2.gz DKJUCQDEJMNOGY-HNNXBMFYSA-N 1 1 373.413 2.595 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000837700105 1025970927 /nfs/dbraw/zinc/97/09/27/1025970927.db2.gz RTUCJJKDNLRVHW-AWEZNQCLSA-N 1 1 358.398 2.873 20 5 FFBDMO CN(CCC[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000839655189 1026777797 /nfs/dbraw/zinc/77/77/97/1026777797.db2.gz TVOPXJOUEBRWOF-MRXNPFEDSA-N 1 1 367.446 2.817 20 5 FFBDMO O=C1[C@H]2CCC[C@H]2CN1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000840014464 1026912278 /nfs/dbraw/zinc/91/22/78/1026912278.db2.gz IFWLOOMINMDDQY-KSSFIOAISA-N 1 1 359.426 2.654 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)C1 ZINC000840085190 1026950015 /nfs/dbraw/zinc/95/00/15/1026950015.db2.gz BIGNFPRHJVSKAI-LJQANCHMSA-N 1 1 355.442 2.834 20 5 FFBDMO COC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840127002 1026969667 /nfs/dbraw/zinc/96/96/67/1026969667.db2.gz QMUDIFVLOJUKMI-QFBILLFUSA-N 1 1 361.442 2.617 20 5 FFBDMO COC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840127002 1026969673 /nfs/dbraw/zinc/96/96/73/1026969673.db2.gz QMUDIFVLOJUKMI-QFBILLFUSA-N 1 1 361.442 2.617 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C12CCC2 ZINC000840140144 1026980036 /nfs/dbraw/zinc/98/00/36/1026980036.db2.gz MFGKZCZRBIYKIO-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccccc2Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160098203 1027589985 /nfs/dbraw/zinc/58/99/85/1027589985.db2.gz WYDGZKHMIUZSPO-NVXWUHKLSA-N 1 1 363.845 2.644 20 5 FFBDMO Cc1ccccc1CCC[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001160106825 1027592764 /nfs/dbraw/zinc/59/27/64/1027592764.db2.gz DAQBIDDKZHKFND-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1ccccc1CCC[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160106825 1027592778 /nfs/dbraw/zinc/59/27/78/1027592778.db2.gz DAQBIDDKZHKFND-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1ccccc1CCC[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001160106825 1027592790 /nfs/dbraw/zinc/59/27/90/1027592790.db2.gz DAQBIDDKZHKFND-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO CC(C)[C@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000780499093 1028715863 /nfs/dbraw/zinc/71/58/63/1028715863.db2.gz RJKBQHPCPQPFBH-AWEZNQCLSA-N 1 1 360.414 2.689 20 5 FFBDMO Cc1cccc(N2CCN(c3cnc4ccc([N+](=O)[O-])cc4n3)CC2)[nH+]1 ZINC001163660116 1029012164 /nfs/dbraw/zinc/01/21/64/1029012164.db2.gz MLXIWCDDFZLSPW-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO CSc1ncc2c(n1)CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)CC2 ZINC001156162695 1029069836 /nfs/dbraw/zinc/06/98/36/1029069836.db2.gz KXJRCEJOFFYFLG-GQCTYLIASA-N 1 1 372.454 2.597 20 5 FFBDMO Cc1[nH+]ccn1CCNc1nc(C)c(Br)c(C)c1[N+](=O)[O-] ZINC001163930047 1029118222 /nfs/dbraw/zinc/11/82/22/1029118222.db2.gz ZYINJBLAALXCGI-UHFFFAOYSA-N 1 1 354.208 2.986 20 5 FFBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000781585730 1029289001 /nfs/dbraw/zinc/28/90/01/1029289001.db2.gz IAETVQPVCUYNON-IFXJQAMLSA-N 1 1 372.425 2.833 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494423 1029298064 /nfs/dbraw/zinc/29/80/64/1029298064.db2.gz JFDVAFWGCANYFQ-QZTJIDSGSA-N 1 1 357.454 2.605 20 5 FFBDMO Cn1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc([N+](=O)[O-])c1=O ZINC001164491800 1029298765 /nfs/dbraw/zinc/29/87/65/1029298765.db2.gz GKNLCTLIEWJBHX-CGTJXYLNSA-N 1 1 368.437 2.616 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cc([N+](=O)[O-])c3cc[nH]c3n2)CC1 ZINC001165110603 1029400263 /nfs/dbraw/zinc/40/02/63/1029400263.db2.gz TZKUPKXAGYXJME-AWEZNQCLSA-N 1 1 359.430 2.551 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1cc([N+](=O)[O-])cc[n+]1[O-] ZINC001165180688 1029435813 /nfs/dbraw/zinc/43/58/13/1029435813.db2.gz DJOKKRVZWNATSW-MAUKXSAKSA-N 1 1 356.426 2.575 20 5 FFBDMO Cc1ccc(-c2ccc(N3C[C@@H]4CCC[N@H+](C)[C@@H]4C3)nn2)cc1[N+](=O)[O-] ZINC001157269203 1029531015 /nfs/dbraw/zinc/53/10/15/1029531015.db2.gz ASLXSVVQUDUPGZ-MAUKXSAKSA-N 1 1 353.426 2.891 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@@H]21 ZINC001157282991 1029536006 /nfs/dbraw/zinc/53/60/06/1029536006.db2.gz SCKLPJXAZVFGPE-GUYCJALGSA-N 1 1 357.389 2.721 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3nc(SC)nc(Cl)c3[N+](=O)[O-])C[C@H]2C1 ZINC001157688108 1029646061 /nfs/dbraw/zinc/64/60/61/1029646061.db2.gz BPFNNRXHCJYETO-AOOOYVTPSA-N 1 1 357.867 2.538 20 5 FFBDMO Cc1cc(NC2CC[NH+](C[C@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000782947199 1029860832 /nfs/dbraw/zinc/86/08/32/1029860832.db2.gz FAMDSBZHOXJCSY-QGZVFWFLSA-N 1 1 370.453 2.929 20 5 FFBDMO COC(=O)COc1c(C)cc(NCC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC001165300113 1029936736 /nfs/dbraw/zinc/93/67/36/1029936736.db2.gz HKSSBGWFVJOJMV-CQSZACIVSA-N 1 1 365.430 2.599 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2nc(NCc3ccc(C[NH+]4CCOCC4)cc3)ccc12 ZINC001165326967 1029945755 /nfs/dbraw/zinc/94/57/55/1029945755.db2.gz SDISFDFCSBOHOD-UHFFFAOYSA-N 1 1 367.409 2.915 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000784031993 1030430499 /nfs/dbraw/zinc/43/04/99/1030430499.db2.gz UZNLBPWYBJTQKQ-AWEZNQCLSA-N 1 1 360.414 2.685 20 5 FFBDMO C/C(=C/C(=O)OC[C@H]1C[N@@H+](CC(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000784870965 1030854418 /nfs/dbraw/zinc/85/44/18/1030854418.db2.gz JUGTWXMKMUZMFO-QWSHFYNQSA-N 1 1 362.426 2.898 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796703621 1030887446 /nfs/dbraw/zinc/88/74/46/1030887446.db2.gz BMYOBZVNNWJNST-INIZCTEOSA-N 1 1 365.430 2.963 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000842835382 1030984898 /nfs/dbraw/zinc/98/48/98/1030984898.db2.gz GKTOEPJXMXOCKA-ZDUSSCGKSA-N 1 1 364.398 2.643 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])n1C ZINC000797081620 1030991658 /nfs/dbraw/zinc/99/16/58/1030991658.db2.gz VVTIKWDJNGQLHQ-GDBMZVCRSA-N 1 1 354.410 2.690 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196601 1031694698 /nfs/dbraw/zinc/69/46/98/1031694698.db2.gz UHTKJMFHXMEGPV-RDTXWAMCSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000799196601 1031694701 /nfs/dbraw/zinc/69/47/01/1031694701.db2.gz UHTKJMFHXMEGPV-RDTXWAMCSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C(NCC1([NH2+]CCCc2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530828 1031788375 /nfs/dbraw/zinc/78/83/75/1031788375.db2.gz UELKVBQMFXRTTA-QZTJIDSGSA-N 1 1 359.470 2.693 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2C)CC[N@@H+]1CCOC ZINC001151375673 1031937758 /nfs/dbraw/zinc/93/77/58/1031937758.db2.gz IISIWGURMKZUSC-CQSZACIVSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2C)CC[N@H+]1CCOC ZINC001151375673 1031937766 /nfs/dbraw/zinc/93/77/66/1031937766.db2.gz IISIWGURMKZUSC-CQSZACIVSA-N 1 1 367.421 2.615 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@H](O)CNC(=O)OC(C)(C)C ZINC000830456878 1033621581 /nfs/dbraw/zinc/62/15/81/1033621581.db2.gz MWQPOFULZMFYPN-DZGCQCFKSA-N 1 1 367.446 2.782 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000830838113 1033813850 /nfs/dbraw/zinc/81/38/50/1033813850.db2.gz JOWWGQDRRCRQQD-INIZCTEOSA-N 1 1 366.437 2.650 20 5 FFBDMO Cc1ccnc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC001226120327 1034534575 /nfs/dbraw/zinc/53/45/75/1034534575.db2.gz UBWILOLDGHQKJO-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(OC2CC[NH+](C(C)(C)C)CC2)cc1O ZINC001228814377 1036340614 /nfs/dbraw/zinc/34/06/14/1036340614.db2.gz MFMIKPMGQQUHFF-UHFFFAOYSA-N 1 1 352.387 2.729 20 5 FFBDMO Cc1nc2c(c(O[C@H](C[N+](=O)[O-])C3CC3)n1)C[N@H+](Cc1ccccc1)CC2 ZINC001229846068 1036929942 /nfs/dbraw/zinc/92/99/42/1036929942.db2.gz KMSXINVYKPIQBZ-LJQANCHMSA-N 1 1 368.437 2.777 20 5 FFBDMO Cc1nc2c(c(O[C@H](C[N+](=O)[O-])C3CC3)n1)C[N@@H+](Cc1ccccc1)CC2 ZINC001229846068 1036929952 /nfs/dbraw/zinc/92/99/52/1036929952.db2.gz KMSXINVYKPIQBZ-LJQANCHMSA-N 1 1 368.437 2.777 20 5 FFBDMO COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1[N+](=O)[O-] ZINC001229876337 1036953411 /nfs/dbraw/zinc/95/34/11/1036953411.db2.gz UTODGLDKSWGTOS-DRXBFXEBSA-N 1 1 365.386 2.929 20 5 FFBDMO CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c1 ZINC001234410131 1037024669 /nfs/dbraw/zinc/02/46/69/1037024669.db2.gz NFYJFMXQCKOHPV-QWHZDKJVSA-N 1 1 362.426 2.810 20 5 FFBDMO Cc1c(Br)cnc(O[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-] ZINC001230037118 1037048032 /nfs/dbraw/zinc/04/80/32/1037048032.db2.gz GMIHLFPMVXDCGV-SECBINFHSA-N 1 1 353.176 2.651 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CO1 ZINC001207716099 1037675065 /nfs/dbraw/zinc/67/50/65/1037675065.db2.gz UDADRWUVUYAZIC-LLVKDONJSA-N 1 1 357.794 2.889 20 5 FFBDMO COc1cc(N2CCC(N3CCC[N@H+]4CCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099562 1038385192 /nfs/dbraw/zinc/38/51/92/1038385192.db2.gz RMNKVYHRRDPSJT-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCCN4CCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099562 1038385203 /nfs/dbraw/zinc/38/52/03/1038385203.db2.gz RMNKVYHRRDPSJT-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCN4CCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099562 1038385208 /nfs/dbraw/zinc/38/52/08/1038385208.db2.gz RMNKVYHRRDPSJT-SFHVURJKSA-N 1 1 374.485 2.742 20 5 FFBDMO N[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1F ZINC001246572179 1039402452 /nfs/dbraw/zinc/40/24/52/1039402452.db2.gz UVDNNOUDXGLPRA-CJNGLKHVSA-N 1 1 372.391 2.603 20 5 FFBDMO c1cc2n(n1)[C@H](c1nc(-c3ccc4ccc5cccnc5c4n3)no1)C[NH2+]C2 ZINC001247129348 1039623440 /nfs/dbraw/zinc/62/34/40/1039623440.db2.gz ALZUHQBTWGACCO-INIZCTEOSA-N 1 1 369.388 2.722 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@](O)(C(F)(F)F)C3)CC2)cc1 ZINC001254475069 1040743725 /nfs/dbraw/zinc/74/37/25/1040743725.db2.gz ZOUBKVXTMCDPKG-HNNXBMFYSA-N 1 1 359.348 2.563 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](Oc4ncccn4)C3)CC2)cc1 ZINC001254483743 1040749959 /nfs/dbraw/zinc/74/99/59/1040749959.db2.gz XKPQKPWXBNYJHN-GOSISDBHSA-N 1 1 369.425 2.507 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559864 1040795829 /nfs/dbraw/zinc/79/58/29/1040795829.db2.gz ZULJBBJRRIWHEG-HZPDHXFCSA-N 1 1 358.442 2.891 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559864 1040795841 /nfs/dbraw/zinc/79/58/41/1040795841.db2.gz ZULJBBJRRIWHEG-HZPDHXFCSA-N 1 1 358.442 2.891 20 5 FFBDMO COc1ccnc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC001254571448 1040808068 /nfs/dbraw/zinc/80/80/68/1040808068.db2.gz VTYUWPTXRMQXCZ-OAHLLOKOSA-N 1 1 356.426 2.752 20 5 FFBDMO CCn1ncc2c1[C@H](COC)C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597627 1040826988 /nfs/dbraw/zinc/82/69/88/1040826988.db2.gz UIFBMOKVQPWTLT-WMZOPIPTSA-N 1 1 356.426 2.524 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603066 1040832124 /nfs/dbraw/zinc/83/21/24/1040832124.db2.gz LGPRKSNSKSWTQX-UXHICEINSA-N 1 1 359.470 2.637 20 5 FFBDMO COC(=O)[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1c1ccccc1 ZINC001254608772 1040836350 /nfs/dbraw/zinc/83/63/50/1040836350.db2.gz BMOMYFNJIKNFGO-ZCNNSNEGSA-N 1 1 366.417 2.951 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC001262356789 1041654653 /nfs/dbraw/zinc/65/46/53/1041654653.db2.gz OAFFOCMZYPWZDJ-UHFFFAOYSA-N 1 1 351.357 2.683 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001538310378 1070402475 /nfs/dbraw/zinc/40/24/75/1070402475.db2.gz WDSKPUXHGAXDSP-CYBMUJFWSA-N 1 1 371.384 2.999 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC001538310378 1070402481 /nfs/dbraw/zinc/40/24/81/1070402481.db2.gz WDSKPUXHGAXDSP-CYBMUJFWSA-N 1 1 371.384 2.999 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C1 ZINC001310159358 1043645753 /nfs/dbraw/zinc/64/57/53/1043645753.db2.gz HLVZZYZFWHSXCH-JTQLQIEISA-N 1 1 358.345 2.754 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313368334 1044331610 /nfs/dbraw/zinc/33/16/10/1044331610.db2.gz DUWSDVNIYIFZJB-NVXWUHKLSA-N 1 1 360.458 2.968 20 5 FFBDMO CC(C)(C)c1ccc2c(c1)CC[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2 ZINC001318777948 1044870247 /nfs/dbraw/zinc/87/02/47/1044870247.db2.gz CMSAZJKOEIWVEZ-GOSISDBHSA-N 1 1 358.442 2.508 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC001289678778 1047717938 /nfs/dbraw/zinc/71/79/38/1047717938.db2.gz JRSFGMCAJLEPIP-UHFFFAOYSA-N 1 1 357.813 2.778 20 5 FFBDMO CC[NH+](CC)C1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC001330517530 1049189740 /nfs/dbraw/zinc/18/97/40/1049189740.db2.gz QCGQBZBKBKBWFQ-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2cc(Cl)c(C)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001340465133 1050859205 /nfs/dbraw/zinc/85/92/05/1050859205.db2.gz MIIZIQXWJRXSFD-UHFFFAOYSA-N 1 1 355.803 2.791 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001341133151 1051482327 /nfs/dbraw/zinc/48/23/27/1051482327.db2.gz LHSWBSNSARIFOE-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001341133151 1051482332 /nfs/dbraw/zinc/48/23/32/1051482332.db2.gz LHSWBSNSARIFOE-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](CC(C)C)C[C@@H](O)c1ccc(F)cc1 ZINC001307478774 1052312175 /nfs/dbraw/zinc/31/21/75/1052312175.db2.gz JYNPVLFTWLJGGC-QGZVFWFLSA-N 1 1 364.421 2.930 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)OCCO1 ZINC001307600443 1052326278 /nfs/dbraw/zinc/32/62/78/1052326278.db2.gz BRTLBKBUTFIUCU-ZDUSSCGKSA-N 1 1 374.397 2.620 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CCN2Cc1ccc(C[NH+]2CCOCC2)cc1 ZINC001307650244 1052330245 /nfs/dbraw/zinc/33/02/45/1052330245.db2.gz VARLNWYLTNHUDK-UHFFFAOYSA-N 1 1 353.422 2.990 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1 ZINC001308079619 1052401339 /nfs/dbraw/zinc/40/13/39/1052401339.db2.gz NUHQLCKUGWBFMS-CQSZACIVSA-N 1 1 361.442 2.830 20 5 FFBDMO CC(=O)NCc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC001308858498 1052508877 /nfs/dbraw/zinc/50/88/77/1052508877.db2.gz FKKQWCAGPFNJST-UHFFFAOYSA-N 1 1 354.366 2.662 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC001335442051 1053367268 /nfs/dbraw/zinc/36/72/68/1053367268.db2.gz VTHHSUALZFKUSH-SJORKVTESA-N 1 1 355.442 2.819 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c2ncc([N+](=O)[O-])cc12 ZINC001347244912 1053753614 /nfs/dbraw/zinc/75/36/14/1053753614.db2.gz WPHNJLNRLUZLGG-YOEHRIQHSA-N 1 1 359.430 2.887 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC001336560208 1054062771 /nfs/dbraw/zinc/06/27/71/1054062771.db2.gz FBULVXIDCIYTAW-DYVFJYSZSA-N 1 1 358.442 2.725 20 5 FFBDMO O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001347772342 1054304647 /nfs/dbraw/zinc/30/46/47/1054304647.db2.gz XHMYVMOHFMSHQR-GFCCVEGCSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001348361233 1054652749 /nfs/dbraw/zinc/65/27/49/1054652749.db2.gz CDDMLAZHDRTAMF-FUHWJXTLSA-N 1 1 370.409 2.623 20 5 FFBDMO Cc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000847253264 1055320593 /nfs/dbraw/zinc/32/05/93/1055320593.db2.gz ABGUWEGCRWYPIG-GJZGRUSLSA-N 1 1 362.386 2.558 20 5 FFBDMO C[C@@H]1CC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(C)C ZINC001473365746 1056253493 /nfs/dbraw/zinc/25/34/93/1056253493.db2.gz UCFDWPHQFDSRMP-MRXNPFEDSA-N 1 1 374.485 2.611 20 5 FFBDMO CCN(c1nnc(C[N+](=O)[O-])n1CC)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001339454022 1056468790 /nfs/dbraw/zinc/46/87/90/1056468790.db2.gz FYQHAQQLYLLUFW-WBVHZDCISA-N 1 1 372.473 2.737 20 5 FFBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC001339549719 1056573609 /nfs/dbraw/zinc/57/36/09/1056573609.db2.gz OVXYLYOMXYTRFU-ZDUSSCGKSA-N 1 1 373.461 2.512 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C(C)(C)C1 ZINC001472058973 1058337101 /nfs/dbraw/zinc/33/71/01/1058337101.db2.gz RHQWUAHBVGMCKY-GFCCVEGCSA-N 1 1 370.247 2.817 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2C)cc1SC ZINC001518485527 1058398251 /nfs/dbraw/zinc/39/82/51/1058398251.db2.gz JGSGXWLCBPXDNK-LLVKDONJSA-N 1 1 353.444 2.539 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001472448591 1058650585 /nfs/dbraw/zinc/65/05/85/1058650585.db2.gz OGKIZJRUDVHILA-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H](c1nnc(N2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)n1C)[N+](=O)[O-] ZINC001519598451 1058866246 /nfs/dbraw/zinc/86/62/46/1058866246.db2.gz VZGUHLDTHGVPGK-QXSJWSMHSA-N 1 1 372.473 2.641 20 5 FFBDMO CCC[N@H+]1CCC[C@H](C(=O)NCCCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC001455683228 1059870977 /nfs/dbraw/zinc/87/09/77/1059870977.db2.gz WHAMGSQRPAQELX-AWEZNQCLSA-N 1 1 373.457 2.642 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C2CC2)C[C@H]1C ZINC001515904463 1059875306 /nfs/dbraw/zinc/87/53/06/1059875306.db2.gz IYSNAADYBAFZJJ-CYBMUJFWSA-N 1 1 356.430 2.719 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(OCC2CC2)CC1 ZINC000848480244 1060108886 /nfs/dbraw/zinc/10/88/86/1060108886.db2.gz JHRKBRNKPPYGOS-LJQANCHMSA-N 1 1 373.453 2.759 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848487401 1060133430 /nfs/dbraw/zinc/13/34/30/1060133430.db2.gz RSMIVIFOQREFSK-MRXNPFEDSA-N 1 1 371.441 2.797 20 5 FFBDMO CC(C)Oc1nc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC001458594265 1060629690 /nfs/dbraw/zinc/62/96/90/1060629690.db2.gz MBFRLEAUJPTARW-OCCSQVGLSA-N 1 1 352.460 2.769 20 5 FFBDMO CC[C@H](C[NH+]1CCOCC1)Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001458613612 1060634643 /nfs/dbraw/zinc/63/46/43/1060634643.db2.gz FACXWNJTCAYOCI-LLVKDONJSA-N 1 1 365.821 2.714 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1Cc1[nH+]ccn1Cc1ccccc1 ZINC001459059487 1060699914 /nfs/dbraw/zinc/69/99/14/1060699914.db2.gz SUYJFPJLZACFCJ-UHFFFAOYSA-N 1 1 350.334 2.796 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C2 ZINC001460897260 1061143899 /nfs/dbraw/zinc/14/38/99/1061143899.db2.gz BUEUHDNGNHHCCI-MEDUHNTESA-N 1 1 353.419 2.747 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)C[C@@H](O)CNC(=O)OC(C)(C)C ZINC001462254013 1061556098 /nfs/dbraw/zinc/55/60/98/1061556098.db2.gz DRVPVBGMSMIXHN-AWEZNQCLSA-N 1 1 367.446 2.529 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC001463064641 1061922298 /nfs/dbraw/zinc/92/22/98/1061922298.db2.gz MIGFTXXIYPRUOG-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@H]2CNc2cccc(C)[nH+]2)n1 ZINC001465072842 1062966313 /nfs/dbraw/zinc/96/63/13/1062966313.db2.gz LEGIFKPPAAGAEL-AWEZNQCLSA-N 1 1 355.398 2.718 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001471030878 1064529617 /nfs/dbraw/zinc/52/96/17/1064529617.db2.gz OBGMUKUVZNQCOQ-GOEBONIOSA-N 1 1 368.437 2.675 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)[nH+]c1 ZINC001472010312 1064889931 /nfs/dbraw/zinc/88/99/31/1064889931.db2.gz AYUYXGWIACIVBV-UHFFFAOYSA-N 1 1 351.366 2.688 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001472035792 1064901281 /nfs/dbraw/zinc/90/12/81/1064901281.db2.gz OMOAISDYMJKZJF-AWEZNQCLSA-N 1 1 353.850 2.979 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001472895671 1065169259 /nfs/dbraw/zinc/16/92/59/1065169259.db2.gz BUYBLRPOUXIUHI-NEPJUHHUSA-N 1 1 360.241 2.937 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)COc1ccc2cc[nH]c2c1 ZINC001473415886 1065259034 /nfs/dbraw/zinc/25/90/34/1065259034.db2.gz FWDCBPNGHIIWTE-SFHVURJKSA-N 1 1 369.421 2.990 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@](O)(C3CC3)C2)o1 ZINC001473426784 1065260635 /nfs/dbraw/zinc/26/06/35/1065260635.db2.gz JRZBNSRIRDBXKU-INIZCTEOSA-N 1 1 364.789 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)o1 ZINC001473426784 1065260640 /nfs/dbraw/zinc/26/06/40/1065260640.db2.gz JRZBNSRIRDBXKU-INIZCTEOSA-N 1 1 364.789 2.645 20 5 FFBDMO C[C@]([NH3+])(C(=O)Nc1nc2c(cccc2Cl)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC001576084871 1078193758 /nfs/dbraw/zinc/19/37/58/1078193758.db2.gz GNGSPERCEVUYIB-MRXNPFEDSA-N 1 1 359.773 2.937 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2N)cc1)[NH+]1CCOCC1 ZINC001585567029 1079476083 /nfs/dbraw/zinc/47/60/83/1079476083.db2.gz LPISKBNIVYOSFO-CYBMUJFWSA-N 1 1 370.409 2.823 20 5 FFBDMO CC1(C)[C@H]2[C@H](CCC[N@@H+]2Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1O ZINC001560064543 1076220004 /nfs/dbraw/zinc/22/00/04/1076220004.db2.gz MYXBKJUTQZRHBO-MAZHCROVSA-N 1 1 358.398 2.626 20 5 FFBDMO CC1(C)[C@H]2[C@H](CCC[N@H+]2Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1O ZINC001560064543 1076220007 /nfs/dbraw/zinc/22/00/07/1076220007.db2.gz MYXBKJUTQZRHBO-MAZHCROVSA-N 1 1 358.398 2.626 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC001560274128 1076258619 /nfs/dbraw/zinc/25/86/19/1076258619.db2.gz DDNYWGZIMKRLGK-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001561125505 1076335916 /nfs/dbraw/zinc/33/59/16/1076335916.db2.gz OFODQQJLNSKUAQ-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001561474306 1076381553 /nfs/dbraw/zinc/38/15/53/1076381553.db2.gz ATOXSZNSVCBZEX-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1ccc(CNC(=O)NCC[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001563751273 1076580434 /nfs/dbraw/zinc/58/04/34/1076580434.db2.gz MAAZDBBAGUUTBD-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO CCc1ccccc1C[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001568126071 1077072535 /nfs/dbraw/zinc/07/25/35/1077072535.db2.gz OVSYDUQPBYWZJD-RTBURBONSA-N 1 1 359.470 2.633 20 5 FFBDMO CCC1([NH2+]Cc2csc(C)c2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570254739 1077193559 /nfs/dbraw/zinc/19/35/59/1077193559.db2.gz ATLIHIZGKJUVQM-HUUCEWRRSA-N 1 1 351.472 2.583 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)cc1 ZINC001587796438 1079865988 /nfs/dbraw/zinc/86/59/88/1079865988.db2.gz LNJWRZBFDMAZCU-CQSZACIVSA-N 1 1 372.400 2.629 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(-c2nn[nH]n2)cc1)Cc1cccnc1[N+](=O)[O-] ZINC001589701758 1080677662 /nfs/dbraw/zinc/67/76/62/1080677662.db2.gz YBTLNVDRDUSHPJ-UHFFFAOYSA-N 1 1 353.386 2.581 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc(-c2nn[nH]n2)cc1)Cc1cccnc1[N+](=O)[O-] ZINC001589701758 1080677664 /nfs/dbraw/zinc/67/76/64/1080677664.db2.gz YBTLNVDRDUSHPJ-UHFFFAOYSA-N 1 1 353.386 2.581 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 ZINC000067237587 205368096 /nfs/dbraw/zinc/36/80/96/205368096.db2.gz JNSOOBRKZMAUOS-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000372988939 512120873 /nfs/dbraw/zinc/12/08/73/512120873.db2.gz FLMXOXUGZRDKIK-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000372988939 512120877 /nfs/dbraw/zinc/12/08/77/512120877.db2.gz FLMXOXUGZRDKIK-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO COCC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H](C)C(N)=O ZINC000093138226 250018675 /nfs/dbraw/zinc/01/86/75/250018675.db2.gz CBLXLQOEQNMVMP-LBPRGKRZSA-N 1 1 363.439 2.646 20 5 FFBDMO COCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H](C)C(N)=O ZINC000093138226 250018676 /nfs/dbraw/zinc/01/86/76/250018676.db2.gz CBLXLQOEQNMVMP-LBPRGKRZSA-N 1 1 363.439 2.646 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000092764860 250000657 /nfs/dbraw/zinc/00/06/57/250000657.db2.gz XVJLCLIOVCNVDK-INIZCTEOSA-N 1 1 372.421 2.997 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000092764860 250000660 /nfs/dbraw/zinc/00/06/60/250000660.db2.gz XVJLCLIOVCNVDK-INIZCTEOSA-N 1 1 372.421 2.997 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)cc1SC ZINC000103070036 250132652 /nfs/dbraw/zinc/13/26/52/250132652.db2.gz ZUDREOYLPSYJSC-GFCCVEGCSA-N 1 1 367.471 2.787 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1 ZINC000273446852 252308552 /nfs/dbraw/zinc/30/85/52/252308552.db2.gz NYTGETGAKGPJJX-NSHDSACASA-N 1 1 370.377 2.998 20 5 FFBDMO Cc1cc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)c(N)c([N+](=O)[O-])c1 ZINC000278501260 256319070 /nfs/dbraw/zinc/31/90/70/256319070.db2.gz DCWZAQGPMZGUKR-UHFFFAOYSA-N 1 1 370.409 2.872 20 5 FFBDMO CN1C(=O)CCc2cc(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)ccc21 ZINC000278695923 256339290 /nfs/dbraw/zinc/33/92/90/256339290.db2.gz NGWSOSBSSJQGDD-UHFFFAOYSA-N 1 1 365.393 2.670 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000278726085 256341671 /nfs/dbraw/zinc/34/16/71/256341671.db2.gz LKYSBAUHXIGMGR-AWEZNQCLSA-N 1 1 362.430 2.620 20 5 FFBDMO COc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc(OC)c1OC ZINC000278806187 256349956 /nfs/dbraw/zinc/34/99/56/256349956.db2.gz YEILYGWYQDDTLD-UHFFFAOYSA-N 1 1 372.381 2.787 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000278806471 256350002 /nfs/dbraw/zinc/35/00/02/256350002.db2.gz ZGNDYRZJMFJMSE-UHFFFAOYSA-N 1 1 374.372 2.703 20 5 FFBDMO CN(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000280873804 256579094 /nfs/dbraw/zinc/57/90/94/256579094.db2.gz FKLWBRCQYLYORA-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000281157876 256610647 /nfs/dbraw/zinc/61/06/47/256610647.db2.gz CHELTEWVFGWGKW-HZPDHXFCSA-N 1 1 363.458 2.861 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@@H]1C[C@@H](C)O ZINC000286210681 257025874 /nfs/dbraw/zinc/02/58/74/257025874.db2.gz YHLMSFCRRCQTDN-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000286645763 257047577 /nfs/dbraw/zinc/04/75/77/257047577.db2.gz CCMOZRQUNAPQGZ-LBPRGKRZSA-N 1 1 370.438 2.878 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@@H+]2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000286735016 257052190 /nfs/dbraw/zinc/05/21/90/257052190.db2.gz XWFPNENRNFDXHU-CPTIBSQESA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000286735016 257052191 /nfs/dbraw/zinc/05/21/91/257052191.db2.gz XWFPNENRNFDXHU-CPTIBSQESA-N 1 1 365.817 2.542 20 5 FFBDMO Cc1cc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)c(N)c([N+](=O)[O-])c1 ZINC000286840780 257057971 /nfs/dbraw/zinc/05/79/71/257057971.db2.gz YCUUFELXNURXIA-UHFFFAOYSA-N 1 1 360.414 2.673 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000301290142 258040029 /nfs/dbraw/zinc/04/00/29/258040029.db2.gz OPDLNULXHDJRNB-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO Cc1cc(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)ncc1[N+](=O)[O-] ZINC000302044765 258084351 /nfs/dbraw/zinc/08/43/51/258084351.db2.gz JXNAEXQIZIBVGB-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO C[C@H](CCN1CC[NH+](C)CC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000302305628 258098393 /nfs/dbraw/zinc/09/83/93/258098393.db2.gz ZKSABRDKGYKQPQ-GFCCVEGCSA-N 1 1 371.279 2.795 20 5 FFBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000302414518 258101015 /nfs/dbraw/zinc/10/10/15/258101015.db2.gz HMDQPHGQXKZRBI-IBGZPJMESA-N 1 1 359.401 2.807 20 5 FFBDMO C[C@@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000302475680 258103275 /nfs/dbraw/zinc/10/32/75/258103275.db2.gz DWZLCFOKMJXQOB-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO CCc1cc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000302853245 258112316 /nfs/dbraw/zinc/11/23/16/258112316.db2.gz JTJRZYDXCSYKIX-GASCZTMLSA-N 1 1 353.426 2.612 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000301535389 258054344 /nfs/dbraw/zinc/05/43/44/258054344.db2.gz MIILFYOEYCHGDO-LLVKDONJSA-N 1 1 357.252 2.920 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000301579607 258057206 /nfs/dbraw/zinc/05/72/06/258057206.db2.gz ZZLWLVBFGWIDQW-GFCCVEGCSA-N 1 1 373.251 2.521 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301835355 258070066 /nfs/dbraw/zinc/07/00/66/258070066.db2.gz LCRKVZYVRVKOEX-SJLPKXTDSA-N 1 1 354.410 2.812 20 5 FFBDMO C[N@@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C1CCCCC1 ZINC000301895479 258073291 /nfs/dbraw/zinc/07/32/91/258073291.db2.gz PXUDJZJJTFNRDG-UHFFFAOYSA-N 1 1 355.460 2.675 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-] ZINC000331953708 258207477 /nfs/dbraw/zinc/20/74/77/258207477.db2.gz PFBGRGVZFMOKDM-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000332394189 258228442 /nfs/dbraw/zinc/22/84/42/258228442.db2.gz NRSOPCFHQHFMMJ-IBGZPJMESA-N 1 1 374.485 2.610 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000332465404 258231371 /nfs/dbraw/zinc/23/13/71/258231371.db2.gz ISJOMPUJCRECGY-TZMCWYRMSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332659283 258239482 /nfs/dbraw/zinc/23/94/82/258239482.db2.gz WOYUNVWDZNIXGX-ZYHUDNBSSA-N 1 1 355.341 2.505 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])sc2C1 ZINC000331789154 258200681 /nfs/dbraw/zinc/20/06/81/258200681.db2.gz PLGDRKYGRDCNEP-UHFFFAOYSA-N 1 1 364.431 2.528 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3n[nH]c(C(C)C)c3[N+](=O)[O-])sc2C1 ZINC000331789154 258200682 /nfs/dbraw/zinc/20/06/82/258200682.db2.gz PLGDRKYGRDCNEP-UHFFFAOYSA-N 1 1 364.431 2.528 20 5 FFBDMO CNc1ccc(C(=O)NCCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000032399673 506248070 /nfs/dbraw/zinc/24/80/70/506248070.db2.gz ZMIQESYAVXFVNE-UHFFFAOYSA-N 1 1 368.437 2.815 20 5 FFBDMO O=C1C[C@@H](c2ccccc2)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1 ZINC000052836993 506259414 /nfs/dbraw/zinc/25/94/14/506259414.db2.gz NBUVUKUYEZADMQ-IBGZPJMESA-N 1 1 369.421 2.927 20 5 FFBDMO CCOc1ccc(C(=O)NCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000053348818 506359367 /nfs/dbraw/zinc/35/93/67/506359367.db2.gz YRZDUHQBUWEHFB-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)Cc1ccccc1 ZINC000053349900 506361569 /nfs/dbraw/zinc/36/15/69/506361569.db2.gz UFIZBMKGQCDGMN-UHFFFAOYSA-N 1 1 352.394 2.938 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000036773843 506416002 /nfs/dbraw/zinc/41/60/02/506416002.db2.gz TYIWRIDZQKICBL-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000066137815 506427864 /nfs/dbraw/zinc/42/78/64/506427864.db2.gz KXLOJDIQHVSFTE-OAHLLOKOSA-N 1 1 362.474 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000371231544 512280689 /nfs/dbraw/zinc/28/06/89/512280689.db2.gz PIARUMCMEGJTNI-PBHICJAKSA-N 1 1 366.368 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2c2ccc(F)cc2F)c1 ZINC000371231544 512280693 /nfs/dbraw/zinc/28/06/93/512280693.db2.gz PIARUMCMEGJTNI-PBHICJAKSA-N 1 1 366.368 2.658 20 5 FFBDMO COc1ccc(CN2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000066377617 506500740 /nfs/dbraw/zinc/50/07/40/506500740.db2.gz LNBTWUQUIWXTQT-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@@H+]2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000066377617 506500744 /nfs/dbraw/zinc/50/07/44/506500744.db2.gz LNBTWUQUIWXTQT-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000066377617 506500750 /nfs/dbraw/zinc/50/07/50/506500750.db2.gz LNBTWUQUIWXTQT-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000054223610 506515387 /nfs/dbraw/zinc/51/53/87/506515387.db2.gz KFQDIVDRBRRBRL-WBVHZDCISA-N 1 1 369.421 2.925 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000041904779 506566378 /nfs/dbraw/zinc/56/63/78/506566378.db2.gz YEHFSVLRVZUKKT-INIZCTEOSA-N 1 1 362.817 2.984 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043148857 506708943 /nfs/dbraw/zinc/70/89/43/506708943.db2.gz LVXMUCBDSSFSLS-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043148857 506708946 /nfs/dbraw/zinc/70/89/46/506708946.db2.gz LVXMUCBDSSFSLS-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000067203883 506792501 /nfs/dbraw/zinc/79/25/01/506792501.db2.gz ZJKISYHANFYUKM-UHFFFAOYSA-N 1 1 369.421 2.665 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000067288102 506819677 /nfs/dbraw/zinc/81/96/77/506819677.db2.gz QWTVGFFYZAEDOT-UHFFFAOYSA-N 1 1 368.437 2.741 20 5 FFBDMO C[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000044491691 506850837 /nfs/dbraw/zinc/85/08/37/506850837.db2.gz OUHMKLSPOBTLST-SNVBAGLBSA-N 1 1 351.453 2.894 20 5 FFBDMO C[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000044491691 506850842 /nfs/dbraw/zinc/85/08/42/506850842.db2.gz OUHMKLSPOBTLST-SNVBAGLBSA-N 1 1 351.453 2.894 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000068265791 507166959 /nfs/dbraw/zinc/16/69/59/507166959.db2.gz FKDGRCLEWAVVKL-YPMHNXCESA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541870 507178347 /nfs/dbraw/zinc/17/83/47/507178347.db2.gz NECITENCGJJRNC-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541870 507178356 /nfs/dbraw/zinc/17/83/56/507178356.db2.gz NECITENCGJJRNC-LBPRGKRZSA-N 1 1 357.366 2.783 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CC1 ZINC000046939382 507228142 /nfs/dbraw/zinc/22/81/42/507228142.db2.gz QDNOHBDXBLHKSA-UHFFFAOYSA-N 1 1 358.398 2.578 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1C ZINC000058178681 507380419 /nfs/dbraw/zinc/38/04/19/507380419.db2.gz UGOKHXACJLLPPF-GXTWGEPZSA-N 1 1 369.487 2.610 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)[NH+]1CCOCC1 ZINC000029208291 507768833 /nfs/dbraw/zinc/76/88/33/507768833.db2.gz WGQXFFXRRWRKKY-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(NC1CC1)c1ccc(N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000077994925 507825047 /nfs/dbraw/zinc/82/50/47/507825047.db2.gz BJFBTTOZBQVYRK-UHFFFAOYSA-N 1 1 372.469 2.942 20 5 FFBDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000072732030 507848750 /nfs/dbraw/zinc/84/87/50/507848750.db2.gz SNQVYQQBPYBOEX-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000107891829 507872685 /nfs/dbraw/zinc/87/26/85/507872685.db2.gz FENNZVACQLRNQU-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO CS(=O)(=O)c1ccc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000078526833 507879653 /nfs/dbraw/zinc/87/96/53/507879653.db2.gz ZCIWJAHQFPULLA-AWEZNQCLSA-N 1 1 367.471 2.675 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000072974869 507879694 /nfs/dbraw/zinc/87/96/94/507879694.db2.gz FQRADVQSLVZYJP-JKSUJKDBSA-N 1 1 374.485 2.780 20 5 FFBDMO O=c1[nH]cnc2cc(N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)c([N+](=O)[O-])cc21 ZINC000072991022 507881666 /nfs/dbraw/zinc/88/16/66/507881666.db2.gz KPIWAXMWUJLJCR-CQSZACIVSA-N 1 1 365.393 2.518 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000108392165 507892648 /nfs/dbraw/zinc/89/26/48/507892648.db2.gz XBPBLFLKKLIHLE-KRWDZBQOSA-N 1 1 361.442 2.765 20 5 FFBDMO CC1CCC([N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]2CCCO2)CC1 ZINC000090550794 507926851 /nfs/dbraw/zinc/92/68/51/507926851.db2.gz CBEQGBUIOAFEMC-LEOMRAHMSA-N 1 1 363.458 2.816 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC000090588979 507929127 /nfs/dbraw/zinc/92/91/27/507929127.db2.gz YLRBYHALKKGBMM-AWEZNQCLSA-N 1 1 363.801 2.563 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](Oc2ccccc2Cl)C1 ZINC000090588979 507929128 /nfs/dbraw/zinc/92/91/28/507929128.db2.gz YLRBYHALKKGBMM-AWEZNQCLSA-N 1 1 363.801 2.563 20 5 FFBDMO CCCO[C@@H]1CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000109133293 507941782 /nfs/dbraw/zinc/94/17/82/507941782.db2.gz KBRIBVHRNLJJMP-QZTJIDSGSA-N 1 1 361.442 2.981 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079578275 507978286 /nfs/dbraw/zinc/97/82/86/507978286.db2.gz HGYNXSJUIYXFFZ-QWHCGFSZSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNc2ncc([N+](=O)[O-])c(N)n2)cc1 ZINC000079906328 508013593 /nfs/dbraw/zinc/01/35/93/508013593.db2.gz KCRVHNFUPBXALY-ZDUSSCGKSA-N 1 1 356.430 2.954 20 5 FFBDMO CCOc1ccnc(N2CCC[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)n1 ZINC000091959436 508027685 /nfs/dbraw/zinc/02/76/85/508027685.db2.gz VVKKMNBILBMRKE-UHFFFAOYSA-N 1 1 371.441 2.804 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000092010482 508032669 /nfs/dbraw/zinc/03/26/69/508032669.db2.gz VJLOMMCOTSJHGU-VCUNKILJSA-N 1 1 356.426 2.787 20 5 FFBDMO COCCOc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000092048149 508037764 /nfs/dbraw/zinc/03/77/64/508037764.db2.gz MPDOWYSFHFQMCU-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000074857982 508063233 /nfs/dbraw/zinc/06/32/33/508063233.db2.gz BNQACBUWZBRGPH-KRWDZBQOSA-N 1 1 360.458 2.511 20 5 FFBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCCN(c2ccccc2)C1 ZINC000081013779 508125935 /nfs/dbraw/zinc/12/59/35/508125935.db2.gz VYZLPBGFWZEOQV-GOSISDBHSA-N 1 1 368.437 2.795 20 5 FFBDMO COc1cc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000081124421 508140381 /nfs/dbraw/zinc/14/03/81/508140381.db2.gz PTBCXXATMIGGGL-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO COCCOc1ccccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534666 508148096 /nfs/dbraw/zinc/14/80/96/508148096.db2.gz CUCRCMAWBAJGSE-MRXNPFEDSA-N 1 1 372.425 2.701 20 5 FFBDMO COCCOc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000093534753 508148193 /nfs/dbraw/zinc/14/81/93/508148193.db2.gz FZNIMZPMBDYRPZ-INIZCTEOSA-N 1 1 372.425 2.701 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000081363233 508167830 /nfs/dbraw/zinc/16/78/30/508167830.db2.gz HIVYMPBUQMCNGA-HNNXBMFYSA-N 1 1 358.442 2.740 20 5 FFBDMO CCc1nn(C)c(N2CC[NH+]([C@H](C)c3cccc(OC)c3)CC2)c1[N+](=O)[O-] ZINC000094155611 508171160 /nfs/dbraw/zinc/17/11/60/508171160.db2.gz CZWBIXFBHBOFQJ-CQSZACIVSA-N 1 1 373.457 2.783 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000081572982 508191715 /nfs/dbraw/zinc/19/17/15/508191715.db2.gz TVKWZTJFTUNZDY-AWEZNQCLSA-N 1 1 359.430 2.809 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nnc4ccccn43)C2)cc1 ZINC000076396445 508200201 /nfs/dbraw/zinc/20/02/01/508200201.db2.gz RPEXUYOQGQIRRT-OAHLLOKOSA-N 1 1 367.409 2.896 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415910 508203927 /nfs/dbraw/zinc/20/39/27/508203927.db2.gz RAMKJMZGQFEYFI-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCCC(=O)OC(C)(C)C ZINC000076415910 508203929 /nfs/dbraw/zinc/20/39/29/508203929.db2.gz RAMKJMZGQFEYFI-ZDUSSCGKSA-N 1 1 365.430 2.976 20 5 FFBDMO Cc1sc2nc(C[NH+]3CCCC3)nc(-n3cc([N+](=O)[O-])cn3)c2c1C ZINC000084483567 508280598 /nfs/dbraw/zinc/28/05/98/508280598.db2.gz XVEXHOFNWAKAAB-UHFFFAOYSA-N 1 1 358.427 2.998 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCC[C@@H](C)C1 ZINC000087103057 508336683 /nfs/dbraw/zinc/33/66/83/508336683.db2.gz UTXNTDQZZXHQOK-CABCVRRESA-N 1 1 360.458 2.783 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088616521 508379616 /nfs/dbraw/zinc/37/96/16/508379616.db2.gz ACZFBMXREXZDPE-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000088616521 508379618 /nfs/dbraw/zinc/37/96/18/508379618.db2.gz ACZFBMXREXZDPE-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000156643718 508455880 /nfs/dbraw/zinc/45/58/80/508455880.db2.gz FDTWIAJFEGFHTN-HNNXBMFYSA-N 1 1 372.425 2.593 20 5 FFBDMO COc1cc(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)ccc1[N+](=O)[O-] ZINC000156680541 508461913 /nfs/dbraw/zinc/46/19/13/508461913.db2.gz JQLYZMMCTDILOS-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO Cc1c(CC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134078749 508489809 /nfs/dbraw/zinc/48/98/09/508489809.db2.gz XWBPAHZHUKUXKQ-QFBILLFUSA-N 1 1 357.454 2.921 20 5 FFBDMO CC[C@H](O)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000134478457 508538189 /nfs/dbraw/zinc/53/81/89/508538189.db2.gz OVNRFRIZEVVWSM-INIZCTEOSA-N 1 1 357.410 2.806 20 5 FFBDMO CC[C@H](O)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000134478457 508538193 /nfs/dbraw/zinc/53/81/93/508538193.db2.gz OVNRFRIZEVVWSM-INIZCTEOSA-N 1 1 357.410 2.806 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000157377099 508558994 /nfs/dbraw/zinc/55/89/94/508558994.db2.gz JYOMNQWNLJGVRT-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO COc1cc(C[N@H+](CCO)C2CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000153607626 508606800 /nfs/dbraw/zinc/60/68/00/508606800.db2.gz LMKHWHOCCHUTEJ-UHFFFAOYSA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@@H+](CCO)C2CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000153607626 508606804 /nfs/dbraw/zinc/60/68/04/508606804.db2.gz LMKHWHOCCHUTEJ-UHFFFAOYSA-N 1 1 364.320 2.501 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccccc1F ZINC000118866184 508688517 /nfs/dbraw/zinc/68/85/17/508688517.db2.gz SFMJZUSUQMMZDR-CYBMUJFWSA-N 1 1 373.388 2.644 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997470 508694581 /nfs/dbraw/zinc/69/45/81/508694581.db2.gz VUSWKWLMXUESLT-DLBZAZTESA-N 1 1 361.442 2.837 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997470 508694584 /nfs/dbraw/zinc/69/45/84/508694584.db2.gz VUSWKWLMXUESLT-DLBZAZTESA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000119221120 508751436 /nfs/dbraw/zinc/75/14/36/508751436.db2.gz YXMVTFZVOQHWMA-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000119322095 508772735 /nfs/dbraw/zinc/77/27/35/508772735.db2.gz FAYXXJOOILRJHJ-ZDUSSCGKSA-N 1 1 353.850 2.885 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000119372559 508782894 /nfs/dbraw/zinc/78/28/94/508782894.db2.gz UXUJMHVITOZJOA-BBRMVZONSA-N 1 1 355.398 2.632 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000124168964 508792531 /nfs/dbraw/zinc/79/25/31/508792531.db2.gz JAWPXYWBNHCTRJ-HKUYNNGSSA-N 1 1 356.422 2.899 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC[C@@H]21 ZINC000140052961 508799229 /nfs/dbraw/zinc/79/92/29/508799229.db2.gz AQULGWWXIFFQHG-HOCLYGCPSA-N 1 1 357.414 2.561 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])sc2C1 ZINC000159253666 508814903 /nfs/dbraw/zinc/81/49/03/508814903.db2.gz CEIYDLZBUOJXOK-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2OC)c1 ZINC000141837699 508819594 /nfs/dbraw/zinc/81/95/94/508819594.db2.gz SRXBVWYEZADWEK-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000143211311 508829229 /nfs/dbraw/zinc/82/92/29/508829229.db2.gz QFIRWHLNIQXXMA-UHFFFAOYSA-N 1 1 366.377 2.784 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1C)[NH+](C)C ZINC000159548169 508857053 /nfs/dbraw/zinc/85/70/53/508857053.db2.gz VNVVATKEUACWEL-GOSISDBHSA-N 1 1 371.437 2.873 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000131015462 508876963 /nfs/dbraw/zinc/87/69/63/508876963.db2.gz ZBKLMVOUAZCLMS-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000131015462 508876967 /nfs/dbraw/zinc/87/69/67/508876967.db2.gz ZBKLMVOUAZCLMS-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(C(F)(F)F)cc1 ZINC000159702535 508877176 /nfs/dbraw/zinc/87/71/76/508877176.db2.gz YDRCSLDVLBGVQB-UHFFFAOYSA-N 1 1 355.316 2.907 20 5 FFBDMO O=C(NCc1ccco1)[C@@H]1CCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000124743811 508878436 /nfs/dbraw/zinc/87/84/36/508878436.db2.gz IPJXFCZZWDINLW-SFHVURJKSA-N 1 1 373.409 2.738 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1CCOC ZINC000131071870 508883432 /nfs/dbraw/zinc/88/34/32/508883432.db2.gz MIYYXFRFXWEFFV-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CCOC ZINC000131071870 508883436 /nfs/dbraw/zinc/88/34/36/508883436.db2.gz MIYYXFRFXWEFFV-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO Cc1c(Br)cc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000125224804 508951169 /nfs/dbraw/zinc/95/11/69/508951169.db2.gz AHNNDDWCSFRIRY-LBPRGKRZSA-N 1 1 370.247 2.832 20 5 FFBDMO CN1CCC([N@@H+](CCO)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000155507626 509016426 /nfs/dbraw/zinc/01/64/26/509016426.db2.gz ATCOYIIZAKEAHQ-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[NH+]1CCC(N(CCO)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000155507626 509016427 /nfs/dbraw/zinc/01/64/27/509016427.db2.gz ATCOYIIZAKEAHQ-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CCCC1 ZINC000120846079 509074949 /nfs/dbraw/zinc/07/49/49/509074949.db2.gz WJTOFEIKACWPML-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000121063419 509120306 /nfs/dbraw/zinc/12/03/06/509120306.db2.gz HLKBCJFEBOYTGU-YGRLFVJLSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000162089255 509172010 /nfs/dbraw/zinc/17/20/10/509172010.db2.gz JWQKALRMUKWUPG-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO CC[N@H+]1CCC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000162385090 509213660 /nfs/dbraw/zinc/21/36/60/509213660.db2.gz NDNFWGFRLLAYQQ-GFCCVEGCSA-N 1 1 356.220 2.571 20 5 FFBDMO CCOc1cc(NC2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)ncn1 ZINC000185664811 509292885 /nfs/dbraw/zinc/29/28/85/509292885.db2.gz ZFMAEMVSAAFBPH-UHFFFAOYSA-N 1 1 357.414 2.860 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000248461064 509333188 /nfs/dbraw/zinc/33/31/88/509333188.db2.gz OUSDZZUUMCWSGQ-RBSFLKMASA-N 1 1 354.472 2.941 20 5 FFBDMO Cc1cccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1 ZINC000248472218 509337021 /nfs/dbraw/zinc/33/70/21/509337021.db2.gz WAMOLBFHFJLFSY-NVXWUHKLSA-N 1 1 357.410 2.875 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000248473137 509337110 /nfs/dbraw/zinc/33/71/10/509337110.db2.gz WRDMEHURAVYZBO-UKPHBRMFSA-N 1 1 352.456 2.695 20 5 FFBDMO C[C@@H](c1ccccc1Cl)N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000176203835 509376653 /nfs/dbraw/zinc/37/66/53/509376653.db2.gz ZCNPFXFQQSQICC-AWEZNQCLSA-N 1 1 363.849 2.824 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000185877424 509400897 /nfs/dbraw/zinc/40/08/97/509400897.db2.gz ZPDVFFDXYXLCLU-INIZCTEOSA-N 1 1 372.469 2.970 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1C[C@H](C)O ZINC000248637092 509406337 /nfs/dbraw/zinc/40/63/37/509406337.db2.gz KWSVXHNLLKJAKJ-GJZGRUSLSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@H](c1ccc(Cl)cc1)N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000176269730 509413022 /nfs/dbraw/zinc/41/30/22/509413022.db2.gz FWNMXAJIUMKHBL-CQSZACIVSA-N 1 1 363.849 2.824 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000264281392 509432354 /nfs/dbraw/zinc/43/23/54/509432354.db2.gz IHQJSKYTKCQPNL-GOSISDBHSA-N 1 1 367.449 2.818 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3CCOC3)CC2)c(Br)c1 ZINC000267419332 509471129 /nfs/dbraw/zinc/47/11/29/509471129.db2.gz UDPWMVJTMPGMIX-LBPRGKRZSA-N 1 1 370.247 2.516 20 5 FFBDMO O=C(CC[NH+]1CCC(C(=O)C(F)(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000186071053 509509584 /nfs/dbraw/zinc/50/95/84/509509584.db2.gz DEVCBHLLYXPHDI-UHFFFAOYSA-N 1 1 373.331 2.767 20 5 FFBDMO CC[N@@H+]1CCC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236932799 509536550 /nfs/dbraw/zinc/53/65/50/509536550.db2.gz LEBOESTVORFBOG-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236932799 509536553 /nfs/dbraw/zinc/53/65/53/509536553.db2.gz LEBOESTVORFBOG-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO CCc1n[nH]c(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670304 509591441 /nfs/dbraw/zinc/59/14/41/509591441.db2.gz RBGRPZMLHRVXEL-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670304 509591445 /nfs/dbraw/zinc/59/14/45/509591445.db2.gz RBGRPZMLHRVXEL-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192670304 509591453 /nfs/dbraw/zinc/59/14/53/509591453.db2.gz RBGRPZMLHRVXEL-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3cccc(O)c3)CC2)c([N+](=O)[O-])c1 ZINC000173508782 509638135 /nfs/dbraw/zinc/63/81/35/509638135.db2.gz OWMVJLONKPJGEC-UHFFFAOYSA-N 1 1 373.409 2.510 20 5 FFBDMO CCc1n[nH]c(C(=O)N(CC)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192898112 509689922 /nfs/dbraw/zinc/68/99/22/509689922.db2.gz WMXZOFLXGNHBIV-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192898112 509689925 /nfs/dbraw/zinc/68/99/25/509689925.db2.gz WMXZOFLXGNHBIV-HNNXBMFYSA-N 1 1 371.441 2.617 20 5 FFBDMO COc1ccc(CN2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249817385 509768516 /nfs/dbraw/zinc/76/85/16/509768516.db2.gz LNBTWUQUIWXTQT-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249817385 509768522 /nfs/dbraw/zinc/76/85/22/509768522.db2.gz LNBTWUQUIWXTQT-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249817385 509768529 /nfs/dbraw/zinc/76/85/29/509768529.db2.gz LNBTWUQUIWXTQT-HLLBOEOZSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249811694 509768724 /nfs/dbraw/zinc/76/87/24/509768724.db2.gz IGWGVXRPYUPZED-RVKKMQEKSA-N 1 1 363.458 2.687 20 5 FFBDMO CC(C)[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249811694 509768725 /nfs/dbraw/zinc/76/87/25/509768725.db2.gz IGWGVXRPYUPZED-RVKKMQEKSA-N 1 1 363.458 2.687 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000249890992 509779340 /nfs/dbraw/zinc/77/93/40/509779340.db2.gz SXJYBPSSZTUDMD-XHSDSOJGSA-N 1 1 363.458 2.846 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000268183527 509801698 /nfs/dbraw/zinc/80/16/98/509801698.db2.gz LXOGJEQWMGNUEF-TVQRCGJNSA-N 1 1 357.332 2.826 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[C@@H](C[NH+]3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000189913896 509825561 /nfs/dbraw/zinc/82/55/61/509825561.db2.gz ZSGZBQNKXXKBHY-HNNXBMFYSA-N 1 1 361.442 2.513 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C[N@H+]1C1CC1 ZINC000177154064 509905254 /nfs/dbraw/zinc/90/52/54/509905254.db2.gz OPHPKQDLLZYTGE-ZBFHGGJFSA-N 1 1 372.469 2.553 20 5 FFBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000255583526 509929813 /nfs/dbraw/zinc/92/98/13/509929813.db2.gz OJTOOUOATZAZCU-KVPVBUAESA-N 1 1 352.456 2.896 20 5 FFBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000255583526 509929816 /nfs/dbraw/zinc/92/98/16/509929816.db2.gz OJTOOUOATZAZCU-KVPVBUAESA-N 1 1 352.456 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC000245441586 509935173 /nfs/dbraw/zinc/93/51/73/509935173.db2.gz VNNONRMTHGRSFG-BEFAXECRSA-N 1 1 369.421 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1 ZINC000245441586 509935180 /nfs/dbraw/zinc/93/51/80/509935180.db2.gz VNNONRMTHGRSFG-BEFAXECRSA-N 1 1 369.421 2.897 20 5 FFBDMO C[N@@H+](CCOc1ccc(C(F)(F)F)cc1)CCn1ccc([N+](=O)[O-])n1 ZINC000190367736 510090156 /nfs/dbraw/zinc/09/01/56/510090156.db2.gz JLCNDMHHTNXJAR-UHFFFAOYSA-N 1 1 358.320 2.821 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000193838464 510093003 /nfs/dbraw/zinc/09/30/03/510093003.db2.gz RPPFLBICQGLOPY-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000180799666 510115865 /nfs/dbraw/zinc/11/58/65/510115865.db2.gz MLGLTLVBLHCKBG-SNVBAGLBSA-N 1 1 368.340 2.767 20 5 FFBDMO C[NH+]1CCC(N2CCC(Nc3ncc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000265562860 510117669 /nfs/dbraw/zinc/11/76/69/510117669.db2.gz SREBEHRGSVRCDE-UHFFFAOYSA-N 1 1 353.854 2.614 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]21 ZINC000268936685 510147468 /nfs/dbraw/zinc/14/74/68/510147468.db2.gz OYIYIXGCKYHACO-LRDDRELGSA-N 1 1 366.849 2.874 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000265678332 510170502 /nfs/dbraw/zinc/17/05/02/510170502.db2.gz DIOCTTUUXLNHAD-UHFFFAOYSA-N 1 1 365.405 2.590 20 5 FFBDMO CCC[C@@]1(C)C(=O)NCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000187330851 510199720 /nfs/dbraw/zinc/19/97/20/510199720.db2.gz YXNYHEVQDFJLCL-IBGZPJMESA-N 1 1 372.425 2.783 20 5 FFBDMO CCC[C@@]1(C)C(=O)NCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000187330851 510199724 /nfs/dbraw/zinc/19/97/24/510199724.db2.gz YXNYHEVQDFJLCL-IBGZPJMESA-N 1 1 372.425 2.783 20 5 FFBDMO Cc1cnn([C@@H]2CCC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000246043804 510263200 /nfs/dbraw/zinc/26/32/00/510263200.db2.gz SLFVEHYIYHQQNS-MSOLQXFVSA-N 1 1 369.425 2.542 20 5 FFBDMO Cc1cnn([C@@H]2CCC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000246043804 510263206 /nfs/dbraw/zinc/26/32/06/510263206.db2.gz SLFVEHYIYHQQNS-MSOLQXFVSA-N 1 1 369.425 2.542 20 5 FFBDMO O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[NH2+]Cc2ccccc21 ZINC000269184704 510279132 /nfs/dbraw/zinc/27/91/32/510279132.db2.gz SIJICPFNFHJMNH-UHFFFAOYSA-N 1 1 366.421 2.945 20 5 FFBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)C(F)(F)F ZINC000181263282 510327948 /nfs/dbraw/zinc/32/79/48/510327948.db2.gz ZAQFAJDVHOGECE-CYBMUJFWSA-N 1 1 359.304 2.647 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)C(F)(F)F ZINC000181263282 510327954 /nfs/dbraw/zinc/32/79/54/510327954.db2.gz ZAQFAJDVHOGECE-CYBMUJFWSA-N 1 1 359.304 2.647 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000246212822 510367695 /nfs/dbraw/zinc/36/76/95/510367695.db2.gz NXQKHHPYRQLGOP-UKRRQHHQSA-N 1 1 371.224 2.688 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000269373836 510369122 /nfs/dbraw/zinc/36/91/22/510369122.db2.gz MWBIUNBGCUUITN-UHFFFAOYSA-N 1 1 359.430 2.693 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000269488643 510432154 /nfs/dbraw/zinc/43/21/54/510432154.db2.gz XGATWPGETUQAFG-ZDUSSCGKSA-N 1 1 359.430 2.692 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000269622782 510488230 /nfs/dbraw/zinc/48/82/30/510488230.db2.gz FBYJPIVYQSFUOX-NSHDSACASA-N 1 1 374.340 2.732 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000269622782 510488237 /nfs/dbraw/zinc/48/82/37/510488237.db2.gz FBYJPIVYQSFUOX-NSHDSACASA-N 1 1 374.340 2.732 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000246441016 510489794 /nfs/dbraw/zinc/48/97/94/510489794.db2.gz CAOACTXUPVYMMQ-SUMWQHHRSA-N 1 1 359.426 2.579 20 5 FFBDMO COCCCNC(=O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000172019691 510503127 /nfs/dbraw/zinc/50/31/27/510503127.db2.gz RPTUICMCCCYVQD-UHFFFAOYSA-N 1 1 369.849 2.613 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000184812395 510525440 /nfs/dbraw/zinc/52/54/40/510525440.db2.gz AVFXJMBCOLPTEU-PWSUYJOCSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000269901874 510590996 /nfs/dbraw/zinc/59/09/96/510590996.db2.gz HLERPIVHPYWGMO-UHFFFAOYSA-N 1 1 367.203 2.601 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000194925848 510593832 /nfs/dbraw/zinc/59/38/32/510593832.db2.gz RTWRVCGQHPOWQM-WMZOPIPTSA-N 1 1 352.431 2.616 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000188107033 510597296 /nfs/dbraw/zinc/59/72/96/510597296.db2.gz FDXQCXFTKCLNTQ-DYVFJYSZSA-N 1 1 372.425 2.626 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000181915698 510658380 /nfs/dbraw/zinc/65/83/80/510658380.db2.gz ZGQWUVITVCSOHD-IRXDYDNUSA-N 1 1 364.442 2.758 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000175484678 510661762 /nfs/dbraw/zinc/66/17/62/510661762.db2.gz CSEKNQNSBVFZQS-MRXNPFEDSA-N 1 1 371.393 2.695 20 5 FFBDMO C[N@H+](Cc1ccccc1N1CCOCC1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178569885 510667906 /nfs/dbraw/zinc/66/79/06/510667906.db2.gz XEQYRUWHDIPNLG-FQEVSTJZSA-N 1 1 371.437 2.597 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181976739 510687914 /nfs/dbraw/zinc/68/79/14/510687914.db2.gz XJHJMEHATADSRF-RDJZCZTQSA-N 1 1 371.437 2.675 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000182145591 510780691 /nfs/dbraw/zinc/78/06/91/510780691.db2.gz NUYVKSTYOAGTOZ-IRXDYDNUSA-N 1 1 357.410 2.521 20 5 FFBDMO CC(=O)N1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000182177746 510796805 /nfs/dbraw/zinc/79/68/05/510796805.db2.gz JNYPOJUXGUSAEH-UHFFFAOYSA-N 1 1 372.425 2.735 20 5 FFBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000247539921 510864987 /nfs/dbraw/zinc/86/49/87/510864987.db2.gz PAHTYBFDNHQLLF-YSVLISHTSA-N 1 1 354.472 2.941 20 5 FFBDMO CC(=O)c1cccc(OC[C@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285359431 510875763 /nfs/dbraw/zinc/87/57/63/510875763.db2.gz QFHQVBZGVWMLNW-GOSISDBHSA-N 1 1 372.421 2.712 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297354293 510914167 /nfs/dbraw/zinc/91/41/67/510914167.db2.gz BRYJFFCKROFKSX-RDJZCZTQSA-N 1 1 373.453 2.763 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000282443032 510980266 /nfs/dbraw/zinc/98/02/66/510980266.db2.gz RUTITDUKKFFYIS-AWEZNQCLSA-N 1 1 373.409 2.525 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270801232 510988558 /nfs/dbraw/zinc/98/85/58/510988558.db2.gz MACWWXIRTDQYHH-QZTJIDSGSA-N 1 1 358.442 2.896 20 5 FFBDMO C[C@H]([NH2+]Cc1ccncc1OC[C@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294457252 511071632 /nfs/dbraw/zinc/07/16/32/511071632.db2.gz VYVKJCRCVGZMRT-KBPBESRZSA-N 1 1 372.425 2.838 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H](c1ccco1)[NH+](C)C ZINC000282711475 511082729 /nfs/dbraw/zinc/08/27/29/511082729.db2.gz BLXZAXLEKPXSLL-MRXNPFEDSA-N 1 1 360.414 2.675 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCN1CCN(C)CC1 ZINC000271109512 511086295 /nfs/dbraw/zinc/08/62/95/511086295.db2.gz GYGVMLMOIBYVDS-INIZCTEOSA-N 1 1 366.531 2.693 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)N1CCN(C)CC1 ZINC000271135019 511094305 /nfs/dbraw/zinc/09/43/05/511094305.db2.gz MSXQGCZLWXDQID-CVEARBPZSA-N 1 1 366.531 2.691 20 5 FFBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000294664593 511136078 /nfs/dbraw/zinc/13/60/78/511136078.db2.gz ACJILWIDHXOXTR-ZDUSSCGKSA-N 1 1 373.837 2.566 20 5 FFBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000294664593 511136080 /nfs/dbraw/zinc/13/60/80/511136080.db2.gz ACJILWIDHXOXTR-ZDUSSCGKSA-N 1 1 373.837 2.566 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H](O)c2cc3ccccc3o2)CC1 ZINC000298170630 511196689 /nfs/dbraw/zinc/19/66/89/511196689.db2.gz UHDWNYYAXVXXME-MRXNPFEDSA-N 1 1 368.393 2.592 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481720 511219295 /nfs/dbraw/zinc/21/92/95/511219295.db2.gz NPSMRMKGRIXIGK-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481720 511219298 /nfs/dbraw/zinc/21/92/98/511219298.db2.gz NPSMRMKGRIXIGK-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481720 511219302 /nfs/dbraw/zinc/21/93/02/511219302.db2.gz NPSMRMKGRIXIGK-QFBILLFUSA-N 1 1 365.474 2.700 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000362776419 511235673 /nfs/dbraw/zinc/23/56/73/511235673.db2.gz UZUNJGCMPSLDGW-GOEBONIOSA-N 1 1 361.442 2.979 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000294968334 511238494 /nfs/dbraw/zinc/23/84/94/511238494.db2.gz NBWUTBOXBWTPRN-WMLDXEAASA-N 1 1 361.442 2.746 20 5 FFBDMO CNC(=O)c1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271639820 511270672 /nfs/dbraw/zinc/27/06/72/511270672.db2.gz RDUPMKHPCCFSGD-CHWSQXEVSA-N 1 1 370.409 2.632 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]([C@H](C)CO)C2CCCC2)c([N+](=O)[O-])c1 ZINC000298431865 511282583 /nfs/dbraw/zinc/28/25/83/511282583.db2.gz GMUQSEJKZYBKLR-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1 ZINC000365195655 511310335 /nfs/dbraw/zinc/31/03/35/511310335.db2.gz FMHQPHDHYHHOFB-UHFFFAOYSA-N 1 1 356.382 2.685 20 5 FFBDMO CO[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000280239863 511387932 /nfs/dbraw/zinc/38/79/32/511387932.db2.gz AXUQDACYCXYTRJ-QGZVFWFLSA-N 1 1 353.394 2.954 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+](C2CC2)C1 ZINC000295422049 511400160 /nfs/dbraw/zinc/40/01/60/511400160.db2.gz UBMWVALXNKRCLM-ZDUSSCGKSA-N 1 1 356.426 2.561 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)c1 ZINC000272179828 511455823 /nfs/dbraw/zinc/45/58/23/511455823.db2.gz CQSUEGDMUYODRY-HNNXBMFYSA-N 1 1 373.461 2.837 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272205181 511464104 /nfs/dbraw/zinc/46/41/04/511464104.db2.gz ZDHMXJJIGPLGPU-SWLSCSKDSA-N 1 1 353.369 2.629 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292245560 511520145 /nfs/dbraw/zinc/52/01/45/511520145.db2.gz XFSUQIDGMPBMKH-SJKOYZFVSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000363562304 511629306 /nfs/dbraw/zinc/62/93/06/511629306.db2.gz LLLIARJLBOAOFQ-OLZOCXBDSA-N 1 1 373.413 2.533 20 5 FFBDMO COC(=O)c1ccccc1CC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC000365835591 511678319 /nfs/dbraw/zinc/67/83/19/511678319.db2.gz FXLJIUXPOZYBOZ-UHFFFAOYSA-N 1 1 372.425 2.570 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000302912419 511720411 /nfs/dbraw/zinc/72/04/11/511720411.db2.gz QHPRPUDFRUOXAO-UHFFFAOYSA-N 1 1 353.422 2.524 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)c1 ZINC000350338568 511781802 /nfs/dbraw/zinc/78/18/02/511781802.db2.gz JQMHROLUCRMZET-MAUKXSAKSA-N 1 1 374.397 2.969 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)n1 ZINC000312597589 511785862 /nfs/dbraw/zinc/78/58/62/511785862.db2.gz FIHSRZPESIZCOC-ZFWWWQNUSA-N 1 1 370.409 2.851 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000293014213 511807722 /nfs/dbraw/zinc/80/77/22/511807722.db2.gz QBHNRJKWQYQSGH-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000293054531 511823022 /nfs/dbraw/zinc/82/30/22/511823022.db2.gz UEVKTORKJLCGAL-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000293054531 511823029 /nfs/dbraw/zinc/82/30/29/511823029.db2.gz UEVKTORKJLCGAL-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000293054531 511823037 /nfs/dbraw/zinc/82/30/37/511823037.db2.gz UEVKTORKJLCGAL-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000296670138 511845337 /nfs/dbraw/zinc/84/53/37/511845337.db2.gz GTKHLZQGLSILIG-STQMWFEESA-N 1 1 368.393 2.619 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])C1 ZINC000281447638 511851802 /nfs/dbraw/zinc/85/18/02/511851802.db2.gz DYQYKCQBTIHZIA-INIZCTEOSA-N 1 1 363.458 2.862 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293184514 511872759 /nfs/dbraw/zinc/87/27/59/511872759.db2.gz PVSMCQGOIMXBLZ-CXAGYDPISA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293184514 511872764 /nfs/dbraw/zinc/87/27/64/511872764.db2.gz PVSMCQGOIMXBLZ-CXAGYDPISA-N 1 1 365.430 2.677 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)Cc1ccccc1 ZINC000293277237 511905443 /nfs/dbraw/zinc/90/54/43/511905443.db2.gz JNLNQCKDUPJOIG-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)Cc1ccccc1 ZINC000293277237 511905446 /nfs/dbraw/zinc/90/54/46/511905446.db2.gz JNLNQCKDUPJOIG-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[C@H]1[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCS1(=O)=O ZINC000293519662 511994660 /nfs/dbraw/zinc/99/46/60/511994660.db2.gz AXRVBHKLJHRVPI-CPCISQLKSA-N 1 1 353.227 2.567 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2cn[nH]c2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275032405 512021094 /nfs/dbraw/zinc/02/10/94/512021094.db2.gz APSDUUKCYGOWAH-VIFPVBQESA-N 1 1 356.329 2.821 20 5 FFBDMO Cn1nccc1[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281963380 512029637 /nfs/dbraw/zinc/02/96/37/512029637.db2.gz GJJMIIZSGZYKIF-QGZVFWFLSA-N 1 1 357.414 2.884 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+](C2CCC2)C1 ZINC000293665007 512044864 /nfs/dbraw/zinc/04/48/64/512044864.db2.gz JTTLKJYPCWNLQV-AWEZNQCLSA-N 1 1 360.458 2.607 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000285292156 512066584 /nfs/dbraw/zinc/06/65/84/512066584.db2.gz GNIYZHQOQUKCRM-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000285292156 512066590 /nfs/dbraw/zinc/06/65/90/512066590.db2.gz GNIYZHQOQUKCRM-MRXNPFEDSA-N 1 1 373.413 2.882 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000369670340 512546278 /nfs/dbraw/zinc/54/62/78/512546278.db2.gz LOVJSWQFDTZADA-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nnc(-c4ccccc4)o3)CC2)n1 ZINC000369693132 512557840 /nfs/dbraw/zinc/55/78/40/512557840.db2.gz PVXXHDNHLJCKAT-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO CNC(=O)c1ccc(N2CCC(Oc3cc[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000376049131 512635418 /nfs/dbraw/zinc/63/54/18/512635418.db2.gz YRUMKBTXQJIZCP-UHFFFAOYSA-N 1 1 370.409 2.706 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](c3nc4ccc(F)cc4o3)C2)n1 ZINC000378245466 512656723 /nfs/dbraw/zinc/65/67/23/512656723.db2.gz NVSAFCGENVLUOF-LBPRGKRZSA-N 1 1 359.361 2.951 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000367984369 512751234 /nfs/dbraw/zinc/75/12/34/512751234.db2.gz AZRJIJNNFHOYJQ-OAHLLOKOSA-N 1 1 363.805 2.720 20 5 FFBDMO CCOC(=O)C1(COC)CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000370122289 512778698 /nfs/dbraw/zinc/77/86/98/512778698.db2.gz PDWNHTMVAIACFL-SOFGYWHQSA-N 1 1 362.426 2.900 20 5 FFBDMO COC[C@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376370612 512789090 /nfs/dbraw/zinc/78/90/90/512789090.db2.gz RJSLPWOVFINBLA-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CN1 ZINC000372335067 512820774 /nfs/dbraw/zinc/82/07/74/512820774.db2.gz ZASXSHDYHKKIPJ-YOEHRIQHSA-N 1 1 370.409 2.740 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C(N)=O)[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000411970524 512895315 /nfs/dbraw/zinc/89/53/15/512895315.db2.gz FXZRARSFPCHKPQ-SJORKVTESA-N 1 1 369.421 2.694 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000411980662 512899776 /nfs/dbraw/zinc/89/97/76/512899776.db2.gz HNIBVJXEQAMQGU-KRWDZBQOSA-N 1 1 355.394 2.737 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000412053253 512932562 /nfs/dbraw/zinc/93/25/62/512932562.db2.gz FCZZXHPKNGDVLT-ZDUSSCGKSA-N 1 1 358.398 2.713 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000412053253 512932565 /nfs/dbraw/zinc/93/25/65/512932565.db2.gz FCZZXHPKNGDVLT-ZDUSSCGKSA-N 1 1 358.398 2.713 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075215 512994977 /nfs/dbraw/zinc/99/49/77/512994977.db2.gz YJUPZGBGZZHJJX-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075215 512994978 /nfs/dbraw/zinc/99/49/78/512994978.db2.gz YJUPZGBGZZHJJX-OAGGEKHMSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374797696 513008718 /nfs/dbraw/zinc/00/87/18/513008718.db2.gz FUSIWKIWWUYVAW-GOEBONIOSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[nH+]1 ZINC000374829976 513025547 /nfs/dbraw/zinc/02/55/47/513025547.db2.gz QBJGSJNCYWNUEC-GFCCVEGCSA-N 1 1 373.388 2.736 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000368845878 513120465 /nfs/dbraw/zinc/12/04/65/513120465.db2.gz PWWIVVKFUFCBAC-INIZCTEOSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](OCc2c(C)noc2C)C1 ZINC000368845878 513120466 /nfs/dbraw/zinc/12/04/66/513120466.db2.gz PWWIVVKFUFCBAC-INIZCTEOSA-N 1 1 361.398 2.999 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000433827975 513160339 /nfs/dbraw/zinc/16/03/39/513160339.db2.gz GBRJACGOVIEGEB-CYBMUJFWSA-N 1 1 351.451 2.826 20 5 FFBDMO CN(C)C(=O)c1ccccc1C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000417709784 513174790 /nfs/dbraw/zinc/17/47/90/513174790.db2.gz ADUHGMPXVFTEFY-UHFFFAOYSA-N 1 1 368.437 2.619 20 5 FFBDMO C[C@@]12CC[N@@H+](CCCn3c(=O)oc4ccc([N+](=O)[O-])cc43)C[C@@H]1C2(F)F ZINC000428735796 513177282 /nfs/dbraw/zinc/17/72/82/513177282.db2.gz XJLFMVOXKFAQMV-GOEBONIOSA-N 1 1 367.352 2.870 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)Cc2cccs2)c1[N+](=O)[O-] ZINC000434014929 513216262 /nfs/dbraw/zinc/21/62/62/513216262.db2.gz YLYRMHXKOPHJQF-UHFFFAOYSA-N 1 1 365.459 2.707 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000412700462 513232324 /nfs/dbraw/zinc/23/23/24/513232324.db2.gz QTBAPBKRNDJZJE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000412700462 513232330 /nfs/dbraw/zinc/23/23/30/513232330.db2.gz QTBAPBKRNDJZJE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000412701409 513233851 /nfs/dbraw/zinc/23/38/51/513233851.db2.gz TZZRXVLAIBUSPE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1 ZINC000412701409 513233856 /nfs/dbraw/zinc/23/38/56/513233856.db2.gz TZZRXVLAIBUSPE-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3cc(C(F)(F)C(F)(F)F)ncc3[N+](=O)[O-])C[C@@H]21 ZINC000450775611 513335056 /nfs/dbraw/zinc/33/50/56/513335056.db2.gz GEXDKSDHTWBOBT-KCJUWKMLSA-N 1 1 366.290 2.784 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418107572 513375472 /nfs/dbraw/zinc/37/54/72/513375472.db2.gz FBFUFFIGPUELSM-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418107572 513375479 /nfs/dbraw/zinc/37/54/79/513375479.db2.gz FBFUFFIGPUELSM-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CN(CCO)[C@@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418107572 513375483 /nfs/dbraw/zinc/37/54/83/513375483.db2.gz FBFUFFIGPUELSM-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421706463 513378660 /nfs/dbraw/zinc/37/86/60/513378660.db2.gz VAFCEZVPIHTTNZ-CYBMUJFWSA-N 1 1 355.822 2.570 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000434712494 513403814 /nfs/dbraw/zinc/40/38/14/513403814.db2.gz CIBWNLAIVRESOV-IYBDPMFKSA-N 1 1 365.474 2.923 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000434712494 513403817 /nfs/dbraw/zinc/40/38/17/513403817.db2.gz CIBWNLAIVRESOV-IYBDPMFKSA-N 1 1 365.474 2.923 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3nccc4ccc([N+](=O)[O-])cc43)CC2)CCO1 ZINC000413069389 513422042 /nfs/dbraw/zinc/42/20/42/513422042.db2.gz DVGHSGBYAQARBC-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c1 ZINC000434772758 513425545 /nfs/dbraw/zinc/42/55/45/513425545.db2.gz BNVOGDCVUIUIGY-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1 ZINC000434772758 513425549 /nfs/dbraw/zinc/42/55/49/513425549.db2.gz BNVOGDCVUIUIGY-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000441186292 513508355 /nfs/dbraw/zinc/50/83/55/513508355.db2.gz WNDSXDZADQZSLF-LSDHHAIUSA-N 1 1 350.415 2.731 20 5 FFBDMO Cc1cnc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])c1 ZINC000430117264 513558590 /nfs/dbraw/zinc/55/85/90/513558590.db2.gz YTSLAKVDJOVERO-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000413491320 513681366 /nfs/dbraw/zinc/68/13/66/513681366.db2.gz BBIUMJXWYNIRIW-STQMWFEESA-N 1 1 367.421 2.616 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451339620 513686316 /nfs/dbraw/zinc/68/63/16/513686316.db2.gz ILTBNIWGSFOVTH-BVPBIZIASA-N 1 1 361.442 2.937 20 5 FFBDMO CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1c([N+](=O)[O-])c(C)nn1C ZINC000413536427 513703553 /nfs/dbraw/zinc/70/35/53/513703553.db2.gz QWJRRVKYDZBJOZ-IAGOWNOFSA-N 1 1 373.457 2.586 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C)CC23CCCCC3)ccc1[N+](=O)[O-] ZINC000430708164 513729073 /nfs/dbraw/zinc/72/90/73/513729073.db2.gz ZYUFTDUBFIOBJA-UHFFFAOYSA-N 1 1 361.442 2.759 20 5 FFBDMO Cc1nn(-c2ccncc2)cc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425976339 513813095 /nfs/dbraw/zinc/81/30/95/513813095.db2.gz QRRXKJBSUMJSMK-UHFFFAOYSA-N 1 1 367.413 2.518 20 5 FFBDMO COc1cc(C[N@H+](C)CCCO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000442953417 513825846 /nfs/dbraw/zinc/82/58/46/513825846.db2.gz ANNZNRAHSDXQSK-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000442953417 513825853 /nfs/dbraw/zinc/82/58/53/513825853.db2.gz ANNZNRAHSDXQSK-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CC[N@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)[C@H]1CCNC1=O ZINC000442967447 513829623 /nfs/dbraw/zinc/82/96/23/513829623.db2.gz NTULRQRKSRSXDY-HNNXBMFYSA-N 1 1 359.382 2.574 20 5 FFBDMO CC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)[C@H]1CCNC1=O ZINC000442967447 513829632 /nfs/dbraw/zinc/82/96/32/513829632.db2.gz NTULRQRKSRSXDY-HNNXBMFYSA-N 1 1 359.382 2.574 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448706584 513857160 /nfs/dbraw/zinc/85/71/60/513857160.db2.gz ZIGMNKISNLXKOM-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])cc1F ZINC000448777483 513893148 /nfs/dbraw/zinc/89/31/48/513893148.db2.gz MGHBSMDWHXDVRQ-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000448934807 513979201 /nfs/dbraw/zinc/97/92/01/513979201.db2.gz XHFRSOJYAUUXLX-MRXNPFEDSA-N 1 1 369.425 2.685 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431931625 514043424 /nfs/dbraw/zinc/04/34/24/514043424.db2.gz RDUQPNMRMNGWQF-CYBMUJFWSA-N 1 1 370.247 2.962 20 5 FFBDMO CC1(C)CCC[N@H+](CCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000443971784 514087814 /nfs/dbraw/zinc/08/78/14/514087814.db2.gz WNXHEQCONMZIQC-UHFFFAOYSA-N 1 1 355.460 2.532 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000443971784 514087820 /nfs/dbraw/zinc/08/78/20/514087820.db2.gz WNXHEQCONMZIQC-UHFFFAOYSA-N 1 1 355.460 2.532 20 5 FFBDMO COc1cc(CNCC[N@H+]2CCCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000444019195 514100525 /nfs/dbraw/zinc/10/05/25/514100525.db2.gz WQRFKNZJESVNGO-UHFFFAOYSA-N 1 1 351.447 2.824 20 5 FFBDMO COc1cc(C[NH2+]CCN2CCCC(C)(C)C2)c([N+](=O)[O-])cc1OC ZINC000444019195 514100528 /nfs/dbraw/zinc/10/05/28/514100528.db2.gz WQRFKNZJESVNGO-UHFFFAOYSA-N 1 1 351.447 2.824 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(OC)ccc1[N+](=O)[O-])CCC(F)(F)F ZINC000427260566 514165482 /nfs/dbraw/zinc/16/54/82/514165482.db2.gz NZPPWUUIHKBEGD-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(C)s1)CCC(F)(F)F ZINC000427284763 514172511 /nfs/dbraw/zinc/17/25/11/514172511.db2.gz PQPZJSOGOJSPCC-UHFFFAOYSA-N 1 1 353.366 2.969 20 5 FFBDMO COC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452106478 514194296 /nfs/dbraw/zinc/19/42/96/514194296.db2.gz QQXQKQVOUZDKGK-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NCC[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000420613124 514201332 /nfs/dbraw/zinc/20/13/32/514201332.db2.gz QROHBBUTSRGLAZ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NCC[N@H+]1CCc2c(Cl)cccc2C1 ZINC000420613124 514201336 /nfs/dbraw/zinc/20/13/36/514201336.db2.gz QROHBBUTSRGLAZ-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000452121271 514205927 /nfs/dbraw/zinc/20/59/27/514205927.db2.gz SGOZRZBKTKUHJG-CYBMUJFWSA-N 1 1 354.838 2.601 20 5 FFBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449460450 514217606 /nfs/dbraw/zinc/21/76/06/514217606.db2.gz ZBDJNDZMFDMVBG-LJQANCHMSA-N 1 1 374.393 2.866 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000437834318 514247657 /nfs/dbraw/zinc/24/76/57/514247657.db2.gz NGMPDMDJMBQJIA-KRWDZBQOSA-N 1 1 351.406 2.801 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]1Cc1ccccc1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000437834318 514247659 /nfs/dbraw/zinc/24/76/59/514247659.db2.gz NGMPDMDJMBQJIA-KRWDZBQOSA-N 1 1 351.406 2.801 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4ccc5c(c4)OCO5)CC3)nc2c1 ZINC000444687023 514292417 /nfs/dbraw/zinc/29/24/17/514292417.db2.gz YWWCFVHCFPTQAI-UHFFFAOYSA-N 1 1 352.350 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433060746 514366207 /nfs/dbraw/zinc/36/62/07/514366207.db2.gz MSIIRQIFBFVNKQ-WBVHZDCISA-N 1 1 371.437 2.766 20 5 FFBDMO Cc1c([C@@H](C)Nc2ccc3c(c2)C[N@@H+](CC(N)=O)CC3)cccc1[N+](=O)[O-] ZINC000433059158 514367140 /nfs/dbraw/zinc/36/71/40/514367140.db2.gz MNUHEKUFAHJCFF-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1c([C@@H](C)Nc2ccc3c(c2)C[N@H+](CC(N)=O)CC3)cccc1[N+](=O)[O-] ZINC000433059158 514367144 /nfs/dbraw/zinc/36/71/44/514367144.db2.gz MNUHEKUFAHJCFF-CQSZACIVSA-N 1 1 368.437 2.920 20 5 FFBDMO C[C@@H](Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000433093593 514376757 /nfs/dbraw/zinc/37/67/57/514376757.db2.gz RNXVZUHYGRDKKN-CYBMUJFWSA-N 1 1 354.410 2.611 20 5 FFBDMO C[C@@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1cccc([N+](=O)[O-])c1 ZINC000433093593 514376765 /nfs/dbraw/zinc/37/67/65/514376765.db2.gz RNXVZUHYGRDKKN-CYBMUJFWSA-N 1 1 354.410 2.611 20 5 FFBDMO C[C@]1(Cc2ccc(F)cc2)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000420921464 514377204 /nfs/dbraw/zinc/37/72/04/514377204.db2.gz CUROLWXDRHLUIB-LJQANCHMSA-N 1 1 359.401 2.993 20 5 FFBDMO CC(C)c1cc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc(N(C)C)[nH+]1 ZINC000428156874 514410740 /nfs/dbraw/zinc/41/07/40/514410740.db2.gz XANQJOAMQCDBJM-CYBMUJFWSA-N 1 1 371.445 2.660 20 5 FFBDMO CC[C@H](C)[C@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079623 514490704 /nfs/dbraw/zinc/49/07/04/514490704.db2.gz UVZPLHGMJJZMRQ-WMLDXEAASA-N 1 1 372.473 2.769 20 5 FFBDMO CC[C@H](C)[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079623 514490707 /nfs/dbraw/zinc/49/07/07/514490707.db2.gz UVZPLHGMJJZMRQ-WMLDXEAASA-N 1 1 372.473 2.769 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488823809 514598922 /nfs/dbraw/zinc/59/89/22/514598922.db2.gz FFCSXSWGKSKMNJ-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488823809 514598932 /nfs/dbraw/zinc/59/89/32/514598932.db2.gz FFCSXSWGKSKMNJ-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458192862 514616281 /nfs/dbraw/zinc/61/62/81/514616281.db2.gz PGKUOJKALXYNMH-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475322271 514620083 /nfs/dbraw/zinc/62/00/83/514620083.db2.gz OKQSCELPLGVWNC-SFHVURJKSA-N 1 1 369.421 2.707 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000461636525 514678995 /nfs/dbraw/zinc/67/89/95/514678995.db2.gz KNXYRHCVOPSRQW-LBPRGKRZSA-N 1 1 360.414 2.699 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3nc(C)ccc3O)CC2)ccc1[N+](=O)[O-] ZINC000475496755 514689228 /nfs/dbraw/zinc/68/92/28/514689228.db2.gz PJYVXPKUUFFCAF-UHFFFAOYSA-N 1 1 372.425 2.725 20 5 FFBDMO Cc1cc(NCCCN2CC[NH+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461732698 514711681 /nfs/dbraw/zinc/71/16/81/514711681.db2.gz RGFBWXKONQTPJY-UHFFFAOYSA-N 1 1 360.380 2.971 20 5 FFBDMO CS[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1N1CCCC1 ZINC000484633173 514720534 /nfs/dbraw/zinc/72/05/34/514720534.db2.gz CRPBGFCFONKGCN-ROUUACIJSA-N 1 1 365.499 2.875 20 5 FFBDMO CS[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1N1CCCC1 ZINC000484633173 514720542 /nfs/dbraw/zinc/72/05/42/514720542.db2.gz CRPBGFCFONKGCN-ROUUACIJSA-N 1 1 365.499 2.875 20 5 FFBDMO C[C@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1 ZINC000498140447 514776361 /nfs/dbraw/zinc/77/63/61/514776361.db2.gz NYRWQJYFJPLWJC-WBMJQRKESA-N 1 1 367.496 2.606 20 5 FFBDMO Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461948224 514799689 /nfs/dbraw/zinc/79/96/89/514799689.db2.gz MHGQEEDSDGGBPY-HUUCEWRRSA-N 1 1 359.348 2.831 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CC[C@@H](C)C1 ZINC000484852101 514814324 /nfs/dbraw/zinc/81/43/24/514814324.db2.gz BBFYMDWTSMAWLC-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498476600 514920956 /nfs/dbraw/zinc/92/09/56/514920956.db2.gz WKEMHZHODDTODW-LBPRGKRZSA-N 1 1 354.838 2.526 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H]1CC=CCC1 ZINC000485142079 514933349 /nfs/dbraw/zinc/93/33/49/514933349.db2.gz METYKNLEEYISIE-INIZCTEOSA-N 1 1 373.453 2.789 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000467197876 514936762 /nfs/dbraw/zinc/93/67/62/514936762.db2.gz WFDRPCIJUBQYFZ-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000467197876 514936777 /nfs/dbraw/zinc/93/67/77/514936777.db2.gz WFDRPCIJUBQYFZ-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000467217808 514942645 /nfs/dbraw/zinc/94/26/45/514942645.db2.gz OOCBKCMOQGXVQZ-QWHCGFSZSA-N 1 1 352.822 2.674 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000498567940 514973514 /nfs/dbraw/zinc/97/35/14/514973514.db2.gz XIRNHENQJZLUNZ-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO O=[N+]([O-])c1c(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)nc2sccn21 ZINC000480565590 514999359 /nfs/dbraw/zinc/99/93/59/514999359.db2.gz VZJGLUBWXGSHHH-GASCZTMLSA-N 1 1 369.450 2.872 20 5 FFBDMO COc1c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476334808 515007635 /nfs/dbraw/zinc/00/76/35/515007635.db2.gz GDILTRBPXWVRIN-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000485407074 515028228 /nfs/dbraw/zinc/02/82/28/515028228.db2.gz MKLWUJFQHHYGCR-AWEZNQCLSA-N 1 1 374.416 2.689 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000498710591 515035760 /nfs/dbraw/zinc/03/57/60/515035760.db2.gz PYCCSPNIPJWSTG-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO COc1ccc(C(=O)CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000509359882 515140927 /nfs/dbraw/zinc/14/09/27/515140927.db2.gz UEZJKXZRFXZRAE-HNNXBMFYSA-N 1 1 370.409 2.758 20 5 FFBDMO COc1cccc(C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C2CCC(O)CC2)c1 ZINC000472245819 515182687 /nfs/dbraw/zinc/18/26/87/515182687.db2.gz XAFAFUSZJWLQNB-UHFFFAOYSA-N 1 1 374.441 2.606 20 5 FFBDMO C[N@@H+](CCOCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000504574550 515330689 /nfs/dbraw/zinc/33/06/89/515330689.db2.gz FUORDZYVUGFPLZ-UHFFFAOYSA-N 1 1 364.373 2.967 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000486102467 515334817 /nfs/dbraw/zinc/33/48/17/515334817.db2.gz DJLYGFJHXBQMHQ-GFCCVEGCSA-N 1 1 367.471 2.787 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463135235 515379086 /nfs/dbraw/zinc/37/90/86/515379086.db2.gz WBYQMCCWWMJFQQ-RYUDHWBXSA-N 1 1 357.332 2.970 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000481717006 515435865 /nfs/dbraw/zinc/43/58/65/515435865.db2.gz UXDCLNATUGGKSV-ZDUSSCGKSA-N 1 1 368.865 2.822 20 5 FFBDMO CN(CC(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000463358027 515456975 /nfs/dbraw/zinc/45/69/75/515456975.db2.gz CMVRMMIECNMBQQ-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO CN(CC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000463358027 515456988 /nfs/dbraw/zinc/45/69/88/515456988.db2.gz CMVRMMIECNMBQQ-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])[NH+](C)C ZINC000505176097 515466565 /nfs/dbraw/zinc/46/65/65/515466565.db2.gz GLIGWGOIHCLVHH-MRXNPFEDSA-N 1 1 357.410 2.945 20 5 FFBDMO COc1ccccc1[C@@H]1CC[C@H](C)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000510258617 515486540 /nfs/dbraw/zinc/48/65/40/515486540.db2.gz ZXOFNIBEKBOKLL-ZVZYQTTQSA-N 1 1 374.441 2.634 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000463481404 515519083 /nfs/dbraw/zinc/51/90/83/515519083.db2.gz DDFXAXFDFXBHRC-UHFFFAOYSA-N 1 1 362.474 2.754 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000510472446 515549169 /nfs/dbraw/zinc/54/91/69/515549169.db2.gz GDCPSHZZXRPMDI-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000463621319 515561880 /nfs/dbraw/zinc/56/18/80/515561880.db2.gz FAFGTROFNKQWHQ-MRXNPFEDSA-N 1 1 362.474 2.802 20 5 FFBDMO O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457004759 515578766 /nfs/dbraw/zinc/57/87/66/515578766.db2.gz YOTFPDYSPQEJIU-GOSISDBHSA-N 1 1 366.421 2.956 20 5 FFBDMO O=c1cc2c(n[nH]1)CC[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000482318288 515649061 /nfs/dbraw/zinc/64/90/61/515649061.db2.gz SHSWRXXSOBKKNX-UHFFFAOYSA-N 1 1 352.350 2.909 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)c1 ZINC000459568216 515657152 /nfs/dbraw/zinc/65/71/52/515657152.db2.gz BDYUYHIEOBTUQP-ZWKOTPCHSA-N 1 1 356.426 2.770 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000486962634 515700563 /nfs/dbraw/zinc/70/05/63/515700563.db2.gz GTHQIDKWQARGOS-LSDHHAIUSA-N 1 1 366.849 2.717 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])nn2C)cc1 ZINC000478117439 515706104 /nfs/dbraw/zinc/70/61/04/515706104.db2.gz YOKGEMLRUHTRNA-ZDUSSCGKSA-N 1 1 357.414 2.955 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000494061266 515724556 /nfs/dbraw/zinc/72/45/56/515724556.db2.gz VKMFQDBXLXJQJW-RDJZCZTQSA-N 1 1 368.437 2.786 20 5 FFBDMO CN(Cc1ccccc1F)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074758 515766699 /nfs/dbraw/zinc/76/66/99/515766699.db2.gz WMURHTHNJMBHBB-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO CN(Cc1ccccc1F)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511074758 515766709 /nfs/dbraw/zinc/76/67/09/515766709.db2.gz WMURHTHNJMBHBB-UHFFFAOYSA-N 1 1 359.401 2.867 20 5 FFBDMO C[N@@H+]1CCO[C@H](C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000469535689 515857371 /nfs/dbraw/zinc/85/73/71/515857371.db2.gz PAQCOMRDGIZUKS-KRWDZBQOSA-N 1 1 357.366 2.656 20 5 FFBDMO C[N@H+]1CCO[C@H](C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000469535689 515857379 /nfs/dbraw/zinc/85/73/79/515857379.db2.gz PAQCOMRDGIZUKS-KRWDZBQOSA-N 1 1 357.366 2.656 20 5 FFBDMO O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000482986344 515872444 /nfs/dbraw/zinc/87/24/44/515872444.db2.gz CHGHLKXKZOVCDQ-HNNXBMFYSA-N 1 1 360.458 2.778 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)[NH+](C)C ZINC000511527794 515934478 /nfs/dbraw/zinc/93/44/78/515934478.db2.gz BCTQQDVIJDRKDE-QGZVFWFLSA-N 1 1 357.410 2.945 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000478718134 515940801 /nfs/dbraw/zinc/94/08/01/515940801.db2.gz AWFLGCMRDCYZSJ-QWHCGFSZSA-N 1 1 365.430 2.605 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCCOC2)O1 ZINC000483360693 516049171 /nfs/dbraw/zinc/04/91/71/516049171.db2.gz WTPOTTUIZOECDC-SFHVURJKSA-N 1 1 350.415 2.634 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000495084349 516059815 /nfs/dbraw/zinc/05/98/15/516059815.db2.gz MEZHHKNKRLEEGX-ZDUSSCGKSA-N 1 1 366.414 2.646 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@H](C)[N@@H+](CC)C[C@@H]1C ZINC000460208847 516068185 /nfs/dbraw/zinc/06/81/85/516068185.db2.gz HPXRHCGOIZWVCR-KBPBESRZSA-N 1 1 358.446 2.792 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1OCCc2ccccc21 ZINC000507243643 516138364 /nfs/dbraw/zinc/13/83/64/516138364.db2.gz RPWMGTOBIXOGDK-XLIONFOSSA-N 1 1 372.421 2.580 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@@H]1C ZINC000495473972 516174449 /nfs/dbraw/zinc/17/44/49/516174449.db2.gz KSTISRNWMBNZTH-GJZGRUSLSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507374014 516189879 /nfs/dbraw/zinc/18/98/79/516189879.db2.gz YGGSFLSXWZIHRY-ZBFHGGJFSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507374014 516189887 /nfs/dbraw/zinc/18/98/87/516189887.db2.gz YGGSFLSXWZIHRY-ZBFHGGJFSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507374013 516191050 /nfs/dbraw/zinc/19/10/50/516191050.db2.gz YGGSFLSXWZIHRY-HOCLYGCPSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507374013 516191058 /nfs/dbraw/zinc/19/10/58/516191058.db2.gz YGGSFLSXWZIHRY-HOCLYGCPSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000465603956 516207709 /nfs/dbraw/zinc/20/77/09/516207709.db2.gz PWWCXPCRJIYKBX-MRXNPFEDSA-N 1 1 362.474 2.949 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000512439113 516279748 /nfs/dbraw/zinc/27/97/48/516279748.db2.gz NTIMEZYYMDBPQC-MAUKXSAKSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](N2CCOCC2)C[C@@H]1C ZINC000512439113 516279752 /nfs/dbraw/zinc/27/97/52/516279752.db2.gz NTIMEZYYMDBPQC-MAUKXSAKSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)c1ccc(C[C@@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000460984252 516297082 /nfs/dbraw/zinc/29/70/82/516297082.db2.gz VNBDAOQICXQLJM-FXAWDEMLSA-N 1 1 372.469 2.840 20 5 FFBDMO C[C@@H]1C[C@H]1[N@@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747342 516299647 /nfs/dbraw/zinc/29/96/47/516299647.db2.gz FFZJONYWFFOEOW-DMDPSCGWSA-N 1 1 369.263 2.919 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747342 516299651 /nfs/dbraw/zinc/29/96/51/516299651.db2.gz FFZJONYWFFOEOW-DMDPSCGWSA-N 1 1 369.263 2.919 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000488748220 516300000 /nfs/dbraw/zinc/30/00/00/516300000.db2.gz KAQGBVBDNNWCTE-WOSRLPQWSA-N 1 1 361.442 2.856 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)[C@@H](c2ccccc2)C1 ZINC000497412342 516320805 /nfs/dbraw/zinc/32/08/05/516320805.db2.gz ZFBQZIMHDYGYCF-NVXWUHKLSA-N 1 1 364.405 2.904 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000535432525 516353594 /nfs/dbraw/zinc/35/35/94/516353594.db2.gz ZHCZQTGFGOVPSA-UHFFFAOYSA-N 1 1 362.474 2.899 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000535432264 516353620 /nfs/dbraw/zinc/35/36/20/516353620.db2.gz OJQHZMIQNQTAPR-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000535432264 516353634 /nfs/dbraw/zinc/35/36/34/516353634.db2.gz OJQHZMIQNQTAPR-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO O=c1[nH]c(NC[C@@H]2CCC[N@H+]2C2CCCCC2)nc2ccc([N+](=O)[O-])cc21 ZINC000557670465 516372262 /nfs/dbraw/zinc/37/22/62/516372262.db2.gz BFXYSCNBADDXFY-HNNXBMFYSA-N 1 1 371.441 2.875 20 5 FFBDMO COc1cc(CNC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000543705692 516380178 /nfs/dbraw/zinc/38/01/78/516380178.db2.gz USQIYJDINMMJMV-GFCCVEGCSA-N 1 1 373.400 2.679 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000561153976 516412561 /nfs/dbraw/zinc/41/25/61/516412561.db2.gz LUDRSZZYRSJCMM-CQSZACIVSA-N 1 1 359.430 2.732 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCCc2occc2C1 ZINC000517777144 516449475 /nfs/dbraw/zinc/44/94/75/516449475.db2.gz CBQQRMBPVUDDGZ-UHFFFAOYSA-N 1 1 357.366 2.934 20 5 FFBDMO CC[NH+](CC)CCCC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 ZINC000543949396 516510501 /nfs/dbraw/zinc/51/05/01/516510501.db2.gz ICXLBMAEAVHQNM-UHFFFAOYSA-N 1 1 351.451 2.601 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000561347282 516535568 /nfs/dbraw/zinc/53/55/68/516535568.db2.gz IDPLMKXOSNMIJX-DCGLDWPTSA-N 1 1 365.861 2.979 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000558027891 516559758 /nfs/dbraw/zinc/55/97/58/516559758.db2.gz XFFMFBWSWPJWAP-KHYOSLBOSA-N 1 1 370.453 2.738 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000523909704 516605944 /nfs/dbraw/zinc/60/59/44/516605944.db2.gz HFIXVMSWHMGNQL-HNNXBMFYSA-N 1 1 362.474 2.901 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561746992 516746483 /nfs/dbraw/zinc/74/64/83/516746483.db2.gz QTPOWGAQKYPWDL-BXWFABGCSA-N 1 1 374.485 2.976 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561762604 516756788 /nfs/dbraw/zinc/75/67/88/516756788.db2.gz PBHBWZFGSKDJHQ-VBQJREDUSA-N 1 1 363.483 2.876 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C1 ZINC000524774910 516825606 /nfs/dbraw/zinc/82/56/06/516825606.db2.gz ISKREEUHUPHXHP-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000558596186 516828389 /nfs/dbraw/zinc/82/83/89/516828389.db2.gz JEGNBSLDVVCTBW-IRXDYDNUSA-N 1 1 368.437 2.527 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000532169370 516837306 /nfs/dbraw/zinc/83/73/06/516837306.db2.gz NMNPOYBYQWVWLS-RDJZCZTQSA-N 1 1 362.430 2.668 20 5 FFBDMO CCOc1cc(CN2CCC([N@H+]3CCOC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000518995793 516849630 /nfs/dbraw/zinc/84/96/30/516849630.db2.gz IYGUWBZKTBYZSC-OAHLLOKOSA-N 1 1 363.458 2.679 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000514498713 516933380 /nfs/dbraw/zinc/93/33/80/516933380.db2.gz YTKXMOUMVLCQQO-SFHVURJKSA-N 1 1 353.422 2.918 20 5 FFBDMO CC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000532388408 516947098 /nfs/dbraw/zinc/94/70/98/516947098.db2.gz YUSYVRDKAUGTGX-INIZCTEOSA-N 1 1 354.410 2.557 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000555598146 517003818 /nfs/dbraw/zinc/00/38/18/517003818.db2.gz PBWDGTYUBDKFDD-KXBFYZLASA-N 1 1 360.458 2.648 20 5 FFBDMO COc1cc(Cc2noc([C@H]3CCn4c[nH+]cc4C3)n2)ccc1[N+](=O)[O-] ZINC000545050963 517032969 /nfs/dbraw/zinc/03/29/69/517032969.db2.gz PQPSTIVEJLARQF-LBPRGKRZSA-N 1 1 355.354 2.504 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3CCn4c[nH+]cc4C3)n2)ccc1[N+](=O)[O-] ZINC000545050962 517034092 /nfs/dbraw/zinc/03/40/92/517034092.db2.gz PQPSTIVEJLARQF-GFCCVEGCSA-N 1 1 355.354 2.504 20 5 FFBDMO Cc1cnccc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000552063181 517056936 /nfs/dbraw/zinc/05/69/36/517056936.db2.gz RLHVHUPCVDTZQD-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000525576143 517079007 /nfs/dbraw/zinc/07/90/07/517079007.db2.gz OBQVQIGRKBLSLY-BETUJISGSA-N 1 1 365.430 2.605 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC=C(c3ccccn3)C2)c1 ZINC000562443025 517113602 /nfs/dbraw/zinc/11/36/02/517113602.db2.gz CKOYHBUSAFNGJX-QGZVFWFLSA-N 1 1 355.394 2.519 20 5 FFBDMO CC(C)[C@H](O)C1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552277738 517176513 /nfs/dbraw/zinc/17/65/13/517176513.db2.gz HLBIMTAAHRWJKA-IRXDYDNUSA-N 1 1 358.442 2.804 20 5 FFBDMO COCC[N@H+](CCc1ccccc1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000532933775 517208686 /nfs/dbraw/zinc/20/86/86/517208686.db2.gz QTVNWKMDECGQOS-UHFFFAOYSA-N 1 1 371.437 2.749 20 5 FFBDMO COCC[N@@H+](CCc1ccccc1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000532933775 517208692 /nfs/dbraw/zinc/20/86/92/517208692.db2.gz QTVNWKMDECGQOS-UHFFFAOYSA-N 1 1 371.437 2.749 20 5 FFBDMO O=C(c1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000559691113 517376393 /nfs/dbraw/zinc/37/63/93/517376393.db2.gz UIHDHEFMFZHJPY-AWEZNQCLSA-N 1 1 358.442 2.727 20 5 FFBDMO Cc1cc(C[C@H](C)[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000520439424 517394091 /nfs/dbraw/zinc/39/40/91/517394091.db2.gz UVUDXQXYXGFWSQ-YVEFUNNKSA-N 1 1 354.414 2.670 20 5 FFBDMO Cc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549181511 517442296 /nfs/dbraw/zinc/44/22/96/517442296.db2.gz BQQVILNIWMSPGA-UHFFFAOYSA-N 1 1 355.320 2.972 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC1)CC(C)C ZINC000538032775 517445127 /nfs/dbraw/zinc/44/51/27/517445127.db2.gz RLDWBHHEHDRVMV-UHFFFAOYSA-N 1 1 365.478 2.847 20 5 FFBDMO CC[N@H+](CCC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1)CC(C)C ZINC000538032775 517445134 /nfs/dbraw/zinc/44/51/34/517445134.db2.gz RLDWBHHEHDRVMV-UHFFFAOYSA-N 1 1 365.478 2.847 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1)CC(C)C ZINC000538032775 517445139 /nfs/dbraw/zinc/44/51/39/517445139.db2.gz RLDWBHHEHDRVMV-UHFFFAOYSA-N 1 1 365.478 2.847 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000546036102 517505949 /nfs/dbraw/zinc/50/59/49/517505949.db2.gz YGSLIDRAXMOMRA-RDJZCZTQSA-N 1 1 362.430 2.668 20 5 FFBDMO CC1(C2CC2)CC[NH+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000520905836 517548668 /nfs/dbraw/zinc/54/86/68/517548668.db2.gz BJOSXHQZRHKZEW-INIZCTEOSA-N 1 1 357.410 2.739 20 5 FFBDMO CNC(=O)C[NH+]1CCC(Nc2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000553308965 517636145 /nfs/dbraw/zinc/63/61/45/517636145.db2.gz GDVRGXYBRVAKRF-UHFFFAOYSA-N 1 1 361.229 2.524 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549612161 517637810 /nfs/dbraw/zinc/63/78/10/517637810.db2.gz MKJMSLKNEKSSLJ-CYBMUJFWSA-N 1 1 350.337 2.831 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549612161 517637821 /nfs/dbraw/zinc/63/78/21/517637821.db2.gz MKJMSLKNEKSSLJ-CYBMUJFWSA-N 1 1 350.337 2.831 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000560252765 517658038 /nfs/dbraw/zinc/65/80/38/517658038.db2.gz XBOVFPLDEHUTKK-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000560252765 517658045 /nfs/dbraw/zinc/65/80/45/517658045.db2.gz XBOVFPLDEHUTKK-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000534020777 517710184 /nfs/dbraw/zinc/71/01/84/517710184.db2.gz SSKZULORQKJTJW-AEFFLSMTSA-N 1 1 354.410 2.812 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O[C@H]2CCOC2)CC1 ZINC000556902256 517737482 /nfs/dbraw/zinc/73/74/82/517737482.db2.gz RFAKSWHNPQOABV-KRWDZBQOSA-N 1 1 350.415 2.763 20 5 FFBDMO CCN(C(=O)c1[nH]nc(C)c1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000521477128 517747598 /nfs/dbraw/zinc/74/75/98/517747598.db2.gz SDHYWDXZIUJTIZ-ZBFHGGJFSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000521477128 517747608 /nfs/dbraw/zinc/74/76/08/517747608.db2.gz SDHYWDXZIUJTIZ-ZBFHGGJFSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000521477128 517747616 /nfs/dbraw/zinc/74/76/16/517747616.db2.gz SDHYWDXZIUJTIZ-ZBFHGGJFSA-N 1 1 371.441 2.924 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538791495 517781275 /nfs/dbraw/zinc/78/12/75/517781275.db2.gz ADRPXEZOQUWHEJ-CRAIPNDOSA-N 1 1 356.426 2.996 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000542889142 517800649 /nfs/dbraw/zinc/80/06/49/517800649.db2.gz OPHFZPWGFABZEV-QWRGUYRKSA-N 1 1 357.357 2.751 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000516677221 517803716 /nfs/dbraw/zinc/80/37/16/517803716.db2.gz RIGQPWITLMUTGD-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO CCC[C@@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000553622445 517817096 /nfs/dbraw/zinc/81/70/96/517817096.db2.gz WJXCQMZMRMKGSA-QGZVFWFLSA-N 1 1 357.458 2.815 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000542962140 517839966 /nfs/dbraw/zinc/83/99/66/517839966.db2.gz OFYQIUGISBLUBJ-INIZCTEOSA-N 1 1 370.409 2.999 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCCn1ccnc1)c1cccc([N+](=O)[O-])c1 ZINC000560516480 517867008 /nfs/dbraw/zinc/86/70/08/517867008.db2.gz KBVNVQFAAKKGRV-QGZVFWFLSA-N 1 1 354.414 2.684 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000521907554 517896449 /nfs/dbraw/zinc/89/64/49/517896449.db2.gz DBPVOHUHACGKJQ-BETUJISGSA-N 1 1 365.478 2.757 20 5 FFBDMO Cc1cc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)ccc1[N+](=O)[O-] ZINC000560677979 517966626 /nfs/dbraw/zinc/96/66/26/517966626.db2.gz ADNDEVUAYOKRLL-QGZVFWFLSA-N 1 1 355.394 2.722 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000557525883 518055071 /nfs/dbraw/zinc/05/50/71/518055071.db2.gz AGZQOVNWFOAIQL-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@H](C)C1 ZINC000557525883 518055084 /nfs/dbraw/zinc/05/50/84/518055084.db2.gz AGZQOVNWFOAIQL-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[NH+](Cc4cccc(F)c4)CC3)c21 ZINC000543435066 518089254 /nfs/dbraw/zinc/08/92/54/518089254.db2.gz CXNYRRUANXQRON-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000543580853 518143726 /nfs/dbraw/zinc/14/37/26/518143726.db2.gz GPAPMKHRGNQXJE-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@H](C3CCCCC3)C2)c1 ZINC000543585131 518146246 /nfs/dbraw/zinc/14/62/46/518146246.db2.gz IEMWIDHXNWXJLH-MJGOQNOKSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@H](C3CCCCC3)C2)c1 ZINC000543585131 518146252 /nfs/dbraw/zinc/14/62/52/518146252.db2.gz IEMWIDHXNWXJLH-MJGOQNOKSA-N 1 1 364.442 2.616 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000584175259 518214852 /nfs/dbraw/zinc/21/48/52/518214852.db2.gz PRGFOCVRJYDGQU-OAHLLOKOSA-N 1 1 369.425 2.882 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])cc1 ZINC000572627297 518283626 /nfs/dbraw/zinc/28/36/26/518283626.db2.gz DTLCFDLJOKQYHO-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO COC(=O)c1cnc(NCC[N@@H+]2CC=C(C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000572829515 518379311 /nfs/dbraw/zinc/37/93/11/518379311.db2.gz IZTRCORAGQHITD-UHFFFAOYSA-N 1 1 362.430 2.867 20 5 FFBDMO CCC(CC)(C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(=O)OC ZINC000567283696 518445040 /nfs/dbraw/zinc/44/50/40/518445040.db2.gz VHKANEZCWNYLCQ-MRXNPFEDSA-N 1 1 374.441 2.987 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000564607403 518523337 /nfs/dbraw/zinc/52/33/37/518523337.db2.gz LLXDGBDWBDVREU-RDJZCZTQSA-N 1 1 360.385 2.963 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376484 518650996 /nfs/dbraw/zinc/65/09/96/518650996.db2.gz SPDCCAOKOPDTNM-FPOVZHCZSA-N 1 1 367.449 2.809 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000579376484 518651004 /nfs/dbraw/zinc/65/10/04/518651004.db2.gz SPDCCAOKOPDTNM-FPOVZHCZSA-N 1 1 367.449 2.809 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C[N@H+]1C1CC1 ZINC000582311532 518692765 /nfs/dbraw/zinc/69/27/65/518692765.db2.gz PCEAFIZSXZNNDI-STQMWFEESA-N 1 1 364.421 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3c[nH+]cn3C2)nc1OCc1ccccc1 ZINC000588067786 518714773 /nfs/dbraw/zinc/71/47/73/518714773.db2.gz PLIGPWZZXADBCG-OAHLLOKOSA-N 1 1 365.393 2.614 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000576986125 518861916 /nfs/dbraw/zinc/86/19/16/518861916.db2.gz OEOBXALYWNBPMY-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000576986125 518861919 /nfs/dbraw/zinc/86/19/19/518861919.db2.gz OEOBXALYWNBPMY-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CN(c3ccccc3)CCO1)C2 ZINC000582674764 518868640 /nfs/dbraw/zinc/86/86/40/518868640.db2.gz XEPDGDLXPOPIGM-GOSISDBHSA-N 1 1 353.422 2.858 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CN(c3ccccc3)CCO1)C2 ZINC000582674764 518868647 /nfs/dbraw/zinc/86/86/47/518868647.db2.gz XEPDGDLXPOPIGM-GOSISDBHSA-N 1 1 353.422 2.858 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCc2[nH+]c[nH]c2C1 ZINC000570981933 518871088 /nfs/dbraw/zinc/87/10/88/518871088.db2.gz CJYVQEKMYOWWOR-MRVPVSSYSA-N 1 1 350.762 2.727 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCc2[nH]c[nH+]c2C1 ZINC000570981933 518871094 /nfs/dbraw/zinc/87/10/94/518871094.db2.gz CJYVQEKMYOWWOR-MRVPVSSYSA-N 1 1 350.762 2.727 20 5 FFBDMO Cc1ncccc1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000589259223 518966812 /nfs/dbraw/zinc/96/68/12/518966812.db2.gz UKAWHPSSOJGBCN-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNc1nc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000580357291 519133507 /nfs/dbraw/zinc/13/35/07/519133507.db2.gz AFBYDKFLYDXCEQ-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO COc1ccc(OCC[N@H+]2C[C@H](c3cnn(C)c3)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000583213073 519133720 /nfs/dbraw/zinc/13/37/20/519133720.db2.gz YOBYHGQBNQIHTQ-MRXNPFEDSA-N 1 1 374.441 2.841 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH+]c[nH]c3C2)nc1OCc1ccccc1 ZINC000577568358 519142433 /nfs/dbraw/zinc/14/24/33/519142433.db2.gz QCOQSLARLQQUIX-CQSZACIVSA-N 1 1 365.393 2.683 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH]c[nH+]c3C2)nc1OCc1ccccc1 ZINC000577568358 519142440 /nfs/dbraw/zinc/14/24/40/519142440.db2.gz QCOQSLARLQQUIX-CQSZACIVSA-N 1 1 365.393 2.683 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135218 519158588 /nfs/dbraw/zinc/15/85/88/519158588.db2.gz FCBKJDMZHCIYAG-ZDUSSCGKSA-N 1 1 374.363 2.674 20 5 FFBDMO CNc1c(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000583326601 519190495 /nfs/dbraw/zinc/19/04/95/519190495.db2.gz GNMNCYQLBIKMSM-UHFFFAOYSA-N 1 1 371.441 2.626 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000590523113 519253711 /nfs/dbraw/zinc/25/37/11/519253711.db2.gz SLRMDIZUJGKFLJ-GFCCVEGCSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000590523113 519253721 /nfs/dbraw/zinc/25/37/21/519253721.db2.gz SLRMDIZUJGKFLJ-GFCCVEGCSA-N 1 1 370.247 2.832 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000566247893 519392846 /nfs/dbraw/zinc/39/28/46/519392846.db2.gz ZBEDWDRUEQGVQI-MRXNPFEDSA-N 1 1 371.393 2.531 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000574950132 519417380 /nfs/dbraw/zinc/41/73/80/519417380.db2.gz RFZPGHQJLNIKOY-MRXNPFEDSA-N 1 1 356.426 2.955 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC000591011802 519474717 /nfs/dbraw/zinc/47/47/17/519474717.db2.gz FMRPJSXIPRIVJN-UHFFFAOYSA-N 1 1 365.430 2.823 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000583867608 519476024 /nfs/dbraw/zinc/47/60/24/519476024.db2.gz VDDULTSQHAFPNE-VIFPVBQESA-N 1 1 374.290 2.681 20 5 FFBDMO CC1(C)CC[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000591028426 519484020 /nfs/dbraw/zinc/48/40/20/519484020.db2.gz RBCHEZJDMPKLGS-HNNXBMFYSA-N 1 1 373.457 2.941 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)cc([N+](=O)[O-])c1C ZINC000572190954 519487085 /nfs/dbraw/zinc/48/70/85/519487085.db2.gz WVTMECJBNUVSEZ-UHFFFAOYSA-N 1 1 361.442 2.860 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1C ZINC000594484043 519992661 /nfs/dbraw/zinc/99/26/61/519992661.db2.gz QERPHDQMDQERJK-LSDHHAIUSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[NH+](CCCF)CC1 ZINC000600071545 520030939 /nfs/dbraw/zinc/03/09/39/520030939.db2.gz DNKUJWDSKFTGOL-LBPRGKRZSA-N 1 1 373.812 2.519 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597576363 520113952 /nfs/dbraw/zinc/11/39/52/520113952.db2.gz BSDWHQLVJNLGHM-NJAFHUGGSA-N 1 1 363.433 2.808 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608836178 520140458 /nfs/dbraw/zinc/14/04/58/520140458.db2.gz NDFQMCOSAKMQIW-AEFFLSMTSA-N 1 1 355.442 2.712 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c(C)cc1[N+](=O)[O-] ZINC000594787690 520158830 /nfs/dbraw/zinc/15/88/30/520158830.db2.gz CDPHQBBYBHOESV-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1 ZINC000597676267 520171047 /nfs/dbraw/zinc/17/10/47/520171047.db2.gz HCOPRHDNJIKEAW-OAHLLOKOSA-N 1 1 361.442 2.537 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000600297330 520187437 /nfs/dbraw/zinc/18/74/37/520187437.db2.gz ASPVAVXADFTWDC-HNNXBMFYSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000600297330 520187443 /nfs/dbraw/zinc/18/74/43/520187443.db2.gz ASPVAVXADFTWDC-HNNXBMFYSA-N 1 1 373.384 2.747 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000603402073 520249446 /nfs/dbraw/zinc/24/94/46/520249446.db2.gz MBUURZSCLHIECJ-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000603403915 520250199 /nfs/dbraw/zinc/25/01/99/520250199.db2.gz XEWPXMRRDOWVBK-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000600469593 520278759 /nfs/dbraw/zinc/27/87/59/520278759.db2.gz CKVQCKBUGLSIKI-ZDUSSCGKSA-N 1 1 369.368 2.943 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000597921874 520324670 /nfs/dbraw/zinc/32/46/70/520324670.db2.gz HFSHBUNNHKDCHN-LLVKDONJSA-N 1 1 357.357 2.799 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000609560653 520358522 /nfs/dbraw/zinc/35/85/22/520358522.db2.gz DVNUHFMQZVPZKD-AWEZNQCLSA-N 1 1 371.441 2.702 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@@H]2COc3ccccc3O2)CC1 ZINC000603782453 520359396 /nfs/dbraw/zinc/35/93/96/520359396.db2.gz RHRBADMKFNUOLI-OAHLLOKOSA-N 1 1 355.394 2.557 20 5 FFBDMO O=[N+]([O-])c1ncccc1N1CC[NH+](CCOc2ccc(Cl)cc2)CC1 ZINC000603839549 520372457 /nfs/dbraw/zinc/37/24/57/520372457.db2.gz ZUCKITLPQJESOC-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO CN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000609724568 520414728 /nfs/dbraw/zinc/41/47/28/520414728.db2.gz ARGNINDFBWCDGA-CQSZACIVSA-N 1 1 367.833 2.712 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493524 520415697 /nfs/dbraw/zinc/41/56/97/520415697.db2.gz UBORCMQXIKAKSB-HZPDHXFCSA-N 1 1 360.458 2.553 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000592525605 520439075 /nfs/dbraw/zinc/43/90/75/520439075.db2.gz AUBDQKHSCBLPBM-IYCSXQJISA-N 1 1 371.359 2.999 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604105761 520452334 /nfs/dbraw/zinc/45/23/34/520452334.db2.gz XQARYGNLMCUFGU-UONOGXRCSA-N 1 1 364.446 2.523 20 5 FFBDMO CN(CCOCC[NH3+])Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000600771801 520459467 /nfs/dbraw/zinc/45/94/67/520459467.db2.gz BFODKVBQRXRESE-UHFFFAOYSA-N 1 1 353.806 2.915 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000595476255 520494328 /nfs/dbraw/zinc/49/43/28/520494328.db2.gz ZFFNPPDXPGZSJG-GOSISDBHSA-N 1 1 354.410 2.669 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595476256 520495359 /nfs/dbraw/zinc/49/53/59/520495359.db2.gz ZFFNPPDXPGZSJG-SFHVURJKSA-N 1 1 354.410 2.669 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C2 ZINC000595505414 520513855 /nfs/dbraw/zinc/51/38/55/520513855.db2.gz SZOKMBIFJHTBRJ-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595507978 520519470 /nfs/dbraw/zinc/51/94/70/520519470.db2.gz SNFIQDOUHLSTPP-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595508390 520519836 /nfs/dbraw/zinc/51/98/36/520519836.db2.gz XBUZXHNZZHOQEC-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](CO)Cc1ccccc1 ZINC000595597589 520581154 /nfs/dbraw/zinc/58/11/54/520581154.db2.gz SIGRENMLAXDZOO-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](CO)Cc1ccccc1 ZINC000595597589 520581161 /nfs/dbraw/zinc/58/11/61/520581161.db2.gz SIGRENMLAXDZOO-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3c(F)cccc3[N+](=O)[O-])cc2)CC1 ZINC000600996184 520582396 /nfs/dbraw/zinc/58/23/96/520582396.db2.gz WUUGPKCMEQMQPM-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccc([N+](=O)[O-])[nH]1 ZINC000598396341 520595939 /nfs/dbraw/zinc/59/59/39/520595939.db2.gz LEKKECDINZWQAX-MRXNPFEDSA-N 1 1 368.437 2.955 20 5 FFBDMO CCCN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[C@H]1CC[N@@H+](C)C1 ZINC000592828866 520605317 /nfs/dbraw/zinc/60/53/17/520605317.db2.gz KIKGJJUTUZZCRD-HNNXBMFYSA-N 1 1 357.414 2.541 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000595637864 520614762 /nfs/dbraw/zinc/61/47/62/520614762.db2.gz YHXWIMKBHPTTEV-ZIEJDFEHSA-N 1 1 358.398 2.799 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000595665957 520633678 /nfs/dbraw/zinc/63/36/78/520633678.db2.gz ZBLOKADGQHDWLD-HNNXBMFYSA-N 1 1 373.457 2.791 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595683399 520645557 /nfs/dbraw/zinc/64/55/57/520645557.db2.gz IONNRPYZFZINQM-GOSISDBHSA-N 1 1 373.409 2.828 20 5 FFBDMO COc1cc2c(cc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000601149195 520660248 /nfs/dbraw/zinc/66/02/48/520660248.db2.gz KPCTZQIDDKSBLL-RNODOKPDSA-N 1 1 372.421 2.924 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000610422113 520675800 /nfs/dbraw/zinc/67/58/00/520675800.db2.gz CIWPEDSEPXXBOT-SFHVURJKSA-N 1 1 354.410 2.613 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000610422113 520675813 /nfs/dbraw/zinc/67/58/13/520675813.db2.gz CIWPEDSEPXXBOT-SFHVURJKSA-N 1 1 354.410 2.613 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c1 ZINC000610447481 520691027 /nfs/dbraw/zinc/69/10/27/520691027.db2.gz ATVOQQIOEJEXCS-UHFFFAOYSA-N 1 1 358.398 2.965 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595788323 520725308 /nfs/dbraw/zinc/72/53/08/520725308.db2.gz JCKGWSIWZNQEEC-MAUKXSAKSA-N 1 1 361.442 2.839 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595789779 520727292 /nfs/dbraw/zinc/72/72/92/520727292.db2.gz OHLNPJXXKVBKFV-APWZRJJASA-N 1 1 373.453 2.765 20 5 FFBDMO CC[C@H](C(=O)OC(C)(C)C)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593118599 520757563 /nfs/dbraw/zinc/75/75/63/520757563.db2.gz URBRYAPASOLOAZ-CQSZACIVSA-N 1 1 365.430 2.976 20 5 FFBDMO CC[C@H](C(=O)OC(C)(C)C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593118599 520757570 /nfs/dbraw/zinc/75/75/70/520757570.db2.gz URBRYAPASOLOAZ-CQSZACIVSA-N 1 1 365.430 2.976 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@]3(CC3(F)F)C2)c([N+](=O)[O-])c1 ZINC000593119232 520757882 /nfs/dbraw/zinc/75/78/82/520757882.db2.gz VUEHGGGKGWKFTF-HNNXBMFYSA-N 1 1 355.341 2.663 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645369 520758435 /nfs/dbraw/zinc/75/84/35/520758435.db2.gz INKMWNICLQAOIZ-CMPLNLGQSA-N 1 1 360.357 2.655 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000598645369 520758442 /nfs/dbraw/zinc/75/84/42/520758442.db2.gz INKMWNICLQAOIZ-CMPLNLGQSA-N 1 1 360.357 2.655 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595874659 520783283 /nfs/dbraw/zinc/78/32/83/520783283.db2.gz YJPUINOMFAWVDL-UHFFFAOYSA-N 1 1 356.854 2.897 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901292 520807839 /nfs/dbraw/zinc/80/78/39/520807839.db2.gz UUEAVHDNCMVHTI-ZBFHGGJFSA-N 1 1 360.458 2.633 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CCOC(C)(C)C ZINC000610859772 520877211 /nfs/dbraw/zinc/87/72/11/520877211.db2.gz MBULQVJOKVPDLZ-GFCCVEGCSA-N 1 1 353.419 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000610859772 520877217 /nfs/dbraw/zinc/87/72/17/520877217.db2.gz MBULQVJOKVPDLZ-GFCCVEGCSA-N 1 1 353.419 2.677 20 5 FFBDMO CCOC(=O)CCC1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000610997751 520939079 /nfs/dbraw/zinc/93/90/79/520939079.db2.gz FBZMFVYNYKBGBX-UHFFFAOYSA-N 1 1 363.414 2.589 20 5 FFBDMO CCC1([NH+](C)C)CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000601792523 520954906 /nfs/dbraw/zinc/95/49/06/520954906.db2.gz XDDQVAIPYCYMME-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)nc2c1 ZINC000618288441 520982722 /nfs/dbraw/zinc/98/27/22/520982722.db2.gz PURCUXIFKJLTOG-UGSOOPFHSA-N 1 1 355.442 2.920 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000593424790 520985197 /nfs/dbraw/zinc/98/51/97/520985197.db2.gz PSOSYDBENWDKQO-UHFFFAOYSA-N 1 1 350.463 2.757 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c1 ZINC000601881135 521004116 /nfs/dbraw/zinc/00/41/16/521004116.db2.gz RTJIJWRECZAORQ-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599072943 521016282 /nfs/dbraw/zinc/01/62/82/521016282.db2.gz LVRIDENDNMQZDI-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(CN3CC[NH+](C[C@@H]4CCCO4)CC3)co2)cc1 ZINC000611169841 521022050 /nfs/dbraw/zinc/02/20/50/521022050.db2.gz UBDBCEKVQBTPGV-SFHVURJKSA-N 1 1 372.425 2.546 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2nc3sccn3c2[N+](=O)[O-])cc1 ZINC000599138775 521050037 /nfs/dbraw/zinc/05/00/37/521050037.db2.gz FRWANQKSOYOMPO-CYBMUJFWSA-N 1 1 373.438 2.999 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000593541451 521063160 /nfs/dbraw/zinc/06/31/60/521063160.db2.gz AXJCBNKSBAOPPA-AWEZNQCLSA-N 1 1 351.422 2.761 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c(Cl)c1 ZINC000596423727 521063408 /nfs/dbraw/zinc/06/34/08/521063408.db2.gz OORYDRCPOFEEFQ-HNNXBMFYSA-N 1 1 362.817 2.822 20 5 FFBDMO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611261387 521064542 /nfs/dbraw/zinc/06/45/42/521064542.db2.gz ZXVONRPSDOGTFN-CQSZACIVSA-N 1 1 358.394 2.749 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611261387 521064548 /nfs/dbraw/zinc/06/45/48/521064548.db2.gz ZXVONRPSDOGTFN-CQSZACIVSA-N 1 1 358.394 2.749 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000593545676 521065507 /nfs/dbraw/zinc/06/55/07/521065507.db2.gz XTIAQGGUOUQGOT-RHSMWYFYSA-N 1 1 361.417 2.752 20 5 FFBDMO CC(C)C[N@@H+](C)CCCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647371 521130095 /nfs/dbraw/zinc/13/00/95/521130095.db2.gz YOHJCAHMCWTMIW-SFHVURJKSA-N 1 1 359.474 2.985 20 5 FFBDMO O=c1[nH]cnc2cc(NC[C@@H]3CCC[N@@H+](CC4CC4)C3)c([N+](=O)[O-])cc21 ZINC000596571760 521138694 /nfs/dbraw/zinc/13/86/94/521138694.db2.gz ZSYBEEDGZMWJSQ-ZDUSSCGKSA-N 1 1 357.414 2.778 20 5 FFBDMO O=C(NC1CC1)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000618618910 521146374 /nfs/dbraw/zinc/14/63/74/521146374.db2.gz LICVOMBIJXIJKR-UHFFFAOYSA-N 1 1 365.393 2.653 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000611560788 521218885 /nfs/dbraw/zinc/21/88/85/521218885.db2.gz XHRDTQNPCKGQBE-SCTDSRPQSA-N 1 1 358.442 2.949 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000611568004 521223214 /nfs/dbraw/zinc/22/32/14/521223214.db2.gz JTEWIKLDGFIEIE-AWEZNQCLSA-N 1 1 350.444 2.842 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611579127 521232340 /nfs/dbraw/zinc/23/23/40/521232340.db2.gz IWNCRXAWWUAACY-GFCCVEGCSA-N 1 1 371.340 2.596 20 5 FFBDMO C[C@@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2sccc2C1 ZINC000611700541 521287311 /nfs/dbraw/zinc/28/73/11/521287311.db2.gz AQPRVUUUVOUMFO-LBPRGKRZSA-N 1 1 369.450 2.880 20 5 FFBDMO C[C@@H](CNc1ncnc2ccc([N+](=O)[O-])cc21)[N@H+]1CCc2ccccc2C1 ZINC000611703508 521288155 /nfs/dbraw/zinc/28/81/55/521288155.db2.gz UAAHNTDKUCNECF-AWEZNQCLSA-N 1 1 363.421 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[NH+](Cc4cccc(F)c4)CC3)c2c1 ZINC000611712072 521293387 /nfs/dbraw/zinc/29/33/87/521293387.db2.gz VQGSMXKHFJCYQO-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599552967 521293894 /nfs/dbraw/zinc/29/38/94/521293894.db2.gz LLXTVLDTBXSTKJ-KGLIPLIRSA-N 1 1 365.455 2.902 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599552967 521293902 /nfs/dbraw/zinc/29/39/02/521293902.db2.gz LLXTVLDTBXSTKJ-KGLIPLIRSA-N 1 1 365.455 2.902 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599576169 521307573 /nfs/dbraw/zinc/30/75/73/521307573.db2.gz KFDHMAMJDJGIBN-ZJUUUORDSA-N 1 1 356.220 2.570 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCc2ccc(Br)cc2)c([N+](=O)[O-])n1 ZINC000602458823 521357936 /nfs/dbraw/zinc/35/79/36/521357936.db2.gz QBLRFFTWUAKKCH-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO CN(C)C[C@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602517415 521389508 /nfs/dbraw/zinc/38/95/08/521389508.db2.gz BHCAUDWNTPMPFU-HNNXBMFYSA-N 1 1 354.410 2.999 20 5 FFBDMO COC(=O)C1C[C@@H](C)[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](C)C1 ZINC000599706240 521416412 /nfs/dbraw/zinc/41/64/12/521416412.db2.gz JSKHEVPSZNMEGL-VXGBXAGGSA-N 1 1 364.398 2.623 20 5 FFBDMO CC[C@@H](C)NC(=O)[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602585084 521425622 /nfs/dbraw/zinc/42/56/22/521425622.db2.gz COIXJGVOZAZJEE-HTQZYQBOSA-N 1 1 364.265 2.812 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739584 521440659 /nfs/dbraw/zinc/44/06/59/521440659.db2.gz NQTRZVPGPCWRDD-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739584 521440666 /nfs/dbraw/zinc/44/06/66/521440666.db2.gz NQTRZVPGPCWRDD-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn(C[C@H]4CCOC4)nn3)C2)cc1 ZINC000602686600 521478647 /nfs/dbraw/zinc/47/86/47/521478647.db2.gz XULPULULSIWRCD-WBVHZDCISA-N 1 1 371.441 2.602 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn(C[C@H]4CCOC4)nn3)C2)cc1 ZINC000602686600 521478654 /nfs/dbraw/zinc/47/86/54/521478654.db2.gz XULPULULSIWRCD-WBVHZDCISA-N 1 1 371.441 2.602 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)[C@H](O)C(F)(F)F ZINC000602743125 521509394 /nfs/dbraw/zinc/50/93/94/521509394.db2.gz IFEMVZLJLVNWKI-FFWSUHOLSA-N 1 1 363.155 2.820 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597103915 521509687 /nfs/dbraw/zinc/50/96/87/521509687.db2.gz MQUMWIRNVRHAFU-ONGXEEELSA-N 1 1 355.826 2.777 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC000602755153 521515563 /nfs/dbraw/zinc/51/55/63/521515563.db2.gz WXVDIYJMGOLUHP-UHFFFAOYSA-N 1 1 357.458 2.696 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN(C)C1CC[NH+](Cc2ccccc2)CC1 ZINC000602755153 521515568 /nfs/dbraw/zinc/51/55/68/521515568.db2.gz WXVDIYJMGOLUHP-UHFFFAOYSA-N 1 1 357.458 2.696 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000612286013 521561031 /nfs/dbraw/zinc/56/10/31/521561031.db2.gz URCBRCZYDQLGIN-CYBMUJFWSA-N 1 1 369.874 2.941 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N=c1ccn(CC[NH+](C)C)[nH]1 ZINC000477612417 538662158 /nfs/dbraw/zinc/66/21/58/538662158.db2.gz VCIMRPKXYICOFO-UHFFFAOYSA-N 1 1 351.794 2.567 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CCc2c(C[NH+](C)C)nn(C(C)C)c2C1 ZINC001164646729 719307530 /nfs/dbraw/zinc/30/75/30/719307530.db2.gz GOTJFZHLQBAAQB-UHFFFAOYSA-N 1 1 358.446 2.700 20 5 FFBDMO COC[C@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc([N+](=O)[O-])c(C)c1C)C2 ZINC001164811790 720125988 /nfs/dbraw/zinc/12/59/88/720125988.db2.gz NJYZLIAPHYSQRG-YLJYHZDGSA-N 1 1 374.485 2.791 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CCN(c3cccc([N+](=O)[O-])n3)C[C@H]2C[C@H]1Cn1cccn1 ZINC001164832950 720519263 /nfs/dbraw/zinc/51/92/63/720519263.db2.gz CCNMASFKISGJEX-IXDOHACOSA-N 1 1 370.457 2.564 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cc(N2C[C@@H]3C[NH+](Cc4nccs4)C[C@H]3C2)n1 ZINC001164785876 721404820 /nfs/dbraw/zinc/40/48/20/721404820.db2.gz NLMOEDNZLMATAC-QWRGUYRKSA-N 1 1 365.846 2.668 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCC(CO)CC1 ZINC000156261426 728846689 /nfs/dbraw/zinc/84/66/89/728846689.db2.gz LVLYHWQGQIOCOP-UHFFFAOYSA-N 1 1 355.822 2.670 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@H]2[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000897984945 735300239 /nfs/dbraw/zinc/30/02/39/735300239.db2.gz HWNQRYSUEHQKTD-GFCCVEGCSA-N 1 1 364.789 2.856 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1 ZINC000053698536 728082957 /nfs/dbraw/zinc/08/29/57/728082957.db2.gz SAYBZGLZUXZJFG-LBPRGKRZSA-N 1 1 373.450 2.523 20 5 FFBDMO CC(C)[C@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)N1CCN(C)CC1 ZINC000064620257 728151728 /nfs/dbraw/zinc/15/17/28/728151728.db2.gz XQLNJHARGAUOML-KRWDZBQOSA-N 1 1 354.882 2.610 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCS[C@H]4COCC[C@@H]43)c2)cc1 ZINC000131059141 728721419 /nfs/dbraw/zinc/72/14/19/728721419.db2.gz ITQKTLFWFMFDHM-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCS[C@H]4COCC[C@@H]43)c2)cc1 ZINC000131059141 728721420 /nfs/dbraw/zinc/72/14/20/728721420.db2.gz ITQKTLFWFMFDHM-IRXDYDNUSA-N 1 1 360.439 2.622 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000174638299 729075695 /nfs/dbraw/zinc/07/56/95/729075695.db2.gz CGQIIKRSMFLWCV-UHFFFAOYSA-N 1 1 352.391 2.582 20 5 FFBDMO C[C@H](C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000860098749 730476129 /nfs/dbraw/zinc/47/61/29/730476129.db2.gz QIOJYPVACJVFIQ-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO COC(=O)C1C[C@H](C)[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000860189970 730485451 /nfs/dbraw/zinc/48/54/51/730485451.db2.gz NXUWUNOWJUYXKM-QWRGUYRKSA-N 1 1 351.359 2.665 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)ON=C(N)[C@@H]1C[N@H+](C(C)C)CCO1 ZINC000779651023 738474664 /nfs/dbraw/zinc/47/46/64/738474664.db2.gz BTSWGFDUOHBACY-CJNGLKHVSA-N 1 1 350.419 2.572 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)ON=C(N)[C@@H]1C[N@@H+](C(C)C)CCO1 ZINC000779651023 738474666 /nfs/dbraw/zinc/47/46/66/738474666.db2.gz BTSWGFDUOHBACY-CJNGLKHVSA-N 1 1 350.419 2.572 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cc(SC)ccc2[N+](=O)[O-])C1 ZINC000861343848 730601214 /nfs/dbraw/zinc/60/12/14/730601214.db2.gz LODGZZVCIABZGK-ZBEGNZNMSA-N 1 1 354.428 2.583 20 5 FFBDMO COCCCN1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866255383 731044224 /nfs/dbraw/zinc/04/42/24/731044224.db2.gz RRLGPBLEYHGJKA-CQSZACIVSA-N 1 1 353.438 2.755 20 5 FFBDMO C[C@H]1CN(c2cc(Br)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000780655011 738566045 /nfs/dbraw/zinc/56/60/45/738566045.db2.gz NNJQBSHDMSXRQV-NSHDSACASA-N 1 1 372.263 2.639 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000874830732 732104677 /nfs/dbraw/zinc/10/46/77/732104677.db2.gz SSOOZDBWODIGQO-UONOGXRCSA-N 1 1 355.797 2.625 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000874839386 732106237 /nfs/dbraw/zinc/10/62/37/732106237.db2.gz VUGGBBUYMZQSCG-UONOGXRCSA-N 1 1 368.231 2.666 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCS(=O)(=O)CC1CC1 ZINC000877110529 732324168 /nfs/dbraw/zinc/32/41/68/732324168.db2.gz XRWNHFGSQRIAPS-UHFFFAOYSA-N 1 1 366.361 2.528 20 5 FFBDMO COC[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878123034 732486236 /nfs/dbraw/zinc/48/62/36/732486236.db2.gz OTBSALJHUJFFQO-SNVBAGLBSA-N 1 1 352.778 2.767 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557755 732721582 /nfs/dbraw/zinc/72/15/82/732721582.db2.gz FKAFDIBRKVLDAX-GHMZBOCLSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000879557755 732721588 /nfs/dbraw/zinc/72/15/88/732721588.db2.gz FKAFDIBRKVLDAX-GHMZBOCLSA-N 1 1 355.847 2.872 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)c2ccnn2C)c([N+](=O)[O-])cc1OC(F)F ZINC000879684617 732750917 /nfs/dbraw/zinc/75/09/17/732750917.db2.gz LHKMZTMHALTLGR-SECBINFHSA-N 1 1 356.329 2.789 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]2COCC[C@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000782510384 738728806 /nfs/dbraw/zinc/72/88/06/738728806.db2.gz HTLDPQVDFXYEGH-BLLLJJGKSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886118836 733751777 /nfs/dbraw/zinc/75/17/77/733751777.db2.gz QMLUNAXISUUWEY-QWHCGFSZSA-N 1 1 350.419 2.725 20 5 FFBDMO CC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000886411504 733786198 /nfs/dbraw/zinc/78/61/98/733786198.db2.gz WPOBVUGTPIZPIN-AWEZNQCLSA-N 1 1 350.419 2.821 20 5 FFBDMO CC[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000886411504 733786202 /nfs/dbraw/zinc/78/62/02/733786202.db2.gz WPOBVUGTPIZPIN-AWEZNQCLSA-N 1 1 350.419 2.821 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886822464 733843723 /nfs/dbraw/zinc/84/37/23/733843723.db2.gz QRUJSEVMMKLXPF-BLLLJJGKSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(S(N)(=O)=O)c1 ZINC000782977901 738769676 /nfs/dbraw/zinc/76/96/76/738769676.db2.gz BJACEKFTYOOBPI-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO C[C@](O)(C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(F)(F)F ZINC000705012035 734359878 /nfs/dbraw/zinc/35/98/78/734359878.db2.gz CMUDRQIDCNQNIT-JTQLQIEISA-N 1 1 357.126 2.760 20 5 FFBDMO CCOC(=O)N(C)C1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000726972841 734457276 /nfs/dbraw/zinc/45/72/76/734457276.db2.gz ROBNLVJNKARNRH-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]C2CCN(C[C@H]3CCCO3)CC2)cc1Cl ZINC000783628807 738821233 /nfs/dbraw/zinc/82/12/33/738821233.db2.gz MFNFCUWWQRNSSE-OAHLLOKOSA-N 1 1 353.850 2.981 20 5 FFBDMO CC(C)[C@@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000892534961 734570341 /nfs/dbraw/zinc/57/03/41/734570341.db2.gz BNCOOJZJDCADAH-QGZVFWFLSA-N 1 1 354.882 2.610 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894048513 734793116 /nfs/dbraw/zinc/79/31/16/734793116.db2.gz ZGGTVGPRGYJEQO-CABCVRRESA-N 1 1 366.849 2.669 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000741242680 735126733 /nfs/dbraw/zinc/12/67/33/735126733.db2.gz RKYACTZMJFMAGQ-GFCCVEGCSA-N 1 1 353.394 2.689 20 5 FFBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1 ZINC000748820112 735674841 /nfs/dbraw/zinc/67/48/41/735674841.db2.gz DCEUUFGTOXOBSG-JTQLQIEISA-N 1 1 355.441 2.879 20 5 FFBDMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)sc2C1 ZINC000752837013 736017015 /nfs/dbraw/zinc/01/70/15/736017015.db2.gz LHUBXCCQIVCJHI-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO CC(C)[N@H+]1CCc2nc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)sc2C1 ZINC000752837013 736017018 /nfs/dbraw/zinc/01/70/18/736017018.db2.gz LHUBXCCQIVCJHI-UHFFFAOYSA-N 1 1 361.427 2.652 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000754968994 736219904 /nfs/dbraw/zinc/21/99/04/736219904.db2.gz UEAHEVSONSWNBQ-VIFPVBQESA-N 1 1 374.210 2.568 20 5 FFBDMO O=C(C[N@@H+]1CC[C@]2(C1)CCCOC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000792939827 739720440 /nfs/dbraw/zinc/72/04/40/739720440.db2.gz KLUBTWAAQNOOMC-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@]2(C1)CCCOC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000792939827 739720445 /nfs/dbraw/zinc/72/04/45/739720445.db2.gz KLUBTWAAQNOOMC-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000756967375 736378442 /nfs/dbraw/zinc/37/84/42/736378442.db2.gz WMLCUEHUXMKLDT-STQMWFEESA-N 1 1 352.822 2.674 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906969752 736566663 /nfs/dbraw/zinc/56/66/63/736566663.db2.gz BETJTCRYMZUSDD-BDJLRTHQSA-N 1 1 351.834 2.780 20 5 FFBDMO C[C@H](NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl)C1=CC[N@@H+](C)CC1 ZINC000907281270 736606112 /nfs/dbraw/zinc/60/61/12/736606112.db2.gz HNMUHILGMFTTNO-LBPRGKRZSA-N 1 1 351.834 2.947 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CCCO1 ZINC000763787464 736968451 /nfs/dbraw/zinc/96/84/51/736968451.db2.gz VYELAGXMJJRSFY-GFCCVEGCSA-N 1 1 370.837 2.871 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000766557967 737242065 /nfs/dbraw/zinc/24/20/65/737242065.db2.gz XEXIGWVVAVIASH-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)(C)OC(=O)NCC[N@H+](CCO)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000767931910 737383981 /nfs/dbraw/zinc/38/39/81/737383981.db2.gz VRNRIAAZGHWILU-UHFFFAOYSA-N 1 1 373.837 2.567 20 5 FFBDMO CC(C)(C)OC(=O)NCC[N@@H+](CCO)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000767931910 737383984 /nfs/dbraw/zinc/38/39/84/737383984.db2.gz VRNRIAAZGHWILU-UHFFFAOYSA-N 1 1 373.837 2.567 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769525296 737539173 /nfs/dbraw/zinc/53/91/73/737539173.db2.gz HFSHHIWGDGBQFN-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769525296 737539174 /nfs/dbraw/zinc/53/91/74/737539174.db2.gz HFSHHIWGDGBQFN-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO Cc1nn(C[N@H+]2CCSC3(CCOCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000769773771 737564925 /nfs/dbraw/zinc/56/49/25/737564925.db2.gz BKBAJVXQKSBHPR-UHFFFAOYSA-N 1 1 362.455 2.808 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395085 737722071 /nfs/dbraw/zinc/72/20/71/737722071.db2.gz KITDAZRAZFCVMZ-RKDXNWHRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000771395085 737722072 /nfs/dbraw/zinc/72/20/72/737722072.db2.gz KITDAZRAZFCVMZ-RKDXNWHRSA-N 1 1 374.210 2.661 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](CO)c1ccccc1 ZINC000772739893 737838415 /nfs/dbraw/zinc/83/84/15/737838415.db2.gz FHQXGHGPWIFPQZ-INIZCTEOSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](CO)c1ccccc1 ZINC000772739893 737838422 /nfs/dbraw/zinc/83/84/22/737838422.db2.gz FHQXGHGPWIFPQZ-INIZCTEOSA-N 1 1 363.801 2.852 20 5 FFBDMO CC[N@@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@H]1C(C)C ZINC000922394540 738136814 /nfs/dbraw/zinc/13/68/14/738136814.db2.gz XBJASLBKKKGERX-MUIFIZLQSA-N 1 1 353.488 2.616 20 5 FFBDMO CC[N@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@H]1C(C)C ZINC000922394540 738136816 /nfs/dbraw/zinc/13/68/16/738136816.db2.gz XBJASLBKKKGERX-MUIFIZLQSA-N 1 1 353.488 2.616 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000776592034 738212327 /nfs/dbraw/zinc/21/23/27/738212327.db2.gz XAHUXRVGRRHKJY-CYBMUJFWSA-N 1 1 358.320 2.513 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000776592034 738212328 /nfs/dbraw/zinc/21/23/28/738212328.db2.gz XAHUXRVGRRHKJY-CYBMUJFWSA-N 1 1 358.320 2.513 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cn1c[nH+]c2c1CCCC2 ZINC000777793629 738320247 /nfs/dbraw/zinc/32/02/47/738320247.db2.gz HWCINQFLHCYEFG-UHFFFAOYSA-N 1 1 362.817 2.982 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000785547485 738976136 /nfs/dbraw/zinc/97/61/36/738976136.db2.gz YVVDULVJDZARHN-HSMVNMDESA-N 1 1 353.394 2.544 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000930318030 739086378 /nfs/dbraw/zinc/08/63/78/739086378.db2.gz ZPSUHYLPKYMRNA-DZGCQCFKSA-N 1 1 364.471 2.913 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000787336093 739128827 /nfs/dbraw/zinc/12/88/27/739128827.db2.gz YFIUKMSOQOBIRB-LBPRGKRZSA-N 1 1 359.220 2.595 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000787336093 739128829 /nfs/dbraw/zinc/12/88/29/739128829.db2.gz YFIUKMSOQOBIRB-LBPRGKRZSA-N 1 1 359.220 2.595 20 5 FFBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932166966 739397302 /nfs/dbraw/zinc/39/73/02/739397302.db2.gz GKKRTJNQOVZRDE-CABCVRRESA-N 1 1 352.431 2.614 20 5 FFBDMO COCC[N@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@@H]1CC[C@H](C)C1 ZINC000790475955 739459771 /nfs/dbraw/zinc/45/97/71/739459771.db2.gz CLGOLXZNKPNJBP-WDEREUQCSA-N 1 1 361.240 2.648 20 5 FFBDMO COCC[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)[C@@H]1CC[C@H](C)C1 ZINC000790475955 739459774 /nfs/dbraw/zinc/45/97/74/739459774.db2.gz CLGOLXZNKPNJBP-WDEREUQCSA-N 1 1 361.240 2.648 20 5 FFBDMO O=C(C[N@@H+]1CCCCC[C@H]1CCO)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000792926873 739719499 /nfs/dbraw/zinc/71/94/99/739719499.db2.gz OIEPSTJTDVZZHS-ZDUSSCGKSA-N 1 1 355.822 2.814 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@]2(C1)CCCOC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000792939828 739720790 /nfs/dbraw/zinc/72/07/90/739720790.db2.gz KLUBTWAAQNOOMC-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000792939828 739720793 /nfs/dbraw/zinc/72/07/93/739720793.db2.gz KLUBTWAAQNOOMC-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333013 739766995 /nfs/dbraw/zinc/76/69/95/739766995.db2.gz NJYQLGWHKORVNQ-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333013 739767000 /nfs/dbraw/zinc/76/70/00/739767000.db2.gz NJYQLGWHKORVNQ-STQMWFEESA-N 1 1 360.439 2.943 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000802140871 740677603 /nfs/dbraw/zinc/67/76/03/740677603.db2.gz MOCWKRXMIYATQV-UKRRQHHQSA-N 1 1 368.455 2.728 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)OCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000803510656 740806773 /nfs/dbraw/zinc/80/67/73/740806773.db2.gz MEUBOZFAQVULGB-UHFFFAOYSA-N 1 1 356.806 2.794 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000809916621 741360625 /nfs/dbraw/zinc/36/06/25/741360625.db2.gz QDYCJERAROBCNH-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985431967 741395283 /nfs/dbraw/zinc/39/52/83/741395283.db2.gz VALXXHPVEUIDRQ-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985431967 741395290 /nfs/dbraw/zinc/39/52/90/741395290.db2.gz VALXXHPVEUIDRQ-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1Cl)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985431967 741395295 /nfs/dbraw/zinc/39/52/95/741395295.db2.gz VALXXHPVEUIDRQ-GDBMZVCRSA-N 1 1 369.824 2.567 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000814910273 741874337 /nfs/dbraw/zinc/87/43/37/741874337.db2.gz YHVUABDNZXQRMW-KRWDZBQOSA-N 1 1 367.833 2.957 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC000822568948 742753440 /nfs/dbraw/zinc/75/34/40/742753440.db2.gz KPVZKCRJEUULDX-SECBINFHSA-N 1 1 358.801 2.526 20 5 FFBDMO CC(C)(CCC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[N+](=O)[O-] ZINC000822883320 742796756 /nfs/dbraw/zinc/79/67/56/742796756.db2.gz AAHKYJDWMQRKKU-AWEZNQCLSA-N 1 1 353.488 2.912 20 5 FFBDMO C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000824926499 743179151 /nfs/dbraw/zinc/17/91/51/743179151.db2.gz PRLHUKFIPKKMIY-PHIMTYICSA-N 1 1 362.257 2.789 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1C ZINC000826633831 743411604 /nfs/dbraw/zinc/41/16/04/743411604.db2.gz VAELLQIFJMDPIS-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@H+](C2CC2)C[C@H](C)C1 ZINC000828264101 745049282 /nfs/dbraw/zinc/04/92/82/745049282.db2.gz XELPIPHPDORNLP-NSHDSACASA-N 1 1 367.833 2.955 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C[C@@H]2C1 ZINC000832226817 745659785 /nfs/dbraw/zinc/65/97/85/745659785.db2.gz YWHCFWHFASFDPO-MNOVXSKESA-N 1 1 357.332 2.637 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2CCC[C@H]2CO)cc1Cl ZINC000836780081 746304427 /nfs/dbraw/zinc/30/44/27/746304427.db2.gz VQJYXHBNUYFTLL-ZDUSSCGKSA-N 1 1 369.849 2.523 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000839105066 746775893 /nfs/dbraw/zinc/77/58/93/746775893.db2.gz OEICIYCKWSHDSF-QAPCUYQASA-N 1 1 350.415 2.682 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000839440000 746828599 /nfs/dbraw/zinc/82/85/99/746828599.db2.gz YOPCEIDJJDJVRY-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000839440613 746828751 /nfs/dbraw/zinc/82/87/51/746828751.db2.gz XCDLASWANXPZGV-LBPRGKRZSA-N 1 1 370.247 2.912 20 5 FFBDMO CSC[C@@H]1CCC[N@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078462 746993615 /nfs/dbraw/zinc/99/36/15/746993615.db2.gz UYJQAILBSDJWDJ-DYVFJYSZSA-N 1 1 365.455 2.565 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078462 746993618 /nfs/dbraw/zinc/99/36/18/746993618.db2.gz UYJQAILBSDJWDJ-DYVFJYSZSA-N 1 1 365.455 2.565 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000842836754 747703102 /nfs/dbraw/zinc/70/31/02/747703102.db2.gz RFHPYRJWBCHQQN-GFCCVEGCSA-N 1 1 350.371 2.601 20 5 FFBDMO O=C(c1cc(Cl)cc(Cl)c1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1 ZINC000847946661 748815261 /nfs/dbraw/zinc/81/52/61/748815261.db2.gz KGNGGXCSCPFXEF-UHFFFAOYSA-N 1 1 370.196 2.587 20 5 FFBDMO C[N@@H+](CCCCNC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000848590602 748968629 /nfs/dbraw/zinc/96/86/29/748968629.db2.gz FSNKXFOHGBRGHU-UHFFFAOYSA-N 1 1 357.357 2.557 20 5 FFBDMO COc1cc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000848755107 749001109 /nfs/dbraw/zinc/00/11/09/749001109.db2.gz XRXDFSLGGHVIRS-UPJWGTAASA-N 1 1 353.419 2.522 20 5 FFBDMO COc1cc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000848755107 749001113 /nfs/dbraw/zinc/00/11/13/749001113.db2.gz XRXDFSLGGHVIRS-UPJWGTAASA-N 1 1 353.419 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1Cl ZINC000848929859 749037537 /nfs/dbraw/zinc/03/75/37/749037537.db2.gz KKHKDVACUMRDQK-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)cc1Cl ZINC000848929859 749037540 /nfs/dbraw/zinc/03/75/40/749037540.db2.gz KKHKDVACUMRDQK-OAHLLOKOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCn1cnc(Br)n1)C1CC1 ZINC000851859796 749706546 /nfs/dbraw/zinc/70/65/46/749706546.db2.gz BCOCWMKLWTVEFW-UHFFFAOYSA-N 1 1 366.219 2.613 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCn1cnc(Br)n1)C1CC1 ZINC000851859796 749706554 /nfs/dbraw/zinc/70/65/54/749706554.db2.gz BCOCWMKLWTVEFW-UHFFFAOYSA-N 1 1 366.219 2.613 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000852167702 749791699 /nfs/dbraw/zinc/79/16/99/749791699.db2.gz YVKVIQSHWSUYAJ-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1C ZINC000852204662 749802569 /nfs/dbraw/zinc/80/25/69/749802569.db2.gz UVHCWENKUNGRBX-IXKJSCDLSA-N 1 1 350.415 2.680 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1CCO ZINC000852463429 749867360 /nfs/dbraw/zinc/86/73/60/749867360.db2.gz VXGXOPGPQGRJQD-MLGOLLRUSA-N 1 1 353.394 2.545 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000896755316 971692901 /nfs/dbraw/zinc/69/29/01/971692901.db2.gz KGMPQEZFBMSPON-ZDUSSCGKSA-N 1 1 356.426 2.744 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872281720 1013200760 /nfs/dbraw/zinc/20/07/60/1013200760.db2.gz YLIOHUBPBWPKIM-NVXWUHKLSA-N 1 1 364.442 2.758 20 5 FFBDMO O=C(NC1(C[NH2+]CCc2ccccc2Cl)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269545452 964195616 /nfs/dbraw/zinc/19/56/16/964195616.db2.gz QEWOOIRDTFGKAJ-GDBMZVCRSA-N 1 1 365.861 2.566 20 5 FFBDMO Cc1c(OC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000728469811 966187526 /nfs/dbraw/zinc/18/75/26/966187526.db2.gz WUCAEAVDPNUHSK-IBGZPJMESA-N 1 1 369.421 2.797 20 5 FFBDMO Cn1c(=O)c([N+](=O)[O-])c(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c2ccccc21 ZINC000892301005 966961137 /nfs/dbraw/zinc/96/11/37/966961137.db2.gz VVHLTZRNPQOPGR-GFCCVEGCSA-N 1 1 353.382 2.554 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050901705 968104360 /nfs/dbraw/zinc/10/43/60/968104360.db2.gz HIGFVDBABMHHRG-AWEZNQCLSA-N 1 1 359.430 2.530 20 5 FFBDMO COc1ccc([C@@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001176926302 1013798677 /nfs/dbraw/zinc/79/86/77/1013798677.db2.gz HVAICMRTWPOQOF-CYBMUJFWSA-N 1 1 373.409 2.926 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@@H+](C)CCN1C ZINC000895246131 968758705 /nfs/dbraw/zinc/75/87/05/968758705.db2.gz LRGZWYRJFHRBQU-SUMWQHHRSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CN(C)CC[N@@H+]1C ZINC000895246131 968758709 /nfs/dbraw/zinc/75/87/09/968758709.db2.gz LRGZWYRJFHRBQU-SUMWQHHRSA-N 1 1 373.432 2.842 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1CN(C)CC[N@H+]1C ZINC000895246131 968758712 /nfs/dbraw/zinc/75/87/12/968758712.db2.gz LRGZWYRJFHRBQU-SUMWQHHRSA-N 1 1 373.432 2.842 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cn3ccc(-c4ccccc4)n3)CC2)n1 ZINC000782870255 969784542 /nfs/dbraw/zinc/78/45/42/969784542.db2.gz KUAQRUDDHOFSLU-UHFFFAOYSA-N 1 1 352.398 2.949 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000874828469 1013910197 /nfs/dbraw/zinc/91/01/97/1013910197.db2.gz GZEHSYMZCCZGIV-IRXDYDNUSA-N 1 1 366.421 2.966 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2C1 ZINC000895575426 970749657 /nfs/dbraw/zinc/74/96/57/970749657.db2.gz DRPRISPABMMYAB-GASCZTMLSA-N 1 1 372.450 2.628 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]2C1 ZINC000895575426 970749666 /nfs/dbraw/zinc/74/96/66/970749666.db2.gz DRPRISPABMMYAB-GASCZTMLSA-N 1 1 372.450 2.628 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897067208 973217475 /nfs/dbraw/zinc/21/74/75/973217475.db2.gz HBESABIITNPIJM-XHSDSOJGSA-N 1 1 360.458 2.967 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCc2ccccc2C1 ZINC000030363431 975590491 /nfs/dbraw/zinc/59/04/91/975590491.db2.gz DQXHIADELVGICA-JXMROGBWSA-N 1 1 351.406 2.783 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)n1 ZINC000728899799 976998925 /nfs/dbraw/zinc/99/89/25/976998925.db2.gz QZSLOZWCPCFRQQ-HNNXBMFYSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)n1 ZINC000728899799 976998934 /nfs/dbraw/zinc/99/89/34/976998934.db2.gz QZSLOZWCPCFRQQ-HNNXBMFYSA-N 1 1 368.397 2.987 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](C/C=C\c1ccccc1)C2 ZINC000982278560 977375939 /nfs/dbraw/zinc/37/59/39/977375939.db2.gz IRQSYYKCDFDNKU-FDTADBGJSA-N 1 1 369.465 2.535 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](C/C=C\c1ccccc1)C2 ZINC000982278560 977375941 /nfs/dbraw/zinc/37/59/41/977375941.db2.gz IRQSYYKCDFDNKU-FDTADBGJSA-N 1 1 369.465 2.535 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](C/C=C\c1ccccc1)C2 ZINC000982278560 977375946 /nfs/dbraw/zinc/37/59/46/977375946.db2.gz IRQSYYKCDFDNKU-FDTADBGJSA-N 1 1 369.465 2.535 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCC[C@@H]([NH+]2CCOCC2)C1 ZINC000894022823 977637866 /nfs/dbraw/zinc/63/78/66/977637866.db2.gz FPRKHDVSOQYMMY-CQSZACIVSA-N 1 1 360.389 2.583 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(C2(O)CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000897529012 981555063 /nfs/dbraw/zinc/55/50/63/981555063.db2.gz SFVRIFMURFSTKW-INIZCTEOSA-N 1 1 356.426 2.703 20 5 FFBDMO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000760464030 982419707 /nfs/dbraw/zinc/41/97/07/982419707.db2.gz WULIXASJFBYJQZ-SCLBCKFNSA-N 1 1 353.382 2.560 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NCCC[N@H+]1CCc2ccccc2C1 ZINC000129962877 985146816 /nfs/dbraw/zinc/14/68/16/985146816.db2.gz OOJXNSBMAUTCDZ-UHFFFAOYSA-N 1 1 371.412 2.841 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878652012 1015151271 /nfs/dbraw/zinc/15/12/71/1015151271.db2.gz KNEKXNJQRDWQAO-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO CC(C)(C)c1ccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001002790729 987474665 /nfs/dbraw/zinc/47/46/65/987474665.db2.gz FQGFHRRWOZVILK-QZTJIDSGSA-N 1 1 359.470 2.730 20 5 FFBDMO C[N@@H+]1CCc2c(NCc3ccc(OC4COC4)cc3)ccc([N+](=O)[O-])c2C1 ZINC001168467961 987680661 /nfs/dbraw/zinc/68/06/61/987680661.db2.gz SUADQWCFGUQUJF-UHFFFAOYSA-N 1 1 369.421 2.972 20 5 FFBDMO C[N@H+]1CCc2c(NCc3ccc(OC4COC4)cc3)ccc([N+](=O)[O-])c2C1 ZINC001168467961 987680667 /nfs/dbraw/zinc/68/06/67/987680667.db2.gz SUADQWCFGUQUJF-UHFFFAOYSA-N 1 1 369.421 2.972 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000879237712 1015429021 /nfs/dbraw/zinc/42/90/21/1015429021.db2.gz OEANZSDOKDIJDH-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2cccc(C(F)F)c2)CC1 ZINC001005381374 989740363 /nfs/dbraw/zinc/74/03/63/989740363.db2.gz JTINZNCGDTVWEN-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@H]2CCC[N@@H+](C)C2)CC1 ZINC000918395817 990383945 /nfs/dbraw/zinc/38/39/45/990383945.db2.gz VDQBMDXCXLNHCO-HNNXBMFYSA-N 1 1 360.458 2.655 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000154871711 990550192 /nfs/dbraw/zinc/55/01/92/990550192.db2.gz FFNHPDJTXJWYQP-AWEZNQCLSA-N 1 1 360.414 2.957 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000194881051 990621383 /nfs/dbraw/zinc/62/13/83/990621383.db2.gz DQQMDZWZZPSJDO-PBHICJAKSA-N 1 1 369.421 2.854 20 5 FFBDMO CN1CC[NH+](Cc2cccc(-c3noc(-c4ccc([N+](=O)[O-])o4)n3)c2)CC1 ZINC001212569881 990710317 /nfs/dbraw/zinc/71/03/17/990710317.db2.gz BLQBKCXXLDTWBD-UHFFFAOYSA-N 1 1 369.381 2.652 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000068084996 991331195 /nfs/dbraw/zinc/33/11/95/991331195.db2.gz KLVUSSPKYIKZOX-CYBMUJFWSA-N 1 1 364.402 2.887 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690368 1015641804 /nfs/dbraw/zinc/64/18/04/1015641804.db2.gz QRJXAAAPOKJTMI-INIZCTEOSA-N 1 1 354.410 2.853 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001484394822 991560456 /nfs/dbraw/zinc/56/04/56/991560456.db2.gz RMBSNHXPIBIREW-PJSGCXFTSA-N 1 1 371.481 2.877 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000880025185 1015734949 /nfs/dbraw/zinc/73/49/49/1015734949.db2.gz ZMZVZTLMJZCNCT-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000880061055 1015745571 /nfs/dbraw/zinc/74/55/71/1015745571.db2.gz QIQVHBZQVTVYHB-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2COC(=O)NC2CC2)ccc1[N+](=O)[O-] ZINC000810036452 994683828 /nfs/dbraw/zinc/68/38/28/994683828.db2.gz GKRPRXDQGCRFAW-HNNXBMFYSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2COC(=O)NC2CC2)ccc1[N+](=O)[O-] ZINC000810036452 994683832 /nfs/dbraw/zinc/68/38/32/994683832.db2.gz GKRPRXDQGCRFAW-HNNXBMFYSA-N 1 1 363.414 2.847 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494642 995559929 /nfs/dbraw/zinc/55/99/29/995559929.db2.gz PWAIMDDZUSYVDE-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494642 995559936 /nfs/dbraw/zinc/55/99/36/995559936.db2.gz PWAIMDDZUSYVDE-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC(C)(C)C ZINC000812892306 995572658 /nfs/dbraw/zinc/57/26/58/995572658.db2.gz FMGUQFREANZDPC-UHFFFAOYSA-N 1 1 362.474 2.611 20 5 FFBDMO CCn1nc(C)c(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C ZINC000813173804 995633678 /nfs/dbraw/zinc/63/36/78/995633678.db2.gz KKBPIQMYCMUNFI-KRWDZBQOSA-N 1 1 372.425 2.859 20 5 FFBDMO CCn1nc(C)c(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C ZINC000813173804 995633680 /nfs/dbraw/zinc/63/36/80/995633680.db2.gz KKBPIQMYCMUNFI-KRWDZBQOSA-N 1 1 372.425 2.859 20 5 FFBDMO Cc1cccc(C[N@H+]2Cc3ccc(CNC(=O)[C@@H]4C[C@H]4[N+](=O)[O-])cc3C2)c1 ZINC001054264719 1015995769 /nfs/dbraw/zinc/99/57/69/1015995769.db2.gz QMXOOCIFICICQG-WOJBJXKFSA-N 1 1 365.433 2.792 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@H]3C[C@H](C)C[N@@H+]3C2)c([N+](=O)[O-])c1 ZINC001136872055 996950902 /nfs/dbraw/zinc/95/09/02/996950902.db2.gz BTOGJOAXKCVTBE-BBWFWOEESA-N 1 1 374.485 2.942 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000825183635 997243439 /nfs/dbraw/zinc/24/34/39/997243439.db2.gz OTRBFZXRTHKGGQ-IBGZPJMESA-N 1 1 371.437 2.785 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C ZINC000844018605 997610455 /nfs/dbraw/zinc/61/04/55/997610455.db2.gz PKPHBVVZLDYULZ-BETUJISGSA-N 1 1 361.398 2.522 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C ZINC000844018605 997610464 /nfs/dbraw/zinc/61/04/64/997610464.db2.gz PKPHBVVZLDYULZ-BETUJISGSA-N 1 1 361.398 2.522 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000845735771 998643205 /nfs/dbraw/zinc/64/32/05/998643205.db2.gz OPAKTNOENKTFKX-OAHLLOKOSA-N 1 1 358.398 2.810 20 5 FFBDMO CC(C)[C@@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1CCCC1 ZINC000741013536 999700335 /nfs/dbraw/zinc/70/03/35/999700335.db2.gz KQNWWTDDIYELSM-INIZCTEOSA-N 1 1 374.397 2.808 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741023027 999704073 /nfs/dbraw/zinc/70/40/73/999704073.db2.gz YBNYSOLAQGSEPO-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741023027 999704075 /nfs/dbraw/zinc/70/40/75/999704075.db2.gz YBNYSOLAQGSEPO-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCCCC1 ZINC000741027709 999704729 /nfs/dbraw/zinc/70/47/29/999704729.db2.gz BQJOIUXBTPEIDF-CYBMUJFWSA-N 1 1 374.397 2.953 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CCCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086083091 999754749 /nfs/dbraw/zinc/75/47/49/999754749.db2.gz NTKJEZCWKNCZDO-XWPNQZOQSA-N 1 1 371.481 2.994 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000744798034 999876158 /nfs/dbraw/zinc/87/61/58/999876158.db2.gz FIOHOQHGTRZRPD-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO O=[N+]([O-])c1ccnc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)c1 ZINC001212580675 999986387 /nfs/dbraw/zinc/98/63/87/999986387.db2.gz VBVINGOSRRQYJV-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169011329 1000015390 /nfs/dbraw/zinc/01/53/90/1000015390.db2.gz JWLVDVSZWXCLND-QKPAOTATSA-N 1 1 353.463 2.763 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169035776 1000016774 /nfs/dbraw/zinc/01/67/74/1000016774.db2.gz LUDXHXDUPPEMQQ-LVQVYYBASA-N 1 1 353.463 2.621 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@H](OCC3CC3)[C@@H]2Cc2cccnc2)C1 ZINC001169019036 1000017504 /nfs/dbraw/zinc/01/75/04/1000017504.db2.gz GKQHJOXLLLWKBB-MUGJNUQGSA-N 1 1 359.470 2.939 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCO[C@]3(CCCN(c4ccccc4)C3)C2)C1 ZINC001169023979 1000017971 /nfs/dbraw/zinc/01/79/71/1000017971.db2.gz WHIDRJRIFODCBI-HOJAQTOUSA-N 1 1 359.470 2.803 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCn3cnc(COCc4ccco4)c3C2)C1 ZINC001169026240 1000018203 /nfs/dbraw/zinc/01/82/03/1000018203.db2.gz WJYYQCINDARRHS-HZPDHXFCSA-N 1 1 374.441 2.844 20 5 FFBDMO O=C1Nc2ccccc2CN1[C@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169051364 1000018786 /nfs/dbraw/zinc/01/87/86/1000018786.db2.gz DNPVAYOLAKCQJJ-OIISXLGYSA-N 1 1 358.442 2.944 20 5 FFBDMO O=C(c1ccc(Cl)cc1)N1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169049643 1000018827 /nfs/dbraw/zinc/01/88/27/1000018827.db2.gz XENIIFWDLLEVAN-RHSMWYFYSA-N 1 1 365.861 2.933 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]([N@@H+](C2CC2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169048693 1000018839 /nfs/dbraw/zinc/01/88/39/1000018839.db2.gz APTKGIJMMDTWNL-FVQBIDKESA-N 1 1 353.463 2.906 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846105956 1000209185 /nfs/dbraw/zinc/20/91/85/1000209185.db2.gz ZHAHFEHIURQWNN-MRXNPFEDSA-N 1 1 370.352 2.768 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)C[C@@H]2CNC(=O)OC(C)(C)C)c1 ZINC000746704030 1001705352 /nfs/dbraw/zinc/70/53/52/1001705352.db2.gz WIHDOCANJMWEHG-AWEZNQCLSA-N 1 1 364.446 2.548 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(N2CC[N@H+](C)C[C@@H]2CNC(=O)OC(C)(C)C)c1 ZINC000746704030 1001705354 /nfs/dbraw/zinc/70/53/54/1001705354.db2.gz WIHDOCANJMWEHG-AWEZNQCLSA-N 1 1 364.446 2.548 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788476380 1001811416 /nfs/dbraw/zinc/81/14/16/1001811416.db2.gz NHRDMWODPPLPSF-IYBDPMFKSA-N 1 1 364.465 2.724 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000790125417 1002294072 /nfs/dbraw/zinc/29/40/72/1002294072.db2.gz SIBCRMWESZQBNG-SQFISAMPSA-N 1 1 361.442 2.567 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000790125417 1002294078 /nfs/dbraw/zinc/29/40/78/1002294078.db2.gz SIBCRMWESZQBNG-SQFISAMPSA-N 1 1 361.442 2.567 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](Oc3ncc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC001170355633 1003123224 /nfs/dbraw/zinc/12/32/24/1003123224.db2.gz NGOOEWSNYDSDCH-PBHICJAKSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC001170344399 1003131693 /nfs/dbraw/zinc/13/16/93/1003131693.db2.gz BSEBDHPKITZXRI-MRXNPFEDSA-N 1 1 370.453 2.747 20 5 FFBDMO COC(=O)[C@H]1CC[C@@H](C)[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170348021 1003133937 /nfs/dbraw/zinc/13/39/37/1003133937.db2.gz UUYHXSMASAVHFH-NFAWXSAZSA-N 1 1 350.415 2.808 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000775054943 1003474193 /nfs/dbraw/zinc/47/41/93/1003474193.db2.gz CHDCKJXVKYBSAL-CYBMUJFWSA-N 1 1 365.386 2.914 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000775054943 1003474196 /nfs/dbraw/zinc/47/41/96/1003474196.db2.gz CHDCKJXVKYBSAL-CYBMUJFWSA-N 1 1 365.386 2.914 20 5 FFBDMO C[C@]1(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000804684298 1003782860 /nfs/dbraw/zinc/78/28/60/1003782860.db2.gz YCOHYMLYUNNKTR-HXUWFJFHSA-N 1 1 370.453 2.993 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001196773856 1003966246 /nfs/dbraw/zinc/96/62/46/1003966246.db2.gz UVECIKVIHAXGBK-KGLIPLIRSA-N 1 1 365.430 2.961 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2CSC[C@@]2(C)C1 ZINC001198468492 1004627798 /nfs/dbraw/zinc/62/77/98/1004627798.db2.gz XLAJVHVAFHYGIE-YVEFUNNKSA-N 1 1 365.455 2.617 20 5 FFBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(OC)c1 ZINC001198694008 1004699197 /nfs/dbraw/zinc/69/91/97/1004699197.db2.gz ABMKCOKNRGENFS-LLVKDONJSA-N 1 1 359.382 2.562 20 5 FFBDMO CN(C)c1cc[nH+]cc1C(=O)n1c2ccccc2cc2c(=O)c(N)ccc1-2 ZINC001199352672 1004908345 /nfs/dbraw/zinc/90/83/45/1004908345.db2.gz DHPZTLTUIBXOLU-UHFFFAOYSA-N 1 1 358.401 2.838 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000776574158 1005952858 /nfs/dbraw/zinc/95/28/58/1005952858.db2.gz DPWFYMLVCMFYSK-DLBZAZTESA-N 1 1 358.394 2.790 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581021 1005960910 /nfs/dbraw/zinc/96/09/10/1005960910.db2.gz CGLKQSRSKTXPPD-GOSISDBHSA-N 1 1 358.394 2.694 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498942 1006415396 /nfs/dbraw/zinc/41/53/96/1006415396.db2.gz SKLCGHZBNOFWCB-CVEARBPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853498942 1006415399 /nfs/dbraw/zinc/41/53/99/1006415399.db2.gz SKLCGHZBNOFWCB-CVEARBPZSA-N 1 1 359.430 2.946 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC(C3CCOCC3)CC2)nc1-c1ccccn1 ZINC000853504851 1006419428 /nfs/dbraw/zinc/41/94/28/1006419428.db2.gz WUNMAJSFAHHXSX-UHFFFAOYSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)nc1-c1ccccn1 ZINC000853513649 1006421096 /nfs/dbraw/zinc/42/10/96/1006421096.db2.gz GTWGWUAAJFPBEN-HNNXBMFYSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCOC[C@@H](C3CCC3)C2)nc1-c1ccccn1 ZINC000853513649 1006421102 /nfs/dbraw/zinc/42/11/02/1006421102.db2.gz GTWGWUAAJFPBEN-HNNXBMFYSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](c3ccccn3)C2)nc1-c1ccccn1 ZINC000853510845 1006421278 /nfs/dbraw/zinc/42/12/78/1006421278.db2.gz MGGMXWKTSQQNHK-CQSZACIVSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](c3ccccn3)C2)nc1-c1ccccn1 ZINC000853510845 1006421286 /nfs/dbraw/zinc/42/12/86/1006421286.db2.gz MGGMXWKTSQQNHK-CQSZACIVSA-N 1 1 350.382 2.695 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000853602182 1006470184 /nfs/dbraw/zinc/47/01/84/1006470184.db2.gz JVIBRBFLOYBQCJ-OAHLLOKOSA-N 1 1 371.441 2.652 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1Cc1cn2cc(Cl)ccc2[nH+]1 ZINC001189276694 1007007935 /nfs/dbraw/zinc/00/79/35/1007007935.db2.gz NUFDDGYXBWFIFX-UHFFFAOYSA-N 1 1 371.740 2.761 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)CCn1cc([N+](=O)[O-])cn1 ZINC000816452134 1007060439 /nfs/dbraw/zinc/06/04/39/1007060439.db2.gz WQYQFXVNXJIXTJ-MAUKXSAKSA-N 1 1 372.425 2.635 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000856283227 1007747906 /nfs/dbraw/zinc/74/79/06/1007747906.db2.gz RMEUGQCQGFZCDE-UHFFFAOYSA-N 1 1 366.418 2.970 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3nc(C)ccc3[N+](=O)[O-])C2)ccn1 ZINC000856534345 1007873911 /nfs/dbraw/zinc/87/39/11/1007873911.db2.gz ZNMOOHBTIZSIME-QGZVFWFLSA-N 1 1 371.441 2.803 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ccc([N+](=O)[O-])nc3)C2)ccn1 ZINC000856535097 1007874875 /nfs/dbraw/zinc/87/48/75/1007874875.db2.gz NNVOACDOPSZRDQ-SFHVURJKSA-N 1 1 371.441 2.883 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000819016291 1008024801 /nfs/dbraw/zinc/02/48/01/1008024801.db2.gz WUNFZMFPRUVYMT-NQIIRXRSSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000819016291 1008024807 /nfs/dbraw/zinc/02/48/07/1008024807.db2.gz WUNFZMFPRUVYMT-NQIIRXRSSA-N 1 1 369.465 2.782 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000858779849 1008422075 /nfs/dbraw/zinc/42/20/75/1008422075.db2.gz DNBRCAZBVJJPON-HNNXBMFYSA-N 1 1 360.414 2.980 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc2ncccc2c1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458426 1008994605 /nfs/dbraw/zinc/99/46/05/1008994605.db2.gz HARMKOFSSUHSFU-IEBWSBKVSA-N 1 1 370.453 2.666 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458340 1008995800 /nfs/dbraw/zinc/99/58/00/1008995800.db2.gz BKRWXWUIFFHTKK-GDBMZVCRSA-N 1 1 371.840 2.911 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126446098 1009229340 /nfs/dbraw/zinc/22/93/40/1009229340.db2.gz LKTWDQGBDIXHFH-APWZRJJASA-N 1 1 372.469 2.796 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000824003108 1009290103 /nfs/dbraw/zinc/29/01/03/1009290103.db2.gz PHLBJWZOMHAOIY-ZDUSSCGKSA-N 1 1 369.425 2.745 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000130430370 1009336628 /nfs/dbraw/zinc/33/66/28/1009336628.db2.gz ZEHFIHOKXNILKT-CQSZACIVSA-N 1 1 356.426 2.993 20 5 FFBDMO CCC1(CC)[C@H]([N@H+](C)Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C[C@@H]1OC ZINC000794635159 1010448373 /nfs/dbraw/zinc/44/83/73/1010448373.db2.gz UGBPWXYHRLXNRY-CABCVRRESA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H]([N@@H+](C)Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C[C@@H]1OC ZINC000794635159 1010448382 /nfs/dbraw/zinc/44/83/82/1010448382.db2.gz UGBPWXYHRLXNRY-CABCVRRESA-N 1 1 363.414 2.986 20 5 FFBDMO COCC1(C)CC[NH+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)CC1 ZINC000773257573 1010911819 /nfs/dbraw/zinc/91/18/19/1010911819.db2.gz ZAIWPQSIMXPEJZ-UHFFFAOYSA-N 1 1 362.430 2.543 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866260621 1010964707 /nfs/dbraw/zinc/96/47/07/1010964707.db2.gz WCSFAAGORKIDIJ-JKSUJKDBSA-N 1 1 366.481 2.528 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000773260684 1010966406 /nfs/dbraw/zinc/96/64/06/1010966406.db2.gz ZTMUSLCBBPXPJD-KGLIPLIRSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000773260684 1010966412 /nfs/dbraw/zinc/96/64/12/1010966412.db2.gz ZTMUSLCBBPXPJD-KGLIPLIRSA-N 1 1 361.398 2.599 20 5 FFBDMO C[C@H]1COc2ccccc2CN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867978996 1011137650 /nfs/dbraw/zinc/13/76/50/1011137650.db2.gz CHIZMZUTBCZBRF-DJJJIMSYSA-N 1 1 355.394 2.578 20 5 FFBDMO C[C@H](C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000870087702 1012117461 /nfs/dbraw/zinc/11/74/61/1012117461.db2.gz UALLBCNGCRRYKR-SGTLLEGYSA-N 1 1 373.384 2.716 20 5 FFBDMO CN1CCC[C@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173011691 1012181559 /nfs/dbraw/zinc/18/15/59/1012181559.db2.gz JNEJZLQUFMAQKP-ZDUSSCGKSA-N 1 1 368.428 2.916 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H]1O ZINC001173010654 1012182473 /nfs/dbraw/zinc/18/24/73/1012182473.db2.gz WWZHFOABPMFHFF-BDJLRTHQSA-N 1 1 355.385 2.545 20 5 FFBDMO CO[C@@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014579 1012187061 /nfs/dbraw/zinc/18/70/61/1012187061.db2.gz SRMJRQDDWYOSQK-CQSZACIVSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@](O)(CF)C2)c1F ZINC001173180365 1012325139 /nfs/dbraw/zinc/32/51/39/1012325139.db2.gz KDXKJIGCXIUXKB-SJCJKPOMSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)c1F ZINC001173183577 1012325809 /nfs/dbraw/zinc/32/58/09/1012325809.db2.gz ZNYLEGPWNFOWLT-XPTSAGLGSA-N 1 1 366.311 2.673 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@](O)(C(F)(F)F)C2)c1F ZINC001173183577 1012325822 /nfs/dbraw/zinc/32/58/22/1012325822.db2.gz ZNYLEGPWNFOWLT-XPTSAGLGSA-N 1 1 366.311 2.673 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c1F ZINC001173184069 1012327048 /nfs/dbraw/zinc/32/70/48/1012327048.db2.gz CQNRFNKTAIDFOX-MJBXVCDLSA-N 1 1 351.422 2.557 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@](O)(C(F)(F)F)C2)c1F ZINC001173183575 1012327323 /nfs/dbraw/zinc/32/73/23/1012327323.db2.gz ZNYLEGPWNFOWLT-LKFCYVNXSA-N 1 1 366.311 2.673 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@](O)(C(F)(F)F)C2)c1F ZINC001173183575 1012327348 /nfs/dbraw/zinc/32/73/48/1012327348.db2.gz ZNYLEGPWNFOWLT-LKFCYVNXSA-N 1 1 366.311 2.673 20 5 FFBDMO CC[N@@H+](CCn1ccnc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192153 1012333753 /nfs/dbraw/zinc/33/37/53/1012333753.db2.gz IXTZMXLWYSKHCJ-ZDUSSCGKSA-N 1 1 350.394 2.892 20 5 FFBDMO COCCN1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cccnc21 ZINC001173226343 1012362634 /nfs/dbraw/zinc/36/26/34/1012362634.db2.gz MAEDNHFKFQMDRO-INIZCTEOSA-N 1 1 370.453 2.889 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](Cc1ccsc1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291391 1017270203 /nfs/dbraw/zinc/27/02/03/1017270203.db2.gz QRHPOIHAOUSHIE-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](Cc1ccsc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291391 1017270210 /nfs/dbraw/zinc/27/02/10/1017270210.db2.gz QRHPOIHAOUSHIE-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](Cc1ccsc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291391 1017270223 /nfs/dbraw/zinc/27/02/23/1017270223.db2.gz QRHPOIHAOUSHIE-QZTJIDSGSA-N 1 1 371.462 2.588 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@H]21 ZINC000827331028 1017640356 /nfs/dbraw/zinc/64/03/56/1017640356.db2.gz VDEQQFDTMWLZEJ-XJKSGUPXSA-N 1 1 372.450 2.885 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000927058353 1018340546 /nfs/dbraw/zinc/34/05/46/1018340546.db2.gz ZQOIQVNCKSVHAH-MXASKKJJSA-N 1 1 372.425 2.690 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)c1 ZINC000801578510 1019134201 /nfs/dbraw/zinc/13/42/01/1019134201.db2.gz HHCDOGBQYHRRNV-HXUWFJFHSA-N 1 1 356.422 3.000 20 5 FFBDMO CCOC(=O)/C=C\C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000930809327 1020197962 /nfs/dbraw/zinc/19/79/62/1020197962.db2.gz LZHWQVCGEMAKKR-IYINBOPBSA-N 1 1 362.426 2.820 20 5 FFBDMO CCOC(=O)/C=C\C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000930809327 1020197968 /nfs/dbraw/zinc/19/79/68/1020197968.db2.gz LZHWQVCGEMAKKR-IYINBOPBSA-N 1 1 362.426 2.820 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001048525428 1020275871 /nfs/dbraw/zinc/27/58/71/1020275871.db2.gz UNVFIKCCQGOTJD-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525428 1020275876 /nfs/dbraw/zinc/27/58/76/1020275876.db2.gz UNVFIKCCQGOTJD-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048525428 1020275886 /nfs/dbraw/zinc/27/58/86/1020275886.db2.gz UNVFIKCCQGOTJD-RHQZKXFESA-N 1 1 363.502 2.981 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1cc3ccccc3s1)C2 ZINC001072725135 1020294904 /nfs/dbraw/zinc/29/49/04/1020294904.db2.gz IJELANDWCVQJLR-HZPDHXFCSA-N 1 1 371.462 2.601 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1cc3ccccc3s1)C2 ZINC001072725135 1020294909 /nfs/dbraw/zinc/29/49/09/1020294909.db2.gz IJELANDWCVQJLR-HZPDHXFCSA-N 1 1 371.462 2.601 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1cc3ccccc3s1)C2 ZINC001072725135 1020294913 /nfs/dbraw/zinc/29/49/13/1020294913.db2.gz IJELANDWCVQJLR-HZPDHXFCSA-N 1 1 371.462 2.601 20 5 FFBDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777954791 1020327242 /nfs/dbraw/zinc/32/72/42/1020327242.db2.gz PYUFNPOGCFSWFA-MRXNPFEDSA-N 1 1 371.441 2.654 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000800566616 1020401837 /nfs/dbraw/zinc/40/18/37/1020401837.db2.gz ZXAYPOOZTFGHQK-KRWDZBQOSA-N 1 1 354.410 2.526 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000931308295 1020415485 /nfs/dbraw/zinc/41/54/85/1020415485.db2.gz SLXMNQOGOUOSOC-FASAQXTFSA-N 1 1 371.441 2.979 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2c[nH]c3ncccc23)C1 ZINC000931371093 1020442321 /nfs/dbraw/zinc/44/23/21/1020442321.db2.gz TVEXAVCJFAKOFO-CQSZACIVSA-N 1 1 367.409 2.512 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2c[nH]c3ncccc23)C1 ZINC000931371092 1020443252 /nfs/dbraw/zinc/44/32/52/1020443252.db2.gz TVEXAVCJFAKOFO-AWEZNQCLSA-N 1 1 367.409 2.512 20 5 FFBDMO Cc1ccccc1C[N@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726583203 1020489006 /nfs/dbraw/zinc/48/90/06/1020489006.db2.gz APIOHVMOWOFFHC-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726583203 1020489011 /nfs/dbraw/zinc/48/90/11/1020489011.db2.gz APIOHVMOWOFFHC-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO COc1ccccc1NC(=O)[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000932631423 1020854859 /nfs/dbraw/zinc/85/48/59/1020854859.db2.gz DJACROHTVDIJAV-HNNXBMFYSA-N 1 1 370.409 2.849 20 5 FFBDMO COc1ccccc1NC(=O)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000932631423 1020854863 /nfs/dbraw/zinc/85/48/63/1020854863.db2.gz DJACROHTVDIJAV-HNNXBMFYSA-N 1 1 370.409 2.849 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000749667119 1021018760 /nfs/dbraw/zinc/01/87/60/1021018760.db2.gz VIOHJILCKSGOCM-ROUUACIJSA-N 1 1 352.394 2.741 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000749810666 1021041940 /nfs/dbraw/zinc/04/19/40/1021041940.db2.gz MJHFEKUIQCZRGC-AWEZNQCLSA-N 1 1 365.430 2.915 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001116374422 1021183238 /nfs/dbraw/zinc/18/32/38/1021183238.db2.gz IGKNBNNCJNJSMR-MJGOQNOKSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(F)cc1 ZINC001116374422 1021183243 /nfs/dbraw/zinc/18/32/43/1021183243.db2.gz IGKNBNNCJNJSMR-MJGOQNOKSA-N 1 1 373.384 2.674 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001116507925 1021253716 /nfs/dbraw/zinc/25/37/16/1021253716.db2.gz VNJWGHWSWNBSAU-OAHLLOKOSA-N 1 1 366.849 2.670 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000750095461 1021337712 /nfs/dbraw/zinc/33/77/12/1021337712.db2.gz YUKCXNWHXKVDQT-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116861410 1021458832 /nfs/dbraw/zinc/45/88/32/1021458832.db2.gz MUDSJQGKUVOXRF-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116861410 1021458840 /nfs/dbraw/zinc/45/88/40/1021458840.db2.gz MUDSJQGKUVOXRF-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO CCOC(=O)c1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1 ZINC001118267571 1022149958 /nfs/dbraw/zinc/14/99/58/1022149958.db2.gz KHESXFLBKAHHGN-CQSZACIVSA-N 1 1 358.398 2.874 20 5 FFBDMO CCOC(=O)c1cc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)[nH]n1 ZINC001118267571 1022149963 /nfs/dbraw/zinc/14/99/63/1022149963.db2.gz KHESXFLBKAHHGN-CQSZACIVSA-N 1 1 358.398 2.874 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000778780122 1022361328 /nfs/dbraw/zinc/36/13/28/1022361328.db2.gz ZFFGASWTBKTJBZ-UHFFFAOYSA-N 1 1 362.342 2.954 20 5 FFBDMO O=C(N[C@H]1C[C@H]([NH2+]C2c3ccccc3-c3ccccc32)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020139089 1022564161 /nfs/dbraw/zinc/56/41/61/1022564161.db2.gz QCAXEQRSNYRDAM-YTFOQLDISA-N 1 1 363.417 2.658 20 5 FFBDMO Cc1ccc(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001039485568 1022760637 /nfs/dbraw/zinc/76/06/37/1022760637.db2.gz GEVSAFZQBMEKME-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1ccc(C[N@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001039485568 1022760655 /nfs/dbraw/zinc/76/06/55/1022760655.db2.gz GEVSAFZQBMEKME-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1ccc(C[N@@H+](CC2CC2)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001039485568 1022760671 /nfs/dbraw/zinc/76/06/71/1022760671.db2.gz GEVSAFZQBMEKME-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1cccc(C)c1C[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001040699740 1022954651 /nfs/dbraw/zinc/95/46/51/1022954651.db2.gz DXZCNQQYTCMGTP-IEBWSBKVSA-N 1 1 371.481 2.783 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@@H]2CCC[N@@H+](C)C2)n1C ZINC001121348313 1023721434 /nfs/dbraw/zinc/72/14/34/1023721434.db2.gz JHCFLASWHKJJGL-MRXNPFEDSA-N 1 1 372.473 2.948 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000757790934 1023859923 /nfs/dbraw/zinc/85/99/23/1023859923.db2.gz SVCVSRODCJIYGX-TVQRCGJNSA-N 1 1 370.356 2.800 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CC[NH+](CC2CC2)CC1 ZINC000079000162 1024058307 /nfs/dbraw/zinc/05/83/07/1024058307.db2.gz PZLODZLUDSFWMR-UHFFFAOYSA-N 1 1 372.469 2.753 20 5 FFBDMO CC(C)CN(CC1CC[NH+](C)CC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000829568765 1033226851 /nfs/dbraw/zinc/22/68/51/1033226851.db2.gz LNOHNUBCSSHRNB-UHFFFAOYSA-N 1 1 373.457 2.911 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000193810873 1024689368 /nfs/dbraw/zinc/68/93/68/1024689368.db2.gz ZIBCGBOGQLCKGQ-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO COC(=O)c1cc(C(=O)OCC[N@@H+](C)Cc2ccccc2)cc([N+](=O)[O-])c1 ZINC000837344899 1025736071 /nfs/dbraw/zinc/73/60/71/1025736071.db2.gz WQUNAZWGOMMWDB-UHFFFAOYSA-N 1 1 372.377 2.670 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)nc1-c1ccncc1 ZINC000840113702 1026962216 /nfs/dbraw/zinc/96/22/16/1026962216.db2.gz CBQUNPLTBXKMRI-NUJGCVRESA-N 1 1 371.441 2.826 20 5 FFBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000840117173 1026965241 /nfs/dbraw/zinc/96/52/41/1026965241.db2.gz SKSGVOHMYIMWDP-OIISXLGYSA-N 1 1 359.430 2.621 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000840118172 1026965845 /nfs/dbraw/zinc/96/58/45/1026965845.db2.gz YCKVLLQQJAOVRS-PBYMTVQHSA-N 1 1 351.410 2.955 20 5 FFBDMO Cc1nn(CN2CC[N@@H+](Cc3ccccc3)C[C@H](C)C2)c(C)c1[N+](=O)[O-] ZINC000840135355 1026975791 /nfs/dbraw/zinc/97/57/91/1026975791.db2.gz OHECVOYNLOHJRO-HNNXBMFYSA-N 1 1 357.458 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[N@H+]3CCC[C@@H]4CC5(CC[C@@H]43)OCCO5)c2c1 ZINC000840138615 1026978681 /nfs/dbraw/zinc/97/86/81/1026978681.db2.gz RSRBOTAPTKCMLP-PBHICJAKSA-N 1 1 372.425 2.910 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(C)c1[N+](=O)[O-] ZINC000795690967 1027815152 /nfs/dbraw/zinc/81/51/52/1027815152.db2.gz BTNPHBLLINVNRF-KZNAEPCWSA-N 1 1 356.426 2.870 20 5 FFBDMO COC[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)[C@@H](O)c1ccccc1 ZINC001160944923 1027934542 /nfs/dbraw/zinc/93/45/42/1027934542.db2.gz JUXIDQHXSAHQCD-FCGLOEDJSA-N 1 1 372.425 2.683 20 5 FFBDMO [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCNC2(CC2)C1 ZINC001161550275 1028223942 /nfs/dbraw/zinc/22/39/42/1028223942.db2.gz GUIXSXFBWYXNBF-NRFANRHFSA-N 1 1 359.473 2.827 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)CC2)[nH+]c1C ZINC001155610019 1028814933 /nfs/dbraw/zinc/81/49/33/1028814933.db2.gz LVWVKPGTJAQOOW-UHFFFAOYSA-N 1 1 372.381 2.683 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](COC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1 ZINC000842833290 1030979734 /nfs/dbraw/zinc/97/97/34/1030979734.db2.gz KKOMLJVIWQMVFI-CYBMUJFWSA-N 1 1 364.398 2.643 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000843475036 1031418882 /nfs/dbraw/zinc/41/88/82/1031418882.db2.gz WPAXNALIPHXOEH-IBWPDUFMSA-N 1 1 367.405 2.790 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799191995 1031689219 /nfs/dbraw/zinc/68/92/19/1031689219.db2.gz WKWLTYFWOVSWAE-KBPBESRZSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799191995 1031689227 /nfs/dbraw/zinc/68/92/27/1031689227.db2.gz WKWLTYFWOVSWAE-KBPBESRZSA-N 1 1 370.409 2.815 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2ccccc2C(=O)Nc2ncc([N+](=O)[O-])s2)C1 ZINC001227514917 1035592662 /nfs/dbraw/zinc/59/26/62/1035592662.db2.gz DWCQRYBHSFUWSO-NSHDSACASA-N 1 1 362.411 2.777 20 5 FFBDMO O=c1[nH]nc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2c1cccc2[N+](=O)[O-] ZINC001229374606 1036638966 /nfs/dbraw/zinc/63/89/66/1036638966.db2.gz PPFOHBMLRWFUOQ-AWEZNQCLSA-N 1 1 366.377 2.897 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc4cccc([N+](=O)[O-])c4n3)C[C@H]1[N@H+]2C ZINC001233837145 1036783326 /nfs/dbraw/zinc/78/33/26/1036783326.db2.gz VLUFEFMPUFEJJO-DIECFANBSA-N 1 1 371.393 2.689 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ccnc([N+](=O)[O-])c3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001233859286 1036793627 /nfs/dbraw/zinc/79/36/27/1036793627.db2.gz LFYQZLWMKNQBKP-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])c(C)cc3F)C[C@H]1[N@H+]2C ZINC001234058528 1036898324 /nfs/dbraw/zinc/89/83/24/1036898324.db2.gz FNQRIUHWEAQXCT-ZILJWTLNSA-N 1 1 352.362 2.588 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC001256279395 1038462448 /nfs/dbraw/zinc/46/24/48/1038462448.db2.gz OMGXUSGFFONYCK-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCCC[N@H+]1Cc1cccnc1 ZINC001256279395 1038462450 /nfs/dbraw/zinc/46/24/50/1038462450.db2.gz OMGXUSGFFONYCK-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc([N+](=O)[O-])c(F)cc3F)o2)C[C@H](C)O1 ZINC001258139441 1039219342 /nfs/dbraw/zinc/21/93/42/1039219342.db2.gz SHMYFVBDKVLGHS-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)NC[C@@H]([NH3+])Cc2ccccc2)c1F ZINC001246299962 1039302463 /nfs/dbraw/zinc/30/24/63/1039302463.db2.gz NQOOFENYBWEOFD-HIFRSBDPSA-N 1 1 361.417 2.833 20 5 FFBDMO C[C@H]1CC[C@@H](CN)[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246546049 1039389903 /nfs/dbraw/zinc/38/99/03/1039389903.db2.gz MNJMJTRVYYNPOL-AAEUAGOBSA-N 1 1 354.401 2.653 20 5 FFBDMO C[C@H]1CC[C@@H](C[NH3+])N1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246546049 1039389914 /nfs/dbraw/zinc/38/99/14/1039389914.db2.gz MNJMJTRVYYNPOL-AAEUAGOBSA-N 1 1 354.401 2.653 20 5 FFBDMO N[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1F ZINC001246572808 1039402364 /nfs/dbraw/zinc/40/23/64/1039402364.db2.gz UVDNNOUDXGLPRA-XJKSGUPXSA-N 1 1 372.391 2.603 20 5 FFBDMO COCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC001210681040 1039669504 /nfs/dbraw/zinc/66/95/04/1039669504.db2.gz HVJWAMNHTJVBIP-UHFFFAOYSA-N 1 1 358.398 2.544 20 5 FFBDMO [NH3+][C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccn3ccnc23)no1 ZINC001248212207 1040174267 /nfs/dbraw/zinc/17/42/67/1040174267.db2.gz NHSIZVCMUVUXKP-AWEZNQCLSA-N 1 1 350.338 2.535 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H]1C ZINC001254479694 1040744289 /nfs/dbraw/zinc/74/42/89/1040744289.db2.gz HWLIDPOPHJSTBW-RDTXWAMCSA-N 1 1 361.442 2.837 20 5 FFBDMO CN1c2ccccc2[C@@]2(CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1=O ZINC001254594676 1040821518 /nfs/dbraw/zinc/82/15/18/1040821518.db2.gz HADLFLYZPCGMGA-UWJYYQICSA-N 1 1 363.417 2.682 20 5 FFBDMO Cc1cncnc1O[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254612420 1040841163 /nfs/dbraw/zinc/84/11/63/1040841163.db2.gz WEDBVAWMABQSAQ-ZWKOTPCHSA-N 1 1 354.410 2.704 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC001278607674 1041404375 /nfs/dbraw/zinc/40/43/75/1041404375.db2.gz NWAGZDAVFUUKBI-RTBURBONSA-N 1 1 371.481 2.948 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001262826548 1041880809 /nfs/dbraw/zinc/88/08/09/1041880809.db2.gz MCTONCAHEVUKKL-TVYUQYBPSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1c(C)c(C)c(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(C)c1C ZINC001316823409 1044787268 /nfs/dbraw/zinc/78/72/68/1044787268.db2.gz JTAYIPMZYWHGIM-IEBWSBKVSA-N 1 1 361.486 2.832 20 5 FFBDMO Cc1c(C)c(C)c(C[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001316823409 1044787280 /nfs/dbraw/zinc/78/72/80/1044787280.db2.gz JTAYIPMZYWHGIM-IEBWSBKVSA-N 1 1 361.486 2.832 20 5 FFBDMO Cc1c(C)c(C)c(C[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001316823409 1044787296 /nfs/dbraw/zinc/78/72/96/1044787296.db2.gz JTAYIPMZYWHGIM-IEBWSBKVSA-N 1 1 361.486 2.832 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001319704734 1045246155 /nfs/dbraw/zinc/24/61/55/1045246155.db2.gz QSRBXEHWMYAWFQ-DZGCQCFKSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001319704734 1045246162 /nfs/dbraw/zinc/24/61/62/1045246162.db2.gz QSRBXEHWMYAWFQ-DZGCQCFKSA-N 1 1 358.398 2.881 20 5 FFBDMO Cc1cc(C[N@@H+](C)CCC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cs1 ZINC001319876823 1045291468 /nfs/dbraw/zinc/29/14/68/1045291468.db2.gz RGZYHMSMNVRPBA-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO Cc1cc(C[N@H+](C)CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001319876823 1045291473 /nfs/dbraw/zinc/29/14/73/1045291473.db2.gz RGZYHMSMNVRPBA-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO Cc1cc(C[N@@H+](C)CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1 ZINC001319876823 1045291478 /nfs/dbraw/zinc/29/14/78/1045291478.db2.gz RGZYHMSMNVRPBA-IAGOWNOFSA-N 1 1 365.499 2.782 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219765 1046422420 /nfs/dbraw/zinc/42/24/20/1046422420.db2.gz BNMPVRMWWBQKLC-ZIAGYGMSSA-N 1 1 358.485 2.584 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001325219765 1046422427 /nfs/dbraw/zinc/42/24/27/1046422427.db2.gz BNMPVRMWWBQKLC-ZIAGYGMSSA-N 1 1 358.485 2.584 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001284533613 1046564266 /nfs/dbraw/zinc/56/42/66/1046564266.db2.gz OLPJNPQJSVRAQX-HZPDHXFCSA-N 1 1 369.412 2.958 20 5 FFBDMO CC(C)N(CC[N@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533613 1046564283 /nfs/dbraw/zinc/56/42/83/1046564283.db2.gz OLPJNPQJSVRAQX-HZPDHXFCSA-N 1 1 369.412 2.958 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533613 1046564294 /nfs/dbraw/zinc/56/42/94/1046564294.db2.gz OLPJNPQJSVRAQX-HZPDHXFCSA-N 1 1 369.412 2.958 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001328886333 1048502060 /nfs/dbraw/zinc/50/20/60/1048502060.db2.gz VYOHFJFDMGQWQW-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001328886333 1048502066 /nfs/dbraw/zinc/50/20/66/1048502066.db2.gz VYOHFJFDMGQWQW-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001298169333 1050390667 /nfs/dbraw/zinc/39/06/67/1050390667.db2.gz CEXCRXBXNQYONB-UHFFFAOYSA-N 1 1 361.442 2.623 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)C1CC1 ZINC001299058362 1050582610 /nfs/dbraw/zinc/58/26/10/1050582610.db2.gz NGHHCCSMRFXWPS-UHFFFAOYSA-N 1 1 358.801 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)CC[C@@H](O)c1ccccc1)CC2 ZINC001340616651 1050997890 /nfs/dbraw/zinc/99/78/90/1050997890.db2.gz SEXMGEFSDAYFEO-VQTJNVASSA-N 1 1 356.422 2.828 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC001340923687 1051252151 /nfs/dbraw/zinc/25/21/51/1051252151.db2.gz SVGNAUQOHNBIRG-QGZVFWFLSA-N 1 1 374.828 2.749 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001342801740 1051410114 /nfs/dbraw/zinc/41/01/14/1051410114.db2.gz MCCAWDRYWKIPFY-MRXNPFEDSA-N 1 1 372.473 2.694 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC001343485374 1052259134 /nfs/dbraw/zinc/25/91/34/1052259134.db2.gz DGMHLIUZCUBVBF-KRWDZBQOSA-N 1 1 374.828 2.749 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])cc1C(F)(F)F ZINC001307227611 1052272245 /nfs/dbraw/zinc/27/22/45/1052272245.db2.gz IVTJVYWUTSJWBV-ZIAGYGMSSA-N 1 1 373.375 2.957 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)ncc1[N+](=O)[O-] ZINC001307233922 1052273901 /nfs/dbraw/zinc/27/39/01/1052273901.db2.gz JYEJXKOQCVHRQU-OUAUKWLOSA-N 1 1 355.236 2.813 20 5 FFBDMO CCOC(=O)CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)C ZINC001307880989 1052361440 /nfs/dbraw/zinc/36/14/40/1052361440.db2.gz UASHQSSCELDKLY-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](n2ccnn2)CC1 ZINC001307965640 1052372300 /nfs/dbraw/zinc/37/23/00/1052372300.db2.gz JOJZACKBPWNZTD-OAHLLOKOSA-N 1 1 372.429 2.551 20 5 FFBDMO COc1ccc(OCC[N@H+]2C[C@@H]3C[C@H]2CN3c2ccccc2)c([N+](=O)[O-])c1 ZINC001308034039 1052388264 /nfs/dbraw/zinc/38/82/64/1052388264.db2.gz FPFHATQGSOOYTO-IRXDYDNUSA-N 1 1 369.421 2.945 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@H]3COC[C@@]3(c3ccccc3)C2)cc1 ZINC001308066635 1052397954 /nfs/dbraw/zinc/39/79/54/1052397954.db2.gz SPESHFGCCFWGKF-FXAWDEMLSA-N 1 1 354.406 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283581 1052441358 /nfs/dbraw/zinc/44/13/58/1052441358.db2.gz ZIFKFDVGXSQFAR-QUCCMNQESA-N 1 1 355.438 2.567 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1 ZINC001308283581 1052441362 /nfs/dbraw/zinc/44/13/62/1052441362.db2.gz ZIFKFDVGXSQFAR-QUCCMNQESA-N 1 1 355.438 2.567 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(N3CCOC3=O)cc2)c([N+](=O)[O-])cc1O ZINC001308341883 1052447984 /nfs/dbraw/zinc/44/79/84/1052447984.db2.gz DCIYEMVYOAJGAZ-UHFFFAOYSA-N 1 1 373.365 2.555 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(C)nc2N2CCCC2)c([N+](=O)[O-])cc1O ZINC001308367494 1052451535 /nfs/dbraw/zinc/45/15/35/1052451535.db2.gz FJHSGEWOKAVSTF-UHFFFAOYSA-N 1 1 372.425 2.902 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)[C@@H]2C1 ZINC001348312209 1054624984 /nfs/dbraw/zinc/62/49/84/1054624984.db2.gz VBRUWTNTGMZREC-XKQJLSEDSA-N 1 1 358.442 2.609 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccncc2)cc1[N+](=O)[O-] ZINC001352243239 1055303954 /nfs/dbraw/zinc/30/39/54/1055303954.db2.gz UENXEFUJBXQIKZ-SFHVURJKSA-N 1 1 368.437 2.969 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccncc2)cc1[N+](=O)[O-] ZINC001352243239 1055303969 /nfs/dbraw/zinc/30/39/69/1055303969.db2.gz UENXEFUJBXQIKZ-SFHVURJKSA-N 1 1 368.437 2.969 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001356351155 1055467814 /nfs/dbraw/zinc/46/78/14/1055467814.db2.gz IOHXSDSUZVOODC-WBVHZDCISA-N 1 1 372.473 2.594 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C[C@@H](C)C1 ZINC001356351815 1055468357 /nfs/dbraw/zinc/46/83/57/1055468357.db2.gz NFAVJXSMPDLNMD-CVEARBPZSA-N 1 1 372.473 2.594 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2nnc(C[N+](=O)[O-])n2CC(C)C)CC1 ZINC001358057045 1056121700 /nfs/dbraw/zinc/12/17/00/1056121700.db2.gz GCACEIKTDKUPGG-UHFFFAOYSA-N 1 1 366.510 2.659 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@H+](C)CCO1 ZINC000619527314 1056555854 /nfs/dbraw/zinc/55/58/54/1056555854.db2.gz HHABEHLAVPCCIL-BLLLJJGKSA-N 1 1 360.389 2.927 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@@H+](C)CCO1 ZINC000619527314 1056555869 /nfs/dbraw/zinc/55/58/69/1056555869.db2.gz HHABEHLAVPCCIL-BLLLJJGKSA-N 1 1 360.389 2.927 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000849483722 1056869387 /nfs/dbraw/zinc/86/93/87/1056869387.db2.gz IVHVJYKGVKESEK-JKSUJKDBSA-N 1 1 371.441 2.619 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC001545105637 1071733491 /nfs/dbraw/zinc/73/34/91/1071733491.db2.gz MSGPALLXPWJZKR-UKRRQHHQSA-N 1 1 354.410 2.869 20 5 FFBDMO C[C@@H](C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1F ZINC001520069480 1059372720 /nfs/dbraw/zinc/37/27/20/1059372720.db2.gz RAYRNTCJXCILSU-DOMZBBRYSA-N 1 1 366.389 2.634 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC001520129940 1059416659 /nfs/dbraw/zinc/41/66/59/1059416659.db2.gz XEIZKAUHCJOMQZ-QWHCGFSZSA-N 1 1 350.419 2.940 20 5 FFBDMO CO[C@@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488110 1060135922 /nfs/dbraw/zinc/13/59/22/1060135922.db2.gz GIRWRFGDTGPHFP-DLBZAZTESA-N 1 1 361.442 2.615 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488110 1060135926 /nfs/dbraw/zinc/13/59/26/1060135926.db2.gz GIRWRFGDTGPHFP-DLBZAZTESA-N 1 1 361.442 2.615 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC[C@@H](OC4CCC4)C3)n2)c1 ZINC000848497219 1060165609 /nfs/dbraw/zinc/16/56/09/1060165609.db2.gz JNTGEPSZCDJPDA-QGZVFWFLSA-N 1 1 357.414 2.844 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H](OC4CCC4)C3)n2)c1 ZINC000848497219 1060165616 /nfs/dbraw/zinc/16/56/16/1060165616.db2.gz JNTGEPSZCDJPDA-QGZVFWFLSA-N 1 1 357.414 2.844 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1 ZINC000848582083 1060310339 /nfs/dbraw/zinc/31/03/39/1060310339.db2.gz GJJGQNMAQIDZKE-LLVKDONJSA-N 1 1 368.340 2.524 20 5 FFBDMO Cc1ccc(NCCNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)[nH+]c1 ZINC001563109660 1071965662 /nfs/dbraw/zinc/96/56/62/1071965662.db2.gz OTKOELWPPXYFDE-UHFFFAOYSA-N 1 1 364.793 2.767 20 5 FFBDMO CC(C)Oc1nc(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC001458084305 1060508612 /nfs/dbraw/zinc/50/86/12/1060508612.db2.gz DKIQJUYSPTYANN-OKILXGFUSA-N 1 1 352.435 2.688 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])ccc1CC ZINC001475355210 1061059349 /nfs/dbraw/zinc/05/93/49/1061059349.db2.gz CVANXDCKCCNUTG-ZDUSSCGKSA-N 1 1 357.476 2.556 20 5 FFBDMO Cn1c[nH+]c2c1ccc1c2CCCN1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001460944156 1061158925 /nfs/dbraw/zinc/15/89/25/1061158925.db2.gz ZJQZJDCTYCODFY-UHFFFAOYSA-N 1 1 365.393 2.873 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@H+](C3CCCC3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC001475686344 1061206191 /nfs/dbraw/zinc/20/61/91/1061206191.db2.gz WXLIOBFIASCPJL-CQSZACIVSA-N 1 1 367.471 2.541 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)cc1[N+](=O)[O-] ZINC001475686344 1061206214 /nfs/dbraw/zinc/20/62/14/1061206214.db2.gz WXLIOBFIASCPJL-CQSZACIVSA-N 1 1 367.471 2.541 20 5 FFBDMO C[NH+]1CCN(Cc2ccc(C(=O)Nc3cccc([N+](=O)[O-])c3)s2)CC1 ZINC001463667091 1062206284 /nfs/dbraw/zinc/20/62/84/1062206284.db2.gz TVQLNMYNBGPKJI-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)n1 ZINC001523663855 1062567481 /nfs/dbraw/zinc/56/74/81/1062567481.db2.gz XJPDDKNELGDKAZ-MRXNPFEDSA-N 1 1 358.398 2.848 20 5 FFBDMO CN(CC[NH2+]Cc1ccc(-c2ccccc2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001493546451 1063176553 /nfs/dbraw/zinc/17/65/53/1063176553.db2.gz XTRBQWIBLAKCGP-RTBURBONSA-N 1 1 353.422 2.567 20 5 FFBDMO Cc1cccc(NCCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])[nH+]1 ZINC001471425998 1064673446 /nfs/dbraw/zinc/67/34/46/1064673446.db2.gz CPFPQNCQZFCUKD-UHFFFAOYSA-N 1 1 357.414 2.945 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC001472634522 1065118426 /nfs/dbraw/zinc/11/84/26/1065118426.db2.gz WWGIMBPKUBNWGV-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c([N+](=O)[O-])c1 ZINC001472859587 1065160640 /nfs/dbraw/zinc/16/06/40/1065160640.db2.gz LJLHYNJIEWHFDU-MRXNPFEDSA-N 1 1 370.409 2.771 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC001546197363 1065279525 /nfs/dbraw/zinc/27/95/25/1065279525.db2.gz HTBRLHWDNJQTNM-UHFFFAOYSA-N 1 1 351.834 2.878 20 5 FFBDMO C[C@@H](Cc1cccc(F)c1)N(C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC001576052462 1078190136 /nfs/dbraw/zinc/19/01/36/1078190136.db2.gz JPVCFTDQZMJBBX-ORAYPTAESA-N 1 1 359.401 2.997 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CCc3cccc(NC(C)=O)c3C2)c1[N+](=O)[O-] ZINC001474664139 1065573491 /nfs/dbraw/zinc/57/34/91/1065573491.db2.gz UIRPZJFJWIAVNQ-UHFFFAOYSA-N 1 1 371.393 2.826 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCc3cccc(NC(C)=O)c3C2)c1[N+](=O)[O-] ZINC001474664139 1065573503 /nfs/dbraw/zinc/57/35/03/1065573503.db2.gz UIRPZJFJWIAVNQ-UHFFFAOYSA-N 1 1 371.393 2.826 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187212 1076244008 /nfs/dbraw/zinc/24/40/08/1076244008.db2.gz BMBMDZUOYUVRQD-YPMHNXCESA-N 1 1 360.370 2.591 20 5 FFBDMO CCOC(=O)[C@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187212 1076244010 /nfs/dbraw/zinc/24/40/10/1076244010.db2.gz BMBMDZUOYUVRQD-YPMHNXCESA-N 1 1 360.370 2.591 20 5 FFBDMO Cc1cccc(CCC[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c1 ZINC001568234872 1077079754 /nfs/dbraw/zinc/07/97/54/1077079754.db2.gz HAXGWYWHLPVNAR-QZTJIDSGSA-N 1 1 359.470 2.611 20 5 FFBDMO CN(CC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001568480352 1077096076 /nfs/dbraw/zinc/09/60/76/1077096076.db2.gz CUYXHBRARLQDIT-ZIAGYGMSSA-N 1 1 360.241 2.549 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CC1=CCCCC1)Cc1ccccc1 ZINC001569868622 1077169520 /nfs/dbraw/zinc/16/95/20/1077169520.db2.gz CCJFIWPILSWZBI-RTBURBONSA-N 1 1 357.454 2.770 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]1C ZINC001586370760 1079613649 /nfs/dbraw/zinc/61/36/49/1079613649.db2.gz LHTHYIIXTJIVCQ-VOAKCMCISA-N 1 1 369.849 2.955 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590152956 1081053968 /nfs/dbraw/zinc/05/39/68/1081053968.db2.gz IFLDRTUVQVSYTG-LJQANCHMSA-N 1 1 364.409 2.939 20 5 FFBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590164680 1081063241 /nfs/dbraw/zinc/06/32/41/1081063241.db2.gz GSTNLWMTUYNFGI-LDYMZIIASA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590166168 1081065279 /nfs/dbraw/zinc/06/52/79/1081065279.db2.gz VTLCRCUSEVJLBZ-GZMMTYOYSA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590261443 1081128853 /nfs/dbraw/zinc/12/88/53/1081128853.db2.gz WJDZZEBGVHIERW-CYBMUJFWSA-N 1 1 359.434 2.699 20 5 FFBDMO C[C@H]1C[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000093643728 250038146 /nfs/dbraw/zinc/03/81/46/250038146.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@H]1C[C@@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643728 250038150 /nfs/dbraw/zinc/03/81/50/250038150.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@H]1C[C@@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643728 250038155 /nfs/dbraw/zinc/03/81/55/250038155.db2.gz HMVXHNNZSXELAV-KSSFIOAISA-N 1 1 357.458 2.910 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H](n4cncn4)C3)o2)c1 ZINC000106217943 250259265 /nfs/dbraw/zinc/25/92/65/250259265.db2.gz CRUOJNRLMIVQCQ-INIZCTEOSA-N 1 1 368.397 2.721 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000117794048 250361719 /nfs/dbraw/zinc/36/17/19/250361719.db2.gz DOFIQFWGZJCEDW-CYBMUJFWSA-N 1 1 351.834 2.924 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000186786024 251263540 /nfs/dbraw/zinc/26/35/40/251263540.db2.gz OHNGREOZCCOSNW-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](CCn4ccc([N+](=O)[O-])n4)C3)nc2c1 ZINC000181141531 251246524 /nfs/dbraw/zinc/24/65/24/251246524.db2.gz FMVNTBMCBXHKBM-AWEZNQCLSA-N 1 1 354.414 2.856 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H](c1ccco1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272554369 252066492 /nfs/dbraw/zinc/06/64/92/252066492.db2.gz RURCKZDZIPMARV-SJLPKXTDSA-N 1 1 369.425 2.903 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000272604399 252079335 /nfs/dbraw/zinc/07/93/35/252079335.db2.gz YYBYDVUWTAOWQY-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO C[C@@H](NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C1=CC[N@@H+](C)CC1 ZINC000272987580 252183668 /nfs/dbraw/zinc/18/36/68/252183668.db2.gz PPVJVFYEJINCGH-CQSZACIVSA-N 1 1 358.442 2.919 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000273093921 252213673 /nfs/dbraw/zinc/21/36/73/252213673.db2.gz FZCYPMMFJGQFST-UHFFFAOYSA-N 1 1 354.819 2.662 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000273308093 252278174 /nfs/dbraw/zinc/27/81/74/252278174.db2.gz XIEJWRYFRJJEJG-FZMZJTMJSA-N 1 1 369.874 2.893 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651171 512124114 /nfs/dbraw/zinc/12/41/14/512124114.db2.gz HOXWLYBQXKNVKV-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651171 512124121 /nfs/dbraw/zinc/12/41/21/512124121.db2.gz HOXWLYBQXKNVKV-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)ccc1[N+](=O)[O-] ZINC000276934723 256144353 /nfs/dbraw/zinc/14/43/53/256144353.db2.gz RLVPMXKRKYNSSX-MRXNPFEDSA-N 1 1 363.458 2.978 20 5 FFBDMO C[C@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@]1=O ZINC000277305706 256182790 /nfs/dbraw/zinc/18/27/90/256182790.db2.gz UKXJSCDRORFKEX-ZJWNCGCPSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@]1=O ZINC000277305706 256182791 /nfs/dbraw/zinc/18/27/91/256182791.db2.gz UKXJSCDRORFKEX-ZJWNCGCPSA-N 1 1 363.439 2.635 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000277630228 256219599 /nfs/dbraw/zinc/21/95/99/256219599.db2.gz XDMNMJALOOTBMM-CQSZACIVSA-N 1 1 370.409 2.595 20 5 FFBDMO COC(=O)c1cnc(N2CCC(Oc3cc[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000278447623 256313954 /nfs/dbraw/zinc/31/39/54/256313954.db2.gz LEBKNZOUTCRBAB-UHFFFAOYSA-N 1 1 372.381 2.528 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000279215375 256394526 /nfs/dbraw/zinc/39/45/26/256394526.db2.gz OLXHLXXYTSGEGX-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@@H]2C1 ZINC000284550292 256935829 /nfs/dbraw/zinc/93/58/29/256935829.db2.gz HHLDLYHSLCXYIK-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO O=c1[nH]c(NCC[N@@H+]2CCc3sccc3C2)nc2ccc([N+](=O)[O-])cc12 ZINC000286477990 257039060 /nfs/dbraw/zinc/03/90/60/257039060.db2.gz UHRZNHQMUAZRMX-UHFFFAOYSA-N 1 1 371.422 2.775 20 5 FFBDMO O=c1[nH]c(NCC[N@H+]2CCc3sccc3C2)nc2ccc([N+](=O)[O-])cc12 ZINC000286477990 257039061 /nfs/dbraw/zinc/03/90/61/257039061.db2.gz UHRZNHQMUAZRMX-UHFFFAOYSA-N 1 1 371.422 2.775 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](c3ccncc3)C2)c1 ZINC000289358051 257276405 /nfs/dbraw/zinc/27/64/05/257276405.db2.gz NVOMIBKVQJTHOR-FUHWJXTLSA-N 1 1 357.410 2.609 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)[C@H](C)C1 ZINC000289875175 257304142 /nfs/dbraw/zinc/30/41/42/257304142.db2.gz NYSWEUUKDGENEO-CZUORRHYSA-N 1 1 358.446 2.557 20 5 FFBDMO Cc1cc(CNC(=O)NCc2ccccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290679106 257352453 /nfs/dbraw/zinc/35/24/53/257352453.db2.gz LGROBJLLBGFGCV-UHFFFAOYSA-N 1 1 369.425 2.898 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCCC[N@H+]1CCc2ccccc2C1 ZINC000301096836 258024493 /nfs/dbraw/zinc/02/44/93/258024493.db2.gz JMAACDUAJYSIJN-UHFFFAOYSA-N 1 1 368.437 2.815 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000301231496 258035819 /nfs/dbraw/zinc/03/58/19/258035819.db2.gz FRJWWFZECXLSDQ-CVEARBPZSA-N 1 1 369.425 2.598 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)C1 ZINC000301303707 258041581 /nfs/dbraw/zinc/04/15/81/258041581.db2.gz SQMASNPNQUIOJF-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Br)C[NH+]1CCOCC1 ZINC000301393172 258046724 /nfs/dbraw/zinc/04/67/24/258046724.db2.gz IYOZZWTZSDNDNQ-NSHDSACASA-N 1 1 358.236 2.738 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1CC(C)(C)O ZINC000302465499 258102756 /nfs/dbraw/zinc/10/27/56/258102756.db2.gz BFNGXQMKZFVKFR-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1cccc(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000302506970 258104008 /nfs/dbraw/zinc/10/40/08/258104008.db2.gz QTWFQQWNJUXLAJ-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000302499699 258104300 /nfs/dbraw/zinc/10/43/00/258104300.db2.gz CINNGLDQXSJLCZ-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO O=C(NC1CC1)c1ccc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])c1 ZINC000302675677 258107783 /nfs/dbraw/zinc/10/77/83/258107783.db2.gz PTLJFIHIVAIGKE-UHFFFAOYSA-N 1 1 369.425 2.674 20 5 FFBDMO C[C@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000301893756 258073431 /nfs/dbraw/zinc/07/34/31/258073431.db2.gz SPCYGKDFMSYWKV-CQSZACIVSA-N 1 1 350.463 2.820 20 5 FFBDMO CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000301965579 258078964 /nfs/dbraw/zinc/07/89/64/258078964.db2.gz KDAPNYZNHHYGRA-MRXNPFEDSA-N 1 1 366.425 2.738 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000330703346 258168619 /nfs/dbraw/zinc/16/86/19/258168619.db2.gz JBJJVTWLFBESQT-PBHICJAKSA-N 1 1 363.458 2.961 20 5 FFBDMO CC[C@@H]1C[C@@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCO1 ZINC000330785479 258170423 /nfs/dbraw/zinc/17/04/23/258170423.db2.gz UDSSDBAHKOGNFC-UONOGXRCSA-N 1 1 367.471 2.619 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000331458502 258186906 /nfs/dbraw/zinc/18/69/06/258186906.db2.gz ARTNHMNOJJAHBU-KBPBESRZSA-N 1 1 354.410 2.821 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000332088243 258213385 /nfs/dbraw/zinc/21/33/85/258213385.db2.gz JWPLJCBOSSBOOI-HOTGVXAUSA-N 1 1 361.442 2.757 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000332520039 258233420 /nfs/dbraw/zinc/23/34/20/258233420.db2.gz LVGMIYZVOSQESX-WCQYABFASA-N 1 1 369.368 2.895 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1)C1CC1 ZINC000121152545 509140266 /nfs/dbraw/zinc/14/02/66/509140266.db2.gz PBNGNTXHRMFARU-UHFFFAOYSA-N 1 1 370.247 2.880 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000064965230 506245949 /nfs/dbraw/zinc/24/59/49/506245949.db2.gz LCHNKMISOBNGTJ-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])[NH+](C)C ZINC000032695091 506280985 /nfs/dbraw/zinc/28/09/85/506280985.db2.gz ALVXZVRXFZZLEG-INIZCTEOSA-N 1 1 357.410 2.945 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000291529857 511233658 /nfs/dbraw/zinc/23/36/58/511233658.db2.gz JZPIFALXVRVVEL-UHFFFAOYSA-N 1 1 353.227 2.568 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c1 ZINC000371065726 512201438 /nfs/dbraw/zinc/20/14/38/512201438.db2.gz XNFVAUQEFNCSAM-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c1 ZINC000371065726 512201441 /nfs/dbraw/zinc/20/14/41/512201441.db2.gz XNFVAUQEFNCSAM-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000369067506 512211706 /nfs/dbraw/zinc/21/17/06/512211706.db2.gz USRJVVZUWMHKQS-AWEZNQCLSA-N 1 1 369.425 2.527 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000369079992 512218417 /nfs/dbraw/zinc/21/84/17/512218417.db2.gz ZVJZOJHAZIOJMA-UHFFFAOYSA-N 1 1 358.398 2.732 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000366955482 512267193 /nfs/dbraw/zinc/26/71/93/512267193.db2.gz RBZOLWWNPROZBK-HNNXBMFYSA-N 1 1 371.393 2.529 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000366955482 512267200 /nfs/dbraw/zinc/26/72/00/512267200.db2.gz RBZOLWWNPROZBK-HNNXBMFYSA-N 1 1 371.393 2.529 20 5 FFBDMO C[N@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000053582804 506410454 /nfs/dbraw/zinc/41/04/54/506410454.db2.gz BHQAAASXSNNNHG-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO C[N@@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000053582804 506410456 /nfs/dbraw/zinc/41/04/56/506410456.db2.gz BHQAAASXSNNNHG-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1scnc1C ZINC000066563567 506553823 /nfs/dbraw/zinc/55/38/23/506553823.db2.gz XHKMLTSETAIFRT-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO O=[N+]([O-])c1c(Nc2ccc(CC[NH+]3CCOCC3)cc2)nc2sccn21 ZINC000054838736 506634046 /nfs/dbraw/zinc/63/40/46/506634046.db2.gz QGZCRXOEEKPZRO-UHFFFAOYSA-N 1 1 373.438 2.922 20 5 FFBDMO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000011366795 506772753 /nfs/dbraw/zinc/77/27/53/506772753.db2.gz IULRINCQAFEQAC-UHFFFAOYSA-N 1 1 373.409 2.733 20 5 FFBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000011366795 506772763 /nfs/dbraw/zinc/77/27/63/506772763.db2.gz IULRINCQAFEQAC-UHFFFAOYSA-N 1 1 373.409 2.733 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055903750 506882180 /nfs/dbraw/zinc/88/21/80/506882180.db2.gz DMPYZMVPPBQXIY-MRXNPFEDSA-N 1 1 361.442 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000045557183 506983055 /nfs/dbraw/zinc/98/30/55/506983055.db2.gz SOYRSESGCBYMRD-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000067722640 506989199 /nfs/dbraw/zinc/98/91/99/506989199.db2.gz JYIJHSFTMOXKQZ-UHFFFAOYSA-N 1 1 354.410 2.622 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1OC ZINC000375414792 512313845 /nfs/dbraw/zinc/31/38/45/512313845.db2.gz NGOYYIWWHSSORA-GFCCVEGCSA-N 1 1 374.397 2.862 20 5 FFBDMO COc1ccc(CC(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000067911299 507050652 /nfs/dbraw/zinc/05/06/52/507050652.db2.gz SXOBXCXVFMKYLA-CQSZACIVSA-N 1 1 363.458 2.773 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000068226836 507154958 /nfs/dbraw/zinc/15/49/58/507154958.db2.gz XFZSNUSJUBUSDO-LSDHHAIUSA-N 1 1 358.442 2.786 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000068351914 507197440 /nfs/dbraw/zinc/19/74/40/507197440.db2.gz NWPKSTUSICEZTB-GFCCVEGCSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000021055860 507242612 /nfs/dbraw/zinc/24/26/12/507242612.db2.gz XKOROVXRGNTPIJ-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000047226953 507287422 /nfs/dbraw/zinc/28/74/22/507287422.db2.gz OLMPWWDAEBKMAH-DLBZAZTESA-N 1 1 372.469 2.554 20 5 FFBDMO Cc1ccc(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cc1[N+](=O)[O-] ZINC000023736197 507369928 /nfs/dbraw/zinc/36/99/28/507369928.db2.gz CEVCAVGOFAJVGK-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000373445102 512334913 /nfs/dbraw/zinc/33/49/13/512334913.db2.gz ZQHRGWPLGXFUQN-CALCHBBNSA-N 1 1 366.421 2.502 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccco1 ZINC000069039994 507387882 /nfs/dbraw/zinc/38/78/82/507387882.db2.gz GDOFYRRNHMVSNL-KRWDZBQOSA-N 1 1 372.425 2.821 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000058861305 507473576 /nfs/dbraw/zinc/47/35/76/507473576.db2.gz QXLOZXJBEHBGSF-UHFFFAOYSA-N 1 1 352.410 2.509 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000059850243 507504763 /nfs/dbraw/zinc/50/47/63/507504763.db2.gz ZGWIQHGHSIMCLL-GOSISDBHSA-N 1 1 353.422 2.918 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(CC[NH+](C)C)c1ccccc1 ZINC000072054796 507741072 /nfs/dbraw/zinc/74/10/72/507741072.db2.gz PTGFRHOSLKODCP-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000063693666 507759582 /nfs/dbraw/zinc/75/95/82/507759582.db2.gz CJJCACFLQBULCC-OAHLLOKOSA-N 1 1 371.441 2.631 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@H](c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000029536838 507782241 /nfs/dbraw/zinc/78/22/41/507782241.db2.gz TYHXCCZQMROOIN-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](c2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000029536838 507782242 /nfs/dbraw/zinc/78/22/42/507782242.db2.gz TYHXCCZQMROOIN-SFHVURJKSA-N 1 1 355.394 2.997 20 5 FFBDMO CC(C)N(C(=O)[C@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000072665253 507840073 /nfs/dbraw/zinc/84/00/73/507840073.db2.gz GPDZTUYYFUHXDI-GJZGRUSLSA-N 1 1 363.462 2.510 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c(F)c1 ZINC000089644927 507853581 /nfs/dbraw/zinc/85/35/81/507853581.db2.gz RWGWIVXSUUFPOM-CABCVRRESA-N 1 1 363.364 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000089644927 507853583 /nfs/dbraw/zinc/85/35/83/507853583.db2.gz RWGWIVXSUUFPOM-CABCVRRESA-N 1 1 363.364 2.920 20 5 FFBDMO O=C(C[N@@H+]1CCC2(C1)CCOCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000072898720 507871320 /nfs/dbraw/zinc/87/13/20/507871320.db2.gz IITDDVNRISUGRR-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC2(C1)CCOCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000072898720 507871321 /nfs/dbraw/zinc/87/13/21/507871321.db2.gz IITDDVNRISUGRR-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C1CCCN1C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089893198 507880134 /nfs/dbraw/zinc/88/01/34/507880134.db2.gz SEPILJSYMPBLJL-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000089929004 507885588 /nfs/dbraw/zinc/88/55/88/507885588.db2.gz BTCMQATTYUVRMA-GHMZBOCLSA-N 1 1 360.357 2.798 20 5 FFBDMO CC1CCC([N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]2CCCO2)CC1 ZINC000090550793 507926830 /nfs/dbraw/zinc/92/68/30/507926830.db2.gz CBEQGBUIOAFEMC-HTWSVDAQSA-N 1 1 363.458 2.816 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000090552869 507927330 /nfs/dbraw/zinc/92/73/30/507927330.db2.gz PWAYBIUTBMXFBY-IBGZPJMESA-N 1 1 350.378 2.531 20 5 FFBDMO CCCO[C@H]1CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000109133295 507941836 /nfs/dbraw/zinc/94/18/36/507941836.db2.gz KBRIBVHRNLJJMP-ZWKOTPCHSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000073988702 507974416 /nfs/dbraw/zinc/97/44/16/507974416.db2.gz VYWSNFKSNFBQNB-YUTCNCBUSA-N 1 1 367.833 2.711 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000073992736 507974657 /nfs/dbraw/zinc/97/46/57/507974657.db2.gz XSNOQUUNIYZAAV-UONOGXRCSA-N 1 1 367.833 2.712 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])cn1 ZINC000079587499 507979284 /nfs/dbraw/zinc/97/92/84/507979284.db2.gz JETAOUPSFBGUSK-UHFFFAOYSA-N 1 1 366.381 2.559 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000109782309 507986631 /nfs/dbraw/zinc/98/66/31/507986631.db2.gz SXMWOHFYLUBKJT-ZDUSSCGKSA-N 1 1 355.394 2.883 20 5 FFBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000109782309 507986632 /nfs/dbraw/zinc/98/66/32/507986632.db2.gz SXMWOHFYLUBKJT-ZDUSSCGKSA-N 1 1 355.394 2.883 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000091457723 507987523 /nfs/dbraw/zinc/98/75/23/507987523.db2.gz DWAHGOGHLGBZFN-OAHLLOKOSA-N 1 1 360.458 2.975 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CC[N@@H+](C)C2)CC1 ZINC000109849254 507991856 /nfs/dbraw/zinc/99/18/56/507991856.db2.gz QXTXHBBPVWDJIG-OAHLLOKOSA-N 1 1 360.458 2.513 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000079804988 508002611 /nfs/dbraw/zinc/00/26/11/508002611.db2.gz ITWFDOQBAGABGR-UHFFFAOYSA-N 1 1 356.220 2.571 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000074857983 508062901 /nfs/dbraw/zinc/06/29/01/508062901.db2.gz BNQACBUWZBRGPH-QGZVFWFLSA-N 1 1 360.458 2.511 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000110996801 508064373 /nfs/dbraw/zinc/06/43/73/508064373.db2.gz JPGAVELYMIISRF-MRXNPFEDSA-N 1 1 371.441 2.600 20 5 FFBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000092585492 508084775 /nfs/dbraw/zinc/08/47/75/508084775.db2.gz NBRXVWJVGGVZKB-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1[N+](=O)[O-] ZINC000092585492 508084776 /nfs/dbraw/zinc/08/47/76/508084776.db2.gz NBRXVWJVGGVZKB-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)CC2)c[nH+]1 ZINC000092624614 508088824 /nfs/dbraw/zinc/08/88/24/508088824.db2.gz TWNWBBRDUCYTNQ-UHFFFAOYSA-N 1 1 365.340 2.500 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000081095207 508137340 /nfs/dbraw/zinc/13/73/40/508137340.db2.gz PAIWRGMEBYZRNU-QAPCUYQASA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000081095207 508137341 /nfs/dbraw/zinc/13/73/41/508137341.db2.gz PAIWRGMEBYZRNU-QAPCUYQASA-N 1 1 362.474 2.894 20 5 FFBDMO COCCOc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000093534295 508148552 /nfs/dbraw/zinc/14/85/52/508148552.db2.gz FTSKKCMREXCWEH-INIZCTEOSA-N 1 1 372.425 2.701 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000076494031 508214084 /nfs/dbraw/zinc/21/40/84/508214084.db2.gz XXOPRFPMDGGKHD-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000076494031 508214088 /nfs/dbraw/zinc/21/40/88/508214088.db2.gz XXOPRFPMDGGKHD-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO O=C(C[N@@H+](CCO)[C@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000114192595 508299408 /nfs/dbraw/zinc/29/94/08/508299408.db2.gz LNRLISBDPHQQSC-KRWDZBQOSA-N 1 1 355.394 2.515 20 5 FFBDMO O=C(C[N@H+](CCO)[C@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000114192595 508299409 /nfs/dbraw/zinc/29/94/09/508299409.db2.gz LNRLISBDPHQQSC-KRWDZBQOSA-N 1 1 355.394 2.515 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c2c(c1)COCO2 ZINC000114467305 508317954 /nfs/dbraw/zinc/31/79/54/508317954.db2.gz OKRMKYGMTGRQCO-LJQANCHMSA-N 1 1 370.405 2.943 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c2c(c1)COCO2 ZINC000114467305 508317955 /nfs/dbraw/zinc/31/79/55/508317955.db2.gz OKRMKYGMTGRQCO-LJQANCHMSA-N 1 1 370.405 2.943 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000087032877 508332595 /nfs/dbraw/zinc/33/25/95/508332595.db2.gz UQBOSAXWRLVRSM-GJZGRUSLSA-N 1 1 363.458 2.531 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)c1 ZINC000152316135 508422949 /nfs/dbraw/zinc/42/29/49/508422949.db2.gz LDHGNMZWMRIDDU-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1ccnc1 ZINC000156455191 508423446 /nfs/dbraw/zinc/42/34/46/508423446.db2.gz DFRWGSJKLRESGA-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1n1ccnc1 ZINC000156455191 508423449 /nfs/dbraw/zinc/42/34/49/508423449.db2.gz DFRWGSJKLRESGA-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156462860 508424404 /nfs/dbraw/zinc/42/44/04/508424404.db2.gz HWBXALBKSWUOEL-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156462860 508424408 /nfs/dbraw/zinc/42/44/08/508424408.db2.gz HWBXALBKSWUOEL-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1Cl ZINC000133690470 508435693 /nfs/dbraw/zinc/43/56/93/508435693.db2.gz YRRTXMKILAAHQJ-FZMZJTMJSA-N 1 1 367.833 2.955 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000121869604 508437154 /nfs/dbraw/zinc/43/71/54/508437154.db2.gz AXTBWXRWQFSWJJ-ZWNOBZJWSA-N 1 1 370.247 2.912 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1 ZINC000121882714 508439508 /nfs/dbraw/zinc/43/95/08/508439508.db2.gz PSNHHWKZMHMJPO-UHFFFAOYSA-N 1 1 374.466 2.902 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000122236752 508504128 /nfs/dbraw/zinc/50/41/28/508504128.db2.gz MHROBRORCZKYFH-RISCZKNCSA-N 1 1 364.402 2.614 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000157158391 508530835 /nfs/dbraw/zinc/53/08/35/508530835.db2.gz WRKFBIYPXKWIRK-IAGOWNOFSA-N 1 1 372.469 2.751 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000122541131 508551494 /nfs/dbraw/zinc/55/14/94/508551494.db2.gz QBUBKVNIAJBPBV-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO O=[N+]([O-])c1ccccc1N(CCC[NH+]1CCOCC1)Cc1ccncc1 ZINC000135453237 508606980 /nfs/dbraw/zinc/60/69/80/508606980.db2.gz PDTAQEUNQPHGIM-UHFFFAOYSA-N 1 1 356.426 2.719 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[NH+](C2CCCCC2)CC1 ZINC000123271608 508662169 /nfs/dbraw/zinc/66/21/69/508662169.db2.gz NXAYVDQQDGBFHY-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000136314531 508686120 /nfs/dbraw/zinc/68/61/20/508686120.db2.gz SIKVQYHYUYJXCJ-ZIAGYGMSSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000119036285 508711667 /nfs/dbraw/zinc/71/16/67/508711667.db2.gz UNMXMMYRDXQWRK-KXBFYZLASA-N 1 1 368.437 2.915 20 5 FFBDMO COc1ccc(OCC[N@H+](CC(N)=O)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000123871836 508750972 /nfs/dbraw/zinc/75/09/72/508750972.db2.gz MYNCVKYSOWKIRU-CQSZACIVSA-N 1 1 373.409 2.531 20 5 FFBDMO COc1ccc(OCC[N@@H+](CC(N)=O)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000123871836 508750974 /nfs/dbraw/zinc/75/09/74/508750974.db2.gz MYNCVKYSOWKIRU-CQSZACIVSA-N 1 1 373.409 2.531 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000139853970 508796234 /nfs/dbraw/zinc/79/62/34/508796234.db2.gz UVHXXHFGUIQRJF-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1 ZINC000139853970 508796237 /nfs/dbraw/zinc/79/62/37/508796237.db2.gz UVHXXHFGUIQRJF-CRAIPNDOSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccnc(N3CCN(C)CC3)c2)cc1[N+](=O)[O-] ZINC000159156004 508801154 /nfs/dbraw/zinc/80/11/54/508801154.db2.gz BOCDKXHRQQWHBD-INIZCTEOSA-N 1 1 369.469 2.901 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1nc2sccn2c1[N+](=O)[O-] ZINC000154577737 508812900 /nfs/dbraw/zinc/81/29/00/508812900.db2.gz FMYGSMTYUUTHTD-UHFFFAOYSA-N 1 1 360.399 2.588 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000119534161 508814738 /nfs/dbraw/zinc/81/47/38/508814738.db2.gz KYZODTZGKOBZAE-INIZCTEOSA-N 1 1 368.437 2.535 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000124541476 508849135 /nfs/dbraw/zinc/84/91/35/508849135.db2.gz NMEMTOSAXWTQHN-MAUKXSAKSA-N 1 1 358.442 2.753 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000159735828 508882481 /nfs/dbraw/zinc/88/24/81/508882481.db2.gz BNAOXFBGCPCAGB-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3ccc(F)cc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000150767839 508889685 /nfs/dbraw/zinc/88/96/85/508889685.db2.gz XBMLSFGXMGLJIK-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC)sc2C1 ZINC000119973885 508901430 /nfs/dbraw/zinc/90/14/30/508901430.db2.gz SNRAUHNABAWSLI-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3OC)sc2C1 ZINC000119973885 508901432 /nfs/dbraw/zinc/90/14/32/508901432.db2.gz SNRAUHNABAWSLI-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000160061642 508932246 /nfs/dbraw/zinc/93/22/46/508932246.db2.gz GLAMVDKMKIXNKZ-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000160245455 508959988 /nfs/dbraw/zinc/95/99/88/508959988.db2.gz OVEAETJKHVPBBF-LIRRHRJNSA-N 1 1 368.437 2.887 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[NH+](C)C ZINC000132343661 509018519 /nfs/dbraw/zinc/01/85/19/509018519.db2.gz ZYYKKXWSFLDRQJ-INIZCTEOSA-N 1 1 361.373 2.775 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000160970161 509055034 /nfs/dbraw/zinc/05/50/34/509055034.db2.gz CCMUSWRHBKEPLH-NSHDSACASA-N 1 1 374.363 2.613 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000120780157 509063691 /nfs/dbraw/zinc/06/36/91/509063691.db2.gz LWEOTWNCNJDNSW-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3[C@H](C)C[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000155771598 509068989 /nfs/dbraw/zinc/06/89/89/509068989.db2.gz QGIMZRHIPRAAPP-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3[C@H](C)C[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000155771598 509068991 /nfs/dbraw/zinc/06/89/91/509068991.db2.gz QGIMZRHIPRAAPP-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)[nH+]1 ZINC000369495654 512437835 /nfs/dbraw/zinc/43/78/35/512437835.db2.gz CMAFNUREXMAYJE-CQSZACIVSA-N 1 1 355.398 2.597 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126672955 509111319 /nfs/dbraw/zinc/11/13/19/509111319.db2.gz HSKNEAAMRYYPJA-LBPRGKRZSA-N 1 1 372.450 2.932 20 5 FFBDMO COCC[N@@H+](C)CCCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126918585 509147051 /nfs/dbraw/zinc/14/70/51/509147051.db2.gz HLAIXPBGBUYRIK-UHFFFAOYSA-N 1 1 359.430 2.740 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[N@H+]1C1CC1 ZINC000182350713 509189715 /nfs/dbraw/zinc/18/97/15/509189715.db2.gz AGTQNNUJVALKDH-VHSXEESVSA-N 1 1 355.341 2.551 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2C)cn1 ZINC000162286624 509190310 /nfs/dbraw/zinc/19/03/10/509190310.db2.gz PIPGYHBLXOIZLT-UHFFFAOYSA-N 1 1 365.393 2.651 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000195718976 509219101 /nfs/dbraw/zinc/21/91/01/509219101.db2.gz NCQMMKBHDKALIM-JSGCOSHPSA-N 1 1 373.413 2.554 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000195718976 509219107 /nfs/dbraw/zinc/21/91/07/509219107.db2.gz NCQMMKBHDKALIM-JSGCOSHPSA-N 1 1 373.413 2.554 20 5 FFBDMO COC(=O)C[C@@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccncc1 ZINC000191902949 509236960 /nfs/dbraw/zinc/23/69/60/509236960.db2.gz MEMSCDWFBKNTOV-GOSISDBHSA-N 1 1 359.382 2.567 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000248459696 509331484 /nfs/dbraw/zinc/33/14/84/509331484.db2.gz NUYVKSTYOAGTOZ-DLBZAZTESA-N 1 1 357.410 2.521 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000163540089 509390075 /nfs/dbraw/zinc/39/00/75/509390075.db2.gz ZXSSNEAKYWXCOH-MRXNPFEDSA-N 1 1 362.474 2.515 20 5 FFBDMO COc1cc(C[NH2+]C[C@@H](C)N(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000264234172 509399624 /nfs/dbraw/zinc/39/96/24/509399624.db2.gz CSSPOWSALGOKOQ-SNVBAGLBSA-N 1 1 365.352 2.584 20 5 FFBDMO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000192219633 509410471 /nfs/dbraw/zinc/41/04/71/509410471.db2.gz MYRFWIYPXVGUMK-IBGZPJMESA-N 1 1 369.421 2.616 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000264257386 509416191 /nfs/dbraw/zinc/41/61/91/509416191.db2.gz CGYRNSMFAKMWQP-QGZVFWFLSA-N 1 1 353.422 2.889 20 5 FFBDMO CC(C)c1[nH+]ccn1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC000182794489 509429597 /nfs/dbraw/zinc/42/95/97/509429597.db2.gz WLYQCLLJWBSUOE-UHFFFAOYSA-N 1 1 360.370 2.715 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208558 509457102 /nfs/dbraw/zinc/45/71/02/509457102.db2.gz OTOWWDXUAJTQMA-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[C@H](C)[N@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208558 509457107 /nfs/dbraw/zinc/45/71/07/509457107.db2.gz OTOWWDXUAJTQMA-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[C@H](C)[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000173208558 509457115 /nfs/dbraw/zinc/45/71/15/509457115.db2.gz OTOWWDXUAJTQMA-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](OCCO)C3)cs2)c1 ZINC000179570520 509518291 /nfs/dbraw/zinc/51/82/91/509518291.db2.gz ZVPQXWHGNRMWDU-INIZCTEOSA-N 1 1 363.439 2.692 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](OCCO)C3)cs2)c1 ZINC000179570520 509518300 /nfs/dbraw/zinc/51/83/00/509518300.db2.gz ZVPQXWHGNRMWDU-INIZCTEOSA-N 1 1 363.439 2.692 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000248907110 509540128 /nfs/dbraw/zinc/54/01/28/509540128.db2.gz UXUJMHVITOZJOA-CZUORRHYSA-N 1 1 355.398 2.632 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CC(C)(C)O)C[C@@H]1C ZINC000189461120 509585938 /nfs/dbraw/zinc/58/59/38/509585938.db2.gz RTXUSDFWMYFXEY-HNNXBMFYSA-N 1 1 365.474 2.659 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000183148621 509626057 /nfs/dbraw/zinc/62/60/57/509626057.db2.gz VNGNHSFYCKZVFJ-BXUZGUMPSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000264661640 509631335 /nfs/dbraw/zinc/63/13/35/509631335.db2.gz SHKWKEKJURDRNM-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000264661640 509631336 /nfs/dbraw/zinc/63/13/36/509631336.db2.gz SHKWKEKJURDRNM-TXEJJXNPSA-N 1 1 369.849 2.866 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3ccccc3O)CC2)c([N+](=O)[O-])c1 ZINC000173511516 509638311 /nfs/dbraw/zinc/63/83/11/509638311.db2.gz FFFKQFOJSBXKLD-UHFFFAOYSA-N 1 1 373.409 2.510 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000179952010 509686198 /nfs/dbraw/zinc/68/61/98/509686198.db2.gz OTLLBBSCRGFELL-MRXNPFEDSA-N 1 1 358.394 2.749 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000179952010 509686202 /nfs/dbraw/zinc/68/62/02/509686202.db2.gz OTLLBBSCRGFELL-MRXNPFEDSA-N 1 1 358.394 2.749 20 5 FFBDMO CC[C@@]1(CO)CCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000189689243 509704057 /nfs/dbraw/zinc/70/40/57/509704057.db2.gz HFVQFQWJZWGBNK-INIZCTEOSA-N 1 1 360.357 2.942 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000189823019 509770545 /nfs/dbraw/zinc/77/05/45/509770545.db2.gz XTOGNNOLWFPITI-DZGCQCFKSA-N 1 1 363.439 2.937 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000189823019 509770553 /nfs/dbraw/zinc/77/05/53/509770553.db2.gz XTOGNNOLWFPITI-DZGCQCFKSA-N 1 1 363.439 2.937 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000253356599 509870267 /nfs/dbraw/zinc/87/02/67/509870267.db2.gz VNUKBCPTSYDOIY-HLLBOEOZSA-N 1 1 374.485 2.901 20 5 FFBDMO CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000177191318 509927190 /nfs/dbraw/zinc/92/71/90/509927190.db2.gz NQGONUUNNDROGC-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](C2CC2)[C@@H]2CCCc3ccccc32)c1 ZINC000245438547 509933764 /nfs/dbraw/zinc/93/37/64/509933764.db2.gz FLFJHNSUQVVGGW-PKOBYXMFSA-N 1 1 356.426 2.694 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000180571793 509990687 /nfs/dbraw/zinc/99/06/87/509990687.db2.gz IIQOVIONKJONOW-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCC[C@H]1O ZINC000245541699 509994275 /nfs/dbraw/zinc/99/42/75/509994275.db2.gz JJWOKJULEMPVBO-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CCCC[C@H]1O ZINC000245541699 509994283 /nfs/dbraw/zinc/99/42/83/509994283.db2.gz JJWOKJULEMPVBO-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000180629888 510023574 /nfs/dbraw/zinc/02/35/74/510023574.db2.gz YFJXPMXVGQSYPC-RDJZCZTQSA-N 1 1 359.430 2.680 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCC[C@H](C)C1 ZINC000245721179 510106662 /nfs/dbraw/zinc/10/66/62/510106662.db2.gz WCTKIDTYRPHQQP-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC[C@H]21 ZINC000268865948 510108030 /nfs/dbraw/zinc/10/80/30/510108030.db2.gz SPABZKQFWDOCBF-CRAIPNDOSA-N 1 1 372.469 2.751 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)CCC(=O)N2C ZINC000187205968 510122487 /nfs/dbraw/zinc/12/24/87/510122487.db2.gz XFQJGJSDUDOFQT-UHFFFAOYSA-N 1 1 355.394 2.802 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000265586788 510127710 /nfs/dbraw/zinc/12/77/10/510127710.db2.gz XOSSNXAWTHIEMB-OKILXGFUSA-N 1 1 367.881 2.638 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000184099107 510130497 /nfs/dbraw/zinc/13/04/97/510130497.db2.gz QTKYJXPBSJCIGC-AWEZNQCLSA-N 1 1 366.805 2.943 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000245754290 510130662 /nfs/dbraw/zinc/13/06/62/510130662.db2.gz UOBVZCVBKKPJBJ-HUUCEWRRSA-N 1 1 360.458 2.904 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000174483944 510135633 /nfs/dbraw/zinc/13/56/33/510135633.db2.gz ZGLUNMPBMODJLI-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190466068 510147731 /nfs/dbraw/zinc/14/77/31/510147731.db2.gz PAGILDLQDKQPTD-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(O)CCCCCC1 ZINC000187321606 510192691 /nfs/dbraw/zinc/19/26/91/510192691.db2.gz DLOAHZNGKWCRAU-UHFFFAOYSA-N 1 1 350.415 2.978 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184231903 510207340 /nfs/dbraw/zinc/20/73/40/510207340.db2.gz DUFISIOIMLJFPG-NSHDSACASA-N 1 1 354.378 2.906 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184231903 510207344 /nfs/dbraw/zinc/20/73/44/510207344.db2.gz DUFISIOIMLJFPG-NSHDSACASA-N 1 1 354.378 2.906 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)[C@@H](C)C1 ZINC000245928879 510214072 /nfs/dbraw/zinc/21/40/72/510214072.db2.gz HZJOUWBORSDOGD-FZMZJTMJSA-N 1 1 371.384 2.999 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269288769 510325425 /nfs/dbraw/zinc/32/54/25/510325425.db2.gz UBXZWOHCHHLKLF-ROUUACIJSA-N 1 1 358.442 2.896 20 5 FFBDMO Cc1ccc(CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@H]2CCCO2)cc1 ZINC000174879543 510361660 /nfs/dbraw/zinc/36/16/60/510361660.db2.gz XFAAONUVLYDXPG-IBGZPJMESA-N 1 1 358.442 2.823 20 5 FFBDMO Cn1cc(CN[C@@H]2CCC[C@@H]([NH+](C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175012939 510435453 /nfs/dbraw/zinc/43/54/53/510435453.db2.gz ZNDGVASYFSFNGK-SJLPKXTDSA-N 1 1 357.458 2.958 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@H+](Cc3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000178157758 510463209 /nfs/dbraw/zinc/46/32/09/510463209.db2.gz FKTGTFDKWFNYNB-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000178157758 510463216 /nfs/dbraw/zinc/46/32/16/510463216.db2.gz FKTGTFDKWFNYNB-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000175130773 510497680 /nfs/dbraw/zinc/49/76/80/510497680.db2.gz OMLJYRJFIKNSHO-GDBMZVCRSA-N 1 1 369.487 2.562 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000194743692 510506979 /nfs/dbraw/zinc/50/69/79/510506979.db2.gz SJMPABXXHKAJSH-OAHLLOKOSA-N 1 1 371.441 2.522 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H]1C[C@@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000246557748 510554485 /nfs/dbraw/zinc/55/44/85/510554485.db2.gz KKPFGRXNODKAOL-DLBZAZTESA-N 1 1 373.409 2.739 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H]1C[C@@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000246557748 510554493 /nfs/dbraw/zinc/55/44/93/510554493.db2.gz KKPFGRXNODKAOL-DLBZAZTESA-N 1 1 373.409 2.739 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccnc1 ZINC000191242724 510564885 /nfs/dbraw/zinc/56/48/85/510564885.db2.gz UKGNHPMJEUMSPO-UHFFFAOYSA-N 1 1 372.425 2.775 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197673 510594962 /nfs/dbraw/zinc/59/49/62/510594962.db2.gz MCOLVTOKXHLXRB-UONOGXRCSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197673 510594968 /nfs/dbraw/zinc/59/49/68/510594968.db2.gz MCOLVTOKXHLXRB-UONOGXRCSA-N 1 1 363.462 2.607 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000172197673 510594973 /nfs/dbraw/zinc/59/49/73/510594973.db2.gz MCOLVTOKXHLXRB-UONOGXRCSA-N 1 1 363.462 2.607 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000194941713 510602178 /nfs/dbraw/zinc/60/21/78/510602178.db2.gz ALCBPRKHGIRUFW-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182153341 510783986 /nfs/dbraw/zinc/78/39/86/510783986.db2.gz RZWZYVGAIXZCLE-UHFFFAOYSA-N 1 1 368.340 2.911 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])c(C)nn3CC)CC2)cc1 ZINC000195340816 510791772 /nfs/dbraw/zinc/79/17/72/510791772.db2.gz CDADAIIBEYLVJS-UHFFFAOYSA-N 1 1 373.457 2.841 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000247446408 510861076 /nfs/dbraw/zinc/86/10/76/510861076.db2.gz PVVZUHJTUQOXJL-LRDDRELGSA-N 1 1 353.850 2.979 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247511426 510863878 /nfs/dbraw/zinc/86/38/78/510863878.db2.gz VSCBCKWICVFMOP-GOEBONIOSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000360436525 510908059 /nfs/dbraw/zinc/90/80/59/510908059.db2.gz LUEWAWKRRNBAQU-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000294169296 510977565 /nfs/dbraw/zinc/97/75/65/510977565.db2.gz OLJSVFGAPIJWHB-IBGZPJMESA-N 1 1 363.433 2.956 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000361204186 511012446 /nfs/dbraw/zinc/01/24/46/511012446.db2.gz NCJBCYLTIILBQF-PKOBYXMFSA-N 1 1 357.385 2.838 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286515338 511027636 /nfs/dbraw/zinc/02/76/36/511027636.db2.gz NACHZEYTDQXRCR-IUODEOHRSA-N 1 1 362.348 2.856 20 5 FFBDMO COC(=O)[C@]1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000282597462 511040343 /nfs/dbraw/zinc/04/03/43/511040343.db2.gz WEAWLDJLFNSREX-BFUOFWGJSA-N 1 1 373.409 2.923 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2nn(C)cc2[N+](=O)[O-])cc1 ZINC000271099416 511083064 /nfs/dbraw/zinc/08/30/64/511083064.db2.gz JUKKCDBHZUDHLE-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C3CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000361940049 511106019 /nfs/dbraw/zinc/10/60/19/511106019.db2.gz AMUAXIQOPNCQBL-OAHLLOKOSA-N 1 1 350.415 2.731 20 5 FFBDMO CN(C)C(=O)COc1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282981074 511187565 /nfs/dbraw/zinc/18/75/65/511187565.db2.gz JJQSYWSIYZBNHH-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1F ZINC000294992132 511246449 /nfs/dbraw/zinc/24/64/49/511246449.db2.gz OQAWDBMHSCXAKE-LBPRGKRZSA-N 1 1 353.394 2.689 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CC23CCOCC3)cn1 ZINC000295098304 511281598 /nfs/dbraw/zinc/28/15/98/511281598.db2.gz UMTATYCPVYRAGO-GOSISDBHSA-N 1 1 356.426 2.725 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959628 511281667 /nfs/dbraw/zinc/28/16/67/511281667.db2.gz YEYKZPVPGPSUAS-IYOUNJFTSA-N 1 1 350.415 2.762 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959628 511281673 /nfs/dbraw/zinc/28/16/73/511281673.db2.gz YEYKZPVPGPSUAS-IYOUNJFTSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]([C@@H](C)CO)C2CCCC2)c([N+](=O)[O-])c1 ZINC000298431868 511282163 /nfs/dbraw/zinc/28/21/63/511282163.db2.gz GMUQSEJKZYBKLR-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000295315044 511360143 /nfs/dbraw/zinc/36/01/43/511360143.db2.gz CSVKTPQDIGVJHJ-LBPRGKRZSA-N 1 1 365.405 2.689 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000283498167 511390039 /nfs/dbraw/zinc/39/00/39/511390039.db2.gz LKQINEOGLFWMPE-HNNXBMFYSA-N 1 1 356.426 2.692 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000295417373 511398098 /nfs/dbraw/zinc/39/80/98/511398098.db2.gz DSEFHSLKLZPAKZ-CRAIPNDOSA-N 1 1 373.384 2.918 20 5 FFBDMO COC[C@@H]1CC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272215632 511468321 /nfs/dbraw/zinc/46/83/21/511468321.db2.gz BCBRASPHFNXFEQ-LLVKDONJSA-N 1 1 360.357 2.716 20 5 FFBDMO CCOC(=O)c1cc(N2CCC[C@@H](c3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000365545003 511518476 /nfs/dbraw/zinc/51/84/76/511518476.db2.gz ARKSFYCCUZMQHM-CYBMUJFWSA-N 1 1 358.398 2.889 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365588064 511546002 /nfs/dbraw/zinc/54/60/02/511546002.db2.gz UENKQNZMYJPZRG-UWWQBHOKSA-N 1 1 357.410 2.813 20 5 FFBDMO CC(C)(CCc1nc(-c2ccc(C[NH+]3CCOCC3)cc2)no1)[N+](=O)[O-] ZINC000295959412 511568845 /nfs/dbraw/zinc/56/88/45/511568845.db2.gz PNDBHBGDEXEJET-UHFFFAOYSA-N 1 1 360.414 2.557 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818832 511666982 /nfs/dbraw/zinc/66/69/82/511666982.db2.gz HGVLLZSYIQRJHD-ZDUSSCGKSA-N 1 1 360.414 2.725 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@](CO)(Cc3ccccc3)C2)c1 ZINC000365841946 511682447 /nfs/dbraw/zinc/68/24/47/511682447.db2.gz PAZKGTREQWRUQX-RTWAWAEBSA-N 1 1 370.449 2.945 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312662576 511785982 /nfs/dbraw/zinc/78/59/82/511785982.db2.gz MMYDWXDGCWHWQZ-MRXNPFEDSA-N 1 1 368.437 2.819 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000292965009 511788851 /nfs/dbraw/zinc/78/88/51/511788851.db2.gz LTARZEQZZNCUSM-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCCN(C)C2 ZINC000292965009 511788857 /nfs/dbraw/zinc/78/88/57/511788857.db2.gz LTARZEQZZNCUSM-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000292965009 511788864 /nfs/dbraw/zinc/78/88/64/511788864.db2.gz LTARZEQZZNCUSM-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@]2(C1)CCC[N@H+](C)C2 ZINC000292965009 511788870 /nfs/dbraw/zinc/78/88/70/511788870.db2.gz LTARZEQZZNCUSM-LJQANCHMSA-N 1 1 360.458 2.650 20 5 FFBDMO COc1cc(C[NH+]2CCC(C3(C)OCCO3)CC2)c([N+](=O)[O-])cc1F ZINC000274318316 511792531 /nfs/dbraw/zinc/79/25/31/511792531.db2.gz OEOIHMLWXFCJAT-UHFFFAOYSA-N 1 1 354.378 2.718 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000324013818 511832787 /nfs/dbraw/zinc/83/27/87/511832787.db2.gz LVXOUIVSQKLNAO-HNNXBMFYSA-N 1 1 368.437 2.771 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000274615482 511889009 /nfs/dbraw/zinc/88/90/09/511889009.db2.gz YDJAJUZDVYUXMP-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1=CC[N@@H+](C)CC1 ZINC000293532078 512000049 /nfs/dbraw/zinc/00/00/49/512000049.db2.gz RIKNHXCJEZNVPA-SNVBAGLBSA-N 1 1 357.332 2.994 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCCC[N@H+]2CCCC[C@@H]2C)c1F ZINC000411181706 512507896 /nfs/dbraw/zinc/50/78/96/512507896.db2.gz UYKABNHTWAWISL-ZDUSSCGKSA-N 1 1 367.421 2.666 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518177 512538886 /nfs/dbraw/zinc/53/88/86/512538886.db2.gz MIPNRYWVKZOYNF-CYBMUJFWSA-N 1 1 370.400 2.777 20 5 FFBDMO C[NH+]1CCC(N2CC[C@@H](Nc3ccc([N+](=O)[O-])c(OC(F)F)c3)C2)CC1 ZINC000367518177 512538890 /nfs/dbraw/zinc/53/88/90/512538890.db2.gz MIPNRYWVKZOYNF-CYBMUJFWSA-N 1 1 370.400 2.777 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000369728602 512576702 /nfs/dbraw/zinc/57/67/02/512576702.db2.gz BKCPGRKJVKNQLG-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1F ZINC000411414773 512624874 /nfs/dbraw/zinc/62/48/74/512624874.db2.gz BZAGILSBMDUUDV-STQMWFEESA-N 1 1 367.421 2.522 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000378240557 512653855 /nfs/dbraw/zinc/65/38/55/512653855.db2.gz AKIRNHKCUDOVMD-LLVKDONJSA-N 1 1 359.361 2.988 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000378240557 512653856 /nfs/dbraw/zinc/65/38/56/512653856.db2.gz AKIRNHKCUDOVMD-LLVKDONJSA-N 1 1 359.361 2.988 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000372128777 512727697 /nfs/dbraw/zinc/72/76/97/512727697.db2.gz PFSXPQMMHDPIJN-UHFFFAOYSA-N 1 1 361.348 2.824 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC=C(c2c(F)cccc2F)CC1 ZINC000372128777 512727701 /nfs/dbraw/zinc/72/77/01/512727701.db2.gz PFSXPQMMHDPIJN-UHFFFAOYSA-N 1 1 361.348 2.824 20 5 FFBDMO CN(Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000378427748 512754160 /nfs/dbraw/zinc/75/41/60/512754160.db2.gz JLPRGVZVFWMQOG-KRWDZBQOSA-N 1 1 366.893 2.849 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccncn2)CC1 ZINC000411828962 512834786 /nfs/dbraw/zinc/83/47/86/512834786.db2.gz RTJHYEHJQGJKLD-CYBMUJFWSA-N 1 1 355.398 2.591 20 5 FFBDMO CN(C)c1noc([C@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1 ZINC000374640217 512931818 /nfs/dbraw/zinc/93/18/18/512931818.db2.gz YWSKANBNEHHGDG-NSHDSACASA-N 1 1 372.385 2.565 20 5 FFBDMO CN(C)c1noc([C@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)n1 ZINC000374640217 512931821 /nfs/dbraw/zinc/93/18/21/512931821.db2.gz YWSKANBNEHHGDG-NSHDSACASA-N 1 1 372.385 2.565 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000412053250 512932628 /nfs/dbraw/zinc/93/26/28/512932628.db2.gz FCZZXHPKNGDVLT-CYBMUJFWSA-N 1 1 358.398 2.713 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000412053250 512932630 /nfs/dbraw/zinc/93/26/30/512932630.db2.gz FCZZXHPKNGDVLT-CYBMUJFWSA-N 1 1 358.398 2.713 20 5 FFBDMO CC(=O)c1cc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000368542255 512992960 /nfs/dbraw/zinc/99/29/60/512992960.db2.gz CKACEVGSRKPSSH-MSOLQXFVSA-N 1 1 369.421 2.845 20 5 FFBDMO Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000374778531 512998147 /nfs/dbraw/zinc/99/81/47/512998147.db2.gz JYMWLWAAWLTTOD-IYHXRUFHSA-N 1 1 356.426 2.772 20 5 FFBDMO CCOC(=O)c1cc(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000433710107 513132925 /nfs/dbraw/zinc/13/29/25/513132925.db2.gz RBPFCOOGGONTAC-OKILXGFUSA-N 1 1 365.430 2.683 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000428794043 513193471 /nfs/dbraw/zinc/19/34/71/513193471.db2.gz LXJCUGCRVMUSPK-HXUWFJFHSA-N 1 1 370.405 2.920 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000428811720 513198230 /nfs/dbraw/zinc/19/82/30/513198230.db2.gz WFFIHALNFKIAHP-HXUWFJFHSA-N 1 1 354.406 2.954 20 5 FFBDMO CCCN(CC[NH+]1CCN(CC)CC1)c1nccc2c1cccc2[N+](=O)[O-] ZINC000450531653 513239167 /nfs/dbraw/zinc/23/91/67/513239167.db2.gz KCBCSSQVKLVPPO-UHFFFAOYSA-N 1 1 371.485 2.997 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000428994673 513244679 /nfs/dbraw/zinc/24/46/79/513244679.db2.gz PJOYOFYKABARLM-DDUZABMNSA-N 1 1 360.458 2.504 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)nc1-c1ccccc1 ZINC000429335057 513343354 /nfs/dbraw/zinc/34/33/54/513343354.db2.gz XNDMUMGNUATABY-UHFFFAOYSA-N 1 1 350.382 2.707 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000418105909 513373818 /nfs/dbraw/zinc/37/38/18/513373818.db2.gz BQIBKYGTTIABNK-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)CN1CCO ZINC000418105909 513373821 /nfs/dbraw/zinc/37/38/21/513373821.db2.gz BQIBKYGTTIABNK-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)CN1CCO ZINC000418105909 513373824 /nfs/dbraw/zinc/37/38/24/513373824.db2.gz BQIBKYGTTIABNK-HUUCEWRRSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000421706638 513378558 /nfs/dbraw/zinc/37/85/58/513378558.db2.gz VINZUDIPRDGDCW-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)c2C[C@@H]1C ZINC000451006131 513453140 /nfs/dbraw/zinc/45/31/40/513453140.db2.gz ZXTWUYXRJRMXSY-OLZOCXBDSA-N 1 1 354.410 2.751 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)Cc1ccc(Cl)cc1 ZINC000441285139 513530520 /nfs/dbraw/zinc/53/05/20/513530520.db2.gz YDDVSBAZDRSZPW-CHWSQXEVSA-N 1 1 366.849 2.796 20 5 FFBDMO C[C@@H](CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000447666381 513534463 /nfs/dbraw/zinc/53/44/63/513534463.db2.gz ASSZYQKAGXKSLO-ZDUSSCGKSA-N 1 1 351.410 2.752 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c(F)c1 ZINC000413256551 513551286 /nfs/dbraw/zinc/55/12/86/513551286.db2.gz CPANEVJDUYUOSJ-INIZCTEOSA-N 1 1 360.389 2.832 20 5 FFBDMO C[N@@H+]1CCCC(C)(C)[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000447813520 513578082 /nfs/dbraw/zinc/57/80/82/513578082.db2.gz WIOIQOYKMKAOAI-OAHLLOKOSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000447813520 513578087 /nfs/dbraw/zinc/57/80/87/513578087.db2.gz WIOIQOYKMKAOAI-OAHLLOKOSA-N 1 1 355.460 2.531 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425492152 513597999 /nfs/dbraw/zinc/59/79/99/513597999.db2.gz MYQLSGMNWDMOPR-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282850 513650579 /nfs/dbraw/zinc/65/05/79/513650579.db2.gz MDGWHMCHYJQVFP-QFBILLFUSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282850 513650584 /nfs/dbraw/zinc/65/05/84/513650584.db2.gz MDGWHMCHYJQVFP-QFBILLFUSA-N 1 1 360.385 2.903 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1 ZINC000451341705 513687701 /nfs/dbraw/zinc/68/77/01/513687701.db2.gz LLBIFZGBWJZHNF-KZNAEPCWSA-N 1 1 361.442 2.939 20 5 FFBDMO C[C@@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368283 513704414 /nfs/dbraw/zinc/70/44/14/513704414.db2.gz LIZGWTCLPXRESY-BODMPHMZSA-N 1 1 362.451 2.513 20 5 FFBDMO C[C@@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368283 513704420 /nfs/dbraw/zinc/70/44/20/513704420.db2.gz LIZGWTCLPXRESY-BODMPHMZSA-N 1 1 362.451 2.513 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000419007337 513715158 /nfs/dbraw/zinc/71/51/58/513715158.db2.gz RKRAMHWRQYQKQS-UONOGXRCSA-N 1 1 351.447 2.663 20 5 FFBDMO CNC(=O)Cc1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451545464 513823443 /nfs/dbraw/zinc/82/34/43/513823443.db2.gz HLFMOBCXKDBHHO-CQSZACIVSA-N 1 1 374.466 2.719 20 5 FFBDMO CNC(=O)Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451545464 513823453 /nfs/dbraw/zinc/82/34/53/513823453.db2.gz HLFMOBCXKDBHHO-CQSZACIVSA-N 1 1 374.466 2.719 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451548226 513825730 /nfs/dbraw/zinc/82/57/30/513825730.db2.gz UVELROSRFPTZKX-HEHGZKQESA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451548226 513825737 /nfs/dbraw/zinc/82/57/37/513825737.db2.gz UVELROSRFPTZKX-HEHGZKQESA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451548225 513826596 /nfs/dbraw/zinc/82/65/96/513826596.db2.gz UVELROSRFPTZKX-DVOMOZLQSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451548225 513826600 /nfs/dbraw/zinc/82/66/00/513826600.db2.gz UVELROSRFPTZKX-DVOMOZLQSA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCCO1 ZINC000436376325 513841475 /nfs/dbraw/zinc/84/14/75/513841475.db2.gz HHQQNZCJGLIBHY-NSHDSACASA-N 1 1 362.352 2.921 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000444025923 514102135 /nfs/dbraw/zinc/10/21/35/514102135.db2.gz RVNOJVDCUXYVGB-STQMWFEESA-N 1 1 350.419 2.940 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@H]2CCCC[C@@H]2O)CC1 ZINC000449183343 514104722 /nfs/dbraw/zinc/10/47/22/514104722.db2.gz FQWYKWQCZFJELI-XPGWFJOJSA-N 1 1 361.486 2.883 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000432197216 514122994 /nfs/dbraw/zinc/12/29/94/514122994.db2.gz WUGCKPYXLHYLQJ-PXNSSMCTSA-N 1 1 369.421 2.844 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1 ZINC000452081266 514178837 /nfs/dbraw/zinc/17/88/37/514178837.db2.gz JLIQIOVZQPMZAW-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H](COC)CC2)c([N+](=O)[O-])c1 ZINC000452081266 514178847 /nfs/dbraw/zinc/17/88/47/514178847.db2.gz JLIQIOVZQPMZAW-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO C[C@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000420586001 514193345 /nfs/dbraw/zinc/19/33/45/514193345.db2.gz NPLKXKDOERPWDM-CYBMUJFWSA-N 1 1 354.410 2.552 20 5 FFBDMO COc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422711 514205949 /nfs/dbraw/zinc/20/59/49/514205949.db2.gz NHOPBVPXGKQRMN-LPHOPBHVSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422711 514205950 /nfs/dbraw/zinc/20/59/50/514205950.db2.gz NHOPBVPXGKQRMN-LPHOPBHVSA-N 1 1 360.385 2.903 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000452183976 514236347 /nfs/dbraw/zinc/23/63/47/514236347.db2.gz QHXAVNSUJQHEIW-KXBFYZLASA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000452183976 514236357 /nfs/dbraw/zinc/23/63/57/514236357.db2.gz QHXAVNSUJQHEIW-KXBFYZLASA-N 1 1 369.421 2.673 20 5 FFBDMO COC[C@]1(CO)CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000449700695 514312080 /nfs/dbraw/zinc/31/20/80/514312080.db2.gz ROPKSOXESDKBJZ-QGZVFWFLSA-N 1 1 363.439 2.549 20 5 FFBDMO COC[C@]1(CO)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000449700695 514312090 /nfs/dbraw/zinc/31/20/90/514312090.db2.gz ROPKSOXESDKBJZ-QGZVFWFLSA-N 1 1 363.439 2.549 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000449752401 514335643 /nfs/dbraw/zinc/33/56/43/514335643.db2.gz FLCCBPCRBFGKJY-DLBZAZTESA-N 1 1 370.405 2.992 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445086550 514409134 /nfs/dbraw/zinc/40/91/34/514409134.db2.gz TWDJIKKKTSQHGH-BETUJISGSA-N 1 1 374.445 2.533 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514420983 /nfs/dbraw/zinc/42/09/83/514420983.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CC[NH+]1CCC(N2CCCN(Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000420982117 514420985 /nfs/dbraw/zinc/42/09/85/514420985.db2.gz ORKXSLUAHZSFTQ-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000445135657 514424431 /nfs/dbraw/zinc/42/44/31/514424431.db2.gz LRWOPIYREKXXLG-CYBMUJFWSA-N 1 1 374.445 2.535 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C[C@H]1C ZINC000449971134 514447635 /nfs/dbraw/zinc/44/76/35/514447635.db2.gz JSYSWFMKGGLGER-GDBMZVCRSA-N 1 1 371.441 2.725 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000415130633 514458896 /nfs/dbraw/zinc/45/88/96/514458896.db2.gz XMAIGQJVSPGSNQ-QFBILLFUSA-N 1 1 363.458 2.712 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000415130734 514459068 /nfs/dbraw/zinc/45/90/68/514459068.db2.gz XMAIGQJVSPGSNQ-VQIMIIECSA-N 1 1 363.458 2.712 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000458170212 514598299 /nfs/dbraw/zinc/59/82/99/514598299.db2.gz OSADLJCULZOPRN-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO CCS(=O)(=O)c1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000466421527 514644135 /nfs/dbraw/zinc/64/41/35/514644135.db2.gz FEKMSGQUABGMSW-UHFFFAOYSA-N 1 1 352.387 2.817 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000466557843 514690657 /nfs/dbraw/zinc/69/06/57/514690657.db2.gz YOPRYVOXVJZJPB-RDTXWAMCSA-N 1 1 360.458 2.699 20 5 FFBDMO CNc1nc(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000455861284 514789832 /nfs/dbraw/zinc/78/98/32/514789832.db2.gz NEVCSFJSYXZBOY-AWEZNQCLSA-N 1 1 371.441 2.672 20 5 FFBDMO Cc1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461943066 514798275 /nfs/dbraw/zinc/79/82/75/514798275.db2.gz WCSJEBFMSCOKSV-LBPRGKRZSA-N 1 1 361.364 2.815 20 5 FFBDMO COc1cccc(N2C[C@@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2=O)c1 ZINC000480050773 514825737 /nfs/dbraw/zinc/82/57/37/514825737.db2.gz ZDPKFEUPGLJQQN-ZDUSSCGKSA-N 1 1 359.357 2.638 20 5 FFBDMO NC(=O)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466998275 514856445 /nfs/dbraw/zinc/85/64/45/514856445.db2.gz MSVFPMUFSXYGIK-OAHLLOKOSA-N 1 1 351.765 2.574 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@H](C)C1 ZINC000480202535 514877462 /nfs/dbraw/zinc/87/74/62/514877462.db2.gz YKWMZEATXDKHEY-KGLIPLIRSA-N 1 1 351.447 2.663 20 5 FFBDMO COc1c(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000476060503 514903611 /nfs/dbraw/zinc/90/36/11/514903611.db2.gz FCLDASRVJYXQIC-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000467214555 514942248 /nfs/dbraw/zinc/94/22/48/514942248.db2.gz CXSLRMOWDWETAC-MEBBXXQBSA-N 1 1 352.822 2.530 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000489717054 514948964 /nfs/dbraw/zinc/94/89/64/514948964.db2.gz PTGWMEJLEIHEGJ-AWEZNQCLSA-N 1 1 363.414 2.564 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000467321793 514978118 /nfs/dbraw/zinc/97/81/18/514978118.db2.gz PMYNXCCUMJALGZ-CQSZACIVSA-N 1 1 363.414 2.641 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000476381875 515028625 /nfs/dbraw/zinc/02/86/25/515028625.db2.gz YEYXDRGEKZQOAK-GDBMZVCRSA-N 1 1 371.441 2.626 20 5 FFBDMO CCc1cc(N[C@H]2CCn3cc[nH+]c3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489931989 515036713 /nfs/dbraw/zinc/03/67/13/515036713.db2.gz ZXOBWFZMIDLSAZ-HNNXBMFYSA-N 1 1 364.409 2.660 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000498740262 515048538 /nfs/dbraw/zinc/04/85/38/515048538.db2.gz WXHLWHJWPBBRID-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1CCOC ZINC000499426758 515318152 /nfs/dbraw/zinc/31/81/52/515318152.db2.gz FQGURXSFCAQXRW-OAHLLOKOSA-N 1 1 374.441 2.649 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH+](CCC(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000509815860 515335780 /nfs/dbraw/zinc/33/57/80/515335780.db2.gz BGBVTSSNEOUGMC-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO CC[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000499541462 515364793 /nfs/dbraw/zinc/36/47/93/515364793.db2.gz QRDROVBVLGWZJX-INIZCTEOSA-N 1 1 368.437 2.744 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000468483329 515380153 /nfs/dbraw/zinc/38/01/53/515380153.db2.gz JWKGTNNGYXWMLT-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCCC1 ZINC000504896546 515405394 /nfs/dbraw/zinc/40/53/94/515405394.db2.gz YMRWMTRLLPOJOR-GJZGRUSLSA-N 1 1 353.488 2.512 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCC1 ZINC000504896546 515405405 /nfs/dbraw/zinc/40/54/05/515405405.db2.gz YMRWMTRLLPOJOR-GJZGRUSLSA-N 1 1 353.488 2.512 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000468695375 515475106 /nfs/dbraw/zinc/47/51/06/515475106.db2.gz SFIGHURGNOPWPS-DZGCQCFKSA-N 1 1 354.410 2.742 20 5 FFBDMO C[C@@H]1C[C@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510231775 515476527 /nfs/dbraw/zinc/47/65/27/515476527.db2.gz ZIGDTZGKQLKOPV-ZBFHGGJFSA-N 1 1 356.426 2.953 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCCC[C@@H]1C ZINC000468710789 515481845 /nfs/dbraw/zinc/48/18/45/515481845.db2.gz IHXNCVXCMSCVOL-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCCC[C@@H]1C ZINC000468710789 515481852 /nfs/dbraw/zinc/48/18/52/515481852.db2.gz IHXNCVXCMSCVOL-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[N@H+]1Cc1ccccc1 ZINC000510259445 515487280 /nfs/dbraw/zinc/48/72/80/515487280.db2.gz QAZRFSQXWSLLOY-ZBFHGGJFSA-N 1 1 356.426 2.953 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1Br ZINC000492123471 515503694 /nfs/dbraw/zinc/50/36/94/515503694.db2.gz ZRKQUMRCSIQXJS-GFCCVEGCSA-N 1 1 358.236 2.880 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1Br ZINC000492123471 515503703 /nfs/dbraw/zinc/50/37/03/515503703.db2.gz ZRKQUMRCSIQXJS-GFCCVEGCSA-N 1 1 358.236 2.880 20 5 FFBDMO O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000505330417 515507321 /nfs/dbraw/zinc/50/73/21/515507321.db2.gz KCAVQXCGIDJLIC-CQSZACIVSA-N 1 1 363.805 2.538 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)NCC[NH+]2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000505391917 515519876 /nfs/dbraw/zinc/51/98/76/515519876.db2.gz MKOHTHWZEILVDJ-AWEZNQCLSA-N 1 1 369.425 2.598 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000473167953 515524265 /nfs/dbraw/zinc/52/42/65/515524265.db2.gz HKFWJINZNGJLIC-LBPRGKRZSA-N 1 1 355.803 2.571 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)ccc1[N+](=O)[O-] ZINC000492565955 515544907 /nfs/dbraw/zinc/54/49/07/515544907.db2.gz XZEQYQMWRNMFOJ-MRXNPFEDSA-N 1 1 361.442 2.732 20 5 FFBDMO C[N@@H+](CCNC(=O)CCNc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000482044221 515555889 /nfs/dbraw/zinc/55/58/89/515555889.db2.gz ZRYSLOZGYDZCGX-UHFFFAOYSA-N 1 1 374.416 2.784 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871926 515571567 /nfs/dbraw/zinc/57/15/67/515571567.db2.gz JYTYAIRHGOPEFE-LSDHHAIUSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871926 515571570 /nfs/dbraw/zinc/57/15/70/515571570.db2.gz JYTYAIRHGOPEFE-LSDHHAIUSA-N 1 1 366.414 2.536 20 5 FFBDMO O=C(CCC(=O)N1CC[NH2+][C@H](c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000457021558 515589187 /nfs/dbraw/zinc/58/91/87/515589187.db2.gz MQXJDYZUNQOLLM-SFHVURJKSA-N 1 1 367.405 2.731 20 5 FFBDMO COc1ccc(OCCC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc1 ZINC000459494667 515594667 /nfs/dbraw/zinc/59/46/67/515594667.db2.gz JYLQGRLPBOYYDK-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454612319 515609418 /nfs/dbraw/zinc/60/94/18/515609418.db2.gz SBFFSROQUSZAHV-WBVHZDCISA-N 1 1 372.469 2.968 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000457063555 515617946 /nfs/dbraw/zinc/61/79/46/515617946.db2.gz WCUMLLIHYFGTPV-UHFFFAOYSA-N 1 1 372.425 2.512 20 5 FFBDMO Cc1cc(N(C)S(=O)(=O)c2ccc([N+](=O)[O-])c3cccnc32)cc[nH+]1 ZINC000464220511 515748704 /nfs/dbraw/zinc/74/87/04/515748704.db2.gz ZOCGADVHJMCPSH-UHFFFAOYSA-N 1 1 358.379 2.672 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676369 515765717 /nfs/dbraw/zinc/76/57/17/515765717.db2.gz JJCXKYOHQNLQCR-UONOGXRCSA-N 1 1 373.457 2.988 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676369 515765723 /nfs/dbraw/zinc/76/57/23/515765723.db2.gz JJCXKYOHQNLQCR-UONOGXRCSA-N 1 1 373.457 2.988 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1cc(F)cc(F)c1 ZINC000511107733 515782451 /nfs/dbraw/zinc/78/24/51/515782451.db2.gz OOCIJIRDKSUQJM-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1cc(F)cc(F)c1 ZINC000511107733 515782459 /nfs/dbraw/zinc/78/24/59/515782459.db2.gz OOCIJIRDKSUQJM-UHFFFAOYSA-N 1 1 363.364 2.664 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](CN(C)S(C)(=O)=O)C1 ZINC000511124724 515794455 /nfs/dbraw/zinc/79/44/55/515794455.db2.gz LTDUJBQQKDPEOL-GJZGRUSLSA-N 1 1 369.487 2.568 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000478591620 515884320 /nfs/dbraw/zinc/88/43/20/515884320.db2.gz ONRVRCBUKKZGNW-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000478591621 515884800 /nfs/dbraw/zinc/88/48/00/515884800.db2.gz ONRVRCBUKKZGNW-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](CC(N)=O)c1ccccc1 ZINC000483109824 515930738 /nfs/dbraw/zinc/93/07/38/515930738.db2.gz AJTYTTRPMJPVHA-INIZCTEOSA-N 1 1 353.382 2.520 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](CC(N)=O)c1ccccc1 ZINC000483109824 515930750 /nfs/dbraw/zinc/93/07/50/515930750.db2.gz AJTYTTRPMJPVHA-INIZCTEOSA-N 1 1 353.382 2.520 20 5 FFBDMO Cc1c(CNC(=O)NCC[N@@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000478824453 515977100 /nfs/dbraw/zinc/97/71/00/515977100.db2.gz UGUQFJUDJFVKJP-UHFFFAOYSA-N 1 1 374.466 2.822 20 5 FFBDMO Cc1c(CNC(=O)NCC[N@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000478824453 515977111 /nfs/dbraw/zinc/97/71/11/515977111.db2.gz UGUQFJUDJFVKJP-UHFFFAOYSA-N 1 1 374.466 2.822 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)CCC[N@H+](C)CCN(C)C ZINC000494851353 515984955 /nfs/dbraw/zinc/98/49/55/515984955.db2.gz PXBZCYIIAZCFGN-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N(C)CCCN(C)CC[NH+](C)C ZINC000494851353 515984966 /nfs/dbraw/zinc/98/49/66/515984966.db2.gz PXBZCYIIAZCFGN-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO CCSCC[C@H](C)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000464855149 515990187 /nfs/dbraw/zinc/99/01/87/515990187.db2.gz WWZDMXQGJKOUAQ-NSHDSACASA-N 1 1 369.443 2.726 20 5 FFBDMO CC(C)c1ccc(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000470106796 516121845 /nfs/dbraw/zinc/12/18/45/516121845.db2.gz VYFDZSPCLWNXIX-OAHLLOKOSA-N 1 1 363.458 2.949 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000512043144 516127150 /nfs/dbraw/zinc/12/71/50/516127150.db2.gz XEIBEGVECRJMBI-QWHCGFSZSA-N 1 1 369.849 2.864 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(Cc2nccn2C)CC1 ZINC000470170293 516160347 /nfs/dbraw/zinc/16/03/47/516160347.db2.gz RSJHUSNLXJYFNZ-FOWTUZBSSA-N 1 1 355.442 2.549 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000470353844 516216122 /nfs/dbraw/zinc/21/61/22/516216122.db2.gz JOXJAPWNKXRGGJ-UHFFFAOYSA-N 1 1 374.416 2.708 20 5 FFBDMO CC(C)(C)OCCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000474973313 516252493 /nfs/dbraw/zinc/25/24/93/516252493.db2.gz BLNYNFVXLNFFQB-UHFFFAOYSA-N 1 1 363.458 2.948 20 5 FFBDMO Cn1c(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000496390262 516257472 /nfs/dbraw/zinc/25/74/72/516257472.db2.gz PHVCDNLVNDBPRK-CQSZACIVSA-N 1 1 350.806 2.619 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000461040159 516310068 /nfs/dbraw/zinc/31/00/68/516310068.db2.gz CLKQURZDWUIURX-NEPJUHHUSA-N 1 1 357.838 2.860 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1C[C@H](OCC)C1(C)C ZINC000535583767 516412311 /nfs/dbraw/zinc/41/23/11/516412311.db2.gz WEBKUOHWMGCBRD-CVEARBPZSA-N 1 1 351.447 2.672 20 5 FFBDMO C[NH+](C)C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000554655971 516571486 /nfs/dbraw/zinc/57/14/86/516571486.db2.gz SSOLVJLNTWXLFL-MRXNPFEDSA-N 1 1 371.372 2.643 20 5 FFBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NCc1ccccc1 ZINC000540479727 516575270 /nfs/dbraw/zinc/57/52/70/516575270.db2.gz WIGXQUITRVIYAQ-ZIAGYGMSSA-N 1 1 370.409 2.660 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+](C2CCC2)C1 ZINC000561534333 516637035 /nfs/dbraw/zinc/63/70/35/516637035.db2.gz KLYMOTJFNDUFSS-LBPRGKRZSA-N 1 1 367.396 2.748 20 5 FFBDMO C[C@H](C(=O)NCc1ccc(F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554849182 516661651 /nfs/dbraw/zinc/66/16/51/516661651.db2.gz WOSVXKXRKNJTMX-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000551424831 516704231 /nfs/dbraw/zinc/70/42/31/516704231.db2.gz PGNMJRXIAKMSCK-OAHLLOKOSA-N 1 1 373.413 2.526 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561746995 516744807 /nfs/dbraw/zinc/74/48/07/516744807.db2.gz QTPOWGAQKYPWDL-TXPKVOOTSA-N 1 1 374.485 2.976 20 5 FFBDMO NC(=O)[C@H]1CCC[N@H+]1CCCNc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000548116693 516774026 /nfs/dbraw/zinc/77/40/26/516774026.db2.gz TZKIGTSUBSMVJP-GFCCVEGCSA-N 1 1 361.229 2.653 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000518833755 516791641 /nfs/dbraw/zinc/79/16/41/516791641.db2.gz RCRMYMIPRFFEBW-UBHSHLNASA-N 1 1 367.833 2.759 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000544767619 516919941 /nfs/dbraw/zinc/91/99/41/516919941.db2.gz VWWPTXNIXQSUMS-MRXNPFEDSA-N 1 1 354.410 2.726 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000544767619 516919951 /nfs/dbraw/zinc/91/99/51/516919951.db2.gz VWWPTXNIXQSUMS-MRXNPFEDSA-N 1 1 354.410 2.726 20 5 FFBDMO Cc1ccc([C@@H](CC(=O)OC(C)C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000541201170 516927094 /nfs/dbraw/zinc/92/70/94/516927094.db2.gz BUDVWAWWQCRTSR-OAHLLOKOSA-N 1 1 360.414 2.809 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000519512550 517018800 /nfs/dbraw/zinc/01/88/00/517018800.db2.gz WASDLXFSMVWUSB-KBPBESRZSA-N 1 1 351.472 2.922 20 5 FFBDMO C[C@@H]1Cc2ccccc2C[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000532978947 517232352 /nfs/dbraw/zinc/23/23/52/517232352.db2.gz OWJOQQWTFBGEEH-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@@H]1Cc2ccccc2C[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000532978947 517232362 /nfs/dbraw/zinc/23/23/62/517232362.db2.gz OWJOQQWTFBGEEH-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000533011261 517250971 /nfs/dbraw/zinc/25/09/71/517250971.db2.gz AQJUVDRLYFWJPH-UHFFFAOYSA-N 1 1 357.414 2.864 20 5 FFBDMO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1OC(F)F)N1CC[NH+](C)CC1 ZINC000545484732 517262161 /nfs/dbraw/zinc/26/21/61/517262161.db2.gz LKJHGIMAYZZKKW-OAHLLOKOSA-N 1 1 372.416 2.880 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000520073495 517268381 /nfs/dbraw/zinc/26/83/81/517268381.db2.gz OCPMFHINRRNKLB-ZIAGYGMSSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)n1 ZINC000541935029 517299206 /nfs/dbraw/zinc/29/92/06/517299206.db2.gz HKEODWNFEOMPIZ-MSOLQXFVSA-N 1 1 370.453 2.902 20 5 FFBDMO Cc1cc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cc([N+](=O)[O-])c1 ZINC000520384214 517370822 /nfs/dbraw/zinc/37/08/22/517370822.db2.gz TXKOGDYFSNSTGP-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000549156835 517430179 /nfs/dbraw/zinc/43/01/79/517430179.db2.gz OEXLTHRISIREAS-CQSZACIVSA-N 1 1 373.375 2.870 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000549156835 517430183 /nfs/dbraw/zinc/43/01/83/517430183.db2.gz OEXLTHRISIREAS-CQSZACIVSA-N 1 1 373.375 2.870 20 5 FFBDMO COc1cccc(CNC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549171976 517437601 /nfs/dbraw/zinc/43/76/01/517437601.db2.gz PZSUUECKNMKOLD-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC(=O)NC1CCCCC1 ZINC000538281008 517538929 /nfs/dbraw/zinc/53/89/29/517538929.db2.gz YPXYLJAJEGKXHN-CHWSQXEVSA-N 1 1 362.430 2.792 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000542506321 517600665 /nfs/dbraw/zinc/60/06/65/517600665.db2.gz JFYOXRDUONKYMS-GZMMTYOYSA-N 1 1 355.236 2.955 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000542506321 517600673 /nfs/dbraw/zinc/60/06/73/517600673.db2.gz JFYOXRDUONKYMS-GZMMTYOYSA-N 1 1 355.236 2.955 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1Cc1ccccc1 ZINC000560168819 517616268 /nfs/dbraw/zinc/61/62/68/517616268.db2.gz VMWOKDHIRZGLCQ-KRWDZBQOSA-N 1 1 365.437 2.830 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1Cc1ccccc1 ZINC000560168820 517617107 /nfs/dbraw/zinc/61/71/07/517617107.db2.gz VMWOKDHIRZGLCQ-QGZVFWFLSA-N 1 1 365.437 2.830 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000553330553 517649955 /nfs/dbraw/zinc/64/99/55/517649955.db2.gz FUUSGYKIPGMLOQ-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000553330553 517649962 /nfs/dbraw/zinc/64/99/62/517649962.db2.gz FUUSGYKIPGMLOQ-NEPJUHHUSA-N 1 1 355.822 2.568 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556882773 517726496 /nfs/dbraw/zinc/72/64/96/517726496.db2.gz CRSGCBJLHLNRHD-HNNXBMFYSA-N 1 1 374.441 2.969 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000538709846 517739598 /nfs/dbraw/zinc/73/95/98/517739598.db2.gz XCCNTKKZBXZYOZ-ZDUSSCGKSA-N 1 1 368.865 2.820 20 5 FFBDMO CCCCO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C ZINC000534178486 517773378 /nfs/dbraw/zinc/77/33/78/517773378.db2.gz VBGXZRHKKNXPOD-JKSUJKDBSA-N 1 1 351.447 2.672 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000549918770 517781620 /nfs/dbraw/zinc/78/16/20/517781620.db2.gz ITXVVPURZFPSCH-OAHLLOKOSA-N 1 1 357.332 2.716 20 5 FFBDMO O=C1C[C@@]2(CN1)CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000549918770 517781628 /nfs/dbraw/zinc/78/16/28/517781628.db2.gz ITXVVPURZFPSCH-OAHLLOKOSA-N 1 1 357.332 2.716 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3cnccc3C)CC2)c([N+](=O)[O-])c1 ZINC000534241584 517801004 /nfs/dbraw/zinc/80/10/04/517801004.db2.gz GQRDKSSFQNNNPM-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918426 517843723 /nfs/dbraw/zinc/84/37/23/517843723.db2.gz ARSTYYUFTKZKPV-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000538918426 517843735 /nfs/dbraw/zinc/84/37/35/517843735.db2.gz ARSTYYUFTKZKPV-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@]2(C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000546811345 517869684 /nfs/dbraw/zinc/86/96/84/517869684.db2.gz LKCVSVMYSVXXAN-MRXNPFEDSA-N 1 1 360.357 2.594 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000553783337 517902100 /nfs/dbraw/zinc/90/21/00/517902100.db2.gz OZMWPIGUTHHVIB-IQUTYRLHSA-N 1 1 370.453 2.807 20 5 FFBDMO Cn1c(C(=O)N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)ccc1[N+](=O)[O-] ZINC000560768729 518014626 /nfs/dbraw/zinc/01/46/26/518014626.db2.gz MACZYZKRFKYZBS-FQEVSTJZSA-N 1 1 368.437 2.672 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000563650315 518044700 /nfs/dbraw/zinc/04/47/00/518044700.db2.gz NCRVYNCWXAKVIZ-CWTRNNRKSA-N 1 1 372.377 2.758 20 5 FFBDMO Cc1nn(CCC(=O)NCCC[N@H+](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC000522532575 518122916 /nfs/dbraw/zinc/12/29/16/518122916.db2.gz CYEHFTXTRKUVLB-UHFFFAOYSA-N 1 1 365.478 2.569 20 5 FFBDMO COc1cc(NCC[NH+]2CCN(c3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC000535070607 518146081 /nfs/dbraw/zinc/14/60/81/518146081.db2.gz HWGNAHYNRNDIMI-UHFFFAOYSA-N 1 1 374.416 2.977 20 5 FFBDMO C[C@]1(NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000581436304 518284444 /nfs/dbraw/zinc/28/44/44/518284444.db2.gz YGGDNNYVJSARLX-FQEVSTJZSA-N 1 1 368.437 2.788 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000581718863 518423734 /nfs/dbraw/zinc/42/37/34/518423734.db2.gz JKYJYOGFFOFIRB-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000585754876 518587446 /nfs/dbraw/zinc/58/74/46/518587446.db2.gz JPVWRHTUYPBDPG-CQSZACIVSA-N 1 1 365.430 2.559 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])c1 ZINC000585754876 518587450 /nfs/dbraw/zinc/58/74/50/518587450.db2.gz JPVWRHTUYPBDPG-CQSZACIVSA-N 1 1 365.430 2.559 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000582177522 518624199 /nfs/dbraw/zinc/62/41/99/518624199.db2.gz FUMFJBGCFZRNNI-ZDUSSCGKSA-N 1 1 373.400 2.773 20 5 FFBDMO CCc1cc(N[C@H]2CCc3c[nH+]cn3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000588067777 518714561 /nfs/dbraw/zinc/71/45/61/518714561.db2.gz PBBQCRZCFZNZCI-HNNXBMFYSA-N 1 1 364.409 2.660 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(Cc3cc([N+](=O)[O-])ccc3OC(C)C)[C@H]2C1 ZINC000573737050 518812277 /nfs/dbraw/zinc/81/22/77/518812277.db2.gz ZYFGMCFITNJMJT-PKOBYXMFSA-N 1 1 363.458 2.677 20 5 FFBDMO C[C@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000576915290 518823674 /nfs/dbraw/zinc/82/36/74/518823674.db2.gz LWRNHPQRALITKB-HZSPNIEDSA-N 1 1 358.442 2.996 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C[N@@H+](C)C(C)C ZINC000579781612 518846056 /nfs/dbraw/zinc/84/60/56/518846056.db2.gz SREZSLQPKKJFJO-ZDUSSCGKSA-N 1 1 369.487 2.792 20 5 FFBDMO C[C@H]1CC[C@H]([N@@H+](CCO)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000589261243 518966151 /nfs/dbraw/zinc/96/61/51/518966151.db2.gz IXUGASHZOAICMV-AAEUAGOBSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)[N@H+](C)C[C@H](C)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000574128387 518998232 /nfs/dbraw/zinc/99/82/32/518998232.db2.gz RFIJTMXFKGGKBD-HNNXBMFYSA-N 1 1 350.463 2.568 20 5 FFBDMO CC(=O)NCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CCSCC1 ZINC000565552435 519014733 /nfs/dbraw/zinc/01/47/33/519014733.db2.gz SGJSVJYVVOATFW-UHFFFAOYSA-N 1 1 351.472 2.737 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000589510571 519022134 /nfs/dbraw/zinc/02/21/34/519022134.db2.gz LAJLCVKIIFUIFP-HNNXBMFYSA-N 1 1 355.394 2.841 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CN=NC2=O)CC1 ZINC000580151002 519028245 /nfs/dbraw/zinc/02/82/45/519028245.db2.gz LQAGMZWZOBGMNB-UHFFFAOYSA-N 1 1 361.402 2.516 20 5 FFBDMO C[C@H](C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000577338971 519028301 /nfs/dbraw/zinc/02/83/01/519028301.db2.gz FKVNDYPICYXYEN-IFXJQAMLSA-N 1 1 369.421 2.904 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509786 519075285 /nfs/dbraw/zinc/07/52/85/519075285.db2.gz ZVXNFKRHBGCQSM-PWSUYJOCSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@@H](SC[C@@H]1C[N@@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509786 519075290 /nfs/dbraw/zinc/07/52/90/519075290.db2.gz ZVXNFKRHBGCQSM-PWSUYJOCSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000565935662 519204600 /nfs/dbraw/zinc/20/46/00/519204600.db2.gz BRPRZDBXPIZCLT-HNNXBMFYSA-N 1 1 354.410 2.584 20 5 FFBDMO COC(=O)c1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)nc1C1CC1 ZINC000583467470 519261924 /nfs/dbraw/zinc/26/19/24/519261924.db2.gz CABZVILDNLOEKN-UHFFFAOYSA-N 1 1 371.393 2.952 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nccc(C(F)F)n1 ZINC000571781979 519273711 /nfs/dbraw/zinc/27/37/11/519273711.db2.gz MHXLHANUODWLET-SNVBAGLBSA-N 1 1 365.340 2.829 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)CC[C@@H]1C ZINC000569147001 519400631 /nfs/dbraw/zinc/40/06/31/519400631.db2.gz SUKFUKWRWJXBED-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2c([N+](=O)[O-])nc(C)n2CC)[C@@H](C)C1 ZINC000578159841 519450188 /nfs/dbraw/zinc/45/01/88/519450188.db2.gz ZHYLNGBDGGEDOG-DZGCQCFKSA-N 1 1 353.467 2.669 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000566400577 519471942 /nfs/dbraw/zinc/47/19/42/519471942.db2.gz BBSDTUILWVNGAD-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591019690 519479839 /nfs/dbraw/zinc/47/98/39/519479839.db2.gz VLYYUYFSSMNPQE-INIZCTEOSA-N 1 1 357.414 2.666 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000569444337 519552727 /nfs/dbraw/zinc/55/27/27/519552727.db2.gz IOKJFQDGQWCWCT-AWEZNQCLSA-N 1 1 373.457 2.650 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000591347902 519603126 /nfs/dbraw/zinc/60/31/26/519603126.db2.gz WYOJGXCJTLWMIC-IBGZPJMESA-N 1 1 360.502 2.978 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000602874564 519941449 /nfs/dbraw/zinc/94/14/49/519941449.db2.gz QCQUJTLYVHSJSX-XQQFMLRXSA-N 1 1 368.865 2.990 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602875312 519942761 /nfs/dbraw/zinc/94/27/61/519942761.db2.gz ZMKYUMDBCXYBKV-RHSMWYFYSA-N 1 1 362.474 2.892 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594419218 519953234 /nfs/dbraw/zinc/95/32/34/519953234.db2.gz PIKLCMFPNBITGP-IRXDYDNUSA-N 1 1 359.426 2.691 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC000599929139 519955251 /nfs/dbraw/zinc/95/52/51/519955251.db2.gz XLWWUTUTOMEWPF-RBUKOAKNSA-N 1 1 367.449 2.941 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600008540 519999247 /nfs/dbraw/zinc/99/92/47/519999247.db2.gz OFACJJAHHKRLMY-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(-c2nc(CCCCn3c[nH+]c(C)c3C)no2)n1 ZINC000594535580 520017198 /nfs/dbraw/zinc/01/71/98/520017198.db2.gz YYLYSSATMFHUQE-UHFFFAOYSA-N 1 1 359.390 2.697 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000594569891 520032954 /nfs/dbraw/zinc/03/29/54/520032954.db2.gz LDTPCNJMCPBNQK-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)n1 ZINC000591987504 520121941 /nfs/dbraw/zinc/12/19/41/520121941.db2.gz YLQGTZRYAVFUBT-CABCVRRESA-N 1 1 370.409 2.534 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000592039535 520148827 /nfs/dbraw/zinc/14/88/27/520148827.db2.gz YXQAEQGGGQLTPS-AWEZNQCLSA-N 1 1 369.487 2.510 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C2 ZINC000597715539 520193750 /nfs/dbraw/zinc/19/37/50/520193750.db2.gz LSYVMCDNOBWZDZ-LJQANCHMSA-N 1 1 360.458 2.731 20 5 FFBDMO CCN(C)C(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130650 520206130 /nfs/dbraw/zinc/20/61/30/520206130.db2.gz HKMYQYGUAPRSKG-QAQDUYKDSA-N 1 1 363.458 2.569 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+](CC(C)C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000592138795 520215041 /nfs/dbraw/zinc/21/50/41/520215041.db2.gz CTDUHGIZVGJOKI-SFHVURJKSA-N 1 1 360.458 2.927 20 5 FFBDMO C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CS1(=O)=O ZINC000594974466 520236662 /nfs/dbraw/zinc/23/66/62/520236662.db2.gz LUCANFQBCTYFKQ-STQMWFEESA-N 1 1 364.423 2.910 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000600473989 520281699 /nfs/dbraw/zinc/28/16/99/520281699.db2.gz VZLYACFLVRAPIV-INIZCTEOSA-N 1 1 361.442 2.805 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000597859850 520287246 /nfs/dbraw/zinc/28/72/46/520287246.db2.gz ZHVDPBYXTQVAIT-NSHDSACASA-N 1 1 357.357 2.799 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000609509299 520337156 /nfs/dbraw/zinc/33/71/56/520337156.db2.gz NMUUMCBCYDROIU-SMDDNHRTSA-N 1 1 367.833 2.711 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597943953 520342735 /nfs/dbraw/zinc/34/27/35/520342735.db2.gz BDTJCIOQKKMUDW-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492823 520415403 /nfs/dbraw/zinc/41/54/03/520415403.db2.gz DJZLNBOLVZQACJ-OAGGEKHMSA-N 1 1 360.458 2.633 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@@H]2CCCC[C@H]21 ZINC000609766496 520426209 /nfs/dbraw/zinc/42/62/09/520426209.db2.gz XIWMMXWTHROFSC-GDBMZVCRSA-N 1 1 361.398 2.536 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(CO[C@H]2CC[NH2+]C2)CC1 ZINC000600762515 520454673 /nfs/dbraw/zinc/45/46/73/520454673.db2.gz CWWQJDGXXPSVLT-SFHVURJKSA-N 1 1 363.458 2.584 20 5 FFBDMO Cc1noc(C[NH2+][C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000595476756 520494671 /nfs/dbraw/zinc/49/46/71/520494671.db2.gz OVPYGNUVNWALDH-CZUORRHYSA-N 1 1 352.341 2.704 20 5 FFBDMO C[N@H+](CCn1cc(Br)cn1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595489279 520503949 /nfs/dbraw/zinc/50/39/49/520503949.db2.gz LWYHMIRZEABCFF-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1cc(Br)cn1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595489279 520503957 /nfs/dbraw/zinc/50/39/57/520503957.db2.gz LWYHMIRZEABCFF-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505022 520513503 /nfs/dbraw/zinc/51/35/03/520513503.db2.gz PKTZHOBACJDRJO-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505022 520513510 /nfs/dbraw/zinc/51/35/10/520513510.db2.gz PKTZHOBACJDRJO-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505022 520513515 /nfs/dbraw/zinc/51/35/15/520513515.db2.gz PKTZHOBACJDRJO-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505022 520513523 /nfs/dbraw/zinc/51/35/23/520513523.db2.gz PKTZHOBACJDRJO-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000595518611 520522941 /nfs/dbraw/zinc/52/29/41/520522941.db2.gz BWDKNKRMHSMMEU-INIZCTEOSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000595518611 520522951 /nfs/dbraw/zinc/52/29/51/520522951.db2.gz BWDKNKRMHSMMEU-INIZCTEOSA-N 1 1 373.384 2.935 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000610160527 520564461 /nfs/dbraw/zinc/56/44/61/520564461.db2.gz VGFSIGKVLNXNSB-QGZVFWFLSA-N 1 1 362.817 2.692 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000610160526 520565162 /nfs/dbraw/zinc/56/51/62/520565162.db2.gz VGFSIGKVLNXNSB-KRWDZBQOSA-N 1 1 362.817 2.692 20 5 FFBDMO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccc([N+](=O)[O-])[nH]1 ZINC000598396340 520595277 /nfs/dbraw/zinc/59/52/77/520595277.db2.gz LEKKECDINZWQAX-INIZCTEOSA-N 1 1 368.437 2.955 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)N(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601105605 520637753 /nfs/dbraw/zinc/63/77/53/520637753.db2.gz DVCUZLAUNBHDDK-KBPBESRZSA-N 1 1 372.425 2.511 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000601125234 520649276 /nfs/dbraw/zinc/64/92/76/520649276.db2.gz YPHNCXDQWWCMGL-NSHDSACASA-N 1 1 361.368 2.515 20 5 FFBDMO Cc1nocc1C[NH2+]Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000601141422 520657799 /nfs/dbraw/zinc/65/77/99/520657799.db2.gz DGCVOSHNKUSWPV-UHFFFAOYSA-N 1 1 373.150 2.786 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000598508855 520669211 /nfs/dbraw/zinc/66/92/11/520669211.db2.gz IPFHKTAJFZMKLZ-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000598508855 520669216 /nfs/dbraw/zinc/66/92/16/520669216.db2.gz IPFHKTAJFZMKLZ-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1cc(-c2ccc(OCC[NH+]3CCN(C)CC3)cc2)cc([N+](=O)[O-])c1 ZINC000592986832 520673669 /nfs/dbraw/zinc/67/36/69/520673669.db2.gz LTKXCIQVVCMDLU-UHFFFAOYSA-N 1 1 371.437 2.897 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598563071 520708593 /nfs/dbraw/zinc/70/85/93/520708593.db2.gz ZYKIENNTZXUVKL-INIZCTEOSA-N 1 1 361.442 2.602 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@@H](CC)CO1 ZINC000593058107 520714849 /nfs/dbraw/zinc/71/48/49/520714849.db2.gz JIBYWNBKBGRJBM-ZFWWWQNUSA-N 1 1 365.430 2.821 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000595825993 520749414 /nfs/dbraw/zinc/74/94/14/520749414.db2.gz ISXBZKSCJCCYFA-QZTJIDSGSA-N 1 1 371.437 2.545 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCN(Cc3cccc4c3CC[NH2+]C4)CC2)c1 ZINC000595886674 520793214 /nfs/dbraw/zinc/79/32/14/520793214.db2.gz YAJKTMGAQVIHIN-UHFFFAOYSA-N 1 1 352.438 2.563 20 5 FFBDMO CC(C)c1ncc2c(n1)CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000598937682 520929931 /nfs/dbraw/zinc/92/99/31/520929931.db2.gz OYSGWVIZTNQFEJ-UHFFFAOYSA-N 1 1 369.425 2.895 20 5 FFBDMO NC(=O)c1cc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000596129517 520930389 /nfs/dbraw/zinc/93/03/89/520930389.db2.gz QRWALBJLUAMQPK-MRXNPFEDSA-N 1 1 354.410 2.770 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000610995344 520936070 /nfs/dbraw/zinc/93/60/70/520936070.db2.gz VMHXCINQZRTMNV-RDJZCZTQSA-N 1 1 372.469 2.790 20 5 FFBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1 ZINC000596180017 520955480 /nfs/dbraw/zinc/95/54/80/520955480.db2.gz WQZGBANUOHFCIQ-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088202 520979757 /nfs/dbraw/zinc/97/97/57/520979757.db2.gz JJFJFIKISMFWLI-JKSUJKDBSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088202 520979761 /nfs/dbraw/zinc/97/97/61/520979761.db2.gz JJFJFIKISMFWLI-JKSUJKDBSA-N 1 1 374.485 2.997 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599021172 520986118 /nfs/dbraw/zinc/98/61/18/520986118.db2.gz SEPUVXNDGFCWTD-GOSISDBHSA-N 1 1 360.458 2.844 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NCC[NH+]1Cc2ccccc2C1 ZINC000611146596 521008599 /nfs/dbraw/zinc/00/85/99/521008599.db2.gz WGCIIDJPDCWOMC-UHFFFAOYSA-N 1 1 364.405 2.751 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000611155711 521013909 /nfs/dbraw/zinc/01/39/09/521013909.db2.gz SBGKJVUJAPASHQ-UHFFFAOYSA-N 1 1 360.458 2.797 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000614585337 521034975 /nfs/dbraw/zinc/03/49/75/521034975.db2.gz RHUSZTSJVXQFRW-HXUWFJFHSA-N 1 1 367.405 2.960 20 5 FFBDMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000596359615 521040315 /nfs/dbraw/zinc/04/03/15/521040315.db2.gz BLDDPRLEJVPXAW-NSHDSACASA-N 1 1 363.384 2.693 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000596359615 521040323 /nfs/dbraw/zinc/04/03/23/521040323.db2.gz BLDDPRLEJVPXAW-NSHDSACASA-N 1 1 363.384 2.693 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCO[C@H](C(F)F)CC2)cccc1[N+](=O)[O-] ZINC000601971051 521048644 /nfs/dbraw/zinc/04/86/44/521048644.db2.gz ANPOJTBVVXRGSK-AWEZNQCLSA-N 1 1 357.357 2.588 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NC[C@@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])c1 ZINC000599138645 521049974 /nfs/dbraw/zinc/04/99/74/521049974.db2.gz IIDYATCRAIOSOC-AWEZNQCLSA-N 1 1 371.441 2.703 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1OC(F)F ZINC000611296514 521086943 /nfs/dbraw/zinc/08/69/43/521086943.db2.gz DWHMAXSQUOWSNV-AWEZNQCLSA-N 1 1 371.384 2.887 20 5 FFBDMO Cn1c2cc(N[C@@H]3CC[N@H+](C4CCCCC4)C3)c([N+](=O)[O-])cc2n(C)c1=O ZINC000596481069 521092260 /nfs/dbraw/zinc/09/22/60/521092260.db2.gz WZDYOSHYNPPNAC-CYBMUJFWSA-N 1 1 373.457 2.604 20 5 FFBDMO O=c1[nH]cnc2cc(NC[C@@H]3CC[N@H+]3Cc3ccccc3)c([N+](=O)[O-])cc21 ZINC000596553338 521128308 /nfs/dbraw/zinc/12/83/08/521128308.db2.gz QFRNDZUMPWHLOJ-AWEZNQCLSA-N 1 1 365.393 2.930 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])ccc1OCCO ZINC000611383889 521128550 /nfs/dbraw/zinc/12/85/50/521128550.db2.gz GYUWKDOJRVYGSV-LBPRGKRZSA-N 1 1 364.373 2.964 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1 ZINC000596627177 521173832 /nfs/dbraw/zinc/17/38/32/521173832.db2.gz VYYMSKBJYMHVNI-LBPRGKRZSA-N 1 1 350.419 2.845 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599463892 521240790 /nfs/dbraw/zinc/24/07/90/521240790.db2.gz GTSLYAJAGMVURO-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000599463892 521240795 /nfs/dbraw/zinc/24/07/95/521240795.db2.gz GTSLYAJAGMVURO-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599512064 521268114 /nfs/dbraw/zinc/26/81/14/521268114.db2.gz YEVZPAMDYKCQJU-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO CC1(C)[C@@H](c2ccc(F)cc2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599623938 521340972 /nfs/dbraw/zinc/34/09/72/521340972.db2.gz XEPDZYWLHDQZSA-IAGOWNOFSA-N 1 1 362.405 2.559 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602430596 521342825 /nfs/dbraw/zinc/34/28/25/521342825.db2.gz JLPQERBIWLYTCS-GFCCVEGCSA-N 1 1 359.348 2.962 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594198140 521464823 /nfs/dbraw/zinc/46/48/23/521464823.db2.gz SJRNZFFUGYKQCH-HZPDHXFCSA-N 1 1 351.834 2.924 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000612094694 521477649 /nfs/dbraw/zinc/47/76/49/521477649.db2.gz RDOLKPSJLCNFGU-DLBZAZTESA-N 1 1 358.394 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc4c3CCOC4)C2)nc1 ZINC000602794758 521535811 /nfs/dbraw/zinc/53/58/11/521535811.db2.gz OXVAXHNQCYHCSP-MRXNPFEDSA-N 1 1 354.410 2.749 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594284289 521536215 /nfs/dbraw/zinc/53/62/15/521536215.db2.gz UXLCAVWDTNONJK-MSOLQXFVSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000602809366 521545557 /nfs/dbraw/zinc/54/55/57/521545557.db2.gz BXADCXHULZBGMD-YJBOKZPZSA-N 1 1 357.458 2.600 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](Cn4ccnn4)C3)cs2)c1 ZINC000597173170 521553566 /nfs/dbraw/zinc/55/35/66/521553566.db2.gz FQGSFOMVJGRBCX-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3cn(C)nc3CC)CC2)ccc1[N+](=O)[O-] ZINC000619432788 521564161 /nfs/dbraw/zinc/56/41/61/521564161.db2.gz YXEGZAGRQKWKME-UHFFFAOYSA-N 1 1 373.457 2.612 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000616129712 521627198 /nfs/dbraw/zinc/62/71/98/521627198.db2.gz YFHURNNTRPOKOZ-UHFFFAOYSA-N 1 1 350.396 2.840 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000616129712 521627201 /nfs/dbraw/zinc/62/72/01/521627201.db2.gz YFHURNNTRPOKOZ-UHFFFAOYSA-N 1 1 350.396 2.840 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC[N@H+]2CCCC(C)(C)C2)c1 ZINC000619584091 521783600 /nfs/dbraw/zinc/78/36/00/521783600.db2.gz YGHIJNKTNVANAX-UHFFFAOYSA-N 1 1 363.458 2.910 20 5 FFBDMO CNc1nccc(C(=O)NCc2cccc(C[N@@H+](C)C(C)C)c2)c1[N+](=O)[O-] ZINC000515069672 561995168 /nfs/dbraw/zinc/99/51/68/561995168.db2.gz KPXDZDBVXUWOPO-UHFFFAOYSA-N 1 1 371.441 2.802 20 5 FFBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(-c2nn[nH]n2)c1 ZINC000824633267 608487551 /nfs/dbraw/zinc/48/75/51/608487551.db2.gz JLPFBHFHNVNIDA-SNVBAGLBSA-N 1 1 365.353 2.767 20 5 FFBDMO Cc1ccnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c1[N+](=O)[O-] ZINC001164899728 721520943 /nfs/dbraw/zinc/52/09/43/721520943.db2.gz LYRBLYQERJPRDH-RDJZCZTQSA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000746671948 735503470 /nfs/dbraw/zinc/50/34/70/735503470.db2.gz CQITUZMFUPZIBT-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCS(=O)(=O)c2ccc(F)cc2)c1 ZINC000132625224 728724949 /nfs/dbraw/zinc/72/49/49/728724949.db2.gz ALFYXCILQDGKAL-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCCC2)c1 ZINC000135297566 728737275 /nfs/dbraw/zinc/73/72/75/728737275.db2.gz GHNBWRONIIIFGP-AEFFLSMTSA-N 1 1 350.463 2.977 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000856799419 730358501 /nfs/dbraw/zinc/35/85/01/730358501.db2.gz DLPIRKGVQMVEEQ-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NCC[N@@H+]1CC[C@H](O)C1 ZINC000858867791 730435275 /nfs/dbraw/zinc/43/52/75/730435275.db2.gz RXDOYWKVIULIMN-QMMMGPOBSA-N 1 1 353.728 2.746 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000861037624 730569607 /nfs/dbraw/zinc/56/96/07/730569607.db2.gz CLZJGAKXKUGHPD-AWEZNQCLSA-N 1 1 350.415 2.526 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000861349840 730602884 /nfs/dbraw/zinc/60/28/84/730602884.db2.gz WDWIFXKPTKHWGM-KSSFIOAISA-N 1 1 350.415 2.984 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1Cl)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861986277 730658897 /nfs/dbraw/zinc/65/88/97/730658897.db2.gz KXPAWFRKXGDDNA-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(=O)NCC(F)(F)F ZINC000872027088 731721558 /nfs/dbraw/zinc/72/15/58/731721558.db2.gz HHDKHBUEGXBOCX-MRVPVSSYSA-N 1 1 351.350 2.646 20 5 FFBDMO COCCNC(=O)[C@H](CC(C)C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872058746 731724693 /nfs/dbraw/zinc/72/46/93/731724693.db2.gz YKPJYCHHZMICGA-OCCSQVGLSA-N 1 1 355.410 2.562 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H](C)C[N@H+]1C ZINC000878336203 732516255 /nfs/dbraw/zinc/51/62/55/732516255.db2.gz UXEIFBFBNYIOGV-MNOVXSKESA-N 1 1 365.821 2.823 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419276 732699729 /nfs/dbraw/zinc/69/97/29/732699729.db2.gz LCELFTSNRKJPLC-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419276 732699733 /nfs/dbraw/zinc/69/97/33/732699733.db2.gz LCELFTSNRKJPLC-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1 ZINC000782482437 738726095 /nfs/dbraw/zinc/72/60/95/738726095.db2.gz WLNXZZCLFFEZJN-UHFFFAOYSA-N 1 1 353.394 2.954 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]2COCC[C@@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000782510394 738728774 /nfs/dbraw/zinc/72/87/74/738728774.db2.gz HTLDPQVDFXYEGH-WBMJQRKESA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886561514 733802379 /nfs/dbraw/zinc/80/23/79/733802379.db2.gz AGLJVDNZLVURMU-GARJFASQSA-N 1 1 355.847 2.870 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886561514 733802381 /nfs/dbraw/zinc/80/23/81/733802381.db2.gz AGLJVDNZLVURMU-GARJFASQSA-N 1 1 355.847 2.870 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000890068330 734261216 /nfs/dbraw/zinc/26/12/16/734261216.db2.gz NLQOPJMSOBILDJ-UHFFFAOYSA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105069 738825584 /nfs/dbraw/zinc/82/55/84/738825584.db2.gz ZDTNSSAOIBHGGM-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc([N+](=O)[O-])ccc1Cl ZINC000928105069 738825589 /nfs/dbraw/zinc/82/55/89/738825589.db2.gz ZDTNSSAOIBHGGM-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000740886551 735095419 /nfs/dbraw/zinc/09/54/19/735095419.db2.gz UEZPBVNWESJBRW-JSGCOSHPSA-N 1 1 368.865 2.991 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)[C@@H]2C1 ZINC000897826190 735280995 /nfs/dbraw/zinc/28/09/95/735280995.db2.gz VAUXOWMCXWLPML-OIBJUYFYSA-N 1 1 362.188 2.817 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C[C@@H](n2cncn2)C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000903210501 736055901 /nfs/dbraw/zinc/05/59/01/736055901.db2.gz YOQVSZAZUWWPMN-TVQRCGJNSA-N 1 1 359.308 2.649 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC[NH+]1CCSCC1 ZINC000757945093 736437995 /nfs/dbraw/zinc/43/79/95/736437995.db2.gz HIIURSJAWOBUSX-LBPRGKRZSA-N 1 1 356.469 2.667 20 5 FFBDMO CN(C(=O)CCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000906649791 736529216 /nfs/dbraw/zinc/52/92/16/736529216.db2.gz CWAXHJSYWKJVAC-OAHLLOKOSA-N 1 1 351.834 2.876 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000907793135 736668107 /nfs/dbraw/zinc/66/81/07/736668107.db2.gz JSJZNTLAPYNPAF-HOTGVXAUSA-N 1 1 369.824 2.826 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C[C@@H]2C1 ZINC000908294918 736754127 /nfs/dbraw/zinc/75/41/27/736754127.db2.gz WNAUVTLXCJUWMI-KGLIPLIRSA-N 1 1 351.834 2.591 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000908358118 736763292 /nfs/dbraw/zinc/76/32/92/736763292.db2.gz LLHJHVCMXNKMBO-LLVKDONJSA-N 1 1 366.849 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000765451589 737120161 /nfs/dbraw/zinc/12/01/61/737120161.db2.gz ADJXSZWZNCVHHK-ZDUSSCGKSA-N 1 1 370.247 2.658 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1F ZINC000771730119 737750072 /nfs/dbraw/zinc/75/00/72/737750072.db2.gz BEBIBRNAXXHZTD-OLZOCXBDSA-N 1 1 373.450 2.584 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000773602745 737923464 /nfs/dbraw/zinc/92/34/64/737923464.db2.gz BHCCUWHLHHXPJG-UHFFFAOYSA-N 1 1 360.189 2.781 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879937 738135054 /nfs/dbraw/zinc/13/50/54/738135054.db2.gz MGIHIWQYJBXFGN-CHWSQXEVSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775879937 738135057 /nfs/dbraw/zinc/13/50/57/738135057.db2.gz MGIHIWQYJBXFGN-CHWSQXEVSA-N 1 1 356.806 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2CCC[C@H](C3OCCO3)C2)c1 ZINC000929494358 738992833 /nfs/dbraw/zinc/99/28/33/738992833.db2.gz LBNGNHXMEWUFEV-NSHDSACASA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CCC[C@H](C3OCCO3)C2)c1 ZINC000929494358 738992836 /nfs/dbraw/zinc/99/28/36/738992836.db2.gz LBNGNHXMEWUFEV-NSHDSACASA-N 1 1 371.231 2.942 20 5 FFBDMO NC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2Br)CCCCC1 ZINC000930019452 739049175 /nfs/dbraw/zinc/04/91/75/739049175.db2.gz UJQSCJUUUXFSEI-UHFFFAOYSA-N 1 1 356.220 2.635 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H](C)O1 ZINC000788477195 739248491 /nfs/dbraw/zinc/24/84/91/739248491.db2.gz VCPCLEALYNAYQH-IIAWOOMASA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H](C)O1 ZINC000788477195 739248494 /nfs/dbraw/zinc/24/84/94/739248494.db2.gz VCPCLEALYNAYQH-IIAWOOMASA-N 1 1 351.422 2.808 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCc1ccc([N+](=O)[O-])cc1F ZINC000789653372 739377579 /nfs/dbraw/zinc/37/75/79/739377579.db2.gz RUTOXEXWANQFCV-UHFFFAOYSA-N 1 1 356.354 2.647 20 5 FFBDMO CC(C)(C)[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000790431735 739453346 /nfs/dbraw/zinc/45/33/46/739453346.db2.gz QFLXVNRPCROALS-HNNXBMFYSA-N 1 1 353.394 2.809 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@H](C)C1 ZINC000933437412 739625094 /nfs/dbraw/zinc/62/50/94/739625094.db2.gz CJRZSJOAEAPYBI-SKDRFNHKSA-N 1 1 372.828 2.772 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000933977134 739713550 /nfs/dbraw/zinc/71/35/50/739713550.db2.gz ZBLHOOCWULDPGF-IAGOWNOFSA-N 1 1 362.455 2.542 20 5 FFBDMO CC1(C)CCC(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000940107060 740147070 /nfs/dbraw/zinc/14/70/70/740147070.db2.gz FWCVWLOSJIXWQR-HZPDHXFCSA-N 1 1 351.491 2.839 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)CNC(=O)OC(C)(C)C ZINC000797518961 740252815 /nfs/dbraw/zinc/25/28/15/740252815.db2.gz PNIIILWAPUSLRX-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)CNC(=O)OC(C)(C)C ZINC000797518961 740252817 /nfs/dbraw/zinc/25/28/17/740252817.db2.gz PNIIILWAPUSLRX-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000804407213 740869882 /nfs/dbraw/zinc/86/98/82/740869882.db2.gz RHYXFKKSWUXUKG-OAHLLOKOSA-N 1 1 354.838 2.603 20 5 FFBDMO CC(C)(C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+]1CCCC1 ZINC000805610862 740991341 /nfs/dbraw/zinc/99/13/41/740991341.db2.gz KMXAOHUJWZEKCC-UHFFFAOYSA-N 1 1 369.805 2.604 20 5 FFBDMO CNC(=O)OC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000805825237 741014410 /nfs/dbraw/zinc/01/44/10/741014410.db2.gz OIVUCQFZEBBSBL-HNNXBMFYSA-N 1 1 351.403 2.574 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000812387775 741615975 /nfs/dbraw/zinc/61/59/75/741615975.db2.gz REWDPHGOCRDDFF-LLVKDONJSA-N 1 1 352.391 2.662 20 5 FFBDMO C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000814655902 741854046 /nfs/dbraw/zinc/85/40/46/741854046.db2.gz KDEUMTMERGXNIX-RNCFNFMXSA-N 1 1 367.203 2.532 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000815232247 741915264 /nfs/dbraw/zinc/91/52/64/741915264.db2.gz CZAXFHVEIIBNRA-KRWDZBQOSA-N 1 1 369.849 2.917 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000815232247 741915267 /nfs/dbraw/zinc/91/52/67/741915267.db2.gz CZAXFHVEIIBNRA-KRWDZBQOSA-N 1 1 369.849 2.917 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)CC12CCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000817291530 742118979 /nfs/dbraw/zinc/11/89/79/742118979.db2.gz OEIARGFURRHQMN-LBPRGKRZSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)CC12CCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000817291530 742118982 /nfs/dbraw/zinc/11/89/82/742118982.db2.gz OEIARGFURRHQMN-LBPRGKRZSA-N 1 1 353.806 2.566 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCC2CCCCCC2)CC1 ZINC001005380569 742253156 /nfs/dbraw/zinc/25/31/56/742253156.db2.gz DSEAVLRRMLCIJG-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964787 742823637 /nfs/dbraw/zinc/82/36/37/742823637.db2.gz ZODDWGXWVWEDBP-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964787 742823642 /nfs/dbraw/zinc/82/36/42/742823642.db2.gz ZODDWGXWVWEDBP-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964787 742823650 /nfs/dbraw/zinc/82/36/50/742823650.db2.gz ZODDWGXWVWEDBP-IAGOWNOFSA-N 1 1 365.861 2.676 20 5 FFBDMO Cc1cc(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001045437671 743274877 /nfs/dbraw/zinc/27/48/77/743274877.db2.gz YEGIJZYBICARGN-HUUCEWRRSA-N 1 1 351.472 2.501 20 5 FFBDMO Cc1cccc(Cl)c1C[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001045437462 743274914 /nfs/dbraw/zinc/27/49/14/743274914.db2.gz SFWKDFYWQZRYMT-CZUORRHYSA-N 1 1 365.861 2.784 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc(Cl)s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325775 743511594 /nfs/dbraw/zinc/51/15/94/743511594.db2.gz MHSLQIILHVWQFA-HBJVGIJOSA-N 1 1 371.890 2.831 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC[C@H]21 ZINC000827247190 743541788 /nfs/dbraw/zinc/54/17/88/743541788.db2.gz VKLGSWYNABMJFB-GXFFZTMASA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]21 ZINC000827254390 743542170 /nfs/dbraw/zinc/54/21/70/743542170.db2.gz PCVXXYFWNPEZTG-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000827598505 743608961 /nfs/dbraw/zinc/60/89/61/743608961.db2.gz ROKHRKYCYGJBMS-HDICACEKSA-N 1 1 365.861 2.981 20 5 FFBDMO C[C@@H]1CN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000830083158 745303113 /nfs/dbraw/zinc/30/31/13/745303113.db2.gz ZEDCEMDSUNSHKQ-GFCCVEGCSA-N 1 1 366.849 2.603 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2Br)C1 ZINC000839440591 746828431 /nfs/dbraw/zinc/82/84/31/746828431.db2.gz WCOUTZRIAVOQKZ-GFCCVEGCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000839440612 746828588 /nfs/dbraw/zinc/82/85/88/746828588.db2.gz XCDLASWANXPZGV-GFCCVEGCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CCC(=O)N1 ZINC000839670341 746887270 /nfs/dbraw/zinc/88/72/70/746887270.db2.gz UAKMGRGNVXVFIH-LBPRGKRZSA-N 1 1 370.247 2.846 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(Cl)cc1NCC1([NH+]2CCOCC2)CCOCC1 ZINC000845564726 748282733 /nfs/dbraw/zinc/28/27/33/748282733.db2.gz UASUESSFIRRCIK-UHFFFAOYSA-N 1 1 373.812 2.681 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1SC ZINC000845816835 748330295 /nfs/dbraw/zinc/33/02/95/748330295.db2.gz ZRSLFCWGDCUADB-MNOVXSKESA-N 1 1 354.428 2.822 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(C(F)F)CC1 ZINC000848482174 748937890 /nfs/dbraw/zinc/93/78/90/748937890.db2.gz LECYYXCGZHLDIX-HNNXBMFYSA-N 1 1 353.369 2.845 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCO ZINC000852455993 749864196 /nfs/dbraw/zinc/86/41/96/749864196.db2.gz HMVUSVQQZSNFIB-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCO ZINC000852455993 749864204 /nfs/dbraw/zinc/86/42/04/749864204.db2.gz HMVUSVQQZSNFIB-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C2 ZINC000854734897 750361117 /nfs/dbraw/zinc/36/11/17/750361117.db2.gz FRPXFQYXEHUYFI-QGZVFWFLSA-N 1 1 369.824 2.874 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)c2ccccc2N1 ZINC000759893490 971911212 /nfs/dbraw/zinc/91/12/12/971911212.db2.gz CSMDIYRRQPTEDZ-KRWDZBQOSA-N 1 1 366.421 2.670 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@@H](N3CC(=O)Nc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000759898889 971921497 /nfs/dbraw/zinc/92/14/97/971921497.db2.gz HWOYBNDAMTZLRF-MRXNPFEDSA-N 1 1 366.421 2.936 20 5 FFBDMO Cc1c(C(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)cnn1-c1cc[nH+]cc1 ZINC001143377272 960130544 /nfs/dbraw/zinc/13/05/44/960130544.db2.gz UVHILNOGETYIHX-UHFFFAOYSA-N 1 1 373.319 2.692 20 5 FFBDMO COc1cc(C[NH2+]Cc2cccc(C3(C)OCCO3)c2)c([N+](=O)[O-])cc1O ZINC001202536072 1013291824 /nfs/dbraw/zinc/29/18/24/1013291824.db2.gz IJBIQLNLHDBAMU-UHFFFAOYSA-N 1 1 374.393 2.818 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121237983 963069279 /nfs/dbraw/zinc/06/92/79/963069279.db2.gz AWQKGYKOUDTFGT-AWEZNQCLSA-N 1 1 354.414 2.509 20 5 FFBDMO Cn1c2ccccc2c(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1=O ZINC000894476030 965403291 /nfs/dbraw/zinc/40/32/91/965403291.db2.gz MEZMGCIJHJOBJK-CYBMUJFWSA-N 1 1 358.442 2.979 20 5 FFBDMO CC(C)Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1 ZINC000983657622 965685104 /nfs/dbraw/zinc/68/51/04/965685104.db2.gz KKWFHVJPXZGHPP-NCXUSEDFSA-N 1 1 359.470 2.535 20 5 FFBDMO C[N@@H+]1CCc2c(NCc3cc(Br)no3)ccc([N+](=O)[O-])c2C1 ZINC001167502913 965831346 /nfs/dbraw/zinc/83/13/46/965831346.db2.gz GRSRZGPSDCEMHM-UHFFFAOYSA-N 1 1 367.203 2.945 20 5 FFBDMO C[N@H+]1CCc2c(NCc3cc(Br)no3)ccc([N+](=O)[O-])c2C1 ZINC001167502913 965831358 /nfs/dbraw/zinc/83/13/58/965831358.db2.gz GRSRZGPSDCEMHM-UHFFFAOYSA-N 1 1 367.203 2.945 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N ZINC000729526569 967740092 /nfs/dbraw/zinc/74/00/92/967740092.db2.gz CRFGEIYXWZDEIS-UHFFFAOYSA-N 1 1 365.393 2.910 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3C[C@@]3(CO)C2)cc1OC ZINC000782619269 969184841 /nfs/dbraw/zinc/18/48/41/969184841.db2.gz ISYXLUHURJTARR-OHNRDTAOSA-N 1 1 364.442 2.843 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)cc1OC ZINC000782619269 969184846 /nfs/dbraw/zinc/18/48/46/969184846.db2.gz ISYXLUHURJTARR-OHNRDTAOSA-N 1 1 364.442 2.843 20 5 FFBDMO C[C@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000875160961 1013982405 /nfs/dbraw/zinc/98/24/05/1013982405.db2.gz DLDBPCYQHSMXPE-KKXDTOCCSA-N 1 1 372.425 2.668 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000825842157 1014110555 /nfs/dbraw/zinc/11/05/55/1014110555.db2.gz ZJDYMPHCSFILGF-HOTGVXAUSA-N 1 1 361.442 2.621 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1C ZINC001211756712 977796848 /nfs/dbraw/zinc/79/68/48/977796848.db2.gz YQJTWASAWLHUHE-MRXNPFEDSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1ccc(CC[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cc1 ZINC001482029645 977930713 /nfs/dbraw/zinc/93/07/13/977930713.db2.gz MPJCVGDZLVNSOC-WOJBJXKFSA-N 1 1 367.449 2.609 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000249107228 979415304 /nfs/dbraw/zinc/41/53/04/979415304.db2.gz QPNIVJNVDXWCPE-TYNCELHUSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000249107228 979415309 /nfs/dbraw/zinc/41/53/09/979415309.db2.gz QPNIVJNVDXWCPE-TYNCELHUSA-N 1 1 374.397 2.837 20 5 FFBDMO COc1cc([C@H](C)[NH2+]CC(=O)NCCc2ccccc2)cc([N+](=O)[O-])c1 ZINC000903135401 980000364 /nfs/dbraw/zinc/00/03/64/980000364.db2.gz IYFIJNAWIMGUPP-AWEZNQCLSA-N 1 1 357.410 2.613 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[NH3+])[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000904411378 980270027 /nfs/dbraw/zinc/27/00/27/980270027.db2.gz UXAMTQGVUXTRKZ-RYUDHWBXSA-N 1 1 373.400 2.664 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@H+](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000729682643 981284723 /nfs/dbraw/zinc/28/47/23/981284723.db2.gz XMGAVQZKDDUZJF-KRWDZBQOSA-N 1 1 371.437 2.976 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000729682643 981284729 /nfs/dbraw/zinc/28/47/29/981284729.db2.gz XMGAVQZKDDUZJF-KRWDZBQOSA-N 1 1 371.437 2.976 20 5 FFBDMO CCOC(=O)[C@@H](C)C1C[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000877828159 1014746379 /nfs/dbraw/zinc/74/63/79/1014746379.db2.gz AYFJPZYZCLXZRA-ZDUSSCGKSA-N 1 1 372.425 2.626 20 5 FFBDMO CNc1c(C(=O)Nc2ccc(-n3cc[nH+]c3C)nc2)cccc1[N+](=O)[O-] ZINC000765372115 985047176 /nfs/dbraw/zinc/04/71/76/985047176.db2.gz ITWIVPOGZJCJTO-UHFFFAOYSA-N 1 1 352.354 2.778 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccc(C(F)F)cc2)CC1 ZINC000997771614 985733370 /nfs/dbraw/zinc/73/33/70/985733370.db2.gz ILWJFTJWCFRNIG-HZPDHXFCSA-N 1 1 367.396 2.618 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(Cc1nnc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000878662591 1015156319 /nfs/dbraw/zinc/15/63/19/1015156319.db2.gz RJBAXZUKWAZRIX-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CC[NH+](CCCCCO)CC1 ZINC000913696030 986843320 /nfs/dbraw/zinc/84/33/20/986843320.db2.gz ZCWKFYGJCWRTFZ-UHFFFAOYSA-N 1 1 371.437 2.668 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002787152 987475831 /nfs/dbraw/zinc/47/58/31/987475831.db2.gz GSCXXVOSACHNAX-RTBURBONSA-N 1 1 353.422 2.586 20 5 FFBDMO C[C@@H]([N@@H+](C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C(C)(C)C ZINC000914568721 987792548 /nfs/dbraw/zinc/79/25/48/987792548.db2.gz OBAVCWCDIMWTDB-KZULUSFZSA-N 1 1 362.430 2.686 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]2CC1 ZINC000946589107 988771774 /nfs/dbraw/zinc/77/17/74/988771774.db2.gz GKILVKIVLBNHIO-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]2CC1 ZINC000946589107 988771802 /nfs/dbraw/zinc/77/18/02/988771802.db2.gz GKILVKIVLBNHIO-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]2CC1 ZINC000946589107 988771813 /nfs/dbraw/zinc/77/18/13/988771813.db2.gz GKILVKIVLBNHIO-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000130504561 990545508 /nfs/dbraw/zinc/54/55/08/990545508.db2.gz FYDOEEZKNQVPID-UHFFFAOYSA-N 1 1 371.740 2.761 20 5 FFBDMO CCc1nn(C)c(CC)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000179535260 991288730 /nfs/dbraw/zinc/28/87/30/991288730.db2.gz FSDWBLJHFOMYTA-UHFFFAOYSA-N 1 1 357.458 2.775 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](CO)c1ccccc1 ZINC000880462222 1015840459 /nfs/dbraw/zinc/84/04/59/1015840459.db2.gz QREPMTASYJWMFE-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](CO)c1ccccc1 ZINC000880462222 1015840466 /nfs/dbraw/zinc/84/04/66/1015840466.db2.gz QREPMTASYJWMFE-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CCC(CC)[N@@H+](CC)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000808782159 994259918 /nfs/dbraw/zinc/25/99/18/994259918.db2.gz IFSKRMUMHCOVKW-UHFFFAOYSA-N 1 1 362.474 2.754 20 5 FFBDMO CN(CCOC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000810556024 994817298 /nfs/dbraw/zinc/81/72/98/994817298.db2.gz WZRWZLCAWCUIRK-SFHVURJKSA-N 1 1 367.421 2.787 20 5 FFBDMO COC(=O)c1cc(NC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])c1 ZINC000813009014 995597570 /nfs/dbraw/zinc/59/75/70/995597570.db2.gz CWWSWKMNKHLROF-KRWDZBQOSA-N 1 1 367.377 2.532 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])n1C ZINC000824417402 996950345 /nfs/dbraw/zinc/95/03/45/996950345.db2.gz VVTIKWDJNGQLHQ-GOEBONIOSA-N 1 1 354.410 2.690 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000825198609 997272928 /nfs/dbraw/zinc/27/29/28/997272928.db2.gz IFVYHEYKEAJAOS-INIZCTEOSA-N 1 1 355.394 2.704 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741024156 999704443 /nfs/dbraw/zinc/70/44/43/999704443.db2.gz RCXHVFNRGVRNSB-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741024156 999704446 /nfs/dbraw/zinc/70/44/46/999704446.db2.gz RCXHVFNRGVRNSB-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000742154158 999762432 /nfs/dbraw/zinc/76/24/32/999762432.db2.gz DPVQCVYVAPIDBY-ZIAGYGMSSA-N 1 1 360.414 2.831 20 5 FFBDMO CC[C@]1(C)CCC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000743389349 999816263 /nfs/dbraw/zinc/81/62/63/999816263.db2.gz WQHUSOOVUAWHSC-GOSISDBHSA-N 1 1 360.414 2.833 20 5 FFBDMO CC[C@]1(C)CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000743389349 999816264 /nfs/dbraw/zinc/81/62/64/999816264.db2.gz WQHUSOOVUAWHSC-GOSISDBHSA-N 1 1 360.414 2.833 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169011641 1000015545 /nfs/dbraw/zinc/01/55/45/1000015545.db2.gz LWVMMTXMISOGCL-HDMKZQKVSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169011909 1000015660 /nfs/dbraw/zinc/01/56/60/1000015660.db2.gz NHCSVVAZHMBHEO-LSDHHAIUSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169035777 1000016741 /nfs/dbraw/zinc/01/67/41/1000016741.db2.gz LUDXHXDUPPEMQQ-XUWVNRHRSA-N 1 1 353.463 2.621 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCN(c3c(Cl)cncc3Cl)CC2)C1 ZINC001169036692 1000016767 /nfs/dbraw/zinc/01/67/67/1000016767.db2.gz PPOHJXSFWSFZHA-RYUDHWBXSA-N 1 1 359.257 2.956 20 5 FFBDMO Nc1ccc(Br)c2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169038628 1000016893 /nfs/dbraw/zinc/01/68/93/1000016893.db2.gz JKRXFXNOTIKVGU-WDEREUQCSA-N 1 1 354.248 2.835 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024547 1000017825 /nfs/dbraw/zinc/01/78/25/1000017825.db2.gz XAQVAYBZNGNWSS-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nn(CC3CC3)cc21 ZINC001169024547 1000017827 /nfs/dbraw/zinc/01/78/27/1000017827.db2.gz XAQVAYBZNGNWSS-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2cnc(F)c([N+](=O)[O-])c2)c2ccccc12 ZINC001169116398 1000022513 /nfs/dbraw/zinc/02/25/13/1000022513.db2.gz NDZVHSOMPZHDIM-SFHVURJKSA-N 1 1 372.356 2.506 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@@H](C)C[N@@H+]1C ZINC000769147143 1000434996 /nfs/dbraw/zinc/43/49/96/1000434996.db2.gz VHBXBWSJZMVTOP-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@@H](C)C[N@H+]1C ZINC000769147143 1000435000 /nfs/dbraw/zinc/43/50/00/1000435000.db2.gz VHBXBWSJZMVTOP-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO COc1cc(C(=O)OCCn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC(F)F ZINC000771878096 1001226632 /nfs/dbraw/zinc/22/66/32/1001226632.db2.gz WMLCYILHYNUCIJ-UHFFFAOYSA-N 1 1 371.296 2.567 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@@H+]1C ZINC000787391060 1001689630 /nfs/dbraw/zinc/68/96/30/1001689630.db2.gz RBCOEOHQODZYAH-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000787391060 1001689632 /nfs/dbraw/zinc/68/96/32/1001689632.db2.gz RBCOEOHQODZYAH-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000746715027 1001732187 /nfs/dbraw/zinc/73/21/87/1001732187.db2.gz UTOIUFOPQODNRK-UHFFFAOYSA-N 1 1 357.414 2.518 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2cc(F)ccc2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001276199608 1016524684 /nfs/dbraw/zinc/52/46/84/1016524684.db2.gz BVACTSBODLJVDA-GDBMZVCRSA-N 1 1 367.396 2.539 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000790125416 1002293352 /nfs/dbraw/zinc/29/33/52/1002293352.db2.gz SIBCRMWESZQBNG-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000790125416 1002293360 /nfs/dbraw/zinc/29/33/60/1002293360.db2.gz SIBCRMWESZQBNG-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO O=[N+]([O-])c1cncc(Cl)c1NCC1([NH+]2CCSCC2)CCCC1 ZINC001184831072 1002730903 /nfs/dbraw/zinc/73/09/03/1002730903.db2.gz QFPKSAKSHGWEPA-UHFFFAOYSA-N 1 1 356.879 2.839 20 5 FFBDMO C[C@@H](CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC001184839250 1002734343 /nfs/dbraw/zinc/73/43/43/1002734343.db2.gz FOODNWFTRLULNS-KGLIPLIRSA-N 1 1 358.442 2.979 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1 ZINC001170354375 1003121580 /nfs/dbraw/zinc/12/15/80/1003121580.db2.gz JVJNEBXINALODY-ZFWWWQNUSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](Oc3nccnc3C)C2)c([N+](=O)[O-])c1 ZINC001170354834 1003122922 /nfs/dbraw/zinc/12/29/22/1003122922.db2.gz QBKAVSZTJNUSBE-CXAGYDPISA-N 1 1 372.425 2.786 20 5 FFBDMO CCOC(=O)[C@H]1C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355044 1003122984 /nfs/dbraw/zinc/12/29/84/1003122984.db2.gz VJUYFCPGJUAIHZ-BLLLJJGKSA-N 1 1 368.455 2.515 20 5 FFBDMO CCOC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355044 1003122988 /nfs/dbraw/zinc/12/29/88/1003122988.db2.gz VJUYFCPGJUAIHZ-BLLLJJGKSA-N 1 1 368.455 2.515 20 5 FFBDMO CC(C)c1ccccc1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001400034 1016783146 /nfs/dbraw/zinc/78/31/46/1016783146.db2.gz PJWHCCGCHNALEQ-RTBURBONSA-N 1 1 359.470 2.803 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@H]1C[N@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC001196470063 1003779715 /nfs/dbraw/zinc/77/97/15/1003779715.db2.gz MMQYOLRHXZCJBX-KBXCAEBGSA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@H]1C[N@@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC001196470063 1003779718 /nfs/dbraw/zinc/77/97/18/1003779718.db2.gz MMQYOLRHXZCJBX-KBXCAEBGSA-N 1 1 362.430 2.869 20 5 FFBDMO C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000804720342 1003799373 /nfs/dbraw/zinc/79/93/73/1003799373.db2.gz ROFBQRYBFREBOI-INIZCTEOSA-N 1 1 351.410 2.606 20 5 FFBDMO CC[C@H](C)C[N@@H+](CC)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001191375721 1003805398 /nfs/dbraw/zinc/80/53/98/1003805398.db2.gz WZSRFZVWQMAERU-INIZCTEOSA-N 1 1 362.474 2.611 20 5 FFBDMO CC[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H]1O ZINC001193002221 1004338202 /nfs/dbraw/zinc/33/82/02/1004338202.db2.gz LAVIBFZFVYCWPL-RNCFNFMXSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H]1O ZINC001193002221 1004338211 /nfs/dbraw/zinc/33/82/11/1004338211.db2.gz LAVIBFZFVYCWPL-RNCFNFMXSA-N 1 1 352.778 2.501 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccnn1C ZINC001198156097 1004513178 /nfs/dbraw/zinc/51/31/78/1004513178.db2.gz DZMHAABDPUCADD-MRXNPFEDSA-N 1 1 373.413 2.503 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C1CC1 ZINC000101958688 1004964114 /nfs/dbraw/zinc/96/41/14/1004964114.db2.gz XYXITQJYUFKUCN-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC(C)(C)C1 ZINC001050245045 1016930096 /nfs/dbraw/zinc/93/00/96/1016930096.db2.gz XMSNZAJMVICLGJ-QZTJIDSGSA-N 1 1 359.470 2.836 20 5 FFBDMO C[N@@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(C)(C)C1 ZINC001050245045 1016930109 /nfs/dbraw/zinc/93/01/09/1016930109.db2.gz XMSNZAJMVICLGJ-QZTJIDSGSA-N 1 1 359.470 2.836 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(C)(C)C1 ZINC001050245045 1016930122 /nfs/dbraw/zinc/93/01/22/1016930122.db2.gz XMSNZAJMVICLGJ-QZTJIDSGSA-N 1 1 359.470 2.836 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000106867615 1005364989 /nfs/dbraw/zinc/36/49/89/1005364989.db2.gz VAALQZODRMTPQY-CQSZACIVSA-N 1 1 365.430 2.963 20 5 FFBDMO C[C@H]1CO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000851415945 1005884986 /nfs/dbraw/zinc/88/49/86/1005884986.db2.gz QXXFOEYPUDVSSF-RDJZCZTQSA-N 1 1 364.442 2.655 20 5 FFBDMO C[C@H]1CO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000851415945 1005884988 /nfs/dbraw/zinc/88/49/88/1005884988.db2.gz QXXFOEYPUDVSSF-RDJZCZTQSA-N 1 1 364.442 2.655 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153212 1005946076 /nfs/dbraw/zinc/94/60/76/1005946076.db2.gz CRQXKYNCNJWBSX-YPMHNXCESA-N 1 1 368.434 2.874 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000852153212 1005946078 /nfs/dbraw/zinc/94/60/78/1005946078.db2.gz CRQXKYNCNJWBSX-YPMHNXCESA-N 1 1 368.434 2.874 20 5 FFBDMO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000776582880 1005954468 /nfs/dbraw/zinc/95/44/68/1005954468.db2.gz CZPABNTVACQBQA-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000776582880 1005954470 /nfs/dbraw/zinc/95/44/70/1005954470.db2.gz CZPABNTVACQBQA-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580517 1005960990 /nfs/dbraw/zinc/96/09/90/1005960990.db2.gz VYLMDUQXSLRZSW-ZVZYQTTQSA-N 1 1 363.458 2.645 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591196 1005985372 /nfs/dbraw/zinc/98/53/72/1005985372.db2.gz HLOSTYMWISFEJB-HZPDHXFCSA-N 1 1 365.430 2.569 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000776595896 1006038263 /nfs/dbraw/zinc/03/82/63/1006038263.db2.gz CEBRWAIZVCYMSC-ZBFHGGJFSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595896 1006038278 /nfs/dbraw/zinc/03/82/78/1006038278.db2.gz CEBRWAIZVCYMSC-ZBFHGGJFSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595896 1006038291 /nfs/dbraw/zinc/03/82/91/1006038291.db2.gz CEBRWAIZVCYMSC-ZBFHGGJFSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853503305 1006416908 /nfs/dbraw/zinc/41/69/08/1006416908.db2.gz GJNSHIGOBAJSBA-HUUCEWRRSA-N 1 1 357.414 2.559 20 5 FFBDMO CC(C)[C@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCCC1 ZINC000132523988 1006946016 /nfs/dbraw/zinc/94/60/16/1006946016.db2.gz NLHMQIRKGVXYBI-QGZVFWFLSA-N 1 1 363.414 2.587 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000856478821 1007847715 /nfs/dbraw/zinc/84/77/15/1007847715.db2.gz GBVFCXJTFGWUAF-AWEZNQCLSA-N 1 1 367.396 2.925 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000885951721 1007849373 /nfs/dbraw/zinc/84/93/73/1007849373.db2.gz OUOATYGCXLLEAU-OAHLLOKOSA-N 1 1 356.430 2.687 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2nnc3n2CCCCC3)C1 ZINC000885951721 1007849381 /nfs/dbraw/zinc/84/93/81/1007849381.db2.gz OUOATYGCXLLEAU-OAHLLOKOSA-N 1 1 356.430 2.687 20 5 FFBDMO Nc1ccc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000114694406 1008017992 /nfs/dbraw/zinc/01/79/92/1008017992.db2.gz YZQTXRFBWZGLLJ-MRXNPFEDSA-N 1 1 354.410 2.571 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@](O)(c3ccccc3)C2)c2c(c1)COCO2 ZINC000859585453 1008575165 /nfs/dbraw/zinc/57/51/65/1008575165.db2.gz QNYGIMVKPPVLDO-FQEVSTJZSA-N 1 1 370.405 2.945 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859611384 1008586902 /nfs/dbraw/zinc/58/69/02/1008586902.db2.gz CVIQYZPVHPUPLL-COXVUDFISA-N 1 1 364.442 2.928 20 5 FFBDMO C[C@H]1C[C@H]1c1noc(CC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)n1 ZINC000886267430 1008616961 /nfs/dbraw/zinc/61/69/61/1008616961.db2.gz MRHBDMRNAODJTJ-SWLSCSKDSA-N 1 1 357.414 2.951 20 5 FFBDMO O=[N+]([O-])c1ncccc1Cn1cc(C[NH2+][C@@H]2CCCc3ccccc32)nn1 ZINC000887463086 1009241574 /nfs/dbraw/zinc/24/15/74/1009241574.db2.gz OUKCVHJAJMDQQQ-GOSISDBHSA-N 1 1 364.409 2.797 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823939075 1009287091 /nfs/dbraw/zinc/28/70/91/1009287091.db2.gz QUEZEVZAQKGBCF-DYVFJYSZSA-N 1 1 369.425 2.962 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134909221 1009500193 /nfs/dbraw/zinc/50/01/93/1009500193.db2.gz WCDXYMFMJJEDRK-IIDMSEBBSA-N 1 1 372.469 2.871 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000863032058 1010088683 /nfs/dbraw/zinc/08/86/83/1010088683.db2.gz DLQGLVJHCMUSSV-ZDUSSCGKSA-N 1 1 362.386 2.558 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863504688 1010231611 /nfs/dbraw/zinc/23/16/11/1010231611.db2.gz XKSFXMWPEZTFFY-BEFAXECRSA-N 1 1 374.441 2.626 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000794641799 1010438244 /nfs/dbraw/zinc/43/82/44/1010438244.db2.gz XLVCGLUAFBEFDQ-UONOGXRCSA-N 1 1 361.398 2.599 20 5 FFBDMO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000794641799 1010438258 /nfs/dbraw/zinc/43/82/58/1010438258.db2.gz XLVCGLUAFBEFDQ-UONOGXRCSA-N 1 1 361.398 2.599 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@@H]1C[C@@H]1C(N)=O ZINC001182379603 1010540996 /nfs/dbraw/zinc/54/09/96/1010540996.db2.gz HHWKJPKHOVTDDF-JKSUJKDBSA-N 1 1 362.433 2.822 20 5 FFBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[NH2+]C1(c2ccccc2)CCC1 ZINC000120514626 1010770037 /nfs/dbraw/zinc/77/00/37/1010770037.db2.gz JQIVCKNZXSPYFG-UHFFFAOYSA-N 1 1 351.362 2.817 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC(OC2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867953208 1011130069 /nfs/dbraw/zinc/13/00/69/1011130069.db2.gz PVLRYANWZUYHNG-IBGZPJMESA-N 1 1 361.442 2.719 20 5 FFBDMO C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001171598182 1011396474 /nfs/dbraw/zinc/39/64/74/1011396474.db2.gz CIHNGXZTLHVDGV-CKYFFXLPSA-N 1 1 370.247 2.832 20 5 FFBDMO COC[C@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906363 1012076396 /nfs/dbraw/zinc/07/63/96/1012076396.db2.gz HAMOYVYXMYEGPE-IAGOWNOFSA-N 1 1 370.453 2.822 20 5 FFBDMO COC[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906363 1012076411 /nfs/dbraw/zinc/07/64/11/1012076411.db2.gz HAMOYVYXMYEGPE-IAGOWNOFSA-N 1 1 370.453 2.822 20 5 FFBDMO CCC[C@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(=O)OC ZINC001173010440 1012178971 /nfs/dbraw/zinc/17/89/71/1012178971.db2.gz WQYUOHMAZFYSLQ-HNNXBMFYSA-N 1 1 371.384 2.773 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2C[C@@H]3OCC(F)(F)[C@@H]3C2)c1F ZINC001173181887 1012327194 /nfs/dbraw/zinc/32/71/94/1012327194.db2.gz QCTHUWGTBADYIT-UDZFHETQSA-N 1 1 360.332 2.639 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@@H]3OCC(F)(F)[C@@H]3C2)c1F ZINC001173181887 1012327214 /nfs/dbraw/zinc/32/72/14/1012327214.db2.gz QCTHUWGTBADYIT-UDZFHETQSA-N 1 1 360.332 2.639 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192454 1012334928 /nfs/dbraw/zinc/33/49/28/1012334928.db2.gz LDFMQNNHLZSCTN-FZKQIMNGSA-N 1 1 351.422 2.701 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173198024 1012341267 /nfs/dbraw/zinc/34/12/67/1012341267.db2.gz XLHNYBCZBGNHFY-STQMWFEESA-N 1 1 368.405 2.949 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225348 1012357226 /nfs/dbraw/zinc/35/72/26/1012357226.db2.gz NMHFRTMBMHNRBC-ZBFHGGJFSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225348 1012357244 /nfs/dbraw/zinc/35/72/44/1012357244.db2.gz NMHFRTMBMHNRBC-ZBFHGGJFSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC(=O)c1ncn2c1C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173225982 1012362313 /nfs/dbraw/zinc/36/23/13/1012362313.db2.gz KKWHGHKZJYUMDA-AWEZNQCLSA-N 1 1 372.425 2.805 20 5 FFBDMO CCOC(=O)c1ncn2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173225982 1012362326 /nfs/dbraw/zinc/36/23/26/1012362326.db2.gz KKWHGHKZJYUMDA-AWEZNQCLSA-N 1 1 372.425 2.805 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(NC(=O)C(F)(F)F)CC1 ZINC001173231401 1012364654 /nfs/dbraw/zinc/36/46/54/1012364654.db2.gz CFBYJMDPBKKYLT-LLVKDONJSA-N 1 1 359.348 2.669 20 5 FFBDMO Cc1ccccc1[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1 ZINC000870893711 1012623702 /nfs/dbraw/zinc/62/37/02/1012623702.db2.gz TWYCMWLTYQZCET-AZUAARDMSA-N 1 1 369.421 2.677 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCC([C@@H]2CCCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870955438 1012650372 /nfs/dbraw/zinc/65/03/72/1012650372.db2.gz XEOUPOPRYXGRAW-HKUYNNGSSA-N 1 1 361.442 2.576 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000748344524 1017113101 /nfs/dbraw/zinc/11/31/01/1017113101.db2.gz CJMUTIYQXCQNBY-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000748344524 1017113110 /nfs/dbraw/zinc/11/31/10/1017113110.db2.gz CJMUTIYQXCQNBY-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000827395467 1017913896 /nfs/dbraw/zinc/91/38/96/1017913896.db2.gz KSQFAJRRFCCZFQ-INIZCTEOSA-N 1 1 372.400 2.716 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000827395467 1017913901 /nfs/dbraw/zinc/91/39/01/1017913901.db2.gz KSQFAJRRFCCZFQ-INIZCTEOSA-N 1 1 372.400 2.716 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)C[C@H]1COCC2 ZINC000475546331 1019498927 /nfs/dbraw/zinc/49/89/27/1019498927.db2.gz DNEWQFQNXVHFCE-MSTXYJOUSA-N 1 1 360.410 2.510 20 5 FFBDMO COC(=O)/C(C)=C\C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000828806767 1032843996 /nfs/dbraw/zinc/84/39/96/1032843996.db2.gz DBXROCWSPMBIMD-SSIDCMFESA-N 1 1 362.426 2.820 20 5 FFBDMO Cc1ccc(C[N@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000726583775 1020489130 /nfs/dbraw/zinc/48/91/30/1020489130.db2.gz MUTSHWUJXXWPCH-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000726583775 1020489136 /nfs/dbraw/zinc/48/91/36/1020489136.db2.gz MUTSHWUJXXWPCH-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO COc1cc([C@H](C)[NH2+]CC2(N3CCCC3)CCOCC2)cc([N+](=O)[O-])c1 ZINC000903090843 1020672675 /nfs/dbraw/zinc/67/26/75/1020672675.db2.gz IDGMDDPKSDBHCK-HNNXBMFYSA-N 1 1 363.458 2.899 20 5 FFBDMO COc1cc([C@@H](C)NC2CC[NH+](C[C@H]3CCCO3)CC2)cc([N+](=O)[O-])c1 ZINC000903096362 1020674496 /nfs/dbraw/zinc/67/44/96/1020674496.db2.gz BSSKFJZWTWLEJT-RDTXWAMCSA-N 1 1 363.458 2.897 20 5 FFBDMO O=C([C@H]1CC[C@@H]2CCCC[N@@H+]12)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000900880325 1020697296 /nfs/dbraw/zinc/69/72/96/1020697296.db2.gz HMIUTHGGCCPKSK-HNAYVOBHSA-N 1 1 373.453 2.982 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932133625 1020713955 /nfs/dbraw/zinc/71/39/55/1020713955.db2.gz FBJPOJAXTHJSFU-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1COC(C)(C)C ZINC000932169129 1020729291 /nfs/dbraw/zinc/72/92/91/1020729291.db2.gz AKIIZXWTHFQSJH-AWEZNQCLSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1COC(C)(C)C ZINC000932169129 1020729297 /nfs/dbraw/zinc/72/92/97/1020729297.db2.gz AKIIZXWTHFQSJH-AWEZNQCLSA-N 1 1 365.430 2.821 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000749805266 1021039658 /nfs/dbraw/zinc/03/96/58/1021039658.db2.gz AABQUUOSXMJYJZ-OAHLLOKOSA-N 1 1 365.430 2.915 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]12CC[C@H]1CC[N@@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660775 1021327076 /nfs/dbraw/zinc/32/70/76/1021327076.db2.gz ZTQSGDQRSNJCGQ-KBXCAEBGSA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]12CC[C@H]1CC[N@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660775 1021327094 /nfs/dbraw/zinc/32/70/94/1021327094.db2.gz ZTQSGDQRSNJCGQ-KBXCAEBGSA-N 1 1 362.430 2.869 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000934838191 1021421727 /nfs/dbraw/zinc/42/17/27/1021421727.db2.gz IZMORKOSZXDOPO-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC000934836972 1021422263 /nfs/dbraw/zinc/42/22/63/1021422263.db2.gz GUIPBEFTCXMJCB-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc2nc(O[C@H]3C[C@H](O)C3)c3ccccc3c2c1 ZINC001218362680 1033124640 /nfs/dbraw/zinc/12/46/40/1033124640.db2.gz RBYSGCRXKTYIIY-SHTZXODSSA-N 1 1 365.433 2.790 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)c2cnn(C)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000753663868 1023365048 /nfs/dbraw/zinc/36/50/48/1023365048.db2.gz NLVIGUQHSQQILT-PKOBYXMFSA-N 1 1 370.409 2.896 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1 ZINC001121275999 1023683980 /nfs/dbraw/zinc/68/39/80/1023683980.db2.gz CAJPSHAILJIQAA-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@H]2C1 ZINC001123302015 1023731450 /nfs/dbraw/zinc/73/14/50/1023731450.db2.gz VGULQNHDBBOSEU-ZMLRMANQSA-N 1 1 370.356 2.658 20 5 FFBDMO CC/C=C\CC[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540551 1024885239 /nfs/dbraw/zinc/88/52/39/1024885239.db2.gz JIWIKDGPJIMKEM-MBZYTVFJSA-N 1 1 351.491 2.862 20 5 FFBDMO CCCCC[C@@H](C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245431431 1025428751 /nfs/dbraw/zinc/42/87/51/1025428751.db2.gz ASLHPWAQFMSPIC-HUUCEWRRSA-N 1 1 363.462 2.561 20 5 FFBDMO CCCCC[C@@H](C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245431431 1025428757 /nfs/dbraw/zinc/42/87/57/1025428757.db2.gz ASLHPWAQFMSPIC-HUUCEWRRSA-N 1 1 363.462 2.561 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@@H](Nc2cc([N+](=O)[O-])ccn2)C1 ZINC001158586518 1027069685 /nfs/dbraw/zinc/06/96/85/1027069685.db2.gz ZKKYNWOCKSAJSH-RDJZCZTQSA-N 1 1 370.409 2.861 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(C)c1[N+](=O)[O-] ZINC000795690972 1027814065 /nfs/dbraw/zinc/81/40/65/1027814065.db2.gz BTNPHBLLINVNRF-SQNIBIBYSA-N 1 1 356.426 2.870 20 5 FFBDMO COC(=O)C[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1ccccn1 ZINC001161069049 1027995799 /nfs/dbraw/zinc/99/57/99/1027995799.db2.gz HKHQDMYIRPYCMR-HEWZJLJBSA-N 1 1 371.397 2.633 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CCO[C@@H](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001155275615 1028655493 /nfs/dbraw/zinc/65/54/93/1028655493.db2.gz QMEVJUPNVLFEHA-BLGFXRMMSA-N 1 1 368.437 2.970 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]Cc1ccccc1)CCc1ccccc1 ZINC001162810364 1028664334 /nfs/dbraw/zinc/66/43/34/1028664334.db2.gz JUHQANLDNALGKH-WOJBJXKFSA-N 1 1 367.449 2.513 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)c(C(F)(F)NCC[C@@H]2CC[NH2+]CC2(F)F)c1 ZINC001162810209 1028664642 /nfs/dbraw/zinc/66/46/42/1028664642.db2.gz JGFJJKXDWSVONJ-QMMMGPOBSA-N 1 1 370.734 2.917 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nc(Cl)nc1NCC[C@H]1CC[NH2+]CC1(F)F ZINC001162811073 1028665062 /nfs/dbraw/zinc/66/50/62/1028665062.db2.gz QIKYVAKTXNLNAE-ZCFIWIBFSA-N 1 1 356.160 2.738 20 5 FFBDMO COc1cc(N2CC[NH+](C[C@H](OC)c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC001155715705 1028868273 /nfs/dbraw/zinc/86/82/73/1028868273.db2.gz MRLVFSDFVRLNHV-SFHVURJKSA-N 1 1 372.425 2.508 20 5 FFBDMO C[NH+](C)C=Cc1cc(N[C@H]2CCc3[nH]c(=O)ccc3C2)ncc1[N+](=O)[O-] ZINC001155767046 1028903259 /nfs/dbraw/zinc/90/32/59/1028903259.db2.gz MTFNVCPPGWBGBW-NPQIQWPPSA-N 1 1 355.398 2.592 20 5 FFBDMO Nc1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)ncc1[N+](=O)[O-] ZINC001156317357 1029141488 /nfs/dbraw/zinc/14/14/88/1029141488.db2.gz LYJUSNZELZZLQZ-BFYDXBDKSA-N 1 1 353.426 2.895 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(Cl)cc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490159 1029295142 /nfs/dbraw/zinc/29/51/42/1029295142.db2.gz ACTWXGBWLXHWBA-UKRRQHHQSA-N 1 1 369.824 2.520 20 5 FFBDMO COc1cc(N2C[C@H]3[C@@H](CC[N@H+]3Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001165086714 1029375007 /nfs/dbraw/zinc/37/50/07/1029375007.db2.gz OBMGJZQUKRTGPO-RDJZCZTQSA-N 1 1 354.410 2.709 20 5 FFBDMO C[C@@H]1C[N@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@@H]2CCCC[C@@H]21 ZINC000782278096 1029637777 /nfs/dbraw/zinc/63/77/77/1029637777.db2.gz TWJJDWQQKIFWBA-DAXOMENPSA-N 1 1 358.398 2.880 20 5 FFBDMO C[C@@H]1C[N@@H+](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)[C@@H]2CCCC[C@@H]21 ZINC000782278096 1029637782 /nfs/dbraw/zinc/63/77/82/1029637782.db2.gz TWJJDWQQKIFWBA-DAXOMENPSA-N 1 1 358.398 2.880 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)nc1-c1ccncc1 ZINC000782292004 1029644541 /nfs/dbraw/zinc/64/45/41/1029644541.db2.gz UKHYBTLJRIEMJE-INIZCTEOSA-N 1 1 364.409 2.770 20 5 FFBDMO Nc1ccc(C(=O)O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000783442855 1030100700 /nfs/dbraw/zinc/10/07/00/1030100700.db2.gz AGYNIVNPOIUUKF-INIZCTEOSA-N 1 1 355.394 2.998 20 5 FFBDMO CC[C@H]1N(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CCC[C@]12CCC(=O)N2 ZINC001165920663 1030170557 /nfs/dbraw/zinc/17/05/57/1030170557.db2.gz HNDQACUQELXEED-YTRHGNHMSA-N 1 1 373.457 2.550 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000797530176 1031144395 /nfs/dbraw/zinc/14/43/95/1031144395.db2.gz PQLFLRLONXYTLZ-QFBILLFUSA-N 1 1 369.421 2.613 20 5 FFBDMO Cn1c(C(=O)NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000798523612 1031445597 /nfs/dbraw/zinc/44/55/97/1031445597.db2.gz LIKBMVJFEGYSBS-LJQANCHMSA-N 1 1 356.426 2.575 20 5 FFBDMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001149922568 1031618881 /nfs/dbraw/zinc/61/88/81/1031618881.db2.gz DNGVTBIALLCFCV-GOSISDBHSA-N 1 1 366.377 2.568 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799191999 1031687959 /nfs/dbraw/zinc/68/79/59/1031687959.db2.gz WKWLTYFWOVSWAE-UONOGXRCSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799191999 1031687964 /nfs/dbraw/zinc/68/79/64/1031687964.db2.gz WKWLTYFWOVSWAE-UONOGXRCSA-N 1 1 370.409 2.815 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799192513 1031688943 /nfs/dbraw/zinc/68/89/43/1031688943.db2.gz YVKMPUOKRKOZCV-AWEZNQCLSA-N 1 1 368.393 2.777 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC(NC(=O)OC(C)(C)C)C1 ZINC000831237301 1034005113 /nfs/dbraw/zinc/00/51/13/1034005113.db2.gz PRZXQNXLJDPFID-BCLQGDPASA-N 1 1 365.430 2.616 20 5 FFBDMO COC(=O)c1cc(O[C@H]2CCC[N@H+](C(C)C)C2)c(OC)cc1[N+](=O)[O-] ZINC001226438545 1034684776 /nfs/dbraw/zinc/68/47/76/1034684776.db2.gz HNIKBVHWDYVJBN-LBPRGKRZSA-N 1 1 352.387 2.642 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O ZINC000832976081 1035047197 /nfs/dbraw/zinc/04/71/97/1035047197.db2.gz VKAXCPQPVFNUPL-NSHDSACASA-N 1 1 368.409 2.543 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380300 1036642388 /nfs/dbraw/zinc/64/23/88/1036642388.db2.gz KQMBGZJPRQSHCW-DOMZBBRYSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380300 1036642393 /nfs/dbraw/zinc/64/23/93/1036642393.db2.gz KQMBGZJPRQSHCW-DOMZBBRYSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1cc[nH+]c(N2CCC(Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)CC2)c1 ZINC001230231255 1037162985 /nfs/dbraw/zinc/16/29/85/1037162985.db2.gz DQJZVQVDOLMKER-UHFFFAOYSA-N 1 1 354.370 2.617 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](C)[C@@H]3CO)CC2)ccc1[N+](=O)[O-] ZINC001256092954 1038380592 /nfs/dbraw/zinc/38/05/92/1038380592.db2.gz CFALUFULMPRPMP-KSSFIOAISA-N 1 1 363.458 2.665 20 5 FFBDMO CNCC[N@H+](C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1)C(C)(C)C ZINC001256101223 1038385539 /nfs/dbraw/zinc/38/55/39/1038385539.db2.gz CRMWGNXSHWEKIX-UHFFFAOYSA-N 1 1 364.490 2.892 20 5 FFBDMO CNCC[N@@H+](C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1)C(C)(C)C ZINC001256101223 1038385551 /nfs/dbraw/zinc/38/55/51/1038385551.db2.gz CRMWGNXSHWEKIX-UHFFFAOYSA-N 1 1 364.490 2.892 20 5 FFBDMO C[C@H]1C[NH+](CCc2nnc(/C=C/c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258013784 1039112289 /nfs/dbraw/zinc/11/22/89/1039112289.db2.gz YOFGHAAOJDOENN-SWICKSTGSA-N 1 1 358.398 2.800 20 5 FFBDMO COCCC[N@H+]([C@@H]1CCCNC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807343 1039486355 /nfs/dbraw/zinc/48/63/55/1039486355.db2.gz JISSIVKFZKXFHD-UYAOXDASSA-N 1 1 361.486 2.933 20 5 FFBDMO COCCC[N@@H+]([C@@H]1CCCNC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001246807343 1039486364 /nfs/dbraw/zinc/48/63/64/1039486364.db2.gz JISSIVKFZKXFHD-UYAOXDASSA-N 1 1 361.486 2.933 20 5 FFBDMO COc1cc(OC)cc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC001248208072 1040173169 /nfs/dbraw/zinc/17/31/69/1040173169.db2.gz GVTXPIYGIXXRPA-MRXNPFEDSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCN4CC(F)(F)C[C@H]4C3)CC2)cc1 ZINC001254479730 1040745794 /nfs/dbraw/zinc/74/57/94/1040745794.db2.gz JVQCFQKRFWJBSK-KRWDZBQOSA-N 1 1 366.412 2.589 20 5 FFBDMO CC(C)C(=O)N[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254483037 1040749707 /nfs/dbraw/zinc/74/97/07/1040749707.db2.gz PHLVAHVQAXTKRD-MRXNPFEDSA-N 1 1 374.485 2.800 20 5 FFBDMO CC(C)(C)OC(=O)N[C@]12C[C@H]1C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595733 1040824048 /nfs/dbraw/zinc/82/40/48/1040824048.db2.gz YYPMLIMJXRAQGF-QOKNQOGYSA-N 1 1 359.426 2.661 20 5 FFBDMO Cc1noc([C@H]2C[C@@H]3CC[N@H+]([C@@H]4Cc5ccc([N+](=O)[O-])cc5C4)C[C@H]3O2)n1 ZINC001254595960 1040825808 /nfs/dbraw/zinc/82/58/08/1040825808.db2.gz LFLMSARBWCJEAI-OKDNKWQNSA-N 1 1 370.409 2.606 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603067 1040832807 /nfs/dbraw/zinc/83/28/07/1040832807.db2.gz LGPRKSNSKSWTQX-VQTJNVASSA-N 1 1 359.470 2.637 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1Cc3cnn(C4CCOCC4)c3C1)C2 ZINC001254609830 1040836405 /nfs/dbraw/zinc/83/64/05/1040836405.db2.gz ZALLGVNMBJZORK-GOSISDBHSA-N 1 1 354.410 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1Cc3cnn(C4CCOCC4)c3C1)C2 ZINC001254609830 1040836414 /nfs/dbraw/zinc/83/64/14/1040836414.db2.gz ZALLGVNMBJZORK-GOSISDBHSA-N 1 1 354.410 2.626 20 5 FFBDMO COC(=O)[C@H](Cc1ccccc1)[N@H+](C)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609248 1040836920 /nfs/dbraw/zinc/83/69/20/1040836920.db2.gz UPXSACGAYLGXFU-MOPGFXCFSA-N 1 1 354.406 2.778 20 5 FFBDMO COC(=O)[C@H](Cc1ccccc1)[N@@H+](C)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254609248 1040836930 /nfs/dbraw/zinc/83/69/30/1040836930.db2.gz UPXSACGAYLGXFU-MOPGFXCFSA-N 1 1 354.406 2.778 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1cccc2ccccc21)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001266135449 1042896114 /nfs/dbraw/zinc/89/61/14/1042896114.db2.gz KRBSPDJPKKSBEB-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCCC[N@H+](Cc1cccc2ccccc21)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001266135449 1042896116 /nfs/dbraw/zinc/89/61/16/1042896116.db2.gz KRBSPDJPKKSBEB-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1cccc2ccccc21)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001266135449 1042896122 /nfs/dbraw/zinc/89/61/22/1042896122.db2.gz KRBSPDJPKKSBEB-WOJBJXKFSA-N 1 1 367.449 2.976 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486396 1045169464 /nfs/dbraw/zinc/16/94/64/1045169464.db2.gz KLKXXXRBUIYVHV-CRAIPNDOSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486396 1045169469 /nfs/dbraw/zinc/16/94/69/1045169469.db2.gz KLKXXXRBUIYVHV-CRAIPNDOSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cc(N[C@H]2C[N@@H+](C3CC3)C[C@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001319503941 1045176626 /nfs/dbraw/zinc/17/66/26/1045176626.db2.gz BAMCOCMZSBXSQV-PXAZEXFGSA-N 1 1 353.426 2.677 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001320174766 1045362368 /nfs/dbraw/zinc/36/23/68/1045362368.db2.gz BKKMEVDGQUJSSA-ZWKOTPCHSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001320174766 1045362373 /nfs/dbraw/zinc/36/23/73/1045362373.db2.gz BKKMEVDGQUJSSA-ZWKOTPCHSA-N 1 1 372.400 2.951 20 5 FFBDMO CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)c1nc([C@H]([NH3+])c2ccccc2)no1 ZINC001326173158 1046793947 /nfs/dbraw/zinc/79/39/47/1046793947.db2.gz PDZAKDQCXWEFJU-QWHCGFSZSA-N 1 1 371.401 2.631 20 5 FFBDMO Cc1noc(C[NH+]2CCC([C@H]3C(=O)Nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC001327544778 1047941171 /nfs/dbraw/zinc/94/11/71/1047941171.db2.gz BEKXVUKMGCHHPI-MRXNPFEDSA-N 1 1 356.382 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@](O)(c4ccccc4)C3)nc2c1 ZINC001328958244 1048533850 /nfs/dbraw/zinc/53/38/50/1048533850.db2.gz YBYZIDQSMMHKCS-IBGZPJMESA-N 1 1 352.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@](O)(c4ccccc4)C3)nc2c1 ZINC001328958244 1048533864 /nfs/dbraw/zinc/53/38/64/1048533864.db2.gz YBYZIDQSMMHKCS-IBGZPJMESA-N 1 1 352.394 2.955 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC001333311238 1048827645 /nfs/dbraw/zinc/82/76/45/1048827645.db2.gz GITLHQGWESPQCH-GOEBONIOSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC001333311239 1048828190 /nfs/dbraw/zinc/82/81/90/1048828190.db2.gz GITLHQGWESPQCH-HOCLYGCPSA-N 1 1 351.834 2.924 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001295339888 1049917510 /nfs/dbraw/zinc/91/75/10/1049917510.db2.gz WEWNOGFHKNQIES-LBPRGKRZSA-N 1 1 368.865 2.928 20 5 FFBDMO CCc1cc(NCc2c[nH+]c3n2CCC3)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001307210307 1050053557 /nfs/dbraw/zinc/05/35/57/1050053557.db2.gz HAIRJDUSHUSCEA-UHFFFAOYSA-N 1 1 364.409 2.791 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1cccnc1 ZINC001340923686 1051252227 /nfs/dbraw/zinc/25/22/27/1051252227.db2.gz SVGNAUQOHNBIRG-KRWDZBQOSA-N 1 1 374.828 2.749 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2ccc([N+](=O)[O-])cc2Br)c(C)[nH+]1 ZINC001303891859 1051466748 /nfs/dbraw/zinc/46/67/48/1051466748.db2.gz LCXGOYUAFPXBOJ-UHFFFAOYSA-N 1 1 353.176 2.627 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001341146040 1051495805 /nfs/dbraw/zinc/49/58/05/1051495805.db2.gz MXEMXZQQVABNIC-MRXNPFEDSA-N 1 1 372.473 2.694 20 5 FFBDMO CC1(C)C[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC001345007203 1052195381 /nfs/dbraw/zinc/19/53/81/1052195381.db2.gz QMSGGBUVXGNRKV-WBVHZDCISA-N 1 1 362.426 2.918 20 5 FFBDMO CC1(C)C[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC001345007203 1052195391 /nfs/dbraw/zinc/19/53/91/1052195391.db2.gz QMSGGBUVXGNRKV-WBVHZDCISA-N 1 1 362.426 2.918 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001343485659 1052259503 /nfs/dbraw/zinc/25/95/03/1052259503.db2.gz SRBSXUKLYCCWSQ-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001343485659 1052259514 /nfs/dbraw/zinc/25/95/14/1052259514.db2.gz SRBSXUKLYCCWSQ-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@H]1Cc1ccc(O)cc1 ZINC001308148776 1052417714 /nfs/dbraw/zinc/41/77/14/1052417714.db2.gz ILMLRAZUTJKNFJ-INIZCTEOSA-N 1 1 357.410 2.559 20 5 FFBDMO C[C@H](Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001336570438 1054067980 /nfs/dbraw/zinc/06/79/80/1054067980.db2.gz TZBLCDHSJFGOKG-STQMWFEESA-N 1 1 374.441 2.991 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@]2([NH+]3CCOCC3)CCSC2)c2ccccc21 ZINC001349968678 1055563765 /nfs/dbraw/zinc/56/37/65/1055563765.db2.gz FVJCXXBLGNDBHR-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc2ccccc2c1[N+](=O)[O-] ZINC001544237539 1071616843 /nfs/dbraw/zinc/61/68/43/1071616843.db2.gz JLCYKGFSRZCSPM-CVEARBPZSA-N 1 1 354.410 2.687 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC001544800352 1071694510 /nfs/dbraw/zinc/69/45/10/1071694510.db2.gz KTEXCKRFKHCWIP-CYBMUJFWSA-N 1 1 366.437 2.746 20 5 FFBDMO COCC[N@@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)C1CCCC1 ZINC000848477179 1060097579 /nfs/dbraw/zinc/09/75/79/1060097579.db2.gz MYTYSWNWQYDYRA-SFHVURJKSA-N 1 1 361.442 2.759 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[NH+]2CCC3(CC2)OCCCO3)c1 ZINC000848488758 1060143160 /nfs/dbraw/zinc/14/31/60/1060143160.db2.gz IPBLNMFDLFCHLO-UHFFFAOYSA-N 1 1 358.398 2.645 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1CN1CC[C@H](c3ccc([N+](=O)[O-])cc3)C1=O)CCOCC2 ZINC000848489096 1060143403 /nfs/dbraw/zinc/14/34/03/1060143403.db2.gz JCZROMWSYNDSHK-CRAIPNDOSA-N 1 1 373.453 2.759 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1 ZINC000848582081 1060309908 /nfs/dbraw/zinc/30/99/08/1060309908.db2.gz GGLDSZQPDDDVNT-NSHDSACASA-N 1 1 368.340 2.524 20 5 FFBDMO COC(=O)CC[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC(C)C ZINC001459390010 1060755086 /nfs/dbraw/zinc/75/50/86/1060755086.db2.gz DGXDXKAIILEMPW-UHFFFAOYSA-N 1 1 362.386 2.666 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC001459543657 1060772336 /nfs/dbraw/zinc/77/23/36/1060772336.db2.gz RXUUGOJXOPGLDT-KRWDZBQOSA-N 1 1 369.421 2.868 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCO)[C@H](C)c2ccccc2)c1 ZINC001459784896 1060818411 /nfs/dbraw/zinc/81/84/11/1060818411.db2.gz MQGAAADQHXJCFH-CQSZACIVSA-N 1 1 358.394 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)[C@H](C)c2ccccc2)c1 ZINC001459784896 1060818418 /nfs/dbraw/zinc/81/84/18/1060818418.db2.gz MQGAAADQHXJCFH-CQSZACIVSA-N 1 1 358.394 2.937 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1 ZINC001459910337 1060844632 /nfs/dbraw/zinc/84/46/32/1060844632.db2.gz HZYNMYATMFWTJT-NSHDSACASA-N 1 1 374.376 2.948 20 5 FFBDMO C[C@@H]([N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)(C)O ZINC001460127267 1060903172 /nfs/dbraw/zinc/90/31/72/1060903172.db2.gz VFVSNOYOSNZORR-SECBINFHSA-N 1 1 354.794 2.889 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC001461267016 1061273576 /nfs/dbraw/zinc/27/35/76/1061273576.db2.gz FKZWNYNJEPOVJD-UPJWGTAASA-N 1 1 369.849 2.957 20 5 FFBDMO COC1(OC)CCOC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001461732925 1061392773 /nfs/dbraw/zinc/39/27/73/1061392773.db2.gz XNLIWAZHBGPLSS-KRWDZBQOSA-N 1 1 362.382 2.722 20 5 FFBDMO Cc1cccc(NCCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC001479404108 1062347321 /nfs/dbraw/zinc/34/73/21/1062347321.db2.gz FMKRYFNMOJDTJJ-UHFFFAOYSA-N 1 1 357.414 2.945 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001464326727 1062549799 /nfs/dbraw/zinc/54/97/99/1062549799.db2.gz CICLAZLYUIUERU-NSHDSACASA-N 1 1 350.806 2.748 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc2ncccc2c1 ZINC001493859839 1063239336 /nfs/dbraw/zinc/23/93/36/1063239336.db2.gz ZDICXMVLPZSVQR-IEBWSBKVSA-N 1 1 370.453 2.617 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2ncccc2c1 ZINC001493859839 1063239352 /nfs/dbraw/zinc/23/93/52/1063239352.db2.gz ZDICXMVLPZSVQR-IEBWSBKVSA-N 1 1 370.453 2.617 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2ncccc2c1 ZINC001493859839 1063239372 /nfs/dbraw/zinc/23/93/72/1063239372.db2.gz ZDICXMVLPZSVQR-IEBWSBKVSA-N 1 1 370.453 2.617 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001525865148 1063442716 /nfs/dbraw/zinc/44/27/16/1063442716.db2.gz IVIUTTCGQXUSLK-GXTWGEPZSA-N 1 1 369.849 2.958 20 5 FFBDMO Cc1cc(C)cc(NC(=O)C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001473714226 1065327837 /nfs/dbraw/zinc/32/78/37/1065327837.db2.gz OJHIBWWEHSQKOR-IBGZPJMESA-N 1 1 357.410 2.647 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001473764631 1065349811 /nfs/dbraw/zinc/34/98/11/1065349811.db2.gz OBBNSSACESFZHZ-INIZCTEOSA-N 1 1 355.398 2.941 20 5 FFBDMO O=C(CC[N@H+]1CCCC[C@H]1c1ncccn1)Nc1ccc([N+](=O)[O-])cc1 ZINC001473764631 1065349826 /nfs/dbraw/zinc/34/98/26/1065349826.db2.gz OBBNSSACESFZHZ-INIZCTEOSA-N 1 1 355.398 2.941 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCO[C@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC001473769550 1065353150 /nfs/dbraw/zinc/35/31/50/1065353150.db2.gz VJDJLAIFTWCTRS-DAYGRLMNSA-N 1 1 363.458 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCN3CCC(O)CC3)o2)c1 ZINC001473957384 1065427452 /nfs/dbraw/zinc/42/74/52/1065427452.db2.gz IHNDGZWHSPQDRY-UHFFFAOYSA-N 1 1 359.426 2.791 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001557763979 1075885996 /nfs/dbraw/zinc/88/59/96/1075885996.db2.gz BIALMZSQAYCKAK-MRXNPFEDSA-N 1 1 359.357 2.535 20 5 FFBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC001560034662 1076214558 /nfs/dbraw/zinc/21/45/58/1076214558.db2.gz ZSMCBAVHWLAVFU-CQSZACIVSA-N 1 1 361.364 2.932 20 5 FFBDMO NC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC001560393418 1076270218 /nfs/dbraw/zinc/27/02/18/1076270218.db2.gz WWTJOMFIJQSXHP-UHFFFAOYSA-N 1 1 352.350 2.639 20 5 FFBDMO COC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1cccc(OC)c1 ZINC001560921157 1076309691 /nfs/dbraw/zinc/30/96/91/1076309691.db2.gz COZXGAMYQULSKR-OAHLLOKOSA-N 1 1 362.382 2.795 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001561125504 1076336016 /nfs/dbraw/zinc/33/60/16/1076336016.db2.gz OFODQQJLNSKUAQ-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC001589966701 1080909132 /nfs/dbraw/zinc/90/91/32/1080909132.db2.gz CAEVDDFTJJXVNL-SNVBAGLBSA-N 1 1 369.341 2.534 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001590260053 1081128954 /nfs/dbraw/zinc/12/89/54/1081128954.db2.gz LRBANQKIMFEIJD-LLVKDONJSA-N 1 1 365.463 2.903 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000107682975 209278306 /nfs/dbraw/zinc/27/83/06/209278306.db2.gz FXYIPIMCLATWCP-IYBDPMFKSA-N 1 1 362.474 2.881 20 5 FFBDMO NC(=O)N1CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000092754123 250001067 /nfs/dbraw/zinc/00/10/67/250001067.db2.gz JRWLSIICXCELOX-UHFFFAOYSA-N 1 1 360.439 2.910 20 5 FFBDMO COc1cc(C[NH2+]Cc2cccnc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272430182 252037037 /nfs/dbraw/zinc/03/70/37/252037037.db2.gz NFOWLMAYQVWWTB-UHFFFAOYSA-N 1 1 353.325 2.932 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000272465970 252045819 /nfs/dbraw/zinc/04/58/19/252045819.db2.gz HPGXGZIUZJQBKJ-DOMZBBRYSA-N 1 1 368.865 2.915 20 5 FFBDMO Cc1cc(N2CC[NH+](C)CC2)ccc1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000272554918 252067380 /nfs/dbraw/zinc/06/73/80/252067380.db2.gz HPLIRVASNCSRLE-UHFFFAOYSA-N 1 1 370.409 2.613 20 5 FFBDMO C[C@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1 ZINC000272882170 252154833 /nfs/dbraw/zinc/15/48/33/252154833.db2.gz YDIPADWPIFCUCK-HNNXBMFYSA-N 1 1 360.458 2.867 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000272937938 252169172 /nfs/dbraw/zinc/16/91/72/252169172.db2.gz MTQLFQSWEFHICL-LLVKDONJSA-N 1 1 370.377 2.998 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000273308090 252278213 /nfs/dbraw/zinc/27/82/13/252278213.db2.gz XIEJWRYFRJJEJG-BXUZGUMPSA-N 1 1 369.874 2.893 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275435380 256005804 /nfs/dbraw/zinc/00/58/04/256005804.db2.gz JPGFKEVISIJXDA-OAHLLOKOSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000275435380 256005806 /nfs/dbraw/zinc/00/58/06/256005806.db2.gz JPGFKEVISIJXDA-OAHLLOKOSA-N 1 1 374.384 2.840 20 5 FFBDMO CCOC(CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)OCC ZINC000276131785 256075003 /nfs/dbraw/zinc/07/50/03/256075003.db2.gz CSXAEWPQDFTLDV-QGZVFWFLSA-N 1 1 362.430 2.797 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277381735 256191754 /nfs/dbraw/zinc/19/17/54/256191754.db2.gz WJJUKNHJBWLWDU-JOYOIKCWSA-N 1 1 368.231 2.570 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277278220 256179917 /nfs/dbraw/zinc/17/99/17/256179917.db2.gz BAAUQXOGKIWWEZ-CQSZACIVSA-N 1 1 350.419 2.526 20 5 FFBDMO COc1cc(NCCC[N@H+]2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000278179562 256285073 /nfs/dbraw/zinc/28/50/73/256285073.db2.gz PNFZDZFDGUKKAT-ZDUSSCGKSA-N 1 1 353.419 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CNC3CC[NH+](CCC(F)(F)F)CC3)nc2c1 ZINC000278772554 256346457 /nfs/dbraw/zinc/34/64/57/256346457.db2.gz UVEXGHIWEDRWMB-UHFFFAOYSA-N 1 1 371.363 2.978 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(Oc3ncccc3F)CC2)c1 ZINC000278266170 256293353 /nfs/dbraw/zinc/29/33/53/256293353.db2.gz IUBWDQQCFYKQGS-QGZVFWFLSA-N 1 1 361.373 2.706 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000279166305 256389053 /nfs/dbraw/zinc/38/90/53/256389053.db2.gz QHSRBOHCSHIUES-CQSZACIVSA-N 1 1 369.780 2.942 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000281651995 256650756 /nfs/dbraw/zinc/65/07/56/256650756.db2.gz BRASXLAOSZVLIU-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@H+](C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000286120822 257021292 /nfs/dbraw/zinc/02/12/92/257021292.db2.gz MIIMQASMYCFSNA-MRXNPFEDSA-N 1 1 370.409 2.578 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000286120822 257021293 /nfs/dbraw/zinc/02/12/93/257021293.db2.gz MIIMQASMYCFSNA-MRXNPFEDSA-N 1 1 370.409 2.578 20 5 FFBDMO C[C@@H]1C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000290829210 257359959 /nfs/dbraw/zinc/35/99/59/257359959.db2.gz UIQJRQGIXLMTJB-UKRRQHHQSA-N 1 1 369.425 2.554 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4ccncn4)CC3)n2)cc1 ZINC000297988790 257875269 /nfs/dbraw/zinc/87/52/69/257875269.db2.gz AFPUCCGKNHUNIP-UHFFFAOYSA-N 1 1 366.381 2.814 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1ccc([N+](=O)[O-])cc1F ZINC000301290140 258040241 /nfs/dbraw/zinc/04/02/41/258040241.db2.gz OPDLNULXHDJRNB-AWEZNQCLSA-N 1 1 359.405 2.752 20 5 FFBDMO CC[C@@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O ZINC000302022640 258083117 /nfs/dbraw/zinc/08/31/17/258083117.db2.gz ORBSVYMQNHZYLG-HUUCEWRRSA-N 1 1 358.442 2.733 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000302499698 258104137 /nfs/dbraw/zinc/10/41/37/258104137.db2.gz CINNGLDQXSJLCZ-LLVKDONJSA-N 1 1 361.364 2.895 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000302890774 258114237 /nfs/dbraw/zinc/11/42/37/258114237.db2.gz PMVMBWVQPOFNTC-UHFFFAOYSA-N 1 1 368.437 2.894 20 5 FFBDMO C[C@@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000301893755 258073304 /nfs/dbraw/zinc/07/33/04/258073304.db2.gz SPCYGKDFMSYWKV-AWEZNQCLSA-N 1 1 350.463 2.820 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C[N@@H+]1C ZINC000330591159 258166432 /nfs/dbraw/zinc/16/64/32/258166432.db2.gz OFOIEFKJNMPXSK-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C[N@H+]1C ZINC000330591159 258166433 /nfs/dbraw/zinc/16/64/33/258166433.db2.gz OFOIEFKJNMPXSK-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000331338419 258182714 /nfs/dbraw/zinc/18/27/14/258182714.db2.gz JLLUXJGXZKSLPI-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000373055640 512151246 /nfs/dbraw/zinc/15/12/46/512151246.db2.gz FVSDIZIZDXHBNC-AWEZNQCLSA-N 1 1 369.425 2.605 20 5 FFBDMO C[NH+](C)C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCCCCC1 ZINC000032704103 506280358 /nfs/dbraw/zinc/28/03/58/506280358.db2.gz SCRKJWXPXMEDAJ-UHFFFAOYSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccccc2)CC1 ZINC000032723312 506284621 /nfs/dbraw/zinc/28/46/21/506284621.db2.gz NLLMDKXJWHZMPQ-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000003537817 506341649 /nfs/dbraw/zinc/34/16/49/506341649.db2.gz HQHGWWDGZURPKO-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@H]1CCC[N@@H+]1CCCO ZINC000450598539 513266901 /nfs/dbraw/zinc/26/69/01/513266901.db2.gz RBSHVTVFDUFXDQ-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000377282784 512199887 /nfs/dbraw/zinc/19/98/87/512199887.db2.gz JHBAACUTHVBNKC-UHFFFAOYSA-N 1 1 361.358 2.545 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000366841458 512212723 /nfs/dbraw/zinc/21/27/23/512212723.db2.gz ALJQJDZQXBKYPO-BEFAXECRSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000366841458 512212727 /nfs/dbraw/zinc/21/27/27/512212727.db2.gz ALJQJDZQXBKYPO-BEFAXECRSA-N 1 1 373.384 2.674 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000377434648 512267086 /nfs/dbraw/zinc/26/70/86/512267086.db2.gz YETDDZSTTMEAGS-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cn1 ZINC000053545612 506402049 /nfs/dbraw/zinc/40/20/49/506402049.db2.gz ULDKIXNEVIPHLQ-UHFFFAOYSA-N 1 1 368.309 2.644 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)NCc1ccc([N+](=O)[O-])cc1 ZINC000054683981 506605011 /nfs/dbraw/zinc/60/50/11/506605011.db2.gz MEGKZMDWGFFWHO-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)NCc1ccc([N+](=O)[O-])cc1 ZINC000054683981 506605016 /nfs/dbraw/zinc/60/50/16/506605016.db2.gz MEGKZMDWGFFWHO-UHFFFAOYSA-N 1 1 360.439 2.514 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000375361471 512285376 /nfs/dbraw/zinc/28/53/76/512285376.db2.gz MDPDCXFMLAWLHS-GOSISDBHSA-N 1 1 369.425 2.611 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](c1ccsc1)[NH+](C)C ZINC000008896359 506672819 /nfs/dbraw/zinc/67/28/19/506672819.db2.gz BCHOMTKOSLQWIE-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO CC(C)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCOCC1 ZINC000043342400 506736028 /nfs/dbraw/zinc/73/60/28/506736028.db2.gz GDOIODSTCMHBEH-HNNXBMFYSA-N 1 1 370.837 2.727 20 5 FFBDMO C[C@@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000043893367 506797992 /nfs/dbraw/zinc/79/79/92/506797992.db2.gz YVLAJYWKCWZAKZ-CABCVRRESA-N 1 1 363.462 2.569 20 5 FFBDMO Cc1cccc(C(=O)N2CC[NH+](CCc3cccs3)CC2)c1[N+](=O)[O-] ZINC000055644409 506813116 /nfs/dbraw/zinc/81/31/16/506813116.db2.gz ACMKHZPXWYNPIX-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067399530 506864495 /nfs/dbraw/zinc/86/44/95/506864495.db2.gz OVYMBQTXYNSGHJ-GOSISDBHSA-N 1 1 369.421 2.883 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)c1cc([N+](=O)[O-])c[nH]1 ZINC000056341841 506991699 /nfs/dbraw/zinc/99/16/99/506991699.db2.gz ZYEUSZJBUXRIHV-UHFFFAOYSA-N 1 1 364.352 2.596 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000068085598 507105342 /nfs/dbraw/zinc/10/53/42/507105342.db2.gz JMTGWQXZZOXZGI-BETUJISGSA-N 1 1 359.430 2.569 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085598 507105345 /nfs/dbraw/zinc/10/53/45/507105345.db2.gz JMTGWQXZZOXZGI-BETUJISGSA-N 1 1 359.430 2.569 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085598 507105353 /nfs/dbraw/zinc/10/53/53/507105353.db2.gz JMTGWQXZZOXZGI-BETUJISGSA-N 1 1 359.430 2.569 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N[C@@H]3CC[N@H+](C4CC4)C3)cc2[N+](=O)[O-])C1 ZINC000057553083 507287094 /nfs/dbraw/zinc/28/70/94/507287094.db2.gz GVPSXJRMWYOTOL-GDBMZVCRSA-N 1 1 372.469 2.798 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000058273997 507398367 /nfs/dbraw/zinc/39/83/67/507398367.db2.gz XEIBEGVECRJMBI-CHWSQXEVSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000025699651 507523986 /nfs/dbraw/zinc/52/39/86/507523986.db2.gz WAHNRPTVLWRIOQ-QGZVFWFLSA-N 1 1 360.410 2.654 20 5 FFBDMO Cc1sc(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cc1[N+](=O)[O-] ZINC000049733564 507634875 /nfs/dbraw/zinc/63/48/75/507634875.db2.gz XGESAHHXESWFHH-UHFFFAOYSA-N 1 1 374.466 2.964 20 5 FFBDMO C[N@H+](CCOc1ccccc1Cl)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373762 507653729 /nfs/dbraw/zinc/65/37/29/507653729.db2.gz NDYCTZBVXQDLAR-UHFFFAOYSA-N 1 1 363.801 2.858 20 5 FFBDMO C[N@@H+](CCOc1ccccc1Cl)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027373762 507653737 /nfs/dbraw/zinc/65/37/37/507653737.db2.gz NDYCTZBVXQDLAR-UHFFFAOYSA-N 1 1 363.801 2.858 20 5 FFBDMO O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CC[NH+](CC2CC2)CC1 ZINC000050587650 507694872 /nfs/dbraw/zinc/69/48/72/507694872.db2.gz DBRXOPKSLUHQQJ-UHFFFAOYSA-N 1 1 372.450 2.886 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000063530164 507743296 /nfs/dbraw/zinc/74/32/96/507743296.db2.gz QKJQESICTNPPCA-MRXNPFEDSA-N 1 1 374.485 2.658 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051341656 507762962 /nfs/dbraw/zinc/76/29/62/507762962.db2.gz GXZDJNUYWLJJJQ-CQSZACIVSA-N 1 1 360.439 2.932 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@]2([NH+]3CCOCC3)CCSC2)c2ccncc21 ZINC000029625927 507784833 /nfs/dbraw/zinc/78/48/33/507784833.db2.gz CPPXPTSPHIMLOG-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCCCN2CC[NH+](Cc3ccccc3)CC2)nc1 ZINC000052430654 507809119 /nfs/dbraw/zinc/80/91/19/507809119.db2.gz PWKZKHJFLRHRIC-UHFFFAOYSA-N 1 1 369.469 3.000 20 5 FFBDMO Cc1cc(NC[C@@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000077995479 507825230 /nfs/dbraw/zinc/82/52/30/507825230.db2.gz UHSSZQOLBYHSJU-CQSZACIVSA-N 1 1 371.441 2.740 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](C2CC2)[C@H]2CCCc3ccccc32)c1 ZINC000072580332 507827570 /nfs/dbraw/zinc/82/75/70/507827570.db2.gz FLFJHNSUQVVGGW-MJGOQNOKSA-N 1 1 356.426 2.694 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](CCO)c1ccccc1 ZINC000072773165 507852246 /nfs/dbraw/zinc/85/22/46/507852246.db2.gz XUYGZLVHJQGVEP-GOSISDBHSA-N 1 1 369.421 2.539 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](CCO)c1ccccc1 ZINC000072773165 507852247 /nfs/dbraw/zinc/85/22/47/507852247.db2.gz XUYGZLVHJQGVEP-GOSISDBHSA-N 1 1 369.421 2.539 20 5 FFBDMO CN(C)c1cccc(C[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000089923484 507884439 /nfs/dbraw/zinc/88/44/39/507884439.db2.gz ZUFPJOWVTZYBGB-UHFFFAOYSA-N 1 1 368.437 2.682 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000089923484 507884440 /nfs/dbraw/zinc/88/44/40/507884440.db2.gz ZUFPJOWVTZYBGB-UHFFFAOYSA-N 1 1 368.437 2.682 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000369360783 512370867 /nfs/dbraw/zinc/37/08/67/512370867.db2.gz YOTWSUPINOLPIP-SNVBAGLBSA-N 1 1 366.219 2.870 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)c1 ZINC000110356103 508022797 /nfs/dbraw/zinc/02/27/97/508022797.db2.gz PTHLVRLZDWVDHG-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000110654266 508039842 /nfs/dbraw/zinc/03/98/42/508039842.db2.gz WIXUETOYNVOFJG-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO C[C@H]1C[C@@H]1c1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000075588837 508120407 /nfs/dbraw/zinc/12/04/07/508120407.db2.gz FSMPWCOSJHILKC-NUTKFTJISA-N 1 1 360.414 2.533 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000081127242 508140373 /nfs/dbraw/zinc/14/03/73/508140373.db2.gz GDRDOZGNQOIUKN-KRWDZBQOSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H](CC(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000093808899 508156090 /nfs/dbraw/zinc/15/60/90/508156090.db2.gz LYRLVYLUGISEHK-ZDUSSCGKSA-N 1 1 373.409 2.951 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000081293691 508157636 /nfs/dbraw/zinc/15/76/36/508157636.db2.gz AQRMSWYMUWBNDJ-MRXNPFEDSA-N 1 1 360.458 2.778 20 5 FFBDMO CNC(=O)[C@H](C)C[N@@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000093899212 508159438 /nfs/dbraw/zinc/15/94/38/508159438.db2.gz NWIDVXINWODQBI-GFCCVEGCSA-N 1 1 361.398 2.677 20 5 FFBDMO CC(C)c1ccc(C(=O)N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534634 512381282 /nfs/dbraw/zinc/38/12/82/512381282.db2.gz QEGZIPKHAJGOGD-INIZCTEOSA-N 1 1 374.485 2.617 20 5 FFBDMO CC(C)c1ccc(C(=O)N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534634 512381284 /nfs/dbraw/zinc/38/12/84/512381284.db2.gz QEGZIPKHAJGOGD-INIZCTEOSA-N 1 1 374.485 2.617 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000081363968 508167781 /nfs/dbraw/zinc/16/77/81/508167781.db2.gz HXHDWGDSCQYJST-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000081363501 508167800 /nfs/dbraw/zinc/16/78/00/508167800.db2.gz OOONOZNWUXXEBQ-INIZCTEOSA-N 1 1 362.474 2.977 20 5 FFBDMO CCOC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000112356805 508178244 /nfs/dbraw/zinc/17/82/44/508178244.db2.gz GTZVOAYWIJOMTN-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000112356805 508178245 /nfs/dbraw/zinc/17/82/45/508178245.db2.gz GTZVOAYWIJOMTN-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000081571212 508191784 /nfs/dbraw/zinc/19/17/84/508191784.db2.gz XFRPZCWSQFJHCH-CYBMUJFWSA-N 1 1 368.865 2.850 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1C ZINC000103144971 508298828 /nfs/dbraw/zinc/29/88/28/508298828.db2.gz YFIHPQHYWBTYNW-UHFFFAOYSA-N 1 1 369.421 2.933 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1C ZINC000103144971 508298830 /nfs/dbraw/zinc/29/88/30/508298830.db2.gz YFIHPQHYWBTYNW-UHFFFAOYSA-N 1 1 369.421 2.933 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000115275144 508380559 /nfs/dbraw/zinc/38/05/59/508380559.db2.gz VOVZGNMBHUQSRW-QAPCUYQASA-N 1 1 363.458 2.770 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000115275146 508380674 /nfs/dbraw/zinc/38/06/74/508380674.db2.gz VOVZGNMBHUQSRW-CRAIPNDOSA-N 1 1 363.458 2.770 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000115557722 508409219 /nfs/dbraw/zinc/40/92/19/508409219.db2.gz PCCPVGIMBDNARA-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO Cc1n[nH]c(C(=O)NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000116206381 508486246 /nfs/dbraw/zinc/48/62/46/508486246.db2.gz CNCGXAHGIVDULC-ZDUSSCGKSA-N 1 1 371.441 2.788 20 5 FFBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134205867 508507498 /nfs/dbraw/zinc/50/74/98/508507498.db2.gz DYKZRTWQGLQAKX-UGSOOPFHSA-N 1 1 355.394 2.857 20 5 FFBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000134205867 508507501 /nfs/dbraw/zinc/50/75/01/508507501.db2.gz DYKZRTWQGLQAKX-UGSOOPFHSA-N 1 1 355.394 2.857 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000134918805 508575339 /nfs/dbraw/zinc/57/53/39/508575339.db2.gz SPTFVWARVUCHDM-ZBFHGGJFSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000122833204 508593384 /nfs/dbraw/zinc/59/33/84/508593384.db2.gz WSQARMJTRPPPTF-WBVHZDCISA-N 1 1 374.485 2.752 20 5 FFBDMO Cc1cnc(CC[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000157836782 508619798 /nfs/dbraw/zinc/61/97/98/508619798.db2.gz USPHRFQNARCLED-OAHLLOKOSA-N 1 1 360.439 2.640 20 5 FFBDMO Cc1cnc(CC[N@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)s1 ZINC000157836782 508619802 /nfs/dbraw/zinc/61/98/02/508619802.db2.gz USPHRFQNARCLED-OAHLLOKOSA-N 1 1 360.439 2.640 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)cc1SC ZINC000153712436 508632774 /nfs/dbraw/zinc/63/27/74/508632774.db2.gz ALHYWABMTZEHMY-AWEZNQCLSA-N 1 1 367.471 2.738 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)cc1SC ZINC000153712436 508632775 /nfs/dbraw/zinc/63/27/75/508632775.db2.gz ALHYWABMTZEHMY-AWEZNQCLSA-N 1 1 367.471 2.738 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000157949485 508636769 /nfs/dbraw/zinc/63/67/69/508636769.db2.gz BTWZYBHJQSBTGR-AWEZNQCLSA-N 1 1 355.394 2.692 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@@H](C)[C@H]1C ZINC000118415708 508650565 /nfs/dbraw/zinc/65/05/65/508650565.db2.gz DAXZMQJOJIKWGS-NEPJUHHUSA-N 1 1 353.444 2.758 20 5 FFBDMO C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000123199253 508650852 /nfs/dbraw/zinc/65/08/52/508650852.db2.gz UHUBGROLADNFKN-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000123351410 508673488 /nfs/dbraw/zinc/67/34/88/508673488.db2.gz UQPCNJFDTCBWLH-OLZOCXBDSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000158277127 508681730 /nfs/dbraw/zinc/68/17/30/508681730.db2.gz YMTFJOVAKVHRHX-UHFFFAOYSA-N 1 1 357.414 2.710 20 5 FFBDMO CC[N@H+](Cc1ccc(C(=O)N(C)C)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153970117 508689022 /nfs/dbraw/zinc/68/90/22/508689022.db2.gz VQUQBTVWHQHZGK-IBGZPJMESA-N 1 1 371.437 2.852 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002561 508696289 /nfs/dbraw/zinc/69/62/89/508696289.db2.gz MCSVMBMEFQLVLZ-QZTJIDSGSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002561 508696291 /nfs/dbraw/zinc/69/62/91/508696291.db2.gz MCSVMBMEFQLVLZ-QZTJIDSGSA-N 1 1 373.453 2.763 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000371454785 512411612 /nfs/dbraw/zinc/41/16/12/512411612.db2.gz BDYRCVCGEJAXLU-IEBWSBKVSA-N 1 1 374.441 2.685 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000129618788 508746826 /nfs/dbraw/zinc/74/68/26/508746826.db2.gz XSOBULNJHPURNJ-CXAGYDPISA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000129618788 508746830 /nfs/dbraw/zinc/74/68/30/508746830.db2.gz XSOBULNJHPURNJ-CXAGYDPISA-N 1 1 357.414 2.621 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000137507242 508759467 /nfs/dbraw/zinc/75/94/67/508759467.db2.gz QWMWUBHEIMJBLQ-HIFRSBDPSA-N 1 1 371.441 2.663 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000119419011 508792054 /nfs/dbraw/zinc/79/20/54/508792054.db2.gz SDPBKEZVVXTMJZ-INIZCTEOSA-N 1 1 362.474 2.881 20 5 FFBDMO C[NH+](C)[C@@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000144695192 508840084 /nfs/dbraw/zinc/84/00/84/508840084.db2.gz KFRVMFIXSNENNV-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124552169 508850473 /nfs/dbraw/zinc/85/04/73/508850473.db2.gz WSTOFKOOTYGKBL-OAHLLOKOSA-N 1 1 358.442 2.679 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000159568587 508859471 /nfs/dbraw/zinc/85/94/71/508859471.db2.gz GSSYJAFYXRIVIN-RDTXWAMCSA-N 1 1 357.410 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000159568587 508859473 /nfs/dbraw/zinc/85/94/73/508859473.db2.gz GSSYJAFYXRIVIN-RDTXWAMCSA-N 1 1 357.410 2.896 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-] ZINC000119859928 508878016 /nfs/dbraw/zinc/87/80/16/508878016.db2.gz UEKGQFYWMCULRP-DYVFJYSZSA-N 1 1 357.385 2.984 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1C(F)(F)F ZINC000159711095 508879044 /nfs/dbraw/zinc/87/90/44/508879044.db2.gz KBEYRBYDIUBJIL-UHFFFAOYSA-N 1 1 355.316 2.907 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H](C(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000155005958 508902793 /nfs/dbraw/zinc/90/27/93/508902793.db2.gz ZSBPXGVGMFSBMK-LBPRGKRZSA-N 1 1 359.382 2.561 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000125187702 508944284 /nfs/dbraw/zinc/94/42/84/508944284.db2.gz KZZXDECYTSVLFO-UHFFFAOYSA-N 1 1 371.393 2.842 20 5 FFBDMO C[C@H]1C[C@@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@@H+]1C1CC1 ZINC000151102586 508956810 /nfs/dbraw/zinc/95/68/10/508956810.db2.gz XPMHSOLAZYVRFZ-XJKSGUPXSA-N 1 1 355.442 2.710 20 5 FFBDMO C[C@H]1C[C@@H](NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000151102586 508956811 /nfs/dbraw/zinc/95/68/11/508956811.db2.gz XPMHSOLAZYVRFZ-XJKSGUPXSA-N 1 1 355.442 2.710 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000120242431 508957214 /nfs/dbraw/zinc/95/72/14/508957214.db2.gz ULMIKCCQDNJJMC-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000120303814 508968081 /nfs/dbraw/zinc/96/80/81/508968081.db2.gz FOQSDQJXFHZHAP-UHFFFAOYSA-N 1 1 356.220 2.571 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCN(C)CC1 ZINC000132410682 509028344 /nfs/dbraw/zinc/02/83/44/509028344.db2.gz WBDWXGKMYFMZCD-PZJWPPBQSA-N 1 1 374.529 2.778 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000120691021 509045687 /nfs/dbraw/zinc/04/56/87/509045687.db2.gz ZXYRDYWMZCNNFR-UHFFFAOYSA-N 1 1 355.822 2.935 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000160911621 509047402 /nfs/dbraw/zinc/04/74/02/509047402.db2.gz FTHQDDXZLQILOV-KDOFPFPSSA-N 1 1 350.415 2.609 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155674500 509050256 /nfs/dbraw/zinc/05/02/56/509050256.db2.gz GZGHWFUEOACTTE-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO Cc1ccc([C@H](C)NC[C@@H](O)C[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782666 509082348 /nfs/dbraw/zinc/08/23/48/509082348.db2.gz OAUBAUOTASBPRK-OXJNMPFZSA-N 1 1 369.465 2.973 20 5 FFBDMO Cc1ccc([C@H](C)NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000151782666 509082350 /nfs/dbraw/zinc/08/23/50/509082350.db2.gz OAUBAUOTASBPRK-OXJNMPFZSA-N 1 1 369.465 2.973 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000132966782 509097985 /nfs/dbraw/zinc/09/79/85/509097985.db2.gz PEEPLKAZILSAQF-GXFFZTMASA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000132966782 509097989 /nfs/dbraw/zinc/09/79/89/509097989.db2.gz PEEPLKAZILSAQF-GXFFZTMASA-N 1 1 360.357 2.798 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000126673150 509111479 /nfs/dbraw/zinc/11/14/79/509111479.db2.gz HSKNEAAMRYYPJA-GFCCVEGCSA-N 1 1 372.450 2.932 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H](C)O1 ZINC000161630493 509137459 /nfs/dbraw/zinc/13/74/59/509137459.db2.gz HKQKXHDVEJEIRD-STQMWFEESA-N 1 1 374.441 2.694 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000133428939 509158957 /nfs/dbraw/zinc/15/89/57/509158957.db2.gz CRZWPZYKRSTISZ-UHFFFAOYSA-N 1 1 360.439 2.886 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(O)(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000185500655 509208109 /nfs/dbraw/zinc/20/81/09/509208109.db2.gz BYDWZSYUKUTHOR-UHFFFAOYSA-N 1 1 369.421 2.541 20 5 FFBDMO Nc1c(F)c(NCc2cccc(C[NH+]3CCOCC3)c2)ccc1[N+](=O)[O-] ZINC000266852223 509224726 /nfs/dbraw/zinc/22/47/26/509224726.db2.gz LQLTZOJPEQLGSH-UHFFFAOYSA-N 1 1 360.389 2.760 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000179016645 509226402 /nfs/dbraw/zinc/22/64/02/509226402.db2.gz YRYLACHZUFNMKK-GFCCVEGCSA-N 1 1 355.398 2.576 20 5 FFBDMO C[N@H+](Cc1cc(F)c(F)c(F)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182475196 509257949 /nfs/dbraw/zinc/25/79/49/509257949.db2.gz JIVKBVQIFXRSHM-LBPRGKRZSA-N 1 1 370.327 2.884 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000172834655 509264367 /nfs/dbraw/zinc/26/43/67/509264367.db2.gz DZQVCOODAGTLJP-HNNXBMFYSA-N 1 1 371.441 2.727 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000248546822 509358576 /nfs/dbraw/zinc/35/85/76/509358576.db2.gz DZMNDKSUUPEUIR-ZIAGYGMSSA-N 1 1 351.422 2.932 20 5 FFBDMO CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000163404724 509373038 /nfs/dbraw/zinc/37/30/38/509373038.db2.gz HYWGBDIMDWKDJE-HOCLYGCPSA-N 1 1 371.441 2.626 20 5 FFBDMO CCc1n[nH]c(C(=O)NC(C)(C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000185888789 509409865 /nfs/dbraw/zinc/40/98/65/509409865.db2.gz VCWKVZPXXMLSMD-UHFFFAOYSA-N 1 1 359.430 2.521 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)n1 ZINC000248656744 509421873 /nfs/dbraw/zinc/42/18/73/509421873.db2.gz DWSGROIMUOAKEV-CABCVRRESA-N 1 1 363.462 2.538 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000189298221 509507492 /nfs/dbraw/zinc/50/74/92/509507492.db2.gz JREIMLMRCMWELA-QGZVFWFLSA-N 1 1 356.422 2.998 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000192464485 509530542 /nfs/dbraw/zinc/53/05/42/509530542.db2.gz FKNWIXYOJCSTJX-OAHLLOKOSA-N 1 1 355.442 2.592 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)C[C@H]2C1 ZINC000192486092 509537035 /nfs/dbraw/zinc/53/70/35/509537035.db2.gz XIAWIGAIPQOYAD-IYBDPMFKSA-N 1 1 366.421 2.972 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000183057288 509571204 /nfs/dbraw/zinc/57/12/04/509571204.db2.gz VAAXHDNTQISGTM-OAHLLOKOSA-N 1 1 365.336 2.789 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCSC[C@H](C)C1 ZINC000249083981 509595196 /nfs/dbraw/zinc/59/51/96/509595196.db2.gz SAIYHWDWRQGPRL-VXGBXAGGSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000249083981 509595202 /nfs/dbraw/zinc/59/52/02/509595202.db2.gz SAIYHWDWRQGPRL-VXGBXAGGSA-N 1 1 353.444 2.615 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccc(F)cc1 ZINC000173467628 509618953 /nfs/dbraw/zinc/61/89/53/509618953.db2.gz UKXGHSJTYRPTBT-HNNXBMFYSA-N 1 1 373.388 2.644 20 5 FFBDMO COc1ccc(OC)c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000173471901 509622607 /nfs/dbraw/zinc/62/26/07/509622607.db2.gz ZDZSFNNVODEQSB-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[N@@H+](C)C1CC1 ZINC000267919822 509670986 /nfs/dbraw/zinc/67/09/86/509670986.db2.gz JADHNWNMRQIOJH-QMMMGPOBSA-N 1 1 374.210 2.709 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[N@@H+](C)C1CC1 ZINC000267919819 509671442 /nfs/dbraw/zinc/67/14/42/509671442.db2.gz JADHNWNMRQIOJH-MRVPVSSYSA-N 1 1 374.210 2.709 20 5 FFBDMO COc1ccc(F)cc1[C@H](C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000179925495 509675316 /nfs/dbraw/zinc/67/53/16/509675316.db2.gz ABSNQGXYQNRNMQ-LBPRGKRZSA-N 1 1 373.384 2.982 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000249473470 509689024 /nfs/dbraw/zinc/68/90/24/509689024.db2.gz UWWDTJVYHQMCFH-WMLDXEAASA-N 1 1 353.438 2.961 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000268186520 509803169 /nfs/dbraw/zinc/80/31/69/509803169.db2.gz WCQPBZVYHTYZJF-AAEUAGOBSA-N 1 1 354.838 2.872 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1c1c(F)cccc1F ZINC000180215104 509817050 /nfs/dbraw/zinc/81/70/50/509817050.db2.gz LSOUIRGDQKRASI-JTQLQIEISA-N 1 1 353.350 2.830 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C1CCCCC1 ZINC000180241091 509829595 /nfs/dbraw/zinc/82/95/95/509829595.db2.gz NPNRYDPUTFVKCZ-UHFFFAOYSA-N 1 1 363.414 2.708 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCS1 ZINC000173930039 509859482 /nfs/dbraw/zinc/85/94/82/509859482.db2.gz JHMPUZOQUCSWAZ-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000186707233 509865295 /nfs/dbraw/zinc/86/52/95/509865295.db2.gz YIKVSTUCSRJNMC-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000253356598 509869801 /nfs/dbraw/zinc/86/98/01/509869801.db2.gz VNUKBCPTSYDOIY-BFYDXBDKSA-N 1 1 374.485 2.901 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000268353956 509884926 /nfs/dbraw/zinc/88/49/26/509884926.db2.gz NSFPJDJLXILXSR-MRXNPFEDSA-N 1 1 374.340 2.590 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000268353956 509884933 /nfs/dbraw/zinc/88/49/33/509884933.db2.gz NSFPJDJLXILXSR-MRXNPFEDSA-N 1 1 374.340 2.590 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245433183 509928761 /nfs/dbraw/zinc/92/87/61/509928761.db2.gz PAIWRGMEBYZRNU-MAUKXSAKSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000245433183 509928764 /nfs/dbraw/zinc/92/87/64/509928764.db2.gz PAIWRGMEBYZRNU-MAUKXSAKSA-N 1 1 362.474 2.894 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177195606 509930673 /nfs/dbraw/zinc/93/06/73/509930673.db2.gz FYYSZQRVIJMAAW-AAEUAGOBSA-N 1 1 367.833 2.759 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000187015573 510006861 /nfs/dbraw/zinc/00/68/61/510006861.db2.gz UWWDTJVYHQMCFH-RHSMWYFYSA-N 1 1 353.438 2.961 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)OCCO1 ZINC000183869017 510014597 /nfs/dbraw/zinc/01/45/97/510014597.db2.gz CLXATWOGVXYSOQ-AWEZNQCLSA-N 1 1 374.397 2.620 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000177378773 510023443 /nfs/dbraw/zinc/02/34/43/510023443.db2.gz ZCXJMAIQDZZFOI-QGZVFWFLSA-N 1 1 361.442 2.621 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000177378773 510023449 /nfs/dbraw/zinc/02/34/49/510023449.db2.gz ZCXJMAIQDZZFOI-QGZVFWFLSA-N 1 1 361.442 2.621 20 5 FFBDMO O=C(CN1CCC(c2[nH]cc[nH+]2)CC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000265555148 510113256 /nfs/dbraw/zinc/11/32/56/510113256.db2.gz ZIKGPRVPPBBUPO-UHFFFAOYSA-N 1 1 363.805 2.789 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000245751458 510127994 /nfs/dbraw/zinc/12/79/94/510127994.db2.gz GSSYJAFYXRIVIN-KSSFIOAISA-N 1 1 357.410 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000245751458 510128002 /nfs/dbraw/zinc/12/80/02/510128002.db2.gz GSSYJAFYXRIVIN-KSSFIOAISA-N 1 1 357.410 2.896 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180830102 510133777 /nfs/dbraw/zinc/13/37/77/510133777.db2.gz FPHSIGFOUWABNC-INIZCTEOSA-N 1 1 368.437 2.771 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)ccc1[N+](=O)[O-] ZINC000261983039 510136945 /nfs/dbraw/zinc/13/69/45/510136945.db2.gz OFYZCZUTTBVTCB-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000193947924 510143543 /nfs/dbraw/zinc/14/35/43/510143543.db2.gz JCTBIILOVMSSRH-KGLIPLIRSA-N 1 1 364.446 2.523 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1F ZINC000262103328 510179603 /nfs/dbraw/zinc/17/96/03/510179603.db2.gz ZLTYOUCSRHABBJ-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000171479081 510186325 /nfs/dbraw/zinc/18/63/25/510186325.db2.gz CKTJNJVFJDFSFV-GOSISDBHSA-N 1 1 357.410 2.913 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](C[C@@H]2CCCO2)[C@H]2CCSC2)c1 ZINC000245907831 510199865 /nfs/dbraw/zinc/19/98/65/510199865.db2.gz QWJHXIDGNVROHU-RDJZCZTQSA-N 1 1 352.456 2.960 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000174646954 510227398 /nfs/dbraw/zinc/22/73/98/510227398.db2.gz LBYJNVVWVJIGSG-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO Cc1c([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)nc2)cccc1[N+](=O)[O-] ZINC000177826816 510276103 /nfs/dbraw/zinc/27/61/03/510276103.db2.gz XSHHBAMURBQFQV-INIZCTEOSA-N 1 1 369.469 2.901 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Br)N1CC[NH+](C2CCC2)CC1 ZINC000265947448 510317234 /nfs/dbraw/zinc/31/72/34/510317234.db2.gz DALWJDPHWHGJIC-UHFFFAOYSA-N 1 1 368.231 2.668 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000265969275 510330298 /nfs/dbraw/zinc/33/02/98/510330298.db2.gz TZJZBBDBAWIKFJ-UHFFFAOYSA-N 1 1 359.430 2.812 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000181308531 510349082 /nfs/dbraw/zinc/34/90/82/510349082.db2.gz PADDQRLQUZKZHN-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000190828700 510363257 /nfs/dbraw/zinc/36/32/57/510363257.db2.gz PVDKEPWPPSHMAQ-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000190828700 510363263 /nfs/dbraw/zinc/36/32/63/510363263.db2.gz PVDKEPWPPSHMAQ-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404101 510392407 /nfs/dbraw/zinc/39/24/07/510392407.db2.gz RYTZDVKFBDRKQO-PWSUYJOCSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404101 510392409 /nfs/dbraw/zinc/39/24/09/510392409.db2.gz RYTZDVKFBDRKQO-PWSUYJOCSA-N 1 1 360.357 2.940 20 5 FFBDMO C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181540730 510462663 /nfs/dbraw/zinc/46/26/63/510462663.db2.gz OYXSVIOISWLUPG-LSDHHAIUSA-N 1 1 361.442 2.743 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cccc(C)c3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000178188595 510479223 /nfs/dbraw/zinc/47/92/23/510479223.db2.gz CISXGGHQTVVOAB-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194750686 510510876 /nfs/dbraw/zinc/51/08/76/510510876.db2.gz BHEBLKOHOZYSBY-KRWDZBQOSA-N 1 1 368.437 2.645 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269678973 510511231 /nfs/dbraw/zinc/51/12/31/510511231.db2.gz XQQHLUYDKSXORD-KRWDZBQOSA-N 1 1 374.393 2.506 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000194941699 510602232 /nfs/dbraw/zinc/60/22/32/510602232.db2.gz ALCBPRKHGIRUFW-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000246739307 510645130 /nfs/dbraw/zinc/64/51/30/510645130.db2.gz IITJRRMKTWHOEW-YJBOKZPZSA-N 1 1 363.458 2.770 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000246743279 510647706 /nfs/dbraw/zinc/64/77/06/510647706.db2.gz HAJOZZWQRQTNLP-WMLDXEAASA-N 1 1 358.442 2.725 20 5 FFBDMO Cn1cccc1[C@H]1CCCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181939558 510670898 /nfs/dbraw/zinc/67/08/98/510670898.db2.gz ZMNKOMKOODNARP-DOTOQJQBSA-N 1 1 359.426 2.900 20 5 FFBDMO C[C@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178645433 510702404 /nfs/dbraw/zinc/70/24/04/510702404.db2.gz CIZIAWCSKCELNT-HNNXBMFYSA-N 1 1 355.442 2.592 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000246909323 510739349 /nfs/dbraw/zinc/73/93/49/510739349.db2.gz RWUUKLLOYOKVMT-LIRRHRJNSA-N 1 1 373.453 2.910 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000185194492 510741268 /nfs/dbraw/zinc/74/12/68/510741268.db2.gz RVNSPJURMKDTEG-GFCCVEGCSA-N 1 1 361.377 2.665 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172584033 510805629 /nfs/dbraw/zinc/80/56/29/510805629.db2.gz JQHRUCIKXWEMFA-OAHLLOKOSA-N 1 1 360.458 2.872 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182190835 510805899 /nfs/dbraw/zinc/80/58/99/510805899.db2.gz XSQHAFXZJKPYRE-INIZCTEOSA-N 1 1 360.410 2.654 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000247259803 510854509 /nfs/dbraw/zinc/85/45/09/510854509.db2.gz DYWIUZWJTYFHGC-KBXCAEBGSA-N 1 1 371.441 2.583 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])C2)C1 ZINC000293966423 510913099 /nfs/dbraw/zinc/91/30/99/510913099.db2.gz UHHMQUNUXCZENM-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO C[NH+](C)C1CN(C(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)C1 ZINC000275951844 510921987 /nfs/dbraw/zinc/92/19/87/510921987.db2.gz KXIKOUDFSPLKHF-UHFFFAOYSA-N 1 1 357.360 2.758 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)c1c(C)noc1C ZINC000285534860 510946102 /nfs/dbraw/zinc/94/61/02/510946102.db2.gz FQTFMFOBSPFTDB-UHFFFAOYSA-N 1 1 362.386 2.672 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000360775429 510946289 /nfs/dbraw/zinc/94/62/89/510946289.db2.gz GNSDTJYWFUZJJO-QGZVFWFLSA-N 1 1 368.437 2.940 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCN(C)CC1 ZINC000271024206 511061129 /nfs/dbraw/zinc/06/11/29/511061129.db2.gz AYHQGVKDHWTBTM-HOTGVXAUSA-N 1 1 366.531 2.691 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCN1CCN(C)CC1 ZINC000271109513 511086635 /nfs/dbraw/zinc/08/66/35/511086635.db2.gz GYGVMLMOIBYVDS-MRXNPFEDSA-N 1 1 366.531 2.693 20 5 FFBDMO C[C@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000271214846 511122562 /nfs/dbraw/zinc/12/25/62/511122562.db2.gz WYXXGOMANFCFHO-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000271214846 511122567 /nfs/dbraw/zinc/12/25/67/511122567.db2.gz WYXXGOMANFCFHO-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000279626613 511151460 /nfs/dbraw/zinc/15/14/60/511151460.db2.gz AFCZJJWLCAHEBG-IAQYHMDHSA-N 1 1 361.423 2.959 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000279626613 511151465 /nfs/dbraw/zinc/15/14/65/511151465.db2.gz AFCZJJWLCAHEBG-IAQYHMDHSA-N 1 1 361.423 2.959 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000291530157 511233591 /nfs/dbraw/zinc/23/35/91/511233591.db2.gz KNXYRHCVOPSRQW-GFCCVEGCSA-N 1 1 360.414 2.699 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000295088314 511277536 /nfs/dbraw/zinc/27/75/36/511277536.db2.gz JDZYRORQHMZNSO-OAHLLOKOSA-N 1 1 361.442 2.652 20 5 FFBDMO C[C@H]1Cc2[nH+]cn(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2C[C@@H]1C ZINC000295107263 511283730 /nfs/dbraw/zinc/28/37/30/511283730.db2.gz HDKWOHNPEXESJW-STQMWFEESA-N 1 1 363.439 2.636 20 5 FFBDMO O=C(c1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363021316 511301393 /nfs/dbraw/zinc/30/13/93/511301393.db2.gz KZZOMSODTICKCX-CVEARBPZSA-N 1 1 358.442 2.870 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000363026746 511306355 /nfs/dbraw/zinc/30/63/55/511306355.db2.gz MPRFWZOOZVMRJA-LSDHHAIUSA-N 1 1 358.442 2.552 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000298545220 511322876 /nfs/dbraw/zinc/32/28/76/511322876.db2.gz NMQUOGIMKYJOAZ-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295278616 511346373 /nfs/dbraw/zinc/34/63/73/511346373.db2.gz IIMVVQJILXNPBF-CZUORRHYSA-N 1 1 369.425 2.684 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000283694334 511463900 /nfs/dbraw/zinc/46/39/00/511463900.db2.gz XJXRRODGHYKCPF-HNNXBMFYSA-N 1 1 371.441 2.657 20 5 FFBDMO C[C@H]1CC[S@@](=O)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468704 511469000 /nfs/dbraw/zinc/46/90/00/511469000.db2.gz HTBLJPGGTKRUBK-ZJWNCGCPSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@H]1CC[S@@](=O)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468704 511469004 /nfs/dbraw/zinc/46/90/04/511469004.db2.gz HTBLJPGGTKRUBK-ZJWNCGCPSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1CC[S@](=O)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468702 511469109 /nfs/dbraw/zinc/46/91/09/511469109.db2.gz HTBLJPGGTKRUBK-SHZVTRLKSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1CC[S@](=O)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468702 511469114 /nfs/dbraw/zinc/46/91/14/511469114.db2.gz HTBLJPGGTKRUBK-SHZVTRLKSA-N 1 1 363.439 2.635 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000292117231 511471638 /nfs/dbraw/zinc/47/16/38/511471638.db2.gz GGLANEKYEDGUAU-CQSZACIVSA-N 1 1 371.458 2.813 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000292117231 511471641 /nfs/dbraw/zinc/47/16/41/511471641.db2.gz GGLANEKYEDGUAU-CQSZACIVSA-N 1 1 371.458 2.813 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292245557 511520562 /nfs/dbraw/zinc/52/05/62/511520562.db2.gz XFSUQIDGMPBMKH-SJCJKPOMSA-N 1 1 366.849 2.603 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280623681 511537420 /nfs/dbraw/zinc/53/74/20/511537420.db2.gz WTFWPQARHCNWFZ-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280623681 511537425 /nfs/dbraw/zinc/53/74/25/511537425.db2.gz WTFWPQARHCNWFZ-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292300155 511543106 /nfs/dbraw/zinc/54/31/06/511543106.db2.gz MRZLQBOALJXTLI-LSDHHAIUSA-N 1 1 360.458 2.728 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587670 511545789 /nfs/dbraw/zinc/54/57/89/511545789.db2.gz QWYPPTKQJXNJKX-AUUYWEPGSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587670 511545793 /nfs/dbraw/zinc/54/57/93/511545793.db2.gz QWYPPTKQJXNJKX-AUUYWEPGSA-N 1 1 366.421 2.962 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000299195013 511547484 /nfs/dbraw/zinc/54/74/84/511547484.db2.gz MLHMHMCTCVKFCJ-BFYDXBDKSA-N 1 1 361.442 2.617 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)C2)C1 ZINC000292331834 511555925 /nfs/dbraw/zinc/55/59/25/511555925.db2.gz UGKIFSNCZPRHTA-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)C2)C1 ZINC000296005608 511586074 /nfs/dbraw/zinc/58/60/74/511586074.db2.gz VXWIJLZTJWJEJA-LJQANCHMSA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)C2)C1 ZINC000296005608 511586080 /nfs/dbraw/zinc/58/60/80/511586080.db2.gz VXWIJLZTJWJEJA-LJQANCHMSA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCN1C(=O)c2ccccc2C1=O ZINC000299691248 511667507 /nfs/dbraw/zinc/66/75/07/511667507.db2.gz ASFVNRFSKGLDTH-VURMDHGXSA-N 1 1 365.389 2.836 20 5 FFBDMO Cn1cc(C[N@H+]2CCOCC3(CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000363916217 511847919 /nfs/dbraw/zinc/84/79/19/511847919.db2.gz DSOXLOLYGSULJV-UHFFFAOYSA-N 1 1 356.426 2.998 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC000363999554 511897384 /nfs/dbraw/zinc/89/73/84/511897384.db2.gz ZGXKSRKCXJMQOT-LBPRGKRZSA-N 1 1 355.797 2.627 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000364053270 511932250 /nfs/dbraw/zinc/93/22/50/511932250.db2.gz GRIDTLDJXYXCTE-PKOBYXMFSA-N 1 1 369.421 2.782 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293353968 511935142 /nfs/dbraw/zinc/93/51/42/511935142.db2.gz KXMZRIYPIUGQTA-OTYXRUKQSA-N 1 1 357.332 2.826 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293387279 511946206 /nfs/dbraw/zinc/94/62/06/511946206.db2.gz GREZKZGGSHHGMB-GFCCVEGCSA-N 1 1 359.348 2.962 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000293387279 511946212 /nfs/dbraw/zinc/94/62/12/511946212.db2.gz GREZKZGGSHHGMB-GFCCVEGCSA-N 1 1 359.348 2.962 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(=O)NCC(F)(F)F)C1 ZINC000275078754 512034967 /nfs/dbraw/zinc/03/49/67/512034967.db2.gz CNZMLXQCIXFIEK-RYUDHWBXSA-N 1 1 359.348 2.965 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000411063652 512456029 /nfs/dbraw/zinc/45/60/29/512456029.db2.gz SLHVAKUKRGTKEE-NSHDSACASA-N 1 1 357.357 2.753 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000411063652 512456031 /nfs/dbraw/zinc/45/60/31/512456031.db2.gz SLHVAKUKRGTKEE-NSHDSACASA-N 1 1 357.357 2.753 20 5 FFBDMO CN1CCC2(CC[NH+](Cc3cc([N+](=O)[O-])ccc3OC(F)F)CC2)C1=O ZINC000369649519 512533316 /nfs/dbraw/zinc/53/33/16/512533316.db2.gz RDRNPEREAIQILA-UHFFFAOYSA-N 1 1 369.368 2.641 20 5 FFBDMO COC(=O)c1cc(F)ccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000369682207 512551220 /nfs/dbraw/zinc/55/12/20/512551220.db2.gz CENQVHSIYTYCCS-UHFFFAOYSA-N 1 1 362.361 2.554 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+](C[C@H](C)OC)C(C)C)c([N+](=O)[O-])c1 ZINC000411285348 512562528 /nfs/dbraw/zinc/56/25/28/512562528.db2.gz RFCZYYUCNBOVEI-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000373942516 512584369 /nfs/dbraw/zinc/58/43/69/512584369.db2.gz HBGFQVZRSKPCQY-HZPDHXFCSA-N 1 1 361.442 2.615 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000379933350 512871423 /nfs/dbraw/zinc/87/14/23/512871423.db2.gz ADKQIWUKUYHLPS-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO CCc1nn(C)c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]3C2)c1[N+](=O)[O-] ZINC000381013583 512874721 /nfs/dbraw/zinc/87/47/21/512874721.db2.gz PYPMNWCQMZQPGN-IRXDYDNUSA-N 1 1 369.469 2.849 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000411920917 512875114 /nfs/dbraw/zinc/87/51/14/512875114.db2.gz CUAIMRAAEPBEFY-CRAIPNDOSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411932527 512879505 /nfs/dbraw/zinc/87/95/05/512879505.db2.gz GAEJBUROQPVAKG-MSOLQXFVSA-N 1 1 355.394 2.731 20 5 FFBDMO C[N@@H+](CCNc1c(Br)cncc1[N+](=O)[O-])Cc1ccccc1 ZINC000386691944 512890462 /nfs/dbraw/zinc/89/04/62/512890462.db2.gz KPJMOTOECOCBCG-UHFFFAOYSA-N 1 1 365.231 2.718 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000389892135 512903774 /nfs/dbraw/zinc/90/37/74/512903774.db2.gz WOLVNSRVWOVZMD-WMLDXEAASA-N 1 1 368.437 2.887 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000368364990 512915691 /nfs/dbraw/zinc/91/56/91/512915691.db2.gz OORUGWSGCSLVBP-CRAIPNDOSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 ZINC000368364990 512915695 /nfs/dbraw/zinc/91/56/95/512915695.db2.gz OORUGWSGCSLVBP-CRAIPNDOSA-N 1 1 357.410 2.813 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CC[C@@H](O)C[C@H]4C3)o2)c1 ZINC000412051299 512933045 /nfs/dbraw/zinc/93/30/45/512933045.db2.gz WGYXRCQMSXUIHN-YQQAZPJKSA-N 1 1 357.410 2.885 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000412074663 512945275 /nfs/dbraw/zinc/94/52/75/512945275.db2.gz IOZDLDAEMQODJV-RYUDHWBXSA-N 1 1 374.384 2.840 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370582884 513003589 /nfs/dbraw/zinc/00/35/89/513003589.db2.gz LAIPKZQVADUZIC-KRWDZBQOSA-N 1 1 368.437 2.974 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000370584899 513004723 /nfs/dbraw/zinc/00/47/23/513004723.db2.gz VYUMSHKPZWOBHS-OAHLLOKOSA-N 1 1 354.410 2.726 20 5 FFBDMO CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372754512 513029289 /nfs/dbraw/zinc/02/92/89/513029289.db2.gz YLYJYOKYCRTFNI-KRWDZBQOSA-N 1 1 369.469 2.748 20 5 FFBDMO CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000372754512 513029291 /nfs/dbraw/zinc/02/92/91/513029291.db2.gz YLYJYOKYCRTFNI-KRWDZBQOSA-N 1 1 369.469 2.748 20 5 FFBDMO CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372754513 513029542 /nfs/dbraw/zinc/02/95/42/513029542.db2.gz YLYJYOKYCRTFNI-QGZVFWFLSA-N 1 1 369.469 2.748 20 5 FFBDMO CN(c1nc2ccccc2cc1[N+](=O)[O-])[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000372754513 513029547 /nfs/dbraw/zinc/02/95/47/513029547.db2.gz YLYJYOKYCRTFNI-QGZVFWFLSA-N 1 1 369.469 2.748 20 5 FFBDMO C[N@H+]1CCCC12CCN(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000370653496 513035606 /nfs/dbraw/zinc/03/56/06/513035606.db2.gz YJLIMUOSBNNYFS-UHFFFAOYSA-N 1 1 357.414 2.705 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000372810109 513053558 /nfs/dbraw/zinc/05/35/58/513053558.db2.gz NIZGUZCUQBUEIL-FUHWJXTLSA-N 1 1 374.441 2.815 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000368855093 513122380 /nfs/dbraw/zinc/12/23/80/513122380.db2.gz QRZRPMQWCGVATG-HNNXBMFYSA-N 1 1 361.398 2.870 20 5 FFBDMO COC(=O)[C@@H]1CCO[C@H]1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000428713265 513171901 /nfs/dbraw/zinc/17/19/01/513171901.db2.gz RYGBYTRFQOKOEH-DYVFJYSZSA-N 1 1 366.389 2.524 20 5 FFBDMO C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C1CCN(C)CC1 ZINC000450423265 513188211 /nfs/dbraw/zinc/18/82/11/513188211.db2.gz WZPMYUZVYPRDRF-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CCN1C1CC[NH+](C)CC1 ZINC000450423265 513188214 /nfs/dbraw/zinc/18/82/14/513188214.db2.gz WZPMYUZVYPRDRF-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000412704575 513236989 /nfs/dbraw/zinc/23/69/89/513236989.db2.gz ZSYSUBUFGJRQHK-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000412704575 513236992 /nfs/dbraw/zinc/23/69/92/513236992.db2.gz ZSYSUBUFGJRQHK-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000429041008 513266932 /nfs/dbraw/zinc/26/69/32/513266932.db2.gz NTDWPAFPWWLPCP-PGSNGQOISA-N 1 1 374.485 2.892 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]1C(C)C ZINC000429360515 513351127 /nfs/dbraw/zinc/35/11/27/513351127.db2.gz HWGXGJRKPYDVGQ-LRDDRELGSA-N 1 1 354.378 2.762 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413054012 513411154 /nfs/dbraw/zinc/41/11/54/513411154.db2.gz MAEVEJDHSQMXIA-UHFFFAOYSA-N 1 1 373.432 2.879 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425394555 513541025 /nfs/dbraw/zinc/54/10/25/513541025.db2.gz LEBWONAVPOLZQW-GFCCVEGCSA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425394555 513541027 /nfs/dbraw/zinc/54/10/27/513541027.db2.gz LEBWONAVPOLZQW-GFCCVEGCSA-N 1 1 356.220 2.587 20 5 FFBDMO CCc1cnc(N2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000441336747 513543601 /nfs/dbraw/zinc/54/36/01/513543601.db2.gz SYIGUKWJWPDZAA-UHFFFAOYSA-N 1 1 362.455 2.815 20 5 FFBDMO COc1ccccc1[C@H]([NH3+])C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000430114117 513556469 /nfs/dbraw/zinc/55/64/69/513556469.db2.gz PQYSLDFCJKPWEF-SFHVURJKSA-N 1 1 357.410 2.742 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000430306802 513617229 /nfs/dbraw/zinc/61/72/29/513617229.db2.gz XMYRTXPQBCCRGB-MRXNPFEDSA-N 1 1 369.421 2.959 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000430334029 513625935 /nfs/dbraw/zinc/62/59/35/513625935.db2.gz TYAOSXBXIMSFJL-INIZCTEOSA-N 1 1 369.421 2.959 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000451347706 513693973 /nfs/dbraw/zinc/69/39/73/513693973.db2.gz UPPXXMMJHIFWJK-KURKYZTESA-N 1 1 361.442 2.573 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000451404622 513725954 /nfs/dbraw/zinc/72/59/54/513725954.db2.gz BDGJZQNYUWFTTK-MRXNPFEDSA-N 1 1 374.416 2.864 20 5 FFBDMO CC[C@]1(O)CC[N@@H+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000425913689 513797706 /nfs/dbraw/zinc/79/77/06/513797706.db2.gz HCNLGULAFQXMRE-INIZCTEOSA-N 1 1 360.357 2.594 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000436234368 513804180 /nfs/dbraw/zinc/80/41/80/513804180.db2.gz XBRJUDPMPWQGPP-AWEZNQCLSA-N 1 1 363.462 2.968 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448780729 513896346 /nfs/dbraw/zinc/89/63/46/513896346.db2.gz KWJHYYACJWRNQQ-GJZGRUSLSA-N 1 1 361.442 2.794 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2C[C@@H](O)CC[C@@H]2C1 ZINC000451700292 513921468 /nfs/dbraw/zinc/92/14/68/513921468.db2.gz XFOMSUUMSISDSV-INMHGKMJSA-N 1 1 361.442 2.715 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCc2ccccc2CC1 ZINC000451709749 513928564 /nfs/dbraw/zinc/92/85/64/513928564.db2.gz LLVSUCOLKHHRIP-GOSISDBHSA-N 1 1 356.422 2.825 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431832904 514015026 /nfs/dbraw/zinc/01/50/26/514015026.db2.gz MAQKDBCNUDQXLP-IJEWVQPXSA-N 1 1 363.458 2.765 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000451963700 514098336 /nfs/dbraw/zinc/09/83/36/514098336.db2.gz IURGVNBELQKNLI-NVXWUHKLSA-N 1 1 352.456 2.554 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559719 514180976 /nfs/dbraw/zinc/18/09/76/514180976.db2.gz PLAGVGZQYPHOBL-UZLBHIALSA-N 1 1 371.437 2.538 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-] ZINC000414559719 514180984 /nfs/dbraw/zinc/18/09/84/514180984.db2.gz PLAGVGZQYPHOBL-UZLBHIALSA-N 1 1 371.437 2.538 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000427360234 514194327 /nfs/dbraw/zinc/19/43/27/514194327.db2.gz YLFODJVQHIYHCE-KSSFIOAISA-N 1 1 369.421 2.854 20 5 FFBDMO CC1(C)CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000420589825 514195204 /nfs/dbraw/zinc/19/52/04/514195204.db2.gz VFUUQVFFDGVWPC-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000427369806 514195820 /nfs/dbraw/zinc/19/58/20/514195820.db2.gz KVOPLQJVLPTLGJ-GJZGRUSLSA-N 1 1 371.441 2.546 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000427369806 514195824 /nfs/dbraw/zinc/19/58/24/514195824.db2.gz KVOPLQJVLPTLGJ-GJZGRUSLSA-N 1 1 371.441 2.546 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)[N@@H+]1CCO ZINC000449535807 514245157 /nfs/dbraw/zinc/24/51/57/514245157.db2.gz OQPKWEDXTQDSHE-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)N1CCO ZINC000449535807 514245162 /nfs/dbraw/zinc/24/51/62/514245162.db2.gz OQPKWEDXTQDSHE-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)N1CCO ZINC000449535807 514245169 /nfs/dbraw/zinc/24/51/69/514245169.db2.gz OQPKWEDXTQDSHE-GASCZTMLSA-N 1 1 359.426 2.742 20 5 FFBDMO COc1ccc(C[N@@H+]2CCN(CC(F)(F)F)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000449666478 514291241 /nfs/dbraw/zinc/29/12/41/514291241.db2.gz PJJYEJMJLZLWHJ-GFCCVEGCSA-N 1 1 361.364 2.919 20 5 FFBDMO COc1ccc(C[N@H+]2CCN(CC(F)(F)F)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000449666478 514291250 /nfs/dbraw/zinc/29/12/50/514291250.db2.gz PJJYEJMJLZLWHJ-GFCCVEGCSA-N 1 1 361.364 2.919 20 5 FFBDMO CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000452340555 514291732 /nfs/dbraw/zinc/29/17/32/514291732.db2.gz CCRSROHUKRVOKR-ZDUSSCGKSA-N 1 1 359.430 2.711 20 5 FFBDMO CC[NH+](CC)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000427908584 514343191 /nfs/dbraw/zinc/34/31/91/514343191.db2.gz NPFCRMKKYRBFFB-SFHVURJKSA-N 1 1 371.437 2.983 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1 ZINC000438685763 514425078 /nfs/dbraw/zinc/42/50/78/514425078.db2.gz BQDFYYPQQYCPQA-UHFFFAOYSA-N 1 1 367.471 2.549 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1 ZINC000438685763 514425087 /nfs/dbraw/zinc/42/50/87/514425087.db2.gz BQDFYYPQQYCPQA-UHFFFAOYSA-N 1 1 367.471 2.549 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC(OC(C)(C)C)C1 ZINC000420987650 514425697 /nfs/dbraw/zinc/42/56/97/514425697.db2.gz QIAVAIZMPFVLJE-CKDBGZEDSA-N 1 1 352.431 2.612 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C(C)(C)C ZINC000475349969 514631118 /nfs/dbraw/zinc/63/11/18/514631118.db2.gz PLYQTABMIHBTFW-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cc1ccc(CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]2CCCO2)cc1 ZINC000475368055 514637446 /nfs/dbraw/zinc/63/74/46/514637446.db2.gz ZGUGPMCAEAPBNF-KRWDZBQOSA-N 1 1 358.442 2.860 20 5 FFBDMO Cc1ccc(CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]2CCCO2)cc1 ZINC000475368055 514637454 /nfs/dbraw/zinc/63/74/54/514637454.db2.gz ZGUGPMCAEAPBNF-KRWDZBQOSA-N 1 1 358.442 2.860 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000458238086 514653138 /nfs/dbraw/zinc/65/31/38/514653138.db2.gz ZNHFQWBUFVVXML-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCCC[C@H]1C ZINC000479858255 514746946 /nfs/dbraw/zinc/74/69/46/514746946.db2.gz AUXVGQIPCCVPKS-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO CNc1nc(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000455861287 514790408 /nfs/dbraw/zinc/79/04/08/514790408.db2.gz NEVCSFJSYXZBOY-CQSZACIVSA-N 1 1 371.441 2.672 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC000484884014 514828994 /nfs/dbraw/zinc/82/89/94/514828994.db2.gz MFKGSIKYFNHTIO-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO CC(C)c1cc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)nc(N(C)C)[nH+]1 ZINC000462113818 514890547 /nfs/dbraw/zinc/89/05/47/514890547.db2.gz XOYDLNZLCFYNGC-UHFFFAOYSA-N 1 1 370.457 2.901 20 5 FFBDMO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000508776019 514891229 /nfs/dbraw/zinc/89/12/29/514891229.db2.gz WRTQEDKRWLTJSM-UPJWGTAASA-N 1 1 359.430 2.567 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000498566548 514970943 /nfs/dbraw/zinc/97/09/43/514970943.db2.gz LIQZVJFBCGBESP-AVGNSLFASA-N 1 1 369.849 2.957 20 5 FFBDMO CC(C)(CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[NH+]1CCOCC1 ZINC000485396790 515023026 /nfs/dbraw/zinc/02/30/26/515023026.db2.gz NTVOILSCBZKPAZ-UHFFFAOYSA-N 1 1 374.416 2.741 20 5 FFBDMO COc1cc(CN2CC[NH+]([C@H](C)c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000490102393 515105463 /nfs/dbraw/zinc/10/54/63/515105463.db2.gz MHZRQUKPEVCXKA-OAHLLOKOSA-N 1 1 356.426 2.877 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1C ZINC000480946220 515147073 /nfs/dbraw/zinc/14/70/73/515147073.db2.gz ANGOXYKWHRQZRB-JSGCOSHPSA-N 1 1 369.487 2.610 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2nnnn2-c2ccccc2)C2CC2)c1 ZINC000490419189 515204456 /nfs/dbraw/zinc/20/44/56/515204456.db2.gz PFLXLYYTPNZRPZ-UHFFFAOYSA-N 1 1 364.409 2.778 20 5 FFBDMO COc1ccc(OCC[N@@H+](CCO)CC2CCCCC2)c([N+](=O)[O-])c1 ZINC000485859807 515221548 /nfs/dbraw/zinc/22/15/48/515221548.db2.gz REYLCWMEPOFPKP-UHFFFAOYSA-N 1 1 352.431 2.857 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485903450 515249571 /nfs/dbraw/zinc/24/95/71/515249571.db2.gz DXTULWNTUKHQEW-VXGBXAGGSA-N 1 1 355.385 2.652 20 5 FFBDMO CCN(CC)C(=O)C[N@@H+]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240411 515278485 /nfs/dbraw/zinc/27/84/85/515278485.db2.gz LZEHKDHBIKDQKG-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)C[N@H+]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240411 515278493 /nfs/dbraw/zinc/27/84/93/515278493.db2.gz LZEHKDHBIKDQKG-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240411 515278502 /nfs/dbraw/zinc/27/85/02/515278502.db2.gz LZEHKDHBIKDQKG-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CCN(CC)C(=O)CN1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000468240411 515278509 /nfs/dbraw/zinc/27/85/09/515278509.db2.gz LZEHKDHBIKDQKG-INIZCTEOSA-N 1 1 362.474 2.532 20 5 FFBDMO CNc1nc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000454272317 515356220 /nfs/dbraw/zinc/35/62/20/515356220.db2.gz GLALGOUKLCDMSJ-HNNXBMFYSA-N 1 1 373.413 2.582 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000477174458 515358020 /nfs/dbraw/zinc/35/80/20/515358020.db2.gz HTUBDXDOFACDQK-LJQANCHMSA-N 1 1 370.405 2.829 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000509948471 515378930 /nfs/dbraw/zinc/37/89/30/515378930.db2.gz ISRQXFSFVDIIHH-NSHDSACASA-N 1 1 363.345 2.532 20 5 FFBDMO Cn1c(C(=O)NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000477298947 515404284 /nfs/dbraw/zinc/40/42/84/515404284.db2.gz YJGHXWKUSSZBTR-KRWDZBQOSA-N 1 1 356.426 2.574 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736174 515447098 /nfs/dbraw/zinc/44/70/98/515447098.db2.gz MYFBBDAKYXLZOL-HZPDHXFCSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736174 515447107 /nfs/dbraw/zinc/44/71/07/515447107.db2.gz MYFBBDAKYXLZOL-HZPDHXFCSA-N 1 1 366.414 2.536 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)[C@@H](c2ccccc2)C1 ZINC000481793546 515468901 /nfs/dbraw/zinc/46/89/01/515468901.db2.gz KKWMTEZKDDGUMM-MJGOQNOKSA-N 1 1 364.405 2.904 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505556958 515584301 /nfs/dbraw/zinc/58/43/01/515584301.db2.gz FMSWBLFALWADAT-KRWDZBQOSA-N 1 1 369.421 2.709 20 5 FFBDMO CC(C)(NC(=O)c1cc(C[NH+]2CCCC2)on1)c1ccc([N+](=O)[O-])cc1 ZINC000486778958 515629897 /nfs/dbraw/zinc/62/98/97/515629897.db2.gz HMXQMIHFQBZUSM-UHFFFAOYSA-N 1 1 358.398 2.844 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C1CC1 ZINC000457161111 515694899 /nfs/dbraw/zinc/69/48/99/515694899.db2.gz CUQZMGZZMCOSSD-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1nc2c(s1)CCC2 ZINC000459636711 515710151 /nfs/dbraw/zinc/71/01/51/515710151.db2.gz QJMIKPSOONGADE-LLVKDONJSA-N 1 1 372.450 2.780 20 5 FFBDMO CCC[C@@H](NCCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000482569755 515723994 /nfs/dbraw/zinc/72/39/94/515723994.db2.gz QFLZIPXNGUPZHW-SJLPKXTDSA-N 1 1 362.474 2.613 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929496 515727170 /nfs/dbraw/zinc/72/71/70/515727170.db2.gz DOCMPUOMVGAASJ-CJNGLKHVSA-N 1 1 355.394 2.866 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929496 515727177 /nfs/dbraw/zinc/72/71/77/515727177.db2.gz DOCMPUOMVGAASJ-CJNGLKHVSA-N 1 1 355.394 2.866 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694406 515771935 /nfs/dbraw/zinc/77/19/35/515771935.db2.gz WGOBDFGNOQNPAH-KBPBESRZSA-N 1 1 373.457 2.988 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694406 515771940 /nfs/dbraw/zinc/77/19/40/515771940.db2.gz WGOBDFGNOQNPAH-KBPBESRZSA-N 1 1 373.457 2.988 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cn[nH]c1 ZINC000494686739 515923259 /nfs/dbraw/zinc/92/32/59/515923259.db2.gz CPEOUJGAGNAMCJ-SNVBAGLBSA-N 1 1 372.410 2.731 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000501087496 515974048 /nfs/dbraw/zinc/97/40/48/515974048.db2.gz UQWQGTDFMDRWST-ONGXEEELSA-N 1 1 371.235 2.962 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000464937344 516020610 /nfs/dbraw/zinc/02/06/10/516020610.db2.gz RIGUEYAQFFSTLV-KRWDZBQOSA-N 1 1 370.453 2.918 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000501234353 516025997 /nfs/dbraw/zinc/02/59/97/516025997.db2.gz OJGRFUAPHZESPR-GDBMZVCRSA-N 1 1 354.410 2.864 20 5 FFBDMO COc1c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000474416208 516036780 /nfs/dbraw/zinc/03/67/80/516036780.db2.gz VRIGAPTUTVHFRS-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000460221614 516074491 /nfs/dbraw/zinc/07/44/91/516074491.db2.gz OLGUNIXUGHYYAC-UHFFFAOYSA-N 1 1 358.442 2.921 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474555834 516093884 /nfs/dbraw/zinc/09/38/84/516093884.db2.gz JPFILOUHKJAYNQ-UHFFFAOYSA-N 1 1 357.863 2.893 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000470114480 516125883 /nfs/dbraw/zinc/12/58/83/516125883.db2.gz LESBSXBXWCTOAS-RYUDHWBXSA-N 1 1 368.409 2.743 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000512043146 516127251 /nfs/dbraw/zinc/12/72/51/516127251.db2.gz XEIBEGVECRJMBI-STQMWFEESA-N 1 1 369.849 2.864 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000507618706 516264241 /nfs/dbraw/zinc/26/42/41/516264241.db2.gz SXERDXXWNYOCIL-RDJZCZTQSA-N 1 1 369.421 2.925 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523135676 516394708 /nfs/dbraw/zinc/39/47/08/516394708.db2.gz UXDPLOMDONOULU-OAHLLOKOSA-N 1 1 369.849 2.816 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000523202405 516408166 /nfs/dbraw/zinc/40/81/66/516408166.db2.gz NXARONCXWLIVET-HNNXBMFYSA-N 1 1 362.474 2.947 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)ccc1OC(F)F ZINC000531342494 516419057 /nfs/dbraw/zinc/41/90/57/516419057.db2.gz GNQXNPZQGOWLIA-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO NC(=O)c1cccc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000561232494 516468071 /nfs/dbraw/zinc/46/80/71/516468071.db2.gz VSWUYTFRGNFWMM-HNNXBMFYSA-N 1 1 354.410 2.770 20 5 FFBDMO CN1CC[N@@H+](CCCNc2ccc([N+](=O)[O-])nc2)[C@@H](c2ccccc2)C1 ZINC000513103549 516476439 /nfs/dbraw/zinc/47/64/39/516476439.db2.gz WKWAJUDDIXPOLG-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2ccc([N+](=O)[O-])nc2)[C@@H](c2ccccc2)C1 ZINC000513103549 516476447 /nfs/dbraw/zinc/47/64/47/516476447.db2.gz WKWAJUDDIXPOLG-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@H+]1CCN(CCCNc2ccc([N+](=O)[O-])nc2)[C@@H](c2ccccc2)C1 ZINC000513103549 516476456 /nfs/dbraw/zinc/47/64/56/516476456.db2.gz WKWAJUDDIXPOLG-GOSISDBHSA-N 1 1 355.442 2.781 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000557877161 516483277 /nfs/dbraw/zinc/48/32/77/516483277.db2.gz AKYCUOJHBRQFFU-CVEARBPZSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)C1 ZINC000561347279 516534813 /nfs/dbraw/zinc/53/48/13/516534813.db2.gz IDPLMKXOSNMIJX-AHIWAGSCSA-N 1 1 365.861 2.979 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000561404218 516563494 /nfs/dbraw/zinc/56/34/94/516563494.db2.gz RZPIVAKBFSOWCE-UHFFFAOYSA-N 1 1 353.378 2.713 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)NCc1ccco1 ZINC000536019266 516595303 /nfs/dbraw/zinc/59/53/03/516595303.db2.gz VVZDABOVTLFTPK-UHFFFAOYSA-N 1 1 355.350 2.854 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](c1cncc(Br)c1)C1CC1 ZINC000551426102 516706736 /nfs/dbraw/zinc/70/67/36/516706736.db2.gz QOZQBIJDKFXEPX-ZDUSSCGKSA-N 1 1 366.219 2.727 20 5 FFBDMO CC(=O)NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCSCC1 ZINC000555071460 516765452 /nfs/dbraw/zinc/76/54/52/516765452.db2.gz RSYDMCHGGUUBBN-UHFFFAOYSA-N 1 1 355.435 2.568 20 5 FFBDMO CC(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCSCC1 ZINC000555071460 516765460 /nfs/dbraw/zinc/76/54/60/516765460.db2.gz RSYDMCHGGUUBBN-UHFFFAOYSA-N 1 1 355.435 2.568 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637201 516776045 /nfs/dbraw/zinc/77/60/45/516776045.db2.gz QDOODUOOWSHPIF-IHRRRGAJSA-N 1 1 363.462 2.748 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C[C@H]1C ZINC000544655996 516859035 /nfs/dbraw/zinc/85/90/35/516859035.db2.gz VGEJWRDABHVNSO-UKRRQHHQSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000555598144 517005260 /nfs/dbraw/zinc/00/52/60/517005260.db2.gz PBWDGTYUBDKFDD-DNVCBOLYSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525468558 517050758 /nfs/dbraw/zinc/05/07/58/517050758.db2.gz AHALPUOEIGRXDI-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525468558 517050768 /nfs/dbraw/zinc/05/07/68/517050768.db2.gz AHALPUOEIGRXDI-DNVCBOLYSA-N 1 1 369.421 2.614 20 5 FFBDMO Cc1ccc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000552057692 517055837 /nfs/dbraw/zinc/05/58/37/517055837.db2.gz DDOVOKHPUCECOX-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CO[C@@H](CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000552066038 517060525 /nfs/dbraw/zinc/06/05/25/517060525.db2.gz WZXXBJMCPDSYBS-KBPBESRZSA-N 1 1 372.347 2.975 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552254473 517164139 /nfs/dbraw/zinc/16/41/39/517164139.db2.gz GHSOOFHKVVSOIX-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552282318 517177616 /nfs/dbraw/zinc/17/76/16/517177616.db2.gz AFVRJWJZRFPKQA-RYQLBKOJSA-N 1 1 356.426 2.965 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C ZINC000555928398 517188356 /nfs/dbraw/zinc/18/83/56/517188356.db2.gz OWEGTGRQSGEUNU-GHMZBOCLSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C ZINC000555928398 517188363 /nfs/dbraw/zinc/18/83/63/517188363.db2.gz OWEGTGRQSGEUNU-GHMZBOCLSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532972180 517228746 /nfs/dbraw/zinc/22/87/46/517228746.db2.gz PJZOBOZXHHRUSR-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532972180 517228758 /nfs/dbraw/zinc/22/87/58/517228758.db2.gz PJZOBOZXHHRUSR-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])CC2 ZINC000515304701 517289305 /nfs/dbraw/zinc/28/93/05/517289305.db2.gz UGKXUIWICSWRBV-OAHLLOKOSA-N 1 1 371.441 2.589 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000552513153 517291485 /nfs/dbraw/zinc/29/14/85/517291485.db2.gz ILTQCICOILRBLE-QAPCUYQASA-N 1 1 360.385 2.963 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000520834943 517528993 /nfs/dbraw/zinc/52/89/93/517528993.db2.gz SGUKFXJQYGBWPK-OAHLLOKOSA-N 1 1 354.410 2.751 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000520834943 517529003 /nfs/dbraw/zinc/52/90/03/517529003.db2.gz SGUKFXJQYGBWPK-OAHLLOKOSA-N 1 1 354.410 2.751 20 5 FFBDMO CCc1oc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C(=O)OC ZINC000549406750 517550051 /nfs/dbraw/zinc/55/00/51/517550051.db2.gz NYMUNWWUDOUXTK-GFCCVEGCSA-N 1 1 374.397 2.618 20 5 FFBDMO CCc1oc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C(=O)OC ZINC000549406750 517550058 /nfs/dbraw/zinc/55/00/58/517550058.db2.gz NYMUNWWUDOUXTK-GFCCVEGCSA-N 1 1 374.397 2.618 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553455 517615062 /nfs/dbraw/zinc/61/50/62/517615062.db2.gz BDTFBUOTBGYNOP-PBHICJAKSA-N 1 1 351.447 2.527 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000549553455 517615068 /nfs/dbraw/zinc/61/50/68/517615068.db2.gz BDTFBUOTBGYNOP-PBHICJAKSA-N 1 1 351.447 2.527 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000533845471 517638974 /nfs/dbraw/zinc/63/89/74/517638974.db2.gz FBKDSPRBVZLREX-QGZVFWFLSA-N 1 1 354.410 2.923 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533845471 517638984 /nfs/dbraw/zinc/63/89/84/517638984.db2.gz FBKDSPRBVZLREX-QGZVFWFLSA-N 1 1 354.410 2.923 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CCC(C[N@H+](C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000521210632 517650375 /nfs/dbraw/zinc/65/03/75/517650375.db2.gz ZKFOIAHFTGOGOP-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000516500813 517713102 /nfs/dbraw/zinc/71/31/02/517713102.db2.gz OLMPWWDAEBKMAH-IRXDYDNUSA-N 1 1 372.469 2.554 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000538918424 517843685 /nfs/dbraw/zinc/84/36/85/517843685.db2.gz ARSTYYUFTKZKPV-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@@H+]1C ZINC000538918424 517843695 /nfs/dbraw/zinc/84/36/95/517843695.db2.gz ARSTYYUFTKZKPV-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1(C)C ZINC000550117236 517869235 /nfs/dbraw/zinc/86/92/35/517869235.db2.gz VGIXMWSNLVLQCR-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1(C)C ZINC000550117236 517869241 /nfs/dbraw/zinc/86/92/41/517869241.db2.gz VGIXMWSNLVLQCR-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO C[C@@H]1C[C@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000560524578 517872849 /nfs/dbraw/zinc/87/28/49/517872849.db2.gz GWANERQKUTYDLY-XUWXXGDYSA-N 1 1 355.442 2.633 20 5 FFBDMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543136552 517927228 /nfs/dbraw/zinc/92/72/28/517927228.db2.gz HNVZZXQKYIOJIL-AKCHCHLHSA-N 1 1 372.421 2.659 20 5 FFBDMO COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc2c(c1)OCO2 ZINC000522081395 517979791 /nfs/dbraw/zinc/97/97/91/517979791.db2.gz ANXGSQKWBNOMPD-UHFFFAOYSA-N 1 1 374.393 2.851 20 5 FFBDMO COC(=O)CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)C ZINC000522084724 517981012 /nfs/dbraw/zinc/98/10/12/517981012.db2.gz SOMPZSPZEXEZGF-UHFFFAOYSA-N 1 1 362.386 2.666 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@H]1Cc1ccccc1 ZINC000563556601 517982290 /nfs/dbraw/zinc/98/22/90/517982290.db2.gz BDFBUJMLROVPNU-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@H]1Cc1ccccc1 ZINC000563556601 517982296 /nfs/dbraw/zinc/98/22/96/517982296.db2.gz BDFBUJMLROVPNU-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)nc1-c1ccc(F)cc1 ZINC000550339442 518005790 /nfs/dbraw/zinc/00/57/90/518005790.db2.gz PDHOSPWTQNAZDG-UHFFFAOYSA-N 1 1 368.372 2.846 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000517173621 518050362 /nfs/dbraw/zinc/05/03/62/518050362.db2.gz YNUOLDHMBAHOFF-PMUMKWKESA-N 1 1 351.406 2.863 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000522651380 518140964 /nfs/dbraw/zinc/14/09/64/518140964.db2.gz NTVBZYMPKQIEBO-UONOGXRCSA-N 1 1 367.833 2.760 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC(C)(C)O)C1CCOCC1 ZINC000539835438 518170598 /nfs/dbraw/zinc/17/05/98/518170598.db2.gz CSZHTAZATJDGDW-UHFFFAOYSA-N 1 1 352.431 2.745 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2nccc(C(N)=O)c2[N+](=O)[O-])cc1 ZINC000572570729 518251390 /nfs/dbraw/zinc/25/13/90/518251390.db2.gz ZUSNDDWVQRTYPA-LLVKDONJSA-N 1 1 366.381 2.756 20 5 FFBDMO C[N@H+](CCCS(=O)(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000584481972 518362055 /nfs/dbraw/zinc/36/20/55/518362055.db2.gz XHWSUPPACRJQGZ-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO C[N@@H+](CCCS(=O)(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000584481972 518362063 /nfs/dbraw/zinc/36/20/63/518362063.db2.gz XHWSUPPACRJQGZ-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1 ZINC000570032329 518408171 /nfs/dbraw/zinc/40/81/71/518408171.db2.gz ZLAAOJDEJHZJBG-KRWDZBQOSA-N 1 1 355.394 2.722 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000579154211 518546050 /nfs/dbraw/zinc/54/60/50/518546050.db2.gz XLVSUTXSHGAQOS-SCRDCRAPSA-N 1 1 364.446 2.863 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000582081315 518579344 /nfs/dbraw/zinc/57/93/44/518579344.db2.gz APAATHDRIUYROC-QGZVFWFLSA-N 1 1 371.441 2.727 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000567625037 518620692 /nfs/dbraw/zinc/62/06/92/518620692.db2.gz CKLLBHJYVLUOEE-KWCYVHTRSA-N 1 1 367.833 2.711 20 5 FFBDMO O=c1[nH]c(N2CC[NH+](Cc3cccs3)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC000587010137 518674523 /nfs/dbraw/zinc/67/45/23/518674523.db2.gz DBOLJBWQIDTKPD-UHFFFAOYSA-N 1 1 371.422 2.627 20 5 FFBDMO CNC(=O)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000565056742 518765797 /nfs/dbraw/zinc/76/57/97/518765797.db2.gz KKMMLGRVDPUUHX-UHFFFAOYSA-N 1 1 359.348 2.962 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000570847134 518809804 /nfs/dbraw/zinc/80/98/04/518809804.db2.gz XMROLJVSEYKOMH-AWEZNQCLSA-N 1 1 373.457 2.952 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000570847134 518809807 /nfs/dbraw/zinc/80/98/07/518809807.db2.gz XMROLJVSEYKOMH-AWEZNQCLSA-N 1 1 373.457 2.952 20 5 FFBDMO C[C@H]1C[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000571019501 518887254 /nfs/dbraw/zinc/88/72/54/518887254.db2.gz GJLREGDKHUZYLS-GJZGRUSLSA-N 1 1 373.457 2.798 20 5 FFBDMO C[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCCC[C@@H]1C ZINC000565502246 518988362 /nfs/dbraw/zinc/98/83/62/518988362.db2.gz ABTQXLHMEPZTKM-NWDGAFQWSA-N 1 1 355.385 2.795 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH+]c[nH]c3C2)nc1-c1ccc(F)cc1 ZINC000571339201 519045347 /nfs/dbraw/zinc/04/53/47/519045347.db2.gz CDQSYQZIIAKBKC-CYBMUJFWSA-N 1 1 353.357 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3[nH]c[nH+]c3C2)nc1-c1ccc(F)cc1 ZINC000571339201 519045355 /nfs/dbraw/zinc/04/53/55/519045355.db2.gz CDQSYQZIIAKBKC-CYBMUJFWSA-N 1 1 353.357 2.910 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000568468357 519050791 /nfs/dbraw/zinc/05/07/91/519050791.db2.gz VVRVHTGKAAQHAA-LBPRGKRZSA-N 1 1 359.373 2.731 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C[C@H](C)O1 ZINC000574257132 519065244 /nfs/dbraw/zinc/06/52/44/519065244.db2.gz XSKXBESURGMWKC-OKILXGFUSA-N 1 1 373.457 2.797 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cc1OC ZINC000590005816 519126989 /nfs/dbraw/zinc/12/69/89/519126989.db2.gz PUJBIXXLGZMAOZ-ARLBYUKCSA-N 1 1 364.442 2.698 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cc1OC ZINC000590005816 519126992 /nfs/dbraw/zinc/12/69/92/519126992.db2.gz PUJBIXXLGZMAOZ-ARLBYUKCSA-N 1 1 364.442 2.698 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000590378294 519210097 /nfs/dbraw/zinc/21/00/97/519210097.db2.gz SUZDPAPXZAUIFZ-GOSISDBHSA-N 1 1 350.415 2.597 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601950 519283369 /nfs/dbraw/zinc/28/33/69/519283369.db2.gz UEMUGRPZNDPGHU-HNAYVOBHSA-N 1 1 366.421 2.975 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](c3ccccn3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000590601950 519283370 /nfs/dbraw/zinc/28/33/70/519283370.db2.gz UEMUGRPZNDPGHU-HNAYVOBHSA-N 1 1 366.421 2.975 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590599084 519283442 /nfs/dbraw/zinc/28/34/42/519283442.db2.gz AAJCNIQSDXBRAU-CVEARBPZSA-N 1 1 357.410 2.609 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590806561 519380051 /nfs/dbraw/zinc/38/00/51/519380051.db2.gz RMMICKYRKJIOBK-ROUUACIJSA-N 1 1 372.469 2.968 20 5 FFBDMO C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC12CCCCC2 ZINC000574887695 519385373 /nfs/dbraw/zinc/38/53/73/519385373.db2.gz AFCDHGCXVMVANV-UHFFFAOYSA-N 1 1 361.442 2.912 20 5 FFBDMO Cc1nn(C)cc1[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591016063 519477921 /nfs/dbraw/zinc/47/79/21/519477921.db2.gz OLRHIDSJYDBRHZ-KRWDZBQOSA-N 1 1 357.414 2.802 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)c1 ZINC000566429314 519488565 /nfs/dbraw/zinc/48/85/65/519488565.db2.gz SNYLECDLDHUMCB-CVEARBPZSA-N 1 1 357.410 2.527 20 5 FFBDMO CC(C)C[C@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[NH+]1CCOCC1 ZINC000575190257 519547232 /nfs/dbraw/zinc/54/72/32/519547232.db2.gz MRPCWYQEHUMGIA-GFCCVEGCSA-N 1 1 365.459 2.758 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000569444339 519552640 /nfs/dbraw/zinc/55/26/40/519552640.db2.gz IOKJFQDGQWCWCT-CQSZACIVSA-N 1 1 373.457 2.650 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000566632838 519588514 /nfs/dbraw/zinc/58/85/14/519588514.db2.gz RBUCQLIVSOAPPJ-LPHOPBHVSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000566632838 519588518 /nfs/dbraw/zinc/58/85/18/519588518.db2.gz RBUCQLIVSOAPPJ-LPHOPBHVSA-N 1 1 360.385 2.905 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599950381 519968553 /nfs/dbraw/zinc/96/85/53/519968553.db2.gz ZYLFXXCWNIAORB-JTQLQIEISA-N 1 1 358.236 2.816 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2c3ccccc3C[C@@H]2O)c1 ZINC000594516079 520011745 /nfs/dbraw/zinc/01/17/45/520011745.db2.gz AWZZBWCWPNYFKY-HOCLYGCPSA-N 1 1 350.321 2.944 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594604058 520050465 /nfs/dbraw/zinc/05/04/65/520050465.db2.gz XRPKZDRUBPUBKI-MJGOQNOKSA-N 1 1 374.485 2.856 20 5 FFBDMO CC1(C)[C@@H](NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1[NH+]1CCOCC1 ZINC000603112312 520085424 /nfs/dbraw/zinc/08/54/24/520085424.db2.gz VVKPVXXKUTXMHT-IRXDYDNUSA-N 1 1 373.409 2.570 20 5 FFBDMO CN1C[C@@H]([N@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1=O ZINC000600177723 520102588 /nfs/dbraw/zinc/10/25/88/520102588.db2.gz CIWCFJZKIIRWPJ-HNNXBMFYSA-N 1 1 360.439 2.771 20 5 FFBDMO CN1C[C@@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1=O ZINC000600177723 520102594 /nfs/dbraw/zinc/10/25/94/520102594.db2.gz CIWCFJZKIIRWPJ-HNNXBMFYSA-N 1 1 360.439 2.771 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000600230353 520141128 /nfs/dbraw/zinc/14/11/28/520141128.db2.gz RQDZRKFJTWBGDY-CYBMUJFWSA-N 1 1 365.405 2.879 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1Cc1ccccc1 ZINC000600252564 520159868 /nfs/dbraw/zinc/15/98/68/520159868.db2.gz JXSDGOWMIRRWRH-KRWDZBQOSA-N 1 1 356.426 2.906 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)cc1SC ZINC000609129270 520199283 /nfs/dbraw/zinc/19/92/83/520199283.db2.gz NIPQXMMHESOHIA-LBPRGKRZSA-N 1 1 367.471 2.785 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000609157511 520213961 /nfs/dbraw/zinc/21/39/61/520213961.db2.gz ZZEHTUJUMJMONH-MRXNPFEDSA-N 1 1 357.414 2.765 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](C(=O)NCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000592155559 520231817 /nfs/dbraw/zinc/23/18/17/520231817.db2.gz OYDKMAMPWPGLAC-KRWDZBQOSA-N 1 1 369.421 2.742 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](CCO)c1ccccc1F ZINC000592162385 520237332 /nfs/dbraw/zinc/23/73/32/520237332.db2.gz ZMZNGNYJMUKSDG-QGZVFWFLSA-N 1 1 361.373 2.694 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CCN([C@@H]3CCOC3)CC2)c1 ZINC000594994389 520248238 /nfs/dbraw/zinc/24/82/38/520248238.db2.gz UMPXEEXPMVLGKM-OAHLLOKOSA-N 1 1 371.384 2.539 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CC=CC3)[C@H]2c2ccccc2)c1 ZINC000592188896 520255066 /nfs/dbraw/zinc/25/50/66/520255066.db2.gz UWPQXAWUOYXXKM-QZTJIDSGSA-N 1 1 354.410 2.546 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1C1CCC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000592197202 520257634 /nfs/dbraw/zinc/25/76/34/520257634.db2.gz CXISOZBJHVZZKZ-AWEZNQCLSA-N 1 1 361.398 2.917 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000600470131 520279037 /nfs/dbraw/zinc/27/90/37/520279037.db2.gz GDFKXORVNTUXQM-QGZVFWFLSA-N 1 1 369.425 2.527 20 5 FFBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(S(N)(=O)=O)cc2F)cc1[N+](=O)[O-] ZINC000592365484 520352576 /nfs/dbraw/zinc/35/25/76/520352576.db2.gz SWOIDNIBPNGSHO-NSHDSACASA-N 1 1 367.402 2.541 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1[N+](=O)[O-] ZINC000595297078 520392524 /nfs/dbraw/zinc/39/25/24/520392524.db2.gz JOCKQNLULLOPAG-CYBMUJFWSA-N 1 1 360.418 2.589 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1[N+](=O)[O-] ZINC000595297078 520392530 /nfs/dbraw/zinc/39/25/30/520392530.db2.gz JOCKQNLULLOPAG-CYBMUJFWSA-N 1 1 360.418 2.589 20 5 FFBDMO CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CC[N@@H+](CC)C1 ZINC000598044152 520392696 /nfs/dbraw/zinc/39/26/96/520392696.db2.gz YPGRTEUXIGIMMU-KRWDZBQOSA-N 1 1 374.485 2.754 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492968 520416454 /nfs/dbraw/zinc/41/64/54/520416454.db2.gz JVAUFIOWCXKHLM-HOTGVXAUSA-N 1 1 360.458 2.553 20 5 FFBDMO C[C@@H]1C[NH+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)C[C@@H](C)O1 ZINC000609975674 520494960 /nfs/dbraw/zinc/49/49/60/520494960.db2.gz NVHWFTBMNHAOHL-ZIAGYGMSSA-N 1 1 372.425 2.795 20 5 FFBDMO CCOc1cc(NC(=O)N[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OCC ZINC000604230119 520495177 /nfs/dbraw/zinc/49/51/77/520495177.db2.gz SVJBGNIQYHEGND-GFCCVEGCSA-N 1 1 366.418 2.608 20 5 FFBDMO COc1cccc([C@@H]2[C@H]([NH2+]Cc3onc(C)c3[N+](=O)[O-])CCN2C2CC2)c1 ZINC000595475923 520495318 /nfs/dbraw/zinc/49/53/18/520495318.db2.gz KHWVSAUAHBYGFZ-VQIMIIECSA-N 1 1 372.425 2.967 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609984189 520495782 /nfs/dbraw/zinc/49/57/82/520495782.db2.gz QSZCKIZXORNEOA-SWLSCSKDSA-N 1 1 369.849 2.814 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])cc1F ZINC000598218078 520499068 /nfs/dbraw/zinc/49/90/68/520499068.db2.gz FDIGBFSKJPNXAJ-GFCCVEGCSA-N 1 1 365.405 2.879 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2ccccn2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595500483 520509308 /nfs/dbraw/zinc/50/93/08/520509308.db2.gz JRBKZNZBPUPFFO-MRXNPFEDSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2ccccn2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595500483 520509313 /nfs/dbraw/zinc/50/93/13/520509313.db2.gz JRBKZNZBPUPFFO-MRXNPFEDSA-N 1 1 366.421 2.759 20 5 FFBDMO Cc1ccc(NCCCNc2nc(N3CCCC3)cc[nH+]2)c([N+](=O)[O-])c1 ZINC000610077004 520528730 /nfs/dbraw/zinc/52/87/30/520528730.db2.gz MATQOUCKWYCFNA-UHFFFAOYSA-N 1 1 356.430 2.629 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000604427090 520559906 /nfs/dbraw/zinc/55/99/06/520559906.db2.gz KLGQXODUEZMVFY-CYBMUJFWSA-N 1 1 368.821 2.577 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000604472371 520570886 /nfs/dbraw/zinc/57/08/86/520570886.db2.gz UZQNWGNAUNJTOD-MRXNPFEDSA-N 1 1 356.426 2.575 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000595599810 520582298 /nfs/dbraw/zinc/58/22/98/520582298.db2.gz ZFTYVNPCFRWRCA-KRWDZBQOSA-N 1 1 371.437 2.767 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601002759 520588598 /nfs/dbraw/zinc/58/85/98/520588598.db2.gz UXRQVFQTKVWJLN-CQSZACIVSA-N 1 1 356.426 2.974 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000610297749 520627984 /nfs/dbraw/zinc/62/79/84/520627984.db2.gz PUPUABSRTINNGV-HNNXBMFYSA-N 1 1 372.400 2.663 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](c2ccccc2)C1 ZINC000592881914 520631484 /nfs/dbraw/zinc/63/14/84/520631484.db2.gz PAEVFSOTCOUCKU-PBHICJAKSA-N 1 1 357.385 2.809 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1cccc(OC)c1 ZINC000595683074 520646560 /nfs/dbraw/zinc/64/65/60/520646560.db2.gz FXWYHGVQMMEFKA-SFHVURJKSA-N 1 1 373.409 2.828 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccnc2ccc([N+](=O)[O-])cc21 ZINC000601154310 520663962 /nfs/dbraw/zinc/66/39/62/520663962.db2.gz GKTYRAYOMXVWAU-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000610445705 520690958 /nfs/dbraw/zinc/69/09/58/520690958.db2.gz FGJYQWSHZOWKJA-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c1 ZINC000593034662 520696547 /nfs/dbraw/zinc/69/65/47/520696547.db2.gz QTPIPGGLFRSXQI-WMZOPIPTSA-N 1 1 356.378 2.689 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c1 ZINC000593034662 520696555 /nfs/dbraw/zinc/69/65/55/520696555.db2.gz QTPIPGGLFRSXQI-WMZOPIPTSA-N 1 1 356.378 2.689 20 5 FFBDMO COc1cc(C[NH+]2C[C@H](C)C(O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749850 520698230 /nfs/dbraw/zinc/69/82/30/520698230.db2.gz MACWTIKKFAIEKO-UWVGGRQHSA-N 1 1 360.357 2.654 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557151 520702532 /nfs/dbraw/zinc/70/25/32/520702532.db2.gz BQRBWEPJVAPLNJ-HNNXBMFYSA-N 1 1 361.442 2.845 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557117 520703082 /nfs/dbraw/zinc/70/30/82/520703082.db2.gz AFMVKZUCBYHFPN-CYBMUJFWSA-N 1 1 367.396 2.654 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](n1cncn1)C(F)(F)F ZINC000601294700 520726953 /nfs/dbraw/zinc/72/69/53/520726953.db2.gz PUFREKSMDKGYDJ-RNCFNFMXSA-N 1 1 359.308 2.649 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000598605294 520737099 /nfs/dbraw/zinc/73/70/99/520737099.db2.gz BDQYJAZNMZSWNV-DZGCQCFKSA-N 1 1 369.487 2.705 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000595881544 520789426 /nfs/dbraw/zinc/78/94/26/520789426.db2.gz UAKQICNTEXQEFZ-IAGOWNOFSA-N 1 1 356.422 2.996 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CC2=CCSC2)c([N+](=O)[O-])c1 ZINC000595889820 520796867 /nfs/dbraw/zinc/79/68/67/520796867.db2.gz XCLLMXHISWSIQV-LLVKDONJSA-N 1 1 351.428 2.535 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC2=CCSC2)c([N+](=O)[O-])c1 ZINC000595889820 520796873 /nfs/dbraw/zinc/79/68/73/520796873.db2.gz XCLLMXHISWSIQV-LLVKDONJSA-N 1 1 351.428 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595907678 520812846 /nfs/dbraw/zinc/81/28/46/520812846.db2.gz CUNIGEZLBXIQDI-ZMYBRWDISA-N 1 1 359.426 2.814 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC000595916023 520821885 /nfs/dbraw/zinc/82/18/85/520821885.db2.gz KTXZGVAFIVZSCA-SJCJKPOMSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC000595916023 520821889 /nfs/dbraw/zinc/82/18/89/520821889.db2.gz KTXZGVAFIVZSCA-SJCJKPOMSA-N 1 1 371.384 2.976 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596137769 520934176 /nfs/dbraw/zinc/93/41/76/520934176.db2.gz WIOKWAQVWVFWCU-WDEREUQCSA-N 1 1 355.822 2.954 20 5 FFBDMO CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596191953 520962821 /nfs/dbraw/zinc/96/28/21/520962821.db2.gz IRPYGGLLVOOJOJ-MRXNPFEDSA-N 1 1 368.437 2.795 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000599004901 520974462 /nfs/dbraw/zinc/97/44/62/520974462.db2.gz VFTIQSGBJPZRPC-KRWDZBQOSA-N 1 1 362.474 2.949 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C3CC3)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000596256094 520996607 /nfs/dbraw/zinc/99/66/07/520996607.db2.gz YUQLFHZKJFXRQJ-LLVKDONJSA-N 1 1 367.833 2.955 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cn1 ZINC000611140054 521006233 /nfs/dbraw/zinc/00/62/33/521006233.db2.gz QBOCRNXQVSWUSV-UHFFFAOYSA-N 1 1 358.398 2.767 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000596309474 521020962 /nfs/dbraw/zinc/02/09/62/521020962.db2.gz SCQPTKQUJMMZDU-ZDUSSCGKSA-N 1 1 366.437 2.855 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)c(F)c1 ZINC000593496991 521033861 /nfs/dbraw/zinc/03/38/61/521033861.db2.gz ZFLWGULRBAOVRR-MSOLQXFVSA-N 1 1 372.400 2.609 20 5 FFBDMO CC[N@@H+](C[C@@H]1CCOC1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000611205368 521037343 /nfs/dbraw/zinc/03/73/43/521037343.db2.gz YHHNUCXOBQGPBK-NEPJUHHUSA-N 1 1 355.822 2.934 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599125520 521042999 /nfs/dbraw/zinc/04/29/99/521042999.db2.gz HIFQPJTWKUNSTI-JTQLQIEISA-N 1 1 368.231 2.571 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000593559783 521076534 /nfs/dbraw/zinc/07/65/34/521076534.db2.gz NMFMADGXWJCLPV-QFBILLFUSA-N 1 1 357.385 2.838 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1ccnc1 ZINC000611286000 521081242 /nfs/dbraw/zinc/08/12/42/521081242.db2.gz QJANZDUEWRHXPM-BBRMVZONSA-N 1 1 358.398 2.646 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1n1ccnc1 ZINC000611286000 521081251 /nfs/dbraw/zinc/08/12/51/521081251.db2.gz QJANZDUEWRHXPM-BBRMVZONSA-N 1 1 358.398 2.646 20 5 FFBDMO C[C@H](C[NH+]1CCC(C)CC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000596488142 521096365 /nfs/dbraw/zinc/09/63/65/521096365.db2.gz MOHCBLBVMMITCN-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N[C@@H]3C[C@@H]([NH+]4CCOCC4)C34CCC4)nc2c1 ZINC000596513671 521106702 /nfs/dbraw/zinc/10/67/02/521106702.db2.gz BWOPZKJMTJVQPS-HZPDHXFCSA-N 1 1 357.414 2.526 20 5 FFBDMO Cc1ccc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)c(N2CCCC2)[nH+]1 ZINC000611572044 521225517 /nfs/dbraw/zinc/22/55/17/521225517.db2.gz BXQZAHJZFBGBPT-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(Cl)c1 ZINC000611773138 521323487 /nfs/dbraw/zinc/32/34/87/521323487.db2.gz AYPPADNGKAYICO-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO CCC1(N2CCOCC2)CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000599665440 521377182 /nfs/dbraw/zinc/37/71/82/521377182.db2.gz VMDYFRIDEIQFRP-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602543807 521404127 /nfs/dbraw/zinc/40/41/27/521404127.db2.gz AFHIEBQWINXCRK-SECBINFHSA-N 1 1 354.350 2.526 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000599718968 521426082 /nfs/dbraw/zinc/42/60/82/521426082.db2.gz XHMFAFNWSXVUPG-MOPGFXCFSA-N 1 1 353.422 2.599 20 5 FFBDMO O=C(N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1cc([N+](=O)[O-])c[nH]1 ZINC000612037586 521449749 /nfs/dbraw/zinc/44/97/49/521449749.db2.gz HMOZFFKUWDQFSD-RYQLBKOJSA-N 1 1 368.437 2.953 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594198136 521464296 /nfs/dbraw/zinc/46/42/96/521464296.db2.gz SJRNZFFUGYKQCH-CVEARBPZSA-N 1 1 351.834 2.924 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000594200281 521466045 /nfs/dbraw/zinc/46/60/45/521466045.db2.gz KMSQHOWGEBEMOB-CVEARBPZSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C1CCN([C@H]2CCOC2)CC1 ZINC000602717880 521493483 /nfs/dbraw/zinc/49/34/83/521493483.db2.gz JPIOXBWLOMFLQG-HNNXBMFYSA-N 1 1 373.375 2.957 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](OCc3ccccn3)C2)c([N+](=O)[O-])cc1OC ZINC000602716657 521494086 /nfs/dbraw/zinc/49/40/86/521494086.db2.gz VRJRQFAAUUNMHO-INIZCTEOSA-N 1 1 373.409 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](OCc3ccccn3)C2)c([N+](=O)[O-])cc1OC ZINC000602716657 521494093 /nfs/dbraw/zinc/49/40/93/521494093.db2.gz VRJRQFAAUUNMHO-INIZCTEOSA-N 1 1 373.409 2.798 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597092442 521497728 /nfs/dbraw/zinc/49/77/28/521497728.db2.gz LJHAYUZQZLBGQC-UHFFFAOYSA-N 1 1 352.782 2.547 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597100187 521506285 /nfs/dbraw/zinc/50/62/85/521506285.db2.gz GEDZMCVBUXWODE-UHFFFAOYSA-N 1 1 366.809 2.889 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(CCc2cnccn2)CC1 ZINC000602743676 521510130 /nfs/dbraw/zinc/51/01/30/521510130.db2.gz YBIXOIISBCYDHY-GHRIWEEISA-N 1 1 367.453 2.648 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[NH+](CCc2cnccn2)CC1 ZINC000602743676 521510138 /nfs/dbraw/zinc/51/01/38/521510138.db2.gz YBIXOIISBCYDHY-GHRIWEEISA-N 1 1 367.453 2.648 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])cc1OC ZINC000602760341 521517385 /nfs/dbraw/zinc/51/73/85/521517385.db2.gz QLTIWHVPEJMOSA-HNNXBMFYSA-N 1 1 360.414 2.954 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])ccc1SC ZINC000602766351 521521717 /nfs/dbraw/zinc/52/17/17/521521717.db2.gz QVUVTHAXIFZRAB-UHFFFAOYSA-N 1 1 350.444 2.962 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H]1CCN(Cc2ccccc2)C[C@H]1C ZINC000602809363 521545765 /nfs/dbraw/zinc/54/57/65/521545765.db2.gz BXADCXHULZBGMD-CRAIPNDOSA-N 1 1 357.458 2.600 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3cn(C)nc3[N+](=O)[O-])C2)s1 ZINC000602825564 521555002 /nfs/dbraw/zinc/55/50/02/521555002.db2.gz HAOARZIRQATBRO-CQSZACIVSA-N 1 1 363.487 2.652 20 5 FFBDMO CCC[N@H+]1CC[C@H](NCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000597222722 521583228 /nfs/dbraw/zinc/58/32/28/521583228.db2.gz GFRAWSYMEMXMGA-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO CCCN1CC[C@H]([NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000597222722 521583230 /nfs/dbraw/zinc/58/32/30/521583230.db2.gz GFRAWSYMEMXMGA-ZDUSSCGKSA-N 1 1 373.400 2.821 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000619537114 521756992 /nfs/dbraw/zinc/75/69/92/521756992.db2.gz VKGVQBQTUPSNBJ-KXBFYZLASA-N 1 1 373.453 2.757 20 5 FFBDMO C[C@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000824648956 609314295 /nfs/dbraw/zinc/31/42/95/609314295.db2.gz JZBURIHZBFYHHJ-JSGCOSHPSA-N 1 1 371.445 2.840 20 5 FFBDMO COCC[N@@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000543437027 673647481 /nfs/dbraw/zinc/64/74/81/673647481.db2.gz DLXDPQQPDUPMOG-NSHDSACASA-N 1 1 373.251 2.583 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000543437027 673647483 /nfs/dbraw/zinc/64/74/83/673647483.db2.gz DLXDPQQPDUPMOG-NSHDSACASA-N 1 1 373.251 2.583 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)n1 ZINC001164626788 719073884 /nfs/dbraw/zinc/07/38/84/719073884.db2.gz PIORDQWIKYETBD-FUHWJXTLSA-N 1 1 353.426 2.794 20 5 FFBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1nc(C)cc(C)c1[N+](=O)[O-])C2 ZINC001164807452 720125848 /nfs/dbraw/zinc/12/58/48/720125848.db2.gz CLLNUJRNILCXSS-FXAWDEMLSA-N 1 1 374.485 2.791 20 5 FFBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@@]12CCN(c1ncc([N+](=O)[O-])c(C)c1C)C2 ZINC001164811783 720126122 /nfs/dbraw/zinc/12/61/22/720126122.db2.gz NJYZLIAPHYSQRG-FXAWDEMLSA-N 1 1 374.485 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164724902 720332494 /nfs/dbraw/zinc/33/24/94/720332494.db2.gz LOYQWGLQOKCXDV-CABCVRRESA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc2[nH]ccc21 ZINC001164732948 720412624 /nfs/dbraw/zinc/41/26/24/720412624.db2.gz OWDBUASTGOEGRH-HZPDHXFCSA-N 1 1 364.409 2.719 20 5 FFBDMO CCS[C@H]1CC[C@H]([N@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398294 735295772 /nfs/dbraw/zinc/29/57/72/735295772.db2.gz GJKNFXYTMSVZQY-AAEUAGOBSA-N 1 1 363.439 2.754 20 5 FFBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398294 735295773 /nfs/dbraw/zinc/29/57/73/735295773.db2.gz GJKNFXYTMSVZQY-AAEUAGOBSA-N 1 1 363.439 2.754 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)C(N)=O ZINC000102420362 728490946 /nfs/dbraw/zinc/49/09/46/728490946.db2.gz IGTIQHJSZQQKHF-MRVPVSSYSA-N 1 1 368.187 2.581 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000106869001 728513038 /nfs/dbraw/zinc/51/30/38/728513038.db2.gz NGSDSQLADDYYBO-ZDUSSCGKSA-N 1 1 351.403 2.573 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000106869001 728513041 /nfs/dbraw/zinc/51/30/41/728513041.db2.gz NGSDSQLADDYYBO-ZDUSSCGKSA-N 1 1 351.403 2.573 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@@H+]1CCOC ZINC000139682203 728741227 /nfs/dbraw/zinc/74/12/27/728741227.db2.gz ZJLBTMZGQFWBEA-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CCOC ZINC000139682203 728741228 /nfs/dbraw/zinc/74/12/28/728741228.db2.gz ZJLBTMZGQFWBEA-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000862792604 730726698 /nfs/dbraw/zinc/72/66/98/730726698.db2.gz AVLPGRVYVCIFOI-NSHDSACASA-N 1 1 357.813 2.778 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000874839387 732106293 /nfs/dbraw/zinc/10/62/93/732106293.db2.gz VUGGBBUYMZQSCG-ZIAGYGMSSA-N 1 1 368.231 2.666 20 5 FFBDMO CC(C)C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C[C@H](O)c1ccc(F)cc1 ZINC000876744943 732275607 /nfs/dbraw/zinc/27/56/07/732275607.db2.gz HVFYMWREBIMJRP-INIZCTEOSA-N 1 1 350.394 2.659 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CC1(CO)CCCC1 ZINC000878208194 732499112 /nfs/dbraw/zinc/49/91/12/732499112.db2.gz SCHWNBXHFSVFSB-HNNXBMFYSA-N 1 1 356.850 2.984 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CC1(CO)CCCC1 ZINC000878208194 732499115 /nfs/dbraw/zinc/49/91/15/732499115.db2.gz SCHWNBXHFSVFSB-HNNXBMFYSA-N 1 1 356.850 2.984 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000879557769 732721886 /nfs/dbraw/zinc/72/18/86/732721886.db2.gz FLOHMRJPGPSRCO-XQQFMLRXSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000879557769 732721888 /nfs/dbraw/zinc/72/18/88/732721888.db2.gz FLOHMRJPGPSRCO-XQQFMLRXSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879560974 732723274 /nfs/dbraw/zinc/72/32/74/732723274.db2.gz JSVSCEVMOKQDBT-OLZOCXBDSA-N 1 1 365.455 2.617 20 5 FFBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C(C)(C)CO1 ZINC000782497330 738727508 /nfs/dbraw/zinc/72/75/08/738727508.db2.gz CXFTVTFQFRDACQ-UHFFFAOYSA-N 1 1 353.394 2.952 20 5 FFBDMO CCOc1cc(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000888834675 734103788 /nfs/dbraw/zinc/10/37/88/734103788.db2.gz NIEWIYQRLGJVBB-OCCSQVGLSA-N 1 1 350.419 2.940 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CCC[C@H](C2OCCO2)C1 ZINC000719025851 734377272 /nfs/dbraw/zinc/37/72/72/734377272.db2.gz VVPLLMLBKSISKZ-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000719025851 734377273 /nfs/dbraw/zinc/37/72/73/734377273.db2.gz VVPLLMLBKSISKZ-LBPRGKRZSA-N 1 1 371.231 2.942 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)cc1Cl ZINC000928081282 738817368 /nfs/dbraw/zinc/81/73/68/738817368.db2.gz RMDPXSJXZXNBBR-HIFRSBDPSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cc1Cl ZINC000928081282 738817372 /nfs/dbraw/zinc/81/73/72/738817372.db2.gz RMDPXSJXZXNBBR-HIFRSBDPSA-N 1 1 369.874 2.866 20 5 FFBDMO C[C@H](C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928092559 738820383 /nfs/dbraw/zinc/82/03/83/738820383.db2.gz SZWPUUGGPHAJCN-KNXALSJPSA-N 1 1 367.446 2.533 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c1 ZINC000735562389 734950724 /nfs/dbraw/zinc/95/07/24/734950724.db2.gz KAXXXJXZPNQELV-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO C[N@@H+]1CC[C@@H]1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000928574886 738884118 /nfs/dbraw/zinc/88/41/18/738884118.db2.gz ZCTOBEHZBTYMQO-SNVBAGLBSA-N 1 1 363.361 2.526 20 5 FFBDMO C[N@H+]1CC[C@@H]1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000928574886 738884121 /nfs/dbraw/zinc/88/41/21/738884121.db2.gz ZCTOBEHZBTYMQO-SNVBAGLBSA-N 1 1 363.361 2.526 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCOCC2)cc1OC(F)F ZINC000896520511 735171929 /nfs/dbraw/zinc/17/19/29/735171929.db2.gz DADGEHSMCNFLGV-CYBMUJFWSA-N 1 1 357.357 2.861 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cccc1C(F)(F)F ZINC000897216012 735207103 /nfs/dbraw/zinc/20/71/03/735207103.db2.gz GRBYLLJFFFBNES-CHWSQXEVSA-N 1 1 359.348 2.649 20 5 FFBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1 ZINC000748820114 735674763 /nfs/dbraw/zinc/67/47/63/735674763.db2.gz DCEUUFGTOXOBSG-SNVBAGLBSA-N 1 1 355.441 2.879 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252893 735778971 /nfs/dbraw/zinc/77/89/71/735778971.db2.gz PKUKKXYVGVXWNF-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252893 735778975 /nfs/dbraw/zinc/77/89/75/735778975.db2.gz PKUKKXYVGVXWNF-NEPJUHHUSA-N 1 1 353.806 2.545 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000751916525 735934361 /nfs/dbraw/zinc/93/43/61/735934361.db2.gz BHDWIZRWTDJDHL-HNNXBMFYSA-N 1 1 350.488 2.778 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000755012020 736226628 /nfs/dbraw/zinc/22/66/28/736226628.db2.gz CNLUUOPLFUWDBX-WPRPVWTQSA-N 1 1 374.210 2.709 20 5 FFBDMO CC[N@@H+](CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)CCC(F)(F)F ZINC000757619443 736414103 /nfs/dbraw/zinc/41/41/03/736414103.db2.gz WMWLIDZHZFTCJQ-YVMONPNESA-N 1 1 359.348 2.999 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000906362172 736490744 /nfs/dbraw/zinc/49/07/44/736490744.db2.gz QCDJGCBPDANYJY-LBPRGKRZSA-N 1 1 351.834 2.781 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000906781218 736543118 /nfs/dbraw/zinc/54/31/18/736543118.db2.gz RKTUBTGYCGCLJC-CMPLNLGQSA-N 1 1 354.838 2.775 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000765203342 737095742 /nfs/dbraw/zinc/09/57/42/737095742.db2.gz CAYBWGUBQJUMGP-OAHLLOKOSA-N 1 1 353.369 2.820 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](C3CC3)C2)cc1Cl ZINC000765470277 737121542 /nfs/dbraw/zinc/12/15/42/737121542.db2.gz YBDDUFJYLRGVBD-JTQLQIEISA-N 1 1 353.806 2.931 20 5 FFBDMO CC(C)OC(=O)C[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766910787 737274501 /nfs/dbraw/zinc/27/45/01/737274501.db2.gz RQFTZLKLWFMXRN-RHSMWYFYSA-N 1 1 350.415 2.682 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2[C@H](C)CCC[C@@H]2CC[NH+](C)C)c1[N+](=O)[O-] ZINC000912650112 737327680 /nfs/dbraw/zinc/32/76/80/737327680.db2.gz IENIDKPWAODAPC-CHWSQXEVSA-N 1 1 351.451 2.776 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000768479264 737425450 /nfs/dbraw/zinc/42/54/50/737425450.db2.gz KGTYJMKTATXBNF-QGZVFWFLSA-N 1 1 362.499 2.918 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000913813843 737452336 /nfs/dbraw/zinc/45/23/36/737452336.db2.gz HUFFSBSOGDVGMF-HZPDHXFCSA-N 1 1 351.834 2.876 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000768837171 737464276 /nfs/dbraw/zinc/46/42/76/737464276.db2.gz YUJMGWAUTYWPGN-GFCCVEGCSA-N 1 1 361.489 2.589 20 5 FFBDMO COCCOC1CC[NH+](Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000769403862 737524878 /nfs/dbraw/zinc/52/48/78/737524878.db2.gz XOONGXUFYDBIOK-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000914240140 737536712 /nfs/dbraw/zinc/53/67/12/737536712.db2.gz ZMEQQCZUFHMMIA-APHBMKBZSA-N 1 1 364.471 2.535 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999707 737588780 /nfs/dbraw/zinc/58/87/80/737588780.db2.gz FRNRHPJTZLIGFO-AEFFLSMTSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769999707 737588782 /nfs/dbraw/zinc/58/87/82/737588782.db2.gz FRNRHPJTZLIGFO-AEFFLSMTSA-N 1 1 350.415 2.826 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1 ZINC000771756896 737752458 /nfs/dbraw/zinc/75/24/58/737752458.db2.gz SSPSDQGZUZGQHQ-CYBMUJFWSA-N 1 1 373.450 2.585 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639368 738008389 /nfs/dbraw/zinc/00/83/89/738008389.db2.gz VTBSTNQAUKYLHA-LBPRGKRZSA-N 1 1 368.821 2.540 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639368 738008392 /nfs/dbraw/zinc/00/83/92/738008392.db2.gz VTBSTNQAUKYLHA-LBPRGKRZSA-N 1 1 368.821 2.540 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]Cc1cnn(CCF)c1 ZINC000922333595 738123415 /nfs/dbraw/zinc/12/34/15/738123415.db2.gz SJNKZANDSOBERN-UHFFFAOYSA-N 1 1 357.183 2.813 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000776592035 738212273 /nfs/dbraw/zinc/21/22/73/738212273.db2.gz XAHUXRVGRRHKJY-ZDUSSCGKSA-N 1 1 358.320 2.513 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)n1 ZINC000776592035 738212275 /nfs/dbraw/zinc/21/22/75/738212275.db2.gz XAHUXRVGRRHKJY-ZDUSSCGKSA-N 1 1 358.320 2.513 20 5 FFBDMO O=C(N1CC[NH+](C2CCCC2)CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778237318 738365559 /nfs/dbraw/zinc/36/55/59/738365559.db2.gz NYRJMWYUDPDMHS-UHFFFAOYSA-N 1 1 353.369 2.773 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929733783 739015722 /nfs/dbraw/zinc/01/57/22/739015722.db2.gz YJFHFRMKOCGJDV-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929733783 739015724 /nfs/dbraw/zinc/01/57/24/739015724.db2.gz YJFHFRMKOCGJDV-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1C ZINC000787420332 739135409 /nfs/dbraw/zinc/13/54/09/739135409.db2.gz HAQTWJJHEZZQRM-NXEZZACHSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])[C@@H]1C ZINC000787420332 739135412 /nfs/dbraw/zinc/13/54/12/739135412.db2.gz HAQTWJJHEZZQRM-NXEZZACHSA-N 1 1 357.204 2.741 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018157 739374057 /nfs/dbraw/zinc/37/40/57/739374057.db2.gz AXWNSWKTTRVRIC-QFYYESIMSA-N 1 1 355.341 2.584 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018157 739374060 /nfs/dbraw/zinc/37/40/60/739374060.db2.gz AXWNSWKTTRVRIC-QFYYESIMSA-N 1 1 355.341 2.584 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)s1 ZINC000932666210 739488365 /nfs/dbraw/zinc/48/83/65/739488365.db2.gz FTVYYXVLZVOFSY-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)s1 ZINC000932666210 739488368 /nfs/dbraw/zinc/48/83/68/739488368.db2.gz FTVYYXVLZVOFSY-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000933437238 739625135 /nfs/dbraw/zinc/62/51/35/739625135.db2.gz BIVJOAIZXUVJAY-XJKSGUPXSA-N 1 1 351.422 2.855 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(Br)c1 ZINC000934492834 739792192 /nfs/dbraw/zinc/79/21/92/739792192.db2.gz HJLHASWLGHLGHL-OAHLLOKOSA-N 1 1 366.215 2.750 20 5 FFBDMO CN(C)[S@@](C)(=O)=NCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000934761483 739834501 /nfs/dbraw/zinc/83/45/01/739834501.db2.gz YGZRGTSXEWANPZ-VWLOTQADSA-N 1 1 372.466 2.520 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000796165937 740110607 /nfs/dbraw/zinc/11/06/07/740110607.db2.gz WKGCTKNPPANCEB-CQSZACIVSA-N 1 1 351.403 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H](N1CCOCC1)C(F)(F)F ZINC000796514373 740149086 /nfs/dbraw/zinc/14/90/86/740149086.db2.gz JXFUDYPVRLCQAF-CYBMUJFWSA-N 1 1 367.755 2.601 20 5 FFBDMO CC[N@@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713303 740553381 /nfs/dbraw/zinc/55/33/81/740553381.db2.gz WQFMTICVWAESQP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO CC[N@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713303 740553384 /nfs/dbraw/zinc/55/33/84/740553384.db2.gz WQFMTICVWAESQP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO CC[N@@H+](CC1CC(C)(C)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713303 740553388 /nfs/dbraw/zinc/55/33/88/740553388.db2.gz WQFMTICVWAESQP-IAGOWNOFSA-N 1 1 351.491 2.648 20 5 FFBDMO CSc1cccc(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)c1[N+](=O)[O-] ZINC000802132798 740675748 /nfs/dbraw/zinc/67/57/48/740675748.db2.gz MVMZQENIJAELML-GFCCVEGCSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1cccc(C(=O)OC[C@H]2C[N@H+](C(C)C)CCO2)c1[N+](=O)[O-] ZINC000802132798 740675753 /nfs/dbraw/zinc/67/57/53/740675753.db2.gz MVMZQENIJAELML-GFCCVEGCSA-N 1 1 354.428 2.583 20 5 FFBDMO CC(C)c1ccc(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802136363 740676528 /nfs/dbraw/zinc/67/65/28/740676528.db2.gz GPXQITUZEBZBED-OAHLLOKOSA-N 1 1 350.415 2.984 20 5 FFBDMO CSc1ccc(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802138526 740677454 /nfs/dbraw/zinc/67/74/54/740677454.db2.gz JIODRDHLORZVFB-ZDUSSCGKSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1ccc(C(=O)OC[C@@H]2C[N@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802138526 740677457 /nfs/dbraw/zinc/67/74/57/740677457.db2.gz JIODRDHLORZVFB-ZDUSSCGKSA-N 1 1 354.428 2.583 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804443001 740874499 /nfs/dbraw/zinc/87/44/99/740874499.db2.gz UDZBHZFUEUAGDU-OAHLLOKOSA-N 1 1 352.866 2.855 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(N)=NOCCOc1ccc([N+](=O)[O-])cc1 ZINC000809374668 741302867 /nfs/dbraw/zinc/30/28/67/741302867.db2.gz NZMXNYWSJBUBFU-OKILXGFUSA-N 1 1 350.419 2.735 20 5 FFBDMO C[N@@H+](Cc1cccc(Cl)c1F)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985430994 741395195 /nfs/dbraw/zinc/39/51/95/741395195.db2.gz LGDGFPUFNNKUBB-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1cccc(Cl)c1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430994 741395201 /nfs/dbraw/zinc/39/52/01/741395201.db2.gz LGDGFPUFNNKUBB-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1cccc(Cl)c1F)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430994 741395203 /nfs/dbraw/zinc/39/52/03/741395203.db2.gz LGDGFPUFNNKUBB-UKRRQHHQSA-N 1 1 369.824 2.567 20 5 FFBDMO CC(C)OCCCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174485 741684979 /nfs/dbraw/zinc/68/49/79/741684979.db2.gz UWDQFPHZBWKSMS-KRWDZBQOSA-N 1 1 350.415 2.918 20 5 FFBDMO CC(C)OCCCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174485 741684982 /nfs/dbraw/zinc/68/49/82/741684982.db2.gz UWDQFPHZBWKSMS-KRWDZBQOSA-N 1 1 350.415 2.918 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@@H](C)C1 ZINC000822568949 742753405 /nfs/dbraw/zinc/75/34/05/742753405.db2.gz KPVZKCRJEUULDX-VIFPVBQESA-N 1 1 358.801 2.526 20 5 FFBDMO CCCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@@H+](C)C1 ZINC000826677504 743421388 /nfs/dbraw/zinc/42/13/88/743421388.db2.gz MSDACGXUEPYNQS-CQSZACIVSA-N 1 1 354.838 2.874 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC000829010152 745154535 /nfs/dbraw/zinc/15/45/35/745154535.db2.gz INBLDYHMRXSUKY-TXEJJXNPSA-N 1 1 356.220 2.632 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N(C)CCC[N@H+](C)CCN(C)C)cc1Cl ZINC000836789465 746306528 /nfs/dbraw/zinc/30/65/28/746306528.db2.gz NBVWRJGXBCAFBJ-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N(C)CCCN(C)CC[NH+](C)C)cc1Cl ZINC000836789465 746306530 /nfs/dbraw/zinc/30/65/30/746306530.db2.gz NBVWRJGXBCAFBJ-UHFFFAOYSA-N 1 1 370.881 2.512 20 5 FFBDMO C[C@@H]1CN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+](C2CC2)C1 ZINC000838514886 746655907 /nfs/dbraw/zinc/65/59/07/746655907.db2.gz WPYLBPIJMXLKRS-LBPRGKRZSA-N 1 1 366.849 2.874 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839416111 746824952 /nfs/dbraw/zinc/82/49/52/746824952.db2.gz ZTBAHFOQBHYSRT-GFCCVEGCSA-N 1 1 370.247 2.914 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839643758 746880725 /nfs/dbraw/zinc/88/07/25/746880725.db2.gz SNLLGAPDVZUPGM-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO CC[C@@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000844383903 748018071 /nfs/dbraw/zinc/01/80/71/748018071.db2.gz AOVGXKMLCBVAOQ-GFCCVEGCSA-N 1 1 353.394 2.952 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000852199019 749800187 /nfs/dbraw/zinc/80/01/87/749800187.db2.gz FFSXUWKUWOFWDI-ZDUSSCGKSA-N 1 1 354.838 2.920 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852424273 749856683 /nfs/dbraw/zinc/85/66/83/749856683.db2.gz ALMMOYBKNPETQS-WBMJQRKESA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1F ZINC000855054888 750419019 /nfs/dbraw/zinc/41/90/19/750419019.db2.gz AOYPOZQOFDDIPU-NEPJUHHUSA-N 1 1 353.369 2.928 20 5 FFBDMO CCOC(=O)N[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055903511 845342060 /nfs/dbraw/zinc/34/20/60/845342060.db2.gz VYDYTBPOFDBYRX-CQSZACIVSA-N 1 1 351.403 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@H](O)CC3(CCOCC3)C2)c1 ZINC000895721877 970890416 /nfs/dbraw/zinc/89/04/16/970890416.db2.gz MYMCNDWRPUSILN-CQSZACIVSA-N 1 1 372.368 2.560 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@H](O)CC3(CCOCC3)C2)c1 ZINC000895721877 970890427 /nfs/dbraw/zinc/89/04/27/970890427.db2.gz MYMCNDWRPUSILN-CQSZACIVSA-N 1 1 372.368 2.560 20 5 FFBDMO C[C@@]1(CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000312505808 971503349 /nfs/dbraw/zinc/50/33/49/971503349.db2.gz RIXGULDFJREROR-FQEVSTJZSA-N 1 1 368.437 2.819 20 5 FFBDMO CCOC(=O)c1coc2c1CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C2 ZINC001167175430 960360635 /nfs/dbraw/zinc/36/06/35/960360635.db2.gz IFTAHBNSLGXGAD-AATRIKPKSA-N 1 1 372.381 2.812 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000046403829 963250834 /nfs/dbraw/zinc/25/08/34/963250834.db2.gz OVBXGFYXNSUATI-UHFFFAOYSA-N 1 1 354.410 2.989 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCN1C1CCOCC1 ZINC000451552138 966339037 /nfs/dbraw/zinc/33/90/37/966339037.db2.gz VSWOYOLTRWQJAF-APWZRJJASA-N 1 1 373.453 2.554 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C2CCCC2)[C@@H](C)C1 ZINC001176155003 1013647251 /nfs/dbraw/zinc/64/72/51/1013647251.db2.gz TVZBNJJDKFURJY-LSDHHAIUSA-N 1 1 360.458 2.871 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccnn1C ZINC001176517365 1013720996 /nfs/dbraw/zinc/72/09/96/1013720996.db2.gz VSXPZVIDYOWYIA-MRXNPFEDSA-N 1 1 373.413 2.503 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2ncccn2)C1 ZINC001176524903 1013722230 /nfs/dbraw/zinc/72/22/30/1013722230.db2.gz VVIWNGRPXZNIKM-GXTWGEPZSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2ncccn2)C1 ZINC001176524903 1013722233 /nfs/dbraw/zinc/72/22/33/1013722233.db2.gz VVIWNGRPXZNIKM-GXTWGEPZSA-N 1 1 366.381 2.985 20 5 FFBDMO C[N@@H+](CCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000177067309 968790225 /nfs/dbraw/zinc/79/02/25/968790225.db2.gz KDPZBZKNKBURSI-IZZDOVSWSA-N 1 1 357.385 2.995 20 5 FFBDMO Cc1ccc(CNC(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000876171043 1014157675 /nfs/dbraw/zinc/15/76/75/1014157675.db2.gz ISYHHRFAWHPXDA-KRWDZBQOSA-N 1 1 360.458 2.777 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000111169983 975625609 /nfs/dbraw/zinc/62/56/09/975625609.db2.gz HMYQJGHGMLZDPI-GOSISDBHSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000111169983 975625615 /nfs/dbraw/zinc/62/56/15/975625615.db2.gz HMYQJGHGMLZDPI-GOSISDBHSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C(C[N@@H+](C1CC1)C1CCCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000728914626 977467615 /nfs/dbraw/zinc/46/76/15/977467615.db2.gz GYXPSALGZVZPED-UHFFFAOYSA-N 1 1 372.469 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H]([C@H](O)c2nccn2C)C1 ZINC000876809106 1014400845 /nfs/dbraw/zinc/40/08/45/1014400845.db2.gz CQMKDISFWGMRKT-YJBOKZPZSA-N 1 1 358.442 2.891 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000905715938 980496759 /nfs/dbraw/zinc/49/67/59/980496759.db2.gz MDZXNVDIJMJFLP-AWEZNQCLSA-N 1 1 354.414 2.824 20 5 FFBDMO NC(=O)Cc1cccc2c1CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000877679358 1014674329 /nfs/dbraw/zinc/67/43/29/1014674329.db2.gz DBXJYGJFZDLHHF-XBXARRHUSA-N 1 1 351.406 2.694 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000129187279 981439633 /nfs/dbraw/zinc/43/96/33/981439633.db2.gz JPDAUHFSESJASA-UHFFFAOYSA-N 1 1 359.430 2.807 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000908512427 981460187 /nfs/dbraw/zinc/46/01/87/981460187.db2.gz MDXGQIYLLBOJJB-INIZCTEOSA-N 1 1 362.474 2.578 20 5 FFBDMO C[C@H]1CC2(CC([NH2+][C@H](c3nccn3C)c3cccc([N+](=O)[O-])c3)C2)CO1 ZINC000897778405 982512999 /nfs/dbraw/zinc/51/29/99/982512999.db2.gz GSJXFPMHBITBAI-BDTLPFKBSA-N 1 1 356.426 2.965 20 5 FFBDMO Cc1nc2ccccn2c1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000898276958 982664746 /nfs/dbraw/zinc/66/47/46/982664746.db2.gz UGNGJLMHVVSYMF-UHFFFAOYSA-N 1 1 354.366 2.612 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1F ZINC000764045373 984254925 /nfs/dbraw/zinc/25/49/25/984254925.db2.gz YMOMHPJIFNJRMN-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1F ZINC000764045373 984254928 /nfs/dbraw/zinc/25/49/28/984254928.db2.gz YMOMHPJIFNJRMN-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO CC(C)Cc1ccc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000996439928 984347123 /nfs/dbraw/zinc/34/71/23/984347123.db2.gz JTNMLVCCKIVVCR-RTBURBONSA-N 1 1 359.470 2.631 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000764316258 984418129 /nfs/dbraw/zinc/41/81/29/984418129.db2.gz WAPQYKBPIKMBQD-CQSZACIVSA-N 1 1 372.425 2.890 20 5 FFBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1C(N)=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000063560009 985949090 /nfs/dbraw/zinc/94/90/90/985949090.db2.gz MIGZCUHGWVUBHW-UHFFFAOYSA-N 1 1 370.409 2.543 20 5 FFBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1C(N)=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000063560009 985949092 /nfs/dbraw/zinc/94/90/92/985949092.db2.gz MIGZCUHGWVUBHW-UHFFFAOYSA-N 1 1 370.409 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000765845235 986709879 /nfs/dbraw/zinc/70/98/79/986709879.db2.gz OJHZDYYZDVNYIJ-OAQYLSRUSA-N 1 1 369.465 2.925 20 5 FFBDMO O=C(NC1CC[NH+](CCc2ccc3ccccc3c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002789252 987470380 /nfs/dbraw/zinc/47/03/80/987470380.db2.gz SXEGPBZZHBIERK-WOJBJXKFSA-N 1 1 367.449 2.628 20 5 FFBDMO O=C(NC1CC[NH+](Cc2cccc3ccccc32)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002791654 987484242 /nfs/dbraw/zinc/48/42/42/987484242.db2.gz JOOUGISWEGAYSP-RTBURBONSA-N 1 1 353.422 2.586 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 ZINC000762706691 988595151 /nfs/dbraw/zinc/59/51/51/988595151.db2.gz LMUOWKBEGGJUAO-UHFFFAOYSA-N 1 1 372.469 2.967 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643927 990148766 /nfs/dbraw/zinc/14/87/66/990148766.db2.gz AEBQQTPTPJGCRB-NCXUSEDFSA-N 1 1 357.454 2.746 20 5 FFBDMO O=C(NCc1ccc(C[NH2+]CC2CC3(CCC3)C2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001034816269 990269990 /nfs/dbraw/zinc/26/99/90/990269990.db2.gz KPHLAOBYAGZMFU-QZTJIDSGSA-N 1 1 357.454 2.638 20 5 FFBDMO CN(CCC[N@@H+](C)CCc1ccc2ccccc2c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001484742133 991742776 /nfs/dbraw/zinc/74/27/76/991742776.db2.gz QELQKHVOALIZND-WOJBJXKFSA-N 1 1 369.465 2.828 20 5 FFBDMO CN(CCC[N@H+](C)CCc1ccc2ccccc2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001484742133 991742785 /nfs/dbraw/zinc/74/27/85/991742785.db2.gz QELQKHVOALIZND-WOJBJXKFSA-N 1 1 369.465 2.828 20 5 FFBDMO CN(CCC[N@@H+](C)CCc1ccc2ccccc2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001484742133 991742790 /nfs/dbraw/zinc/74/27/90/991742790.db2.gz QELQKHVOALIZND-WOJBJXKFSA-N 1 1 369.465 2.828 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH2+]Cc2cnnn2C)cc1[N+](=O)[O-] ZINC000808437103 994117997 /nfs/dbraw/zinc/11/79/97/994117997.db2.gz ZWDGYKJHLRNJHB-UHFFFAOYSA-N 1 1 352.398 2.781 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])O[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000810845905 994950771 /nfs/dbraw/zinc/95/07/71/994950771.db2.gz WBJPRYXIYDMPRV-DZGCQCFKSA-N 1 1 363.370 2.606 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1 ZINC000811485940 995156181 /nfs/dbraw/zinc/15/61/81/995156181.db2.gz GIHXJDFHKCESND-LJQANCHMSA-N 1 1 374.368 2.614 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1 ZINC000811485940 995156184 /nfs/dbraw/zinc/15/61/84/995156184.db2.gz GIHXJDFHKCESND-LJQANCHMSA-N 1 1 374.368 2.614 20 5 FFBDMO CC(C)CC[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001133395977 995497282 /nfs/dbraw/zinc/49/72/82/995497282.db2.gz LCGBQBIANIFNEC-IAGOWNOFSA-N 1 1 367.877 2.970 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001136839291 996846606 /nfs/dbraw/zinc/84/66/06/996846606.db2.gz DHPBPWJPGZARKY-CYBMUJFWSA-N 1 1 356.426 2.744 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@H]3C[C@@H](C)C[N@@H+]3C2)c([N+](=O)[O-])c1 ZINC001136872058 996950950 /nfs/dbraw/zinc/95/09/50/996950950.db2.gz BTOGJOAXKCVTBE-ZACQAIPSSA-N 1 1 374.485 2.942 20 5 FFBDMO CN(C[C@](C)(O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000844269021 997753385 /nfs/dbraw/zinc/75/33/85/997753385.db2.gz QYXBWTLJVCPQIE-GOSISDBHSA-N 1 1 367.446 2.645 20 5 FFBDMO Cc1cc(N2CCC[C@H](OC(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)nc(C)[nH+]1 ZINC000731552654 998022123 /nfs/dbraw/zinc/02/21/23/998022123.db2.gz SBXIEOLMKLNCGH-INIZCTEOSA-N 1 1 374.372 2.967 20 5 FFBDMO Cc1cn(C[N@@H+]2CC[C@@H](c3ccco3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000732180626 998527694 /nfs/dbraw/zinc/52/76/94/998527694.db2.gz BQGLAPODSHOLDT-OAHLLOKOSA-N 1 1 368.393 2.896 20 5 FFBDMO Cc1cn(C[N@H+]2CC[C@@H](c3ccco3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000732180626 998527707 /nfs/dbraw/zinc/52/77/07/998527707.db2.gz BQGLAPODSHOLDT-OAHLLOKOSA-N 1 1 368.393 2.896 20 5 FFBDMO C[C@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000803856273 1016245741 /nfs/dbraw/zinc/24/57/41/1016245741.db2.gz OCICYLSQOLAGDK-ZFWWWQNUSA-N 1 1 363.414 2.730 20 5 FFBDMO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741015325 999702526 /nfs/dbraw/zinc/70/25/26/999702526.db2.gz ADSASBOKVPBLPS-XQQFMLRXSA-N 1 1 364.398 2.766 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741019624 999703177 /nfs/dbraw/zinc/70/31/77/999703177.db2.gz WMVZOZORCFJOHP-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741019624 999703181 /nfs/dbraw/zinc/70/31/81/999703181.db2.gz WMVZOZORCFJOHP-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO O=C1CN(C[N@H+]2CCC3(C2)CCCCC3)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000742165275 999760613 /nfs/dbraw/zinc/76/06/13/999760613.db2.gz GDUCDZIAUDXIQF-UHFFFAOYSA-N 1 1 372.425 2.977 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000742425338 999773556 /nfs/dbraw/zinc/77/35/56/999773556.db2.gz DJLRGLXEAWPJEU-AWEZNQCLSA-N 1 1 360.458 2.655 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000742425340 999773652 /nfs/dbraw/zinc/77/36/52/999773652.db2.gz DJLRGLXEAWPJEU-CQSZACIVSA-N 1 1 360.458 2.655 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)CCc1ccccn1 ZINC000744201166 999847444 /nfs/dbraw/zinc/84/74/44/999847444.db2.gz QMWIJRCKAOJNHG-UHFFFAOYSA-N 1 1 372.425 2.892 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019192 1000017472 /nfs/dbraw/zinc/01/74/72/1000017472.db2.gz FJIHNJWRMDVLAJ-QWXYKEQDSA-N 1 1 361.442 2.528 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCN(Cc3ccncc3)c3ncccc3C2)C1 ZINC001169019628 1000017645 /nfs/dbraw/zinc/01/76/45/1000017645.db2.gz GYPXVDAEUCDBIS-PKOBYXMFSA-N 1 1 367.453 2.744 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804351363 1000109937 /nfs/dbraw/zinc/10/99/37/1000109937.db2.gz XFIJGZHETQETAH-UHFFFAOYSA-N 1 1 369.469 2.927 20 5 FFBDMO Cc1cc(C)c(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)c1 ZINC001000669086 1016418963 /nfs/dbraw/zinc/41/89/63/1016418963.db2.gz GTQHTOJCRGUUBT-IEBWSBKVSA-N 1 1 357.454 2.525 20 5 FFBDMO Cc1cc(C)c(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001000669086 1016418968 /nfs/dbraw/zinc/41/89/68/1016418968.db2.gz GTQHTOJCRGUUBT-IEBWSBKVSA-N 1 1 357.454 2.525 20 5 FFBDMO Cc1cc(C)c(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001000669086 1016418976 /nfs/dbraw/zinc/41/89/76/1016418976.db2.gz GTQHTOJCRGUUBT-IEBWSBKVSA-N 1 1 357.454 2.525 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001000675139 1016422443 /nfs/dbraw/zinc/42/24/43/1016422443.db2.gz RMBNVBYLBZKZSP-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001000675139 1016422455 /nfs/dbraw/zinc/42/24/55/1016422455.db2.gz RMBNVBYLBZKZSP-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001000675139 1016422468 /nfs/dbraw/zinc/42/24/68/1016422468.db2.gz RMBNVBYLBZKZSP-RTBURBONSA-N 1 1 357.454 2.724 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000770388040 1000784351 /nfs/dbraw/zinc/78/43/51/1000784351.db2.gz ULOBHHVIHUHGCP-DSABOLQXSA-N 1 1 356.426 2.930 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(-c4cc[nH]n4)o3)CC2)cc1 ZINC000789719590 1002177129 /nfs/dbraw/zinc/17/71/29/1002177129.db2.gz ACDYJCGCNHBNDV-UHFFFAOYSA-N 1 1 353.382 2.900 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNC3CCN(c4cc[nH+]cc4)CC3)nc2c1 ZINC001184315490 1002556669 /nfs/dbraw/zinc/55/66/69/1002556669.db2.gz WJWWJZZMCCSHLA-UHFFFAOYSA-N 1 1 353.382 2.890 20 5 FFBDMO CCc1ccc(C(=O)OCCC[NH+]2CCN(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000791979208 1002860033 /nfs/dbraw/zinc/86/00/33/1002860033.db2.gz NFGMKZGSBKBYPY-UHFFFAOYSA-N 1 1 363.458 2.730 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](Oc3ncc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC001170355636 1003122899 /nfs/dbraw/zinc/12/28/99/1003122899.db2.gz NGOOEWSNYDSDCH-YOEHRIQHSA-N 1 1 372.425 2.786 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345427 1003132284 /nfs/dbraw/zinc/13/22/84/1003132284.db2.gz KIIIUASYEWWOGH-UMVBOHGHSA-N 1 1 350.415 2.665 20 5 FFBDMO C/C(=C/C(=O)NC1CCN(c2[nH+]ccn2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000793946786 1003541923 /nfs/dbraw/zinc/54/19/23/1003541923.db2.gz MQFCIESDXPCUTO-YPKPFQOOSA-N 1 1 369.425 2.517 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001197253372 1004142644 /nfs/dbraw/zinc/14/26/44/1004142644.db2.gz BRJWGWYTAHDLHV-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001197253372 1004142648 /nfs/dbraw/zinc/14/26/48/1004142648.db2.gz BRJWGWYTAHDLHV-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001130613518 1004304189 /nfs/dbraw/zinc/30/41/89/1004304189.db2.gz DEJTUBGRKUMOKS-LJQANCHMSA-N 1 1 354.410 2.693 20 5 FFBDMO COc1nscc1C[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001198122857 1004504374 /nfs/dbraw/zinc/50/43/74/1004504374.db2.gz ZVEHAQPJWCBKFK-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1nscc1C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001198122857 1004504380 /nfs/dbraw/zinc/50/43/80/1004504380.db2.gz ZVEHAQPJWCBKFK-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1n[nH]cc1C ZINC001195903158 1005071495 /nfs/dbraw/zinc/07/14/95/1005071495.db2.gz YSRRMCKVZYBTRR-UHFFFAOYSA-N 1 1 361.405 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC(O[C@H]4CCOC4)CC3)c2)cc1 ZINC000748263884 1017006463 /nfs/dbraw/zinc/00/64/63/1017006463.db2.gz FGFOAADZEJADCV-IBGZPJMESA-N 1 1 372.425 2.686 20 5 FFBDMO CC1(C)OC[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)O1 ZINC000852205403 1005951043 /nfs/dbraw/zinc/95/10/43/1005951043.db2.gz ZNTRKYLCKQKFLA-ULQDDVLXSA-N 1 1 364.442 2.852 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000776582884 1005954363 /nfs/dbraw/zinc/95/43/63/1005954363.db2.gz CZPABNTVACQBQA-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2)C1=O ZINC000776582884 1005954365 /nfs/dbraw/zinc/95/43/65/1005954365.db2.gz CZPABNTVACQBQA-RBUKOAKNSA-N 1 1 369.421 2.756 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)cc1 ZINC000776584278 1005954779 /nfs/dbraw/zinc/95/47/79/1005954779.db2.gz KAZOSAJAJKXDFE-DOTOQJQBSA-N 1 1 367.409 2.551 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC001187190643 1005957757 /nfs/dbraw/zinc/95/77/57/1005957757.db2.gz SRBWQHVFBHUJEG-GJZGRUSLSA-N 1 1 354.366 2.966 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC001187190643 1005957761 /nfs/dbraw/zinc/95/77/61/1005957761.db2.gz SRBWQHVFBHUJEG-GJZGRUSLSA-N 1 1 354.366 2.966 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591201 1005985414 /nfs/dbraw/zinc/98/54/14/1005985414.db2.gz HLOSTYMWISFEJB-JKSUJKDBSA-N 1 1 365.430 2.569 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776592676 1006009840 /nfs/dbraw/zinc/00/98/40/1006009840.db2.gz SFBRWOHOVBEPHH-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001134437747 1006331253 /nfs/dbraw/zinc/33/12/53/1006331253.db2.gz IVZQHHBTKRCNQT-UHFFFAOYSA-N 1 1 356.382 2.998 20 5 FFBDMO CN(CC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)c1ccccc1 ZINC000853495123 1006413827 /nfs/dbraw/zinc/41/38/27/1006413827.db2.gz RAOCSNAKWPHMMM-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CN(CC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)c1ccccc1 ZINC000853495123 1006413835 /nfs/dbraw/zinc/41/38/35/1006413835.db2.gz RAOCSNAKWPHMMM-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CCC(=O)c1ccc(N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000882540528 1006426412 /nfs/dbraw/zinc/42/64/12/1006426412.db2.gz RRHIEOLOVLUTIF-AWEZNQCLSA-N 1 1 361.442 2.877 20 5 FFBDMO CCC(=O)c1ccc(N2CCC([N@H+]3CCOC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000882540528 1006426417 /nfs/dbraw/zinc/42/64/17/1006426417.db2.gz RRHIEOLOVLUTIF-AWEZNQCLSA-N 1 1 361.442 2.877 20 5 FFBDMO Cc1nn(CN2CC[C@@H]([N@@H+](C)CCc3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000853560549 1006444237 /nfs/dbraw/zinc/44/42/37/1006444237.db2.gz OZIYABPFUFTTME-GOSISDBHSA-N 1 1 357.458 2.614 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H](C)c3ccccc3)CC2)n1 ZINC000882810281 1006513201 /nfs/dbraw/zinc/51/32/01/1006513201.db2.gz CFNRBSBIKTYAQU-CQSZACIVSA-N 1 1 370.409 2.660 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000854570037 1006895161 /nfs/dbraw/zinc/89/51/61/1006895161.db2.gz NTYOQVBTRSYOHI-MDJJKAFGSA-N 1 1 373.453 2.710 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)CC1 ZINC000816952853 1007274152 /nfs/dbraw/zinc/27/41/52/1007274152.db2.gz SVZIEHXBSJQYPX-KXBFYZLASA-N 1 1 372.469 2.607 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@@H](C)C[N@@H+](C)CCC[NH+](C)C)cc1[N+](=O)[O-] ZINC000855347238 1007296054 /nfs/dbraw/zinc/29/60/54/1007296054.db2.gz ZIGZESCRNOBNCU-ZDUSSCGKSA-N 1 1 370.881 2.558 20 5 FFBDMO C[C@@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000817288913 1007509601 /nfs/dbraw/zinc/50/96/01/1007509601.db2.gz OWMMJTVIQKUWMJ-UKPHBRMFSA-N 1 1 364.442 2.928 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000855735824 1007531671 /nfs/dbraw/zinc/53/16/71/1007531671.db2.gz WZIOHACPAMEBSE-KRWDZBQOSA-N 1 1 368.437 2.566 20 5 FFBDMO O=Cc1ccc(OCc2ccc(C[NH+]3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000817578118 1007654968 /nfs/dbraw/zinc/65/49/68/1007654968.db2.gz QOAWEFIQROXMSO-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000856356141 1007784702 /nfs/dbraw/zinc/78/47/02/1007784702.db2.gz YCYVFFZHWLNIBQ-POGDKVGISA-N 1 1 351.406 2.999 20 5 FFBDMO Nc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1[N+](=O)[O-] ZINC000819640185 1008202507 /nfs/dbraw/zinc/20/25/07/1008202507.db2.gz PZUKTOGBOUGKQB-QFBILLFUSA-N 1 1 366.421 2.524 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3C3CCCCC3)cc2N1 ZINC000858683669 1008403924 /nfs/dbraw/zinc/40/39/24/1008403924.db2.gz VWZUXSZYULCOOQ-CYBMUJFWSA-N 1 1 360.414 2.745 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000858780248 1008422593 /nfs/dbraw/zinc/42/25/93/1008422593.db2.gz LMRKATUNWBRKIJ-AWEZNQCLSA-N 1 1 364.402 2.733 20 5 FFBDMO O=C([C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000822088787 1008518460 /nfs/dbraw/zinc/51/84/60/1008518460.db2.gz GBRVKLPPMBCUSP-QRVBRYPASA-N 1 1 351.406 2.871 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC000886249698 1008611694 /nfs/dbraw/zinc/61/16/94/1008611694.db2.gz QYXJYRNLLOODNA-GOSISDBHSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC000886249698 1008611700 /nfs/dbraw/zinc/61/17/00/1008611700.db2.gz QYXJYRNLLOODNA-GOSISDBHSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886251629 1008611975 /nfs/dbraw/zinc/61/19/75/1008611975.db2.gz HIHAPMJBQDLHTK-UHFFFAOYSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)OCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000859784813 1008665483 /nfs/dbraw/zinc/66/54/83/1008665483.db2.gz LPGKZWXVCJOFSS-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000859955034 1008743952 /nfs/dbraw/zinc/74/39/52/1008743952.db2.gz RQOMFMINLJHDBN-KFWWJZLASA-N 1 1 363.370 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000859955034 1008743966 /nfs/dbraw/zinc/74/39/66/1008743966.db2.gz RQOMFMINLJHDBN-KFWWJZLASA-N 1 1 363.370 2.667 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCc1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464274 1008999361 /nfs/dbraw/zinc/99/93/61/1008999361.db2.gz SKMJSKDKAVKVMP-IAGOWNOFSA-N 1 1 367.877 2.814 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598963 1009137375 /nfs/dbraw/zinc/13/73/75/1009137375.db2.gz PDCHTEKSBQQOFQ-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598963 1009137381 /nfs/dbraw/zinc/13/73/81/1009137381.db2.gz PDCHTEKSBQQOFQ-LJQANCHMSA-N 1 1 357.410 2.681 20 5 FFBDMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000823765510 1009218673 /nfs/dbraw/zinc/21/86/73/1009218673.db2.gz NPLPMJKXOCUFAC-WMZOPIPTSA-N 1 1 373.409 2.565 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000823956539 1009278107 /nfs/dbraw/zinc/27/81/07/1009278107.db2.gz SKSUWUJSSLDTLM-WBVHZDCISA-N 1 1 355.398 2.744 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000134930926 1009502860 /nfs/dbraw/zinc/50/28/60/1009502860.db2.gz RWUUKLLOYOKVMT-AUUYWEPGSA-N 1 1 373.453 2.910 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000868309204 1011240735 /nfs/dbraw/zinc/24/07/35/1011240735.db2.gz GWNGTNSAJGSUQM-AEFFLSMTSA-N 1 1 360.458 2.653 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@H]3COC[C@@]3(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001171867669 1011516067 /nfs/dbraw/zinc/51/60/67/1011516067.db2.gz KIXMDVROOQXBOV-KXBFYZLASA-N 1 1 362.426 2.693 20 5 FFBDMO O=C1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1C1CCCC1 ZINC001172914894 1012097535 /nfs/dbraw/zinc/09/75/35/1012097535.db2.gz KVMCITKKIVZIDH-KRWDZBQOSA-N 1 1 357.454 2.929 20 5 FFBDMO O=C1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1C1CCCC1 ZINC001172914894 1012097554 /nfs/dbraw/zinc/09/75/54/1012097554.db2.gz KVMCITKKIVZIDH-KRWDZBQOSA-N 1 1 357.454 2.929 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000870122032 1012169172 /nfs/dbraw/zinc/16/91/72/1012169172.db2.gz HYSBECUWYYXNTK-CQSZACIVSA-N 1 1 354.410 2.696 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@H](O)CC3)CC2)c(F)c1 ZINC001173009251 1012175799 /nfs/dbraw/zinc/17/57/99/1012175799.db2.gz AJIHWWKDFDRCRC-AWEZNQCLSA-N 1 1 355.385 2.689 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(C)c3)CC[NH2+]2)cc1 ZINC000870137891 1012184263 /nfs/dbraw/zinc/18/42/63/1012184263.db2.gz DWJDBCSPWHAYAC-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO CC[N@@H+](CCC(=O)OC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018866 1012188511 /nfs/dbraw/zinc/18/85/11/1012188511.db2.gz HUOPWNWAVKDLOA-UHFFFAOYSA-N 1 1 371.384 2.727 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3C)CC[NH2+]2)cc1 ZINC000870140863 1012190173 /nfs/dbraw/zinc/19/01/73/1012190173.db2.gz NWUHSRJIOUKGGQ-GOSISDBHSA-N 1 1 355.394 2.699 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCOC[C@H]3C3CC3)CC2)c(F)c1 ZINC001173019513 1012191875 /nfs/dbraw/zinc/19/18/75/1012191875.db2.gz LUYYHLMNMVZHJX-KRWDZBQOSA-N 1 1 367.396 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@@H]3OCC(F)(F)[C@@H]3C2)c1F ZINC001173181884 1012327394 /nfs/dbraw/zinc/32/73/94/1012327394.db2.gz QCTHUWGTBADYIT-PXWWUCIGSA-N 1 1 360.332 2.639 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H]3OCC(F)(F)[C@@H]3C2)c1F ZINC001173181884 1012327413 /nfs/dbraw/zinc/32/74/13/1012327413.db2.gz QCTHUWGTBADYIT-PXWWUCIGSA-N 1 1 360.332 2.639 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)[C@H]2CCC3(C2)OCCO3)c1F ZINC001173193631 1012333730 /nfs/dbraw/zinc/33/37/30/1012333730.db2.gz UUKXOQOHLAZBSF-OLZOCXBDSA-N 1 1 368.405 2.901 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@@H]3COC[C@H](C2)C3(F)F)c1F ZINC001173196022 1012339244 /nfs/dbraw/zinc/33/92/44/1012339244.db2.gz LACQNJNCLABUOT-UTUOFQBUSA-N 1 1 374.359 2.887 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@H](n3cncn3)C2)c1F ZINC001173197306 1012340303 /nfs/dbraw/zinc/34/03/03/1012340303.db2.gz SNYUXSOBIQAYQX-STQMWFEESA-N 1 1 363.393 2.602 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cn(C)nc21 ZINC001173223441 1012356114 /nfs/dbraw/zinc/35/61/14/1012356114.db2.gz FXJMCWBBAJQOGG-PBHICJAKSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001173226906 1012360880 /nfs/dbraw/zinc/36/08/80/1012360880.db2.gz MQAYCGIESCCJMN-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO COc1ccnc(O[C@@H]2CCC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237404 1012383023 /nfs/dbraw/zinc/38/30/23/1012383023.db2.gz JCIWXWOGPJNBGO-WMLDXEAASA-N 1 1 372.425 2.868 20 5 FFBDMO CC1(C)CCC[N@H+]1C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173697573 1012902091 /nfs/dbraw/zinc/90/20/91/1012902091.db2.gz SOQLDKOJBUJLAW-UHFFFAOYSA-N 1 1 367.471 2.622 20 5 FFBDMO C[N@H+](CCc1ccccc1)Cc1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000923951224 1017074996 /nfs/dbraw/zinc/07/49/96/1017074996.db2.gz RGYPISMSZIXCAD-UHFFFAOYSA-N 1 1 353.382 2.638 20 5 FFBDMO C[N@@H+](CCc1ccccc1)Cc1nc(Cc2ccc([N+](=O)[O-])cn2)no1 ZINC000923951224 1017075011 /nfs/dbraw/zinc/07/50/11/1017075011.db2.gz RGYPISMSZIXCAD-UHFFFAOYSA-N 1 1 353.382 2.638 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC[N@H+]1C ZINC000928440784 1018979985 /nfs/dbraw/zinc/97/99/85/1018979985.db2.gz KXNOHNBDRMBGSA-QFYYESIMSA-N 1 1 371.387 2.782 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000801601744 1019163106 /nfs/dbraw/zinc/16/31/06/1019163106.db2.gz MQVORABLBWSWBS-UHFFFAOYSA-N 1 1 358.354 2.616 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000801601744 1019163110 /nfs/dbraw/zinc/16/31/10/1019163110.db2.gz MQVORABLBWSWBS-UHFFFAOYSA-N 1 1 358.354 2.616 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)Cc1ccccc1 ZINC000801891454 1019490204 /nfs/dbraw/zinc/49/02/04/1019490204.db2.gz LWROOOPGGHQZFR-GFCCVEGCSA-N 1 1 360.389 2.566 20 5 FFBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@H]1C[N@H+](C(C)C)CCO1 ZINC000802138836 1019791216 /nfs/dbraw/zinc/79/12/16/1019791216.db2.gz PVFWYZVRTZHDOO-WMZOPIPTSA-N 1 1 364.442 2.816 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)cc1C ZINC001048525024 1020276372 /nfs/dbraw/zinc/27/63/72/1020276372.db2.gz GQOVKFHQYOAVKV-USYVTKNRSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1C ZINC001048525024 1020276375 /nfs/dbraw/zinc/27/63/75/1020276375.db2.gz GQOVKFHQYOAVKV-USYVTKNRSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1C ZINC001048525024 1020276383 /nfs/dbraw/zinc/27/63/83/1020276383.db2.gz GQOVKFHQYOAVKV-USYVTKNRSA-N 1 1 371.481 2.828 20 5 FFBDMO CCCC(=O)NC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777955368 1020319165 /nfs/dbraw/zinc/31/91/65/1020319165.db2.gz PSSKPMJRWPFOJW-UHFFFAOYSA-N 1 1 371.441 2.797 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1 ZINC000931492428 1020488871 /nfs/dbraw/zinc/48/88/71/1020488871.db2.gz XNFYSNQNHZPLDO-SLFFLAALSA-N 1 1 353.422 2.587 20 5 FFBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000726586215 1020489076 /nfs/dbraw/zinc/48/90/76/1020489076.db2.gz IPFBARIZDAXWIR-ZIAGYGMSSA-N 1 1 360.414 2.831 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)cc([N+](=O)[O-])c1 ZINC000903123904 1020689537 /nfs/dbraw/zinc/68/95/37/1020689537.db2.gz CTPURCUYXAYGLV-AGRHKRQWSA-N 1 1 363.458 2.632 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1c1ccnn1C ZINC000932265044 1020759214 /nfs/dbraw/zinc/75/92/14/1020759214.db2.gz DWUARLKAXCMGNX-KRWDZBQOSA-N 1 1 357.414 2.802 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH+]1CCC2(CC1)C[C@@H](O)c1ccccc1O2 ZINC000933065388 1020947773 /nfs/dbraw/zinc/94/77/73/1020947773.db2.gz IDKRVIAUDNIBRP-MRXNPFEDSA-N 1 1 355.394 2.841 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000933245682 1020982669 /nfs/dbraw/zinc/98/26/69/1020982669.db2.gz HXKXMZWMTQZOGS-INIZCTEOSA-N 1 1 359.430 2.807 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000749647563 1021017103 /nfs/dbraw/zinc/01/71/03/1021017103.db2.gz NWGNFVWEEYHAGB-HXUWFJFHSA-N 1 1 355.438 2.882 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1 ZINC000933944558 1021118390 /nfs/dbraw/zinc/11/83/90/1021118390.db2.gz HWNPLBRVASAECB-ZYSHUDEJSA-N 1 1 357.454 2.889 20 5 FFBDMO O=C(NC1CC1)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001116443033 1021220422 /nfs/dbraw/zinc/22/04/22/1021220422.db2.gz CICDVHOTRIJJJU-LLVKDONJSA-N 1 1 369.368 2.687 20 5 FFBDMO O=C(NC1CC1)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001116443033 1021220432 /nfs/dbraw/zinc/22/04/32/1021220432.db2.gz CICDVHOTRIJJJU-LLVKDONJSA-N 1 1 369.368 2.687 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000778777504 1022350856 /nfs/dbraw/zinc/35/08/56/1022350856.db2.gz AUBBFJLIPYZFLU-UHFFFAOYSA-N 1 1 362.342 2.954 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000778774254 1022354693 /nfs/dbraw/zinc/35/46/93/1022354693.db2.gz CFSCGGMXIGZOTQ-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO COCCOC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000116868483 1022427491 /nfs/dbraw/zinc/42/74/91/1022427491.db2.gz LPMVJDARMJWMEY-UHFFFAOYSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCOc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000159174039 1022629312 /nfs/dbraw/zinc/62/93/12/1022629312.db2.gz OPTMQLIHJFLJTF-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(N4CCCC4)nc3)CC2)cc1 ZINC000159171596 1022629350 /nfs/dbraw/zinc/62/93/50/1022629350.db2.gz OKOADASZRRJSMU-UHFFFAOYSA-N 1 1 367.453 2.912 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC(C(C)(C)C[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC001119633551 1022906182 /nfs/dbraw/zinc/90/61/82/1022906182.db2.gz PWGJORAMUXSTIK-UHFFFAOYSA-N 1 1 365.478 2.710 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@H](O)c2cnn(C)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000753663854 1023365288 /nfs/dbraw/zinc/36/52/88/1023365288.db2.gz NLVIGUQHSQQILT-HKUYNNGSSA-N 1 1 370.409 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)[C@H](C)C1 ZINC001121269083 1023681292 /nfs/dbraw/zinc/68/12/92/1023681292.db2.gz YPQFFFMNFYFPAS-VXGBXAGGSA-N 1 1 364.475 2.618 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC001123302013 1023731496 /nfs/dbraw/zinc/73/14/96/1023731496.db2.gz VGULQNHDBBOSEU-MVWJERBFSA-N 1 1 370.356 2.658 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000191663476 1023889846 /nfs/dbraw/zinc/88/98/46/1023889846.db2.gz NUKGEZFAKAHBBW-MRXNPFEDSA-N 1 1 354.410 2.571 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000758333648 1024051991 /nfs/dbraw/zinc/05/19/91/1024051991.db2.gz IBKWGNVHDYLNJH-RDTXWAMCSA-N 1 1 372.469 2.798 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@H]2C1 ZINC001124025340 1024232953 /nfs/dbraw/zinc/23/29/53/1024232953.db2.gz LHIPJEDIMDSCFM-VHFSOBRXSA-N 1 1 361.445 2.751 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000079945148 1024422281 /nfs/dbraw/zinc/42/22/81/1024422281.db2.gz BXUXZKUKBQEZPH-PBHICJAKSA-N 1 1 368.437 2.960 20 5 FFBDMO COc1ccc(CC(=O)OCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000837500084 1025852122 /nfs/dbraw/zinc/85/21/22/1025852122.db2.gz OILNTPWJRYDXRQ-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO CO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144129 1026983432 /nfs/dbraw/zinc/98/34/32/1026983432.db2.gz YBMMCERSHIOICV-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144129 1026983439 /nfs/dbraw/zinc/98/34/39/1026983439.db2.gz YBMMCERSHIOICV-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1ccc(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1[N+](=O)[O-] ZINC001159188004 1027301951 /nfs/dbraw/zinc/30/19/51/1027301951.db2.gz KBMREIRTZFNLHL-DZFIZOCASA-N 1 1 351.406 2.763 20 5 FFBDMO COc1cc2ncnc(N[C@@H]3C[C@H]4CCC[C@@H](C3)[N@@H+]4C)c2cc1[N+](=O)[O-] ZINC001160473384 1027722172 /nfs/dbraw/zinc/72/21/72/1027722172.db2.gz YAPLKINSMNNIMS-XYYAHUGASA-N 1 1 357.414 2.974 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[NH+]2CCC3(CCC3)CC2)C1=O ZINC000795715341 1027945585 /nfs/dbraw/zinc/94/55/85/1027945585.db2.gz XBCMHEIIRXWBHF-GOSISDBHSA-N 1 1 372.425 2.585 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(OC(C)C)cc1NCCCN1CC[NH+](C)CC1 ZINC001161711464 1028292457 /nfs/dbraw/zinc/29/24/57/1028292457.db2.gz NJCSPKKMSORGRY-UHFFFAOYSA-N 1 1 350.463 2.740 20 5 FFBDMO [NH3+]Cc1cc(Br)ccc1Nc1cc([N+](=O)[O-])cc(Cl)[n+]1[O-] ZINC001161853770 1028334209 /nfs/dbraw/zinc/33/42/09/1028334209.db2.gz RJBKEOGDTGITFE-UHFFFAOYSA-N 1 1 373.594 2.846 20 5 FFBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970080 1028372554 /nfs/dbraw/zinc/37/25/54/1028372554.db2.gz STBUNPQDMIGMGZ-SJCJKPOMSA-N 1 1 366.368 2.695 20 5 FFBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970080 1028372570 /nfs/dbraw/zinc/37/25/70/1028372570.db2.gz STBUNPQDMIGMGZ-SJCJKPOMSA-N 1 1 366.368 2.695 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC[C@@H]2C(=O)Nc3ccccc32)ncc1[N+](=O)[O-] ZINC001162614366 1028598747 /nfs/dbraw/zinc/59/87/47/1028598747.db2.gz MCVKOUMQMCXOGM-NPQIQWPPSA-N 1 1 353.382 2.670 20 5 FFBDMO C[C@@H]1CN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC001163069898 1028785926 /nfs/dbraw/zinc/78/59/26/1028785926.db2.gz SBNWJTKEQHXNKE-GFCCVEGCSA-N 1 1 362.405 2.564 20 5 FFBDMO CC(C)Oc1nc(N2CC[NH+](Cc3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC001163958320 1029126640 /nfs/dbraw/zinc/12/66/40/1029126640.db2.gz LZMWGIKJWYFNBN-UHFFFAOYSA-N 1 1 372.425 2.805 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(NCc3ccc(C[NH+]4CCOCC4)cc3)nc21 ZINC001156391921 1029177957 /nfs/dbraw/zinc/17/79/57/1029177957.db2.gz CWAPDGLDNLFCNV-UHFFFAOYSA-N 1 1 367.409 2.915 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])c(N2CC[NH+](CCc3ccncc3)CC2)n1 ZINC001165059568 1029356599 /nfs/dbraw/zinc/35/65/99/1029356599.db2.gz BEZOLNOTIBLGTB-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO CC(C)(C)[NH+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])CC1 ZINC001165090538 1029382624 /nfs/dbraw/zinc/38/26/24/1029382624.db2.gz CWLPQOOHHUATJR-UHFFFAOYSA-N 1 1 367.759 2.978 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCCC[C@@H]1C ZINC001156928915 1029409739 /nfs/dbraw/zinc/40/97/39/1029409739.db2.gz QXBXIGOOSTVOPJ-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO C[N@@H+](C1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)C1)[C@@H]1CCOC1 ZINC001165205979 1029893374 /nfs/dbraw/zinc/89/33/74/1029893374.db2.gz COFYYUSKPWKMPA-OAHLLOKOSA-N 1 1 372.400 2.705 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1nccc3ccc([N+](=O)[O-])cc31)CC2 ZINC001166034681 1030215631 /nfs/dbraw/zinc/21/56/31/1030215631.db2.gz IENQQQKWMHQYCF-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO C/C(=C\C(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784071841 1030452388 /nfs/dbraw/zinc/45/23/88/1030452388.db2.gz DLAXOVZQMWVKMT-VPHMPFFRSA-N 1 1 373.453 2.758 20 5 FFBDMO Cc1ccc(N(C)[C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000784375010 1030593995 /nfs/dbraw/zinc/59/39/95/1030593995.db2.gz PHXWMUGDEHNUKG-GOSISDBHSA-N 1 1 370.453 2.666 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1Cn1cnc(-c3ccc([N+](=O)[O-])cc3)n1)CCOCC2 ZINC000842640073 1030870889 /nfs/dbraw/zinc/87/08/89/1030870889.db2.gz ULDRCBYASZDQKW-CQSZACIVSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C(CC[N@@H+]1CCNCC12CCCCC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000843360899 1031351569 /nfs/dbraw/zinc/35/15/69/1031351569.db2.gz WRORKSGJBSAIOP-UHFFFAOYSA-N 1 1 364.421 2.671 20 5 FFBDMO O=C(CC[N@H+]1CCNCC12CCCCC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000843360899 1031351587 /nfs/dbraw/zinc/35/15/87/1031351587.db2.gz WRORKSGJBSAIOP-UHFFFAOYSA-N 1 1 364.421 2.671 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c1 ZINC000843421482 1031395183 /nfs/dbraw/zinc/39/51/83/1031395183.db2.gz PYSLCHLRJPVUAG-FQEVSTJZSA-N 1 1 370.405 2.647 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2cn(C)nc2-c2ccccc2)c1[N+](=O)[O-] ZINC001205388245 1031703244 /nfs/dbraw/zinc/70/32/44/1031703244.db2.gz FWEFHFCVSXLEIA-UHFFFAOYSA-N 1 1 368.393 2.999 20 5 FFBDMO C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)C[N@H+]2C1 ZINC001150828043 1031790714 /nfs/dbraw/zinc/79/07/14/1031790714.db2.gz WEGAMYCAMSUKQV-DYEKYZERSA-N 1 1 351.834 2.985 20 5 FFBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)[C@]1(C)CC[NH2+]C1 ZINC001219005897 1033456125 /nfs/dbraw/zinc/45/61/25/1033456125.db2.gz XRMXQXCQDJSLNS-OAQYLSRUSA-N 1 1 364.449 2.895 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]C/C=C/c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001276977534 1033916444 /nfs/dbraw/zinc/91/64/44/1033916444.db2.gz UVBWPCGMNOQYQD-YOBUMDGBSA-N 1 1 363.845 2.503 20 5 FFBDMO NC(=O)CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000831894765 1034389171 /nfs/dbraw/zinc/38/91/71/1034389171.db2.gz HQAZVYWSGNJKGP-KRWDZBQOSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCOc2ccccc21 ZINC000831894765 1034389182 /nfs/dbraw/zinc/38/91/82/1034389182.db2.gz HQAZVYWSGNJKGP-KRWDZBQOSA-N 1 1 373.384 2.935 20 5 FFBDMO Cc1nc(CNC(=O)[C@@H]([NH3+])Cc2c3ccccc3cc3ccccc32)n[nH]1 ZINC001221410321 1034721527 /nfs/dbraw/zinc/72/15/27/1034721527.db2.gz XTKOHUSWBJJBMF-IBGZPJMESA-N 1 1 359.433 2.606 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(Cl)c(F)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001226909069 1034880241 /nfs/dbraw/zinc/88/02/41/1034880241.db2.gz PRJXXINUWBGOPZ-UOJCWERNSA-N 1 1 372.780 2.933 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3cc(F)c(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227284287 1035495701 /nfs/dbraw/zinc/49/57/01/1035495701.db2.gz FSPGNIXLKASMHZ-CQOUMUIBSA-N 1 1 373.178 2.679 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cc(F)c(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227284287 1035495703 /nfs/dbraw/zinc/49/57/03/1035495703.db2.gz FSPGNIXLKASMHZ-CQOUMUIBSA-N 1 1 373.178 2.679 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ncc([N+](=O)[O-])c2nc[nH]c21 ZINC001227695010 1035679148 /nfs/dbraw/zinc/67/91/48/1035679148.db2.gz JWGRKWPYYMHQAP-WFASDCNBSA-N 1 1 353.382 2.765 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Oc1[nH]cc([N+](=O)[O-])c2ncnc1-2 ZINC001227695010 1035679152 /nfs/dbraw/zinc/67/91/52/1035679152.db2.gz JWGRKWPYYMHQAP-WFASDCNBSA-N 1 1 353.382 2.765 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1[nH]cc([N+](=O)[O-])c2ncnc1-2 ZINC001227695010 1035679156 /nfs/dbraw/zinc/67/91/56/1035679156.db2.gz JWGRKWPYYMHQAP-WFASDCNBSA-N 1 1 353.382 2.765 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001536523677 1069996799 /nfs/dbraw/zinc/99/67/99/1069996799.db2.gz RSIKNRSASDSSAN-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc3c(c2)oc2cc(O)ccc2c3=O)C1 ZINC001229515614 1036715031 /nfs/dbraw/zinc/71/50/31/1036715031.db2.gz XLMYJKYFRFMTCV-OAHLLOKOSA-N 1 1 355.390 2.751 20 5 FFBDMO COc1c(O[C@H]2CCC[N@@H+](C)C2)c2nccc3c4ccccc4n(c32)c1=O ZINC001234719063 1037154892 /nfs/dbraw/zinc/15/48/92/1037154892.db2.gz XRQSJYNZSMKDGZ-ZDUSSCGKSA-N 1 1 363.417 2.920 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC001230367625 1037253322 /nfs/dbraw/zinc/25/33/22/1037253322.db2.gz FQBMZLBCIVHWSK-UHFFFAOYSA-N 1 1 354.838 2.779 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC001208345692 1038235164 /nfs/dbraw/zinc/23/51/64/1038235164.db2.gz YGPXURCCNYRSCE-GXTWGEPZSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCC(=O)[C@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093974 1038380560 /nfs/dbraw/zinc/38/05/60/1038380560.db2.gz UEIKUNXIUWLNMU-CQSZACIVSA-N 1 1 361.442 2.873 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H](C)N(C)C[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256097359 1038381571 /nfs/dbraw/zinc/38/15/71/1038381571.db2.gz ZWLCOHBAWUHOAR-LSDHHAIUSA-N 1 1 362.474 2.597 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@H]3C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001256100606 1038383541 /nfs/dbraw/zinc/38/35/41/1038383541.db2.gz LPQXBMMXJQQQQH-SFHVURJKSA-N 1 1 363.458 2.929 20 5 FFBDMO COC(=O)c1ccc(-c2nc3ccc(C[NH+](C)C)cc3[nH]2)c([N+](=O)[O-])c1 ZINC001251132699 1038961043 /nfs/dbraw/zinc/96/10/43/1038961043.db2.gz OHXFIMBAPUAADD-UHFFFAOYSA-N 1 1 354.366 2.986 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc([C@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@H](C)O1 ZINC001258090115 1039163408 /nfs/dbraw/zinc/16/34/08/1039163408.db2.gz CSNOMFQBRDQYNQ-USBNGQNGSA-N 1 1 372.385 2.816 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc([C@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@H](C)O1 ZINC001258090115 1039163414 /nfs/dbraw/zinc/16/34/14/1039163414.db2.gz CSNOMFQBRDQYNQ-USBNGQNGSA-N 1 1 372.385 2.816 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1Cc1nnc(CC[NH+]2C[C@@H](C)O[C@H](C)C2)o1 ZINC001258091889 1039165054 /nfs/dbraw/zinc/16/50/54/1039165054.db2.gz OUGRJQBQEGRETK-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO [NH3+][C@H](Cc1c[nH]c2ccccc12)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247096279 1039605690 /nfs/dbraw/zinc/60/56/90/1039605690.db2.gz SSQMHBQDCVEFMD-GFCCVEGCSA-N 1 1 368.328 2.903 20 5 FFBDMO COc1ccc(OC)c(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC001247665248 1039873225 /nfs/dbraw/zinc/87/32/25/1039873225.db2.gz CXXBOZSWKHFGTG-AWEZNQCLSA-N 1 1 370.365 2.905 20 5 FFBDMO Cc1cc(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC001537893702 1070286043 /nfs/dbraw/zinc/28/60/43/1070286043.db2.gz BGMLZCLXDRYDSX-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO C[N@@H+]([C@H]1CCC2(C1)OCCO2)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254484000 1040749345 /nfs/dbraw/zinc/74/93/45/1040749345.db2.gz ZYPNRFMIMYXSLF-SFHVURJKSA-N 1 1 361.442 2.791 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(CCc2ccccn2)CC1 ZINC001254563601 1040801831 /nfs/dbraw/zinc/80/18/31/1040801831.db2.gz ZJAAUQVBPAEOJA-QGZVFWFLSA-N 1 1 354.454 2.781 20 5 FFBDMO COC(=O)c1cnc2c(c1)C[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254570661 1040807978 /nfs/dbraw/zinc/80/79/78/1040807978.db2.gz PHIKDFJYTLIFKM-ZDUSSCGKSA-N 1 1 355.394 2.766 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCn3cnc(COCC4CC4)c3C1)C2 ZINC001254595569 1040825157 /nfs/dbraw/zinc/82/51/57/1040825157.db2.gz ITNQHLQCSYTRML-GOSISDBHSA-N 1 1 368.437 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCn3cnc(COCC4CC4)c3C1)C2 ZINC001254595569 1040825168 /nfs/dbraw/zinc/82/51/68/1040825168.db2.gz ITNQHLQCSYTRML-GOSISDBHSA-N 1 1 368.437 2.701 20 5 FFBDMO O=C(c1ccco1)N1C[C@H]2C[C@@H](C1)[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254597387 1040828226 /nfs/dbraw/zinc/82/82/26/1040828226.db2.gz DBOVDLIWQNRZGG-BVGQSLNGSA-N 1 1 367.405 2.502 20 5 FFBDMO O=C1N(CC2CC2)CC[C@@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599400 1040829717 /nfs/dbraw/zinc/82/97/17/1040829717.db2.gz YURVOZWMEHPHSZ-TZIWHRDSSA-N 1 1 369.465 2.787 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)[C@@H]2C1 ZINC001538046058 1070324084 /nfs/dbraw/zinc/32/40/84/1070324084.db2.gz GUMXWPGOKJRZEV-QGTPRVQTSA-N 1 1 372.469 2.655 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)[C@@H]2C1 ZINC001538046056 1070324781 /nfs/dbraw/zinc/32/47/81/1070324781.db2.gz GUMXWPGOKJRZEV-BMGDILEWSA-N 1 1 372.469 2.655 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@H](c4nccs4)C3)n2)cc1 ZINC001262052687 1041532545 /nfs/dbraw/zinc/53/25/45/1041532545.db2.gz CUUYEFOBLWXPCQ-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](c4nccs4)C3)n2)cc1 ZINC001262052687 1041532551 /nfs/dbraw/zinc/53/25/51/1041532551.db2.gz CUUYEFOBLWXPCQ-ZDUSSCGKSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c(F)c1N1CCOCC1 ZINC001262678650 1041789089 /nfs/dbraw/zinc/78/90/89/1041789089.db2.gz IXWLTGOIKHIGFF-ZFWWWQNUSA-N 1 1 364.421 2.609 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001318785350 1044875384 /nfs/dbraw/zinc/87/53/84/1044875384.db2.gz PIERKRZEGRFCAZ-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001318785350 1044875403 /nfs/dbraw/zinc/87/54/03/1044875403.db2.gz PIERKRZEGRFCAZ-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)N2CCS[C@H]2c2ccc([N+](=O)[O-])cc2)no1 ZINC001320255219 1045376923 /nfs/dbraw/zinc/37/69/23/1045376923.db2.gz SOYOGCSPQGKDIT-INIZCTEOSA-N 1 1 362.411 2.532 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(C)[nH+]c(N2CCCC2)c1 ZINC001325940645 1046694263 /nfs/dbraw/zinc/69/42/63/1046694263.db2.gz PCWIECOXSBSZAK-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)c1 ZINC001326387972 1046911424 /nfs/dbraw/zinc/91/14/24/1046911424.db2.gz NHFVHWKWTPTFLO-CQSZACIVSA-N 1 1 372.425 2.570 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC001289680311 1047717808 /nfs/dbraw/zinc/71/78/08/1047717808.db2.gz ZXJCGXQOMXREOW-CYBMUJFWSA-N 1 1 351.472 2.924 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[N@H+]1CCCC[C@@H]1C ZINC001540833305 1071014339 /nfs/dbraw/zinc/01/43/39/1071014339.db2.gz LUMTUHRXJKXOCW-KBPBESRZSA-N 1 1 371.441 2.978 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001333160113 1048736476 /nfs/dbraw/zinc/73/64/76/1048736476.db2.gz UHBYEPDVZJWMRB-CYBMUJFWSA-N 1 1 351.834 2.878 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC001333317005 1048831646 /nfs/dbraw/zinc/83/16/46/1048831646.db2.gz QWBYEKFENOPYGO-GOEBONIOSA-N 1 1 372.450 2.814 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC001333317005 1048831666 /nfs/dbraw/zinc/83/16/66/1048831666.db2.gz QWBYEKFENOPYGO-GOEBONIOSA-N 1 1 372.450 2.814 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2F)C1 ZINC001307190060 1049914649 /nfs/dbraw/zinc/91/46/49/1049914649.db2.gz OFGOISSSDNWHGC-INIZCTEOSA-N 1 1 360.389 2.750 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2F)C1 ZINC001307190060 1049914655 /nfs/dbraw/zinc/91/46/55/1049914655.db2.gz OFGOISSSDNWHGC-INIZCTEOSA-N 1 1 360.389 2.750 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC2)cc1 ZINC001341963569 1050560725 /nfs/dbraw/zinc/56/07/25/1050560725.db2.gz UFILLSFPULXUAJ-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC1 ZINC001340238434 1050646516 /nfs/dbraw/zinc/64/65/16/1050646516.db2.gz MHAVNOMQOUBAGW-UHFFFAOYSA-N 1 1 367.413 2.508 20 5 FFBDMO CCn1c(-c2cc(C)cc([N+](=O)[O-])c2)nnc1N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC001340300725 1050700338 /nfs/dbraw/zinc/70/03/38/1050700338.db2.gz NXRXCGOOLZGPMK-HNAYVOBHSA-N 1 1 370.457 2.570 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC001342650852 1051258595 /nfs/dbraw/zinc/25/85/95/1051258595.db2.gz HJTRLLSLXDGLOW-HNNXBMFYSA-N 1 1 364.494 2.556 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)o1 ZINC001307421879 1052304882 /nfs/dbraw/zinc/30/48/82/1052304882.db2.gz CXNUGGBIEXADOL-ZDUSSCGKSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](c3ccncn3)C2)o1 ZINC001307421879 1052304887 /nfs/dbraw/zinc/30/48/87/1052304887.db2.gz CXNUGGBIEXADOL-ZDUSSCGKSA-N 1 1 366.381 2.814 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@@H+](Cc2ccccc2)[C@@H](C(C)C)C1 ZINC001307930987 1052368872 /nfs/dbraw/zinc/36/88/72/1052368872.db2.gz NBGFQPRUQSJEMP-LJQANCHMSA-N 1 1 371.485 2.942 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1c1ncccn1)Nc1cc([N+](=O)[O-])ccc1F ZINC001307947537 1052370959 /nfs/dbraw/zinc/37/09/59/1052370959.db2.gz UWBKFVJPEZOQJF-OAHLLOKOSA-N 1 1 359.361 2.690 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1c1ncccn1)Nc1cc([N+](=O)[O-])ccc1F ZINC001307947537 1052370966 /nfs/dbraw/zinc/37/09/66/1052370966.db2.gz UWBKFVJPEZOQJF-OAHLLOKOSA-N 1 1 359.361 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@]3(CO)c3ccccc3)nc2c1 ZINC001308164225 1052422392 /nfs/dbraw/zinc/42/23/92/1052422392.db2.gz RPMBHFOUSJCQDV-IBGZPJMESA-N 1 1 352.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@]3(CO)c3ccccc3)nc2c1 ZINC001308164225 1052422396 /nfs/dbraw/zinc/42/23/96/1052422396.db2.gz RPMBHFOUSJCQDV-IBGZPJMESA-N 1 1 352.394 2.955 20 5 FFBDMO COC(=O)[C@@H]1[C@H](C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1(F)F ZINC001308774212 1052497774 /nfs/dbraw/zinc/49/77/74/1052497774.db2.gz QTDPQVVMCINCAI-QEJZJMRPSA-N 1 1 354.353 2.829 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001335393429 1053333614 /nfs/dbraw/zinc/33/36/14/1053333614.db2.gz LHIXNXXWAQBUPB-OAHLLOKOSA-N 1 1 351.834 2.878 20 5 FFBDMO CCOc1ccc2c(c1)CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001348777762 1054920940 /nfs/dbraw/zinc/92/09/40/1054920940.db2.gz WZTUQTCAIBXVFU-HXUWFJFHSA-N 1 1 369.421 2.752 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000847254992 1055322966 /nfs/dbraw/zinc/32/29/66/1055322966.db2.gz IGNYBJMAUCTYED-LSDHHAIUSA-N 1 1 364.421 2.547 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)[C@@H]2C1 ZINC001338298997 1055399925 /nfs/dbraw/zinc/39/99/25/1055399925.db2.gz XVCCKHMVKCFHQA-IAOVAPTHSA-N 1 1 358.442 2.583 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC001357610250 1055963416 /nfs/dbraw/zinc/96/34/16/1055963416.db2.gz AFGUWSHHBJTZKV-QGZVFWFLSA-N 1 1 374.828 2.749 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001339454187 1056470016 /nfs/dbraw/zinc/47/00/16/1056470016.db2.gz HMXAWZDAEQQNGH-RDJZCZTQSA-N 1 1 372.473 2.564 20 5 FFBDMO C[NH+](C)Cc1ccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)o1 ZINC001544724884 1071682968 /nfs/dbraw/zinc/68/29/68/1071682968.db2.gz IVNVOVSAPJXFPY-UHFFFAOYSA-N 1 1 373.409 2.933 20 5 FFBDMO C[C@H](c1nnc(N2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)n1C)[N+](=O)[O-] ZINC001519598450 1058866790 /nfs/dbraw/zinc/86/67/90/1058866790.db2.gz VZGUHLDTHGVPGK-QKPAOTATSA-N 1 1 372.473 2.641 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001545661655 1071828048 /nfs/dbraw/zinc/82/80/48/1071828048.db2.gz DOYKZDRDBQHZMX-CYBMUJFWSA-N 1 1 362.434 2.581 20 5 FFBDMO C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC001452735228 1059289625 /nfs/dbraw/zinc/28/96/25/1059289625.db2.gz GBWUNBXUVDVSMJ-LJQANCHMSA-N 1 1 354.410 2.571 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1Cn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001515855117 1059846350 /nfs/dbraw/zinc/84/63/50/1059846350.db2.gz SSPHJOQXHHVFLF-GOSISDBHSA-N 1 1 372.473 2.658 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481049 1060112522 /nfs/dbraw/zinc/11/25/22/1060112522.db2.gz VQNAJGRWCPLDFI-APWZRJJASA-N 1 1 374.485 2.532 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000848480973 1060113731 /nfs/dbraw/zinc/11/37/31/1060113731.db2.gz UALIWOPKIRWZHV-AZUAARDMSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000848490237 1060146717 /nfs/dbraw/zinc/14/67/17/1060146717.db2.gz XUXSHLQLLNQREB-NVXWUHKLSA-N 1 1 365.380 2.989 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000848490237 1060146722 /nfs/dbraw/zinc/14/67/22/1060146722.db2.gz XUXSHLQLLNQREB-NVXWUHKLSA-N 1 1 365.380 2.989 20 5 FFBDMO CC(C)O[C@H]1CCC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489556 1060148933 /nfs/dbraw/zinc/14/89/33/1060148933.db2.gz NXFQMCCLLUIAKN-ZWKOTPCHSA-N 1 1 361.442 2.758 20 5 FFBDMO CC(C)O[C@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489556 1060148937 /nfs/dbraw/zinc/14/89/37/1060148937.db2.gz NXFQMCCLLUIAKN-ZWKOTPCHSA-N 1 1 361.442 2.758 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC001458044276 1060499317 /nfs/dbraw/zinc/49/93/17/1060499317.db2.gz HWOHIKHIITYPRW-MRXNPFEDSA-N 1 1 360.458 2.751 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ncccn2)CC1 ZINC001460804863 1061108201 /nfs/dbraw/zinc/10/82/01/1061108201.db2.gz DSDVGHAYIROOOK-ZDUSSCGKSA-N 1 1 355.398 2.591 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@H](c2ccccc2)CC1 ZINC001460950408 1061162301 /nfs/dbraw/zinc/16/23/01/1061162301.db2.gz QJOYLRZOCFTFAW-HKUYNNGSSA-N 1 1 372.421 2.798 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001532594693 1063126713 /nfs/dbraw/zinc/12/67/13/1063126713.db2.gz SRZSRZKHOCKOMC-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001466026517 1063301196 /nfs/dbraw/zinc/30/11/96/1063301196.db2.gz FGBVIELVLLGLNR-UKRRQHHQSA-N 1 1 350.444 2.605 20 5 FFBDMO CC1(C)CCC(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)CC1 ZINC001495916671 1063558415 /nfs/dbraw/zinc/55/84/15/1063558415.db2.gz IELNPHYXIBIWQT-HZPDHXFCSA-N 1 1 351.491 2.887 20 5 FFBDMO C[C@@H](c1ncccn1)[N@@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001473363855 1065248179 /nfs/dbraw/zinc/24/81/79/1065248179.db2.gz FUJYNIGUMWBURE-ZDUSSCGKSA-N 1 1 367.413 2.534 20 5 FFBDMO C[C@@H](c1ncccn1)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC001473363855 1065248187 /nfs/dbraw/zinc/24/81/87/1065248187.db2.gz FUJYNIGUMWBURE-ZDUSSCGKSA-N 1 1 367.413 2.534 20 5 FFBDMO Cn1cc(C[NH+]2CCC(Cc3nc(C4CCCC4)no3)CC2)c([N+](=O)[O-])n1 ZINC001473667360 1065311653 /nfs/dbraw/zinc/31/16/53/1065311653.db2.gz YIUFTDOJGARPGE-UHFFFAOYSA-N 1 1 374.445 2.824 20 5 FFBDMO C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001473759281 1065348339 /nfs/dbraw/zinc/34/83/39/1065348339.db2.gz BYYKZBBRJWIYTB-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO COc1c(F)cc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1F ZINC001579134374 1078573054 /nfs/dbraw/zinc/57/30/54/1078573054.db2.gz HVVMDFGMHVWSDS-MRXNPFEDSA-N 1 1 351.309 2.694 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nn[nH]n2)cc1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001582804627 1079109713 /nfs/dbraw/zinc/10/97/13/1079109713.db2.gz WYYSJRMGFWMLDO-CQSZACIVSA-N 1 1 357.418 2.594 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC001583145776 1079170481 /nfs/dbraw/zinc/17/04/81/1079170481.db2.gz UCQJEYMCEKGFPA-CHWSQXEVSA-N 1 1 352.822 2.577 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@H]4CC[N@@H+](C)[C@H]4C3)cc2[N+](=O)[O-])CC1 ZINC001583279300 1079187475 /nfs/dbraw/zinc/18/74/75/1079187475.db2.gz VULFUYPQDLPDSL-APWZRJJASA-N 1 1 372.469 2.607 20 5 FFBDMO C[C@@H]1C[C@H]2CC[C@H](C(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)C[N@H+]2C1 ZINC001557207953 1075822166 /nfs/dbraw/zinc/82/21/66/1075822166.db2.gz GLOGPCTUGLUVII-NTZNESFSSA-N 1 1 353.369 2.610 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC([NH2+]C2CCC2)CC1 ZINC001558709352 1076061072 /nfs/dbraw/zinc/06/10/72/1076061072.db2.gz WTGPTXOMKBQCHS-UHFFFAOYSA-N 1 1 369.425 2.732 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001561699923 1076409365 /nfs/dbraw/zinc/40/93/65/1076409365.db2.gz GBWWIQGQLYTJAI-HOTGVXAUSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)c1 ZINC001566275988 1076941131 /nfs/dbraw/zinc/94/11/31/1076941131.db2.gz LEQOLPXMCNONOS-UHFFFAOYSA-N 1 1 374.828 2.843 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001568140790 1077073705 /nfs/dbraw/zinc/07/37/05/1077073705.db2.gz XJSVOHKNLNVGJX-MRXNPFEDSA-N 1 1 354.410 2.526 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc(CF)cc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570796043 1077231392 /nfs/dbraw/zinc/23/13/92/1077231392.db2.gz BYSQVTMGACMEHG-IAGOWNOFSA-N 1 1 363.433 2.730 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001586605087 1079655615 /nfs/dbraw/zinc/65/56/15/1079655615.db2.gz YTYUNEWACXAJMY-KDURUIRLSA-N 1 1 361.417 2.990 20 5 FFBDMO COc1ccc(C[NH+]2CCC(NC(=O)c3ccoc3C)CC2)cc1[N+](=O)[O-] ZINC000066890304 249671363 /nfs/dbraw/zinc/67/13/63/249671363.db2.gz FMWQNZBMWSYPMM-UHFFFAOYSA-N 1 1 373.409 2.899 20 5 FFBDMO COCC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H](C)C(N)=O ZINC000093138230 250017475 /nfs/dbraw/zinc/01/74/75/250017475.db2.gz CBLXLQOEQNMVMP-GFCCVEGCSA-N 1 1 363.439 2.646 20 5 FFBDMO COCC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H](C)C(N)=O ZINC000093138230 250017478 /nfs/dbraw/zinc/01/74/78/250017478.db2.gz CBLXLQOEQNMVMP-GFCCVEGCSA-N 1 1 363.439 2.646 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1SC ZINC000103085386 250134458 /nfs/dbraw/zinc/13/44/58/250134458.db2.gz PGNDCULKVSIOLX-SNVBAGLBSA-N 1 1 353.444 2.538 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000181188299 251256146 /nfs/dbraw/zinc/25/61/46/251256146.db2.gz QOTVUNXNUTWXRY-ZFWWWQNUSA-N 1 1 354.410 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCN2CCOCC2)Cc2ccncc2)cc1 ZINC000272461861 252043913 /nfs/dbraw/zinc/04/39/13/252043913.db2.gz ONJYGHGOMBKGRI-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000272524632 252060273 /nfs/dbraw/zinc/06/02/73/252060273.db2.gz LWWMBWKVONSHPY-LMMKCTJWSA-N 1 1 358.442 2.949 20 5 FFBDMO CCN(CC)C(=O)CCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272543225 252064630 /nfs/dbraw/zinc/06/46/30/252064630.db2.gz PLWUDPLKVRLCCN-SFHVURJKSA-N 1 1 373.457 2.656 20 5 FFBDMO CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272683597 252099370 /nfs/dbraw/zinc/09/93/70/252099370.db2.gz OIZBSVVKZOPNMY-MRXNPFEDSA-N 1 1 355.394 2.647 20 5 FFBDMO CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272683597 252099371 /nfs/dbraw/zinc/09/93/71/252099371.db2.gz OIZBSVVKZOPNMY-MRXNPFEDSA-N 1 1 355.394 2.647 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1=CC[N@@H+](C)CC1 ZINC000272621514 252083247 /nfs/dbraw/zinc/08/32/47/252083247.db2.gz ACMABCURDTYAEJ-SNVBAGLBSA-N 1 1 357.332 2.994 20 5 FFBDMO CN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272785071 252130799 /nfs/dbraw/zinc/13/07/99/252130799.db2.gz ZZVTXSVLBIUKLI-OAHLLOKOSA-N 1 1 355.398 2.728 20 5 FFBDMO CS(=O)(=O)c1cccc(Cl)c1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000273388557 252295145 /nfs/dbraw/zinc/29/51/45/252295145.db2.gz JKSSLCUZZZFEQP-UHFFFAOYSA-N 1 1 368.842 2.984 20 5 FFBDMO CCOC(CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)OCC ZINC000276131783 256075047 /nfs/dbraw/zinc/07/50/47/256075047.db2.gz CSXAEWPQDFTLDV-KRWDZBQOSA-N 1 1 362.430 2.797 20 5 FFBDMO C[C@H](CO)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000276448919 256101006 /nfs/dbraw/zinc/10/10/06/256101006.db2.gz MQBRTDSLCIJDFQ-LLVKDONJSA-N 1 1 355.822 2.812 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000277074542 256158845 /nfs/dbraw/zinc/15/88/45/256158845.db2.gz TTYVTEFDPBGFLY-QAPCUYQASA-N 1 1 372.469 2.751 20 5 FFBDMO CCOc1cc(CN2CC[N@H+](C3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000278608612 256330913 /nfs/dbraw/zinc/33/09/13/256330913.db2.gz JAYITBBRXIRQJE-HNNXBMFYSA-N 1 1 363.458 2.679 20 5 FFBDMO C[C@@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000279134984 256385500 /nfs/dbraw/zinc/38/55/00/256385500.db2.gz RHIIAZJICQPVQU-KXBFYZLASA-N 1 1 360.502 2.790 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000279155641 256388013 /nfs/dbraw/zinc/38/80/13/256388013.db2.gz HRETVXSZDRPOSU-ZDUSSCGKSA-N 1 1 366.437 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c1 ZINC000281482496 256636553 /nfs/dbraw/zinc/63/65/53/256636553.db2.gz GZTWYSXRNXJBQD-MRXNPFEDSA-N 1 1 363.458 2.766 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286667101 257048620 /nfs/dbraw/zinc/04/86/20/257048620.db2.gz UXLLRWWVENPUFZ-TZMCWYRMSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286667101 257048621 /nfs/dbraw/zinc/04/86/21/257048621.db2.gz UXLLRWWVENPUFZ-TZMCWYRMSA-N 1 1 362.348 2.986 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccn1 ZINC000287425153 257088690 /nfs/dbraw/zinc/08/86/90/257088690.db2.gz PFBVATDTAVIRKV-UHFFFAOYSA-N 1 1 372.425 2.775 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)Nc1cc(-c3cccc([N+](=O)[O-])c3)[nH]n1)C2 ZINC000290377065 257328919 /nfs/dbraw/zinc/32/89/19/257328919.db2.gz KNCQPNXNKBMIKS-ZDUSSCGKSA-N 1 1 366.381 2.691 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000290829207 257360022 /nfs/dbraw/zinc/36/00/22/257360022.db2.gz UIQJRQGIXLMTJB-HIFRSBDPSA-N 1 1 369.425 2.554 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000290973181 257369634 /nfs/dbraw/zinc/36/96/34/257369634.db2.gz QGSMGZCDHJRXQT-INIZCTEOSA-N 1 1 371.441 2.657 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294604450 257594846 /nfs/dbraw/zinc/59/48/46/257594846.db2.gz VIIYIAKPYHDXJH-GXTWGEPZSA-N 1 1 357.332 2.970 20 5 FFBDMO COc1ccc(C[N@H+](Cc2cccc(C(N)=O)c2)C2CC2)cc1[N+](=O)[O-] ZINC000294805620 257603422 /nfs/dbraw/zinc/60/34/22/257603422.db2.gz NJYLKAWWGAIXLS-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO COc1ccc(C[N@@H+](Cc2cccc(C(N)=O)c2)C2CC2)cc1[N+](=O)[O-] ZINC000294805620 257603423 /nfs/dbraw/zinc/60/34/23/257603423.db2.gz NJYLKAWWGAIXLS-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295568326 257637948 /nfs/dbraw/zinc/63/79/48/257637948.db2.gz UPONUTCHGCXIIE-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000295568326 257637949 /nfs/dbraw/zinc/63/79/49/257637949.db2.gz UPONUTCHGCXIIE-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)CCC(=O)c3cccc([N+](=O)[O-])c3)C2)C1 ZINC000295596108 257638855 /nfs/dbraw/zinc/63/88/55/257638855.db2.gz MQQRKZDHJZIJCL-IBGZPJMESA-N 1 1 359.426 2.502 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000301107926 258026134 /nfs/dbraw/zinc/02/61/34/258026134.db2.gz MWCXGJRYGIEQBZ-AWEZNQCLSA-N 1 1 368.437 2.813 20 5 FFBDMO CC[C@H]1CCCC[N@@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301275070 258038962 /nfs/dbraw/zinc/03/89/62/258038962.db2.gz OODJQTQYHVYDLU-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301275070 258038964 /nfs/dbraw/zinc/03/89/64/258038964.db2.gz OODJQTQYHVYDLU-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000302027090 258083143 /nfs/dbraw/zinc/08/31/43/258083143.db2.gz HDXAWDXUYXMICH-CABCVRRESA-N 1 1 358.446 2.728 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCc3ccccc3C2)c1 ZINC000302109133 258088720 /nfs/dbraw/zinc/08/87/20/258088720.db2.gz SXLHVGGPKSELRD-UHFFFAOYSA-N 1 1 355.394 2.852 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)CC2)C[C@H](C)O1 ZINC000302456809 258102682 /nfs/dbraw/zinc/10/26/82/258102682.db2.gz QPCGGAJEBXSBMK-GASCZTMLSA-N 1 1 374.485 2.888 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000302675418 258107660 /nfs/dbraw/zinc/10/76/60/258107660.db2.gz UDKKXVDKVIBOLG-OKILXGFUSA-N 1 1 369.487 2.778 20 5 FFBDMO O=[N+]([O-])c1cccnc1NCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000301725641 258064740 /nfs/dbraw/zinc/06/47/40/258064740.db2.gz UUSZQRXTWAIVHH-UHFFFAOYSA-N 1 1 361.833 2.877 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1Cc1ccccc1 ZINC000301975102 258079274 /nfs/dbraw/zinc/07/92/74/258079274.db2.gz VRNZXIZBMRZTPX-HIFRSBDPSA-N 1 1 352.398 2.712 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000330703739 258168626 /nfs/dbraw/zinc/16/86/26/258168626.db2.gz JIRFKMQMQMCWJK-DOTOQJQBSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H]2CCCC[N@@H+]2C[C@H]1C ZINC000331980686 258208769 /nfs/dbraw/zinc/20/87/69/258208769.db2.gz FHXJGHDTRNFKDV-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2CCCC[N@@H+]2C[C@H]1C ZINC000331980679 258208784 /nfs/dbraw/zinc/20/87/84/258208784.db2.gz FHXJGHDTRNFKDV-NVXWUHKLSA-N 1 1 360.458 2.790 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000332030111 258211010 /nfs/dbraw/zinc/21/10/10/258211010.db2.gz HLIPLDNLUDOWGI-INIZCTEOSA-N 1 1 360.458 2.508 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000332295282 258223767 /nfs/dbraw/zinc/22/37/67/258223767.db2.gz LYSFUHOOKXORCL-STQMWFEESA-N 1 1 369.368 2.753 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000332631814 258238297 /nfs/dbraw/zinc/23/82/97/258238297.db2.gz RHBCLUWKTMOLPT-KRWDZBQOSA-N 1 1 362.474 2.899 20 5 FFBDMO C[N@@H+](CCCc1ccccc1)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000052802633 506253476 /nfs/dbraw/zinc/25/34/76/506253476.db2.gz CZWUJRCOIXXTRF-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)[C@@H]1CCC[N@@H+](C)C1 ZINC000053245508 506341579 /nfs/dbraw/zinc/34/15/79/506341579.db2.gz DVJAHCHGTBVXHX-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1ccccc1NC(=O)[C@H](C)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373247343 512240016 /nfs/dbraw/zinc/24/00/16/512240016.db2.gz YRFNYQDORJPXST-AWEZNQCLSA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000054676247 506601518 /nfs/dbraw/zinc/60/15/18/506601518.db2.gz LJHWIHFIAKILAH-AWEZNQCLSA-N 1 1 373.413 2.803 20 5 FFBDMO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000055758184 506843419 /nfs/dbraw/zinc/84/34/19/506843419.db2.gz WRTQEDKRWLTJSM-JHJVBQTASA-N 1 1 359.430 2.567 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067399531 506864510 /nfs/dbraw/zinc/86/45/10/506864510.db2.gz OVYMBQTXYNSGHJ-SFHVURJKSA-N 1 1 369.421 2.883 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000067707649 506983093 /nfs/dbraw/zinc/98/30/93/506983093.db2.gz QTNLPQYWRZUJAG-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO C[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000067707649 506983098 /nfs/dbraw/zinc/98/30/98/506983098.db2.gz QTNLPQYWRZUJAG-GOSISDBHSA-N 1 1 354.410 2.522 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000056607948 507055078 /nfs/dbraw/zinc/05/50/78/507055078.db2.gz WYHPGKFFZMRWAW-UHFFFAOYSA-N 1 1 374.466 2.726 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000022474516 507294734 /nfs/dbraw/zinc/29/47/34/507294734.db2.gz CUCQXUZRMGOXFM-CHWSQXEVSA-N 1 1 350.419 2.604 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 ZINC000025137488 507471438 /nfs/dbraw/zinc/47/14/38/507471438.db2.gz QDDBFVGHEXKMTJ-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000060330693 507523902 /nfs/dbraw/zinc/52/39/02/507523902.db2.gz UVLPOCFGPHJDFM-QGZVFWFLSA-N 1 1 369.487 2.669 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000026168029 507563448 /nfs/dbraw/zinc/56/34/48/507563448.db2.gz LGQYRWXTRZSNLG-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000026168029 507563456 /nfs/dbraw/zinc/56/34/56/507563456.db2.gz LGQYRWXTRZSNLG-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCOc1ccccc1 ZINC000026222774 507570098 /nfs/dbraw/zinc/57/00/98/507570098.db2.gz NJMQVRFFHPLFNZ-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027349417 507648727 /nfs/dbraw/zinc/64/87/27/507648727.db2.gz WHTCUGFAIOKYSB-UHFFFAOYSA-N 1 1 365.336 2.927 20 5 FFBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027349417 507648728 /nfs/dbraw/zinc/64/87/28/507648728.db2.gz WHTCUGFAIOKYSB-UHFFFAOYSA-N 1 1 365.336 2.927 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000367126099 512350045 /nfs/dbraw/zinc/35/00/45/512350045.db2.gz KQRVQTZJGQVBEH-CQSZACIVSA-N 1 1 372.400 2.568 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000028836521 507744278 /nfs/dbraw/zinc/74/42/78/507744278.db2.gz WRJRASGIJIFTFW-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000063722615 507764194 /nfs/dbraw/zinc/76/41/94/507764194.db2.gz YZGMUEYSCFCXAI-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000063728085 507765899 /nfs/dbraw/zinc/76/58/99/507765899.db2.gz LQDJIGSOYKQQCZ-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000029622401 507784891 /nfs/dbraw/zinc/78/48/91/507784891.db2.gz XVPGVUPZUFRQOT-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(CNc3c([N+](=O)[O-])ncn3C)cc2)C[C@H](C)O1 ZINC000030001611 507799648 /nfs/dbraw/zinc/79/96/48/507799648.db2.gz VHKYEUOYNSINSZ-OKILXGFUSA-N 1 1 359.430 2.550 20 5 FFBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000072663465 507839631 /nfs/dbraw/zinc/83/96/31/507839631.db2.gz ZVNTVRCBTXKXAG-DYEKYZERSA-N 1 1 361.398 2.915 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644385 507853431 /nfs/dbraw/zinc/85/34/31/507853431.db2.gz IQSAFIQKFWUUFE-OALUTQOASA-N 1 1 371.437 2.789 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@H+](CC3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108423891 507893750 /nfs/dbraw/zinc/89/37/50/507893750.db2.gz OURWDBIULNLVJJ-KRWDZBQOSA-N 1 1 355.442 2.569 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@@H+](CC3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000108423891 507893752 /nfs/dbraw/zinc/89/37/52/507893752.db2.gz OURWDBIULNLVJJ-KRWDZBQOSA-N 1 1 355.442 2.569 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3ncccc3F)CC2)cc1 ZINC000090631108 507931118 /nfs/dbraw/zinc/93/11/18/507931118.db2.gz VHHXTLXFFNDIOA-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO COC(=O)c1cc(NC(=O)CCn2cc[nH+]c2C(C)C)cc([N+](=O)[O-])c1 ZINC000073817179 507959154 /nfs/dbraw/zinc/95/91/54/507959154.db2.gz FWRPMHFYKNMDHN-UHFFFAOYSA-N 1 1 360.370 2.730 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000073842879 507960844 /nfs/dbraw/zinc/96/08/44/507960844.db2.gz ZPKQVKVQTUEMBG-KRWDZBQOSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000091480166 507989022 /nfs/dbraw/zinc/98/90/22/507989022.db2.gz BTDVEAHSDMJCKI-SECBINFHSA-N 1 1 352.192 2.859 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCCCN2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC000079942135 508017969 /nfs/dbraw/zinc/01/79/69/508017969.db2.gz RNADVTYVHLWPIB-UHFFFAOYSA-N 1 1 369.469 3.000 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043075 508036855 /nfs/dbraw/zinc/03/68/55/508036855.db2.gz XPECEGDJMIGYJN-APWZRJJASA-N 1 1 369.469 2.911 20 5 FFBDMO Cc1cc(N[C@H](C[NH+]2CCN(C)CC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000074747188 508052104 /nfs/dbraw/zinc/05/21/04/508052104.db2.gz PNONSQQXPGXJDT-QGZVFWFLSA-N 1 1 355.442 2.699 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000080959061 508117243 /nfs/dbraw/zinc/11/72/43/508117243.db2.gz MEHFGGDUIYGDQQ-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccccc2)C2CCCCC2)c1 ZINC000075645530 508124990 /nfs/dbraw/zinc/12/49/90/508124990.db2.gz BHLQOKVPRBHVKP-LJQANCHMSA-N 1 1 358.442 2.987 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000093280808 508134293 /nfs/dbraw/zinc/13/42/93/508134293.db2.gz NHCORNMBXAXXQY-AWEZNQCLSA-N 1 1 350.415 2.885 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000075861425 508138619 /nfs/dbraw/zinc/13/86/19/508138619.db2.gz KKDFASREYRCHCG-HNNXBMFYSA-N 1 1 359.430 2.951 20 5 FFBDMO COc1ccc(OC)c(C[N@H+](CCO)Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000093361478 508141969 /nfs/dbraw/zinc/14/19/69/508141969.db2.gz CGQJVZAZNJYICZ-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(OC)c(C[N@@H+](CCO)Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000093361478 508141971 /nfs/dbraw/zinc/14/19/71/508141971.db2.gz CGQJVZAZNJYICZ-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000081362236 508167269 /nfs/dbraw/zinc/16/72/69/508167269.db2.gz ZJOOQWLRRVMXFM-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081629862 508198312 /nfs/dbraw/zinc/19/83/12/508198312.db2.gz WWDZHLGMIBQDLG-GDBMZVCRSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081634869 508199990 /nfs/dbraw/zinc/19/99/90/508199990.db2.gz DMQGJGVBLNUVKX-MRXNPFEDSA-N 1 1 360.458 2.505 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)c1 ZINC000076397246 508201007 /nfs/dbraw/zinc/20/10/07/508201007.db2.gz HECLFSSGDQOQGF-HNNXBMFYSA-N 1 1 367.409 2.896 20 5 FFBDMO CC[N@H+](Cc1ccc2c(c1)OCO2)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000104949346 508354592 /nfs/dbraw/zinc/35/45/92/508354592.db2.gz XRERUWQCMMXBSI-INIZCTEOSA-N 1 1 374.393 2.585 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000115275024 508380335 /nfs/dbraw/zinc/38/03/35/508380335.db2.gz UMNYCBWUIJQIEU-DYVFJYSZSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000133526649 508411797 /nfs/dbraw/zinc/41/17/97/508411797.db2.gz LZIJCKFZHPBJIU-OCCSQVGLSA-N 1 1 369.425 2.596 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156442258 508421543 /nfs/dbraw/zinc/42/15/43/508421543.db2.gz CBMLPFOHMIGJCE-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000156442258 508421547 /nfs/dbraw/zinc/42/15/47/508421547.db2.gz CBMLPFOHMIGJCE-ZQIUZPCESA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121859770 508434617 /nfs/dbraw/zinc/43/46/17/508434617.db2.gz YRFMJEAGCWRCAT-HZMBPMFUSA-N 1 1 370.247 2.770 20 5 FFBDMO CC[C@@H](O)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000134478479 508537909 /nfs/dbraw/zinc/53/79/09/508537909.db2.gz OVNRFRIZEVVWSM-MRXNPFEDSA-N 1 1 357.410 2.806 20 5 FFBDMO CC[C@@H](O)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000134478479 508537912 /nfs/dbraw/zinc/53/79/12/508537912.db2.gz OVNRFRIZEVVWSM-MRXNPFEDSA-N 1 1 357.410 2.806 20 5 FFBDMO C[C@H](CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000116748331 508554450 /nfs/dbraw/zinc/55/44/50/508554450.db2.gz VDGOALYDABQWEC-LLVKDONJSA-N 1 1 355.822 2.616 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000157400663 508562296 /nfs/dbraw/zinc/56/22/96/508562296.db2.gz GPWNKSIBRCIGQU-INIZCTEOSA-N 1 1 360.458 2.874 20 5 FFBDMO O=C(CCN1CCC[C@H]([NH+]2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000157400663 508562298 /nfs/dbraw/zinc/56/22/98/508562298.db2.gz GPWNKSIBRCIGQU-INIZCTEOSA-N 1 1 360.458 2.874 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CCC[N@@H+](C)C1 ZINC000153410833 508580929 /nfs/dbraw/zinc/58/09/29/508580929.db2.gz PGAASCZHSOQAEH-YPMHNXCESA-N 1 1 355.822 2.568 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000128387037 508585664 /nfs/dbraw/zinc/58/56/64/508585664.db2.gz HHVHGTCDEPNXNS-KRWDZBQOSA-N 1 1 363.458 2.730 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000128387037 508585668 /nfs/dbraw/zinc/58/56/68/508585668.db2.gz HHVHGTCDEPNXNS-KRWDZBQOSA-N 1 1 363.458 2.730 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000122832758 508593407 /nfs/dbraw/zinc/59/34/07/508593407.db2.gz WSQARMJTRPPPTF-NVXWUHKLSA-N 1 1 374.485 2.752 20 5 FFBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)CCOc1ccccc1 ZINC000117333662 508593825 /nfs/dbraw/zinc/59/38/25/508593825.db2.gz LCDNUAINHSJNSF-UHFFFAOYSA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000123046331 508627465 /nfs/dbraw/zinc/62/74/65/508627465.db2.gz GUHDFIKBSYWFMJ-ZDUSSCGKSA-N 1 1 350.419 2.942 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153825403 508657149 /nfs/dbraw/zinc/65/71/49/508657149.db2.gz WTLIIOIYQAAPKG-LESCRADOSA-N 1 1 363.458 2.645 20 5 FFBDMO Cc1cccn2cc(Cn3cc(Br)cc([N+](=O)[O-])c3=O)[nH+]c12 ZINC000158376707 508695950 /nfs/dbraw/zinc/69/59/50/508695950.db2.gz QPQQSJIRGFNNMU-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000137448781 508756594 /nfs/dbraw/zinc/75/65/94/508756594.db2.gz NUKCPRRANSFZRA-ZBFHGGJFSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000137485009 508758429 /nfs/dbraw/zinc/75/84/29/508758429.db2.gz OEGGFTCSDLVUIT-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159032459 508783312 /nfs/dbraw/zinc/78/33/12/508783312.db2.gz FOGWEPZNRCKSKU-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000124255338 508804675 /nfs/dbraw/zinc/80/46/75/508804675.db2.gz HILGDLKZYURNOK-ZDUSSCGKSA-N 1 1 359.430 2.569 20 5 FFBDMO CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000124255338 508804678 /nfs/dbraw/zinc/80/46/78/508804678.db2.gz HILGDLKZYURNOK-ZDUSSCGKSA-N 1 1 359.430 2.569 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000124255338 508804682 /nfs/dbraw/zinc/80/46/82/508804682.db2.gz HILGDLKZYURNOK-ZDUSSCGKSA-N 1 1 359.430 2.569 20 5 FFBDMO CC[N@H+](CCc1nccs1)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000159406568 508837488 /nfs/dbraw/zinc/83/74/88/508837488.db2.gz QTMMFVNCOJSAKP-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000159406568 508837490 /nfs/dbraw/zinc/83/74/90/508837490.db2.gz QTMMFVNCOJSAKP-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000144837963 508841099 /nfs/dbraw/zinc/84/10/99/508841099.db2.gz HQVBYLSIAWHTOD-JKSUJKDBSA-N 1 1 363.458 2.990 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](C)O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000130830794 508853045 /nfs/dbraw/zinc/85/30/45/508853045.db2.gz CZAUKWQUJQIOFO-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000119836075 508872767 /nfs/dbraw/zinc/87/27/67/508872767.db2.gz OXASXQNBVPQYCI-CQSZACIVSA-N 1 1 351.472 2.781 20 5 FFBDMO CCOc1ccc(C(=O)NCCCNc2ccc(C)c[nH+]2)cc1[N+](=O)[O-] ZINC000119941198 508895085 /nfs/dbraw/zinc/89/50/85/508895085.db2.gz FEHHLHBUFTVLPA-UHFFFAOYSA-N 1 1 358.398 2.929 20 5 FFBDMO C[C@@H]1SCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1c1ccccc1 ZINC000159834302 508898719 /nfs/dbraw/zinc/89/87/19/508898719.db2.gz ZPMWIUJVEGKWOU-KSSFIOAISA-N 1 1 359.451 2.935 20 5 FFBDMO C[N@H+](CCC(=O)OC(C)(C)C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150861443 508909744 /nfs/dbraw/zinc/90/97/44/508909744.db2.gz FZOXQUPNRQPEQN-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO C[N@@H+](CCC(=O)OC(C)(C)C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150861443 508909748 /nfs/dbraw/zinc/90/97/48/508909748.db2.gz FZOXQUPNRQPEQN-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO Cc1c(CC(=O)N2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000160185300 508951167 /nfs/dbraw/zinc/95/11/67/508951167.db2.gz AKCYMHYPEYMDDT-UHFFFAOYSA-N 1 1 367.449 2.833 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CCc2ccccc2)CC1 ZINC000125311978 508963018 /nfs/dbraw/zinc/96/30/18/508963018.db2.gz GTJPDXQZTDVEIW-UHFFFAOYSA-N 1 1 371.412 2.663 20 5 FFBDMO Cc1cccn2cc(Cn3cc(Br)c(=O)c([N+](=O)[O-])c3)[nH+]c12 ZINC000132440953 509032290 /nfs/dbraw/zinc/03/22/90/509032290.db2.gz BJLSYYWKRNFIPP-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704229 509048643 /nfs/dbraw/zinc/04/86/43/509048643.db2.gz TXLLIBZEKBYGHF-HOTGVXAUSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC000120704229 509048646 /nfs/dbraw/zinc/04/86/46/509048646.db2.gz TXLLIBZEKBYGHF-HOTGVXAUSA-N 1 1 365.430 2.677 20 5 FFBDMO Cc1cc([N+](=O)[O-])cn(Cc2cn3cc(Br)ccc3[nH+]2)c1=O ZINC000155790998 509072751 /nfs/dbraw/zinc/07/27/51/509072751.db2.gz ZRSLWINPFLLUDU-UHFFFAOYSA-N 1 1 363.171 2.523 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000371502290 512436901 /nfs/dbraw/zinc/43/69/01/512436901.db2.gz NPLKHZGZDGUJPZ-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@H+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000371502290 512436904 /nfs/dbraw/zinc/43/69/04/512436904.db2.gz NPLKHZGZDGUJPZ-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[N@@H+](Cc3ccccc3C)CC2)c1[N+](=O)[O-] ZINC000371502290 512436906 /nfs/dbraw/zinc/43/69/06/512436906.db2.gz NPLKHZGZDGUJPZ-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000155936507 509095668 /nfs/dbraw/zinc/09/56/68/509095668.db2.gz AVRCFLZANMJSLU-HNNXBMFYSA-N 1 1 364.446 2.868 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000121062915 509120701 /nfs/dbraw/zinc/12/07/01/509120701.db2.gz URQFUOCXNHXYGA-CGTJXYLNSA-N 1 1 364.442 2.614 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCSC1 ZINC000121159434 509141564 /nfs/dbraw/zinc/14/15/64/509141564.db2.gz MRHYOICRBYSOMX-JTQLQIEISA-N 1 1 374.260 2.733 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Br)[C@H]1CCSC1 ZINC000121159434 509141570 /nfs/dbraw/zinc/14/15/70/509141570.db2.gz MRHYOICRBYSOMX-JTQLQIEISA-N 1 1 374.260 2.733 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCC(CO)CC1 ZINC000156279215 509154666 /nfs/dbraw/zinc/15/46/66/509154666.db2.gz NPXCKPKVUPBRCR-UHFFFAOYSA-N 1 1 355.822 2.670 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000179122040 509274434 /nfs/dbraw/zinc/27/44/34/509274434.db2.gz SUMCGIJVVPVERK-CQSZACIVSA-N 1 1 359.382 2.820 20 5 FFBDMO CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000163404593 509372197 /nfs/dbraw/zinc/37/21/97/509372197.db2.gz HYWGBDIMDWKDJE-GOEBONIOSA-N 1 1 371.441 2.626 20 5 FFBDMO Cc1ccc(CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@H]2CCCO2)cc1 ZINC000176271192 509413688 /nfs/dbraw/zinc/41/36/88/509413688.db2.gz WTMXWEBSEFZNSW-SFHVURJKSA-N 1 1 358.442 2.823 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000165697500 509580388 /nfs/dbraw/zinc/58/03/88/509580388.db2.gz BNWQWHDMJDSECA-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2cccc(NCc3csc([N+](=O)[O-])c3)c2)CC1 ZINC000189510255 509610252 /nfs/dbraw/zinc/61/02/52/509610252.db2.gz OQCSKICTKYUKFU-UHFFFAOYSA-N 1 1 374.466 2.933 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000249284625 509647851 /nfs/dbraw/zinc/64/78/51/509647851.db2.gz OWVLWDARAPYHQQ-LRDDRELGSA-N 1 1 351.378 2.563 20 5 FFBDMO COc1cccc([C@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@@H+]2C2CC2)c1 ZINC000183245881 509677469 /nfs/dbraw/zinc/67/74/69/509677469.db2.gz AJAOZHRDTFPTDX-YJBOKZPZSA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cccc([C@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@H+]2C2CC2)c1 ZINC000183245881 509677474 /nfs/dbraw/zinc/67/74/74/509677474.db2.gz AJAOZHRDTFPTDX-YJBOKZPZSA-N 1 1 371.393 2.904 20 5 FFBDMO CC[C@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657213 509687476 /nfs/dbraw/zinc/68/74/76/509687476.db2.gz YLRWNSPIBADPKX-KRWDZBQOSA-N 1 1 353.394 2.547 20 5 FFBDMO Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2C)[NH+]2CCCC2)o1 ZINC000170633834 509688149 /nfs/dbraw/zinc/68/81/49/509688149.db2.gz NOWSPLDOAXQPDO-MRXNPFEDSA-N 1 1 358.398 2.767 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2[C@@H]1CO ZINC000268148578 509782509 /nfs/dbraw/zinc/78/25/09/509782509.db2.gz RCDNBDRGJCQDNL-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268228831 509824756 /nfs/dbraw/zinc/82/47/56/509824756.db2.gz PUFMUXVYOULKAZ-NSHDSACASA-N 1 1 365.821 2.889 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CCS1 ZINC000173930050 509860252 /nfs/dbraw/zinc/86/02/52/509860252.db2.gz JHMPUZOQUCSWAZ-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000183577222 509868732 /nfs/dbraw/zinc/86/87/32/509868732.db2.gz FVZJUZFMECIVEB-UHFFFAOYSA-N 1 1 373.388 2.869 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000183577222 509868742 /nfs/dbraw/zinc/86/87/42/509868742.db2.gz FVZJUZFMECIVEB-UHFFFAOYSA-N 1 1 373.388 2.869 20 5 FFBDMO O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000183601584 509881332 /nfs/dbraw/zinc/88/13/32/509881332.db2.gz FDCQRCNRTCRCCL-HNNXBMFYSA-N 1 1 355.398 2.776 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000186736985 509882726 /nfs/dbraw/zinc/88/27/26/509882726.db2.gz GEPWNNAJJNPUEG-UHFFFAOYSA-N 1 1 363.461 2.707 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1ccco1 ZINC000268387064 509900982 /nfs/dbraw/zinc/90/09/82/509900982.db2.gz PALSNRGLEBIBGX-CQSZACIVSA-N 1 1 366.805 2.943 20 5 FFBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)Cn3cc([N+](=O)[O-])cn3)c2C1 ZINC000171073458 509925172 /nfs/dbraw/zinc/92/51/72/509925172.db2.gz WBPBGXKYOCUFNO-UHFFFAOYSA-N 1 1 357.414 2.792 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000245500036 509968838 /nfs/dbraw/zinc/96/88/38/509968838.db2.gz ZHXQLMQCFRQMBM-OAGGEKHMSA-N 1 1 360.458 2.869 20 5 FFBDMO COC(=O)c1cnc(NCCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000190166494 509981019 /nfs/dbraw/zinc/98/10/19/509981019.db2.gz DPVJBTLAAKNJOY-UHFFFAOYSA-N 1 1 350.419 2.843 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCC[C@H]1O ZINC000245541698 509994147 /nfs/dbraw/zinc/99/41/47/509994147.db2.gz JJWOKJULEMPVBO-IAQYHMDHSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCC[C@H]1O 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/nfs/dbraw/zinc/35/24/05/510352405.db2.gz UIOHIAQFRDTFHP-STQMWFEESA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@H](C)C1 ZINC000266007661 510356004 /nfs/dbraw/zinc/35/60/04/510356004.db2.gz RPEBHYPAAMJZLQ-PBHICJAKSA-N 1 1 358.442 2.738 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000190843227 510370531 /nfs/dbraw/zinc/37/05/31/510370531.db2.gz AWGYBSSFUQGFPQ-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO CCOC(=O)[C@@H](C)[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000190843227 510370538 /nfs/dbraw/zinc/37/05/38/510370538.db2.gz AWGYBSSFUQGFPQ-CYBMUJFWSA-N 1 1 363.414 2.648 20 5 FFBDMO Cc1ccc(CN(CC[NH+](C)C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])o1 ZINC000269380558 510373909 /nfs/dbraw/zinc/37/39/09/510373909.db2.gz JDJYLLDOONQPAY-UHFFFAOYSA-N 1 1 363.418 2.547 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246223358 510374627 /nfs/dbraw/zinc/37/46/27/510374627.db2.gz ZNLPOHWEPJHQSX-UKRRQHHQSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246223358 510374632 /nfs/dbraw/zinc/37/46/32/510374632.db2.gz ZNLPOHWEPJHQSX-UKRRQHHQSA-N 1 1 355.398 2.503 20 5 FFBDMO C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181547894 510465852 /nfs/dbraw/zinc/46/58/52/510465852.db2.gz IWEGGORCUWLMNP-CVEARBPZSA-N 1 1 374.485 2.800 20 5 FFBDMO CC[N@H+]1CC[C@@H]([NH+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477514 /nfs/dbraw/zinc/47/75/14/510477514.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[NH+]1CC[C@@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477519 /nfs/dbraw/zinc/47/75/19/510477519.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[NH+]1CC[C@@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477529 /nfs/dbraw/zinc/47/75/29/510477529.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477534 /nfs/dbraw/zinc/47/75/34/510477534.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477539 /nfs/dbraw/zinc/47/75/39/510477539.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477546 /nfs/dbraw/zinc/47/75/46/510477546.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246415063 510477553 /nfs/dbraw/zinc/47/75/53/510477553.db2.gz BKGBFXCQFXPPOC-GOEBONIOSA-N 1 1 351.447 2.644 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184739964 510492719 /nfs/dbraw/zinc/49/27/19/510492719.db2.gz OCDRJGBDNUCJJZ-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000266343327 510529375 /nfs/dbraw/zinc/52/93/75/510529375.db2.gz AWCDBYRBYPMDGS-ZDUSSCGKSA-N 1 1 369.849 2.817 20 5 FFBDMO COc1cc(C[NH+]2[C@@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000191185418 510538003 /nfs/dbraw/zinc/53/80/03/510538003.db2.gz NCPWLNQCRVUXJP-QWRGUYRKSA-N 1 1 374.384 2.981 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246598984 510576327 /nfs/dbraw/zinc/57/63/27/510576327.db2.gz ABURXHSMVUAFAU-OLZOCXBDSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000172251779 510627827 /nfs/dbraw/zinc/62/78/27/510627827.db2.gz QNFFTWOJJUWXOW-QGZVFWFLSA-N 1 1 360.410 2.613 20 5 FFBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000270126147 510685438 /nfs/dbraw/zinc/68/54/38/510685438.db2.gz GJKQUNLTFUEBGZ-HNNXBMFYSA-N 1 1 354.414 2.614 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000175659781 510718767 /nfs/dbraw/zinc/71/87/67/510718767.db2.gz KXZOTAUSUWAGAG-UHFFFAOYSA-N 1 1 360.389 2.665 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182033560 510722069 /nfs/dbraw/zinc/72/20/69/510722069.db2.gz YBCGXCRPLKEUMI-YOEHRIQHSA-N 1 1 360.410 2.603 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1ccnc1 ZINC000246907321 510738903 /nfs/dbraw/zinc/73/89/03/510738903.db2.gz BLEBKEBRXYASDH-CZUORRHYSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1n1ccnc1 ZINC000246907321 510738914 /nfs/dbraw/zinc/73/89/14/510738914.db2.gz BLEBKEBRXYASDH-CZUORRHYSA-N 1 1 368.397 2.924 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C ZINC000246935940 510754703 /nfs/dbraw/zinc/75/47/03/510754703.db2.gz HIGNNOBBQDMSSD-DNVCBOLYSA-N 1 1 370.453 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C ZINC000246935940 510754707 /nfs/dbraw/zinc/75/47/07/510754707.db2.gz HIGNNOBBQDMSSD-DNVCBOLYSA-N 1 1 370.453 2.999 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000191631179 510760748 /nfs/dbraw/zinc/76/07/48/510760748.db2.gz KUDNIARICWDJDE-OAHLLOKOSA-N 1 1 371.441 2.548 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000191653299 510773925 /nfs/dbraw/zinc/77/39/25/510773925.db2.gz NAUSFVVCWWQOOT-GJZGRUSLSA-N 1 1 360.458 2.904 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000182218920 510818265 /nfs/dbraw/zinc/81/82/65/510818265.db2.gz ZGBYUTOSMVQMKF-KRWDZBQOSA-N 1 1 359.426 2.533 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000247159523 510847080 /nfs/dbraw/zinc/84/70/80/510847080.db2.gz XPCJQVIKZKOTPM-TZMCWYRMSA-N 1 1 373.413 2.506 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)c3csc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000263839674 510852293 /nfs/dbraw/zinc/85/22/93/510852293.db2.gz VRIYENHCXLYMJP-BETUJISGSA-N 1 1 367.471 2.618 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000247216402 510852725 /nfs/dbraw/zinc/85/27/25/510852725.db2.gz CKUCIAZYQPYRRM-NVXWUHKLSA-N 1 1 374.485 2.610 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247382288 510859324 /nfs/dbraw/zinc/85/93/24/510859324.db2.gz LMQMEQIDLOSVLI-RDJZCZTQSA-N 1 1 374.485 2.997 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC000364452917 510874632 /nfs/dbraw/zinc/87/46/32/510874632.db2.gz XPWZHBZQRDAQFE-IBGZPJMESA-N 1 1 353.378 2.569 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC)C1CC1 ZINC000270704498 510956357 /nfs/dbraw/zinc/95/63/57/510956357.db2.gz MRUHEAQHSQQOSI-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000364596109 510960283 /nfs/dbraw/zinc/96/02/83/510960283.db2.gz SBOHYJUTPMTGMV-KRWDZBQOSA-N 1 1 357.435 2.984 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000364596109 510960288 /nfs/dbraw/zinc/96/02/88/510960288.db2.gz SBOHYJUTPMTGMV-KRWDZBQOSA-N 1 1 357.435 2.984 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](N2CCCC2)C[C@@H]1C ZINC000285599107 510972247 /nfs/dbraw/zinc/97/22/47/510972247.db2.gz PLYPOAPZQIIPDX-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](N2CCCC2)C[C@@H]1C ZINC000285599107 510972248 /nfs/dbraw/zinc/97/22/48/510972248.db2.gz PLYPOAPZQIIPDX-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c([N+](=O)[O-])c1 ZINC000297612331 511008409 /nfs/dbraw/zinc/00/84/09/511008409.db2.gz VREYFFQMGFHLGH-CVEARBPZSA-N 1 1 361.442 2.762 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000297702929 511040211 /nfs/dbraw/zinc/04/02/11/511040211.db2.gz AVCIOPUDOSADIB-NVXWUHKLSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000361650748 511074258 /nfs/dbraw/zinc/07/42/58/511074258.db2.gz AVBSYEKDDOJABC-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000282711468 511082039 /nfs/dbraw/zinc/08/20/39/511082039.db2.gz BLXZAXLEKPXSLL-INIZCTEOSA-N 1 1 360.414 2.675 20 5 FFBDMO CCC[NH+]1CCC(N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000294601557 511117588 /nfs/dbraw/zinc/11/75/88/511117588.db2.gz RJRCHFQMGRKVSX-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCCC[C@H]([NH+]3CCCC3)C2)s1 ZINC000271242891 511135621 /nfs/dbraw/zinc/13/56/21/511135621.db2.gz HZKSBFUDEGFQSS-LBPRGKRZSA-N 1 1 373.500 2.515 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1cnccn1 ZINC000271287221 511150607 /nfs/dbraw/zinc/15/06/07/511150607.db2.gz BFLDMCAXWJQZOC-UHFFFAOYSA-N 1 1 353.382 2.757 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccncn3)CC2)c2c(c1)COCO2 ZINC000298039243 511153322 /nfs/dbraw/zinc/15/33/22/511153322.db2.gz DAABOYZIIOPPMN-UHFFFAOYSA-N 1 1 356.382 2.631 20 5 FFBDMO Nc1ncnc2sc3c(c21)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C3 ZINC000362710999 511222870 /nfs/dbraw/zinc/22/28/70/511222870.db2.gz NAZBUVUJHMYIBF-UHFFFAOYSA-N 1 1 355.423 2.783 20 5 FFBDMO Nc1ncnc2sc3c(c21)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C3 ZINC000362710999 511222878 /nfs/dbraw/zinc/22/28/78/511222878.db2.gz NAZBUVUJHMYIBF-UHFFFAOYSA-N 1 1 355.423 2.783 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CCOCC2)C1=O ZINC000365098132 511254975 /nfs/dbraw/zinc/25/49/75/511254975.db2.gz HZVFRJNLKGKLGA-SFHVURJKSA-N 1 1 361.442 2.585 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000298356572 511256638 /nfs/dbraw/zinc/25/66/38/511256638.db2.gz CCRAWWXNKPEJGG-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000291633615 511276365 /nfs/dbraw/zinc/27/63/65/511276365.db2.gz SPYMBJBMXGZFFJ-LVDDQXARSA-N 1 1 371.359 2.999 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271666994 511281436 /nfs/dbraw/zinc/28/14/36/511281436.db2.gz AAYSMLFWHDKBGH-CQSZACIVSA-N 1 1 357.410 2.913 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000298698216 511379519 /nfs/dbraw/zinc/37/95/19/511379519.db2.gz ZSKUUYKHUGMLKW-HOTGVXAUSA-N 1 1 363.414 2.575 20 5 FFBDMO C[NH+](C)Cc1ccnc(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000295438753 511405955 /nfs/dbraw/zinc/40/59/55/511405955.db2.gz XABWDWITEWFXNX-UHFFFAOYSA-N 1 1 356.382 2.653 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000280320138 511419814 /nfs/dbraw/zinc/41/98/14/511419814.db2.gz GYAKVABMSJNYKZ-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000280320138 511419816 /nfs/dbraw/zinc/41/98/16/511419816.db2.gz GYAKVABMSJNYKZ-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](n2cccn2)C1 ZINC000292026539 511436391 /nfs/dbraw/zinc/43/63/91/511436391.db2.gz YQSDMCYUZVXMOC-SWLSCSKDSA-N 1 1 354.370 2.849 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](n2cccn2)C1 ZINC000292026539 511436396 /nfs/dbraw/zinc/43/63/96/511436396.db2.gz YQSDMCYUZVXMOC-SWLSCSKDSA-N 1 1 354.370 2.849 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292058707 511449450 /nfs/dbraw/zinc/44/94/50/511449450.db2.gz BMTHXDYRJZGVAW-HUUCEWRRSA-N 1 1 360.458 2.728 20 5 FFBDMO COc1cccc(CNC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000292067757 511453200 /nfs/dbraw/zinc/45/32/00/511453200.db2.gz DGMPFVMQDCCGGK-UHFFFAOYSA-N 1 1 357.410 2.745 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)c1 ZINC000272179835 511456104 /nfs/dbraw/zinc/45/61/04/511456104.db2.gz CQSUEGDMUYODRY-OAHLLOKOSA-N 1 1 373.461 2.837 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272205176 511464957 /nfs/dbraw/zinc/46/49/57/511464957.db2.gz ZDHMXJJIGPLGPU-DOMZBBRYSA-N 1 1 353.369 2.629 20 5 FFBDMO C[C@H]1CC[S@](=O)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468695 511467568 /nfs/dbraw/zinc/46/75/68/511467568.db2.gz HTBLJPGGTKRUBK-CANCMXDXSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@H]1CC[S@](=O)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468695 511467571 /nfs/dbraw/zinc/46/75/71/511467571.db2.gz HTBLJPGGTKRUBK-CANCMXDXSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000365588061 511545208 /nfs/dbraw/zinc/54/52/08/511545208.db2.gz UENKQNZMYJPZRG-HFTRVMKXSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000284106885 511607368 /nfs/dbraw/zinc/60/73/68/511607368.db2.gz USWYSDZCMAMDCR-UHFFFAOYSA-N 1 1 370.247 2.834 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)n1 ZINC000365841274 511680930 /nfs/dbraw/zinc/68/09/30/511680930.db2.gz AJCSUOJKIJKZOM-UHFFFAOYSA-N 1 1 372.341 2.678 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@@H]2CCn3cc[nH+]c3C2)n1 ZINC000350057281 511710849 /nfs/dbraw/zinc/71/08/49/511710849.db2.gz MHGCNBHXJZBYGR-GFCCVEGCSA-N 1 1 354.370 2.559 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3CCn4cc[nH+]c4C3)n2)ccc1[N+](=O)[O-] ZINC000350182213 511738310 /nfs/dbraw/zinc/73/83/10/511738310.db2.gz KNRLZDZVTMMBAR-GFCCVEGCSA-N 1 1 355.354 2.504 20 5 FFBDMO COc1cccc(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)c1[N+](=O)[O-] ZINC000350346474 511785733 /nfs/dbraw/zinc/78/57/33/511785733.db2.gz ARINAHLAGUCPHW-CXAGYDPISA-N 1 1 360.370 2.579 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000293054527 511822327 /nfs/dbraw/zinc/82/23/27/511822327.db2.gz UEVKTORKJLCGAL-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000293054527 511822332 /nfs/dbraw/zinc/82/23/32/511822332.db2.gz UEVKTORKJLCGAL-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCCN(C)C2 ZINC000293054527 511822338 /nfs/dbraw/zinc/82/23/38/511822338.db2.gz UEVKTORKJLCGAL-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000296881959 511934571 /nfs/dbraw/zinc/93/45/71/511934571.db2.gz XASFSLDDULKVQM-CYBMUJFWSA-N 1 1 371.441 2.787 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839745 511960053 /nfs/dbraw/zinc/96/00/53/511960053.db2.gz LTVBUGPOCDQLMQ-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839745 511960056 /nfs/dbraw/zinc/96/00/56/511960056.db2.gz LTVBUGPOCDQLMQ-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839745 511960060 /nfs/dbraw/zinc/96/00/60/511960060.db2.gz LTVBUGPOCDQLMQ-APWZRJJASA-N 1 1 365.474 2.700 20 5 FFBDMO Cc1c(NC(=O)NC[C@H]2CC[N@H+](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000297099884 512019487 /nfs/dbraw/zinc/01/94/87/512019487.db2.gz MDYSWWYFOJPHBM-SNVBAGLBSA-N 1 1 371.235 2.739 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H](C[N@@H+](C)CC)C1 ZINC000281949058 512022499 /nfs/dbraw/zinc/02/24/99/512022499.db2.gz MBAULVMTEGFRMG-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375757481 512489180 /nfs/dbraw/zinc/48/91/80/512489180.db2.gz JRVCAMASPSGTIP-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375757481 512489182 /nfs/dbraw/zinc/48/91/82/512489182.db2.gz JRVCAMASPSGTIP-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771680 512498740 /nfs/dbraw/zinc/49/87/40/512498740.db2.gz ILLYWIRJUYZEMR-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771680 512498744 /nfs/dbraw/zinc/49/87/44/512498744.db2.gz ILLYWIRJUYZEMR-HUUCEWRRSA-N 1 1 371.441 2.843 20 5 FFBDMO Cn1ccnc1[C@H](NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000367438462 512498966 /nfs/dbraw/zinc/49/89/66/512498966.db2.gz NCVCKZYCPROHEL-GOSISDBHSA-N 1 1 366.425 2.740 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000375774460 512499979 /nfs/dbraw/zinc/49/99/79/512499979.db2.gz PDAYSUHREQTBOI-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000375774460 512499986 /nfs/dbraw/zinc/49/99/86/512499986.db2.gz PDAYSUHREQTBOI-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000373777712 512500330 /nfs/dbraw/zinc/50/03/30/512500330.db2.gz ODGZGHRZCMLRSX-AWEZNQCLSA-N 1 1 357.414 2.521 20 5 FFBDMO O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000367475453 512519680 /nfs/dbraw/zinc/51/96/80/512519680.db2.gz YRPDFPBQXWQPRT-MRXNPFEDSA-N 1 1 370.409 2.844 20 5 FFBDMO CC(C)N1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])c4cnccc43)C2)CC1 ZINC000375867667 512545165 /nfs/dbraw/zinc/54/51/65/512545165.db2.gz DUKXHTOIBZQEEJ-INIZCTEOSA-N 1 1 369.469 2.748 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3ccncn3)C2)c([N+](=O)[O-])c1 ZINC000371785416 512573326 /nfs/dbraw/zinc/57/33/26/512573326.db2.gz MYSMGTHLHUUFHX-AWEZNQCLSA-N 1 1 358.398 2.652 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000374015515 512623876 /nfs/dbraw/zinc/62/38/76/512623876.db2.gz VZJLRBJVHHBXER-IIDMSEBBSA-N 1 1 350.415 2.632 20 5 FFBDMO COc1cc(C[NH2+][C@@H]2CN(C)Cc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000378271391 512668836 /nfs/dbraw/zinc/66/88/36/512668836.db2.gz MQOSPVFFKODGHS-MRXNPFEDSA-N 1 1 357.410 2.888 20 5 FFBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000374169852 512689551 /nfs/dbraw/zinc/68/95/51/512689551.db2.gz GURCWZVDKSGFST-SZXPJGKVSA-N 1 1 361.442 2.795 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(CN2CCc3ccccc32)CC1 ZINC000370044928 512740422 /nfs/dbraw/zinc/74/04/22/512740422.db2.gz IJIWPGKPRDDFDL-UHFFFAOYSA-N 1 1 355.442 2.603 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@H]1C[C@@H](C)O ZINC000411681015 512755536 /nfs/dbraw/zinc/75/55/36/512755536.db2.gz VQHHDLBJNFAFON-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO Cn1ccnc1[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000368137234 512817701 /nfs/dbraw/zinc/81/77/01/512817701.db2.gz YKUHLSSWYYGSMP-NSHDSACASA-N 1 1 352.341 2.919 20 5 FFBDMO O=C(CC[N@H+]1C[C@H](O)C[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000411920926 512875685 /nfs/dbraw/zinc/87/56/85/512875685.db2.gz CUAIMRAAEPBEFY-QAPCUYQASA-N 1 1 355.394 2.731 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000411962556 512891746 /nfs/dbraw/zinc/89/17/46/512891746.db2.gz GNGBBLFFRHSMNA-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO CNc1c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000389892136 512903907 /nfs/dbraw/zinc/90/39/07/512903907.db2.gz WOLVNSRVWOVZMD-YOEHRIQHSA-N 1 1 368.437 2.887 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000389952308 512904123 /nfs/dbraw/zinc/90/41/23/512904123.db2.gz SNMINEUWGIKXND-RDTXWAMCSA-N 1 1 368.437 2.887 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H]2CCCCN12 ZINC000374591076 512906087 /nfs/dbraw/zinc/90/60/87/512906087.db2.gz FYAFROCLMZSBAP-JKSUJKDBSA-N 1 1 372.450 2.961 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000412007404 512909836 /nfs/dbraw/zinc/90/98/36/512909836.db2.gz DLORYHYYJXJGLY-IBGZPJMESA-N 1 1 369.421 2.610 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000376774048 512982156 /nfs/dbraw/zinc/98/21/56/512982156.db2.gz UHRACWOTRBJCEV-UHFFFAOYSA-N 1 1 369.425 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H]3CCCC[C@]32c2ccccc2)c1 ZINC000370706822 513063142 /nfs/dbraw/zinc/06/31/42/513063142.db2.gz FVDFXYLXHBDWBE-QRQLOZEOSA-N 1 1 356.426 2.554 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000370739687 513078712 /nfs/dbraw/zinc/07/87/12/513078712.db2.gz OJBTYIZMKQZFMD-CRAIPNDOSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccncc1 ZINC000370739687 513078713 /nfs/dbraw/zinc/07/87/13/513078713.db2.gz OJBTYIZMKQZFMD-CRAIPNDOSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN(C)c2ncc(C)cc2[N+](=O)[O-])[C@@H]1c1cnn(C)c1 ZINC000433783641 513150679 /nfs/dbraw/zinc/15/06/79/513150679.db2.gz QOBYRAXQBUMTLU-MAUKXSAKSA-N 1 1 372.473 2.941 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000412700784 513232459 /nfs/dbraw/zinc/23/24/59/513232459.db2.gz RHOXXWLQPXTQLS-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000412700784 513232464 /nfs/dbraw/zinc/23/24/64/513232464.db2.gz RHOXXWLQPXTQLS-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412702389 513234745 /nfs/dbraw/zinc/23/47/45/513234745.db2.gz WBUFDIAHKHJSMB-AWEZNQCLSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000412702389 513234752 /nfs/dbraw/zinc/23/47/52/513234752.db2.gz WBUFDIAHKHJSMB-AWEZNQCLSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000429041009 513266293 /nfs/dbraw/zinc/26/62/93/513266293.db2.gz NTDWPAFPWWLPCP-QMYADUOMSA-N 1 1 374.485 2.892 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@]3(CCCc4ccccc43)C2)c1 ZINC000440326304 513294192 /nfs/dbraw/zinc/29/41/92/513294192.db2.gz MGKIUGDNHLQJON-UYAOXDASSA-N 1 1 370.453 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c1C ZINC000440360586 513299846 /nfs/dbraw/zinc/29/98/46/513299846.db2.gz VIDFTBPRAHHZSL-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[C@H](CNc1ncc([N+](=O)[O-])cc1F)[NH+]1CCN(c2ccccc2)CC1 ZINC000413053647 513410465 /nfs/dbraw/zinc/41/04/65/513410465.db2.gz KIOVNSGJWKAKAQ-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO CC(C)N(C)C(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000434832867 513443608 /nfs/dbraw/zinc/44/36/08/513443608.db2.gz TUYXOHKQDSTYKO-UHFFFAOYSA-N 1 1 360.414 2.815 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413137887 513474057 /nfs/dbraw/zinc/47/40/57/513474057.db2.gz OZPMTUCDARHUBI-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@H](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000447828089 513586848 /nfs/dbraw/zinc/58/68/48/513586848.db2.gz DIZUQTZHEPBLQK-INIZCTEOSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000416186864 513632684 /nfs/dbraw/zinc/63/26/84/513632684.db2.gz CKRIHWWIOLAATF-UHFFFAOYSA-N 1 1 365.433 2.928 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000451295871 513659700 /nfs/dbraw/zinc/65/97/00/513659700.db2.gz NVVCKUUEWAAYRI-KRWDZBQOSA-N 1 1 361.442 2.794 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451344440 513690618 /nfs/dbraw/zinc/69/06/18/513690618.db2.gz PQQCJBRYMRLTFB-ZMSDIMECSA-N 1 1 361.442 2.857 20 5 FFBDMO CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])nc1 ZINC000413542715 513706684 /nfs/dbraw/zinc/70/66/84/513706684.db2.gz XEPRKGYGEXKRCX-SJLPKXTDSA-N 1 1 356.426 2.939 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451414734 513734023 /nfs/dbraw/zinc/73/40/23/513734023.db2.gz IVTUBVANNDYIPN-KBAYOESNSA-N 1 1 361.442 2.857 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@H]1C ZINC000451522736 513806236 /nfs/dbraw/zinc/80/62/36/513806236.db2.gz BRHLXPCNNKXSNP-CZUORRHYSA-N 1 1 363.414 2.640 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@H](C)O1 ZINC000436261022 513809243 /nfs/dbraw/zinc/80/92/43/513809243.db2.gz AOVKAFNCMJQEES-PHIMTYICSA-N 1 1 362.352 2.920 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC3CCS(=O)(=O)CC3)C2)cc1 ZINC000451546313 513822896 /nfs/dbraw/zinc/82/28/96/513822896.db2.gz IQDXEMQRDLHFRW-MRXNPFEDSA-N 1 1 352.456 2.599 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)C1CC1 ZINC000436311892 513824142 /nfs/dbraw/zinc/82/41/42/513824142.db2.gz YHKBXGRDDOSLIO-UHFFFAOYSA-N 1 1 353.397 2.644 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCNCC23CCCCC3)cccc1[N+](=O)[O-] ZINC000431100939 513826722 /nfs/dbraw/zinc/82/67/22/513826722.db2.gz WVGSJJWSLWBVKX-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCNCC23CCCCC3)cccc1[N+](=O)[O-] ZINC000431100939 513826727 /nfs/dbraw/zinc/82/67/27/513826727.db2.gz WVGSJJWSLWBVKX-UHFFFAOYSA-N 1 1 360.458 2.840 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451964048 514098458 /nfs/dbraw/zinc/09/84/58/514098458.db2.gz INIZLDDUQJSHHO-YOEHRIQHSA-N 1 1 352.456 2.554 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1c1ccccc1 ZINC000451995125 514120438 /nfs/dbraw/zinc/12/04/38/514120438.db2.gz MYZKLHVLLYCHNQ-QZTJIDSGSA-N 1 1 370.405 2.992 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH2+]Cc3c(C)cccc32)c([N+](=O)[O-])c1 ZINC000420463267 514157703 /nfs/dbraw/zinc/15/77/03/514157703.db2.gz RQRYXWWGNOYLTK-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CCOC(=O)[C@H]1C[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC12COC2 ZINC000449364320 514180338 /nfs/dbraw/zinc/18/03/38/514180338.db2.gz NSSKLQVIDNQGMD-OEXZBZRSSA-N 1 1 360.410 2.510 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2CCC[N@H+]2CCCO)o1 ZINC000449384824 514189675 /nfs/dbraw/zinc/18/96/75/514189675.db2.gz CTVVXXLAWMMDQJ-OAHLLOKOSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)o1 ZINC000449384824 514189676 /nfs/dbraw/zinc/18/96/76/514189676.db2.gz CTVVXXLAWMMDQJ-OAHLLOKOSA-N 1 1 359.426 2.791 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CF)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000449490225 514226874 /nfs/dbraw/zinc/22/68/74/514226874.db2.gz WWIHYDSBOVUQRB-INIZCTEOSA-N 1 1 362.405 2.774 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449558874 514255020 /nfs/dbraw/zinc/25/50/20/514255020.db2.gz XEJBXNAGRUUYSY-MDZRGWNJSA-N 1 1 370.453 2.978 20 5 FFBDMO NC(=O)[C@H]1CCC[N@H+](CCCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300245 514282898 /nfs/dbraw/zinc/28/28/98/514282898.db2.gz ACJRQTGEETXVIU-QFBILLFUSA-N 1 1 374.485 2.539 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417300245 514282906 /nfs/dbraw/zinc/28/29/06/514282906.db2.gz ACJRQTGEETXVIU-QFBILLFUSA-N 1 1 374.485 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](C[C@H]3CCCO3)[C@@H]3CCSC3)nc2c1 ZINC000444664115 514287414 /nfs/dbraw/zinc/28/74/14/514287414.db2.gz PYDVNIYIGHQZCV-ZIAGYGMSSA-N 1 1 362.455 2.958 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](C[C@H]3CCCO3)[C@@H]3CCSC3)nc2c1 ZINC000444664115 514287420 /nfs/dbraw/zinc/28/74/20/514287420.db2.gz PYDVNIYIGHQZCV-ZIAGYGMSSA-N 1 1 362.455 2.958 20 5 FFBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000427799939 514317647 /nfs/dbraw/zinc/31/76/47/514317647.db2.gz RGLYJZIKZXTYEQ-OKILXGFUSA-N 1 1 363.483 2.977 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420574 /nfs/dbraw/zinc/42/05/74/514420574.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000420982042 514420580 /nfs/dbraw/zinc/42/05/80/514420580.db2.gz OKDMCDLRHUWICW-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425621 /nfs/dbraw/zinc/42/56/21/514425621.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 1 1 352.504 2.648 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3csc([N+](=O)[O-])c3)CC2)CC1 ZINC000420986769 514425626 /nfs/dbraw/zinc/42/56/26/514425626.db2.gz YWFMZECFVPZGRF-UHFFFAOYSA-N 1 1 352.504 2.648 20 5 FFBDMO COc1cc(CN(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421006126 514434697 /nfs/dbraw/zinc/43/46/97/514434697.db2.gz PRPLULZHRYVACM-ZDUSSCGKSA-N 1 1 373.400 2.773 20 5 FFBDMO CC[N@H+](Cc1ccc2ccccc2c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000438834955 514451171 /nfs/dbraw/zinc/45/11/71/514451171.db2.gz LHNPKALKALQQMH-LJQANCHMSA-N 1 1 354.410 2.828 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)cc1SC ZINC000458157612 514589386 /nfs/dbraw/zinc/58/93/86/514589386.db2.gz CTJWHIUHRBTCMU-LBPRGKRZSA-N 1 1 367.471 2.787 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C1 ZINC000507960010 514624240 /nfs/dbraw/zinc/62/42/40/514624240.db2.gz BGROCGXWJUYORY-AWEZNQCLSA-N 1 1 358.446 2.558 20 5 FFBDMO Cc1cccc(C)c1NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000489013386 514672792 /nfs/dbraw/zinc/67/27/92/514672792.db2.gz MIMMWHFIJQCQHE-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461796534 514745670 /nfs/dbraw/zinc/74/56/70/514745670.db2.gz OZTYXEAJYXSPGO-AWEZNQCLSA-N 1 1 364.446 2.619 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000479863115 514749972 /nfs/dbraw/zinc/74/99/72/514749972.db2.gz QSAPSEMGYMHRQO-YFHOEESVSA-N 1 1 355.442 2.955 20 5 FFBDMO Cc1cc(N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461946062 514800269 /nfs/dbraw/zinc/80/02/69/514800269.db2.gz LZVZZOHEKYBJTQ-NWDGAFQWSA-N 1 1 361.364 2.813 20 5 FFBDMO CNC(=O)c1ccc(NCC[N@@H+](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000484833149 514810652 /nfs/dbraw/zinc/81/06/52/514810652.db2.gz VVJFVJDFALRSLK-UHFFFAOYSA-N 1 1 360.389 2.637 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000489360379 514816091 /nfs/dbraw/zinc/81/60/91/514816091.db2.gz YHMBILSPDVLMHA-CYBMUJFWSA-N 1 1 357.357 2.608 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000471281329 514824486 /nfs/dbraw/zinc/82/44/86/514824486.db2.gz CWNNANFVGSDXCV-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO Cc1cc(F)cc2c1C[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000502904319 514838769 /nfs/dbraw/zinc/83/87/69/514838769.db2.gz QUZNGXJDQSGGKS-MRXNPFEDSA-N 1 1 360.385 2.840 20 5 FFBDMO Cc1cc(F)cc2c1C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC2 ZINC000502904319 514838775 /nfs/dbraw/zinc/83/87/75/514838775.db2.gz QUZNGXJDQSGGKS-MRXNPFEDSA-N 1 1 360.385 2.840 20 5 FFBDMO COc1c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000475900151 514847613 /nfs/dbraw/zinc/84/76/13/514847613.db2.gz OYVCYQJTCYXUMI-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO Cc1cc(F)cc2c1C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC2 ZINC000502969298 514864020 /nfs/dbraw/zinc/86/40/20/514864020.db2.gz KVCDZLJCCXJGJD-KRWDZBQOSA-N 1 1 360.385 2.840 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000467217806 514943229 /nfs/dbraw/zinc/94/32/29/514943229.db2.gz OOCBKCMOQGXVQZ-CHWSQXEVSA-N 1 1 352.822 2.674 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000467222031 514944295 /nfs/dbraw/zinc/94/42/95/514944295.db2.gz GMIDNMPSLNUMNG-VXGBXAGGSA-N 1 1 354.838 2.872 20 5 FFBDMO COc1c(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476310138 514993934 /nfs/dbraw/zinc/99/39/34/514993934.db2.gz UKMBMLZRWHSLAG-HOCLYGCPSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC[C@@H]1C ZINC000498711319 515036182 /nfs/dbraw/zinc/03/61/82/515036182.db2.gz SYBGJLSVFUIZMJ-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000467552534 515044386 /nfs/dbraw/zinc/04/43/86/515044386.db2.gz XIGFDYLJVCRVGS-SFHVURJKSA-N 1 1 350.415 2.695 20 5 FFBDMO CC[NH+](CC)CCO[C@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490012925 515067610 /nfs/dbraw/zinc/06/76/10/515067610.db2.gz KFNRASDACANNFT-INIZCTEOSA-N 1 1 351.447 2.536 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)[N@@H+](C)C1CC1 ZINC000462482892 515077723 /nfs/dbraw/zinc/07/77/23/515077723.db2.gz BWYSSSZXBBWLEV-CQSZACIVSA-N 1 1 356.426 2.885 20 5 FFBDMO COc1ccc(C(=O)CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000509244658 515089903 /nfs/dbraw/zinc/08/99/03/515089903.db2.gz CYFGLXKLSZTXMF-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1ccc(OCCN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488141 515289436 /nfs/dbraw/zinc/28/94/36/515289436.db2.gz WPIPMWNMYMCHDW-INIZCTEOSA-N 1 1 363.458 2.646 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2nnnn2-c2ccccc2)C2CC2)cc1 ZINC000490804795 515308109 /nfs/dbraw/zinc/30/81/09/515308109.db2.gz VHTZBUUFOFMVBX-UHFFFAOYSA-N 1 1 364.409 2.778 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000468457144 515366488 /nfs/dbraw/zinc/36/64/88/515366488.db2.gz BEAGTLGPMIEZGY-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468719588 515486035 /nfs/dbraw/zinc/48/60/35/515486035.db2.gz ZQLILVZMXYAMEH-HNNXBMFYSA-N 1 1 369.487 2.921 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468719588 515486043 /nfs/dbraw/zinc/48/60/43/515486043.db2.gz ZQLILVZMXYAMEH-HNNXBMFYSA-N 1 1 369.487 2.921 20 5 FFBDMO CCN(CC)C(=O)C1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000463525187 515535568 /nfs/dbraw/zinc/53/55/68/515535568.db2.gz KZPNQBISQYGTPM-UHFFFAOYSA-N 1 1 367.421 2.823 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](C(=O)NCC3CC3)C2)ccc1[N+](=O)[O-] ZINC000492565954 515545526 /nfs/dbraw/zinc/54/55/26/515545526.db2.gz XZEQYQMWRNMFOJ-INIZCTEOSA-N 1 1 361.442 2.732 20 5 FFBDMO COc1cc(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)cc([N+](=O)[O-])c1C ZINC000477792639 515593466 /nfs/dbraw/zinc/59/34/66/515593466.db2.gz MWMKSENEHIBPMA-UHFFFAOYSA-N 1 1 370.409 2.578 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454612312 515609856 /nfs/dbraw/zinc/60/98/56/515609856.db2.gz SBFFSROQUSZAHV-NVXWUHKLSA-N 1 1 372.469 2.968 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493443512 515633791 /nfs/dbraw/zinc/63/37/91/515633791.db2.gz SONUSNUPBNTFTP-STQMWFEESA-N 1 1 369.849 2.611 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)cc1OC ZINC000457126158 515671768 /nfs/dbraw/zinc/67/17/68/515671768.db2.gz QWVMSBPRLXUMKT-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)C1CC1 ZINC000457176776 515707002 /nfs/dbraw/zinc/70/70/02/515707002.db2.gz ZMASCUSIUWTRJT-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000505883475 515709795 /nfs/dbraw/zinc/70/97/95/515709795.db2.gz BFEYTXPFHDOBOS-UHFFFAOYSA-N 1 1 371.441 2.879 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494070185 515726934 /nfs/dbraw/zinc/72/69/34/515726934.db2.gz VOEDGIWECGYNNV-BEFAXECRSA-N 1 1 353.422 2.917 20 5 FFBDMO C[N@H+](Cc1cccc2[nH]ccc21)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000494110027 515736903 /nfs/dbraw/zinc/73/69/03/515736903.db2.gz YFKVCCIPFNHOSM-OAHLLOKOSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000500571811 515775293 /nfs/dbraw/zinc/77/52/93/515775293.db2.gz SXQRWWWCLTVITI-UHFFFAOYSA-N 1 1 368.437 2.663 20 5 FFBDMO Cn1ccnc1[C@H](NCC[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000459734831 515778094 /nfs/dbraw/zinc/77/80/94/515778094.db2.gz OPIITLSDFBKUCH-CRAIPNDOSA-N 1 1 357.458 2.739 20 5 FFBDMO C[C@@H]1CN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[C@H](C)[N@@H+]1C ZINC000454902132 515821492 /nfs/dbraw/zinc/82/14/92/515821492.db2.gz YVHTZTMQEWOEKQ-PHIMTYICSA-N 1 1 374.363 2.848 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459818740 515827105 /nfs/dbraw/zinc/82/71/05/515827105.db2.gz YNLACTPQWUMUCG-QWHCGFSZSA-N 1 1 365.430 2.831 20 5 FFBDMO COC(C)(C)CC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000469766356 515955581 /nfs/dbraw/zinc/95/55/81/515955581.db2.gz BTPUMZFBSVYPJM-UHFFFAOYSA-N 1 1 361.446 2.798 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]2COCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853992 515990614 /nfs/dbraw/zinc/99/06/14/515990614.db2.gz PEPATMYMOLUVQB-FZMZJTMJSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853992 515990620 /nfs/dbraw/zinc/99/06/20/515990620.db2.gz PEPATMYMOLUVQB-FZMZJTMJSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000469874520 516010037 /nfs/dbraw/zinc/01/00/37/516010037.db2.gz WEWWGSQXOZJVOD-CQSZACIVSA-N 1 1 361.423 2.535 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])o1 ZINC000469874520 516010046 /nfs/dbraw/zinc/01/00/46/516010046.db2.gz WEWWGSQXOZJVOD-CQSZACIVSA-N 1 1 361.423 2.535 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000469997508 516067672 /nfs/dbraw/zinc/06/76/72/516067672.db2.gz ZYKKEKUDSOQWOE-DOMZBBRYSA-N 1 1 359.382 2.676 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000470156395 516150878 /nfs/dbraw/zinc/15/08/78/516150878.db2.gz OCHBPYOYMJQIIJ-XCRHUMRWSA-N 1 1 355.394 2.941 20 5 FFBDMO Cc1c(CNC(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000479325371 516150892 /nfs/dbraw/zinc/15/08/92/516150892.db2.gz SQTHZVHFRLBKDS-KRWDZBQOSA-N 1 1 360.458 2.967 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000512118136 516160051 /nfs/dbraw/zinc/16/00/51/516160051.db2.gz GNSNPHMBQWVICG-RYUDHWBXSA-N 1 1 367.833 2.782 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1CCOC ZINC000501605859 516168888 /nfs/dbraw/zinc/16/88/88/516168888.db2.gz WHIQCRWGLNZPDC-CQSZACIVSA-N 1 1 374.441 2.649 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000512145601 516173051 /nfs/dbraw/zinc/17/30/51/516173051.db2.gz CWBIPWJEJFECSG-UHFFFAOYSA-N 1 1 370.453 2.911 20 5 FFBDMO Cc1ccc2c(c1)C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CCO2 ZINC000512279937 516221683 /nfs/dbraw/zinc/22/16/83/516221683.db2.gz VHGJAKCUPQLZDH-INIZCTEOSA-N 1 1 358.394 2.538 20 5 FFBDMO Cc1ccc2c(c1)C[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CCO2 ZINC000512279937 516221693 /nfs/dbraw/zinc/22/16/93/516221693.db2.gz VHGJAKCUPQLZDH-INIZCTEOSA-N 1 1 358.394 2.538 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCN4C(=O)CC[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000512433321 516276456 /nfs/dbraw/zinc/27/64/56/516276456.db2.gz LAJXTYOPPWHTIE-CYBMUJFWSA-N 1 1 371.393 2.670 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCN4C(=O)CC[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000512433321 516276462 /nfs/dbraw/zinc/27/64/62/516276462.db2.gz LAJXTYOPPWHTIE-CYBMUJFWSA-N 1 1 371.393 2.670 20 5 FFBDMO COC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000488748788 516300300 /nfs/dbraw/zinc/30/03/00/516300300.db2.gz HORQCXVJBQHLFO-PBFPGSCMSA-N 1 1 361.442 2.856 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000512574597 516307578 /nfs/dbraw/zinc/30/75/78/516307578.db2.gz ZAEZSDLATSHWLK-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)c1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497536684 516325677 /nfs/dbraw/zinc/32/56/77/516325677.db2.gz XLKPVBAAYNWBOW-UHFFFAOYSA-N 1 1 369.487 2.699 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000557628677 516345742 /nfs/dbraw/zinc/34/57/42/516345742.db2.gz LTJOOEAHGKRWOL-HNNXBMFYSA-N 1 1 361.442 2.858 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1 ZINC000543674669 516358390 /nfs/dbraw/zinc/35/83/90/516358390.db2.gz HQBZFOSZZUWLNW-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO COc1ccccc1/C=C/C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785775 516509390 /nfs/dbraw/zinc/50/93/90/516509390.db2.gz FGHAAHKIUMZEND-GQCTYLIASA-N 1 1 354.410 2.834 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCc2ccccc2C1 ZINC000547742957 516534572 /nfs/dbraw/zinc/53/45/72/516534572.db2.gz UJKYCHNSUSMCHJ-UHFFFAOYSA-N 1 1 365.433 2.928 20 5 FFBDMO NC(=O)c1cccc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000561349496 516535212 /nfs/dbraw/zinc/53/52/12/516535212.db2.gz TVBFCBKKMMHZHE-CYBMUJFWSA-N 1 1 369.425 2.611 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@@H](C)C1 ZINC000558022813 516555036 /nfs/dbraw/zinc/55/50/36/516555036.db2.gz JOASVHSDNGZAEJ-VEVIJQCQSA-N 1 1 356.426 2.878 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000558025805 516555109 /nfs/dbraw/zinc/55/51/09/516555109.db2.gz PJABPCLXYPXXEH-YQQAZPJKSA-N 1 1 361.442 2.552 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1cccc2nsnc21)c1ccccc1[N+](=O)[O-] ZINC000540480108 516575203 /nfs/dbraw/zinc/57/52/03/516575203.db2.gz GNLFROQAUINNSM-SNVBAGLBSA-N 1 1 357.395 2.889 20 5 FFBDMO COC(=O)c1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000540479066 516576035 /nfs/dbraw/zinc/57/60/35/516576035.db2.gz TVFHLFRXYICHSN-GFCCVEGCSA-N 1 1 357.366 2.671 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000554699308 516593231 /nfs/dbraw/zinc/59/32/31/516593231.db2.gz BWJWVVBPLNDRLV-JSGCOSHPSA-N 1 1 371.441 2.543 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000536034256 516600214 /nfs/dbraw/zinc/60/02/14/516600214.db2.gz FISZDKFCPAJYGS-QGZVFWFLSA-N 1 1 354.410 2.700 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000536034256 516600220 /nfs/dbraw/zinc/60/02/20/516600220.db2.gz FISZDKFCPAJYGS-QGZVFWFLSA-N 1 1 354.410 2.700 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2nccn2C)C1 ZINC000536068649 516618421 /nfs/dbraw/zinc/61/84/21/516618421.db2.gz JUBXDXLFSWZBIR-OCCSQVGLSA-N 1 1 368.397 2.929 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000513673359 516716169 /nfs/dbraw/zinc/71/61/69/516716169.db2.gz PUOKRVARJQLPHZ-GOSISDBHSA-N 1 1 352.394 2.956 20 5 FFBDMO Cc1cc(C)n(CCC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)n1 ZINC000513763244 516744975 /nfs/dbraw/zinc/74/49/75/516744975.db2.gz WGCXOVQGSVLOLR-SFHVURJKSA-N 1 1 368.441 2.911 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000524879798 516857110 /nfs/dbraw/zinc/85/71/10/516857110.db2.gz UGVOEKONXGITFT-GDBMZVCRSA-N 1 1 371.441 2.725 20 5 FFBDMO CC[C@@H](C)[C@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847118 516957253 /nfs/dbraw/zinc/95/72/53/516957253.db2.gz RWTLQNRVAJETRE-RDTXWAMCSA-N 1 1 370.457 2.825 20 5 FFBDMO CC[C@@H](C)[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847118 516957260 /nfs/dbraw/zinc/95/72/60/516957260.db2.gz RWTLQNRVAJETRE-RDTXWAMCSA-N 1 1 370.457 2.825 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1)CC(C)C ZINC000536921822 516981318 /nfs/dbraw/zinc/98/13/18/516981318.db2.gz UTJBVFSMIGXJOZ-UHFFFAOYSA-N 1 1 365.478 2.549 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000525355611 517016192 /nfs/dbraw/zinc/01/61/92/517016192.db2.gz YVIFRGISLGHPTJ-SFHVURJKSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCOc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000537178000 517067887 /nfs/dbraw/zinc/06/78/87/517067887.db2.gz IEHBTZUASBZURF-CYBMUJFWSA-N 1 1 361.373 2.580 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC=C(c2ccccn2)C1 ZINC000519682496 517120766 /nfs/dbraw/zinc/12/07/66/517120766.db2.gz YDIXBZBCYZTNID-MRXNPFEDSA-N 1 1 355.394 2.519 20 5 FFBDMO Cc1c(Br)c(NCC[N@H+]2CCC[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000541576983 517122162 /nfs/dbraw/zinc/12/21/62/517122162.db2.gz YKHBDJXPEWECHF-JTQLQIEISA-N 1 1 357.252 2.626 20 5 FFBDMO Cc1c(Br)c(NCC[N@@H+]2CCC[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000541576983 517122172 /nfs/dbraw/zinc/12/21/72/517122172.db2.gz YKHBDJXPEWECHF-JTQLQIEISA-N 1 1 357.252 2.626 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@@H+](C)[C@H]2c2cnn(C)c2)n1 ZINC000548675753 517138046 /nfs/dbraw/zinc/13/80/46/517138046.db2.gz ACRNYUVNBJRZJB-MAUKXSAKSA-N 1 1 372.473 2.859 20 5 FFBDMO C[NH+](C)C1(CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCCCCC1 ZINC000519889792 517232960 /nfs/dbraw/zinc/23/29/60/517232960.db2.gz MYEOAYFDKWDKFG-UHFFFAOYSA-N 1 1 373.450 2.667 20 5 FFBDMO CC(C)(C)OCCCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000559450094 517263433 /nfs/dbraw/zinc/26/34/33/517263433.db2.gz LGOJFUXXKMZZLB-UHFFFAOYSA-N 1 1 363.458 2.948 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000520059492 517266844 /nfs/dbraw/zinc/26/68/44/517266844.db2.gz FDEHXLHNQQQICU-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO Cc1cccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000533056428 517272070 /nfs/dbraw/zinc/27/20/70/517272070.db2.gz OSYCCSQBRTYLKY-GOEBONIOSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1cccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000533056428 517272082 /nfs/dbraw/zinc/27/20/82/517272082.db2.gz OSYCCSQBRTYLKY-GOEBONIOSA-N 1 1 369.425 2.812 20 5 FFBDMO CN1CC[N@H+](C)C[C@@H]1c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000545789222 517367083 /nfs/dbraw/zinc/36/70/83/517367083.db2.gz VSOWPWLGQCUPPZ-GFCCVEGCSA-N 1 1 359.411 2.778 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000545789222 517367095 /nfs/dbraw/zinc/36/70/95/517367095.db2.gz VSOWPWLGQCUPPZ-GFCCVEGCSA-N 1 1 359.411 2.778 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH+](CCC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000515721693 517457888 /nfs/dbraw/zinc/45/78/88/517457888.db2.gz GOHMGBXIWKKIRO-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO COc1ccc2c(c1)CCC[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC000542279882 517481436 /nfs/dbraw/zinc/48/14/36/517481436.db2.gz QDAYJDITHJLBBI-QGZVFWFLSA-N 1 1 372.421 2.792 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000538378997 517595611 /nfs/dbraw/zinc/59/56/11/517595611.db2.gz PYKSHFZBBIKQOT-LJQANCHMSA-N 1 1 371.437 2.971 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553457 517614537 /nfs/dbraw/zinc/61/45/37/517614537.db2.gz BDTFBUOTBGYNOP-WMLDXEAASA-N 1 1 351.447 2.527 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553457 517614543 /nfs/dbraw/zinc/61/45/43/517614543.db2.gz BDTFBUOTBGYNOP-WMLDXEAASA-N 1 1 351.447 2.527 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000521131644 517623649 /nfs/dbraw/zinc/62/36/49/517623649.db2.gz NAOIWFIXPCXQNJ-KRWDZBQOSA-N 1 1 369.421 2.884 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556874431 517721075 /nfs/dbraw/zinc/72/10/75/517721075.db2.gz JUNQNMJRQSMPFS-CRAIPNDOSA-N 1 1 357.458 2.882 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C[C@H]2C)cc1OC ZINC000530361342 517727737 /nfs/dbraw/zinc/72/77/37/517727737.db2.gz VNASMJWGDKDPJW-GUTXKFCHSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C[C@H]2C)cc1OC ZINC000530361342 517727746 /nfs/dbraw/zinc/72/77/46/517727746.db2.gz VNASMJWGDKDPJW-GUTXKFCHSA-N 1 1 352.431 2.983 20 5 FFBDMO CC(=O)NCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCSCC1 ZINC000549852310 517745923 /nfs/dbraw/zinc/74/59/23/517745923.db2.gz ILDRDNHRGISRTI-GQCTYLIASA-N 1 1 363.483 2.942 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)CC2 ZINC000553534844 517769415 /nfs/dbraw/zinc/76/94/15/517769415.db2.gz QPKJFQKWDNFVHT-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO CCCCO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C ZINC000534178483 517773991 /nfs/dbraw/zinc/77/39/91/517773991.db2.gz VBGXZRHKKNXPOD-HOTGVXAUSA-N 1 1 351.447 2.672 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000516623378 517774592 /nfs/dbraw/zinc/77/45/92/517774592.db2.gz LMBOFUVLFJHPMG-IUODEOHRSA-N 1 1 372.400 2.881 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000542852641 517781495 /nfs/dbraw/zinc/78/14/95/517781495.db2.gz OBYWXDDGLPDZIY-ONGXEEELSA-N 1 1 355.341 2.551 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2C2CCCCC2)n1 ZINC000553562094 517784458 /nfs/dbraw/zinc/78/44/58/517784458.db2.gz SBZMEBPUVWCDHA-AWEZNQCLSA-N 1 1 362.430 2.985 20 5 FFBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000534271728 517818545 /nfs/dbraw/zinc/81/85/45/517818545.db2.gz FWVCYQSBLAGEMP-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO COc1c(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000557164073 517894727 /nfs/dbraw/zinc/89/47/27/517894727.db2.gz JCWQHRDWPPLZBJ-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO CC[N@@H+](CCc1cccs1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543131972 517923760 /nfs/dbraw/zinc/92/37/60/517923760.db2.gz IJZAQXCSVYPLSI-CQSZACIVSA-N 1 1 350.440 2.961 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000543178712 517950569 /nfs/dbraw/zinc/95/05/69/517950569.db2.gz UVNUFBKLQTUPNF-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000543178712 517950581 /nfs/dbraw/zinc/95/05/81/517950581.db2.gz UVNUFBKLQTUPNF-QGZVFWFLSA-N 1 1 370.409 2.589 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000534768880 518027314 /nfs/dbraw/zinc/02/73/14/518027314.db2.gz LUYJYNDOGYSKRB-SFHVURJKSA-N 1 1 368.437 2.561 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2CCc2ccccc2)c1 ZINC000534863440 518062251 /nfs/dbraw/zinc/06/22/51/518062251.db2.gz GBJGMYMBMSWLBS-PKOBYXMFSA-N 1 1 358.442 2.640 20 5 FFBDMO CC[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cn1 ZINC000543596098 518149254 /nfs/dbraw/zinc/14/92/54/518149254.db2.gz YNPSHAHLTSSFKB-HNNXBMFYSA-N 1 1 367.402 2.644 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000581426437 518280814 /nfs/dbraw/zinc/28/08/14/518280814.db2.gz SUPROCQQYPAXLW-UHFFFAOYSA-N 1 1 356.430 2.683 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000566967040 518288530 /nfs/dbraw/zinc/28/85/30/518288530.db2.gz MJBPIJRDXNYIAF-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000566967040 518288532 /nfs/dbraw/zinc/28/85/32/518288532.db2.gz MJBPIJRDXNYIAF-ZFWWWQNUSA-N 1 1 370.409 2.815 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000567084613 518344636 /nfs/dbraw/zinc/34/46/36/518344636.db2.gz FBMJHJKUDBZCLJ-OAHLLOKOSA-N 1 1 373.457 2.744 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000576082152 518418451 /nfs/dbraw/zinc/41/84/51/518418451.db2.gz CQBICGSREIFXAW-OAHLLOKOSA-N 1 1 356.426 2.527 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000581850866 518466626 /nfs/dbraw/zinc/46/66/26/518466626.db2.gz LNDZOAFXAZPBFU-MRXNPFEDSA-N 1 1 354.410 2.832 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000581850866 518466635 /nfs/dbraw/zinc/46/66/35/518466635.db2.gz LNDZOAFXAZPBFU-MRXNPFEDSA-N 1 1 354.410 2.832 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000579035611 518489335 /nfs/dbraw/zinc/48/93/35/518489335.db2.gz AEMZLPXIYYGBTG-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000579035611 518489340 /nfs/dbraw/zinc/48/93/40/518489340.db2.gz AEMZLPXIYYGBTG-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000579055832 518497702 /nfs/dbraw/zinc/49/77/02/518497702.db2.gz ONJRBUBUAYKKEE-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000582428166 518749008 /nfs/dbraw/zinc/74/90/08/518749008.db2.gz BQIXPGJXNITDFR-OAHLLOKOSA-N 1 1 351.834 2.985 20 5 FFBDMO COc1ccc(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000568011346 518830250 /nfs/dbraw/zinc/83/02/50/518830250.db2.gz KRGYYRBKQUGOSU-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO CN1CCC[N@@H+](CCCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309950 518893993 /nfs/dbraw/zinc/89/39/93/518893993.db2.gz PYTBIBVESZEQTC-MRXNPFEDSA-N 1 1 374.407 2.815 20 5 FFBDMO C[N@@H+]1CCCN(CCCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309950 518893998 /nfs/dbraw/zinc/89/39/98/518893998.db2.gz PYTBIBVESZEQTC-MRXNPFEDSA-N 1 1 374.407 2.815 20 5 FFBDMO C[N@H+]1CCCN(CCCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309950 518894004 /nfs/dbraw/zinc/89/40/04/518894004.db2.gz PYTBIBVESZEQTC-MRXNPFEDSA-N 1 1 374.407 2.815 20 5 FFBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000589195500 518947857 /nfs/dbraw/zinc/94/78/57/518947857.db2.gz APUHAJUTOSPKKB-WPGJWXSHSA-N 1 1 358.486 2.708 20 5 FFBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000589195500 518947862 /nfs/dbraw/zinc/94/78/62/518947862.db2.gz APUHAJUTOSPKKB-WPGJWXSHSA-N 1 1 358.486 2.708 20 5 FFBDMO C[C@H]1CC[C@@H]([N@@H+](CCO)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000589261245 518967005 /nfs/dbraw/zinc/96/70/05/518967005.db2.gz IXUGASHZOAICMV-WCQYABFASA-N 1 1 355.822 2.670 20 5 FFBDMO CCc1nocc1C[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000577234593 518980473 /nfs/dbraw/zinc/98/04/73/518980473.db2.gz PHXWEKQSQQKXGX-UHFFFAOYSA-N 1 1 360.370 2.575 20 5 FFBDMO Cc1cc(CNc2ncnc3ccc([N+](=O)[O-])cc32)cc(N2CCCC2)[nH+]1 ZINC000589604150 519039256 /nfs/dbraw/zinc/03/92/56/519039256.db2.gz TVSONYNIFYBOJU-UHFFFAOYSA-N 1 1 364.409 2.876 20 5 FFBDMO CC(C)(C)c1nnc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])s1 ZINC000577364958 519044846 /nfs/dbraw/zinc/04/48/46/519044846.db2.gz KMOKJAJERJKZJZ-UHFFFAOYSA-N 1 1 363.443 2.862 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000577393785 519059700 /nfs/dbraw/zinc/05/97/00/519059700.db2.gz YXRDAJFAJPKORF-HKUYNNGSSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000577393785 519059712 /nfs/dbraw/zinc/05/97/12/519059712.db2.gz YXRDAJFAJPKORF-HKUYNNGSSA-N 1 1 360.385 2.905 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000590014363 519130118 /nfs/dbraw/zinc/13/01/18/519130118.db2.gz BSRIDNIQDJWCMW-SJCJKPOMSA-N 1 1 367.833 2.570 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])CC1 ZINC000590575388 519271514 /nfs/dbraw/zinc/27/15/14/519271514.db2.gz XWKYMYUEXQFFMA-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000590602699 519285920 /nfs/dbraw/zinc/28/59/20/519285920.db2.gz VTQMLTRXAQRLKZ-WBVHZDCISA-N 1 1 357.410 2.609 20 5 FFBDMO CN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000580899206 519416834 /nfs/dbraw/zinc/41/68/34/519416834.db2.gz YYUPMAPCIXPLLM-QGZVFWFLSA-N 1 1 368.441 2.861 20 5 FFBDMO Cc1cccc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)c1[N+](=O)[O-] ZINC000569392200 519526389 /nfs/dbraw/zinc/52/63/89/519526389.db2.gz YJKCKOAZQJSEFB-MRXNPFEDSA-N 1 1 355.394 2.722 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000566632840 519588312 /nfs/dbraw/zinc/58/83/12/519588312.db2.gz RBUCQLIVSOAPPJ-QFBILLFUSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000566632840 519588318 /nfs/dbraw/zinc/58/83/18/519588318.db2.gz RBUCQLIVSOAPPJ-QFBILLFUSA-N 1 1 360.385 2.905 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C(C)(C)C ZINC000602874769 519942364 /nfs/dbraw/zinc/94/23/64/519942364.db2.gz UABWTCUHCJXNSR-HNNXBMFYSA-N 1 1 368.865 2.849 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594485148 519994418 /nfs/dbraw/zinc/99/44/18/519994418.db2.gz XJZYGDVAOOVVMP-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO CCn1ccc(C[N@@H+](C)CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)c1 ZINC000616786049 520139038 /nfs/dbraw/zinc/13/90/38/520139038.db2.gz AYHFZJXBCGLYIA-UHFFFAOYSA-N 1 1 358.398 2.846 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600227766 520139536 /nfs/dbraw/zinc/13/95/36/520139536.db2.gz GBOLPAFDAJEUHA-INIZCTEOSA-N 1 1 361.442 2.887 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1 ZINC000597717013 520193945 /nfs/dbraw/zinc/19/39/45/520193945.db2.gz VZQPRRDMMRVYAW-IBGZPJMESA-N 1 1 361.442 2.616 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000600311643 520198890 /nfs/dbraw/zinc/19/88/90/520198890.db2.gz BSXFWBURUHXYSU-ZDUSSCGKSA-N 1 1 351.422 2.860 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609144567 520206515 /nfs/dbraw/zinc/20/65/15/520206515.db2.gz SFZFMBQSAMGZFH-UHFFFAOYSA-N 1 1 363.311 2.624 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000603402038 520249507 /nfs/dbraw/zinc/24/95/07/520249507.db2.gz LSHBFUXXDUYSOV-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C(C)C)N1CCN(C)CC1 ZINC000595007481 520255182 /nfs/dbraw/zinc/25/51/82/520255182.db2.gz OEVJQLGTRDBTIL-QAPCUYQASA-N 1 1 364.490 2.526 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1c[nH+]ccc1-n1cccn1 ZINC000609285601 520258679 /nfs/dbraw/zinc/25/86/79/520258679.db2.gz PFVDQAKNAYPAHY-UHFFFAOYSA-N 1 1 355.379 2.906 20 5 FFBDMO Cn1ccnc1[C@@H](N[C@H]1CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595056352 520271902 /nfs/dbraw/zinc/27/19/02/520271902.db2.gz FOPMTLYOKMYXIM-RDJZCZTQSA-N 1 1 357.458 2.880 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000603601896 520323240 /nfs/dbraw/zinc/32/32/40/520323240.db2.gz KOQPSHPOUZIXMK-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000597925413 520326407 /nfs/dbraw/zinc/32/64/07/520326407.db2.gz ORVKVVCCVSRKJT-OAHLLOKOSA-N 1 1 360.458 2.798 20 5 FFBDMO O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000609530083 520343957 /nfs/dbraw/zinc/34/39/57/520343957.db2.gz OKYWTZRLKYTFHL-MQVJKMGUSA-N 1 1 354.410 2.848 20 5 FFBDMO C[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCCC[C@@H]1C ZINC000609547792 520353883 /nfs/dbraw/zinc/35/38/83/520353883.db2.gz JIPGANJFJUELJK-QWHCGFSZSA-N 1 1 372.425 2.841 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613178953 520371631 /nfs/dbraw/zinc/37/16/31/520371631.db2.gz HSMKOGJDEFINDG-INIZCTEOSA-N 1 1 354.410 2.801 20 5 FFBDMO CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598040545 520389635 /nfs/dbraw/zinc/38/96/35/520389635.db2.gz HTNPBLQEPSNTMB-JSGCOSHPSA-N 1 1 369.849 2.958 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000609674922 520403169 /nfs/dbraw/zinc/40/31/69/520403169.db2.gz XNXKJMVRBOHLRV-HNNXBMFYSA-N 1 1 369.487 2.836 20 5 FFBDMO CC(C)(C)CC(=O)N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000604012228 520426254 /nfs/dbraw/zinc/42/62/54/520426254.db2.gz PDIDURODQRBBHW-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO CN(CC(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000598218092 520499795 /nfs/dbraw/zinc/49/97/95/520499795.db2.gz FPAVQWJHJZGKTC-OAHLLOKOSA-N 1 1 360.458 2.554 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000595505870 520516845 /nfs/dbraw/zinc/51/68/45/520516845.db2.gz ZQWBRMRLMOWWPA-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@@]2(CC[N@H+](C)C2)C1 ZINC000595505870 520516853 /nfs/dbraw/zinc/51/68/53/520516853.db2.gz ZQWBRMRLMOWWPA-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000595505870 520516861 /nfs/dbraw/zinc/51/68/61/520516861.db2.gz ZQWBRMRLMOWWPA-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@]2(CCN(C)C2)C1 ZINC000595505870 520516871 /nfs/dbraw/zinc/51/68/71/520516871.db2.gz ZQWBRMRLMOWWPA-IBGZPJMESA-N 1 1 360.458 2.650 20 5 FFBDMO CC(C)(C)n1nnc(CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000595526506 520529624 /nfs/dbraw/zinc/52/96/24/520529624.db2.gz SRUVJHCDENZRAJ-HNNXBMFYSA-N 1 1 358.446 2.758 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000598367641 520575186 /nfs/dbraw/zinc/57/51/86/520575186.db2.gz VPKGJQNKIROOAR-QZTJIDSGSA-N 1 1 373.453 2.585 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000604535024 520593471 /nfs/dbraw/zinc/59/34/71/520593471.db2.gz PBQLIZKSJCUWGX-KRWDZBQOSA-N 1 1 354.410 2.518 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc21 ZINC000595618810 520597209 /nfs/dbraw/zinc/59/72/09/520597209.db2.gz RXKTWPNQMHRTRX-QGZVFWFLSA-N 1 1 372.425 2.732 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc21 ZINC000595618810 520597215 /nfs/dbraw/zinc/59/72/15/520597215.db2.gz RXKTWPNQMHRTRX-QGZVFWFLSA-N 1 1 372.425 2.732 20 5 FFBDMO CCCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000592830160 520606808 /nfs/dbraw/zinc/60/68/08/520606808.db2.gz COLRQHFXJKYWED-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000592881333 520631743 /nfs/dbraw/zinc/63/17/43/520631743.db2.gz MFEZYFQMCTWRIT-PBHICJAKSA-N 1 1 357.385 2.809 20 5 FFBDMO Cc1nccnc1N1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000601159263 520665820 /nfs/dbraw/zinc/66/58/20/520665820.db2.gz FYTIAQCYKIUZDK-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598509266 520668912 /nfs/dbraw/zinc/66/89/12/520668912.db2.gz KVWLMBFQQLPWHT-KRWDZBQOSA-N 1 1 368.437 2.788 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000598559956 520705332 /nfs/dbraw/zinc/70/53/32/520705332.db2.gz JQGGSBCGPYYLMV-AWEZNQCLSA-N 1 1 356.426 2.928 20 5 FFBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000610489205 520711197 /nfs/dbraw/zinc/71/11/97/520711197.db2.gz MQMBMGHIOKGNKU-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO O=C(C[NH+]1CCC([C@H]2CCCCO2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595787959 520725635 /nfs/dbraw/zinc/72/56/35/520725635.db2.gz LAHXWFFKLGHNGV-LJQANCHMSA-N 1 1 373.453 2.765 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000595825992 520748457 /nfs/dbraw/zinc/74/84/57/520748457.db2.gz ISXBZKSCJCCYFA-MSOLQXFVSA-N 1 1 371.437 2.545 20 5 FFBDMO NC(=O)CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000610580833 520748783 /nfs/dbraw/zinc/74/87/83/520748783.db2.gz SVFASGRPUCOBKK-UHFFFAOYSA-N 1 1 354.366 2.614 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000610580833 520748790 /nfs/dbraw/zinc/74/87/90/520748790.db2.gz SVFASGRPUCOBKK-UHFFFAOYSA-N 1 1 354.366 2.614 20 5 FFBDMO O=C1CCCN1C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595828570 520751293 /nfs/dbraw/zinc/75/12/93/520751293.db2.gz LDYIODXPVHNRGR-AWEZNQCLSA-N 1 1 370.409 2.694 20 5 FFBDMO O=C1CCCN1C[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595828570 520751302 /nfs/dbraw/zinc/75/13/02/520751302.db2.gz LDYIODXPVHNRGR-AWEZNQCLSA-N 1 1 370.409 2.694 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000598645781 520757848 /nfs/dbraw/zinc/75/78/48/520757848.db2.gz IBTUWDKYMAGNCT-WCQYABFASA-N 1 1 374.384 2.698 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601446708 520791032 /nfs/dbraw/zinc/79/10/32/520791032.db2.gz AQPFDIILWLMOTE-BBRMVZONSA-N 1 1 357.385 2.984 20 5 FFBDMO CC[N@H+](CCOc1ccccc1OC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000595888902 520795804 /nfs/dbraw/zinc/79/58/04/520795804.db2.gz VFYTZBWDZGIBFY-UHFFFAOYSA-N 1 1 373.409 2.603 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1OC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000595888902 520795812 /nfs/dbraw/zinc/79/58/12/520795812.db2.gz VFYTZBWDZGIBFY-UHFFFAOYSA-N 1 1 373.409 2.603 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000593188302 520811341 /nfs/dbraw/zinc/81/13/41/520811341.db2.gz BXNMYMAESILWCW-AXFHLTTASA-N 1 1 370.247 2.910 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914417 520818599 /nfs/dbraw/zinc/81/85/99/520818599.db2.gz HFXHEEOVHNWWTC-GTNSWQLSSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)O[C@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914417 520818606 /nfs/dbraw/zinc/81/86/06/520818606.db2.gz HFXHEEOVHNWWTC-GTNSWQLSSA-N 1 1 371.384 2.976 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000610754807 520831001 /nfs/dbraw/zinc/83/10/01/520831001.db2.gz MXXPJAZBIWFJAW-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCOC(C)(C)C ZINC000610859961 520877431 /nfs/dbraw/zinc/87/74/31/520877431.db2.gz XPWWLFZNDDWOSQ-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2c(F)cccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000601649489 520884424 /nfs/dbraw/zinc/88/44/24/520884424.db2.gz PMILINALMCWMQY-CABCVRRESA-N 1 1 357.385 2.809 20 5 FFBDMO Cc1c(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593322023 520908658 /nfs/dbraw/zinc/90/86/58/520908658.db2.gz KUXRCXVRDMTOPD-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593322023 520908661 /nfs/dbraw/zinc/90/86/61/520908661.db2.gz KUXRCXVRDMTOPD-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO COC1CC[NH+](CCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596159931 520945045 /nfs/dbraw/zinc/94/50/45/520945045.db2.gz SGNUQHSUXCHILA-UHFFFAOYSA-N 1 1 358.236 2.880 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000596176211 520954231 /nfs/dbraw/zinc/95/42/31/520954231.db2.gz BBYSXHJNSPSKBM-CABCVRRESA-N 1 1 368.437 2.793 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000598978004 520956295 /nfs/dbraw/zinc/95/62/95/520956295.db2.gz GHFIVRBBSDTCIW-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCC[N@@H+]1CCc2sccc2C1 ZINC000593417974 520979907 /nfs/dbraw/zinc/97/99/07/520979907.db2.gz CXABGXBJMXKRLY-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCC[N@H+]1CCc2sccc2C1 ZINC000593417974 520979916 /nfs/dbraw/zinc/97/99/16/520979916.db2.gz CXABGXBJMXKRLY-UHFFFAOYSA-N 1 1 363.414 2.512 20 5 FFBDMO O=c1[nH]ccc(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000596231183 520985059 /nfs/dbraw/zinc/98/50/59/520985059.db2.gz HBFVQBJEOYLURB-IBGZPJMESA-N 1 1 354.410 2.798 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@@H]1CCCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000599070065 521014822 /nfs/dbraw/zinc/01/48/22/521014822.db2.gz JWYAVICKUCSCLR-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000601973582 521048726 /nfs/dbraw/zinc/04/87/26/521048726.db2.gz QGYFQBSIUAWRQS-LSDHHAIUSA-N 1 1 352.337 2.774 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)N2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000611248099 521055827 /nfs/dbraw/zinc/05/58/27/521055827.db2.gz RYXVJDYXWIPFCG-OAHLLOKOSA-N 1 1 364.490 2.670 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)n1 ZINC000596423584 521063222 /nfs/dbraw/zinc/06/32/22/521063222.db2.gz LSQGLPLXYPLPNT-KRWDZBQOSA-N 1 1 356.426 2.785 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000593545679 521065439 /nfs/dbraw/zinc/06/54/39/521065439.db2.gz XTIAQGGUOUQGOT-YOEHRIQHSA-N 1 1 361.417 2.752 20 5 FFBDMO C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H](CCO)c1ccccc1 ZINC000611272010 521070132 /nfs/dbraw/zinc/07/01/32/521070132.db2.gz WJIIGWQRQZGTGU-INIZCTEOSA-N 1 1 358.394 2.922 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H](CCO)c1ccccc1 ZINC000611272010 521070141 /nfs/dbraw/zinc/07/01/41/521070141.db2.gz WJIIGWQRQZGTGU-INIZCTEOSA-N 1 1 358.394 2.922 20 5 FFBDMO C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H](CCO)c1ccccc1 ZINC000611272011 521070943 /nfs/dbraw/zinc/07/09/43/521070943.db2.gz WJIIGWQRQZGTGU-MRXNPFEDSA-N 1 1 358.394 2.922 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H](CCO)c1ccccc1 ZINC000611272011 521070953 /nfs/dbraw/zinc/07/09/53/521070953.db2.gz WJIIGWQRQZGTGU-MRXNPFEDSA-N 1 1 358.394 2.922 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1ccnc1 ZINC000611286002 521082014 /nfs/dbraw/zinc/08/20/14/521082014.db2.gz QJANZDUEWRHXPM-CZUORRHYSA-N 1 1 358.398 2.646 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1n1ccnc1 ZINC000611286002 521082021 /nfs/dbraw/zinc/08/20/21/521082021.db2.gz QJANZDUEWRHXPM-CZUORRHYSA-N 1 1 358.398 2.646 20 5 FFBDMO CC(C)C[N@@H+](C)CCCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000593647370 521129967 /nfs/dbraw/zinc/12/99/67/521129967.db2.gz YOHJCAHMCWTMIW-GOSISDBHSA-N 1 1 359.474 2.985 20 5 FFBDMO O=C([C@H]1CC[N@H+]1C1CCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602108985 521147335 /nfs/dbraw/zinc/14/73/35/521147335.db2.gz WVHMOLFZICZBQV-LJQANCHMSA-N 1 1 373.453 2.982 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000611522441 521202196 /nfs/dbraw/zinc/20/21/96/521202196.db2.gz QTVOBPFXMHUMSA-HNNXBMFYSA-N 1 1 358.398 2.708 20 5 FFBDMO Cc1ccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)c(N2CCCC2)[nH+]1 ZINC000611582182 521235971 /nfs/dbraw/zinc/23/59/71/521235971.db2.gz GGTMZGUPAOBVKY-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000599463105 521240857 /nfs/dbraw/zinc/24/08/57/521240857.db2.gz BXOVMHTULYNHJP-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O ZINC000599632407 521344688 /nfs/dbraw/zinc/34/46/88/521344688.db2.gz KACGHOOGTSQVSI-YPCHGGDPSA-N 1 1 352.456 2.867 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O ZINC000599632407 521344702 /nfs/dbraw/zinc/34/47/02/521344702.db2.gz KACGHOOGTSQVSI-YPCHGGDPSA-N 1 1 352.456 2.867 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602448933 521352413 /nfs/dbraw/zinc/35/24/13/521352413.db2.gz WISMKKGHLCSOKY-SSDOTTSWSA-N 1 1 351.222 2.660 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](C)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602448933 521352419 /nfs/dbraw/zinc/35/24/19/521352419.db2.gz WISMKKGHLCSOKY-SSDOTTSWSA-N 1 1 351.222 2.660 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCSC[C@@H]1CCO ZINC000602484637 521373244 /nfs/dbraw/zinc/37/32/44/521373244.db2.gz LCCFGYDCVOPXRD-LBPRGKRZSA-N 1 1 350.362 2.913 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCSC[C@@H]1CCO ZINC000602484637 521373249 /nfs/dbraw/zinc/37/32/49/521373249.db2.gz LCCFGYDCVOPXRD-LBPRGKRZSA-N 1 1 350.362 2.913 20 5 FFBDMO COCC[N@@H+]1CCC[C@H](Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000619153826 521421175 /nfs/dbraw/zinc/42/11/75/521421175.db2.gz OQSPGDJJJKZWIG-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO COCC[N@H+]1CCC[C@H](Nc2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000619153826 521421180 /nfs/dbraw/zinc/42/11/80/521421180.db2.gz OQSPGDJJJKZWIG-NSHDSACASA-N 1 1 371.821 2.558 20 5 FFBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H](C)CC(=O)Nc1ccccc1 ZINC000602654525 521461815 /nfs/dbraw/zinc/46/18/15/521461815.db2.gz VEOFWPDDOUCNPM-CQSZACIVSA-N 1 1 359.430 2.958 20 5 FFBDMO Cn1cc(CN2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c([N+](=O)[O-])n1 ZINC000602669486 521470119 /nfs/dbraw/zinc/47/01/19/521470119.db2.gz JCEODHWEYXPAAX-UHFFFAOYSA-N 1 1 369.469 2.816 20 5 FFBDMO CCNC(=O)[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(C)C ZINC000602675052 521475357 /nfs/dbraw/zinc/47/53/57/521475357.db2.gz JEXAVDQZKNHFFW-JTQLQIEISA-N 1 1 364.265 2.669 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597097208 521503504 /nfs/dbraw/zinc/50/35/04/521503504.db2.gz DTNWBHOUPCWYJI-SNVBAGLBSA-N 1 1 355.826 2.636 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](Cc2ccccc2)CC[C@@H]1C ZINC000602784134 521529142 /nfs/dbraw/zinc/52/91/42/521529142.db2.gz QCBMQMHUSBAUSY-INIZCTEOSA-N 1 1 357.458 2.696 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000612310030 521570310 /nfs/dbraw/zinc/57/03/10/521570310.db2.gz GLNDMIPWSULRSH-NSHDSACASA-N 1 1 357.863 2.893 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000612310030 521570319 /nfs/dbraw/zinc/57/03/19/521570319.db2.gz GLNDMIPWSULRSH-NSHDSACASA-N 1 1 357.863 2.893 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]2N1 ZINC000597204842 521572823 /nfs/dbraw/zinc/57/28/23/521572823.db2.gz GGAOTVBBYQQQIC-PBHICJAKSA-N 1 1 355.394 2.955 20 5 FFBDMO Nc1cc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc(CO)c1[N+](=O)[O-] ZINC000619570507 521774609 /nfs/dbraw/zinc/77/46/09/521774609.db2.gz LIPOJXBUXCBEOY-MRXNPFEDSA-N 1 1 370.453 2.646 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CCN(c3cc[nH+]cc3Br)CC2)n1 ZINC000619587240 521785438 /nfs/dbraw/zinc/78/54/38/521785438.db2.gz XWCPTBSCIXSDCG-UHFFFAOYSA-N 1 1 352.192 2.790 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(NS(C)(=O)=O)c1 ZINC000619846242 521901472 /nfs/dbraw/zinc/90/14/72/521901472.db2.gz WAQKGWWIRGVHIT-UHFFFAOYSA-N 1 1 363.439 2.641 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC000820092427 607467303 /nfs/dbraw/zinc/46/73/03/607467303.db2.gz LPIAAYNYARXREY-CYBMUJFWSA-N 1 1 359.434 2.555 20 5 FFBDMO CC(C)([NH2+]Cc1ccc(-c2nn[nH]n2)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000819988197 607484479 /nfs/dbraw/zinc/48/44/79/607484479.db2.gz UGYWAUPFQZPLLS-UHFFFAOYSA-N 1 1 356.361 2.939 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000159135482 728901311 /nfs/dbraw/zinc/90/13/11/728901311.db2.gz LMGKDPFNPYCSCJ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCC[N@H+](CCF)C1 ZINC000899219892 735461216 /nfs/dbraw/zinc/46/12/16/735461216.db2.gz FVWLJQQAJXUYKG-CYBMUJFWSA-N 1 1 357.813 2.731 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCC[N@@H+](CCF)C1 ZINC000899219892 735461218 /nfs/dbraw/zinc/46/12/18/735461218.db2.gz FVWLJQQAJXUYKG-CYBMUJFWSA-N 1 1 357.813 2.731 20 5 FFBDMO O=C(C[N@H+](CCO)C1CCCCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000071079828 728207843 /nfs/dbraw/zinc/20/78/43/728207843.db2.gz NRWWJGLQDCQBTM-UHFFFAOYSA-N 1 1 355.822 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c(Br)c1 ZINC000091672573 728460939 /nfs/dbraw/zinc/46/09/39/728460939.db2.gz BMPJQSJHTCPVEQ-VXGBXAGGSA-N 1 1 356.220 2.632 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188163 728559064 /nfs/dbraw/zinc/55/90/64/728559064.db2.gz BZTHEOWJCCDCKK-ZFWWWQNUSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000114188163 728559066 /nfs/dbraw/zinc/55/90/66/728559066.db2.gz BZTHEOWJCCDCKK-ZFWWWQNUSA-N 1 1 355.822 2.812 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H](SC)C1 ZINC000134583798 728731195 /nfs/dbraw/zinc/73/11/95/728731195.db2.gz QLXQHQJLIYJMGD-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H](SC)C1 ZINC000134583798 728731196 /nfs/dbraw/zinc/73/11/96/728731196.db2.gz QLXQHQJLIYJMGD-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO C[C@@H](CNc1cccc(Br)c1[N+](=O)[O-])C[NH+]1CCOCC1 ZINC000856730807 730351163 /nfs/dbraw/zinc/35/11/63/730351163.db2.gz HRWQOJSHMFLFHZ-NSHDSACASA-N 1 1 358.236 2.738 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@H]1CC[N@@H+](C)C1 ZINC000857305353 730390231 /nfs/dbraw/zinc/39/02/31/730390231.db2.gz DIXAELGAPWHHAB-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CCO[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000860780983 730546571 /nfs/dbraw/zinc/54/65/71/730546571.db2.gz SOCQQWVBCBCHPX-IRXDYDNUSA-N 1 1 350.415 2.773 20 5 FFBDMO CCO[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000860780983 730546574 /nfs/dbraw/zinc/54/65/74/730546574.db2.gz SOCQQWVBCBCHPX-IRXDYDNUSA-N 1 1 350.415 2.773 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCOc1ccccc1C(=O)OCCC[N+](=O)[O-] ZINC000860918543 730559300 /nfs/dbraw/zinc/55/93/00/730559300.db2.gz MDHKALIYAJOUQL-HNNXBMFYSA-N 1 1 350.415 2.763 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000868446326 731292839 /nfs/dbraw/zinc/29/28/39/731292839.db2.gz YEBCHJHPKVUUBA-LLVKDONJSA-N 1 1 372.263 2.745 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000874828669 732104560 /nfs/dbraw/zinc/10/45/60/732104560.db2.gz YDWCAOHAGXAPES-UONOGXRCSA-N 1 1 357.332 2.922 20 5 FFBDMO CNC(=O)C1([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CCCC1 ZINC000877424971 732359496 /nfs/dbraw/zinc/35/94/96/732359496.db2.gz VCKFPPVYGFIGIX-UHFFFAOYSA-N 1 1 362.249 2.567 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1CN(c2ccncn2)C1 ZINC000877702482 732416520 /nfs/dbraw/zinc/41/65/20/732416520.db2.gz USEARCBBPXSFLS-UHFFFAOYSA-N 1 1 354.197 2.670 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)c1cc(Br)no1 ZINC000877917520 732451720 /nfs/dbraw/zinc/45/17/20/732451720.db2.gz WOQWUMQAJJSVNV-NSHDSACASA-N 1 1 356.176 2.511 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)c1cc(Br)no1 ZINC000877917520 732451722 /nfs/dbraw/zinc/45/17/22/732451722.db2.gz WOQWUMQAJJSVNV-NSHDSACASA-N 1 1 356.176 2.511 20 5 FFBDMO C[N@H+]1CCN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C(C)(C)C1 ZINC000878329118 732515255 /nfs/dbraw/zinc/51/52/55/732515255.db2.gz SYQUXHCOGGGVHY-UHFFFAOYSA-N 1 1 365.821 2.824 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878336205 732516097 /nfs/dbraw/zinc/51/60/97/732516097.db2.gz UXEIFBFBNYIOGV-WDEREUQCSA-N 1 1 365.821 2.823 20 5 FFBDMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o1)C2 ZINC000878949129 732620445 /nfs/dbraw/zinc/62/04/45/732620445.db2.gz IXLUSQSQGCQURP-MGPLVRAMSA-N 1 1 364.789 2.767 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000879561704 732723566 /nfs/dbraw/zinc/72/35/66/732723566.db2.gz SLWYFZSPQIARIF-CHWSQXEVSA-N 1 1 365.455 2.617 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879561946 732723944 /nfs/dbraw/zinc/72/39/44/732723944.db2.gz XKXWIOBZDGXTBC-RWMBFGLXSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879561946 732723948 /nfs/dbraw/zinc/72/39/48/732723948.db2.gz XKXWIOBZDGXTBC-RWMBFGLXSA-N 1 1 365.455 2.615 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2CSC[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000879566783 732724853 /nfs/dbraw/zinc/72/48/53/732724853.db2.gz YGUVBIMCLFDJEP-VXGBXAGGSA-N 1 1 353.419 2.747 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC000879574816 732727271 /nfs/dbraw/zinc/72/72/71/732727271.db2.gz GUKFXXPCEYUUOS-HSMVNMDESA-N 1 1 366.849 2.601 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000879961213 732809549 /nfs/dbraw/zinc/80/95/49/732809549.db2.gz BFIAYBHIEKZQFO-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000879961213 732809552 /nfs/dbraw/zinc/80/95/52/732809552.db2.gz BFIAYBHIEKZQFO-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2cccc([N+](=O)[O-])c2Br)CCN1 ZINC000880166530 732858607 /nfs/dbraw/zinc/85/86/07/732858607.db2.gz ASPSRUCOTJFROS-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)CCN1 ZINC000880166530 732858611 /nfs/dbraw/zinc/85/86/11/732858611.db2.gz ASPSRUCOTJFROS-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320760 732888617 /nfs/dbraw/zinc/88/86/17/732888617.db2.gz XXJYISFUSCZOSO-WFASDCNBSA-N 1 1 358.423 2.646 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320760 732888624 /nfs/dbraw/zinc/88/86/24/732888624.db2.gz XXJYISFUSCZOSO-WFASDCNBSA-N 1 1 358.423 2.646 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000886069229 733745425 /nfs/dbraw/zinc/74/54/25/733745425.db2.gz DGGWTARDVAOJHE-JSGCOSHPSA-N 1 1 350.419 2.725 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000886069229 733745426 /nfs/dbraw/zinc/74/54/26/733745426.db2.gz DGGWTARDVAOJHE-JSGCOSHPSA-N 1 1 350.419 2.725 20 5 FFBDMO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078064 734512589 /nfs/dbraw/zinc/51/25/89/734512589.db2.gz FQWDAXANFFKXBJ-SNVBAGLBSA-N 1 1 350.810 2.615 20 5 FFBDMO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078064 734512590 /nfs/dbraw/zinc/51/25/90/734512590.db2.gz FQWDAXANFFKXBJ-SNVBAGLBSA-N 1 1 350.810 2.615 20 5 FFBDMO NC(=[NH+]OCc1cc([N+](=O)[O-])ccc1Br)C1CCOCC1 ZINC000902710483 735984945 /nfs/dbraw/zinc/98/49/45/735984945.db2.gz HVMUBNHBVJGWLH-UHFFFAOYSA-N 1 1 358.192 2.782 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000754999857 736224647 /nfs/dbraw/zinc/22/46/47/736224647.db2.gz ZOKLAYDSTZVMBV-JTQLQIEISA-N 1 1 374.210 2.711 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)OCC[NH+]2CCSCC2)cc1SC ZINC000757932505 736437072 /nfs/dbraw/zinc/43/70/72/736437072.db2.gz IJNKOGOYYAEGNZ-UHFFFAOYSA-N 1 1 372.468 2.531 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H](C)C[N@@H+]1C ZINC000760854699 736674967 /nfs/dbraw/zinc/67/49/67/736674967.db2.gz PKDXTIZKEFBNNP-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H](C)C[N@H+]1C ZINC000760854699 736674970 /nfs/dbraw/zinc/67/49/70/736674970.db2.gz PKDXTIZKEFBNNP-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)C2)C1 ZINC000908422516 736774000 /nfs/dbraw/zinc/77/40/00/736774000.db2.gz OOEDUVBFFHUTKE-MRXNPFEDSA-N 1 1 355.797 2.945 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000766253167 737212527 /nfs/dbraw/zinc/21/25/27/737212527.db2.gz JATYXDAGLZYRPN-NEPJUHHUSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])CC2)c1 ZINC000766496517 737235197 /nfs/dbraw/zinc/23/51/97/737235197.db2.gz SHLNBERWQHINJZ-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766950819 737278829 /nfs/dbraw/zinc/27/88/29/737278829.db2.gz RFGKUNGYFOUJEF-GDBMZVCRSA-N 1 1 350.415 2.682 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000914240141 737536555 /nfs/dbraw/zinc/53/65/55/737536555.db2.gz ZMEQQCZUFHMMIA-MAZHCROVSA-N 1 1 364.471 2.535 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000778245026 738366661 /nfs/dbraw/zinc/36/66/61/738366661.db2.gz HGDBKGLQGDVMBJ-IAQYHMDHSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000778245026 738366667 /nfs/dbraw/zinc/36/66/67/738366667.db2.gz HGDBKGLQGDVMBJ-IAQYHMDHSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785728796 738991622 /nfs/dbraw/zinc/99/16/22/738991622.db2.gz JDYSBZSRINWGEL-GHMZBOCLSA-N 1 1 369.805 2.603 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000930544029 739124707 /nfs/dbraw/zinc/12/47/07/739124707.db2.gz KBCUNSGVONOXSC-ZANVPECISA-N 1 1 369.219 2.525 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CCC([N@H+]3CCCOCC3)CC2)ccc1Cl ZINC000931287518 739238808 /nfs/dbraw/zinc/23/88/08/739238808.db2.gz ZOWZGAWMNXNCPD-UHFFFAOYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1CC[C@H](C2OCCO2)C1 ZINC000931997726 739368775 /nfs/dbraw/zinc/36/87/75/739368775.db2.gz BRUWFMOTSVSXQM-JTQLQIEISA-N 1 1 357.204 2.552 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000790269594 739431130 /nfs/dbraw/zinc/43/11/30/739431130.db2.gz BTSTVIGNUDKCGJ-ABAIWWIYSA-N 1 1 367.833 2.955 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000933247731 739588426 /nfs/dbraw/zinc/58/84/26/739588426.db2.gz IPCFSOKFCJTWSM-AWEZNQCLSA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000933368815 739611272 /nfs/dbraw/zinc/61/12/72/739611272.db2.gz LFUONBXSXPSPMP-XJKSGUPXSA-N 1 1 351.422 2.998 20 5 FFBDMO CO[C@H]1CC[C@H]1[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107652 739731672 /nfs/dbraw/zinc/73/16/72/739731672.db2.gz XNXTVPSKQHRMDC-YPMHNXCESA-N 1 1 352.778 2.907 20 5 FFBDMO CO[C@H]1CC[C@H]1[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107652 739731675 /nfs/dbraw/zinc/73/16/75/739731675.db2.gz XNXTVPSKQHRMDC-YPMHNXCESA-N 1 1 352.778 2.907 20 5 FFBDMO CSC[C@@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000793795339 739814695 /nfs/dbraw/zinc/81/46/95/739814695.db2.gz HBUWMWZDNZHUSM-CQSZACIVSA-N 1 1 364.471 2.869 20 5 FFBDMO CSC[C@@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000793795339 739814697 /nfs/dbraw/zinc/81/46/97/739814697.db2.gz HBUWMWZDNZHUSM-CQSZACIVSA-N 1 1 364.471 2.869 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)CC[C@@H]21 ZINC000934892539 739862491 /nfs/dbraw/zinc/86/24/91/739862491.db2.gz XVMLUSMOGMKLCE-CABZTGNLSA-N 1 1 370.812 2.526 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ncc1Br ZINC000794270414 739869575 /nfs/dbraw/zinc/86/95/75/739869575.db2.gz FGAVHPLGXMXQMY-JTQLQIEISA-N 1 1 373.251 2.603 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000934951149 739870876 /nfs/dbraw/zinc/87/08/76/739870876.db2.gz NNUXRNIYRCPGHQ-BXKDBHETSA-N 1 1 370.812 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000935656839 739989698 /nfs/dbraw/zinc/98/96/98/739989698.db2.gz LDGNYNBYBRDOBX-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO C[C@@H]1C[NH+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C[C@H]1C ZINC000795436130 740021998 /nfs/dbraw/zinc/02/19/98/740021998.db2.gz VEUOARDMBDYSFR-NXEZZACHSA-N 1 1 368.231 2.858 20 5 FFBDMO C[C@H](CO)[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCC1 ZINC000796549328 740152719 /nfs/dbraw/zinc/15/27/19/740152719.db2.gz WQOLZXAMOWNMSA-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccc(Cl)s1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963786478 740655718 /nfs/dbraw/zinc/65/57/18/740655718.db2.gz DSMSETLWTOZBDW-ICJZLJJZSA-N 1 1 369.874 2.584 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)c1 ZINC000802136264 740676249 /nfs/dbraw/zinc/67/62/49/740676249.db2.gz WFDJBZDCRODZCU-GFCCVEGCSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@H+](C(C)C)CCO2)c1 ZINC000802136264 740676252 /nfs/dbraw/zinc/67/62/52/740676252.db2.gz WFDJBZDCRODZCU-GFCCVEGCSA-N 1 1 354.428 2.583 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C ZINC000803496162 740804494 /nfs/dbraw/zinc/80/44/94/740804494.db2.gz XOWFEBUHLMWUTH-QMTHXVAHSA-N 1 1 371.821 2.705 20 5 FFBDMO Cc1ccc(N2CC[NH+]([C@H]3CCOC3)CC2)c([N+](=O)[O-])c1Br ZINC000804561642 740884435 /nfs/dbraw/zinc/88/44/35/740884435.db2.gz NJWJGHAHXHNPBE-LBPRGKRZSA-N 1 1 370.247 2.577 20 5 FFBDMO C[N@@H+](Cc1ccc(F)c(Cl)c1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985432341 741395333 /nfs/dbraw/zinc/39/53/33/741395333.db2.gz ZSZILJHEAJCOLD-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@H+](Cc1ccc(F)c(Cl)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432341 741395338 /nfs/dbraw/zinc/39/53/38/741395338.db2.gz ZSZILJHEAJCOLD-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO C[N@@H+](Cc1ccc(F)c(Cl)c1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985432341 741395340 /nfs/dbraw/zinc/39/53/40/741395340.db2.gz ZSZILJHEAJCOLD-CZUORRHYSA-N 1 1 369.824 2.567 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000811848754 741567100 /nfs/dbraw/zinc/56/71/00/741567100.db2.gz RVWGHAMRTQHBDQ-JTQLQIEISA-N 1 1 365.402 2.732 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000816954156 742076963 /nfs/dbraw/zinc/07/69/63/742076963.db2.gz URLABAREMSDSOZ-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](C)C1 ZINC000823500003 742927782 /nfs/dbraw/zinc/92/77/82/742927782.db2.gz RNNWCSNWMLSRNK-VIFPVBQESA-N 1 1 358.801 2.526 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000828958857 745146084 /nfs/dbraw/zinc/14/60/84/745146084.db2.gz JIMTZECDEUAYGJ-CVEARBPZSA-N 1 1 351.834 2.876 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C1 ZINC000829176130 745176223 /nfs/dbraw/zinc/17/62/23/745176223.db2.gz QRRATERHMWUDBV-LBPRGKRZSA-N 1 1 355.385 2.985 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831965288 745612386 /nfs/dbraw/zinc/61/23/86/745612386.db2.gz VVXJTVPGFIZFJV-ZDUSSCGKSA-N 1 1 354.838 2.603 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(OCCCO)CC2)c1Br ZINC000839501569 746841519 /nfs/dbraw/zinc/84/15/19/746841519.db2.gz CIVPZNRCFDCYRS-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839505303 746842595 /nfs/dbraw/zinc/84/25/95/746842595.db2.gz LZLKAOYNMGPQKP-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839505303 746842601 /nfs/dbraw/zinc/84/26/01/746842601.db2.gz LZLKAOYNMGPQKP-CQSZACIVSA-N 1 1 357.204 2.742 20 5 FFBDMO C[C@@H](CO)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CCCC1 ZINC000839575267 746860208 /nfs/dbraw/zinc/86/02/08/746860208.db2.gz SWGNBHDGDIQLCZ-NSHDSACASA-N 1 1 355.822 2.812 20 5 FFBDMO CSC[C@H]1CCC[N@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078464 746993680 /nfs/dbraw/zinc/99/36/80/746993680.db2.gz UYJQAILBSDJWDJ-GUYCJALGSA-N 1 1 365.455 2.565 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078464 746993686 /nfs/dbraw/zinc/99/36/86/746993686.db2.gz UYJQAILBSDJWDJ-GUYCJALGSA-N 1 1 365.455 2.565 20 5 FFBDMO CC(C)[N@@H+](C[C@H]1CCC(=O)N1)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000840189965 747034263 /nfs/dbraw/zinc/03/42/63/747034263.db2.gz RYIZLMDLNYYCHV-GFCCVEGCSA-N 1 1 365.821 2.544 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851753526 749661536 /nfs/dbraw/zinc/66/15/36/749661536.db2.gz XZGGPSROGPKTOM-GFCCVEGCSA-N 1 1 354.407 2.580 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851753526 749661540 /nfs/dbraw/zinc/66/15/40/749661540.db2.gz XZGGPSROGPKTOM-GFCCVEGCSA-N 1 1 354.407 2.580 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000852199018 749800122 /nfs/dbraw/zinc/80/01/22/749800122.db2.gz FFSXUWKUWOFWDI-CYBMUJFWSA-N 1 1 354.838 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c(Cl)c1 ZINC000853965830 750211326 /nfs/dbraw/zinc/21/13/26/750211326.db2.gz MKIQATMVLPSYNK-LBPRGKRZSA-N 1 1 360.241 2.937 20 5 FFBDMO C[C@H]1C[NH+](CCCNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)O1 ZINC000486447156 887693720 /nfs/dbraw/zinc/69/37/20/887693720.db2.gz DYTBKXRCCYGVQR-STQMWFEESA-N 1 1 361.402 2.556 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@H]2C2CCC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000728195240 959390705 /nfs/dbraw/zinc/39/07/05/959390705.db2.gz DLZVTOFELMWEMJ-INIZCTEOSA-N 1 1 358.398 2.585 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000134886685 960092954 /nfs/dbraw/zinc/09/29/54/960092954.db2.gz ZJZYVWCVHAPDSK-BBRMVZONSA-N 1 1 354.410 2.691 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)CCc1ccc([N+](=O)[O-])cc1 ZINC001175220245 1013416356 /nfs/dbraw/zinc/41/63/56/1013416356.db2.gz ROVQNFGVMSXRCR-UHFFFAOYSA-N 1 1 367.446 2.610 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]([C@H]2CCCO2)C1 ZINC000933181422 963675864 /nfs/dbraw/zinc/67/58/64/963675864.db2.gz QUJQXMHEDBSXKE-BPQIPLTHSA-N 1 1 362.426 2.570 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@](CO)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000894268812 964052983 /nfs/dbraw/zinc/05/29/83/964052983.db2.gz NISHSWFCPNLKAS-FQEVSTJZSA-N 1 1 372.421 2.835 20 5 FFBDMO CC(C)(C)[C@H]1CSCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001175699648 1013528500 /nfs/dbraw/zinc/52/85/00/1013528500.db2.gz VQGAOANGKGKOHR-MRXNPFEDSA-N 1 1 363.483 2.947 20 5 FFBDMO CC(C)(C)[C@H]1CSCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001175699648 1013528505 /nfs/dbraw/zinc/52/85/05/1013528505.db2.gz VQGAOANGKGKOHR-MRXNPFEDSA-N 1 1 363.483 2.947 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000825698719 1013666393 /nfs/dbraw/zinc/66/63/93/1013666393.db2.gz SFZNTSLNUQBYEN-AWEZNQCLSA-N 1 1 358.398 2.808 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2cnccn2)C1 ZINC001176525150 1013722198 /nfs/dbraw/zinc/72/21/98/1013722198.db2.gz WKNIKHFQHGJJRX-JSGCOSHPSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2cnccn2)C1 ZINC001176525150 1013722203 /nfs/dbraw/zinc/72/22/03/1013722203.db2.gz WKNIKHFQHGJJRX-JSGCOSHPSA-N 1 1 366.381 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@@H]2C[C@H]2CCCO2)cc1 ZINC001176611804 1013736018 /nfs/dbraw/zinc/73/60/18/1013736018.db2.gz XIMLDYYTBOLCEU-FUHWJXTLSA-N 1 1 350.415 2.634 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc2ccccc2s1 ZINC001029304863 967649030 /nfs/dbraw/zinc/64/90/30/967649030.db2.gz MYEZYOKEIYQPIE-YALNPMBYSA-N 1 1 371.462 2.742 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2ccccc2s1 ZINC001029304863 967649035 /nfs/dbraw/zinc/64/90/35/967649035.db2.gz MYEZYOKEIYQPIE-YALNPMBYSA-N 1 1 371.462 2.742 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc2ccccc2s1 ZINC001029304863 967649038 /nfs/dbraw/zinc/64/90/38/967649038.db2.gz MYEZYOKEIYQPIE-YALNPMBYSA-N 1 1 371.462 2.742 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000892776701 970284248 /nfs/dbraw/zinc/28/42/48/970284248.db2.gz JUMHMYYHUWBTTN-IBGZPJMESA-N 1 1 355.442 2.821 20 5 FFBDMO O=C1N[C@H](C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3OC(F)F)CC2)CO1 ZINC000897027956 973162700 /nfs/dbraw/zinc/16/27/00/973162700.db2.gz VPXDBWUGFPKUJD-ZDUSSCGKSA-N 1 1 371.340 2.517 20 5 FFBDMO C[C@@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1[N+](=O)[O-] ZINC000897058134 973203096 /nfs/dbraw/zinc/20/30/96/973203096.db2.gz MHJQQQRKPIDAGX-LSVZVQIISA-N 1 1 360.458 2.965 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CC[N@@H+]1C1CCOCC1 ZINC000897228920 973478793 /nfs/dbraw/zinc/47/87/93/973478793.db2.gz OSKZHUHRXHZBHJ-OAHLLOKOSA-N 1 1 373.375 2.957 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000897228920 973478798 /nfs/dbraw/zinc/47/87/98/973478798.db2.gz OSKZHUHRXHZBHJ-OAHLLOKOSA-N 1 1 373.375 2.957 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000893442943 974004092 /nfs/dbraw/zinc/00/40/92/974004092.db2.gz BNCSJNHDKMLJLW-UHFFFAOYSA-N 1 1 370.388 2.518 20 5 FFBDMO C[N@@H+](Cc1ccc(C2CC2)cc1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985425792 974050927 /nfs/dbraw/zinc/05/09/27/974050927.db2.gz JHHNAKYNVQPDBW-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO C[N@H+](Cc1ccc(C2CC2)cc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425792 974050940 /nfs/dbraw/zinc/05/09/40/974050940.db2.gz JHHNAKYNVQPDBW-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO C[N@@H+](Cc1ccc(C2CC2)cc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985425792 974050952 /nfs/dbraw/zinc/05/09/52/974050952.db2.gz JHHNAKYNVQPDBW-RTBURBONSA-N 1 1 357.454 2.652 20 5 FFBDMO C[C@@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876468018 1014279364 /nfs/dbraw/zinc/27/93/64/1014279364.db2.gz BCITYVLUSRUNCJ-XYPHTWIQSA-N 1 1 372.425 2.668 20 5 FFBDMO C[N@@H+](CCC1CCCC1)CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001268196982 977117577 /nfs/dbraw/zinc/11/75/77/977117577.db2.gz BBQXXBORYLLLQJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@H+](CCC1CCCC1)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001268196982 977117581 /nfs/dbraw/zinc/11/75/81/977117581.db2.gz BBQXXBORYLLLQJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO C[N@@H+](CCC1CCCC1)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001268196982 977117584 /nfs/dbraw/zinc/11/75/84/977117584.db2.gz BBQXXBORYLLLQJ-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+][C@@H](CN1CCOCC1)c1ccccc1 ZINC000182136107 977195535 /nfs/dbraw/zinc/19/55/35/977195535.db2.gz MYNPHQBGWCISAA-SFHVURJKSA-N 1 1 359.401 2.897 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c(C)cc1[N+](=O)[O-] ZINC001211765776 977852634 /nfs/dbraw/zinc/85/26/34/977852634.db2.gz BUCPGXXEILQCCC-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c(C)cc1[N+](=O)[O-] ZINC001211765776 977852646 /nfs/dbraw/zinc/85/26/46/977852646.db2.gz BUCPGXXEILQCCC-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000126339839 978432112 /nfs/dbraw/zinc/43/21/12/978432112.db2.gz WYGUVZARDRWROM-QGZVFWFLSA-N 1 1 358.394 2.749 20 5 FFBDMO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000877168438 1014496380 /nfs/dbraw/zinc/49/63/80/1014496380.db2.gz UJBNMZSALXHTEE-FLODPWGTSA-N 1 1 369.469 2.995 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000877526653 1014613859 /nfs/dbraw/zinc/61/38/59/1014613859.db2.gz UOLHPLHYOZJNSK-SFHVURJKSA-N 1 1 360.502 2.812 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000877526653 1014613866 /nfs/dbraw/zinc/61/38/66/1014613866.db2.gz UOLHPLHYOZJNSK-SFHVURJKSA-N 1 1 360.502 2.812 20 5 FFBDMO C[N@H+](Cc1ccccc1C1CC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964600 980152988 /nfs/dbraw/zinc/15/29/88/980152988.db2.gz QKVNKJLZRWJULY-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO C[N@@H+](Cc1ccccc1C1CC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964600 980152994 /nfs/dbraw/zinc/15/29/94/980152994.db2.gz QKVNKJLZRWJULY-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO C[N@H+](Cc1ccccc1C1CC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964600 980152997 /nfs/dbraw/zinc/15/29/97/980152997.db2.gz QKVNKJLZRWJULY-WOJBJXKFSA-N 1 1 371.481 2.900 20 5 FFBDMO CCC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000878058235 1014841326 /nfs/dbraw/zinc/84/13/26/1014841326.db2.gz YSUSWBXIIOADIQ-AWEZNQCLSA-N 1 1 367.450 2.550 20 5 FFBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000878058235 1014841333 /nfs/dbraw/zinc/84/13/33/1014841333.db2.gz YSUSWBXIIOADIQ-AWEZNQCLSA-N 1 1 367.450 2.550 20 5 FFBDMO Cc1ncccc1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000898256350 982671087 /nfs/dbraw/zinc/67/10/87/982671087.db2.gz WLERILSSUNTIFV-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO C/C(=C/C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000911839219 983904367 /nfs/dbraw/zinc/90/43/67/983904367.db2.gz AGWMWHOZBHZZAI-JKTUTYCYSA-N 1 1 373.453 2.614 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000796455738 1015004859 /nfs/dbraw/zinc/00/48/59/1015004859.db2.gz MXKYHNFFEVHYFT-GFCCVEGCSA-N 1 1 366.418 2.980 20 5 FFBDMO Nc1ccc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000010136002 984371504 /nfs/dbraw/zinc/37/15/04/984371504.db2.gz GXMDUEOUFIGSTD-INIZCTEOSA-N 1 1 358.398 2.727 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4nnc(-c5ccccc5[N+](=O)[O-])o4)[C@H]1[C@H]3C2 ZINC000878603805 1015125839 /nfs/dbraw/zinc/12/58/39/1015125839.db2.gz IENPAEPCSHASIF-SKRAFVOUSA-N 1 1 356.382 2.500 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913684468 986823306 /nfs/dbraw/zinc/82/33/06/986823306.db2.gz XBQPFDNMCRSZBR-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913684468 986823317 /nfs/dbraw/zinc/82/33/17/986823317.db2.gz XBQPFDNMCRSZBR-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913687525 986832400 /nfs/dbraw/zinc/83/24/00/986832400.db2.gz MRYDPESAZOSPTB-IRXDYDNUSA-N 1 1 369.396 2.762 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000130251572 987338136 /nfs/dbraw/zinc/33/81/36/987338136.db2.gz IIEJWGDTBJIUSB-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO CCOC(=O)CC1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000130256477 987478582 /nfs/dbraw/zinc/47/85/82/987478582.db2.gz CSJDYAUMDUPDPE-UHFFFAOYSA-N 1 1 363.414 2.507 20 5 FFBDMO CN(c1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000761909988 987978628 /nfs/dbraw/zinc/97/86/28/987978628.db2.gz AXLAPQRWDWVFNP-MRXNPFEDSA-N 1 1 351.410 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOCCOc3ccccc3)CC2)cc1 ZINC000916987333 990080270 /nfs/dbraw/zinc/08/02/70/990080270.db2.gz RGZHPELGIJUGBY-UHFFFAOYSA-N 1 1 371.437 2.812 20 5 FFBDMO NC(=O)COc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000917175037 990168054 /nfs/dbraw/zinc/16/80/54/990168054.db2.gz AESZLXABAZWWEW-UHFFFAOYSA-N 1 1 355.394 2.624 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000919769063 990727109 /nfs/dbraw/zinc/72/71/09/990727109.db2.gz MQDHOUJOXVEDFS-CQSZACIVSA-N 1 1 373.457 2.571 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(-c3noc(CNCC4CC[NH2+]CC4)n3)nc12 ZINC001212320768 991669056 /nfs/dbraw/zinc/66/90/56/991669056.db2.gz ZPYHFWSSWJVZRR-UHFFFAOYSA-N 1 1 374.448 2.922 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184481573 992778416 /nfs/dbraw/zinc/77/84/16/992778416.db2.gz BRQKVODVEXURBL-HOCLYGCPSA-N 1 1 368.437 2.960 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@@]2(c3ccccc3)C[C@@H](O)C2)c2c(c1)COCO2 ZINC000880223955 1015785229 /nfs/dbraw/zinc/78/52/29/1015785229.db2.gz XBJQRFLKCFUDPE-IZAXUBKRSA-N 1 1 356.378 2.601 20 5 FFBDMO COc1cc(CO[NH+]=C(N)CCNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000810017352 994674470 /nfs/dbraw/zinc/67/44/70/994674470.db2.gz VKBYJKPHGYPKNN-UHFFFAOYSA-N 1 1 368.390 2.517 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000811505138 995169309 /nfs/dbraw/zinc/16/93/09/995169309.db2.gz GACKMPGCTMNORZ-UHFFFAOYSA-N 1 1 373.365 2.964 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000811505138 995169316 /nfs/dbraw/zinc/16/93/16/995169316.db2.gz GACKMPGCTMNORZ-UHFFFAOYSA-N 1 1 373.365 2.964 20 5 FFBDMO O=C(COCc1ccccc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173534 995633767 /nfs/dbraw/zinc/63/37/67/995633767.db2.gz DHOPCCVJOWLQBI-IBGZPJMESA-N 1 1 370.405 2.929 20 5 FFBDMO O=C(COCc1ccccc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173534 995633770 /nfs/dbraw/zinc/63/37/70/995633770.db2.gz DHOPCCVJOWLQBI-IBGZPJMESA-N 1 1 370.405 2.929 20 5 FFBDMO C[C@@H](CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000826747868 1016058402 /nfs/dbraw/zinc/05/84/02/1016058402.db2.gz YRUXAFBNFUSDOK-HNAYVOBHSA-N 1 1 371.437 2.655 20 5 FFBDMO Cc1cc(N2CCC[C@H](OC(=O)Cc3ccccc3[N+](=O)[O-])C2)nc(C)[nH+]1 ZINC000731299178 997799351 /nfs/dbraw/zinc/79/93/51/997799351.db2.gz KRRXIDIHTGLJFM-INIZCTEOSA-N 1 1 370.409 2.756 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)/C=C/C(=O)OC ZINC001144105237 998023333 /nfs/dbraw/zinc/02/33/33/998023333.db2.gz UGZDRHOGRGLBFL-HYHZBMSMSA-N 1 1 365.389 2.624 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@H](C)OC(C)=O ZINC001144159648 998075484 /nfs/dbraw/zinc/07/54/84/998075484.db2.gz GNYJQBOGGPQVJA-NSHDSACASA-N 1 1 367.405 2.847 20 5 FFBDMO C[C@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844731412 998128353 /nfs/dbraw/zinc/12/83/53/998128353.db2.gz SMQQXUYJECAUBL-DZGCQCFKSA-N 1 1 367.450 2.764 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)[C@@H]1CCNC(=O)OC(C)(C)C ZINC000844731412 998128357 /nfs/dbraw/zinc/12/83/57/998128357.db2.gz SMQQXUYJECAUBL-DZGCQCFKSA-N 1 1 367.450 2.764 20 5 FFBDMO O=C1CCCCN1[C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000732807505 998780920 /nfs/dbraw/zinc/78/09/20/998780920.db2.gz PQCZVEVRTMTCDD-KRWDZBQOSA-N 1 1 361.442 2.841 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000734178419 999222672 /nfs/dbraw/zinc/22/26/72/999222672.db2.gz XSJUHHLDMVWHGO-INIZCTEOSA-N 1 1 368.437 2.880 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC000741014050 999700858 /nfs/dbraw/zinc/70/08/58/999700858.db2.gz ILMYNKKHGSUQLT-QGZVFWFLSA-N 1 1 363.414 2.505 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC000741031700 999701414 /nfs/dbraw/zinc/70/14/14/999701414.db2.gz VYYMJRMXXFTDSP-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741016727 999702770 /nfs/dbraw/zinc/70/27/70/999702770.db2.gz JYZRDVOVZBXSJR-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741016727 999702772 /nfs/dbraw/zinc/70/27/72/999702772.db2.gz JYZRDVOVZBXSJR-RQJABVFESA-N 1 1 363.414 2.726 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000741022164 999703563 /nfs/dbraw/zinc/70/35/63/999703563.db2.gz QKPLKQSGJOBHKD-IHRRRGAJSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C ZINC000741024618 999704434 /nfs/dbraw/zinc/70/44/34/999704434.db2.gz XOWZMIJNYZWACU-IHRRRGAJSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1CCCCCC1 ZINC000741028315 999705373 /nfs/dbraw/zinc/70/53/73/999705373.db2.gz FJIWBCKLHUPIBL-ZDUSSCGKSA-N 1 1 374.397 2.953 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2CCC[C@@H]21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000744407309 999855780 /nfs/dbraw/zinc/85/57/80/999855780.db2.gz SOYKJRGVVYGDIX-LPHOPBHVSA-N 1 1 372.469 2.508 20 5 FFBDMO COc1ccc(OCCOC(=O)[C@H](C)[N@@H+]2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000745091367 999891977 /nfs/dbraw/zinc/89/19/77/999891977.db2.gz GMMATVMQCANJCV-MJBXVCDLSA-N 1 1 366.414 2.787 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169010293 1000015276 /nfs/dbraw/zinc/01/52/76/1000015276.db2.gz CHLDJXDLQQBEJJ-VKJFTORMSA-N 1 1 353.463 2.765 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]2C1 ZINC001169035778 1000016554 /nfs/dbraw/zinc/01/65/54/1000016554.db2.gz LUDXHXDUPPEMQQ-ZJIFWQFVSA-N 1 1 353.463 2.621 20 5 FFBDMO CS(=O)(=O)c1cccc([C@@H]2CCC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)c1 ZINC001169046923 1000018423 /nfs/dbraw/zinc/01/84/23/1000018423.db2.gz OLCBYTPVVWIEOR-UAGQMJEPSA-N 1 1 366.483 2.715 20 5 FFBDMO COC(=O)[C@@](C)([NH3+])Cc1cn(-c2cc(C)c([N+](=O)[O-])cn2)c2ccccc12 ZINC001169116230 1000022242 /nfs/dbraw/zinc/02/22/42/1000022242.db2.gz WGPFQCQZNYRRKF-IBGZPJMESA-N 1 1 368.393 2.675 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)CC1 ZINC000769146517 1000446653 /nfs/dbraw/zinc/44/66/53/1000446653.db2.gz SKIQUBCOGKGSQS-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)CC1 ZINC000769146517 1000446656 /nfs/dbraw/zinc/44/66/56/1000446656.db2.gz SKIQUBCOGKGSQS-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194072 1001674348 /nfs/dbraw/zinc/67/43/48/1001674348.db2.gz ZBLYWHSTDNQAPE-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194072 1001674350 /nfs/dbraw/zinc/67/43/50/1001674350.db2.gz ZBLYWHSTDNQAPE-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CC[C@@H](C)C1 ZINC000790481345 1002390631 /nfs/dbraw/zinc/39/06/31/1002390631.db2.gz XLQFWMLJUBXTEO-ZBFHGGJFSA-N 1 1 359.430 2.948 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001185338864 1002922802 /nfs/dbraw/zinc/92/28/02/1002922802.db2.gz MXHXNODWORBUSL-CYBMUJFWSA-N 1 1 359.386 2.759 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@H](C)C1 ZINC000804380216 1003642222 /nfs/dbraw/zinc/64/22/22/1003642222.db2.gz ULMONUHUXPKODQ-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)[C@H](C)C1 ZINC000804380216 1003642227 /nfs/dbraw/zinc/64/22/27/1003642227.db2.gz ULMONUHUXPKODQ-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000804607273 1003741852 /nfs/dbraw/zinc/74/18/52/1003741852.db2.gz PZXDCPRNFYATRJ-HNNXBMFYSA-N 1 1 372.381 2.682 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@@]3(C)C2)c1[N+](=O)[O-] ZINC001197603229 1004296290 /nfs/dbraw/zinc/29/62/90/1004296290.db2.gz URTHTHGSIRNWNG-YVEFUNNKSA-N 1 1 366.418 2.580 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@@]3(C)C2)c1[N+](=O)[O-] ZINC001197603229 1004296298 /nfs/dbraw/zinc/29/62/98/1004296298.db2.gz URTHTHGSIRNWNG-YVEFUNNKSA-N 1 1 366.418 2.580 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](CO)c1ccccc1C ZINC001197817247 1004386779 /nfs/dbraw/zinc/38/67/79/1004386779.db2.gz ATWDSPHXZLFNOU-KRWDZBQOSA-N 1 1 373.409 2.516 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](CO)c1ccccc1C ZINC001197817247 1004386787 /nfs/dbraw/zinc/38/67/87/1004386787.db2.gz ATWDSPHXZLFNOU-KRWDZBQOSA-N 1 1 373.409 2.516 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000808218016 1004776996 /nfs/dbraw/zinc/77/69/96/1004776996.db2.gz MKCLFJITFNVINC-MRXNPFEDSA-N 1 1 371.441 2.654 20 5 FFBDMO CCC[N@@H+](Cn1cc([N+](=O)[O-])cn1)C1CCN(C(=O)c2ccccc2)CC1 ZINC000101539255 1004860244 /nfs/dbraw/zinc/86/02/44/1004860244.db2.gz ZKBJXMJZYVYMCW-UHFFFAOYSA-N 1 1 371.441 2.766 20 5 FFBDMO C[N@@H+](CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@@H]1C=CCCCCC1 ZINC001195488052 1004975720 /nfs/dbraw/zinc/97/57/20/1004975720.db2.gz NTNLNXIBMHFKCB-OAHLLOKOSA-N 1 1 367.471 2.694 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc3c(c2)CCC3)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325986 1016969241 /nfs/dbraw/zinc/96/92/41/1016969241.db2.gz PZGZMPMVMFSINW-LMFCIFFHSA-N 1 1 371.481 2.605 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccnn1C(F)F ZINC000851035190 1005857931 /nfs/dbraw/zinc/85/79/31/1005857931.db2.gz DTKYZUOQUWLSNK-ZDUSSCGKSA-N 1 1 366.324 2.618 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccnn1C(F)F ZINC000851035190 1005857932 /nfs/dbraw/zinc/85/79/32/1005857932.db2.gz DTKYZUOQUWLSNK-ZDUSSCGKSA-N 1 1 366.324 2.618 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCO1 ZINC000851035707 1005857937 /nfs/dbraw/zinc/85/79/37/1005857937.db2.gz WILNYIBUWIKHOO-FHLIZLRMSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CCCO1 ZINC000851035707 1005857940 /nfs/dbraw/zinc/85/79/40/1005857940.db2.gz WILNYIBUWIKHOO-FHLIZLRMSA-N 1 1 362.426 2.918 20 5 FFBDMO Cc1nn(CCC(=O)OC[C@@H]2CC[N@H+]2Cc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000851467545 1005889928 /nfs/dbraw/zinc/88/99/28/1005889928.db2.gz YLTVVWJLOAJQMX-KRWDZBQOSA-N 1 1 372.425 2.616 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000776574163 1005953169 /nfs/dbraw/zinc/95/31/69/1005953169.db2.gz DPWFYMLVCMFYSK-IRXDYDNUSA-N 1 1 358.394 2.790 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1 ZINC000776594142 1006009153 /nfs/dbraw/zinc/00/91/53/1006009153.db2.gz XADAPRKJODGROZ-UXHICEINSA-N 1 1 356.422 2.901 20 5 FFBDMO O=C(Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1)c1ccc([N+](=O)[O-])cn1 ZINC000882394178 1006381967 /nfs/dbraw/zinc/38/19/67/1006381967.db2.gz RBXHVRCOGDRAKW-QGZVFWFLSA-N 1 1 367.409 2.527 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1c[nH]nc1C ZINC001188058991 1006390307 /nfs/dbraw/zinc/39/03/07/1006390307.db2.gz STCZPECFMWFACJ-UHFFFAOYSA-N 1 1 361.405 2.975 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1cn[nH]c1C ZINC001188058991 1006390320 /nfs/dbraw/zinc/39/03/20/1006390320.db2.gz STCZPECFMWFACJ-UHFFFAOYSA-N 1 1 361.405 2.975 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2C2CCOCC2)nc1-c1ccccn1 ZINC000853505899 1006418858 /nfs/dbraw/zinc/41/88/58/1006418858.db2.gz SBXVOVSIKNXBSY-MRXNPFEDSA-N 1 1 357.414 2.702 20 5 FFBDMO CCC(=O)c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000853688358 1006505273 /nfs/dbraw/zinc/50/52/73/1006505273.db2.gz NAXGIJCMISLWTR-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCc1c(F)cc([N+](=O)[O-])cc1F ZINC000853698389 1006509527 /nfs/dbraw/zinc/50/95/27/1006509527.db2.gz PXRZVNRTODZIFJ-UHFFFAOYSA-N 1 1 374.344 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000853793870 1006539521 /nfs/dbraw/zinc/53/95/21/1006539521.db2.gz BIKVTYROJIAMOV-INIZCTEOSA-N 1 1 372.381 2.682 20 5 FFBDMO COc1cc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])ccc1OCCO ZINC000775190722 1006670841 /nfs/dbraw/zinc/67/08/41/1006670841.db2.gz BUNJVJCZKMUQGB-LBPRGKRZSA-N 1 1 364.373 2.964 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000855166672 1007149095 /nfs/dbraw/zinc/14/90/95/1007149095.db2.gz NXPGZWINGLZVEM-GFCCVEGCSA-N 1 1 364.402 2.722 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3nccc(C)c3[N+](=O)[O-])C2)ccn1 ZINC000856533768 1007873646 /nfs/dbraw/zinc/87/36/46/1007873646.db2.gz MISNCHJXHOPQTB-KRWDZBQOSA-N 1 1 371.441 2.803 20 5 FFBDMO CN1CC[N@@H+](C)Cc2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc21 ZINC000819466218 1008161064 /nfs/dbraw/zinc/16/10/64/1008161064.db2.gz LOVADGBTDKQAJI-LJQANCHMSA-N 1 1 356.426 2.622 20 5 FFBDMO Cc1ccc(CNC(=O)C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000886030523 1008519190 /nfs/dbraw/zinc/51/91/90/1008519190.db2.gz MJSKYBQBMMFBQD-UHFFFAOYSA-N 1 1 368.437 2.827 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000886241274 1008610903 /nfs/dbraw/zinc/61/09/03/1008610903.db2.gz TXDDOYHIIUSUNM-HIFRSBDPSA-N 1 1 364.446 2.973 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C ZINC000886241274 1008610912 /nfs/dbraw/zinc/61/09/12/1008610912.db2.gz TXDDOYHIIUSUNM-HIFRSBDPSA-N 1 1 364.446 2.973 20 5 FFBDMO CCc1ccccc1CC[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001178463556 1008997396 /nfs/dbraw/zinc/99/73/96/1008997396.db2.gz HIHKDUKPWRCGSK-RTBURBONSA-N 1 1 361.486 2.723 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000823950343 1009276929 /nfs/dbraw/zinc/27/69/29/1009276929.db2.gz IKRFZLQFFBCXID-OAHLLOKOSA-N 1 1 369.425 2.821 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000129982979 1009308005 /nfs/dbraw/zinc/30/80/05/1009308005.db2.gz RCYFDIWCDWOESV-UHFFFAOYSA-N 1 1 359.430 2.888 20 5 FFBDMO O=c1[nH]ccc2oc(C[N@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc21 ZINC001179938764 1009498565 /nfs/dbraw/zinc/49/85/65/1009498565.db2.gz XYYBCIKGUFPCIX-LLVKDONJSA-N 1 1 355.354 2.523 20 5 FFBDMO O=c1[nH]ccc2oc(C[N@@H+]3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)cc21 ZINC001179938764 1009498571 /nfs/dbraw/zinc/49/85/71/1009498571.db2.gz XYYBCIKGUFPCIX-LLVKDONJSA-N 1 1 355.354 2.523 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)c1[N+](=O)[O-] ZINC001180112364 1009568768 /nfs/dbraw/zinc/56/87/68/1009568768.db2.gz IQWGUVRYGWVMNJ-HIFRSBDPSA-N 1 1 362.382 2.990 20 5 FFBDMO C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861825786 1009574582 /nfs/dbraw/zinc/57/45/82/1009574582.db2.gz YLUHYBVXRWERTG-OALUTQOASA-N 1 1 369.421 2.683 20 5 FFBDMO CC(C)(NC(=O)c1cnn(-c2cc[nH+]cc2)c1)c1ccccc1[N+](=O)[O-] ZINC001274200947 1009589195 /nfs/dbraw/zinc/58/91/95/1009589195.db2.gz CDNPCSZFKHOYIH-UHFFFAOYSA-N 1 1 351.366 2.841 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001181839382 1010277692 /nfs/dbraw/zinc/27/76/92/1010277692.db2.gz LMWGOOBKSKJYAZ-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H](C[C@@H]4CCOC4)C3)n2)c1 ZINC000773255393 1010898454 /nfs/dbraw/zinc/89/84/54/1010898454.db2.gz AINXNQCOBYUTHX-HOTGVXAUSA-N 1 1 371.441 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1c2ccccc2C[N@H+]1C ZINC000868079539 1011160823 /nfs/dbraw/zinc/16/08/23/1011160823.db2.gz FGNBURUBYDTEKN-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1c2ccccc2C[N@@H+]1C ZINC000868079539 1011160826 /nfs/dbraw/zinc/16/08/26/1011160826.db2.gz FGNBURUBYDTEKN-KRWDZBQOSA-N 1 1 370.409 2.589 20 5 FFBDMO C[C@H]1CC[C@@H](CO)[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009881 1012179013 /nfs/dbraw/zinc/17/90/13/1012179013.db2.gz IVMJKFRONRSMKN-AAEUAGOBSA-N 1 1 355.385 2.687 20 5 FFBDMO C[C@@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H]1CO ZINC001173009673 1012179174 /nfs/dbraw/zinc/17/91/74/1012179174.db2.gz HAAJSOCHXHKDPK-PXAZEXFGSA-N 1 1 369.412 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3CCCC[C@H]3CO)CC2)c(F)c1 ZINC001173014931 1012185994 /nfs/dbraw/zinc/18/59/94/1012185994.db2.gz WPZYYLHCABUVCK-ZDUSSCGKSA-N 1 1 355.385 2.689 20 5 FFBDMO CN1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1(C)C ZINC001173016004 1012186758 /nfs/dbraw/zinc/18/67/58/1012186758.db2.gz YOBHQDLNUGXIBV-UHFFFAOYSA-N 1 1 368.428 2.868 20 5 FFBDMO C[N@@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1(C)C ZINC001173016004 1012186769 /nfs/dbraw/zinc/18/67/69/1012186769.db2.gz YOBHQDLNUGXIBV-UHFFFAOYSA-N 1 1 368.428 2.868 20 5 FFBDMO C[N@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1(C)C ZINC001173016004 1012186785 /nfs/dbraw/zinc/18/67/85/1012186785.db2.gz YOBHQDLNUGXIBV-UHFFFAOYSA-N 1 1 368.428 2.868 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@](O)(CF)CC2)c1F ZINC001173180150 1012325257 /nfs/dbraw/zinc/32/52/57/1012325257.db2.gz ITYXVFXDQMKBII-PXAZEXFGSA-N 1 1 358.385 2.860 20 5 FFBDMO COC(=O)C1(C)CC[NH+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173190300 1012333244 /nfs/dbraw/zinc/33/32/44/1012333244.db2.gz SIOHETCJYPTPNM-GFCCVEGCSA-N 1 1 368.405 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192452 1012334461 /nfs/dbraw/zinc/33/44/61/1012334461.db2.gz LDFMQNNHLZSCTN-ACJLOTCBSA-N 1 1 351.422 2.701 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)C[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197247 1012340550 /nfs/dbraw/zinc/34/05/50/1012340550.db2.gz RUPYHRRAZLPIBU-RWMBFGLXSA-N 1 1 368.405 2.805 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(CC2CC2)c1 ZINC000870377447 1012341950 /nfs/dbraw/zinc/34/19/50/1012341950.db2.gz LCSHDEGDDGYFGN-SFHVURJKSA-N 1 1 370.409 2.633 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(CC2CC2)c1 ZINC000870377447 1012341966 /nfs/dbraw/zinc/34/19/66/1012341966.db2.gz LCSHDEGDDGYFGN-SFHVURJKSA-N 1 1 370.409 2.633 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CCN2c2ncccn2)C1 ZINC001173222944 1012355335 /nfs/dbraw/zinc/35/53/35/1012355335.db2.gz DQNYTBZKAOSCHU-KXBFYZLASA-N 1 1 353.426 2.671 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(C(=O)c3ccco3)C[C@H]2C1 ZINC001173226179 1012361544 /nfs/dbraw/zinc/36/15/44/1012361544.db2.gz LBQVVCULMUJDJX-OIISXLGYSA-N 1 1 369.421 2.823 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173227428 1012362267 /nfs/dbraw/zinc/36/22/67/1012362267.db2.gz OGWJQOHYLNGZKW-WBVHZDCISA-N 1 1 358.442 2.891 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC001173229112 1012363308 /nfs/dbraw/zinc/36/33/08/1012363308.db2.gz PZQUSEGKGZKMQL-HYVNUMGLSA-N 1 1 353.422 2.807 20 5 FFBDMO C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1 ZINC000870873417 1012614766 /nfs/dbraw/zinc/61/47/66/1012614766.db2.gz CSIAIUJQUYUPRF-HEFCMCLBSA-N 1 1 369.421 2.757 20 5 FFBDMO COc1ccc2c(c1)CCCN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C2 ZINC000870881528 1012619884 /nfs/dbraw/zinc/61/98/84/1012619884.db2.gz XZZZNAVWBGMKTH-HXUWFJFHSA-N 1 1 369.421 2.752 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801836643 1019433927 /nfs/dbraw/zinc/43/39/27/1019433927.db2.gz POWUJVISLNVLMR-OCCSQVGLSA-N 1 1 372.400 2.881 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](Cc3nccs3)C2)nc1-c1ccccn1 ZINC000902649372 1020373260 /nfs/dbraw/zinc/37/32/60/1020373260.db2.gz JZUXFKSYZVOODA-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](Cc3nccs3)C2)nc1-c1ccccn1 ZINC000902649372 1020373271 /nfs/dbraw/zinc/37/32/71/1020373271.db2.gz JZUXFKSYZVOODA-CYBMUJFWSA-N 1 1 370.438 2.832 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1CNC(=O)OC(C)(C)C ZINC000932709607 1020880688 /nfs/dbraw/zinc/88/06/88/1020880688.db2.gz JUGQOYSZLABFNR-KGLIPLIRSA-N 1 1 364.446 2.973 20 5 FFBDMO Cc1csc(C[C@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933134142 1020960541 /nfs/dbraw/zinc/96/05/41/1020960541.db2.gz LCDLSNDGWAHYPJ-CQSZACIVSA-N 1 1 374.466 2.887 20 5 FFBDMO Cc1csc(C[C@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000933134142 1020960550 /nfs/dbraw/zinc/96/05/50/1020960550.db2.gz LCDLSNDGWAHYPJ-CQSZACIVSA-N 1 1 374.466 2.887 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000749675148 1021018867 /nfs/dbraw/zinc/01/88/67/1021018867.db2.gz XMMIQRTVESFAEI-OAQYLSRUSA-N 1 1 369.465 2.925 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000778395835 1021911265 /nfs/dbraw/zinc/91/12/65/1021911265.db2.gz VRXHFHGCWGSZDY-AWEZNQCLSA-N 1 1 369.406 2.516 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1 ZINC000778395835 1021911267 /nfs/dbraw/zinc/91/12/67/1021911267.db2.gz VRXHFHGCWGSZDY-AWEZNQCLSA-N 1 1 369.406 2.516 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829349784 1033113492 /nfs/dbraw/zinc/11/34/92/1033113492.db2.gz IRHNVVMNVDRYHS-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829349784 1033113499 /nfs/dbraw/zinc/11/34/99/1033113499.db2.gz IRHNVVMNVDRYHS-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1nn(C[N@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803951 1023208545 /nfs/dbraw/zinc/20/85/45/1023208545.db2.gz PFBZYUVUBIGGKA-FZMZJTMJSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000752803951 1023208549 /nfs/dbraw/zinc/20/85/49/1023208549.db2.gz PFBZYUVUBIGGKA-FZMZJTMJSA-N 1 1 367.450 2.601 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](C4CCOCC4)C3)n2)c1 ZINC000754778722 1023515761 /nfs/dbraw/zinc/51/57/61/1023515761.db2.gz MBUDPDARXOFQGG-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@@]1(COC(=O)Cn2cc([N+](=O)[O-])cn2)CCCC[N@H+]1Cc1ccccc1 ZINC000755917310 1023650472 /nfs/dbraw/zinc/65/04/72/1023650472.db2.gz WDEKIYBECVAUET-IBGZPJMESA-N 1 1 372.425 2.779 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@H]2C1 ZINC001123302012 1023731486 /nfs/dbraw/zinc/73/14/86/1023731486.db2.gz VGULQNHDBBOSEU-DLOVCJGASA-N 1 1 370.356 2.658 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@H]32)n1 ZINC000756624640 1023737062 /nfs/dbraw/zinc/73/70/62/1023737062.db2.gz BMSIWOMFRRLRQT-GDBMZVCRSA-N 1 1 369.425 2.568 20 5 FFBDMO O=C1O[C@H](C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1c1ccccc1 ZINC000757168085 1023808300 /nfs/dbraw/zinc/80/83/00/1023808300.db2.gz SNNOUTPDEVKTTD-MRXNPFEDSA-N 1 1 353.378 2.978 20 5 FFBDMO O=C1O[C@H](C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1c1ccccc1 ZINC000757168085 1023808309 /nfs/dbraw/zinc/80/83/09/1023808309.db2.gz SNNOUTPDEVKTTD-MRXNPFEDSA-N 1 1 353.378 2.978 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000192236022 1024037898 /nfs/dbraw/zinc/03/78/98/1024037898.db2.gz FVTFKMSFMFIGPJ-UHFFFAOYSA-N 1 1 370.413 2.507 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000839417180 1026672723 /nfs/dbraw/zinc/67/27/23/1026672723.db2.gz ZNOKBOQNXQNGKM-ZDUSSCGKSA-N 1 1 364.402 2.676 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000839417180 1026672726 /nfs/dbraw/zinc/67/27/26/1026672726.db2.gz ZNOKBOQNXQNGKM-ZDUSSCGKSA-N 1 1 364.402 2.676 20 5 FFBDMO CN(CCC[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000839655188 1026777159 /nfs/dbraw/zinc/77/71/59/1026777159.db2.gz TVOPXJOUEBRWOF-INIZCTEOSA-N 1 1 367.446 2.817 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@@H]2CCC[N@@H+]2C)[nH]n1 ZINC001141720565 1026860516 /nfs/dbraw/zinc/86/05/16/1026860516.db2.gz OURSFORTZUQYAF-HNNXBMFYSA-N 1 1 359.386 2.736 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([C@@H]2CCC[N@H+]2C)[nH]n1 ZINC001141720565 1026860524 /nfs/dbraw/zinc/86/05/24/1026860524.db2.gz OURSFORTZUQYAF-HNNXBMFYSA-N 1 1 359.386 2.736 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC=C(c3ccncc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000795734489 1028072311 /nfs/dbraw/zinc/07/23/11/1028072311.db2.gz DKKCUQMBLRKYJP-UHFFFAOYSA-N 1 1 350.382 2.790 20 5 FFBDMO Cc1nn(C[N@H+]2CCC=C(c3ccncc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000795734489 1028072328 /nfs/dbraw/zinc/07/23/28/1028072328.db2.gz DKKCUQMBLRKYJP-UHFFFAOYSA-N 1 1 350.382 2.790 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CC[C@](F)(C[NH3+])C1 ZINC001161245778 1028091800 /nfs/dbraw/zinc/09/18/00/1028091800.db2.gz GBSYMMNGETWSHU-UNMCSNQZSA-N 1 1 365.452 2.762 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@@H](CO)c2cc(F)cc(F)c2)ncc1[N+](=O)[O-] ZINC001161708033 1028289608 /nfs/dbraw/zinc/28/96/08/1028289608.db2.gz HDCLFEMFUYZQMI-BWPKMQGJSA-N 1 1 364.352 2.946 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC001154616014 1028377754 /nfs/dbraw/zinc/37/77/54/1028377754.db2.gz LLECEZFNGQZTAX-UHFFFAOYSA-N 1 1 360.417 2.870 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001154713356 1028419236 /nfs/dbraw/zinc/41/92/36/1028419236.db2.gz JPGIVEWQERUMPZ-ATNYBXOESA-N 1 1 363.458 2.906 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)ncnc2N1CC[N@H+]2CCc3ccccc3[C@H]2C1 ZINC001155090612 1028574990 /nfs/dbraw/zinc/57/49/90/1028574990.db2.gz GVOIYCLASAHRPC-LJQANCHMSA-N 1 1 361.405 2.957 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000781150165 1029025429 /nfs/dbraw/zinc/02/54/29/1029025429.db2.gz OVFPOAKECMBJOJ-UHFFFAOYSA-N 1 1 370.413 2.956 20 5 FFBDMO Nc1cc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)ncc1[N+](=O)[O-] ZINC001156317358 1029141994 /nfs/dbraw/zinc/14/19/94/1029141994.db2.gz LYJUSNZELZZLQZ-HLLBOEOZSA-N 1 1 353.426 2.895 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1ncc([N+](=O)[O-])cc1N ZINC001156341914 1029155898 /nfs/dbraw/zinc/15/58/98/1029155898.db2.gz RTNNQCSVBOIDRF-KSSFIOAISA-N 1 1 355.442 2.919 20 5 FFBDMO CCOc1nc(NCc2ccc(C[NH+]3CCOCC3)cc2)ccc1[N+](=O)[O-] ZINC001156392106 1029178234 /nfs/dbraw/zinc/17/82/34/1029178234.db2.gz IXDADSGWPRDBKS-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO [NH3+][C@H]1CN(c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)nn2)CCC1(F)F ZINC001164326967 1029244914 /nfs/dbraw/zinc/24/49/14/1029244914.db2.gz KUFLAZSECQQSQX-ZDUSSCGKSA-N 1 1 369.759 2.878 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(N2CC3(C2)C[NH+](Cc2ccccc2)C3)n1 ZINC001165123070 1029407592 /nfs/dbraw/zinc/40/75/92/1029407592.db2.gz YXNQXKYGIXYQFL-UHFFFAOYSA-N 1 1 359.817 2.669 20 5 FFBDMO Nc1[nH]c2ccc(C(=O)n3c4ccccc4cc4c(=O)c(N)ccc3-4)cc2[nH+]1 ZINC001156975539 1029428753 /nfs/dbraw/zinc/42/87/53/1029428753.db2.gz PFQJJXAQPRCXPC-UHFFFAOYSA-N 1 1 369.384 2.836 20 5 FFBDMO COc1nc(N(C)[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)ncc1[N+](=O)[O-] ZINC001165184599 1029440274 /nfs/dbraw/zinc/44/02/74/1029440274.db2.gz XQFHDLZIBPQBPZ-PBHICJAKSA-N 1 1 371.441 2.740 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3ccc(-c4ccc(F)c([N+](=O)[O-])c4)nn3)C[C@@H]21 ZINC001157282990 1029535841 /nfs/dbraw/zinc/53/58/41/1029535841.db2.gz SCKLPJXAZVFGPE-DYVFJYSZSA-N 1 1 357.389 2.721 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(C(F)(F)c3ccc([N+](=O)[O-])c(Cl)n3)C[C@H]2C1 ZINC001157692605 1029647155 /nfs/dbraw/zinc/64/71/55/1029647155.db2.gz XEQYHTQUBBZLFS-PHIMTYICSA-N 1 1 360.792 2.966 20 5 FFBDMO COc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001165202758 1029889506 /nfs/dbraw/zinc/88/95/06/1029889506.db2.gz OEJRAQUOLMZUNB-KBPBESRZSA-N 1 1 371.441 2.801 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cn3cc(-c4ccc([N+](=O)[O-])cc4)cn3)C2)OCCO1 ZINC000784039757 1030435404 /nfs/dbraw/zinc/43/54/04/1030435404.db2.gz VBTMDHMULBWNTI-KRWDZBQOSA-N 1 1 372.425 2.891 20 5 FFBDMO C[N@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C[C@@H]1CC=CCC1 ZINC000784394517 1030602731 /nfs/dbraw/zinc/60/27/31/1030602731.db2.gz TXJOLXLOTXSFPA-QGZVFWFLSA-N 1 1 372.469 2.532 20 5 FFBDMO C[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C[C@@]1(O)CCc2ccccc21 ZINC000842626627 1030850828 /nfs/dbraw/zinc/85/08/28/1030850828.db2.gz WIVMVUGNXIVZAU-IBGZPJMESA-N 1 1 352.394 2.668 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796703622 1030887537 /nfs/dbraw/zinc/88/75/37/1030887537.db2.gz BMYOBZVNNWJNST-MRXNPFEDSA-N 1 1 365.430 2.963 20 5 FFBDMO CC(C)NC(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796719257 1030894046 /nfs/dbraw/zinc/89/40/46/1030894046.db2.gz YMOGDEHYAHNBMT-DLBZAZTESA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796719265 1030895535 /nfs/dbraw/zinc/89/55/35/1030895535.db2.gz YMOGDEHYAHNBMT-SJORKVTESA-N 1 1 365.430 2.617 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@H](c3ccccn3)C2)nc1-c1ccncc1 ZINC000799158730 1031673635 /nfs/dbraw/zinc/67/36/35/1031673635.db2.gz RGVDZRYOCUBPTN-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](c3ccccn3)C2)nc1-c1ccncc1 ZINC000799158730 1031673642 /nfs/dbraw/zinc/67/36/42/1031673642.db2.gz RGVDZRYOCUBPTN-HNNXBMFYSA-N 1 1 350.382 2.695 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001115530626 1031787175 /nfs/dbraw/zinc/78/71/75/1031787175.db2.gz IAMCBOBUCBCSRJ-IAGOWNOFSA-N 1 1 363.433 2.708 20 5 FFBDMO O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000799632612 1031844779 /nfs/dbraw/zinc/84/47/79/1031844779.db2.gz OEXPPEHJLRHBMW-QGZVFWFLSA-N 1 1 372.425 2.779 20 5 FFBDMO O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000799632611 1031846887 /nfs/dbraw/zinc/84/68/87/1031846887.db2.gz OEXPPEHJLRHBMW-KRWDZBQOSA-N 1 1 372.425 2.779 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H]2CC[NH+]2CCC(C)CC2)c1[N+](=O)[O-] ZINC001151737587 1032017866 /nfs/dbraw/zinc/01/78/66/1032017866.db2.gz FBWBUWUCCGHQOT-CQSZACIVSA-N 1 1 363.462 2.607 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1cc([N+](=O)[O-])ccc1F ZINC000831164323 1033974922 /nfs/dbraw/zinc/97/49/22/1033974922.db2.gz BTQJKKYMSBJTQX-XYPHTWIQSA-N 1 1 365.405 2.688 20 5 FFBDMO COc1cc(Br)c(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1 ZINC001226279331 1034609829 /nfs/dbraw/zinc/60/98/29/1034609829.db2.gz JMELJBPAVZJBGD-SECBINFHSA-N 1 1 368.187 2.956 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001227062132 1034923627 /nfs/dbraw/zinc/92/36/27/1034923627.db2.gz GIRIOEIYYLFXQH-QGZVFWFLSA-N 1 1 357.410 2.968 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC001140097019 1035341040 /nfs/dbraw/zinc/34/10/40/1035341040.db2.gz HVLSXAPBNOSLQG-AWEZNQCLSA-N 1 1 351.834 2.924 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001227466067 1035565736 /nfs/dbraw/zinc/56/57/36/1035565736.db2.gz KNYHIXNOCDKPHT-MRXNPFEDSA-N 1 1 373.365 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001227466067 1035565743 /nfs/dbraw/zinc/56/57/43/1035565743.db2.gz KNYHIXNOCDKPHT-MRXNPFEDSA-N 1 1 373.365 2.783 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc(OC(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227603951 1035633558 /nfs/dbraw/zinc/63/35/58/1035633558.db2.gz NKCVIGCOLHGKOQ-OLXJLDBKSA-N 1 1 360.288 2.676 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3ccc(OC(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227603951 1035633568 /nfs/dbraw/zinc/63/35/68/1035633568.db2.gz NKCVIGCOLHGKOQ-OLXJLDBKSA-N 1 1 360.288 2.676 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3c(Cl)cccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001227999864 1035861510 /nfs/dbraw/zinc/86/15/10/1035861510.db2.gz FSGVMMUMRPNMKW-AZHAFVHUSA-N 1 1 354.790 2.794 20 5 FFBDMO Cc1nc(O[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229375861 1036638975 /nfs/dbraw/zinc/63/89/75/1036638975.db2.gz OOFZGKKGKNISQG-WFASDCNBSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375861 1036638977 /nfs/dbraw/zinc/63/89/77/1036638977.db2.gz OOFZGKKGKNISQG-WFASDCNBSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229375861 1036638979 /nfs/dbraw/zinc/63/89/79/1036638979.db2.gz OOFZGKKGKNISQG-WFASDCNBSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@@H+](Cc3ccccc3Cl)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229378256 1036640488 /nfs/dbraw/zinc/64/04/88/1036640488.db2.gz JMNPNDOGSOSFKZ-LBPRGKRZSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@@H+](Cc3ccccc3Cl)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229378256 1036640507 /nfs/dbraw/zinc/64/05/07/1036640507.db2.gz JMNPNDOGSOSFKZ-LBPRGKRZSA-N 1 1 364.789 2.706 20 5 FFBDMO COc1cc(N2CCC([NH2+]CC[C@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC001256087528 1038373610 /nfs/dbraw/zinc/37/36/10/1038373610.db2.gz DSOBNOHCFKHSPM-MRXNPFEDSA-N 1 1 362.474 2.646 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](N4CCCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256099900 1038383471 /nfs/dbraw/zinc/38/34/71/1038383471.db2.gz ZKJYLUZFTWCAOI-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@@H]([NH+]4CCCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256099900 1038383484 /nfs/dbraw/zinc/38/34/84/1038383484.db2.gz ZKJYLUZFTWCAOI-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@]4(CCO4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100364 1038384963 /nfs/dbraw/zinc/38/49/63/1038384963.db2.gz GVYGUKNARHELOI-LJQANCHMSA-N 1 1 361.442 2.827 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccc([N+](=O)[O-])c(Cl)c3)o2)C[C@H](C)O1 ZINC001258136896 1039215560 /nfs/dbraw/zinc/21/55/60/1039215560.db2.gz DENWUWJCLPHJCQ-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@H]3CC[C@H](C)CN3)CC2)ccc1[N+](=O)[O-] ZINC001246111248 1039246544 /nfs/dbraw/zinc/24/65/44/1039246544.db2.gz IPBGZKHFIYZNTA-GOEBONIOSA-N 1 1 362.474 2.550 20 5 FFBDMO COc1cc(N2CCC(NC[C@H]3CC[C@H](C)C[NH2+]3)CC2)ccc1[N+](=O)[O-] ZINC001246111248 1039246548 /nfs/dbraw/zinc/24/65/48/1039246548.db2.gz IPBGZKHFIYZNTA-GOEBONIOSA-N 1 1 362.474 2.550 20 5 FFBDMO C[C@H]1C[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)N1 ZINC001246944141 1039543820 /nfs/dbraw/zinc/54/38/20/1039543820.db2.gz QHLXTTVQUBCCGQ-RYUDHWBXSA-N 1 1 354.401 2.524 20 5 FFBDMO O=[N+]([O-])c1cccnc1-c1nc(-c2ccc(C[NH+]3CCOCC3)cc2)no1 ZINC001213199817 1040330784 /nfs/dbraw/zinc/33/07/84/1040330784.db2.gz HFIHWSQEDYSZQP-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCC[C@@](F)(CO)CC3)CC2)cc1 ZINC001254475021 1040742660 /nfs/dbraw/zinc/74/26/60/1040742660.db2.gz YGQWUYDVVMXKCA-SFHVURJKSA-N 1 1 351.422 2.750 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCN(C(=O)c3ccco3)[C@@H]2C1 ZINC001254555877 1040795069 /nfs/dbraw/zinc/79/50/69/1040795069.db2.gz IQUVFZNOGKGGHK-QILLFSRXSA-N 1 1 369.421 2.965 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560822 1040796549 /nfs/dbraw/zinc/79/65/49/1040796549.db2.gz HNPSRMWQAWVNSF-HOCLYGCPSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560822 1040796561 /nfs/dbraw/zinc/79/65/61/1040796561.db2.gz HNPSRMWQAWVNSF-HOCLYGCPSA-N 1 1 373.457 2.773 20 5 FFBDMO COc1ccnc(O[C@H]2CCC[N@H+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254567331 1040805787 /nfs/dbraw/zinc/80/57/87/1040805787.db2.gz BPDGQZPBHQOSIN-HOCLYGCPSA-N 1 1 372.425 2.868 20 5 FFBDMO COC(=O)c1ccc2c(c1)CC[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594432 1040821332 /nfs/dbraw/zinc/82/13/32/1040821332.db2.gz QWBIMSMIGAYEMJ-LJQANCHMSA-N 1 1 352.390 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593977 1040821983 /nfs/dbraw/zinc/82/19/83/1040821983.db2.gz OPARRKRNDZHZLL-YESZJQIVSA-N 1 1 359.426 2.756 20 5 FFBDMO O=C(NC1CCC1)[C@H]1C[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2C1 ZINC001254595468 1040824937 /nfs/dbraw/zinc/82/49/37/1040824937.db2.gz KARDGEQUQUQKPQ-LJCCNALRSA-N 1 1 369.465 2.689 20 5 FFBDMO C[N@@H+](C1CCOCC1)C1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254603812 1040831534 /nfs/dbraw/zinc/83/15/34/1040831534.db2.gz QXPRMFBWBFWLLB-HXUWFJFHSA-N 1 1 359.470 2.637 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1c1ccccc1 ZINC001254605363 1040835083 /nfs/dbraw/zinc/83/50/83/1040835083.db2.gz BMOMYFNJIKNFGO-SLFFLAALSA-N 1 1 366.417 2.951 20 5 FFBDMO COc1ccnc(O[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)c1 ZINC001254610261 1040840011 /nfs/dbraw/zinc/84/00/11/1040840011.db2.gz ISFVKYTZZQJOTJ-FUHWJXTLSA-N 1 1 355.394 2.619 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)[C@@H]2C1 ZINC001262826962 1041881035 /nfs/dbraw/zinc/88/10/35/1041881035.db2.gz UFBXPGHMMCGYMV-UMNHJUIQSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC001311321027 1043885564 /nfs/dbraw/zinc/88/55/64/1043885564.db2.gz PRVHKQFFCVCGOH-IAGOWNOFSA-N 1 1 362.430 2.668 20 5 FFBDMO O=C(NCCC1CC[NH+](CCCC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001319019615 1044985013 /nfs/dbraw/zinc/98/50/13/1044985013.db2.gz YIHRWOJEZISDPB-QZTJIDSGSA-N 1 1 351.491 2.840 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001319019651 1044985421 /nfs/dbraw/zinc/98/54/21/1044985421.db2.gz ZIUZMVWBPSUYGI-QZTJIDSGSA-N 1 1 371.437 2.816 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001539394163 1070630141 /nfs/dbraw/zinc/63/01/41/1070630141.db2.gz CHTLTFITIYKEFU-AWEZNQCLSA-N 1 1 360.439 2.932 20 5 FFBDMO CC(C)(C(=O)NCC[N@H+]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1F ZINC001539537820 1070655106 /nfs/dbraw/zinc/65/51/06/1070655106.db2.gz XAHINRUYBMEZFJ-UHFFFAOYSA-N 1 1 351.422 2.860 20 5 FFBDMO Cc1c(C(=O)N(C)CCc2ccccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001323191749 1046379586 /nfs/dbraw/zinc/37/95/86/1046379586.db2.gz GQQAVXYCOWBRSM-UHFFFAOYSA-N 1 1 365.393 2.799 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC001331329572 1047867623 /nfs/dbraw/zinc/86/76/23/1047867623.db2.gz JMHKTJCOOVIVFX-DOMZBBRYSA-N 1 1 368.865 2.849 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC001328553232 1048352925 /nfs/dbraw/zinc/35/29/25/1048352925.db2.gz LHKCUNXDXAEKEC-XJKSGUPXSA-N 1 1 361.398 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC001328553232 1048352937 /nfs/dbraw/zinc/35/29/37/1048352937.db2.gz LHKCUNXDXAEKEC-XJKSGUPXSA-N 1 1 361.398 2.741 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC001329881156 1048947575 /nfs/dbraw/zinc/94/75/75/1048947575.db2.gz USXCPUABKYBFMA-QMTHXVAHSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1nc(N2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@]3(C)C2)ncc1[N+](=O)[O-] ZINC001330113352 1049043828 /nfs/dbraw/zinc/04/38/28/1049043828.db2.gz CLPDSTRJKCYLNI-QFBILLFUSA-N 1 1 353.426 2.652 20 5 FFBDMO COC(=O)/C=C/c1ccc(N[C@H]2CCC[N@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153576 1049434498 /nfs/dbraw/zinc/43/44/98/1049434498.db2.gz ZREYMPCLEBOTQN-DYLGSBMWSA-N 1 1 351.378 2.627 20 5 FFBDMO COC(=O)/C=C/c1ccc(N[C@H]2CCC[N@@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153576 1049434501 /nfs/dbraw/zinc/43/45/01/1049434501.db2.gz ZREYMPCLEBOTQN-DYLGSBMWSA-N 1 1 351.378 2.627 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001331098209 1049471479 /nfs/dbraw/zinc/47/14/79/1049471479.db2.gz QCVWVDOTJAEUJG-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])cc1C(F)(F)F ZINC001307227608 1052272272 /nfs/dbraw/zinc/27/22/72/1052272272.db2.gz IVTJVYWUTSJWBV-KBPBESRZSA-N 1 1 373.375 2.957 20 5 FFBDMO Cc1c(C(=O)NCc2cccc([N+](=O)[O-])c2C)cnn1-c1cc[nH+]cc1 ZINC001343560359 1052307314 /nfs/dbraw/zinc/30/73/14/1052307314.db2.gz MEKQVTRJSNQCNI-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC001308134715 1052414727 /nfs/dbraw/zinc/41/47/27/1052414727.db2.gz RSFNWAUBAMRRBP-ZUZCIYMTSA-N 1 1 355.847 2.872 20 5 FFBDMO C[C@@]12CSC[C@@H]1C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC001308134715 1052414731 /nfs/dbraw/zinc/41/47/31/1052414731.db2.gz RSFNWAUBAMRRBP-ZUZCIYMTSA-N 1 1 355.847 2.872 20 5 FFBDMO C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1nc(C(C)(C)C)no1 ZINC001308740722 1052492754 /nfs/dbraw/zinc/49/27/54/1052492754.db2.gz XRBDXHGPBGSNOT-GFCCVEGCSA-N 1 1 374.445 2.990 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001345925567 1052673531 /nfs/dbraw/zinc/67/35/31/1052673531.db2.gz UGOXXYGAUGYNAB-QWHCGFSZSA-N 1 1 362.382 2.540 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC001347505292 1054052843 /nfs/dbraw/zinc/05/28/43/1054052843.db2.gz WQZZRNVWHPSOBZ-INIZCTEOSA-N 1 1 363.461 2.755 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNc3c(C)cncc3[N+](=O)[O-])CC2)oc1C ZINC001338680959 1055726850 /nfs/dbraw/zinc/72/68/50/1055726850.db2.gz GTQSFRNDJRXODS-UHFFFAOYSA-N 1 1 359.430 2.649 20 5 FFBDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001350499279 1055802578 /nfs/dbraw/zinc/80/25/78/1055802578.db2.gz FBHZKIPVLZSNMF-MNOVXSKESA-N 1 1 365.821 2.713 20 5 FFBDMO C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001350499279 1055802585 /nfs/dbraw/zinc/80/25/85/1055802585.db2.gz FBHZKIPVLZSNMF-MNOVXSKESA-N 1 1 365.821 2.713 20 5 FFBDMO CC[N@@H+](CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)CCC(F)(F)F ZINC001339007871 1056009546 /nfs/dbraw/zinc/00/95/46/1056009546.db2.gz XOJFPWUNDGLSKP-UHFFFAOYSA-N 1 1 374.363 2.894 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2ncnc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000611709970 1056448167 /nfs/dbraw/zinc/44/81/67/1056448167.db2.gz XJLICQQMXPHXRU-OKILXGFUSA-N 1 1 359.430 2.839 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c(Br)c2)no1 ZINC001544649137 1071672550 /nfs/dbraw/zinc/67/25/50/1071672550.db2.gz OCIJFDAEGWLDSN-UHFFFAOYSA-N 1 1 369.175 2.659 20 5 FFBDMO Nc1ccc(C(=O)N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)cc1[N+](=O)[O-] ZINC001451880688 1059158576 /nfs/dbraw/zinc/15/85/76/1059158576.db2.gz PZUKTOGBOUGKQB-APWZRJJASA-N 1 1 366.421 2.524 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000848480977 1060114965 /nfs/dbraw/zinc/11/49/65/1060114965.db2.gz UALIWOPKIRWZHV-UYAOXDASSA-N 1 1 373.453 2.761 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](C2CCOCC2)C1 ZINC000848481751 1060117481 /nfs/dbraw/zinc/11/74/81/1060117481.db2.gz CQRJQHWOQYASOZ-PKOBYXMFSA-N 1 1 373.453 2.617 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000848585181 1060314965 /nfs/dbraw/zinc/31/49/65/1060314965.db2.gz MVHKJARKJBATEW-WFASDCNBSA-N 1 1 369.368 2.509 20 5 FFBDMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC001458045752 1060500262 /nfs/dbraw/zinc/50/02/62/1060500262.db2.gz KKAMCCCPZKVYJS-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001458414777 1060585727 /nfs/dbraw/zinc/58/57/27/1060585727.db2.gz MEGFNVVQJSRBPC-UHFFFAOYSA-N 1 1 365.865 2.514 20 5 FFBDMO CN(CCCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-])CC[NH+](C)C ZINC001458414777 1060585737 /nfs/dbraw/zinc/58/57/37/1060585737.db2.gz MEGFNVVQJSRBPC-UHFFFAOYSA-N 1 1 365.865 2.514 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001458447292 1060593716 /nfs/dbraw/zinc/59/37/16/1060593716.db2.gz HDQQUJFYRPGEMV-SJORKVTESA-N 1 1 355.442 2.830 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848784343 1060690258 /nfs/dbraw/zinc/69/02/58/1060690258.db2.gz ZIZRZWZLSWGIJR-GDBMZVCRSA-N 1 1 360.414 2.980 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC001460715085 1061072634 /nfs/dbraw/zinc/07/26/34/1061072634.db2.gz BOYRGCCYSPYHCI-CQSZACIVSA-N 1 1 363.414 2.507 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC001460715085 1061072649 /nfs/dbraw/zinc/07/26/49/1061072649.db2.gz BOYRGCCYSPYHCI-CQSZACIVSA-N 1 1 363.414 2.507 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](c3ncccn3)C2)cccc1[N+](=O)[O-] ZINC001460847042 1061128059 /nfs/dbraw/zinc/12/80/59/1061128059.db2.gz HMZLELURAPUFKQ-AWEZNQCLSA-N 1 1 355.398 2.511 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC001463064634 1061920778 /nfs/dbraw/zinc/92/07/78/1061920778.db2.gz MIGFTXXIYPRUOG-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1 ZINC001532914490 1063206356 /nfs/dbraw/zinc/20/63/56/1063206356.db2.gz LBAGHLYGRPWFCK-QGZVFWFLSA-N 1 1 356.426 2.842 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC001440037279 1063253878 /nfs/dbraw/zinc/25/38/78/1063253878.db2.gz ZWTLXKISZMBCJZ-UHFFFAOYSA-N 1 1 360.458 2.657 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001465900089 1063256069 /nfs/dbraw/zinc/25/60/69/1063256069.db2.gz NFOFCXZTVPPUMS-ZBEGNZNMSA-N 1 1 354.410 2.543 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC001466389167 1063419953 /nfs/dbraw/zinc/41/99/53/1063419953.db2.gz QGYUZBMVUBEFFF-ONGXEEELSA-N 1 1 371.235 2.880 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C)n3)CC[NH2+]2)cc1 ZINC001467501695 1063762015 /nfs/dbraw/zinc/76/20/15/1063762015.db2.gz FSTZLQQBRJZHLE-GOSISDBHSA-N 1 1 354.410 2.647 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001467570741 1063787665 /nfs/dbraw/zinc/78/76/65/1063787665.db2.gz QOIJWKFXPVXJDU-KBPBESRZSA-N 1 1 359.430 2.839 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC001468766698 1064035486 /nfs/dbraw/zinc/03/54/86/1064035486.db2.gz LQQWJRZAKPLBSC-CYBMUJFWSA-N 1 1 369.849 2.960 20 5 FFBDMO Cc1[nH]c(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)c(C)[nH+]1 ZINC001471980510 1064877668 /nfs/dbraw/zinc/87/76/68/1064877668.db2.gz TZNFZXIMPIQVAC-UHFFFAOYSA-N 1 1 367.203 2.556 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)[C@@H](C)c1ccccc1 ZINC001473292538 1065236980 /nfs/dbraw/zinc/23/69/80/1065236980.db2.gz AFSZLZALFZRITN-HNNXBMFYSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@@H](C)c1ccccc1 ZINC001473292538 1065236989 /nfs/dbraw/zinc/23/69/89/1065236989.db2.gz AFSZLZALFZRITN-HNNXBMFYSA-N 1 1 357.410 2.897 20 5 FFBDMO C[C@@]([NH3+])(C(=O)Nc1cc(C(F)(F)F)ccn1)c1cccc([N+](=O)[O-])c1 ZINC001576085162 1078193887 /nfs/dbraw/zinc/19/38/87/1078193887.db2.gz JDPXTARPXOOFKL-AWEZNQCLSA-N 1 1 354.288 2.821 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001473906608 1065416732 /nfs/dbraw/zinc/41/67/32/1065416732.db2.gz LAYXJLUCAFIPEO-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@H](C)Oc1cccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)n1 ZINC001577001978 1078293419 /nfs/dbraw/zinc/29/34/19/1078293419.db2.gz ASISXALJNXJZTJ-KPZWWZAWSA-N 1 1 358.398 2.980 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001583597006 1079238629 /nfs/dbraw/zinc/23/86/29/1079238629.db2.gz VRDYYNNMXZKNAZ-UHFFFAOYSA-N 1 1 360.817 2.677 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@H]1C(C)(C)C ZINC001557279793 1075832527 /nfs/dbraw/zinc/83/25/27/1075832527.db2.gz FKQQGOPOUCIQFB-KRWDZBQOSA-N 1 1 362.474 2.976 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)Nc1nc(-c3ccc([N+](=O)[O-])cc3)c[nH]1)C2 ZINC001559006324 1076114687 /nfs/dbraw/zinc/11/46/87/1076114687.db2.gz DUEZEBMUXODMKN-ZDUSSCGKSA-N 1 1 366.381 2.691 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(NCC[NH+]2CCSCC2)cc1C ZINC001559101521 1076125780 /nfs/dbraw/zinc/12/57/80/1076125780.db2.gz KYSCBLWIYWXRKE-UHFFFAOYSA-N 1 1 353.444 2.541 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559205620 1076134592 /nfs/dbraw/zinc/13/45/92/1076134592.db2.gz YUWBMSVMDKRWNI-UHFFFAOYSA-N 1 1 365.865 2.514 20 5 FFBDMO CN(CCCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-])CC[NH+](C)C ZINC001559205620 1076134593 /nfs/dbraw/zinc/13/45/93/1076134593.db2.gz YUWBMSVMDKRWNI-UHFFFAOYSA-N 1 1 365.865 2.514 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001561350437 1076366648 /nfs/dbraw/zinc/36/66/48/1076366648.db2.gz KNHKNPNTDANAFQ-HZSPNIEDSA-N 1 1 369.487 2.548 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)c1 ZINC001561945610 1076451240 /nfs/dbraw/zinc/45/12/40/1076451240.db2.gz FOAGKMDDDNICCM-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CC/C=C\c2ccccc2)CC1 ZINC001569699888 1077160382 /nfs/dbraw/zinc/16/03/82/1077160382.db2.gz HHWDVODYIBIAAP-RJOCJTBNSA-N 1 1 371.481 2.973 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C ZINC001570910285 1077242272 /nfs/dbraw/zinc/24/22/72/1077242272.db2.gz BYYVFYSDOUNYQD-GOSISDBHSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[N@H+]1CCC[C@@H](C)C1 ZINC000109291395 209302700 /nfs/dbraw/zinc/30/27/00/209302700.db2.gz OQDCHXWRUJVNLF-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)CCCO)o2)c(Cl)c1 ZINC000093323743 250030068 /nfs/dbraw/zinc/03/00/68/250030068.db2.gz CUTKEQZZHUGZJV-UHFFFAOYSA-N 1 1 354.790 2.685 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272474558 252047570 /nfs/dbraw/zinc/04/75/70/252047570.db2.gz IRGQZQWHUKLYML-CJNGLKHVSA-N 1 1 366.849 2.526 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CSCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000272588185 252074745 /nfs/dbraw/zinc/07/47/45/252074745.db2.gz ZQNRMZWYZCHNGT-HUUCEWRRSA-N 1 1 364.496 2.856 20 5 FFBDMO Cc1nc(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000273075141 252209359 /nfs/dbraw/zinc/20/93/59/252209359.db2.gz GIAQYSOPOSMGMN-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000273177562 252240619 /nfs/dbraw/zinc/24/06/19/252240619.db2.gz LIEFVDFVCNBUNE-INIZCTEOSA-N 1 1 372.381 2.682 20 5 FFBDMO COc1ccccc1[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000273397647 252298309 /nfs/dbraw/zinc/29/83/09/252298309.db2.gz VVFOXDGKIUVCOQ-HOTGVXAUSA-N 1 1 372.421 2.833 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000275555266 256023355 /nfs/dbraw/zinc/02/33/55/256023355.db2.gz CVEFBSSAPSIADT-QGZVFWFLSA-N 1 1 353.394 2.690 20 5 FFBDMO C[C@H]1CC[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000276472997 256103262 /nfs/dbraw/zinc/10/32/62/256103262.db2.gz ZDRALMGMUIXFTC-ZFWWWQNUSA-N 1 1 359.430 2.551 20 5 FFBDMO C[C@@H]1CC[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000276472988 256103549 /nfs/dbraw/zinc/10/35/49/256103549.db2.gz ZDRALMGMUIXFTC-HIFRSBDPSA-N 1 1 359.430 2.551 20 5 FFBDMO Cc1ccc(NC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000277342286 256187611 /nfs/dbraw/zinc/18/76/11/256187611.db2.gz DGNIKSPGRIZFME-AWEZNQCLSA-N 1 1 350.419 2.526 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277439611 256198552 /nfs/dbraw/zinc/19/85/52/256198552.db2.gz LEWWFRHGLORLHK-OAHLLOKOSA-N 1 1 364.446 2.834 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000278373173 256305013 /nfs/dbraw/zinc/30/50/13/256305013.db2.gz RURJZDISMAOKHV-ZDUSSCGKSA-N 1 1 369.849 2.787 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279068057 256377956 /nfs/dbraw/zinc/37/79/56/256377956.db2.gz AFDVCQPSQOVAFL-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279068057 256377957 /nfs/dbraw/zinc/37/79/57/256377957.db2.gz AFDVCQPSQOVAFL-KBPBESRZSA-N 1 1 365.430 2.557 20 5 FFBDMO CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286102524 257020223 /nfs/dbraw/zinc/02/02/23/257020223.db2.gz FHPLMISENZTDOM-FKEKPDDDSA-N 1 1 356.426 2.633 20 5 FFBDMO O=c1[nH]c(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000286290887 257029789 /nfs/dbraw/zinc/02/97/89/257029789.db2.gz RXPLBPGCTVARNC-PXAZEXFGSA-N 1 1 369.425 2.697 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000286351496 257032805 /nfs/dbraw/zinc/03/28/05/257032805.db2.gz BMKISTVKZRJEDC-UHFFFAOYSA-N 1 1 374.441 2.848 20 5 FFBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000286564160 257043309 /nfs/dbraw/zinc/04/33/09/257043309.db2.gz UCLXCDGUALWCBM-AWEZNQCLSA-N 1 1 373.413 2.526 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC000286857149 257058650 /nfs/dbraw/zinc/05/86/50/257058650.db2.gz MREJXVMGTLGMSI-CHWSQXEVSA-N 1 1 362.430 2.841 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccn1 ZINC000287433109 257089293 /nfs/dbraw/zinc/08/92/93/257089293.db2.gz PQKLPGMTYLMSQY-UHFFFAOYSA-N 1 1 372.425 2.775 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](CO)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000289090930 257255604 /nfs/dbraw/zinc/25/56/04/257255604.db2.gz UMSDFGUSAUSTRK-QWRGUYRKSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CO)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000289090930 257255606 /nfs/dbraw/zinc/25/56/06/257255606.db2.gz UMSDFGUSAUSTRK-QWRGUYRKSA-N 1 1 360.357 2.798 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000290048721 257312976 /nfs/dbraw/zinc/31/29/76/257312976.db2.gz MFJMHDYYHIRGMT-INIZCTEOSA-N 1 1 356.426 2.801 20 5 FFBDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000289569661 257287781 /nfs/dbraw/zinc/28/77/81/257287781.db2.gz GQKURJUJCRNVAA-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@H]1CO ZINC000289579739 257288231 /nfs/dbraw/zinc/28/82/31/257288231.db2.gz INOSPYIGTCHVQQ-KRWDZBQOSA-N 1 1 373.457 2.688 20 5 FFBDMO Cc1cc(F)c(NC(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000296901204 257764874 /nfs/dbraw/zinc/76/48/74/257764874.db2.gz XVSBIMODEPXZEK-CYBMUJFWSA-N 1 1 368.409 2.665 20 5 FFBDMO C[N@@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000302836581 258112096 /nfs/dbraw/zinc/11/20/96/258112096.db2.gz WQIPTEMABNWIEN-CXAGYDPISA-N 1 1 374.351 2.773 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccc(F)c(F)c1 ZINC000302836581 258112097 /nfs/dbraw/zinc/11/20/97/258112097.db2.gz WQIPTEMABNWIEN-CXAGYDPISA-N 1 1 374.351 2.773 20 5 FFBDMO C[N@@H+](CCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)Cc1ccc(F)cc1 ZINC000301692893 258063158 /nfs/dbraw/zinc/06/31/58/258063158.db2.gz OKQAQDPLEDWOML-UHFFFAOYSA-N 1 1 374.372 2.609 20 5 FFBDMO Cc1cc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)ncc1[N+](=O)[O-] ZINC000301719975 258065090 /nfs/dbraw/zinc/06/50/90/258065090.db2.gz MDEMIHVKTZXYHK-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301835354 258069934 /nfs/dbraw/zinc/06/99/34/258069934.db2.gz LCRKVZYVRVKOEX-FUHWJXTLSA-N 1 1 354.410 2.812 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000330703349 258168662 /nfs/dbraw/zinc/16/86/62/258168662.db2.gz JBJJVTWLFBESQT-YOEHRIQHSA-N 1 1 363.458 2.961 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000331215234 258179883 /nfs/dbraw/zinc/17/98/83/258179883.db2.gz NXSVDUHZHZWMMB-GFCCVEGCSA-N 1 1 351.451 2.682 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CC2)C1 ZINC000331488247 258188112 /nfs/dbraw/zinc/18/81/12/258188112.db2.gz KIDJATRXWSNNIC-SNVBAGLBSA-N 1 1 368.231 2.632 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000332331071 258225487 /nfs/dbraw/zinc/22/54/87/258225487.db2.gz QIGNCCSOIYPIGV-ACJLOTCBSA-N 1 1 365.430 2.821 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000366653807 512125151 /nfs/dbraw/zinc/12/51/51/512125151.db2.gz NSQFDURTQVRRIK-FRRDWIJNSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000366653807 512125158 /nfs/dbraw/zinc/12/51/58/512125158.db2.gz NSQFDURTQVRRIK-FRRDWIJNSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000097617981 132229959 /nfs/dbraw/zinc/22/99/59/132229959.db2.gz TZCQSZPQMPCKGK-HZPDHXFCSA-N 1 1 374.485 2.855 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000064960294 506245753 /nfs/dbraw/zinc/24/57/53/506245753.db2.gz DGBVHYYVFXXYEE-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000375157676 512188194 /nfs/dbraw/zinc/18/81/94/512188194.db2.gz GMNNRWBARAKSMD-WMZOPIPTSA-N 1 1 361.398 2.524 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000053666681 506423995 /nfs/dbraw/zinc/42/39/95/506423995.db2.gz MQSFDJMJVCACPX-UHFFFAOYSA-N 1 1 368.437 2.637 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000375348177 512279763 /nfs/dbraw/zinc/27/97/63/512279763.db2.gz HOYIYBNOXLISRK-UHFFFAOYSA-N 1 1 357.414 2.753 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](c3ccnc(N)n3)C2)ccc1[N+](=O)[O-] ZINC000366990970 512285391 /nfs/dbraw/zinc/28/53/91/512285391.db2.gz VVHTWLOPVSHRDS-CQSZACIVSA-N 1 1 357.414 2.576 20 5 FFBDMO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000054981056 506653973 /nfs/dbraw/zinc/65/39/73/506653973.db2.gz RPNVWZZJBIHVHB-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000054981056 506653978 /nfs/dbraw/zinc/65/39/78/506653978.db2.gz RPNVWZZJBIHVHB-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+](CCOc1ccccc1F)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375445 506850054 /nfs/dbraw/zinc/85/00/54/506850054.db2.gz OWMJWOTZINKUDY-KRWDZBQOSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccccc1F)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375445 506850058 /nfs/dbraw/zinc/85/00/58/506850058.db2.gz OWMJWOTZINKUDY-KRWDZBQOSA-N 1 1 373.384 2.850 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000067387602 506856075 /nfs/dbraw/zinc/85/60/75/506856075.db2.gz BIKLOTAFLNMHLQ-JZXOWHBKSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000067446449 506885027 /nfs/dbraw/zinc/88/50/27/506885027.db2.gz YDSHKAVAMZZYSF-CYBMUJFWSA-N 1 1 353.378 2.884 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)c1 ZINC000067679139 506972257 /nfs/dbraw/zinc/97/22/57/506972257.db2.gz JSCTVDACVKYUTJ-UHFFFAOYSA-N 1 1 367.409 2.853 20 5 FFBDMO CC[N@H+](C)Cc1cccc(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000067679139 506972265 /nfs/dbraw/zinc/97/22/65/506972265.db2.gz JSCTVDACVKYUTJ-UHFFFAOYSA-N 1 1 367.409 2.853 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1 ZINC000067679139 506972274 /nfs/dbraw/zinc/97/22/74/506972274.db2.gz JSCTVDACVKYUTJ-UHFFFAOYSA-N 1 1 367.409 2.853 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@@H]2C[NH+]2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000067702724 506982008 /nfs/dbraw/zinc/98/20/08/506982008.db2.gz ZUUAVECJBOJYSN-IIAWOOMASA-N 1 1 361.442 2.617 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000067716808 506988937 /nfs/dbraw/zinc/98/89/37/506988937.db2.gz LXYCDUGQGJIPBG-UHFFFAOYSA-N 1 1 363.439 2.525 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000068226377 507155656 /nfs/dbraw/zinc/15/56/56/507155656.db2.gz NLKCSASIIDEXIT-RDJZCZTQSA-N 1 1 368.437 2.958 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCC[NH+]1Cc2ccccc2C1 ZINC000068255532 507163864 /nfs/dbraw/zinc/16/38/64/507163864.db2.gz IINHYNFFDUNOCB-UHFFFAOYSA-N 1 1 368.437 2.919 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541981 507178387 /nfs/dbraw/zinc/17/83/87/507178387.db2.gz ZOYBJUSBXPRABE-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541981 507178393 /nfs/dbraw/zinc/17/83/93/507178393.db2.gz ZOYBJUSBXPRABE-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000057778187 507327817 /nfs/dbraw/zinc/32/78/17/507327817.db2.gz YQBUISGMDKOGAY-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC1 ZINC000068800477 507328595 /nfs/dbraw/zinc/32/85/95/507328595.db2.gz IOVRRZLRWIKUTC-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051057499 507732225 /nfs/dbraw/zinc/73/22/25/507732225.db2.gz IJBYHRCTTGMDNE-INIZCTEOSA-N 1 1 363.458 2.992 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000051469040 507772512 /nfs/dbraw/zinc/77/25/12/507772512.db2.gz UKYXLSCBQHDDEJ-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@]2([NH+]3CCOCC3)CCSC2)c2ncccc12 ZINC000029625754 507784744 /nfs/dbraw/zinc/78/47/44/507784744.db2.gz FMFRSJWWCFHNOI-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NCCC[N@H+]1CCc2ccccc2C1 ZINC000029837964 507792138 /nfs/dbraw/zinc/79/21/38/507792138.db2.gz VMCOORBXAQSMQU-UHFFFAOYSA-N 1 1 369.421 2.538 20 5 FFBDMO CCOc1ccc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000030319090 507806443 /nfs/dbraw/zinc/80/64/43/507806443.db2.gz HQUHLJXOPBZSNS-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CCOc1ccc(C(=O)NCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000030319090 507806445 /nfs/dbraw/zinc/80/64/45/507806445.db2.gz HQUHLJXOPBZSNS-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000107889468 507872857 /nfs/dbraw/zinc/87/28/57/507872857.db2.gz FDSYULLZVVXMRP-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089935214 507887500 /nfs/dbraw/zinc/88/75/00/507887500.db2.gz QGEUOIVBPNDDHI-CQSZACIVSA-N 1 1 358.398 2.550 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000078650318 507893617 /nfs/dbraw/zinc/89/36/17/507893617.db2.gz MLRSGEFOAGABNJ-ZDUSSCGKSA-N 1 1 359.430 2.898 20 5 FFBDMO C[C@H](NCc1ccc(C(=O)NCC[NH+](C)C)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000090038818 507903458 /nfs/dbraw/zinc/90/34/58/507903458.db2.gz NJNPKBNXGPKTOR-HNNXBMFYSA-N 1 1 370.453 2.737 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]nc(CCC)c1[N+](=O)[O-] ZINC000109621299 507971742 /nfs/dbraw/zinc/97/17/42/507971742.db2.gz SEDAQSDDNMSACT-ZDUSSCGKSA-N 1 1 351.451 2.655 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(Cn3ccnn3)CC2)c1 ZINC000092098985 508043119 /nfs/dbraw/zinc/04/31/19/508043119.db2.gz BOSKKEBTQWLNLI-UHFFFAOYSA-N 1 1 367.356 2.700 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000111050077 508066910 /nfs/dbraw/zinc/06/69/10/508066910.db2.gz MLMFFSKUKUWACM-SNVBAGLBSA-N 1 1 363.867 2.565 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000075061534 508080606 /nfs/dbraw/zinc/08/06/06/508080606.db2.gz XBWPRUDXGFEMRB-NEPJUHHUSA-N 1 1 351.378 2.584 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCCC2=O)C1 ZINC000111292028 508087151 /nfs/dbraw/zinc/08/71/51/508087151.db2.gz BPBRLQMRNIRGSO-QGZVFWFLSA-N 1 1 361.442 2.969 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCCC2=O)C1 ZINC000111292028 508087152 /nfs/dbraw/zinc/08/71/52/508087152.db2.gz BPBRLQMRNIRGSO-QGZVFWFLSA-N 1 1 361.442 2.969 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000111461199 508101324 /nfs/dbraw/zinc/10/13/24/508101324.db2.gz IHHFMERRNHIRLF-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)nc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000080915123 508111731 /nfs/dbraw/zinc/11/17/31/508111731.db2.gz XDAZXZDFVNPGNO-AWEZNQCLSA-N 1 1 351.790 2.515 20 5 FFBDMO O=C(CN1CCC[C@H](c2[nH]cc[nH+]2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000080959960 508117816 /nfs/dbraw/zinc/11/78/16/508117816.db2.gz WFTINUIGOVYKPQ-NSHDSACASA-N 1 1 363.805 2.789 20 5 FFBDMO O=C1CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1 ZINC000093101801 508120896 /nfs/dbraw/zinc/12/08/96/508120896.db2.gz JNAKSAVZDAWCQT-UHFFFAOYSA-N 1 1 359.357 2.848 20 5 FFBDMO O=C1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1 ZINC000093101801 508120897 /nfs/dbraw/zinc/12/08/97/508120897.db2.gz JNAKSAVZDAWCQT-UHFFFAOYSA-N 1 1 359.357 2.848 20 5 FFBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000081013785 508125955 /nfs/dbraw/zinc/12/59/55/508125955.db2.gz VYZLPBGFWZEOQV-SFHVURJKSA-N 1 1 368.437 2.795 20 5 FFBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2F)C1=O ZINC000112360167 508178605 /nfs/dbraw/zinc/17/86/05/508178605.db2.gz CTYCYBQZKIVHBP-KRWDZBQOSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCN(c2ccccc2F)C1=O ZINC000112360167 508178607 /nfs/dbraw/zinc/17/86/07/508178607.db2.gz CTYCYBQZKIVHBP-KRWDZBQOSA-N 1 1 373.384 2.850 20 5 FFBDMO Cc1c(C(=O)NCc2c[nH+]c3n2CCCC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000375539366 512382885 /nfs/dbraw/zinc/38/28/85/512382885.db2.gz CABQNAPVGONTNF-UHFFFAOYSA-N 1 1 373.369 2.583 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000081634871 508200102 /nfs/dbraw/zinc/20/01/02/508200102.db2.gz DMQGJGVBLNUVKX-INIZCTEOSA-N 1 1 360.458 2.505 20 5 FFBDMO C[N@H+]1CCCC12CCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000369385938 512383678 /nfs/dbraw/zinc/38/36/78/512383678.db2.gz ZJDAMBOEJYVKNG-UHFFFAOYSA-N 1 1 366.849 2.747 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000076713625 508245125 /nfs/dbraw/zinc/24/51/25/508245125.db2.gz RBKGTRMTHYANLA-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000076921946 508262751 /nfs/dbraw/zinc/26/27/51/508262751.db2.gz WRJYOSMSJKEPSN-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000084131916 508266155 /nfs/dbraw/zinc/26/61/55/508266155.db2.gz YFGLDJJDNFEKDC-QGZVFWFLSA-N 1 1 354.414 2.998 20 5 FFBDMO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000084131916 508266159 /nfs/dbraw/zinc/26/61/59/508266159.db2.gz YFGLDJJDNFEKDC-QGZVFWFLSA-N 1 1 354.414 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000113950767 508287960 /nfs/dbraw/zinc/28/79/60/508287960.db2.gz UZYSJEVWRNWIPI-GXSJLCMTSA-N 1 1 362.386 2.886 20 5 FFBDMO CN(C(=O)C[N@H+](CCO)[C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000114467277 508317969 /nfs/dbraw/zinc/31/79/69/508317969.db2.gz KGKHFBSRUVBHBP-IBGZPJMESA-N 1 1 369.421 2.539 20 5 FFBDMO CN(C(=O)C[N@@H+](CCO)[C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000114467277 508317971 /nfs/dbraw/zinc/31/79/71/508317971.db2.gz KGKHFBSRUVBHBP-IBGZPJMESA-N 1 1 369.421 2.539 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc(F)cc1[N+](=O)[O-] ZINC000114695019 508338265 /nfs/dbraw/zinc/33/82/65/508338265.db2.gz UUCJIICPBPUNGV-OAHLLOKOSA-N 1 1 372.400 2.711 20 5 FFBDMO NC(=O)C[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104680065 508340787 /nfs/dbraw/zinc/34/07/87/508340787.db2.gz VTAZPUVOVIVXRG-CQSZACIVSA-N 1 1 358.398 2.522 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCOCC1CC1 ZINC000088601156 508378344 /nfs/dbraw/zinc/37/83/44/508378344.db2.gz UJUBSTOEHNWVHT-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCOCC1CC1 ZINC000088601156 508378345 /nfs/dbraw/zinc/37/83/45/508378345.db2.gz UJUBSTOEHNWVHT-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO COc1ccc(COC[C@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088605741 508379104 /nfs/dbraw/zinc/37/91/04/508379104.db2.gz MZINCTHIWOFZHF-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccc(COC[C@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088605741 508379106 /nfs/dbraw/zinc/37/91/06/508379106.db2.gz MZINCTHIWOFZHF-LJQANCHMSA-N 1 1 372.421 2.539 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000133526834 508412038 /nfs/dbraw/zinc/41/20/38/508412038.db2.gz LZIJCKFZHPBJIU-JSGCOSHPSA-N 1 1 369.425 2.596 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000156447983 508421684 /nfs/dbraw/zinc/42/16/84/508421684.db2.gz KGVRWCACPJFHLN-AWEZNQCLSA-N 1 1 356.426 2.947 20 5 FFBDMO CC[C@@H]1CN(C)c2ccccc2C[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000127261318 508422333 /nfs/dbraw/zinc/42/23/33/508422333.db2.gz MGHLCOGMEZJBBY-QGZVFWFLSA-N 1 1 368.437 2.924 20 5 FFBDMO CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1 ZINC000122033244 508470301 /nfs/dbraw/zinc/47/03/01/508470301.db2.gz WBRXQXSOVHMICF-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000122202919 508497623 /nfs/dbraw/zinc/49/76/23/508497623.db2.gz YBTPALGNNHIFDW-OAHLLOKOSA-N 1 1 358.373 2.888 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CS(=O)(=O)c1ccccc1 ZINC000122343048 508520266 /nfs/dbraw/zinc/52/02/66/508520266.db2.gz JIGSYQOKMPGSPA-ZDUSSCGKSA-N 1 1 364.423 2.555 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122900549 508604120 /nfs/dbraw/zinc/60/41/20/508604120.db2.gz ZYZCYIQCLLDJGU-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO CC[N@H+]1CCCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000118826182 508679650 /nfs/dbraw/zinc/67/96/50/508679650.db2.gz NMIXSKWVPMPJFB-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000118958805 508695611 /nfs/dbraw/zinc/69/56/11/508695611.db2.gz ZSWZCAYWMOWPDA-YJBOKZPZSA-N 1 1 368.437 2.915 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1 ZINC000158600973 508727447 /nfs/dbraw/zinc/72/74/47/508727447.db2.gz IPEAQTFDEDSXDG-QUCCMNQESA-N 1 1 372.469 2.887 20 5 FFBDMO CC1CCN(C[C@H](O)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000158872197 508762747 /nfs/dbraw/zinc/76/27/47/508762747.db2.gz CIQYNACYRXVKCD-RTBURBONSA-N 1 1 361.486 2.598 20 5 FFBDMO Nc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cc1[N+](=O)[O-] ZINC000140179241 508801071 /nfs/dbraw/zinc/80/10/71/508801071.db2.gz KKXPBZHBGLVALX-ZDUSSCGKSA-N 1 1 374.466 2.881 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000159172631 508803464 /nfs/dbraw/zinc/80/34/64/508803464.db2.gz JBWYUADEZRALJY-IBGZPJMESA-N 1 1 369.469 2.983 20 5 FFBDMO CC[C@@H](c1ccncc1)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130223604 508805845 /nfs/dbraw/zinc/80/58/45/508805845.db2.gz XCRYZYBLWNRYFR-KRWDZBQOSA-N 1 1 354.410 2.962 20 5 FFBDMO CC[C@@H](c1ccncc1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130223604 508805849 /nfs/dbraw/zinc/80/58/49/508805849.db2.gz XCRYZYBLWNRYFR-KRWDZBQOSA-N 1 1 354.410 2.962 20 5 FFBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(S(N)(=O)=O)cc1 ZINC000119622812 508831043 /nfs/dbraw/zinc/83/10/43/508831043.db2.gz PYXODKLJHFRBEZ-SNVBAGLBSA-N 1 1 369.830 2.746 20 5 FFBDMO O=c1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc2ccccn12 ZINC000130764760 508842861 /nfs/dbraw/zinc/84/28/61/508842861.db2.gz BGUGDVDNAOQBCZ-UHFFFAOYSA-N 1 1 350.378 2.767 20 5 FFBDMO O=c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc2ccccn12 ZINC000130764760 508842864 /nfs/dbraw/zinc/84/28/64/508842864.db2.gz BGUGDVDNAOQBCZ-UHFFFAOYSA-N 1 1 350.378 2.767 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000119726208 508851424 /nfs/dbraw/zinc/85/14/24/508851424.db2.gz CMMQWLQEFBCYBI-CQSZACIVSA-N 1 1 360.458 2.877 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000119744789 508854900 /nfs/dbraw/zinc/85/49/00/508854900.db2.gz RWBKDWQAKXAOCG-RYVRDWITSA-N 1 1 358.486 2.899 20 5 FFBDMO CN(C(=O)CN1CC[N@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000124590987 508855887 /nfs/dbraw/zinc/85/58/87/508855887.db2.gz FLPSSRKCXPXHIF-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO CN(C(=O)CN1CC[N@@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000124590987 508855892 /nfs/dbraw/zinc/85/58/92/508855892.db2.gz FLPSSRKCXPXHIF-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1OC ZINC000159704013 508877940 /nfs/dbraw/zinc/87/79/40/508877940.db2.gz JGDRBTYFXXMERK-INIZCTEOSA-N 1 1 373.409 2.611 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1OC(F)(F)F ZINC000131022406 508878175 /nfs/dbraw/zinc/87/81/75/508878175.db2.gz QMOMIUUEWBLXNB-UHFFFAOYSA-N 1 1 371.315 2.787 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccc1OC(F)(F)F ZINC000131022406 508878178 /nfs/dbraw/zinc/87/81/78/508878178.db2.gz QMOMIUUEWBLXNB-UHFFFAOYSA-N 1 1 371.315 2.787 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000159902252 508909410 /nfs/dbraw/zinc/90/94/10/508909410.db2.gz ODKSCWUKCGEVHN-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000120328403 508974225 /nfs/dbraw/zinc/97/42/25/508974225.db2.gz JWGUWOPUOKOALV-HNNXBMFYSA-N 1 1 364.446 2.570 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000125556577 508999116 /nfs/dbraw/zinc/99/91/16/508999116.db2.gz BMKYGJKVMAYHRE-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000125556577 508999121 /nfs/dbraw/zinc/99/91/21/508999121.db2.gz BMKYGJKVMAYHRE-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515304 509011788 /nfs/dbraw/zinc/01/17/88/509011788.db2.gz IARRHHKZARUBIN-HOTGVXAUSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1(C)C ZINC000120515304 509011790 /nfs/dbraw/zinc/01/17/90/509011790.db2.gz IARRHHKZARUBIN-HOTGVXAUSA-N 1 1 365.430 2.677 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000160688028 509020330 /nfs/dbraw/zinc/02/03/30/509020330.db2.gz GZMVYXKUJNXSSO-UHFFFAOYSA-N 1 1 368.397 2.837 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000155627132 509040444 /nfs/dbraw/zinc/04/04/44/509040444.db2.gz BAXYQSVNBFRLIY-GFCCVEGCSA-N 1 1 357.357 2.544 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000155627132 509040445 /nfs/dbraw/zinc/04/04/45/509040445.db2.gz BAXYQSVNBFRLIY-GFCCVEGCSA-N 1 1 357.357 2.544 20 5 FFBDMO O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126554308 509094845 /nfs/dbraw/zinc/09/48/45/509094845.db2.gz VGGAHBQSHMIICP-PXAZEXFGSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000126554308 509094849 /nfs/dbraw/zinc/09/48/49/509094849.db2.gz VGGAHBQSHMIICP-PXAZEXFGSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126554308 509094854 /nfs/dbraw/zinc/09/48/54/509094854.db2.gz VGGAHBQSHMIICP-PXAZEXFGSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000133214318 509132776 /nfs/dbraw/zinc/13/27/76/509132776.db2.gz MXJQNUWRXBAYMT-OAHLLOKOSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000185493301 509203503 /nfs/dbraw/zinc/20/35/03/509203503.db2.gz ICUSCWJVCUCTDD-LBPRGKRZSA-N 1 1 360.439 2.638 20 5 FFBDMO C[C@@H](O)C[NH+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000188724672 509232061 /nfs/dbraw/zinc/23/20/61/509232061.db2.gz ZLWNHNSNUSGQCO-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@@H](O)CN1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000188724672 509232066 /nfs/dbraw/zinc/23/20/66/509232066.db2.gz ZLWNHNSNUSGQCO-CQSZACIVSA-N 1 1 361.467 2.822 20 5 FFBDMO Cc1cc(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000182448448 509243025 /nfs/dbraw/zinc/24/30/25/509243025.db2.gz UFZKQIPDPCWEQC-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO COCCO[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000188821385 509279306 /nfs/dbraw/zinc/27/93/06/509279306.db2.gz GEUMJIZGCDYLBI-MRXNPFEDSA-N 1 1 363.439 2.956 20 5 FFBDMO COCCO[C@@H]1CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000188821385 509279308 /nfs/dbraw/zinc/27/93/08/509279308.db2.gz GEUMJIZGCDYLBI-MRXNPFEDSA-N 1 1 363.439 2.956 20 5 FFBDMO Cc1ncc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)s1 ZINC000188847563 509292425 /nfs/dbraw/zinc/29/24/25/509292425.db2.gz VQEZIVMWHHQWHV-UHFFFAOYSA-N 1 1 352.391 2.959 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(Cc3c(Cl)cccc3[N+](=O)[O-])CC2)CCO1 ZINC000163419983 509373917 /nfs/dbraw/zinc/37/39/17/509373917.db2.gz ZHEYENUVIQEZRU-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCS[C@@H](C)CC1 ZINC000192171890 509387342 /nfs/dbraw/zinc/38/73/42/509387342.db2.gz LQAULHMVBQHHGB-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000192171890 509387349 /nfs/dbraw/zinc/38/73/49/509387349.db2.gz LQAULHMVBQHHGB-RYUDHWBXSA-N 1 1 353.444 2.758 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)c(SC)cc1OC ZINC000176261515 509409793 /nfs/dbraw/zinc/40/97/93/509409793.db2.gz HPWPGVLNEMDGHR-UHFFFAOYSA-N 1 1 366.443 2.662 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000267276374 509422877 /nfs/dbraw/zinc/42/28/77/509422877.db2.gz UHCRAJVONBJKLG-GJZGRUSLSA-N 1 1 360.458 2.904 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@H]([NH+]3CCCCC3)C2)c(Br)c1 ZINC000267275440 509423634 /nfs/dbraw/zinc/42/36/34/509423634.db2.gz UCWAMGJTYOUUSJ-LLVKDONJSA-N 1 1 355.236 2.817 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000248880553 509525373 /nfs/dbraw/zinc/52/53/73/509525373.db2.gz FDXQCXFTKCLNTQ-SUMWQHHRSA-N 1 1 372.425 2.626 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000192556555 509553100 /nfs/dbraw/zinc/55/31/00/509553100.db2.gz IDEWMDWXSPEMKQ-CVEARBPZSA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(C[NH2+]C1(c2cccc(F)c2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000179680880 509572215 /nfs/dbraw/zinc/57/22/15/509572215.db2.gz RDBHTIBJIAELOM-UHFFFAOYSA-N 1 1 373.340 2.680 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000249035609 509578138 /nfs/dbraw/zinc/57/81/38/509578138.db2.gz SNHQXWXIHBPPGF-SUMWQHHRSA-N 1 1 360.414 2.952 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000179707891 509584814 /nfs/dbraw/zinc/58/48/14/509584814.db2.gz HVJIEIPVTOIQKH-OAHLLOKOSA-N 1 1 356.426 2.643 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCCC[NH+]1CCOCC1 ZINC000264667065 509634375 /nfs/dbraw/zinc/63/43/75/509634375.db2.gz KOUQVMIDWPIVMQ-UHFFFAOYSA-N 1 1 363.458 2.834 20 5 FFBDMO CC(C)[NH+](CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000173526121 509642452 /nfs/dbraw/zinc/64/24/52/509642452.db2.gz WDZLIGPCGXLYCY-UHFFFAOYSA-N 1 1 361.439 2.521 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCCO1)C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000173578923 509658298 /nfs/dbraw/zinc/65/82/98/509658298.db2.gz LIZSGBHEFAANLD-SFHVURJKSA-N 1 1 373.453 2.908 20 5 FFBDMO COc1cc(C[NH+]2CCC([C@@H](C)O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058509 509730006 /nfs/dbraw/zinc/73/00/06/509730006.db2.gz LRICMYLHJTXMAR-LLVKDONJSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000180109283 509756814 /nfs/dbraw/zinc/75/68/14/509756814.db2.gz LRXDHDZXNHMAQX-YJBOKZPZSA-N 1 1 355.394 2.779 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000249783702 509763053 /nfs/dbraw/zinc/76/30/53/509763053.db2.gz QVWFQQUIBIJMAR-KBPBESRZSA-N 1 1 364.446 2.523 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000268148221 509780494 /nfs/dbraw/zinc/78/04/94/509780494.db2.gz WGCWSRCVFGRAFQ-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NC(C1CC1)C1CC1 ZINC000173799214 509785671 /nfs/dbraw/zinc/78/56/71/509785671.db2.gz DPOHZFHGQZKHCF-UHFFFAOYSA-N 1 1 373.453 2.743 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000268196495 509807465 /nfs/dbraw/zinc/80/74/65/509807465.db2.gz FTPYIXFUWLUBIG-CQSZACIVSA-N 1 1 362.430 2.941 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000183588408 509874174 /nfs/dbraw/zinc/87/41/74/509874174.db2.gz CJSAPVJNUHVXQQ-NSHDSACASA-N 1 1 361.427 2.620 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000183588408 509874180 /nfs/dbraw/zinc/87/41/80/509874180.db2.gz CJSAPVJNUHVXQQ-NSHDSACASA-N 1 1 361.427 2.620 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000268336899 509875948 /nfs/dbraw/zinc/87/59/48/509875948.db2.gz GEQYWZQDEIRWSE-ZWNOBZJWSA-N 1 1 370.247 2.816 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)C2CCC(OC)CC2)c([N+](=O)[O-])c1 ZINC000265178856 509905236 /nfs/dbraw/zinc/90/52/36/509905236.db2.gz DJAJXWLJIXUMRE-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1nnc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)[nH]1 ZINC000268416313 509917113 /nfs/dbraw/zinc/91/71/13/509917113.db2.gz BSRVRBXASVRRLZ-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000268416313 509917120 /nfs/dbraw/zinc/91/71/20/509917120.db2.gz BSRVRBXASVRRLZ-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n1 ZINC000268416313 509917132 /nfs/dbraw/zinc/91/71/32/509917132.db2.gz BSRVRBXASVRRLZ-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n[nH]1 ZINC000268416313 509917138 /nfs/dbraw/zinc/91/71/38/509917138.db2.gz BSRVRBXASVRRLZ-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)n[nH]1 ZINC000268416313 509917146 /nfs/dbraw/zinc/91/71/46/509917146.db2.gz BSRVRBXASVRRLZ-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@H]2CCCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177194379 509930697 /nfs/dbraw/zinc/93/06/97/509930697.db2.gz CQXTYVFYLUJIET-RDJZCZTQSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@H]2CCCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177194379 509930703 /nfs/dbraw/zinc/93/07/03/509930703.db2.gz CQXTYVFYLUJIET-RDJZCZTQSA-N 1 1 361.467 2.844 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000177208005 509937006 /nfs/dbraw/zinc/93/70/06/509937006.db2.gz NWMUOXNEWGHTPX-UKRRQHHQSA-N 1 1 358.442 2.550 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000180571835 509992332 /nfs/dbraw/zinc/99/23/32/509992332.db2.gz IIQOVIONKJONOW-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000190257621 510030274 /nfs/dbraw/zinc/03/02/74/510030274.db2.gz QMZWJLKNXVHYIP-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000190257621 510030279 /nfs/dbraw/zinc/03/02/79/510030279.db2.gz QMZWJLKNXVHYIP-GFCCVEGCSA-N 1 1 373.837 2.560 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000245731903 510112810 /nfs/dbraw/zinc/11/28/10/510112810.db2.gz YXIPDVNOKWTSOC-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSC[C@H](C)C1 ZINC000190479542 510154374 /nfs/dbraw/zinc/15/43/74/510154374.db2.gz GQJUDVJYCQLXFY-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](C[C@@H]2CCCO2)[C@H]2CCSC2)cc1 ZINC000245903415 510197894 /nfs/dbraw/zinc/19/78/94/510197894.db2.gz QGMQIWIDYIPIGW-RDJZCZTQSA-N 1 1 352.456 2.960 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)C1CC1 ZINC000187463303 510280089 /nfs/dbraw/zinc/28/00/89/510280089.db2.gz SVBKINLVPCTFNJ-SFHVURJKSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2CN2CCCC2)cccc1[N+](=O)[O-] ZINC000171708313 510323244 /nfs/dbraw/zinc/32/32/44/510323244.db2.gz GXAMVTZEIWTCDE-INIZCTEOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2CN2CCCC2)cccc1[N+](=O)[O-] ZINC000171708313 510323251 /nfs/dbraw/zinc/32/32/51/510323251.db2.gz GXAMVTZEIWTCDE-INIZCTEOSA-N 1 1 360.458 2.792 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184462433 510336138 /nfs/dbraw/zinc/33/61/38/510336138.db2.gz PIRJCYSGQFUUQN-MRXNPFEDSA-N 1 1 368.437 2.771 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000246172481 510338811 /nfs/dbraw/zinc/33/88/11/510338811.db2.gz PVZGBFMRTKXPRU-KBPBESRZSA-N 1 1 359.430 2.979 20 5 FFBDMO CC[N@H+](CCO)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000184544065 510381178 /nfs/dbraw/zinc/38/11/78/510381178.db2.gz MXMAUZKUIRBTPT-UHFFFAOYSA-N 1 1 367.833 2.912 20 5 FFBDMO CC[N@@H+](CCO)CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000184544065 510381188 /nfs/dbraw/zinc/38/11/88/510381188.db2.gz MXMAUZKUIRBTPT-UHFFFAOYSA-N 1 1 367.833 2.912 20 5 FFBDMO CCc1[nH]nc(C(=O)Nc2ccc([C@@H](C)[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000171870745 510421097 /nfs/dbraw/zinc/42/10/97/510421097.db2.gz GDCXZGVEXYCAEV-GFCCVEGCSA-N 1 1 373.413 2.526 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266226153 510470702 /nfs/dbraw/zinc/47/07/02/510470702.db2.gz AQAIMQQAJVDXFB-UHFFFAOYSA-N 1 1 356.304 2.939 20 5 FFBDMO CCOc1cc(NC(C)(C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC000184836054 510539114 /nfs/dbraw/zinc/53/91/14/510539114.db2.gz SPAUHGVVFTURAA-UHFFFAOYSA-N 1 1 350.463 2.822 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C[N@H+]1C1CC1 ZINC000184856948 510550642 /nfs/dbraw/zinc/55/06/42/510550642.db2.gz HUZIPDDPOCZUAB-VHSXEESVSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000172359965 510688217 /nfs/dbraw/zinc/68/82/17/510688217.db2.gz GTUKITGXJCLLRB-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000172359965 510688220 /nfs/dbraw/zinc/68/82/20/510688220.db2.gz GTUKITGXJCLLRB-CQSZACIVSA-N 1 1 351.406 2.931 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246883669 510727521 /nfs/dbraw/zinc/72/75/21/510727521.db2.gz TYBFDUPMYZJKEF-XJKSGUPXSA-N 1 1 367.421 2.601 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246965628 510772825 /nfs/dbraw/zinc/77/28/25/510772825.db2.gz YYJPGCHXYXKSNE-MAUKXSAKSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1ccc(OCC[N@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000182190543 510806101 /nfs/dbraw/zinc/80/61/01/510806101.db2.gz PIUPUZYXHHBYPI-MRXNPFEDSA-N 1 1 360.410 2.654 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000247181797 510849732 /nfs/dbraw/zinc/84/97/32/510849732.db2.gz PPTVIXQMGCUHAG-IAGOWNOFSA-N 1 1 352.431 2.616 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247382281 510859299 /nfs/dbraw/zinc/85/92/99/510859299.db2.gz LMQMEQIDLOSVLI-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CCC[N@H+](C)CCN(C)C ZINC000294128153 510965068 /nfs/dbraw/zinc/96/50/68/510965068.db2.gz FOFHQJIOIHQHBP-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CCCN(C)CC[NH+](C)C ZINC000294128153 510965070 /nfs/dbraw/zinc/96/50/70/510965070.db2.gz FOFHQJIOIHQHBP-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1 ZINC000277737113 510970868 /nfs/dbraw/zinc/97/08/68/510970868.db2.gz KLKWETBLMHHZSK-DOMZBBRYSA-N 1 1 362.348 2.999 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000294169298 510977352 /nfs/dbraw/zinc/97/73/52/510977352.db2.gz OLJSVFGAPIJWHB-LJQANCHMSA-N 1 1 363.433 2.956 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000361193018 511010858 /nfs/dbraw/zinc/01/08/58/511010858.db2.gz YQPWDRRWOQPJFS-APWZRJJASA-N 1 1 357.385 2.838 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)cc1 ZINC000361193018 511010866 /nfs/dbraw/zinc/01/08/66/511010866.db2.gz YQPWDRRWOQPJFS-APWZRJJASA-N 1 1 357.385 2.838 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000271008801 511054835 /nfs/dbraw/zinc/05/48/35/511054835.db2.gz XHDJIROVYFMNIF-LLVKDONJSA-N 1 1 355.236 2.817 20 5 FFBDMO COc1cc(C[N@@H+](C)CC(C)(C)CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000294698824 511147222 /nfs/dbraw/zinc/14/72/22/511147222.db2.gz CUPRRXJTLOHSKV-UHFFFAOYSA-N 1 1 362.373 2.698 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[NH+](C2CCC2)CC1 ZINC000294772982 511173650 /nfs/dbraw/zinc/17/36/50/511173650.db2.gz NIOZTPAVVLLJGN-UHFFFAOYSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(c1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279730849 511193381 /nfs/dbraw/zinc/19/33/81/511193381.db2.gz RWRNOGZVXSYWAQ-HDICACEKSA-N 1 1 351.406 2.799 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000294968330 511237748 /nfs/dbraw/zinc/23/77/48/511237748.db2.gz NBWUTBOXBWTPRN-RHSMWYFYSA-N 1 1 361.442 2.746 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000271562942 511246044 /nfs/dbraw/zinc/24/60/44/511246044.db2.gz AFLTVGBMZBMWPE-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)[nH]n1 ZINC000271562942 511246048 /nfs/dbraw/zinc/24/60/48/511246048.db2.gz AFLTVGBMZBMWPE-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)N1CC(=O)Nc2ccccc21 ZINC000271621220 511266607 /nfs/dbraw/zinc/26/66/07/511266607.db2.gz MXLWBQTUZGZITA-CHWSQXEVSA-N 1 1 368.393 2.619 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000291678544 511294187 /nfs/dbraw/zinc/29/41/87/511294187.db2.gz CCGRDFZDNIAUAR-CZUORRHYSA-N 1 1 354.410 2.570 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccccc1[N+](=O)[O-] ZINC000271717499 511299604 /nfs/dbraw/zinc/29/96/04/511299604.db2.gz KFDIHMVAVFYAGD-LBPRGKRZSA-N 1 1 370.365 2.743 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000271765838 511315916 /nfs/dbraw/zinc/31/59/16/511315916.db2.gz PSAJZUQRUCBICK-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000295497821 511424832 /nfs/dbraw/zinc/42/48/32/511424832.db2.gz KNNRUIQHDAUEAW-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1SC ZINC000334042579 511435197 /nfs/dbraw/zinc/43/51/97/511435197.db2.gz TXVGUWTTWBRVQL-MNOVXSKESA-N 1 1 353.444 2.538 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000272258747 511482919 /nfs/dbraw/zinc/48/29/19/511482919.db2.gz MMANXTPZYACIRC-HUUCEWRRSA-N 1 1 360.458 2.785 20 5 FFBDMO COc1cc(C[N@@H+](C)C2(CO)CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000292183404 511497263 /nfs/dbraw/zinc/49/72/63/511497263.db2.gz QRMHBZLGAONAIT-UHFFFAOYSA-N 1 1 360.357 2.594 20 5 FFBDMO C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+](C2CCC2)C1 ZINC000292258535 511525369 /nfs/dbraw/zinc/52/53/69/511525369.db2.gz KQMRIAJAAJAVIT-CYBMUJFWSA-N 1 1 358.442 2.790 20 5 FFBDMO C[C@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000295960825 511569892 /nfs/dbraw/zinc/56/98/92/511569892.db2.gz HUCLNMWWVAOEJP-HNNXBMFYSA-N 1 1 369.469 2.911 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CCC[N@H+](C(C)C)CC1 ZINC000296059069 511605006 /nfs/dbraw/zinc/60/50/06/511605006.db2.gz VRBVYKQUIONCKO-UHFFFAOYSA-N 1 1 358.446 2.794 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000284217789 511645966 /nfs/dbraw/zinc/64/59/66/511645966.db2.gz TUDLWNLDNCTKQN-MPGHIAIKSA-N 1 1 364.490 2.965 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)C2)C1 ZINC000292892553 511761467 /nfs/dbraw/zinc/76/14/67/511761467.db2.gz VYZSUUSPDVQCKM-HXUWFJFHSA-N 1 1 372.469 2.753 20 5 FFBDMO COc1cc(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350340288 511784195 /nfs/dbraw/zinc/78/41/95/511784195.db2.gz NTDZWVMAGYVCNX-WMLDXEAASA-N 1 1 360.370 2.579 20 5 FFBDMO CCOc1ccc(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350381691 511797532 /nfs/dbraw/zinc/79/75/32/511797532.db2.gz FEUGGKRVAUTMBJ-QAPCUYQASA-N 1 1 374.397 2.969 20 5 FFBDMO CCn1nccc1C1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000366109377 511844549 /nfs/dbraw/zinc/84/45/49/511844549.db2.gz PMEVCCFJULCQHB-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296731189 511873298 /nfs/dbraw/zinc/87/32/98/511873298.db2.gz NYYDYFASNCMQMP-ZDUSSCGKSA-N 1 1 369.849 2.787 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000274570416 511877487 /nfs/dbraw/zinc/87/74/87/511877487.db2.gz MAKRPPBDRWTADA-UHFFFAOYSA-N 1 1 374.210 2.663 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000366198522 511895814 /nfs/dbraw/zinc/89/58/14/511895814.db2.gz VFHPDRTWFUQDCD-MRXNPFEDSA-N 1 1 354.410 2.632 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000366382900 511991221 /nfs/dbraw/zinc/99/12/21/511991221.db2.gz BUXNARYJOAHEJI-DOTOQJQBSA-N 1 1 358.442 2.896 20 5 FFBDMO Cc1cc(C2=CC[N@H+](Cc3cnc4cnccn34)CC2)cc([N+](=O)[O-])c1N ZINC000359869184 512053193 /nfs/dbraw/zinc/05/31/93/512053193.db2.gz HYSMYKHOWZTFEM-UHFFFAOYSA-N 1 1 364.409 2.817 20 5 FFBDMO Cc1cc(C2=CC[N@@H+](Cc3cnc4cnccn34)CC2)cc([N+](=O)[O-])c1N ZINC000359869184 512053196 /nfs/dbraw/zinc/05/31/96/512053196.db2.gz HYSMYKHOWZTFEM-UHFFFAOYSA-N 1 1 364.409 2.817 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000275156919 512059338 /nfs/dbraw/zinc/05/93/38/512059338.db2.gz WJEVSIWTMMXQBD-LQPUYASZSA-N 1 1 357.332 2.608 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(n3cccn3)CC2)cccc1[N+](=O)[O-] ZINC000371584821 512479130 /nfs/dbraw/zinc/47/91/30/512479130.db2.gz IVMHWWLXKPTKLC-AWEZNQCLSA-N 1 1 357.414 2.764 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000375830525 512529022 /nfs/dbraw/zinc/52/90/22/512529022.db2.gz KLRVPZBMJABWGJ-HZPDHXFCSA-N 1 1 361.442 2.696 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](c4ccncn4)C3)o2)cc1 ZINC000373932651 512577404 /nfs/dbraw/zinc/57/74/04/512577404.db2.gz IQHWWTYMSNMRBG-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](c4ccncn4)C3)o2)cc1 ZINC000373932651 512577409 /nfs/dbraw/zinc/57/74/09/512577409.db2.gz IQHWWTYMSNMRBG-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000374028060 512630563 /nfs/dbraw/zinc/63/05/63/512630563.db2.gz VYVMGPPATCRFJP-BRWVUGGUSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[NH+](C[C@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000374028060 512630568 /nfs/dbraw/zinc/63/05/68/512630568.db2.gz VYVMGPPATCRFJP-BRWVUGGUSA-N 1 1 363.458 2.547 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)C2)CC1 ZINC000370012364 512727431 /nfs/dbraw/zinc/72/74/31/512727431.db2.gz WNRSPLSWACPZOP-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](O)C[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949952 512885550 /nfs/dbraw/zinc/88/55/50/512885550.db2.gz QSXAMSSDQKCRDS-MSOLQXFVSA-N 1 1 356.378 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000411949952 512885553 /nfs/dbraw/zinc/88/55/53/512885553.db2.gz QSXAMSSDQKCRDS-MSOLQXFVSA-N 1 1 356.378 2.769 20 5 FFBDMO COC(=O)c1cn([C@@H]2CCC[N@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nn1 ZINC000368356452 512912324 /nfs/dbraw/zinc/91/23/24/512912324.db2.gz AOFWSSUYXXFJPK-DZGCQCFKSA-N 1 1 373.413 2.679 20 5 FFBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000412017528 512913480 /nfs/dbraw/zinc/91/34/80/512913480.db2.gz ZVXFYNROHFGSCH-OTWHNJEPSA-N 1 1 358.442 2.810 20 5 FFBDMO CC(C)(O)C[N@H+]1CCc2c(cccc2NC(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000374613206 512916869 /nfs/dbraw/zinc/91/68/69/512916869.db2.gz RHWRSIAGFVTSMQ-UHFFFAOYSA-N 1 1 369.421 2.976 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000412079907 512949093 /nfs/dbraw/zinc/94/90/93/512949093.db2.gz VJFVADUOZQQRAL-SGTLLEGYSA-N 1 1 374.397 2.981 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2ccncn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000372599285 512962395 /nfs/dbraw/zinc/96/23/95/512962395.db2.gz KFEUOGOFHWMIMT-CYBMUJFWSA-N 1 1 373.388 2.732 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412357091 513052089 /nfs/dbraw/zinc/05/20/89/513052089.db2.gz DNNMXKFZVRMOKD-LBPRGKRZSA-N 1 1 355.410 2.522 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)cc1[N+](=O)[O-] ZINC000368699593 513066090 /nfs/dbraw/zinc/06/60/90/513066090.db2.gz FMPANETXGVEFMC-UHFFFAOYSA-N 1 1 362.386 2.512 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c2c(c1)COCO2 ZINC000370719307 513069289 /nfs/dbraw/zinc/06/92/89/513069289.db2.gz KIMHEIPBLVKPSB-HNNXBMFYSA-N 1 1 355.394 2.921 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](Cc2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000374935496 513080834 /nfs/dbraw/zinc/08/08/34/513080834.db2.gz YJZRECVXLWBPIY-MRXNPFEDSA-N 1 1 354.410 2.517 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2nccc3c2cccc3[N+](=O)[O-])C[C@H](C)O1 ZINC000450373560 513165060 /nfs/dbraw/zinc/16/50/60/513165060.db2.gz CSHDRCBVOAJXMQ-GASCZTMLSA-N 1 1 358.442 2.866 20 5 FFBDMO CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000450391790 513174438 /nfs/dbraw/zinc/17/44/38/513174438.db2.gz RLARFJCHGLYIOZ-FUHWJXTLSA-N 1 1 371.441 2.785 20 5 FFBDMO CC[C@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000450391790 513174442 /nfs/dbraw/zinc/17/44/42/513174442.db2.gz RLARFJCHGLYIOZ-FUHWJXTLSA-N 1 1 371.441 2.785 20 5 FFBDMO C[C@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000412703006 513234903 /nfs/dbraw/zinc/23/49/03/513234903.db2.gz XKZITQRGONRXQJ-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000412703006 513234911 /nfs/dbraw/zinc/23/49/11/513234911.db2.gz XKZITQRGONRXQJ-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007862 513249722 /nfs/dbraw/zinc/24/97/22/513249722.db2.gz WLHRVSOBMCJBBC-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@H]1N1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007862 513249729 /nfs/dbraw/zinc/24/97/29/513249729.db2.gz WLHRVSOBMCJBBC-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@H]1N1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007862 513249731 /nfs/dbraw/zinc/24/97/31/513249731.db2.gz WLHRVSOBMCJBBC-RVKKMQEKSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC000421496943 513285625 /nfs/dbraw/zinc/28/56/25/513285625.db2.gz GOCZXVTZGNOSOM-UHFFFAOYSA-N 1 1 370.409 2.964 20 5 FFBDMO Cc1cccc(OCCNC(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429258971 513318570 /nfs/dbraw/zinc/31/85/70/513318570.db2.gz ISFAKAODZHADGF-UHFFFAOYSA-N 1 1 371.437 2.923 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000440594888 513360265 /nfs/dbraw/zinc/36/02/65/513360265.db2.gz CJICUMFDGQCPSS-SFHVURJKSA-N 1 1 363.364 2.922 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000429396308 513364386 /nfs/dbraw/zinc/36/43/86/513364386.db2.gz FNXSSBVNQBSATL-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000418107570 513375194 /nfs/dbraw/zinc/37/51/94/513375194.db2.gz FBFUFFIGPUELSM-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1CCO ZINC000418107570 513375198 /nfs/dbraw/zinc/37/51/98/513375198.db2.gz FBFUFFIGPUELSM-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)CN1CCO ZINC000418107570 513375204 /nfs/dbraw/zinc/37/52/04/513375204.db2.gz FBFUFFIGPUELSM-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000440928372 513439237 /nfs/dbraw/zinc/43/92/37/513439237.db2.gz YIYQKTJDPIITIT-GVXVVHGQSA-N 1 1 367.833 2.757 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441191478 513507641 /nfs/dbraw/zinc/50/76/41/513507641.db2.gz BXIZPRVYZKVHGP-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccccc2C[N@@H+]2CCC[C@@H]2CO)c(F)c1 ZINC000413232583 513536770 /nfs/dbraw/zinc/53/67/70/513536770.db2.gz CIYSYIPHHMVXLO-OAHLLOKOSA-N 1 1 360.389 2.698 20 5 FFBDMO Cc1c(NC(=O)NC[C@H]2CCC[N@@H+]2C)cc(Br)cc1[N+](=O)[O-] ZINC000435329467 513558031 /nfs/dbraw/zinc/55/80/31/513558031.db2.gz PQOOLYBUZURWFP-LLVKDONJSA-N 1 1 371.235 2.881 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1c(Cl)cc([N+](=O)[O-])cc1C(=O)OC ZINC000447802621 513573042 /nfs/dbraw/zinc/57/30/42/513573042.db2.gz MAGZXCOHBPTTTA-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H](CSC)C2)cc1[N+](=O)[O-] ZINC000430198543 513586887 /nfs/dbraw/zinc/58/68/87/513586887.db2.gz RUEJGLLWLWAZFJ-AWEZNQCLSA-N 1 1 368.455 2.722 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](n2ccnn2)C1 ZINC000425497118 513600062 /nfs/dbraw/zinc/60/00/62/513600062.db2.gz CAVNCQNJIDJHBW-DOMZBBRYSA-N 1 1 369.385 2.634 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](n2ccnn2)C1 ZINC000425497118 513600068 /nfs/dbraw/zinc/60/00/68/513600068.db2.gz CAVNCQNJIDJHBW-DOMZBBRYSA-N 1 1 369.385 2.634 20 5 FFBDMO CN(C(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000430334030 513625871 /nfs/dbraw/zinc/62/58/71/513625871.db2.gz TYAOSXBXIMSFJL-MRXNPFEDSA-N 1 1 369.421 2.959 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)s1 ZINC000435637894 513646952 /nfs/dbraw/zinc/64/69/52/513646952.db2.gz QMAPHWGPBKJAAB-CYBMUJFWSA-N 1 1 373.500 2.732 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1 ZINC000451311869 513669129 /nfs/dbraw/zinc/66/91/29/513669129.db2.gz ZHNTWAOGJUNOOE-XFJVYGCCSA-N 1 1 374.359 2.975 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC000416406201 513755243 /nfs/dbraw/zinc/75/52/43/513755243.db2.gz FCGKTBUNWDOOMI-CABCVRRESA-N 1 1 369.487 2.562 20 5 FFBDMO O=C(C[NH+]1CCC(OC2CCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000419300638 513768047 /nfs/dbraw/zinc/76/80/47/513768047.db2.gz JMPHYQQVQXBZBY-UHFFFAOYSA-N 1 1 359.426 2.517 20 5 FFBDMO COc1ccc2c(c1)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000451643622 513883157 /nfs/dbraw/zinc/88/31/57/513883157.db2.gz QLFCFUYJSBPAFO-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc2c(c1)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000451643622 513883163 /nfs/dbraw/zinc/88/31/63/513883163.db2.gz QLFCFUYJSBPAFO-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO CN(C)c1ncc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1C ZINC000419731792 513900048 /nfs/dbraw/zinc/90/00/48/513900048.db2.gz RMBGDMBIJNFFPV-UHFFFAOYSA-N 1 1 357.336 2.703 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000448932284 513978014 /nfs/dbraw/zinc/97/80/14/513978014.db2.gz HSAWPQFBQBITMG-TXEJJXNPSA-N 1 1 353.394 2.735 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451859746 514026756 /nfs/dbraw/zinc/02/67/56/514026756.db2.gz AKTHWIBGIMYSPT-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO C[C@@H]1CN(CC(F)(F)F)CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000451875567 514038180 /nfs/dbraw/zinc/03/81/80/514038180.db2.gz VKWTVHLOSBMOFH-ZDUSSCGKSA-N 1 1 361.364 2.790 20 5 FFBDMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000451875567 514038185 /nfs/dbraw/zinc/03/81/85/514038185.db2.gz VKWTVHLOSBMOFH-ZDUSSCGKSA-N 1 1 361.364 2.790 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431931626 514043523 /nfs/dbraw/zinc/04/35/23/514043523.db2.gz RDUQPNMRMNGWQF-ZDUSSCGKSA-N 1 1 370.247 2.962 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@]3(CCSC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451963915 514098713 /nfs/dbraw/zinc/09/87/13/514098713.db2.gz IFCUVJNFIAGETF-AEFFLSMTSA-N 1 1 361.467 2.919 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@H]1CCC[N@H+](C)C1 ZINC000444084786 514117840 /nfs/dbraw/zinc/11/78/40/514117840.db2.gz LLEAGOHUCAPCRN-ZDUSSCGKSA-N 1 1 367.424 2.987 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12)[C@H]1CCC[N@@H+](C)C1 ZINC000444084786 514117844 /nfs/dbraw/zinc/11/78/44/514117844.db2.gz LLEAGOHUCAPCRN-ZDUSSCGKSA-N 1 1 367.424 2.987 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000432197215 514123869 /nfs/dbraw/zinc/12/38/69/514123869.db2.gz WUGCKPYXLHYLQJ-FXAWDEMLSA-N 1 1 369.421 2.844 20 5 FFBDMO C[C@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452055346 514164806 /nfs/dbraw/zinc/16/48/06/514164806.db2.gz UGGAAYNOWBJDNX-IDCJVQTKSA-N 1 1 364.467 2.737 20 5 FFBDMO C[C@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000452055346 514164810 /nfs/dbraw/zinc/16/48/10/514164810.db2.gz UGGAAYNOWBJDNX-IDCJVQTKSA-N 1 1 364.467 2.737 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000452103736 514193104 /nfs/dbraw/zinc/19/31/04/514193104.db2.gz MLZOEDQXRLPNAD-AWEZNQCLSA-N 1 1 363.414 2.641 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000420589150 514193373 /nfs/dbraw/zinc/19/33/73/514193373.db2.gz RNLVVQDZUSXYAT-YVMONPNESA-N 1 1 366.421 2.529 20 5 FFBDMO COC(=O)c1cc([C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)oc1C ZINC000432778555 514283109 /nfs/dbraw/zinc/28/31/09/514283109.db2.gz DXXKEQGTZTXPPL-AAEUAGOBSA-N 1 1 374.397 2.925 20 5 FFBDMO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677698 514298344 /nfs/dbraw/zinc/29/83/44/514298344.db2.gz NKYLZBUTRPWCKW-WBMJQRKESA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449677698 514298353 /nfs/dbraw/zinc/29/83/53/514298353.db2.gz NKYLZBUTRPWCKW-WBMJQRKESA-N 1 1 363.439 2.690 20 5 FFBDMO C[C@@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[N@H+]1CCCC[C@@H]1C ZINC000444850053 514350531 /nfs/dbraw/zinc/35/05/31/514350531.db2.gz NXVSPXIIPWBEMQ-STQMWFEESA-N 1 1 374.445 2.533 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(CO)(c4ccccc4)CC3)nc2c1 ZINC000433069522 514369496 /nfs/dbraw/zinc/36/94/96/514369496.db2.gz DAEXIBGYJAOJNR-UHFFFAOYSA-N 1 1 366.421 2.997 20 5 FFBDMO CC[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](CC)O1 ZINC000420949217 514396756 /nfs/dbraw/zinc/39/67/56/514396756.db2.gz FEHMPKLDFJOXEH-GASCZTMLSA-N 1 1 363.414 2.782 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000449973932 514449154 /nfs/dbraw/zinc/44/91/54/514449154.db2.gz SYSMDXLAEWFQEE-GDBMZVCRSA-N 1 1 361.442 2.889 20 5 FFBDMO C[C@@H](C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[NH+]1CCSCC1 ZINC000452836895 514511602 /nfs/dbraw/zinc/51/16/02/514511602.db2.gz DKBUJRMIWZDHBF-HOCLYGCPSA-N 1 1 363.483 2.738 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)c([N+](=O)[O-])cc1F ZINC000450192873 514534038 /nfs/dbraw/zinc/53/40/38/514534038.db2.gz LKGRTLUGCTYTNU-CYBMUJFWSA-N 1 1 367.421 2.983 20 5 FFBDMO COCC[C@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000502653624 514728656 /nfs/dbraw/zinc/72/86/56/514728656.db2.gz MNXCNBVTVKXZLG-HOTGVXAUSA-N 1 1 359.382 2.661 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000484826025 514807498 /nfs/dbraw/zinc/80/74/98/514807498.db2.gz AMAUHEDYTXLGEO-UHFFFAOYSA-N 1 1 360.389 2.637 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000498382239 514891109 /nfs/dbraw/zinc/89/11/09/514891109.db2.gz BQPQNHNKUBEKQQ-UHFFFAOYSA-N 1 1 368.437 2.663 20 5 FFBDMO COc1c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000476060505 514903768 /nfs/dbraw/zinc/90/37/68/514903768.db2.gz FCLDASRVJYXQIC-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1ccc(NC(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000480341500 514926747 /nfs/dbraw/zinc/92/67/47/514926747.db2.gz YPUJSXLIPAMHEF-UHFFFAOYSA-N 1 1 370.409 2.952 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000485204217 514955623 /nfs/dbraw/zinc/95/56/23/514955623.db2.gz NFGNNDSBSOTSQO-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000485204217 514955635 /nfs/dbraw/zinc/95/56/35/514955635.db2.gz NFGNNDSBSOTSQO-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO O=C(c1cc(C[NH+]2CCCC2)on1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000462246193 514956777 /nfs/dbraw/zinc/95/67/77/514956777.db2.gz KHVRDKOLBNJUCH-UHFFFAOYSA-N 1 1 370.409 2.983 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC[N@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467423372 515002456 /nfs/dbraw/zinc/00/24/56/515002456.db2.gz MLVGPKFYWDICTK-PHIMTYICSA-N 1 1 361.489 2.506 20 5 FFBDMO Cc1sc(S(=O)(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467423372 515002459 /nfs/dbraw/zinc/00/24/59/515002459.db2.gz MLVGPKFYWDICTK-PHIMTYICSA-N 1 1 361.489 2.506 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462491877 515083647 /nfs/dbraw/zinc/08/36/47/515083647.db2.gz SQHTYXHIMIPMHF-RHSMWYFYSA-N 1 1 368.437 2.885 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000467709059 515087996 /nfs/dbraw/zinc/08/79/96/515087996.db2.gz PCGGWMPECNXEMH-MJVIPROJSA-N 1 1 367.833 2.614 20 5 FFBDMO CCS[C@H]1CCCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000480866807 515118369 /nfs/dbraw/zinc/11/83/69/515118369.db2.gz RKUVMKCTISTZMH-RDJZCZTQSA-N 1 1 354.472 2.942 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000490171667 515129213 /nfs/dbraw/zinc/12/92/13/515129213.db2.gz GTJNRUFTPQKCKZ-AWEZNQCLSA-N 1 1 359.430 2.620 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000490204019 515140022 /nfs/dbraw/zinc/14/00/22/515140022.db2.gz SKPSJCBKKVNGSV-PMUMKWKESA-N 1 1 360.458 2.775 20 5 FFBDMO CC(C)c1cc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)nc(N(C)C)[nH+]1 ZINC000462774612 515236412 /nfs/dbraw/zinc/23/64/12/515236412.db2.gz KCHAHBUMZLLWMC-UHFFFAOYSA-N 1 1 370.457 2.901 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000490671613 515278468 /nfs/dbraw/zinc/27/84/68/515278468.db2.gz IPSSFWPVGDJCKZ-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO COc1c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477128427 515341172 /nfs/dbraw/zinc/34/11/72/515341172.db2.gz PYVMFWVUMMGMFQ-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000486145182 515351995 /nfs/dbraw/zinc/35/19/95/515351995.db2.gz NLRKKIXMDGLIFX-HTQZYQBOSA-N 1 1 362.249 2.631 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000486145182 515352004 /nfs/dbraw/zinc/35/20/04/515352004.db2.gz NLRKKIXMDGLIFX-HTQZYQBOSA-N 1 1 362.249 2.631 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000499698809 515416968 /nfs/dbraw/zinc/41/69/68/515416968.db2.gz YCSPJMHZKBJWQG-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@@H]1C[C@H](CCNC(=O)c2ccc([N+](=O)[O-])n2C)C[N@H+]1Cc1ccccc1 ZINC000510150549 515451088 /nfs/dbraw/zinc/45/10/88/515451088.db2.gz WMKVEKYAKKDKMB-WBVHZDCISA-N 1 1 370.453 2.964 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)[C@@H](c2ccccc2)C1 ZINC000481793545 515469979 /nfs/dbraw/zinc/46/99/79/515469979.db2.gz KKWMTEZKDDGUMM-IEBWSBKVSA-N 1 1 364.405 2.904 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492178021 515510346 /nfs/dbraw/zinc/51/03/46/515510346.db2.gz JFGXHTIJMDDQAM-VQTJNVASSA-N 1 1 354.454 2.520 20 5 FFBDMO CN1CCN(C)[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492178021 515510353 /nfs/dbraw/zinc/51/03/53/515510353.db2.gz JFGXHTIJMDDQAM-VQTJNVASSA-N 1 1 354.454 2.520 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000486517927 515522019 /nfs/dbraw/zinc/52/20/19/515522019.db2.gz WTKNWHIYZMPCJM-MRXNPFEDSA-N 1 1 368.865 2.772 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000510472445 515549716 /nfs/dbraw/zinc/54/97/16/515549716.db2.gz GDCPSHZZXRPMDI-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505498551 515559201 /nfs/dbraw/zinc/55/92/01/515559201.db2.gz LMZUDYWLUXJUSY-KRWDZBQOSA-N 1 1 369.421 2.953 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486666927 515588572 /nfs/dbraw/zinc/58/85/72/515588572.db2.gz SKYFEXRPBQAGHR-CYBMUJFWSA-N 1 1 369.412 2.900 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H]2CCC3(CCCCC3)O2)CC1 ZINC000459511497 515607658 /nfs/dbraw/zinc/60/76/58/515607658.db2.gz PKTVQRWCWSVGLF-MRXNPFEDSA-N 1 1 360.458 2.994 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494040583 515719329 /nfs/dbraw/zinc/71/93/29/515719329.db2.gz YDJCFHMSDKABAH-BEFAXECRSA-N 1 1 369.421 2.753 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000494061265 515723463 /nfs/dbraw/zinc/72/34/63/515723463.db2.gz VKMFQDBXLXJQJW-NVXWUHKLSA-N 1 1 368.437 2.786 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694408 515772950 /nfs/dbraw/zinc/77/29/50/515772950.db2.gz WGOBDFGNOQNPAH-KGLIPLIRSA-N 1 1 373.457 2.988 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482694408 515772957 /nfs/dbraw/zinc/77/29/57/515772957.db2.gz WGOBDFGNOQNPAH-KGLIPLIRSA-N 1 1 373.457 2.988 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCOc2ccccc21)CCc1ccccc1[N+](=O)[O-] ZINC000511142001 515803234 /nfs/dbraw/zinc/80/32/34/515803234.db2.gz YDRHQXVAGPLFAH-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459814174 515825265 /nfs/dbraw/zinc/82/52/65/515825265.db2.gz UDHDWCKMHMXBJL-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](C)C(=O)OC(C)(C)C ZINC000459814174 515825274 /nfs/dbraw/zinc/82/52/74/515825274.db2.gz UDHDWCKMHMXBJL-CYBMUJFWSA-N 1 1 365.430 2.751 20 5 FFBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459818742 515827999 /nfs/dbraw/zinc/82/79/99/515827999.db2.gz YNLACTPQWUMUCG-STQMWFEESA-N 1 1 365.430 2.831 20 5 FFBDMO CCc1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000478457095 515830999 /nfs/dbraw/zinc/83/09/99/515830999.db2.gz IQWXTQIZCYNAHW-MSOLQXFVSA-N 1 1 353.422 2.985 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CCOC)C1 ZINC000506353603 515858219 /nfs/dbraw/zinc/85/82/19/515858219.db2.gz FPFJLQXMOOYIDM-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000511559768 515944871 /nfs/dbraw/zinc/94/48/71/515944871.db2.gz JIHIJVASVUCJIZ-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO Cc1c(CNC(=O)NCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000478755209 515952441 /nfs/dbraw/zinc/95/24/41/515952441.db2.gz MEFALDGNNFERMF-UHFFFAOYSA-N 1 1 368.437 2.761 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501080024 515970039 /nfs/dbraw/zinc/97/00/39/515970039.db2.gz BPFWFSSPSJYFCE-NSHDSACASA-N 1 1 357.208 2.573 20 5 FFBDMO Cn1c(C(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000507106571 516091425 /nfs/dbraw/zinc/09/14/25/516091425.db2.gz WZZRYTQVBXJTKN-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO CC(C)c1ccc(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000470106795 516122090 /nfs/dbraw/zinc/12/20/90/516122090.db2.gz VYFDZSPCLWNXIX-HNNXBMFYSA-N 1 1 363.458 2.949 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000470137381 516137287 /nfs/dbraw/zinc/13/72/87/516137287.db2.gz JYVWUJFZWRGYPE-HNNXBMFYSA-N 1 1 368.409 2.699 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616492 516173607 /nfs/dbraw/zinc/17/36/07/516173607.db2.gz FVAXIFBEHRYFEA-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616492 516173617 /nfs/dbraw/zinc/17/36/17/516173617.db2.gz FVAXIFBEHRYFEA-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc(F)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000501873874 516252530 /nfs/dbraw/zinc/25/25/30/516252530.db2.gz MCQLVHBVEJSMDR-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc(F)cc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000501873874 516252533 /nfs/dbraw/zinc/25/25/33/516252533.db2.gz MCQLVHBVEJSMDR-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000507618707 516264594 /nfs/dbraw/zinc/26/45/94/516264594.db2.gz SXERDXXWNYOCIL-WBVHZDCISA-N 1 1 369.421 2.925 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488714514 516291698 /nfs/dbraw/zinc/29/16/98/516291698.db2.gz NCEXXZOOIOFYEJ-QWQRMKEZSA-N 1 1 372.469 2.654 20 5 FFBDMO C[C@@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135246 516302715 /nfs/dbraw/zinc/30/27/15/516302715.db2.gz QXUMMAZSEFIAAK-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135246 516302719 /nfs/dbraw/zinc/30/27/19/516302719.db2.gz QXUMMAZSEFIAAK-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135244 516302780 /nfs/dbraw/zinc/30/27/80/516302780.db2.gz QXUMMAZSEFIAAK-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000484135244 516302783 /nfs/dbraw/zinc/30/27/83/516302783.db2.gz QXUMMAZSEFIAAK-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@H]1C ZINC000497603992 516327801 /nfs/dbraw/zinc/32/78/01/516327801.db2.gz JXXKKPXTMHERES-GHMZBOCLSA-N 1 1 357.357 2.751 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000557733308 516410139 /nfs/dbraw/zinc/41/01/39/516410139.db2.gz IKTWCCXERRGLKY-ZDUSSCGKSA-N 1 1 370.247 2.962 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1C[C@H](OCC)C1(C)C ZINC000535583771 516411446 /nfs/dbraw/zinc/41/14/46/516411446.db2.gz WEBKUOHWMGCBRD-HOTGVXAUSA-N 1 1 351.447 2.672 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000561153615 516412407 /nfs/dbraw/zinc/41/24/07/516412407.db2.gz FPRUCWBJWZQGDK-HIFRSBDPSA-N 1 1 354.410 2.941 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccccc2)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC000523445280 516473795 /nfs/dbraw/zinc/47/37/95/516473795.db2.gz CGFFXLPNJBJNIJ-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC000523445280 516473805 /nfs/dbraw/zinc/47/38/05/516473805.db2.gz CGFFXLPNJBJNIJ-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO Cc1nc(CC[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)no1 ZINC000513216211 516528297 /nfs/dbraw/zinc/52/82/97/516528297.db2.gz YNYAGGZCSCRTAD-UHFFFAOYSA-N 1 1 357.370 2.658 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000558024817 516555691 /nfs/dbraw/zinc/55/56/91/516555691.db2.gz HGBIIFBWBIBQFB-OFQRWUPVSA-N 1 1 361.442 2.796 20 5 FFBDMO CCc1ccc(C(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000531663302 516584209 /nfs/dbraw/zinc/58/42/09/516584209.db2.gz DPTQMVDGECVMIV-IAGOWNOFSA-N 1 1 361.442 2.530 20 5 FFBDMO C[C@@H]1CC[N@@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140112 516646384 /nfs/dbraw/zinc/64/63/84/516646384.db2.gz LAXFBSLUEBHELQ-CZUORRHYSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000536140112 516646390 /nfs/dbraw/zinc/64/63/90/516646390.db2.gz LAXFBSLUEBHELQ-CZUORRHYSA-N 1 1 357.410 2.739 20 5 FFBDMO C[C@@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554843848 516660870 /nfs/dbraw/zinc/66/08/70/516660870.db2.gz OLXKJJQDPCFOPB-AWEZNQCLSA-N 1 1 359.401 2.913 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000540747237 516695150 /nfs/dbraw/zinc/69/51/50/516695150.db2.gz NCLFURBGNLQEHR-YJBOKZPZSA-N 1 1 364.490 2.646 20 5 FFBDMO CC(C)(C)c1ccc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000561681182 516713261 /nfs/dbraw/zinc/71/32/61/516713261.db2.gz ZUPINXBSKLRDAP-UHFFFAOYSA-N 1 1 357.414 2.578 20 5 FFBDMO Cc1c(Br)c(N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)ncc1[N+](=O)[O-] ZINC000544395003 516740044 /nfs/dbraw/zinc/74/00/44/516740044.db2.gz SXENLPYTDSYSAG-VXGBXAGGSA-N 1 1 369.263 2.981 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)C1 ZINC000561749739 516748218 /nfs/dbraw/zinc/74/82/18/516748218.db2.gz ZARHAHARDYIDOX-PMUMKWKESA-N 1 1 368.437 2.945 20 5 FFBDMO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760309 516763567 /nfs/dbraw/zinc/76/35/67/516763567.db2.gz RPIFADDBMHLFRI-MAUKXSAKSA-N 1 1 373.457 2.952 20 5 FFBDMO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1NC[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760309 516763573 /nfs/dbraw/zinc/76/35/73/516763573.db2.gz RPIFADDBMHLFRI-MAUKXSAKSA-N 1 1 373.457 2.952 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000518865523 516800709 /nfs/dbraw/zinc/80/07/09/516800709.db2.gz LLCQIKFWIQYTEA-ZDUSSCGKSA-N 1 1 351.451 2.512 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000541013664 516829082 /nfs/dbraw/zinc/82/90/82/516829082.db2.gz DZBHRRHHJJXCTH-LLVKDONJSA-N 1 1 357.357 2.656 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000514191136 516895976 /nfs/dbraw/zinc/89/59/76/516895976.db2.gz VYWOXDPGHRGYMY-NSHDSACASA-N 1 1 374.363 2.613 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC2 ZINC000536719499 516906884 /nfs/dbraw/zinc/90/68/84/516906884.db2.gz UTRHCLYMZAGADE-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccc2c(c1)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC2 ZINC000536719499 516906889 /nfs/dbraw/zinc/90/68/89/516906889.db2.gz UTRHCLYMZAGADE-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000514635237 516973002 /nfs/dbraw/zinc/97/30/02/516973002.db2.gz NICQECAXWYXYAV-ZDUSSCGKSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1ccc(OCC[N@H+](Cc2ccccc2)C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000525274435 516989477 /nfs/dbraw/zinc/98/94/77/516989477.db2.gz KBORMWSIPOZHLJ-HNNXBMFYSA-N 1 1 360.410 2.865 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@H]1CC[N@H+](CC)[C@@H](C)C1 ZINC000525385639 517025028 /nfs/dbraw/zinc/02/50/28/517025028.db2.gz FCQCQYPGIBKAQG-ZFWWWQNUSA-N 1 1 369.487 2.651 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000525560307 517075595 /nfs/dbraw/zinc/07/55/95/517075595.db2.gz NVINIKZMKHEPLM-QWHCGFSZSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000545156864 517076166 /nfs/dbraw/zinc/07/61/66/517076166.db2.gz LANQZUMKDBRZQI-ZDUSSCGKSA-N 1 1 351.422 2.858 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552282315 517178180 /nfs/dbraw/zinc/17/81/80/517178180.db2.gz AFVRJWJZRFPKQA-BPQIPLTHSA-N 1 1 356.426 2.965 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000548736510 517179973 /nfs/dbraw/zinc/17/99/73/517179973.db2.gz UWMIKMVQXTWRAI-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000548736510 517179978 /nfs/dbraw/zinc/17/99/78/517179978.db2.gz UWMIKMVQXTWRAI-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C ZINC000555928399 517187966 /nfs/dbraw/zinc/18/79/66/517187966.db2.gz OWEGTGRQSGEUNU-MNOVXSKESA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C ZINC000555928399 517187970 /nfs/dbraw/zinc/18/79/70/517187970.db2.gz OWEGTGRQSGEUNU-MNOVXSKESA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCN(Cc2ccco2)CC1 ZINC000532907358 517195822 /nfs/dbraw/zinc/19/58/22/517195822.db2.gz GBKJPDMYGYFPFL-UHFFFAOYSA-N 1 1 372.425 2.643 20 5 FFBDMO Cc1cc(NC[C@@H]2CC[N@H+](C(C)C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000548764971 517199285 /nfs/dbraw/zinc/19/92/85/517199285.db2.gz LRYIDFRUHPKQKN-HNNXBMFYSA-N 1 1 355.442 2.924 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532974061 517228256 /nfs/dbraw/zinc/22/82/56/517228256.db2.gz NAAJPDRGVPEBRU-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccccc1)C[C@@H](C)O ZINC000532974061 517228260 /nfs/dbraw/zinc/22/82/60/517228260.db2.gz NAAJPDRGVPEBRU-OAHLLOKOSA-N 1 1 357.410 2.725 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000537613113 517257058 /nfs/dbraw/zinc/25/70/58/517257058.db2.gz CKSUWZGMGVUAPM-GOEBONIOSA-N 1 1 356.426 2.574 20 5 FFBDMO C[C@@H](C(=O)NC(=O)Nc1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000520257958 517320692 /nfs/dbraw/zinc/32/06/92/517320692.db2.gz SHRCCCJAFDNZLI-AWEZNQCLSA-N 1 1 370.409 2.806 20 5 FFBDMO COc1ccc2c(c1)C[C@H](C)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]2C ZINC000541988928 517325175 /nfs/dbraw/zinc/32/51/75/517325175.db2.gz CSZAUZCPFQDNST-UONOGXRCSA-N 1 1 357.410 2.773 20 5 FFBDMO CCC[C@H]1CN(c2cccc(OCC)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000545872689 517408580 /nfs/dbraw/zinc/40/85/80/517408580.db2.gz OWOSVVCHFWEUHG-HNNXBMFYSA-N 1 1 351.447 2.931 20 5 FFBDMO C[C@@](O)(C1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1)C(F)(F)F ZINC000545931860 517442613 /nfs/dbraw/zinc/44/26/13/517442613.db2.gz MGFCHFNLKORFES-OAHLLOKOSA-N 1 1 362.348 2.999 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2n[nH]cc2Br)n1 ZINC000520720105 517490107 /nfs/dbraw/zinc/49/01/07/517490107.db2.gz NEJCNZKZSDWYNK-PWSUYJOCSA-N 1 1 369.223 2.550 20 5 FFBDMO CN(c1cccc(C(N)=O)c1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000553155109 517548344 /nfs/dbraw/zinc/54/83/44/517548344.db2.gz YGJGBOQPTQKWQA-INIZCTEOSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000553162271 517551073 /nfs/dbraw/zinc/55/10/73/517551073.db2.gz LLGMGUPRJVUCBC-LBPRGKRZSA-N 1 1 360.439 2.638 20 5 FFBDMO COCCO[C@@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000549411215 517551091 /nfs/dbraw/zinc/55/10/91/517551091.db2.gz ZJGZMEILGREZDS-GOSISDBHSA-N 1 1 374.441 2.623 20 5 FFBDMO NC(=O)c1cccc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)c1[N+](=O)[O-] ZINC000553225278 517587013 /nfs/dbraw/zinc/58/70/13/517587013.db2.gz MHNCJNIZODNPSS-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C ZINC000538918884 517842081 /nfs/dbraw/zinc/84/20/81/517842081.db2.gz PGYLAPLFCQZXKP-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C ZINC000538918884 517842093 /nfs/dbraw/zinc/84/20/93/517842093.db2.gz PGYLAPLFCQZXKP-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000521835462 517866908 /nfs/dbraw/zinc/86/69/08/517866908.db2.gz KIXPYIKMCQPGET-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000521835462 517866919 /nfs/dbraw/zinc/86/69/19/517866919.db2.gz KIXPYIKMCQPGET-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[N@@H+](CCCCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1 ZINC000516850720 517869061 /nfs/dbraw/zinc/86/90/61/517869061.db2.gz ZVKJOYKWBXYKRZ-UHFFFAOYSA-N 1 1 373.457 2.792 20 5 FFBDMO C[C@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@@H+](C)Cc1ccccc1 ZINC000521955519 517917262 /nfs/dbraw/zinc/91/72/62/517917262.db2.gz LALPOWXRCMIEMM-CYBMUJFWSA-N 1 1 371.393 2.574 20 5 FFBDMO Cc1c(C[N@@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000550225475 517937743 /nfs/dbraw/zinc/93/77/43/517937743.db2.gz IFYYETDCXRWACT-IBGZPJMESA-N 1 1 353.422 2.836 20 5 FFBDMO Cc1c(C[N@H+]2CCCNC(=O)[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000550225475 517937751 /nfs/dbraw/zinc/93/77/51/517937751.db2.gz IFYYETDCXRWACT-IBGZPJMESA-N 1 1 353.422 2.836 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000534643361 517979029 /nfs/dbraw/zinc/97/90/29/517979029.db2.gz SQGPAHNXQQTFEQ-OWCLPIDISA-N 1 1 362.474 2.803 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000553958771 517993321 /nfs/dbraw/zinc/99/33/21/517993321.db2.gz QOXSOWPCVCZVBI-OAHLLOKOSA-N 1 1 372.425 2.988 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000547281893 518056387 /nfs/dbraw/zinc/05/63/87/518056387.db2.gz GEMLZXJCGAZRIZ-UHFFFAOYSA-N 1 1 372.469 2.579 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Oc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000584410214 518328786 /nfs/dbraw/zinc/32/87/86/518328786.db2.gz TZVCAJRYGFPBKS-SFHVURJKSA-N 1 1 367.405 2.637 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Oc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000584410214 518328790 /nfs/dbraw/zinc/32/87/90/518328790.db2.gz TZVCAJRYGFPBKS-SFHVURJKSA-N 1 1 367.405 2.637 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccc(O)cc2C1 ZINC000569889728 518341322 /nfs/dbraw/zinc/34/13/22/518341322.db2.gz XVYFMYOYQCQRIF-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CCCc2[nH]cnc21 ZINC000570144398 518460871 /nfs/dbraw/zinc/46/08/71/518460871.db2.gz CDHUGONXTGWDQT-ZDUSSCGKSA-N 1 1 353.382 2.578 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1(C)C ZINC000576248252 518502208 /nfs/dbraw/zinc/50/22/08/518502208.db2.gz KJBSMSNSNQMKSO-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1(C)C ZINC000576248252 518502216 /nfs/dbraw/zinc/50/22/16/518502216.db2.gz KJBSMSNSNQMKSO-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO CC1(C)CC[N@@H+](CC(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000570292217 518536109 /nfs/dbraw/zinc/53/61/09/518536109.db2.gz HKYZGTFZUOIMMX-UHFFFAOYSA-N 1 1 361.442 2.697 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023204 518550861 /nfs/dbraw/zinc/55/08/61/518550861.db2.gz WQYDAQXKEKSYCX-YPMHNXCESA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023204 518550866 /nfs/dbraw/zinc/55/08/66/518550866.db2.gz WQYDAQXKEKSYCX-YPMHNXCESA-N 1 1 355.822 2.568 20 5 FFBDMO COc1cc(Cc2noc([C@H]3CCc4[nH+]ccn4C3)n2)ccc1[N+](=O)[O-] ZINC000570376744 518574682 /nfs/dbraw/zinc/57/46/82/518574682.db2.gz OJNJJYUILKEEQG-LBPRGKRZSA-N 1 1 355.354 2.504 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000576524547 518634001 /nfs/dbraw/zinc/63/40/01/518634001.db2.gz VULDVDWTSBQIOR-KBXCAEBGSA-N 1 1 372.450 2.936 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000579384500 518655260 /nfs/dbraw/zinc/65/52/60/518655260.db2.gz VPDQXTSKKQMMED-IBGZPJMESA-N 1 1 355.438 2.962 20 5 FFBDMO C[N@@H+](CCCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)Cc1ccccc1 ZINC000587029852 518675557 /nfs/dbraw/zinc/67/55/57/518675557.db2.gz UDLBKWUPEHIRDP-UHFFFAOYSA-N 1 1 367.409 2.600 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC1 ZINC000576934714 518834486 /nfs/dbraw/zinc/83/44/86/518834486.db2.gz UWHVOMKFWVGLKT-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO CC(C)(C)[N@@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000576934714 518834491 /nfs/dbraw/zinc/83/44/91/518834491.db2.gz UWHVOMKFWVGLKT-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000576934714 518834497 /nfs/dbraw/zinc/83/44/97/518834497.db2.gz UWHVOMKFWVGLKT-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576986124 518861589 /nfs/dbraw/zinc/86/15/89/518861589.db2.gz OEOBXALYWNBPMY-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000576986124 518861593 /nfs/dbraw/zinc/86/15/93/518861593.db2.gz OEOBXALYWNBPMY-UKRRQHHQSA-N 1 1 370.409 2.815 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH+]c[nH]c3C2)nc1-c1ccc(F)cc1 ZINC000571339202 519045698 /nfs/dbraw/zinc/04/56/98/519045698.db2.gz CDQSYQZIIAKBKC-ZDUSSCGKSA-N 1 1 353.357 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH]c[nH+]c3C2)nc1-c1ccc(F)cc1 ZINC000571339202 519045702 /nfs/dbraw/zinc/04/57/02/519045702.db2.gz CDQSYQZIIAKBKC-ZDUSSCGKSA-N 1 1 353.357 2.910 20 5 FFBDMO O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000574367889 519119661 /nfs/dbraw/zinc/11/96/61/519119661.db2.gz WSQLEIACLJBLLS-KRWDZBQOSA-N 1 1 371.441 2.884 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1 ZINC000589997202 519123909 /nfs/dbraw/zinc/12/39/09/519123909.db2.gz ZRPGRSVMHTVMLT-KRWDZBQOSA-N 1 1 355.394 2.722 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659904 519151718 /nfs/dbraw/zinc/15/17/18/519151718.db2.gz MRKJNEJDKSRWGL-BEFAXECRSA-N 1 1 366.421 2.893 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659904 519151724 /nfs/dbraw/zinc/15/17/24/519151724.db2.gz MRKJNEJDKSRWGL-BEFAXECRSA-N 1 1 366.421 2.893 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000568683915 519161708 /nfs/dbraw/zinc/16/17/08/519161708.db2.gz SYTZBJRHSORTSC-ZDUSSCGKSA-N 1 1 355.822 2.570 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000590582901 519275319 /nfs/dbraw/zinc/27/53/19/519275319.db2.gz WDWXPXBNLYVCQQ-ZWNOBZJWSA-N 1 1 353.806 2.565 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590806559 519381295 /nfs/dbraw/zinc/38/12/95/519381295.db2.gz RMMICKYRKJIOBK-MSOLQXFVSA-N 1 1 372.469 2.968 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000590926381 519437290 /nfs/dbraw/zinc/43/72/90/519437290.db2.gz OGIPBPXYRCMRHV-AEFFLSMTSA-N 1 1 360.458 2.968 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)CC23CCCCC3)c([N+](=O)[O-])cc1F ZINC000590985328 519467762 /nfs/dbraw/zinc/46/77/62/519467762.db2.gz CICJILFDXNLUGR-UHFFFAOYSA-N 1 1 365.405 2.833 20 5 FFBDMO COC(=O)c1cc(C)nc(N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000575080589 519490614 /nfs/dbraw/zinc/49/06/14/519490614.db2.gz UQWFPWPUWNQIBX-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000569582710 519620412 /nfs/dbraw/zinc/62/04/12/519620412.db2.gz ZFAWMKNTLHHLNO-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](c3cccnc3)C2)c1 ZINC000602855825 519930069 /nfs/dbraw/zinc/93/00/69/519930069.db2.gz PQYMUTUFHUMHHG-WMZOPIPTSA-N 1 1 357.410 2.609 20 5 FFBDMO CCN(C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000602965535 519997074 /nfs/dbraw/zinc/99/70/74/519997074.db2.gz IATLMYZYAAWOGO-IBGZPJMESA-N 1 1 363.458 2.573 20 5 FFBDMO Cc1nn(C)c(-c2nc(CCCCn3c[nH+]c(C)c3C)no2)c1[N+](=O)[O-] ZINC000594534027 520016151 /nfs/dbraw/zinc/01/61/51/520016151.db2.gz FVWIPQGEZLZNGB-UHFFFAOYSA-N 1 1 359.390 2.523 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000600087953 520039892 /nfs/dbraw/zinc/03/98/92/520039892.db2.gz PEWMARWZNDQMRQ-SNVBAGLBSA-N 1 1 370.247 2.960 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600182404 520106893 /nfs/dbraw/zinc/10/68/93/520106893.db2.gz BICPVEZLZLWWJH-RYUDHWBXSA-N 1 1 372.368 2.870 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000600226397 520138074 /nfs/dbraw/zinc/13/80/74/520138074.db2.gz AEVUYJWHHFOIQS-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000600226397 520138081 /nfs/dbraw/zinc/13/80/81/520138081.db2.gz AEVUYJWHHFOIQS-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000600226397 520138088 /nfs/dbraw/zinc/13/80/88/520138088.db2.gz AEVUYJWHHFOIQS-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC000600226397 520138091 /nfs/dbraw/zinc/13/80/91/520138091.db2.gz AEVUYJWHHFOIQS-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000600230074 520140120 /nfs/dbraw/zinc/14/01/20/520140120.db2.gz ZBWYDDPDQLPYNF-AWEZNQCLSA-N 1 1 357.414 2.608 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000608855772 520145110 /nfs/dbraw/zinc/14/51/10/520145110.db2.gz PYGSITJOKQAVRM-CYBMUJFWSA-N 1 1 370.247 2.658 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCC[C@@H]4CCOC4)CC3)nc2c1 ZINC000592101655 520185292 /nfs/dbraw/zinc/18/52/92/520185292.db2.gz CUTFUNWOCRAQGI-OAHLLOKOSA-N 1 1 373.457 2.800 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000600298887 520188721 /nfs/dbraw/zinc/18/87/21/520188721.db2.gz OEGWABRSIPIQRN-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2C)cc1 ZINC000600298887 520188730 /nfs/dbraw/zinc/18/87/30/520188730.db2.gz OEGWABRSIPIQRN-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000600312375 520198489 /nfs/dbraw/zinc/19/84/89/520198489.db2.gz FXPQLCMTSOWNKD-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000600316263 520200324 /nfs/dbraw/zinc/20/03/24/520200324.db2.gz YPWGZRZLSYUUON-ZDUSSCGKSA-N 1 1 369.849 2.865 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000600314171 520201521 /nfs/dbraw/zinc/20/15/21/520201521.db2.gz MFOBVCBHZZHDFA-CHWSQXEVSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](n2ccnc2)C1 ZINC000609157510 520214236 /nfs/dbraw/zinc/21/42/36/520214236.db2.gz ZZEHTUJUMJMONH-INIZCTEOSA-N 1 1 357.414 2.765 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000592154816 520232425 /nfs/dbraw/zinc/23/24/25/520232425.db2.gz KCAQAYMZGBWOGM-MRXNPFEDSA-N 1 1 357.385 2.872 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000592183115 520249299 /nfs/dbraw/zinc/24/92/99/520249299.db2.gz CYFWGPRXDQOUMT-ABAIWWIYSA-N 1 1 359.348 2.965 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000600472722 520279553 /nfs/dbraw/zinc/27/95/53/520279553.db2.gz OWTCZYKQBKZPCM-KRWDZBQOSA-N 1 1 369.425 2.527 20 5 FFBDMO CCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OCC)[C@@H]1CC[N@@H+](C)C1 ZINC000592258742 520295106 /nfs/dbraw/zinc/29/51/06/520295106.db2.gz UHHTWOIJFGNXAP-CQSZACIVSA-N 1 1 350.419 2.942 20 5 FFBDMO CCc1cc(N[C@@H]2CC[N@@H+](CC3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000609384288 520299724 /nfs/dbraw/zinc/29/97/24/520299724.db2.gz FACDWBIEFFUHTI-QGZVFWFLSA-N 1 1 367.453 2.932 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCc3ccc(O)cc3CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000609449503 520315276 /nfs/dbraw/zinc/31/52/76/520315276.db2.gz YXVNFVUQBWPHTJ-LJQANCHMSA-N 1 1 367.405 2.507 20 5 FFBDMO O=C1[C@H]([N@H+]2CCc3ccc(O)cc3CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000609449503 520315284 /nfs/dbraw/zinc/31/52/84/520315284.db2.gz YXVNFVUQBWPHTJ-LJQANCHMSA-N 1 1 367.405 2.507 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc1OC ZINC000597922530 520324430 /nfs/dbraw/zinc/32/44/30/520324430.db2.gz FQCPGQCPJKYOHV-LBPRGKRZSA-N 1 1 365.430 2.605 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCCC[C@@H]1C ZINC000609547795 520353669 /nfs/dbraw/zinc/35/36/69/520353669.db2.gz JIPGANJFJUELJK-STQMWFEESA-N 1 1 372.425 2.841 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000609549646 520355474 /nfs/dbraw/zinc/35/54/74/520355474.db2.gz GBCDLUBNQNFCCC-BETUJISGSA-N 1 1 372.425 2.841 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000592478716 520406993 /nfs/dbraw/zinc/40/69/93/520406993.db2.gz ITGSKIVCVWQHOH-CRAIPNDOSA-N 1 1 360.458 2.696 20 5 FFBDMO C[NH+]1CCN(CC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000609771586 520427240 /nfs/dbraw/zinc/42/72/40/520427240.db2.gz PROCYIFYQYWUTR-UHFFFAOYSA-N 1 1 370.409 2.573 20 5 FFBDMO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000595414731 520454963 /nfs/dbraw/zinc/45/49/63/520454963.db2.gz LBYFIBBVRRJFJW-HNNXBMFYSA-N 1 1 367.402 2.622 20 5 FFBDMO Cc1noc(C[NH2+][C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000595476755 520495126 /nfs/dbraw/zinc/49/51/26/520495126.db2.gz OVPYGNUVNWALDH-CJNGLKHVSA-N 1 1 352.341 2.704 20 5 FFBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000604489590 520577569 /nfs/dbraw/zinc/57/75/69/520577569.db2.gz OZNSSNXTLAZZDX-AWEZNQCLSA-N 1 1 367.833 2.575 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccco2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595614148 520594068 /nfs/dbraw/zinc/59/40/68/520594068.db2.gz GJMRBGKOHGRVKE-UHFFFAOYSA-N 1 1 355.394 2.957 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000598466651 520630193 /nfs/dbraw/zinc/63/01/93/520630193.db2.gz RTCCDSQOFYUTBC-UHFFFAOYSA-N 1 1 374.441 2.758 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000601147179 520660017 /nfs/dbraw/zinc/66/00/17/520660017.db2.gz XKQHSZKYDQJYQN-KBPBESRZSA-N 1 1 359.382 2.690 20 5 FFBDMO Cn1c(=O)sc2cc(C[NH2+][C@@](C)(CO)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000601148618 520660201 /nfs/dbraw/zinc/66/02/01/520660201.db2.gz FNWODCTXYNHHPA-SFHVURJKSA-N 1 1 373.434 2.506 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000601198907 520683000 /nfs/dbraw/zinc/68/30/00/520683000.db2.gz JMRXMHHMJNOBTN-LLVKDONJSA-N 1 1 361.368 2.881 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1 ZINC000593019732 520687302 /nfs/dbraw/zinc/68/73/02/520687302.db2.gz JLQFILSUOJIJGM-NSHDSACASA-N 1 1 358.350 2.961 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@H]1Cc1ccccc1F ZINC000593080087 520729447 /nfs/dbraw/zinc/72/94/47/520729447.db2.gz DUAHSXIPFNYOMW-INIZCTEOSA-N 1 1 359.401 2.993 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+]([C@H]2CCCOC2)CC1 ZINC000610559993 520738426 /nfs/dbraw/zinc/73/84/26/520738426.db2.gz INFRXXRLBIYGDQ-ZDUSSCGKSA-N 1 1 359.348 2.915 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCc2ccccc21 ZINC000595882212 520789258 /nfs/dbraw/zinc/78/92/58/520789258.db2.gz ZJNUHGMBYWTYNV-FUHWJXTLSA-N 1 1 356.422 2.996 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CC1=CCSC1 ZINC000595887239 520793861 /nfs/dbraw/zinc/79/38/61/520793861.db2.gz CJIKSKQTEYMOLE-LLVKDONJSA-N 1 1 351.428 2.535 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CC1=CCSC1 ZINC000595887239 520793866 /nfs/dbraw/zinc/79/38/66/520793866.db2.gz CJIKSKQTEYMOLE-LLVKDONJSA-N 1 1 351.428 2.535 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000593188462 520812890 /nfs/dbraw/zinc/81/28/90/520812890.db2.gz IAVSDAZCYPKBCI-GMTAPVOTSA-N 1 1 370.247 2.910 20 5 FFBDMO CC1CCC(O)(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000596094007 520907685 /nfs/dbraw/zinc/90/76/85/520907685.db2.gz GGPWSWMQUHVBFS-KGYZHSKHSA-N 1 1 358.442 2.949 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CC[NH+](Cc3ccccc3)CC1)OCCO2 ZINC000610929954 520908769 /nfs/dbraw/zinc/90/87/69/520908769.db2.gz YNTACMSVQABKDJ-UHFFFAOYSA-N 1 1 369.421 2.684 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596150989 520940020 /nfs/dbraw/zinc/94/00/20/520940020.db2.gz GWDIBOVKSOTSEH-GHMZBOCLSA-N 1 1 355.822 2.811 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000611088285 520978359 /nfs/dbraw/zinc/97/83/59/520978359.db2.gz NTQGVPPXXFETKN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000611088285 520978362 /nfs/dbraw/zinc/97/83/62/520978362.db2.gz NTQGVPPXXFETKN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000599020012 520984123 /nfs/dbraw/zinc/98/41/23/520984123.db2.gz LRFKYXSGBIELGZ-MRXNPFEDSA-N 1 1 356.426 2.834 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC000601851645 520988187 /nfs/dbraw/zinc/98/81/87/520988187.db2.gz VFWQTZYHAFMBOY-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC000601851644 520988471 /nfs/dbraw/zinc/98/84/71/520988471.db2.gz VFWQTZYHAFMBOY-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000618307234 520990138 /nfs/dbraw/zinc/99/01/38/520990138.db2.gz UULUCAJLTQVQRR-IBGZPJMESA-N 1 1 363.377 2.567 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000618307234 520990142 /nfs/dbraw/zinc/99/01/42/520990142.db2.gz UULUCAJLTQVQRR-IBGZPJMESA-N 1 1 363.377 2.567 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])cnc3C)C2)cc1 ZINC000601878478 521001732 /nfs/dbraw/zinc/00/17/32/521001732.db2.gz AFJLEAXPXFIUCW-INIZCTEOSA-N 1 1 354.410 2.611 20 5 FFBDMO CN1Cc2ccccc2[C@@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000611134196 521002748 /nfs/dbraw/zinc/00/27/48/521002748.db2.gz PEIBNBQRERUXFK-INIZCTEOSA-N 1 1 355.394 2.642 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@]1([NH+]2CCOCC2)CCSC1 ZINC000593456356 521003518 /nfs/dbraw/zinc/00/35/18/521003518.db2.gz DNZQBDWPIGZLJP-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000611150016 521011076 /nfs/dbraw/zinc/01/10/76/521011076.db2.gz QXMIWXTUKXUHAA-KRWDZBQOSA-N 1 1 358.394 2.669 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)[C@@H](Cc2ccccc2)C1 ZINC000593504850 521035936 /nfs/dbraw/zinc/03/59/36/521035936.db2.gz RTIQELCCAYCXJR-KRWDZBQOSA-N 1 1 363.421 2.901 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599164069 521065806 /nfs/dbraw/zinc/06/58/06/521065806.db2.gz IZSNLCWXTMPLQS-NSHDSACASA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599164069 521065813 /nfs/dbraw/zinc/06/58/13/521065813.db2.gz IZSNLCWXTMPLQS-NSHDSACASA-N 1 1 355.236 2.603 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1(O)CCCCCC1 ZINC000614662858 521080188 /nfs/dbraw/zinc/08/01/88/521080188.db2.gz AIDNHLBAFYKFKV-UHFFFAOYSA-N 1 1 350.415 2.883 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1 ZINC000611370589 521122997 /nfs/dbraw/zinc/12/29/97/521122997.db2.gz KQBZHIMMTBZIEK-GASCZTMLSA-N 1 1 363.458 2.929 20 5 FFBDMO O=[N+]([O-])c1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1C(F)(F)F ZINC000596540888 521123159 /nfs/dbraw/zinc/12/31/59/521123159.db2.gz VRKPXECZEZCTFL-CYBMUJFWSA-N 1 1 359.348 2.649 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)c1 ZINC000593717238 521173065 /nfs/dbraw/zinc/17/30/65/521173065.db2.gz WPHJHBPPGCPCQH-CQSZACIVSA-N 1 1 373.457 2.607 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CCO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000611518696 521198569 /nfs/dbraw/zinc/19/85/69/521198569.db2.gz DLXQCWVIWXOZAT-LBPRGKRZSA-N 1 1 374.384 2.842 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)cc1F ZINC000611525525 521203407 /nfs/dbraw/zinc/20/34/07/521203407.db2.gz JACDDSFHIAQKBC-UHFFFAOYSA-N 1 1 371.372 2.915 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccn(-c4cccc(F)c4)n3)CC2)n1 ZINC000618760297 521217811 /nfs/dbraw/zinc/21/78/11/521217811.db2.gz PCSUSWJQHPYQKJ-UHFFFAOYSA-N 1 1 370.388 2.953 20 5 FFBDMO Cc1ccc(CNC(=O)CNc2ccccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611582205 521236174 /nfs/dbraw/zinc/23/61/74/521236174.db2.gz HTFIMBXJIPBZKL-UHFFFAOYSA-N 1 1 369.425 2.627 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000611583182 521236381 /nfs/dbraw/zinc/23/63/81/521236381.db2.gz LWRPCQVLPSZLNQ-CHWSQXEVSA-N 1 1 363.462 2.824 20 5 FFBDMO O=C(c1c(Br)cccc1[N+](=O)[O-])N1CC[NH+](C2CCC2)CC1 ZINC000599492202 521257093 /nfs/dbraw/zinc/25/70/93/521257093.db2.gz UTODZITXKHMYJF-UHFFFAOYSA-N 1 1 368.231 2.668 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](CO)C2)cc1OC ZINC000611662675 521270171 /nfs/dbraw/zinc/27/01/71/521270171.db2.gz XJPMGWDYAIQZKG-KGLIPLIRSA-N 1 1 352.431 2.843 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](CO)C2)cc1OC ZINC000611662675 521270176 /nfs/dbraw/zinc/27/01/76/521270176.db2.gz XJPMGWDYAIQZKG-KGLIPLIRSA-N 1 1 352.431 2.843 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553347 521293152 /nfs/dbraw/zinc/29/31/52/521293152.db2.gz QBKGCCNMTPANKR-BNOWGMLFSA-N 1 1 365.455 2.900 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553347 521293163 /nfs/dbraw/zinc/29/31/63/521293163.db2.gz QBKGCCNMTPANKR-BNOWGMLFSA-N 1 1 365.455 2.900 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000593987386 521331745 /nfs/dbraw/zinc/33/17/45/521331745.db2.gz OWIDHWXYSDHKGX-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000593997544 521338475 /nfs/dbraw/zinc/33/84/75/521338475.db2.gz LOHCETLRXRMLSM-INIZCTEOSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000593997544 521338482 /nfs/dbraw/zinc/33/84/82/521338482.db2.gz LOHCETLRXRMLSM-INIZCTEOSA-N 1 1 371.441 2.701 20 5 FFBDMO O=C1NCCN1[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602449175 521351345 /nfs/dbraw/zinc/35/13/45/521351345.db2.gz ORNAHNVHYYMFHS-CYBMUJFWSA-N 1 1 372.347 2.603 20 5 FFBDMO O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602449175 521351351 /nfs/dbraw/zinc/35/13/51/521351351.db2.gz ORNAHNVHYYMFHS-CYBMUJFWSA-N 1 1 372.347 2.603 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCCc2cc(-c3ccccc3)n[nH]2)c([N+](=O)[O-])n1 ZINC000602454172 521356373 /nfs/dbraw/zinc/35/63/73/521356373.db2.gz PLDKPUQPGFLIMR-UHFFFAOYSA-N 1 1 354.414 2.783 20 5 FFBDMO CN(C)[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000602503311 521383806 /nfs/dbraw/zinc/38/38/06/521383806.db2.gz LURCQKWQMYZGRE-INIZCTEOSA-N 1 1 354.410 2.999 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108724 521408571 /nfs/dbraw/zinc/40/85/71/521408571.db2.gz FPZIIRVUXQAKSB-MCIONIFRSA-N 1 1 364.446 2.776 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108724 521408577 /nfs/dbraw/zinc/40/85/77/521408577.db2.gz FPZIIRVUXQAKSB-MCIONIFRSA-N 1 1 364.446 2.776 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000612030452 521447047 /nfs/dbraw/zinc/44/70/47/521447047.db2.gz KFUHOQDBKQJVJU-FXAWDEMLSA-N 1 1 372.421 2.798 20 5 FFBDMO O=C1[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C[C@@H]2CCCCN12 ZINC000602686758 521479845 /nfs/dbraw/zinc/47/98/45/521479845.db2.gz HTGAXDMFWBPGMZ-GZMMTYOYSA-N 1 1 374.260 2.662 20 5 FFBDMO Cn1cc(C[NH+]2CCC(c3ccc4cccnc4n3)CC2)c([N+](=O)[O-])n1 ZINC000602709034 521488905 /nfs/dbraw/zinc/48/89/05/521488905.db2.gz YWVUQHASDKRXAE-UHFFFAOYSA-N 1 1 352.398 2.651 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599829348 521497588 /nfs/dbraw/zinc/49/75/88/521497588.db2.gz FXVBWMTYEQWFEB-ZDUSSCGKSA-N 1 1 357.414 2.995 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@@H]2C1 ZINC000599832687 521501726 /nfs/dbraw/zinc/50/17/26/521501726.db2.gz IGUABJJKGAPLAH-SJKOYZFVSA-N 1 1 355.398 2.701 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2CCn2c(C)ncc2[N+](=O)[O-])cc1OC ZINC000602760342 521518064 /nfs/dbraw/zinc/51/80/64/521518064.db2.gz QLTIWHVPEJMOSA-OAHLLOKOSA-N 1 1 360.414 2.954 20 5 FFBDMO COc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000619440575 521568917 /nfs/dbraw/zinc/56/89/17/521568917.db2.gz HPWOAFFYUJKXSC-CZUORRHYSA-N 1 1 359.426 2.692 20 5 FFBDMO O=C(NC1CC([NH+]2CCOCC2)C1)c1cc2ccccc2c2cccnc12 ZINC000627930288 523215674 /nfs/dbraw/zinc/21/56/74/523215674.db2.gz ZSHUMWBCIRRIBJ-UHFFFAOYSA-N 1 1 361.445 2.981 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(-c3nn[nH]n3)c2)CC1 ZINC000826212201 608527806 /nfs/dbraw/zinc/52/78/06/608527806.db2.gz JTUATACIAWPXJK-UHFFFAOYSA-N 1 1 366.381 2.562 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000824656554 609314499 /nfs/dbraw/zinc/31/44/99/609314499.db2.gz LPPUMYCNBDWLQN-QWHCGFSZSA-N 1 1 371.445 2.840 20 5 FFBDMO Cc1cc(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)nc(C(C)C)[nH+]1 ZINC000543482431 673649676 /nfs/dbraw/zinc/64/96/76/673649676.db2.gz BMXRHPRNAHFUNO-UHFFFAOYSA-N 1 1 364.427 2.702 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@@H]3C[N@@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164784895 721390488 /nfs/dbraw/zinc/39/04/88/721390488.db2.gz KBGUISIUVQNLFJ-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@@H]3C[N@H+](Cc4nccs4)C[C@@H]3C2)c(Cl)c1 ZINC001164784895 721390490 /nfs/dbraw/zinc/39/04/90/721390490.db2.gz KBGUISIUVQNLFJ-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1(C)C ZINC000159110694 728900907 /nfs/dbraw/zinc/90/09/07/728900907.db2.gz AWUDPZGQEJJXNE-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1(C)C ZINC000159110694 728900909 /nfs/dbraw/zinc/90/09/09/728900909.db2.gz AWUDPZGQEJJXNE-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000159144868 728901605 /nfs/dbraw/zinc/90/16/05/728901605.db2.gz ZQHUTIDDTCVHAQ-ZJUUUORDSA-N 1 1 356.220 2.570 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000744345146 735350507 /nfs/dbraw/zinc/35/05/07/735350507.db2.gz LALFSDRVCBIEGK-LBPRGKRZSA-N 1 1 360.439 2.932 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000072858616 728214285 /nfs/dbraw/zinc/21/42/85/728214285.db2.gz ASEBSZALYGYAPA-QWHCGFSZSA-N 1 1 368.865 2.849 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000081571215 728401782 /nfs/dbraw/zinc/40/17/82/728401782.db2.gz WYIIAJIBVJENED-ZDUSSCGKSA-N 1 1 368.865 2.850 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H](C3OCCO3)C2)c1 ZINC000179375195 729185105 /nfs/dbraw/zinc/18/51/05/729185105.db2.gz KPCSQEQJRCQSCY-NSHDSACASA-N 1 1 358.341 2.781 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H](C3OCCO3)C2)c1 ZINC000179375195 729185108 /nfs/dbraw/zinc/18/51/08/729185108.db2.gz KPCSQEQJRCQSCY-NSHDSACASA-N 1 1 358.341 2.781 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000760810479 736670084 /nfs/dbraw/zinc/67/00/84/736670084.db2.gz HKEGWCOOIHHXNB-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000856717464 730349481 /nfs/dbraw/zinc/34/94/81/730349481.db2.gz GDJIBMFCMIVOBE-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(F)c(C)cc2[N+](=O)[O-])C[C@H]1C ZINC000866854646 731109103 /nfs/dbraw/zinc/10/91/03/731109103.db2.gz JGCVQWGVOUOELP-CHWSQXEVSA-N 1 1 373.450 2.536 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000872720486 731819465 /nfs/dbraw/zinc/81/94/65/731819465.db2.gz QRPHTXXZHGRFHV-UXLLHSPISA-N 1 1 361.467 2.553 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)cc1SC ZINC000874835768 732105466 /nfs/dbraw/zinc/10/54/66/732105466.db2.gz ADXAQSOGIOANTC-QWHCGFSZSA-N 1 1 365.455 2.634 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877665916 732409111 /nfs/dbraw/zinc/40/91/11/732409111.db2.gz NSOLYZWSRMZEPC-ZDUSSCGKSA-N 1 1 361.364 2.548 20 5 FFBDMO CC(C)(O)CN1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877665916 732409115 /nfs/dbraw/zinc/40/91/15/732409115.db2.gz NSOLYZWSRMZEPC-ZDUSSCGKSA-N 1 1 361.364 2.548 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cc(Br)c([N+](=O)[O-])s3)CC[C@@H]21 ZINC000877741006 732421741 /nfs/dbraw/zinc/42/17/41/732421741.db2.gz MAAWBRCYEAPWDU-CABZTGNLSA-N 1 1 360.277 2.945 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)c1cc(Br)no1 ZINC000878566167 732555395 /nfs/dbraw/zinc/55/53/95/732555395.db2.gz UAGUEQKUUABRCZ-LBPRGKRZSA-N 1 1 370.203 2.553 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880144359 732854847 /nfs/dbraw/zinc/85/48/47/732854847.db2.gz CULUTMXKMIRCRC-WDEREUQCSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H](C(C)(C)O)C1 ZINC000880144359 732854850 /nfs/dbraw/zinc/85/48/50/732854850.db2.gz CULUTMXKMIRCRC-WDEREUQCSA-N 1 1 355.822 2.668 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]2COCC[C@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000782510391 738728754 /nfs/dbraw/zinc/72/87/54/738728754.db2.gz HTLDPQVDFXYEGH-MLGOLLRUSA-N 1 1 351.378 2.563 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000886557106 733802223 /nfs/dbraw/zinc/80/22/23/733802223.db2.gz SBWYSMUEPPSLGW-PHIMTYICSA-N 1 1 360.382 3.000 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886822467 733843786 /nfs/dbraw/zinc/84/37/86/733843786.db2.gz QRUJSEVMMKLXPF-WBMJQRKESA-N 1 1 351.378 2.563 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827067 733845316 /nfs/dbraw/zinc/84/53/16/733845316.db2.gz CROXUMUWUQGQMB-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827067 733845320 /nfs/dbraw/zinc/84/53/20/733845320.db2.gz CROXUMUWUQGQMB-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000927645662 738765239 /nfs/dbraw/zinc/76/52/39/738765239.db2.gz PBQMBTAPKYUONC-CYBMUJFWSA-N 1 1 368.821 2.623 20 5 FFBDMO CC(C)(C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000928079379 738816646 /nfs/dbraw/zinc/81/66/46/738816646.db2.gz IOMJWIRWDDRDDB-ZBFHGGJFSA-N 1 1 363.483 2.568 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@H]1C ZINC000783920731 738849085 /nfs/dbraw/zinc/84/90/85/738849085.db2.gz OFRDRCCWNXIIQA-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894048515 734792957 /nfs/dbraw/zinc/79/29/57/734792957.db2.gz ZGGTVGPRGYJEQO-HUUCEWRRSA-N 1 1 366.849 2.669 20 5 FFBDMO C[C@H](C[N@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1)c1nccs1 ZINC000784044924 738858019 /nfs/dbraw/zinc/85/80/19/738858019.db2.gz URTALMQZMFIHTR-MRVPVSSYSA-N 1 1 360.237 2.703 20 5 FFBDMO C[C@H](C[N@@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1)c1nccs1 ZINC000784044924 738858024 /nfs/dbraw/zinc/85/80/24/738858024.db2.gz URTALMQZMFIHTR-MRVPVSSYSA-N 1 1 360.237 2.703 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000740886552 735095513 /nfs/dbraw/zinc/09/55/13/735095513.db2.gz UEZPBVNWESJBRW-OCCSQVGLSA-N 1 1 368.865 2.991 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C[C@H](n2cncn2)C(F)(F)F)cc([N+](=O)[O-])c1 ZINC000903210502 736055918 /nfs/dbraw/zinc/05/59/18/736055918.db2.gz YOQVSZAZUWWPMN-ZANVPECISA-N 1 1 359.308 2.649 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000755025988 736227776 /nfs/dbraw/zinc/22/77/76/736227776.db2.gz PZBUTWBLJZKKAX-KOLCDFICSA-N 1 1 371.235 2.962 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000756967374 736378346 /nfs/dbraw/zinc/37/83/46/736378346.db2.gz WMLCUEHUXMKLDT-QWHCGFSZSA-N 1 1 352.822 2.674 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(F)ccc1[N+](=O)[O-])CCC(F)(F)F ZINC000757614227 736413558 /nfs/dbraw/zinc/41/35/58/736413558.db2.gz ODRNBVBIJGCQNK-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000758333757 736476740 /nfs/dbraw/zinc/47/67/40/736476740.db2.gz CACDDPIYEFCZAU-LLVKDONJSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CCCO1 ZINC000907756787 736664101 /nfs/dbraw/zinc/66/41/01/736664101.db2.gz SKXRCFURRLBTEV-NSHDSACASA-N 1 1 373.812 2.618 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507842 736741341 /nfs/dbraw/zinc/74/13/41/736741341.db2.gz ZDAUBYQAZIHWLU-GXTWGEPZSA-N 1 1 369.849 2.611 20 5 FFBDMO CC[N@@H+](C[C@@H]1CCOC1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764197669 737000808 /nfs/dbraw/zinc/00/08/08/737000808.db2.gz PQEPPNYUUJSXAO-NEPJUHHUSA-N 1 1 355.822 2.934 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2[C@H](C)CCC[C@H]2CC[NH+](C)C)c1[N+](=O)[O-] ZINC000912650113 737327706 /nfs/dbraw/zinc/32/77/06/737327706.db2.gz IENIDKPWAODAPC-OLZOCXBDSA-N 1 1 351.451 2.776 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000768100856 737397895 /nfs/dbraw/zinc/39/78/95/737397895.db2.gz DFSOZXIAKWMJTG-PMPSAXMXSA-N 1 1 365.499 2.918 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000768100856 737397900 /nfs/dbraw/zinc/39/79/00/737397900.db2.gz DFSOZXIAKWMJTG-PMPSAXMXSA-N 1 1 365.499 2.918 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939777 737585454 /nfs/dbraw/zinc/58/54/54/737585454.db2.gz AUFWLFFEEXTKDO-BBRMVZONSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939777 737585460 /nfs/dbraw/zinc/58/54/60/737585460.db2.gz AUFWLFFEEXTKDO-BBRMVZONSA-N 1 1 364.833 2.927 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000771940515 737768429 /nfs/dbraw/zinc/76/84/29/737768429.db2.gz ULQDZTUCWOKACJ-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000771940515 737768432 /nfs/dbraw/zinc/76/84/32/737768432.db2.gz ULQDZTUCWOKACJ-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000771975550 737772129 /nfs/dbraw/zinc/77/21/29/737772129.db2.gz GBGCUMKDUAAWOE-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774625866 738006533 /nfs/dbraw/zinc/00/65/33/738006533.db2.gz HUQZIYHUQZFMNS-LLVKDONJSA-N 1 1 365.821 2.533 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774625866 738006536 /nfs/dbraw/zinc/00/65/36/738006536.db2.gz HUQZIYHUQZFMNS-LLVKDONJSA-N 1 1 365.821 2.533 20 5 FFBDMO CN(CC(F)F)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000774902074 738038665 /nfs/dbraw/zinc/03/86/65/738038665.db2.gz BQDYGRRMGQWRRW-UHFFFAOYSA-N 1 1 358.345 2.664 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000921806127 738047851 /nfs/dbraw/zinc/04/78/51/738047851.db2.gz IYJPYGBXHDGTAL-NOLJZWGESA-N 1 1 364.471 2.535 20 5 FFBDMO Cn1cc(Br)cc1C[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587571 738211913 /nfs/dbraw/zinc/21/19/13/738211913.db2.gz WRYKHQBXYXCDAN-OAHLLOKOSA-N 1 1 368.231 2.861 20 5 FFBDMO COc1cc(CN2CC[C@H](C[NH3+])[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000923501767 738292812 /nfs/dbraw/zinc/29/28/12/738292812.db2.gz VHNXNQQJDDPSSP-GHMZBOCLSA-N 1 1 359.373 2.622 20 5 FFBDMO Cc1nn(C)c(Cl)c1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000788007592 739197034 /nfs/dbraw/zinc/19/70/34/739197034.db2.gz XZJCZCILEHBPMI-UHFFFAOYSA-N 1 1 365.821 2.751 20 5 FFBDMO Cc1nn(C)c(Cl)c1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000788007592 739197036 /nfs/dbraw/zinc/19/70/36/739197036.db2.gz XZJCZCILEHBPMI-UHFFFAOYSA-N 1 1 365.821 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CC[C@@H](C3OCCO3)C2)c1 ZINC000931999664 739369562 /nfs/dbraw/zinc/36/95/62/739369562.db2.gz YOFZAIRPRPFIGU-SNVBAGLBSA-N 1 1 357.204 2.552 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932017555 739373380 /nfs/dbraw/zinc/37/33/80/739373380.db2.gz WGBWHVIHDHJGND-BLLLJJGKSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@]1([C@H]2CCC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018156 739374071 /nfs/dbraw/zinc/37/40/71/739374071.db2.gz AXWNSWKTTRVRIC-MGPLVRAMSA-N 1 1 355.341 2.584 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018156 739374075 /nfs/dbraw/zinc/37/40/75/739374075.db2.gz AXWNSWKTTRVRIC-MGPLVRAMSA-N 1 1 355.341 2.584 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCSC[C@H]1C1CC1 ZINC000933913393 739704146 /nfs/dbraw/zinc/70/41/46/739704146.db2.gz BUXXPFXRIBICBI-HOCLYGCPSA-N 1 1 352.456 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1 ZINC000795720601 740056154 /nfs/dbraw/zinc/05/61/54/740056154.db2.gz QQUFMHKJQTWNMV-CQSZACIVSA-N 1 1 358.320 2.681 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1 ZINC000795720601 740056159 /nfs/dbraw/zinc/05/61/59/740056159.db2.gz QQUFMHKJQTWNMV-CQSZACIVSA-N 1 1 358.320 2.681 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000796329946 740132636 /nfs/dbraw/zinc/13/26/36/740132636.db2.gz LZWSRCLTKOGOGW-CPTIBSQESA-N 1 1 365.817 2.542 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2COC(=O)N(C)C)ccc1[N+](=O)[O-] ZINC000796550137 740152725 /nfs/dbraw/zinc/15/27/25/740152725.db2.gz UIZSUDXWGCRXTK-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2COC(=O)N(C)C)ccc1[N+](=O)[O-] ZINC000796550137 740152727 /nfs/dbraw/zinc/15/27/27/740152727.db2.gz UIZSUDXWGCRXTK-AWEZNQCLSA-N 1 1 351.403 2.656 20 5 FFBDMO CNC(=O)OC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000805825238 741014388 /nfs/dbraw/zinc/01/43/88/741014388.db2.gz OIVUCQFZEBBSBL-OAHLLOKOSA-N 1 1 351.403 2.574 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(N)=NOCCOc1cccc([N+](=O)[O-])c1 ZINC000809374877 741302943 /nfs/dbraw/zinc/30/29/43/741302943.db2.gz RFSOWHBERQDCML-OKILXGFUSA-N 1 1 350.419 2.735 20 5 FFBDMO O=C(CCc1nccs1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171317 741684529 /nfs/dbraw/zinc/68/45/29/741684529.db2.gz SRIGNFZZTKQZBY-HNNXBMFYSA-N 1 1 361.423 2.802 20 5 FFBDMO O=C(CCc1nccs1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171317 741684530 /nfs/dbraw/zinc/68/45/30/741684530.db2.gz SRIGNFZZTKQZBY-HNNXBMFYSA-N 1 1 361.423 2.802 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)OCC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000814482784 741835422 /nfs/dbraw/zinc/83/54/22/741835422.db2.gz ASAFCBILOHHICN-LBPRGKRZSA-N 1 1 353.394 2.831 20 5 FFBDMO Cc1cc(Cl)ccc1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005379527 742253181 /nfs/dbraw/zinc/25/31/81/742253181.db2.gz UFDWUCQGETZOCW-IAGOWNOFSA-N 1 1 365.861 2.736 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2sccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326345 743511487 /nfs/dbraw/zinc/51/14/87/743511487.db2.gz YIPLMGULNHXFBJ-HKUMRIAESA-N 1 1 371.890 2.831 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000828958863 745146100 /nfs/dbraw/zinc/14/61/00/745146100.db2.gz JIMTZECDEUAYGJ-JKSUJKDBSA-N 1 1 351.834 2.876 20 5 FFBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)OC[C@@H]1CCCC[N@H+]1C(C)C ZINC000837667304 746495883 /nfs/dbraw/zinc/49/58/83/746495883.db2.gz VDZKEOQDZIBPPT-LBPRGKRZSA-N 1 1 351.403 2.605 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000839183886 746797097 /nfs/dbraw/zinc/79/70/97/746797097.db2.gz PQIBWUQJVFHMBI-CQSZACIVSA-N 1 1 353.394 2.954 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839393075 746821441 /nfs/dbraw/zinc/82/14/41/746821441.db2.gz VJSRDISFTAJRFN-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000839393075 746821447 /nfs/dbraw/zinc/82/14/47/746821447.db2.gz VJSRDISFTAJRFN-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839497597 746840298 /nfs/dbraw/zinc/84/02/98/746840298.db2.gz IRNPCAHHLASVSD-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839497597 746840304 /nfs/dbraw/zinc/84/03/04/746840304.db2.gz IRNPCAHHLASVSD-GFCCVEGCSA-N 1 1 373.247 2.842 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]2COCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502359 746841526 /nfs/dbraw/zinc/84/15/26/746841526.db2.gz HWBFEIVNZFLRTC-FZMZJTMJSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839502359 746841533 /nfs/dbraw/zinc/84/15/33/746841533.db2.gz HWBFEIVNZFLRTC-FZMZJTMJSA-N 1 1 353.806 2.688 20 5 FFBDMO CNC(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2Br)CCCC1 ZINC000839518414 746845487 /nfs/dbraw/zinc/84/54/87/746845487.db2.gz BRJGTRYNCHBIQW-UHFFFAOYSA-N 1 1 356.220 2.506 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000844640412 748062217 /nfs/dbraw/zinc/06/22/17/748062217.db2.gz HIHULKSWUCLNLS-HBNTYKKESA-N 1 1 370.247 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000848929395 749036477 /nfs/dbraw/zinc/03/64/77/749036477.db2.gz DLEDGIZASKHVEG-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1 ZINC000848929395 749036482 /nfs/dbraw/zinc/03/64/82/749036482.db2.gz DLEDGIZASKHVEG-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422723 749856709 /nfs/dbraw/zinc/85/67/09/749856709.db2.gz HPDKRBYXLKAPQU-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422723 749856714 /nfs/dbraw/zinc/85/67/14/749856714.db2.gz HPDKRBYXLKAPQU-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(Cl)c1 ZINC000853965829 750211318 /nfs/dbraw/zinc/21/13/18/750211318.db2.gz MKIQATMVLPSYNK-GFCCVEGCSA-N 1 1 360.241 2.937 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000896736038 971683667 /nfs/dbraw/zinc/68/36/67/971683667.db2.gz RHCCTQBCSPEDPM-QGZVFWFLSA-N 1 1 361.442 2.837 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)c2ccccc2N1 ZINC000759897597 971913716 /nfs/dbraw/zinc/91/37/16/971913716.db2.gz ZMZPTVVNOCQRJT-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)c2ccccc2N1 ZINC000759897597 971913723 /nfs/dbraw/zinc/91/37/23/971913723.db2.gz ZMZPTVVNOCQRJT-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](OC2CCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000872280601 1013198416 /nfs/dbraw/zinc/19/84/16/1013198416.db2.gz RYLIQYQUHPMEGT-GOSISDBHSA-N 1 1 373.453 2.908 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)cc1 ZINC001174833727 1013311776 /nfs/dbraw/zinc/31/17/76/1013311776.db2.gz WBLOPWMXWGLARK-INIZCTEOSA-N 1 1 355.394 2.613 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)cc1 ZINC001174833727 1013311783 /nfs/dbraw/zinc/31/17/83/1013311783.db2.gz WBLOPWMXWGLARK-INIZCTEOSA-N 1 1 355.394 2.613 20 5 FFBDMO Cc1c(NC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933346760 964086844 /nfs/dbraw/zinc/08/68/44/964086844.db2.gz YQPRFUNAYDVLFA-PHIMTYICSA-N 1 1 372.347 2.947 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN2CC[NH+](Cc3ccc(O)cc3)CC2)cc1 ZINC001175533562 1013501313 /nfs/dbraw/zinc/50/13/13/1013501313.db2.gz ZMHORIFCBKIQJS-UHFFFAOYSA-N 1 1 371.437 2.887 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1CCCC1 ZINC000729438040 965315809 /nfs/dbraw/zinc/31/58/09/965315809.db2.gz ABABCIYWVSWTKF-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO COc1cc2c(cc1O)CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC001176192959 1013646552 /nfs/dbraw/zinc/64/65/52/1013646552.db2.gz HCGLSBYCNBARSK-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 ZINC000101949762 966471877 /nfs/dbraw/zinc/47/18/77/966471877.db2.gz KUPNMIGGAUZISR-UHFFFAOYSA-N 1 1 354.370 2.909 20 5 FFBDMO Cc1cc(C(=O)NCC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000729525367 967667028 /nfs/dbraw/zinc/66/70/28/967667028.db2.gz HWGFHDWPSWCYJI-OKILXGFUSA-N 1 1 362.474 2.972 20 5 FFBDMO Cc1cc(N2CCC[C@H](OC(=O)c3cccc([N+](=O)[O-])c3)C2)nc(C)[nH+]1 ZINC000066731264 970102670 /nfs/dbraw/zinc/10/26/70/970102670.db2.gz UPGDGDANUKBCHP-INIZCTEOSA-N 1 1 356.382 2.827 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc3ccccc3c2)CC1 ZINC000981138621 976263323 /nfs/dbraw/zinc/26/33/23/976263323.db2.gz WEJZANDNAKSACJ-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccc3ccccc3c2)CC1 ZINC000981138621 976263329 /nfs/dbraw/zinc/26/33/29/976263329.db2.gz WEJZANDNAKSACJ-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc3ccccc3c2)CC1 ZINC000981138621 976263341 /nfs/dbraw/zinc/26/33/41/976263341.db2.gz WEJZANDNAKSACJ-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)n1 ZINC001126869300 976429376 /nfs/dbraw/zinc/42/93/76/976429376.db2.gz PZRXFPYNLMXDDI-HNNXBMFYSA-N 1 1 356.426 2.939 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000843802940 976844495 /nfs/dbraw/zinc/84/44/95/976844495.db2.gz FQTVCTTYZMLAIH-BXUZGUMPSA-N 1 1 364.402 2.756 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000126245578 1014431213 /nfs/dbraw/zinc/43/12/13/1014431213.db2.gz WLOIEUPIRRVJOR-LLVKDONJSA-N 1 1 364.402 2.582 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCc2c(CC(N)=O)cccc2C1 ZINC000877679052 1014673294 /nfs/dbraw/zinc/67/32/94/1014673294.db2.gz XVJIXPDUGZFCHZ-UHFFFAOYSA-N 1 1 353.422 2.798 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908249042 981399884 /nfs/dbraw/zinc/39/98/84/981399884.db2.gz JVEDGUKYRDHJTM-RDTXWAMCSA-N 1 1 356.426 2.752 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC001212034743 981463692 /nfs/dbraw/zinc/46/36/92/981463692.db2.gz CORDLYQZMUXCHL-CYBMUJFWSA-N 1 1 357.476 2.610 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910296443 981902849 /nfs/dbraw/zinc/90/28/49/981902849.db2.gz MXOPPDIBNKYPIX-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO COCCCOC1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)CC1 ZINC000765028080 984929966 /nfs/dbraw/zinc/92/99/66/984929966.db2.gz IUTPVICPXZWYER-UHFFFAOYSA-N 1 1 362.430 2.728 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765055869 984947898 /nfs/dbraw/zinc/94/78/98/984947898.db2.gz PYDSQYZBTMVBRQ-CQSZACIVSA-N 1 1 354.414 2.509 20 5 FFBDMO Cc1nn(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765057908 984954560 /nfs/dbraw/zinc/95/45/60/984954560.db2.gz SCWBKGTXMPWFJL-INIZCTEOSA-N 1 1 357.458 2.874 20 5 FFBDMO C[C@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+](C2CCC2)C1 ZINC000878644459 1015149477 /nfs/dbraw/zinc/14/94/77/1015149477.db2.gz WGXUECHHPIZZKG-AWEZNQCLSA-N 1 1 371.441 2.951 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2cccc(C(F)F)c2)CC1 ZINC000997772236 985732668 /nfs/dbraw/zinc/73/26/68/985732668.db2.gz MQULXZTYQYZCTC-HZPDHXFCSA-N 1 1 367.396 2.618 20 5 FFBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1 ZINC000673514242 988433003 /nfs/dbraw/zinc/43/30/03/988433003.db2.gz LVZDMHZMZZYRKR-SJORKVTESA-N 1 1 361.445 2.669 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)CC2)CC1 ZINC000879249103 1015436975 /nfs/dbraw/zinc/43/69/75/1015436975.db2.gz FBPVEFGVGSBKHP-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000919212895 990590812 /nfs/dbraw/zinc/59/08/12/990590812.db2.gz YROSITJGURJSHY-HNNXBMFYSA-N 1 1 362.382 2.855 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)c1 ZINC000879690597 1015641770 /nfs/dbraw/zinc/64/17/70/1015641770.db2.gz AKUMZQADNZFROG-ZWKOTPCHSA-N 1 1 354.410 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)cc1 ZINC000879691108 1015641911 /nfs/dbraw/zinc/64/19/11/1015641911.db2.gz OOAYYCKZDCNQRJ-ROUUACIJSA-N 1 1 354.410 2.508 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267452 991728785 /nfs/dbraw/zinc/72/87/85/991728785.db2.gz PKBXXNBFBQHASF-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](c3nccn3C)C2)cccc1[N+](=O)[O-] ZINC000377267452 991728793 /nfs/dbraw/zinc/72/87/93/991728793.db2.gz PKBXXNBFBQHASF-GJZGRUSLSA-N 1 1 371.441 2.843 20 5 FFBDMO COc1cc(CN2CC[C@H]3[C@@H]2CCC[N@H+]3C)c([N+](=O)[O-])cc1OC(F)F ZINC000880133374 1015763987 /nfs/dbraw/zinc/76/39/87/1015763987.db2.gz SXMQCEWTGSBQJW-STQMWFEESA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000810616023 994840008 /nfs/dbraw/zinc/84/00/08/994840008.db2.gz SLXMIBVPEKDMDI-LBPRGKRZSA-N 1 1 355.354 2.531 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810852790 994959111 /nfs/dbraw/zinc/95/91/11/994959111.db2.gz RBAKROBBZNQHAC-IAGOWNOFSA-N 1 1 356.382 2.564 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000823981539 996772259 /nfs/dbraw/zinc/77/22/59/996772259.db2.gz ZLFFQTLOWCSMEM-CJNGLKHVSA-N 1 1 369.425 2.962 20 5 FFBDMO Cc1ccc2c(c1)[C@@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])cn1C ZINC000824415867 996948174 /nfs/dbraw/zinc/94/81/74/996948174.db2.gz KUCZCSNEEFIHMB-DOTOQJQBSA-N 1 1 354.410 2.690 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@@H]3C[C@@H](C)C[N@@H+]3C2)c([N+](=O)[O-])c1 ZINC001136872056 996951047 /nfs/dbraw/zinc/95/10/47/996951047.db2.gz BTOGJOAXKCVTBE-BRWVUGGUSA-N 1 1 374.485 2.942 20 5 FFBDMO Cc1ccccc1[C@H]1CN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[NH2+]1 ZINC000825154405 997246521 /nfs/dbraw/zinc/24/65/21/997246521.db2.gz UNIMIAAGDDWJFV-QGZVFWFLSA-N 1 1 357.385 2.758 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825393750 997360196 /nfs/dbraw/zinc/36/01/96/997360196.db2.gz KOMGUPJLSRQRQR-VBQJREDUSA-N 1 1 363.458 2.501 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000732278432 998572879 /nfs/dbraw/zinc/57/28/79/998572879.db2.gz MNWJPTYXYLTLBM-UHFFFAOYSA-N 1 1 369.381 2.599 20 5 FFBDMO CC[C@@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000738252814 999623256 /nfs/dbraw/zinc/62/32/56/999623256.db2.gz CANVAJFKXRALLR-AUUYWEPGSA-N 1 1 374.441 2.831 20 5 FFBDMO COc1ccc([C@H]2[C@@H](COC(=O)c3ccc([N+](=O)[O-])n3C)CC[N@H+]2C)cc1 ZINC000741120412 999709649 /nfs/dbraw/zinc/70/96/49/999709649.db2.gz GDBLFSODIDKNKH-KDOFPFPSSA-N 1 1 373.409 2.792 20 5 FFBDMO CC[C@@]1(C)CCC[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386228 999816048 /nfs/dbraw/zinc/81/60/48/999816048.db2.gz FMGYBYHMELNBPQ-OALUTQOASA-N 1 1 374.441 2.831 20 5 FFBDMO CC[C@@]1(C)CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000743386228 999816049 /nfs/dbraw/zinc/81/60/49/999816049.db2.gz FMGYBYHMELNBPQ-OALUTQOASA-N 1 1 374.441 2.831 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169010596 1000015230 /nfs/dbraw/zinc/01/52/30/1000015230.db2.gz DYFIVXHWNHDCMB-JJXSEGSLSA-N 1 1 353.463 2.906 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C1 ZINC001169010589 1000015286 /nfs/dbraw/zinc/01/52/86/1000015286.db2.gz DVBRXITVXODCRJ-ZJIFWQFVSA-N 1 1 353.463 2.621 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019194 1000017530 /nfs/dbraw/zinc/01/75/30/1000017530.db2.gz FJIHNJWRMDVLAJ-WAARBJQMSA-N 1 1 361.442 2.528 20 5 FFBDMO Cc1cccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)c1 ZINC001169020002 1000017538 /nfs/dbraw/zinc/01/75/38/1000017538.db2.gz HMWCLFIDEQDHFD-ABSDTBQOSA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCO[C@H]3[C@H](OCC4CCCC4)CC[C@@H]32)C1 ZINC001169025136 1000018144 /nfs/dbraw/zinc/01/81/44/1000018144.db2.gz XUGAKPVNMMPPLI-UJWQCDCRSA-N 1 1 352.475 2.870 20 5 FFBDMO Cc1ccc(O[C@@H]2C[C@@H]3CN([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)CC[N@H+]3C2)cc1 ZINC001169026358 1000018157 /nfs/dbraw/zinc/01/81/57/1000018157.db2.gz LHCGIBCMNLZYTE-SOAMZJECSA-N 1 1 359.470 2.578 20 5 FFBDMO CCn1cc(C[N@@H+](Cc2c(C)nn(C)c2C)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cn1 ZINC001169026335 1000018165 /nfs/dbraw/zinc/01/81/65/1000018165.db2.gz KYJPNWYJRCLXOU-AEFFLSMTSA-N 1 1 374.489 2.701 20 5 FFBDMO CC(C)[N@@H+](C[C@H](O)COc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770038680 1000661198 /nfs/dbraw/zinc/66/11/98/1000661198.db2.gz DHTXGNQTYIEXOM-AZUAARDMSA-N 1 1 374.437 2.779 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001146934740 1000792191 /nfs/dbraw/zinc/79/21/91/1000792191.db2.gz PCTHUVBRMCBZAE-NEPJUHHUSA-N 1 1 369.853 2.698 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001147493647 1000905200 /nfs/dbraw/zinc/90/52/00/1000905200.db2.gz FHABEAJJXGEPBL-WFASDCNBSA-N 1 1 353.850 2.979 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)[nH+]c1 ZINC000771508841 1001133419 /nfs/dbraw/zinc/13/34/19/1001133419.db2.gz GNFUYEPJHOPWBV-UHFFFAOYSA-N 1 1 372.410 2.535 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194070 1001674377 /nfs/dbraw/zinc/67/43/77/1001674377.db2.gz ZBLYWHSTDNQAPE-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194070 1001674380 /nfs/dbraw/zinc/67/43/80/1001674380.db2.gz ZBLYWHSTDNQAPE-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000788116900 1001756858 /nfs/dbraw/zinc/75/68/58/1001756858.db2.gz LBHBSNCTCDNLNI-CVEARBPZSA-N 1 1 359.426 2.979 20 5 FFBDMO C/C(=C/C(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790128319 1002286334 /nfs/dbraw/zinc/28/63/34/1002286334.db2.gz UELRYPZTMNNLLF-REJXWNQVSA-N 1 1 361.442 2.566 20 5 FFBDMO C/C(=C/C(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790128319 1002286338 /nfs/dbraw/zinc/28/63/38/1002286338.db2.gz UELRYPZTMNNLLF-REJXWNQVSA-N 1 1 361.442 2.566 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1 ZINC000774847680 1002883491 /nfs/dbraw/zinc/88/34/91/1002883491.db2.gz WOXYLNMJXQKVLC-CYBMUJFWSA-N 1 1 357.370 2.981 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)n1 ZINC000774847680 1002883515 /nfs/dbraw/zinc/88/35/15/1002883515.db2.gz WOXYLNMJXQKVLC-CYBMUJFWSA-N 1 1 357.370 2.981 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352781 1003121795 /nfs/dbraw/zinc/12/17/95/1003121795.db2.gz QCYBNLMULHDCTR-UONOGXRCSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](Oc3nccc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001170356059 1003123329 /nfs/dbraw/zinc/12/33/29/1003123329.db2.gz VIMLCEKHFNDGGJ-WMLDXEAASA-N 1 1 372.425 2.786 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001129932747 1003826445 /nfs/dbraw/zinc/82/64/45/1003826445.db2.gz FPBOKUPDEZHOFZ-QUCCMNQESA-N 1 1 365.433 2.870 20 5 FFBDMO CCC1([NH2+]C/C=C\c2ccccc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001273756546 1004437147 /nfs/dbraw/zinc/43/71/47/1004437147.db2.gz BDVWDAPLFVQVKP-RPPGEJNMSA-N 1 1 357.454 2.726 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1Nc1cccc2c1CC[N@@H+](CC(C)(C)O)C2 ZINC000808015339 1004738371 /nfs/dbraw/zinc/73/83/71/1004738371.db2.gz OPTCTBSSQFIDHO-UHFFFAOYSA-N 1 1 373.457 2.992 20 5 FFBDMO CC(=O)NCC[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000808216319 1004776960 /nfs/dbraw/zinc/77/69/60/1004776960.db2.gz APIAIYPMBWIBHG-MRXNPFEDSA-N 1 1 371.441 2.654 20 5 FFBDMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194731787 1004796230 /nfs/dbraw/zinc/79/62/30/1004796230.db2.gz GBLJOGATABMJPT-GXFFZTMASA-N 1 1 366.805 2.891 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1=CCCCC1 ZINC001050244843 1016929300 /nfs/dbraw/zinc/92/93/00/1016929300.db2.gz WTEXALPWQYBSRP-RTBURBONSA-N 1 1 357.454 2.900 20 5 FFBDMO C[N@@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1=CCCCC1 ZINC001050244843 1016929316 /nfs/dbraw/zinc/92/93/16/1016929316.db2.gz WTEXALPWQYBSRP-RTBURBONSA-N 1 1 357.454 2.900 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1=CCCCC1 ZINC001050244843 1016929329 /nfs/dbraw/zinc/92/93/29/1016929329.db2.gz WTEXALPWQYBSRP-RTBURBONSA-N 1 1 357.454 2.900 20 5 FFBDMO C[N@H+](Cc1ccc(C(=O)NC2CC2)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278933 1005345366 /nfs/dbraw/zinc/34/53/66/1005345366.db2.gz VFSVQELXXUFVSB-IBGZPJMESA-N 1 1 369.421 2.652 20 5 FFBDMO CO[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000851035474 1005857917 /nfs/dbraw/zinc/85/79/17/1005857917.db2.gz NZAOMRMIFXWRAG-ROUUACIJSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCCC1 ZINC000851035474 1005857920 /nfs/dbraw/zinc/85/79/20/1005857920.db2.gz NZAOMRMIFXWRAG-ROUUACIJSA-N 1 1 362.426 2.918 20 5 FFBDMO O=[N+]([O-])c1ncccc1N[C@H]1CC[C@H](N2CC[NH+](CC3CC3)CC2)CC1 ZINC001170720641 1006104815 /nfs/dbraw/zinc/10/48/15/1006104815.db2.gz RLBJAGVBENQORJ-QAQDUYKDSA-N 1 1 359.474 2.741 20 5 FFBDMO CC(C)(O)C[N@H+]1CCc2c(cccc2Nc2cc[nH]c(=O)c2[N+](=O)[O-])C1 ZINC000853475922 1006403308 /nfs/dbraw/zinc/40/33/08/1006403308.db2.gz ANQDBBKHHMGRLL-UHFFFAOYSA-N 1 1 358.398 2.568 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC3(CCOCC3)C2)nc1-c1ccccn1 ZINC000853497805 1006415323 /nfs/dbraw/zinc/41/53/23/1006415323.db2.gz GPDDPOVBRLJSNA-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCCC3(CCOCC3)C2)nc1-c1ccccn1 ZINC000853497805 1006415328 /nfs/dbraw/zinc/41/53/28/1006415328.db2.gz GPDDPOVBRLJSNA-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](C3CCOCC3)C2)nc1-c1ccccn1 ZINC000853505255 1006418757 /nfs/dbraw/zinc/41/87/57/1006418757.db2.gz UBXHSWNEROHJGU-HNNXBMFYSA-N 1 1 357.414 2.559 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@]2(C1)CCC[N@@H+](C)C2 ZINC000814909251 1006462886 /nfs/dbraw/zinc/46/28/86/1006462886.db2.gz JIYFWEKAHGCOFO-GOSISDBHSA-N 1 1 365.405 2.833 20 5 FFBDMO COc1cc(C[NH2+]Cc2cnn(C)c2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000131398810 1006726736 /nfs/dbraw/zinc/72/67/36/1006726736.db2.gz VNWRIVSSILSQEJ-UHFFFAOYSA-N 1 1 374.319 2.568 20 5 FFBDMO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)n(C)c1C ZINC000883346443 1006763777 /nfs/dbraw/zinc/76/37/77/1006763777.db2.gz ZMNWXGHBSVVOMT-NSHDSACASA-N 1 1 361.398 2.888 20 5 FFBDMO Cc1c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000855290062 1007248829 /nfs/dbraw/zinc/24/88/29/1007248829.db2.gz YINBQNKWJKUEPA-LBPRGKRZSA-N 1 1 364.402 2.722 20 5 FFBDMO CCc1cccc(NC(=O)C[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])c1 ZINC001206366275 1032255740 /nfs/dbraw/zinc/25/57/40/1032255740.db2.gz PUPMQDYGGAHBLK-UHFFFAOYSA-N 1 1 359.382 2.600 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856673831 1007942311 /nfs/dbraw/zinc/94/23/11/1007942311.db2.gz FDBZTELEWFVFQI-ACJLOTCBSA-N 1 1 360.414 2.671 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])cc1OC ZINC000858011844 1008276969 /nfs/dbraw/zinc/27/69/69/1008276969.db2.gz RYJCEMITPFQYLP-OAHLLOKOSA-N 1 1 373.409 2.969 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])cc1OC ZINC000858011844 1008276975 /nfs/dbraw/zinc/27/69/75/1008276975.db2.gz RYJCEMITPFQYLP-OAHLLOKOSA-N 1 1 373.409 2.969 20 5 FFBDMO C[N@H+]1CCCN(CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000859364012 1008507329 /nfs/dbraw/zinc/50/73/29/1008507329.db2.gz DXUHFNYHIVHZFF-UHFFFAOYSA-N 1 1 370.453 2.505 20 5 FFBDMO CN1CCC[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000859364012 1008507332 /nfs/dbraw/zinc/50/73/32/1008507332.db2.gz DXUHFNYHIVHZFF-UHFFFAOYSA-N 1 1 370.453 2.505 20 5 FFBDMO CN1CCC[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000859364012 1008507335 /nfs/dbraw/zinc/50/73/35/1008507335.db2.gz DXUHFNYHIVHZFF-UHFFFAOYSA-N 1 1 370.453 2.505 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](c3ncccn3)C2)c1 ZINC000886690605 1008824951 /nfs/dbraw/zinc/82/49/51/1008824951.db2.gz YUFDGIPFLDSHOU-CQSZACIVSA-N 1 1 356.382 2.551 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](c3ncccn3)C2)c1 ZINC000886690605 1008824963 /nfs/dbraw/zinc/82/49/63/1008824963.db2.gz YUFDGIPFLDSHOU-CQSZACIVSA-N 1 1 356.382 2.551 20 5 FFBDMO Cc1cc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)s1 ZINC001178449715 1008979726 /nfs/dbraw/zinc/97/97/26/1008979726.db2.gz FFVZBIFWQMLNLJ-HZPDHXFCSA-N 1 1 353.488 2.796 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1ccc(CF)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458452 1008994992 /nfs/dbraw/zinc/99/49/92/1008994992.db2.gz HUMWFQLOHSLMFT-IAGOWNOFSA-N 1 1 351.422 2.588 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 ZINC000860739197 1009132546 /nfs/dbraw/zinc/13/25/46/1009132546.db2.gz ILPHLSAGRXAOBF-GXTWGEPZSA-N 1 1 374.372 2.703 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@]1(C)C[C@H](OC)C[N@H+]1C ZINC000861348299 1009366396 /nfs/dbraw/zinc/36/63/96/1009366396.db2.gz NZBJXQKSXAWCAH-HHXXYDBFSA-N 1 1 364.442 2.816 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861395075 1009389237 /nfs/dbraw/zinc/38/92/37/1009389237.db2.gz CSXIEVUFXYKZIM-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861395075 1009389245 /nfs/dbraw/zinc/38/92/45/1009389245.db2.gz CSXIEVUFXYKZIM-UHFFFAOYSA-N 1 1 371.437 2.931 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000862631806 1009911570 /nfs/dbraw/zinc/91/15/70/1009911570.db2.gz VTTPFVPFLPRDRA-INIZCTEOSA-N 1 1 360.458 2.798 20 5 FFBDMO CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)[C@H]1CCN(CC(F)(F)F)C1=O ZINC000865536360 1010808695 /nfs/dbraw/zinc/80/86/95/1010808695.db2.gz WSJTYDAQIXCIIN-AWEZNQCLSA-N 1 1 368.315 2.742 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000773262177 1010946362 /nfs/dbraw/zinc/94/63/62/1010946362.db2.gz OCKFNFXBKXTPDA-LSDHHAIUSA-N 1 1 359.430 2.744 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121159640 1011024550 /nfs/dbraw/zinc/02/45/50/1011024550.db2.gz BAQQPBPAAQKBTP-HNNXBMFYSA-N 1 1 373.457 2.695 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000121159640 1011024554 /nfs/dbraw/zinc/02/45/54/1011024554.db2.gz BAQQPBPAAQKBTP-HNNXBMFYSA-N 1 1 373.457 2.695 20 5 FFBDMO C[C@@H]1CC[C@@H](C(N)=O)[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001171598184 1011396090 /nfs/dbraw/zinc/39/60/90/1011396090.db2.gz CIHNGXZTLHVDGV-JFGNBEQYSA-N 1 1 370.247 2.832 20 5 FFBDMO CNc1nccc(C(=O)N2CC[NH+]([C@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000870124141 1012171989 /nfs/dbraw/zinc/17/19/89/1012171989.db2.gz SYOCZTMMFLTTFM-CQSZACIVSA-N 1 1 369.425 2.551 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H](O)[C@@H](F)CC3)CC2)c(F)c1 ZINC001173010153 1012179598 /nfs/dbraw/zinc/17/95/98/1012179598.db2.gz NCXLQIAVZKAYIZ-XJKSGUPXSA-N 1 1 373.375 2.637 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173185910 1012329037 /nfs/dbraw/zinc/32/90/37/1012329037.db2.gz QAQJIZYDRHVNLA-NWDGAFQWSA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@@H]1C ZINC001173192226 1012335490 /nfs/dbraw/zinc/33/54/90/1012335490.db2.gz JUEOHMNMIDBDAF-YNEHKIRRSA-N 1 1 368.405 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2nccc(Cl)n2)c1F ZINC001173193757 1012335764 /nfs/dbraw/zinc/33/57/64/1012335764.db2.gz XBSKZQBYUFWBNM-SECBINFHSA-N 1 1 354.769 2.907 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001173226905 1012362567 /nfs/dbraw/zinc/36/25/67/1012362567.db2.gz MQAYCGIESCCJMN-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO COc1ccnc(O[C@@H]2CCC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237403 1012381381 /nfs/dbraw/zinc/38/13/81/1012381381.db2.gz JCIWXWOGPJNBGO-RHSMWYFYSA-N 1 1 372.425 2.868 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)Cc2ccsc2)CC1 ZINC001173237770 1012385232 /nfs/dbraw/zinc/38/52/32/1012385232.db2.gz MIHCFTPPEPUZCC-HNNXBMFYSA-N 1 1 373.478 2.974 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2ccncc2)C1 ZINC001173237466 1012385934 /nfs/dbraw/zinc/38/59/34/1012385934.db2.gz KEAVDFVCISQGHM-CRAIPNDOSA-N 1 1 368.437 2.815 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)OC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC000870734083 1012542868 /nfs/dbraw/zinc/54/28/68/1012542868.db2.gz YRHDYMNNNRWRIE-MRXNPFEDSA-N 1 1 364.446 2.830 20 5 FFBDMO O=C(OC1CC(n2cc([N+](=O)[O-])cn2)C1)[C@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000870828382 1012582890 /nfs/dbraw/zinc/58/28/90/1012582890.db2.gz PSRJTPYELSLHBP-VMWRSERWSA-N 1 1 370.409 2.703 20 5 FFBDMO O=C(OC1CC(n2cc([N+](=O)[O-])cn2)C1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000870828382 1012582902 /nfs/dbraw/zinc/58/29/02/1012582902.db2.gz PSRJTPYELSLHBP-VMWRSERWSA-N 1 1 370.409 2.703 20 5 FFBDMO C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1 ZINC000870873419 1012615299 /nfs/dbraw/zinc/61/52/99/1012615299.db2.gz CSIAIUJQUYUPRF-WNYOCNMUSA-N 1 1 369.421 2.757 20 5 FFBDMO COC(=O)Cc1ccc(N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000827655266 1018592319 /nfs/dbraw/zinc/59/23/19/1018592319.db2.gz RBMHNAHQCSHAFU-UHFFFAOYSA-N 1 1 361.442 2.765 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1Cc1ccccc1 ZINC000801921037 1019513855 /nfs/dbraw/zinc/51/38/55/1019513855.db2.gz WONIHUNTUVTPNN-OCCSQVGLSA-N 1 1 372.400 2.709 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccccc2C2CC2)CC1 ZINC001045437672 1019967059 /nfs/dbraw/zinc/96/70/59/1019967059.db2.gz YEMIUNSMPMGGEN-QZTJIDSGSA-N 1 1 357.454 2.700 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)n1 ZINC000777953629 1020306629 /nfs/dbraw/zinc/30/66/29/1020306629.db2.gz IIOOHPMFIBZOJW-OAHLLOKOSA-N 1 1 368.397 2.987 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)n1 ZINC000777953629 1020306640 /nfs/dbraw/zinc/30/66/40/1020306640.db2.gz IIOOHPMFIBZOJW-OAHLLOKOSA-N 1 1 368.397 2.987 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@@H](Cc4nccs4)C3)n2)c1 ZINC000902649523 1020375225 /nfs/dbraw/zinc/37/52/25/1020375225.db2.gz NUBRMJREKXBTJP-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](Cc4nccs4)C3)n2)c1 ZINC000902649523 1020375231 /nfs/dbraw/zinc/37/52/31/1020375231.db2.gz NUBRMJREKXBTJP-ZDUSSCGKSA-N 1 1 370.438 2.832 20 5 FFBDMO Cn1ccc([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000932140144 1020720212 /nfs/dbraw/zinc/72/02/12/1020720212.db2.gz WMJFJQLUBDBIFL-CYBMUJFWSA-N 1 1 358.398 2.574 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3ccn(C)n3)CC2)cccc1[N+](=O)[O-] ZINC000932143083 1020721258 /nfs/dbraw/zinc/72/12/58/1020721258.db2.gz KXYPIUBSPKJEME-AWEZNQCLSA-N 1 1 371.441 2.843 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1CNC(=O)OC(C)(C)C ZINC000932709609 1020880135 /nfs/dbraw/zinc/88/01/35/1020880135.db2.gz JUGQOYSZLABFNR-ZIAGYGMSSA-N 1 1 364.446 2.973 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]([C@@H]2CCCO2)C1 ZINC000933183229 1020974250 /nfs/dbraw/zinc/97/42/50/1020974250.db2.gz OCGPNSNNMJPLQT-XYPHTWIQSA-N 1 1 366.389 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]([C@@H]2CCCO2)C1 ZINC000933183229 1020974253 /nfs/dbraw/zinc/97/42/53/1020974253.db2.gz OCGPNSNNMJPLQT-XYPHTWIQSA-N 1 1 366.389 2.667 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)C[C@@H]1CC(C)C ZINC000933246515 1020983305 /nfs/dbraw/zinc/98/33/05/1020983305.db2.gz CFUFZWPPDNMAGX-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)C[C@@H]1CC(C)C ZINC000933246515 1020983310 /nfs/dbraw/zinc/98/33/10/1020983310.db2.gz CFUFZWPPDNMAGX-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)C[C@@H]1CC(C)C ZINC000933246515 1020983315 /nfs/dbraw/zinc/98/33/15/1020983315.db2.gz CFUFZWPPDNMAGX-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000933245683 1020983492 /nfs/dbraw/zinc/98/34/92/1020983492.db2.gz HXKXMZWMTQZOGS-MRXNPFEDSA-N 1 1 359.430 2.807 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC000934611778 1021295969 /nfs/dbraw/zinc/29/59/69/1021295969.db2.gz ZPRNYXVSJBTCCU-CFVMTHIKSA-N 1 1 362.430 2.867 20 5 FFBDMO Cc1cc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)ccc1N1CC[NH+](C)CC1 ZINC001116637873 1021323876 /nfs/dbraw/zinc/32/38/76/1021323876.db2.gz OXOYQUNTJCSIFK-UHFFFAOYSA-N 1 1 370.409 2.613 20 5 FFBDMO Cc1ccc(CC[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cc1 ZINC001040699816 1022954960 /nfs/dbraw/zinc/95/49/60/1022954960.db2.gz GIUGIYPIVZDGMF-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1CN(C)CC[N@@H+]1C ZINC001120960112 1023544539 /nfs/dbraw/zinc/54/45/39/1023544539.db2.gz QUJIQTBXFLJSOU-WBMJQRKESA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1CN(C)CC[N@H+]1C ZINC001120960112 1023544547 /nfs/dbraw/zinc/54/45/47/1023544547.db2.gz QUJIQTBXFLJSOU-WBMJQRKESA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1C[N@H+](C)CCN1C ZINC001120960112 1023544552 /nfs/dbraw/zinc/54/45/52/1023544552.db2.gz QUJIQTBXFLJSOU-WBMJQRKESA-N 1 1 361.471 2.765 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@@H]1C[N@@H+](C)CCN1C ZINC001120960112 1023544558 /nfs/dbraw/zinc/54/45/58/1023544558.db2.gz QUJIQTBXFLJSOU-WBMJQRKESA-N 1 1 361.471 2.765 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC001122957995 1023573796 /nfs/dbraw/zinc/57/37/96/1023573796.db2.gz LBOKDAYSAUWKOT-YOEHRIQHSA-N 1 1 372.425 2.554 20 5 FFBDMO Cc1cccc(CCC[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)c1 ZINC001121087580 1023598969 /nfs/dbraw/zinc/59/89/69/1023598969.db2.gz OIQKPPOCSDONBC-JGQKGBITSA-N 1 1 371.481 2.610 20 5 FFBDMO CCC1(CC)CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000755930435 1023651785 /nfs/dbraw/zinc/65/17/85/1023651785.db2.gz GRZIWGAGEZZLQG-UHFFFAOYSA-N 1 1 360.414 2.833 20 5 FFBDMO CCC[C@@H]1CN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC001121296128 1023692792 /nfs/dbraw/zinc/69/27/92/1023692792.db2.gz GBJYUWLQWPIVII-DOTOQJQBSA-N 1 1 372.473 2.644 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2c3ccc(C)cc3[C@H]3C[N@H+](C)CC[C@@H]32)n1 ZINC000756624643 1023736627 /nfs/dbraw/zinc/73/66/27/1023736627.db2.gz BMSIWOMFRRLRQT-ZBFHGGJFSA-N 1 1 369.425 2.568 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001121700861 1023934918 /nfs/dbraw/zinc/93/49/18/1023934918.db2.gz ZVSKEEFDUHQURK-HOTGVXAUSA-N 1 1 372.473 2.737 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192752133 1024265394 /nfs/dbraw/zinc/26/53/94/1024265394.db2.gz ZEINMMLMDHDSRH-HOCLYGCPSA-N 1 1 369.421 2.996 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@H+]1CCCO ZINC001218705049 1033291008 /nfs/dbraw/zinc/29/10/08/1033291008.db2.gz SPOHTYJOCRUMLS-GFCCVEGCSA-N 1 1 370.837 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246569819 1026274916 /nfs/dbraw/zinc/27/49/16/1026274916.db2.gz RHZKAPPCNKGVBE-KBXCAEBGSA-N 1 1 355.442 2.851 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)n2)c1 ZINC000840114435 1026961681 /nfs/dbraw/zinc/96/16/81/1026961681.db2.gz IDYXXGVHKPOWCI-KURKYZTESA-N 1 1 371.441 2.826 20 5 FFBDMO CCOC(=O)c1cnn(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000840126710 1026969759 /nfs/dbraw/zinc/96/97/59/1026969759.db2.gz QLMCKBLTVTUXJJ-HNNXBMFYSA-N 1 1 358.398 2.805 20 5 FFBDMO CCOC(=O)c1cnn(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000840126710 1026969770 /nfs/dbraw/zinc/96/97/70/1026969770.db2.gz QLMCKBLTVTUXJJ-HNNXBMFYSA-N 1 1 358.398 2.805 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+]1Cc1ccccc1 ZINC000840522017 1027101153 /nfs/dbraw/zinc/10/11/53/1027101153.db2.gz LOLVTHRXLKWDRD-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000840522017 1027101156 /nfs/dbraw/zinc/10/11/56/1027101156.db2.gz LOLVTHRXLKWDRD-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO CCOC(=O)C1=C(Nc2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC[NH2+]C1 ZINC001159453055 1027395111 /nfs/dbraw/zinc/39/51/11/1027395111.db2.gz PNIQFWCWXWGNFY-UHFFFAOYSA-N 1 1 361.185 2.519 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC2CCC(F)(F)CC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160106778 1027592816 /nfs/dbraw/zinc/59/28/16/1027592816.db2.gz BMQWUDHDWSPZRZ-HZPDHXFCSA-N 1 1 371.428 2.616 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CC2CCC(F)(F)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106778 1027592831 /nfs/dbraw/zinc/59/28/31/1027592831.db2.gz BMQWUDHDWSPZRZ-HZPDHXFCSA-N 1 1 371.428 2.616 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CC2CCC(F)(F)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160106778 1027592844 /nfs/dbraw/zinc/59/28/44/1027592844.db2.gz BMQWUDHDWSPZRZ-HZPDHXFCSA-N 1 1 371.428 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)n1 ZINC001213026800 1027887188 /nfs/dbraw/zinc/88/71/88/1027887188.db2.gz SYVKGLOIICAIBA-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000795754593 1028094811 /nfs/dbraw/zinc/09/48/11/1028094811.db2.gz YDAWGMQMAGZFPX-UHFFFAOYSA-N 1 1 374.397 2.507 20 5 FFBDMO COc1ccc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)nc1OC ZINC001161441301 1028176815 /nfs/dbraw/zinc/17/68/15/1028176815.db2.gz PXGQNKGYBVOWQY-BQYQJAHWSA-N 1 1 359.386 2.546 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC001154615588 1028378637 /nfs/dbraw/zinc/37/86/37/1028378637.db2.gz IYAPSVHKLWVMLR-NSHDSACASA-N 1 1 366.805 2.591 20 5 FFBDMO CC[N@H+](Cc1ccc(F)cc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957712918 1028581669 /nfs/dbraw/zinc/58/16/69/1028581669.db2.gz ANAWEVJVYRQTIX-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@@H+](Cc1ccc(F)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712918 1028581686 /nfs/dbraw/zinc/58/16/86/1028581686.db2.gz ANAWEVJVYRQTIX-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO CC[N@H+](Cc1ccc(F)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957712918 1028581699 /nfs/dbraw/zinc/58/16/99/1028581699.db2.gz ANAWEVJVYRQTIX-QZTJIDSGSA-N 1 1 363.433 2.551 20 5 FFBDMO Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])c3c1CC[N@@H+](C)C3)C(=O)N2 ZINC001162573671 1028583846 /nfs/dbraw/zinc/58/38/46/1028583846.db2.gz CCEZGEDCDGOXPB-SFHVURJKSA-N 1 1 352.394 2.996 20 5 FFBDMO Cc1ccc2c(c1)[C@H](Nc1ccc([N+](=O)[O-])c3c1CC[N@H+](C)C3)C(=O)N2 ZINC001162573671 1028583849 /nfs/dbraw/zinc/58/38/49/1028583849.db2.gz CCEZGEDCDGOXPB-SFHVURJKSA-N 1 1 352.394 2.996 20 5 FFBDMO CSc1nc(Cl)nc(NCC[C@H]2CC[NH2+]CC2(F)F)c1[N+](=O)[O-] ZINC001162813213 1028666612 /nfs/dbraw/zinc/66/66/12/1028666612.db2.gz SONIJPHPXAUJFB-SSDOTTSWSA-N 1 1 367.809 2.807 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cccc(Cl)c2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490630 1029295030 /nfs/dbraw/zinc/29/50/30/1029295030.db2.gz OPJTVJPUTYRRNG-TZMCWYRMSA-N 1 1 369.824 2.520 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001165083549 1029371247 /nfs/dbraw/zinc/37/12/47/1029371247.db2.gz GXWKUOUYSBUNLE-WMLDXEAASA-N 1 1 369.381 2.609 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001156965347 1029423551 /nfs/dbraw/zinc/42/35/51/1029423551.db2.gz VCOAFXKLXHVHDV-MRXNPFEDSA-N 1 1 369.425 2.732 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1cc([N+](=O)[O-])cc[n+]1[O-] ZINC001165180689 1029435693 /nfs/dbraw/zinc/43/56/93/1029435693.db2.gz DJOKKRVZWNATSW-QAPCUYQASA-N 1 1 356.426 2.575 20 5 FFBDMO CCCc1[nH]nc(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1[N+](=O)[O-] ZINC001157439088 1029587258 /nfs/dbraw/zinc/58/72/58/1029587258.db2.gz VAPYVXAUUMOGKN-UHFFFAOYSA-N 1 1 358.402 2.908 20 5 FFBDMO Cc1c(F)cnc(NCc2ccc(C[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC001165327500 1029948958 /nfs/dbraw/zinc/94/89/58/1029948958.db2.gz XLSHPWSBWZLIGE-UHFFFAOYSA-N 1 1 360.389 2.882 20 5 FFBDMO CCOC(=O)[C@H]1C[C@H](C)CCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1 ZINC001167002761 1030605899 /nfs/dbraw/zinc/60/58/99/1030605899.db2.gz PHAOTQSPGNJJAT-KHGFPJFYSA-N 1 1 362.430 2.690 20 5 FFBDMO Nc1c(C(=O)N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)cccc1[N+](=O)[O-] ZINC001142659271 1030689653 /nfs/dbraw/zinc/68/96/53/1030689653.db2.gz NTEJORWCSBZYGW-QAPCUYQASA-N 1 1 366.421 2.524 20 5 FFBDMO COc1cc(OCC(=O)OC[C@@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000842834087 1030986528 /nfs/dbraw/zinc/98/65/28/1030986528.db2.gz REVHFGRAVBYROZ-CQSZACIVSA-N 1 1 366.414 2.646 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001219317468 1033597177 /nfs/dbraw/zinc/59/71/77/1033597177.db2.gz BOBYUWMAALBCJQ-ZDUSSCGKSA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000831572900 1034129958 /nfs/dbraw/zinc/12/99/58/1034129958.db2.gz XDRXJPKVSMQVLT-AGIUHOORSA-N 1 1 371.359 2.998 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000831572901 1034130051 /nfs/dbraw/zinc/13/00/51/1034130051.db2.gz XDRXJPKVSMQVLT-FRRDWIJNSA-N 1 1 371.359 2.998 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC(C)([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000832238901 1034666996 /nfs/dbraw/zinc/66/69/96/1034666996.db2.gz NITJFKPFWMEIKV-UHFFFAOYSA-N 1 1 363.462 2.751 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227502171 1035588311 /nfs/dbraw/zinc/58/83/11/1035588311.db2.gz WXKADJUHWNVCOD-LLVKDONJSA-N 1 1 354.319 2.663 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1c1cccnc1 ZINC000835457893 1035777256 /nfs/dbraw/zinc/77/72/56/1035777256.db2.gz LQOAOBDAEUWNTI-GBESFXJTSA-N 1 1 367.405 2.911 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1C[C@H]1c1cccnc1 ZINC000835457893 1035777270 /nfs/dbraw/zinc/77/72/70/1035777270.db2.gz LQOAOBDAEUWNTI-GBESFXJTSA-N 1 1 367.405 2.911 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2ccc([N+](=O)[O-])c(I)c2)C1 ZINC001227995088 1035858466 /nfs/dbraw/zinc/85/84/66/1035858466.db2.gz RJMRFJFPPDPGIC-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3nccc4ccc([N+](=O)[O-])cc43)C[C@H]1[N@H+]2C ZINC001229010079 1036456470 /nfs/dbraw/zinc/45/64/70/1036456470.db2.gz ZCJQZOSUBYIDHQ-CWLKWCNXSA-N 1 1 371.393 2.689 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001277849084 1036996959 /nfs/dbraw/zinc/99/69/59/1036996959.db2.gz INLZDARVKDPYQY-YNEHKIRRSA-N 1 1 356.426 2.883 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2CCC[N@@H+]([C@H](C)c3ccccn3)C2)n1 ZINC001234881019 1037222817 /nfs/dbraw/zinc/22/28/17/1037222817.db2.gz KXFITKCMJBRMKS-KGLIPLIRSA-N 1 1 358.398 2.998 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(O[C@H]2CCC[N@H+]([C@H](C)c3ccccn3)C2)n1 ZINC001234881019 1037222828 /nfs/dbraw/zinc/22/28/28/1037222828.db2.gz KXFITKCMJBRMKS-KGLIPLIRSA-N 1 1 358.398 2.998 20 5 FFBDMO C[NH+]1CCN(c2ncc(-c3cnc4c(ccc5cccnc54)c3)cn2)CC1 ZINC001235919210 1037837745 /nfs/dbraw/zinc/83/77/45/1037837745.db2.gz NEQIPHMNMNDYCF-UHFFFAOYSA-N 1 1 356.433 2.992 20 5 FFBDMO CCC[N@@H+](CCOC)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256095106 1038379839 /nfs/dbraw/zinc/37/98/39/1038379839.db2.gz YRLQQNCMQDHJSH-UHFFFAOYSA-N 1 1 351.447 2.931 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)Cc3cc(C)nn3C)CC2)ccc1[N+](=O)[O-] ZINC001256098994 1038382325 /nfs/dbraw/zinc/38/23/25/1038382325.db2.gz IJJJMYNUSCUGID-UHFFFAOYSA-N 1 1 373.457 2.746 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1Cc1nnc(CC[NH+]2C[C@H](C)O[C@@H](C)C2)o1 ZINC001258091887 1039166167 /nfs/dbraw/zinc/16/61/67/1039166167.db2.gz OUGRJQBQEGRETK-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(Nc3cnc(OC)c([N+](=O)[O-])c3)cc2)CC1 ZINC001210138483 1039401746 /nfs/dbraw/zinc/40/17/46/1039401746.db2.gz UUSBPDSUSRVWFN-UHFFFAOYSA-N 1 1 371.441 2.880 20 5 FFBDMO CN(C)c1ccccc1-c1noc([C@@H]([NH3+])Cc2ccccc2[N+](=O)[O-])n1 ZINC001247666237 1039876198 /nfs/dbraw/zinc/87/61/98/1039876198.db2.gz MPNVATWPUGSPAC-AWEZNQCLSA-N 1 1 353.382 2.953 20 5 FFBDMO CN(C)c1cccc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC001248208916 1040172756 /nfs/dbraw/zinc/17/27/56/1040172756.db2.gz NOYSYMVWNFNOJH-MRXNPFEDSA-N 1 1 353.382 2.953 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479732 1040746289 /nfs/dbraw/zinc/74/62/89/1040746289.db2.gz JXAHPTNEEHOHQC-GOSISDBHSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC001254551509 1040791768 /nfs/dbraw/zinc/79/17/68/1040791768.db2.gz CMZMNSIBRJEHRP-FAYQHZLMSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001254560588 1040796607 /nfs/dbraw/zinc/79/66/07/1040796607.db2.gz VZBAEUFFYGDYNM-OAHLLOKOSA-N 1 1 357.410 2.967 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001254560588 1040796622 /nfs/dbraw/zinc/79/66/22/1040796622.db2.gz VZBAEUFFYGDYNM-OAHLLOKOSA-N 1 1 357.410 2.967 20 5 FFBDMO Cc1noc(C[C@@H]2C[C@H]3C[N@H+]([C@H](C)Cc4ccccc4[N+](=O)[O-])C[C@H]3O2)n1 ZINC001254559476 1040797051 /nfs/dbraw/zinc/79/70/51/1040797051.db2.gz YCZIQSSZCPURCD-BLBBIFAFSA-N 1 1 372.425 2.549 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001254561841 1040799281 /nfs/dbraw/zinc/79/92/81/1040799281.db2.gz MOMVKTSYSWFXAS-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001254561841 1040799288 /nfs/dbraw/zinc/79/92/88/1040799288.db2.gz MOMVKTSYSWFXAS-AWEZNQCLSA-N 1 1 367.409 2.817 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2CN1c1ccsc1 ZINC001254593854 1040821600 /nfs/dbraw/zinc/82/16/00/1040821600.db2.gz COWWVZSBKUZGBG-QGTPRVQTSA-N 1 1 369.446 2.718 20 5 FFBDMO CC(C)C(=O)N1CC[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC[C@@H]21 ZINC001254596124 1040825306 /nfs/dbraw/zinc/82/53/06/1040825306.db2.gz OWCVHDZHTZBVLR-LZQZEXGQSA-N 1 1 357.454 2.641 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596891 1040828068 /nfs/dbraw/zinc/82/80/68/1040828068.db2.gz QRRCHSZXAQXTGV-SJLPKXTDSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2nn(CC)cc21 ZINC001254596891 1040828081 /nfs/dbraw/zinc/82/80/81/1040828081.db2.gz QRRCHSZXAQXTGV-SJLPKXTDSA-N 1 1 370.453 2.914 20 5 FFBDMO COc1ccc(CC[N@@H+](C[C@H](C)O)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001254599668 1040829024 /nfs/dbraw/zinc/82/90/24/1040829024.db2.gz OGTNVLYBAYRZBI-YWZLYKJASA-N 1 1 370.449 2.996 20 5 FFBDMO O=C1N(CC2CC2)CC[C@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254599398 1040829471 /nfs/dbraw/zinc/82/94/71/1040829471.db2.gz YURVOZWMEHPHSZ-FPOVZHCZSA-N 1 1 369.465 2.787 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCCN(Cc3ccncc3)CC1)C2 ZINC001254599743 1040830052 /nfs/dbraw/zinc/83/00/52/1040830052.db2.gz PRZNPGZAKOKYFZ-FQEVSTJZSA-N 1 1 352.438 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCC[N@H+](Cc3ccncc3)CC1)C2 ZINC001254599743 1040830061 /nfs/dbraw/zinc/83/00/61/1040830061.db2.gz PRZNPGZAKOKYFZ-FQEVSTJZSA-N 1 1 352.438 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCC[N@@H+](Cc3ccncc3)CC1)C2 ZINC001254599743 1040830068 /nfs/dbraw/zinc/83/00/68/1040830068.db2.gz PRZNPGZAKOKYFZ-FQEVSTJZSA-N 1 1 352.438 2.665 20 5 FFBDMO COc1ccc(CC[N@@H+](C[C@H](C)O)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001254599666 1040830360 /nfs/dbraw/zinc/83/03/60/1040830360.db2.gz OGTNVLYBAYRZBI-MGPUTAFESA-N 1 1 370.449 2.996 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254601050 1040832194 /nfs/dbraw/zinc/83/21/94/1040832194.db2.gz XRNHDPVZGMKIKK-XLAORIBOSA-N 1 1 373.453 2.765 20 5 FFBDMO Cc1nc(Nc2cc([N+](=O)[O-])cnc2C)cc(N2C[C@@H](C)O[C@@H](C)C2)[nH+]1 ZINC001249546958 1040858628 /nfs/dbraw/zinc/85/86/28/1040858628.db2.gz SVTGJNWEBUHBAO-PHIMTYICSA-N 1 1 358.402 2.754 20 5 FFBDMO Cc1ccc(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC001310095971 1043636125 /nfs/dbraw/zinc/63/61/25/1043636125.db2.gz CVOXGVHXVHWZLH-ZFWWWQNUSA-N 1 1 350.444 2.605 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C(C)(C)CC1 ZINC001310654452 1043720098 /nfs/dbraw/zinc/72/00/98/1043720098.db2.gz CBRJZBRNFXNRKA-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO COCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)C1 ZINC001311330584 1043891495 /nfs/dbraw/zinc/89/14/95/1043891495.db2.gz FUOAGXXNPHMHRJ-ZDUSSCGKSA-N 1 1 358.398 2.590 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001312380988 1044103681 /nfs/dbraw/zinc/10/36/81/1044103681.db2.gz NNPPDLDNXDAGFG-AWEZNQCLSA-N 1 1 354.838 2.574 20 5 FFBDMO COC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001319400377 1045138448 /nfs/dbraw/zinc/13/84/48/1045138448.db2.gz PLNOHCCGHALDOI-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001316614309 1045147432 /nfs/dbraw/zinc/14/74/32/1045147432.db2.gz BVWUNZAQAPPHEA-YPHDPYNUSA-N 1 1 363.845 2.503 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC001322002079 1045910652 /nfs/dbraw/zinc/91/06/52/1045910652.db2.gz TZCGODUWEIGQPK-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC001322002079 1045910663 /nfs/dbraw/zinc/91/06/63/1045910663.db2.gz TZCGODUWEIGQPK-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO O=C(NC1(C[NH2+]CCCc2ccsc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282607135 1045954342 /nfs/dbraw/zinc/95/43/42/1045954342.db2.gz JVXJPJMBJOOTRQ-HZPDHXFCSA-N 1 1 365.499 2.755 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CCC(CO)CC1 ZINC001325993639 1046712214 /nfs/dbraw/zinc/71/22/14/1046712214.db2.gz ASFISHLOUKBEAY-UHFFFAOYSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CSc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001327713247 1048008526 /nfs/dbraw/zinc/00/85/26/1048008526.db2.gz ABXCGZFMWHXNLN-SNVBAGLBSA-N 1 1 354.819 2.614 20 5 FFBDMO C[N@H+]1CCO[C@@H](CSc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)C1 ZINC001327713247 1048008540 /nfs/dbraw/zinc/00/85/40/1048008540.db2.gz ABXCGZFMWHXNLN-SNVBAGLBSA-N 1 1 354.819 2.614 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001327891853 1048084857 /nfs/dbraw/zinc/08/48/57/1048084857.db2.gz PFMQLQZQQWDLQM-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001328886330 1048501764 /nfs/dbraw/zinc/50/17/64/1048501764.db2.gz VYOHFJFDMGQWQW-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC001328886330 1048501772 /nfs/dbraw/zinc/50/17/72/1048501772.db2.gz VYOHFJFDMGQWQW-MGPUTAFESA-N 1 1 369.421 2.905 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H]1c1ccc(F)cc1 ZINC001333709472 1049069778 /nfs/dbraw/zinc/06/97/78/1049069778.db2.gz MLIOSXFIIGTDBY-RDJZCZTQSA-N 1 1 358.373 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3nc(C(F)F)no3)CC2)cc1 ZINC001333792407 1049121115 /nfs/dbraw/zinc/12/11/15/1049121115.db2.gz ITPKWLCDATWVQL-UHFFFAOYSA-N 1 1 353.329 2.674 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3ccncc3[N+](=O)[O-])C2)O1 ZINC001330829258 1049350807 /nfs/dbraw/zinc/35/08/07/1049350807.db2.gz JRXKTHHIRXNDMR-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001292799435 1049396146 /nfs/dbraw/zinc/39/61/46/1049396146.db2.gz IKSIRQHPAFPBEV-NSHDSACASA-N 1 1 372.263 2.746 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001295339887 1049917615 /nfs/dbraw/zinc/91/76/15/1049917615.db2.gz WEWNOGFHKNQIES-GFCCVEGCSA-N 1 1 368.865 2.928 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC001303802579 1051451870 /nfs/dbraw/zinc/45/18/70/1051451870.db2.gz ZLAZBNOHIFUZHB-JQWIXIFHSA-N 1 1 374.363 2.624 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001341133154 1051482050 /nfs/dbraw/zinc/48/20/50/1051482050.db2.gz LHSWBSNSARIFOE-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001341133154 1051482055 /nfs/dbraw/zinc/48/20/55/1051482055.db2.gz LHSWBSNSARIFOE-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO CC(C)(C)c1cc2n(n1)CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC001308129272 1052413559 /nfs/dbraw/zinc/41/35/59/1052413559.db2.gz YUGFWFZPDONOJN-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO CC(C)(C)c1cc2n(n1)CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC001308129272 1052413565 /nfs/dbraw/zinc/41/35/65/1052413565.db2.gz YUGFWFZPDONOJN-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@@H]1Cc1ccc(O)cc1 ZINC001308148778 1052417171 /nfs/dbraw/zinc/41/71/71/1052417171.db2.gz ILMLRAZUTJKNFJ-MRXNPFEDSA-N 1 1 357.410 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC001345925568 1052673386 /nfs/dbraw/zinc/67/33/86/1052673386.db2.gz UGOXXYGAUGYNAB-STQMWFEESA-N 1 1 362.382 2.540 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC001344369179 1052737636 /nfs/dbraw/zinc/73/76/36/1052737636.db2.gz UHBASTMHXQFWIU-AWEZNQCLSA-N 1 1 366.439 2.727 20 5 FFBDMO COc1ccc([C@@H](C[NH+](C)C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335414553 1053347252 /nfs/dbraw/zinc/34/72/52/1053347252.db2.gz YUXPQRAPGUFFDG-MOPGFXCFSA-N 1 1 359.426 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c(C(F)(F)F)c1 ZINC001335565340 1053439260 /nfs/dbraw/zinc/43/92/60/1053439260.db2.gz HYZISUMGJLTTMR-HUUCEWRRSA-N 1 1 359.348 2.649 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C[C@H](C)C1 ZINC001356351817 1055468154 /nfs/dbraw/zinc/46/81/54/1055468154.db2.gz NFAVJXSMPDLNMD-HOTGVXAUSA-N 1 1 372.473 2.594 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1ccncc1 ZINC001357610249 1055963329 /nfs/dbraw/zinc/96/33/29/1055963329.db2.gz AFGUWSHHBJTZKV-KRWDZBQOSA-N 1 1 374.828 2.749 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001544799088 1071694171 /nfs/dbraw/zinc/69/41/71/1071694171.db2.gz RLTOAMFOJJBLTL-MRVPVSSYSA-N 1 1 369.784 2.541 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848488836 1060143616 /nfs/dbraw/zinc/14/36/16/1060143616.db2.gz NANDQKXQZMQDQS-GOSISDBHSA-N 1 1 358.398 2.691 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)c1 ZINC000848491688 1060150785 /nfs/dbraw/zinc/15/07/85/1060150785.db2.gz YMADPXKMYVAFMC-INIZCTEOSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)c1 ZINC000848491688 1060150794 /nfs/dbraw/zinc/15/07/94/1060150794.db2.gz YMADPXKMYVAFMC-INIZCTEOSA-N 1 1 352.398 2.868 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848783795 1060687790 /nfs/dbraw/zinc/68/77/90/1060687790.db2.gz CYSGIBPJPMTPNY-ROUUACIJSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C(CC[NH2+][C@@H](CO)c1c(F)cccc1F)Nc1ccccc1[N+](=O)[O-] ZINC001459805504 1060822524 /nfs/dbraw/zinc/82/25/24/1060822524.db2.gz MKJIFQDAKKXWBR-AWEZNQCLSA-N 1 1 365.336 2.525 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC001460296184 1060946069 /nfs/dbraw/zinc/94/60/69/1060946069.db2.gz OVCSOJVADHDUAU-CQSZACIVSA-N 1 1 371.503 2.877 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(O)(Cc4ccccn4)CC3)nc2c1 ZINC001460393785 1060982584 /nfs/dbraw/zinc/98/25/84/1060982584.db2.gz SNLDOSIFDUZHRM-UHFFFAOYSA-N 1 1 368.393 2.701 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001460602329 1061028090 /nfs/dbraw/zinc/02/80/90/1061028090.db2.gz AFOQLRRWBKNWFY-IVMMDQJWSA-N 1 1 365.430 2.616 20 5 FFBDMO C[N@@H+](CCCC(=O)OC(C)(C)C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001460895857 1061141624 /nfs/dbraw/zinc/14/16/24/1061141624.db2.gz FHVSXOMVKMDNNY-UHFFFAOYSA-N 1 1 365.430 2.977 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c(C)cc1[N+](=O)[O-] ZINC001462737522 1061751148 /nfs/dbraw/zinc/75/11/48/1061751148.db2.gz CWBWFRCHAFAYOV-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC(C)[N@@H+](C)CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001360104218 1061891837 /nfs/dbraw/zinc/89/18/37/1061891837.db2.gz NDCUKIBBSSYEGQ-UHFFFAOYSA-N 1 1 358.446 2.792 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1 ZINC001522551311 1062208929 /nfs/dbraw/zinc/20/89/29/1062208929.db2.gz PHWQDWQERHOZRK-JGGQBBKZSA-N 1 1 351.834 2.637 20 5 FFBDMO CC(C)C[C@@H](C[NH+]1CCCC1)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC001463753988 1062243838 /nfs/dbraw/zinc/24/38/38/1062243838.db2.gz SEYVBWVHUJUPTR-ZDUSSCGKSA-N 1 1 373.450 2.523 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc2ccccc2c1[N+](=O)[O-] ZINC001464364837 1062570161 /nfs/dbraw/zinc/57/01/61/1062570161.db2.gz QFAWYOTVBWDKMP-LBPRGKRZSA-N 1 1 354.410 2.544 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001464546453 1062678561 /nfs/dbraw/zinc/67/85/61/1062678561.db2.gz SPFKVKCQUNYXMO-JTQLQIEISA-N 1 1 372.828 2.820 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001479843524 1063003845 /nfs/dbraw/zinc/00/38/45/1063003845.db2.gz HGZRLZJDWKJUFV-HZPDHXFCSA-N 1 1 353.850 2.642 20 5 FFBDMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001479843524 1063003867 /nfs/dbraw/zinc/00/38/67/1063003867.db2.gz HGZRLZJDWKJUFV-HZPDHXFCSA-N 1 1 353.850 2.642 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001479843524 1063003878 /nfs/dbraw/zinc/00/38/78/1063003878.db2.gz HGZRLZJDWKJUFV-HZPDHXFCSA-N 1 1 353.850 2.642 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001469560225 1064168218 /nfs/dbraw/zinc/16/82/18/1064168218.db2.gz QVWOPMLJGOQXLI-AWEZNQCLSA-N 1 1 354.838 2.526 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC001473168045 1065212229 /nfs/dbraw/zinc/21/22/29/1065212229.db2.gz LVSZODLGPHMIBT-YWXMQNBFSA-N 1 1 355.232 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1 ZINC001473168045 1065212238 /nfs/dbraw/zinc/21/22/38/1065212238.db2.gz LVSZODLGPHMIBT-YWXMQNBFSA-N 1 1 355.232 2.950 20 5 FFBDMO CCOC(=O)CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC001473592513 1065295227 /nfs/dbraw/zinc/29/52/27/1065295227.db2.gz BNJHXTKPSIUZTJ-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1C[N@H+]1CCC=C(c2ccco2)C1 ZINC001582804025 1079110186 /nfs/dbraw/zinc/11/01/86/1079110186.db2.gz FZHKSRSNENYEIX-UHFFFAOYSA-N 1 1 352.354 2.657 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1c(F)cccc1[N+](=O)[O-] ZINC001583030287 1079156303 /nfs/dbraw/zinc/15/63/03/1079156303.db2.gz IASYKNPZMRTDCM-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC001583145778 1079170755 /nfs/dbraw/zinc/17/07/55/1079170755.db2.gz UCQJEYMCEKGFPA-QWHCGFSZSA-N 1 1 352.822 2.577 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C(C)(C)C1 ZINC001558504666 1076019968 /nfs/dbraw/zinc/01/99/68/1076019968.db2.gz SYZMVPBLMWIWBZ-HNNXBMFYSA-N 1 1 354.410 2.727 20 5 FFBDMO CCc1c[nH]c2nc[nH+]c(N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c12 ZINC001559051424 1076121351 /nfs/dbraw/zinc/12/13/51/1076121351.db2.gz ZIRHYQHFWTXPOQ-UHFFFAOYSA-N 1 1 352.398 2.755 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC001560082851 1076224308 /nfs/dbraw/zinc/22/43/08/1076224308.db2.gz IJWLAXUIKHCTBY-QGZVFWFLSA-N 1 1 354.410 2.983 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1Cc2cccnc2N2CCC[C@@H]2C1 ZINC001560082851 1076224309 /nfs/dbraw/zinc/22/43/09/1076224309.db2.gz IJWLAXUIKHCTBY-QGZVFWFLSA-N 1 1 354.410 2.983 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(CN2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)c1 ZINC001560201216 1076245788 /nfs/dbraw/zinc/24/57/88/1076245788.db2.gz GBFVVVUFGXBYTH-AAEUAGOBSA-N 1 1 358.211 2.585 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(CN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)c1 ZINC001560201216 1076245790 /nfs/dbraw/zinc/24/57/90/1076245790.db2.gz GBFVVVUFGXBYTH-AAEUAGOBSA-N 1 1 358.211 2.585 20 5 FFBDMO CC[N@@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC001560638779 1076287209 /nfs/dbraw/zinc/28/72/09/1076287209.db2.gz MRFMONTUULZDPC-CQSZACIVSA-N 1 1 374.393 2.971 20 5 FFBDMO CC[N@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC001560638779 1076287211 /nfs/dbraw/zinc/28/72/11/1076287211.db2.gz MRFMONTUULZDPC-CQSZACIVSA-N 1 1 374.393 2.971 20 5 FFBDMO CC[N@@H+](CCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC001561720270 1076412572 /nfs/dbraw/zinc/41/25/72/1076412572.db2.gz FFVHZCFLWJDRGN-UHFFFAOYSA-N 1 1 369.487 2.918 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001562575487 1076504710 /nfs/dbraw/zinc/50/47/10/1076504710.db2.gz PWPQJFHCQYAUOV-JTQLQIEISA-N 1 1 371.235 2.915 20 5 FFBDMO C[C@@H](O)C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@H](C)C1 ZINC001563396350 1076550685 /nfs/dbraw/zinc/55/06/85/1076550685.db2.gz UMXGCKZEIZTPPA-ZIAGYGMSSA-N 1 1 372.425 2.667 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)[C@H](C)C1 ZINC001563396350 1076550687 /nfs/dbraw/zinc/55/06/87/1076550687.db2.gz UMXGCKZEIZTPPA-ZIAGYGMSSA-N 1 1 372.425 2.667 20 5 FFBDMO CN(C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC001568917199 1077118299 /nfs/dbraw/zinc/11/82/99/1077118299.db2.gz GJZDVDRFZSPGLJ-PBWFPOADSA-N 1 1 351.834 2.874 20 5 FFBDMO Cc1ccc(C[NH2+]CCN(Cc2ccccc2)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001569869611 1077169416 /nfs/dbraw/zinc/16/94/16/1077169416.db2.gz ZCLQCCNURFIRBI-WOJBJXKFSA-N 1 1 367.449 2.779 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001570017408 1077177427 /nfs/dbraw/zinc/17/74/27/1077177427.db2.gz MUANMAAOSYJEOF-VQIMIIECSA-N 1 1 366.421 2.934 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@H]1C(C)(C)C ZINC001570910773 1077241930 /nfs/dbraw/zinc/24/19/30/1077241930.db2.gz RUGIYHDHILTPNK-KRWDZBQOSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001590049409 1080978404 /nfs/dbraw/zinc/97/84/04/1080978404.db2.gz OYRGXAUOICIKCX-LBPRGKRZSA-N 1 1 350.382 2.894 20 5 FFBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001590049409 1080978408 /nfs/dbraw/zinc/97/84/08/1080978408.db2.gz OYRGXAUOICIKCX-LBPRGKRZSA-N 1 1 350.382 2.894 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226632 1081107251 /nfs/dbraw/zinc/10/72/51/1081107251.db2.gz RCWCTTZJTFYAEY-BXKDBHETSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226632 1081107253 /nfs/dbraw/zinc/10/72/53/1081107253.db2.gz RCWCTTZJTFYAEY-BXKDBHETSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109286423 209302658 /nfs/dbraw/zinc/30/26/58/209302658.db2.gz QLNPDCZVFROJDF-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000375011259 512118200 /nfs/dbraw/zinc/11/82/00/512118200.db2.gz FBYVFGUUSKILAC-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000375011259 512118204 /nfs/dbraw/zinc/11/82/04/512118204.db2.gz FBYVFGUUSKILAC-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093146932 250020377 /nfs/dbraw/zinc/02/03/77/250020377.db2.gz AMTNCQZPQKAXQW-FNQPIQQGSA-N 1 1 358.486 2.710 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000152832273 251072886 /nfs/dbraw/zinc/07/28/86/251072886.db2.gz GPCZJRLWTJWWRA-JQWIXIFHSA-N 1 1 360.357 2.940 20 5 FFBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)N1CC(=O)Nc2ccccc21 ZINC000271621228 251837736 /nfs/dbraw/zinc/83/77/36/251837736.db2.gz MXLWBQTUZGZITA-STQMWFEESA-N 1 1 368.393 2.619 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O ZINC000272295075 252003545 /nfs/dbraw/zinc/00/35/45/252003545.db2.gz FXBUIOXZWIOAQM-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O ZINC000272295075 252003548 /nfs/dbraw/zinc/00/35/48/252003548.db2.gz FXBUIOXZWIOAQM-LSDHHAIUSA-N 1 1 360.414 2.874 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272474561 252048037 /nfs/dbraw/zinc/04/80/37/252048037.db2.gz IRGQZQWHUKLYML-XJKSGUPXSA-N 1 1 366.849 2.526 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)[C@H]2C1 ZINC000272697274 252106954 /nfs/dbraw/zinc/10/69/54/252106954.db2.gz YATUKULQLRCZTN-HZMBPMFUSA-N 1 1 368.231 2.524 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCC([NH+]3CCCCC3)CC2)s1 ZINC000272890553 252159299 /nfs/dbraw/zinc/15/92/99/252159299.db2.gz XSJATJSMPUXGSA-UHFFFAOYSA-N 1 1 373.500 2.515 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](N3CCCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000285706857 257000854 /nfs/dbraw/zinc/00/08/54/257000854.db2.gz WENXHQLBWCYLER-ZBFHGGJFSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](N3CCCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000285706857 257000855 /nfs/dbraw/zinc/00/08/55/257000855.db2.gz WENXHQLBWCYLER-ZBFHGGJFSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(CC(=O)N2CCCC2)CC1 ZINC000276141740 256075859 /nfs/dbraw/zinc/07/58/59/256075859.db2.gz OPCUUBLANGODRF-KRWDZBQOSA-N 1 1 374.485 2.594 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[N@H+](CC(=O)N2CCCC2)CC1 ZINC000276141740 256075862 /nfs/dbraw/zinc/07/58/62/256075862.db2.gz OPCUUBLANGODRF-KRWDZBQOSA-N 1 1 374.485 2.594 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1 ZINC000276141740 256075864 /nfs/dbraw/zinc/07/58/64/256075864.db2.gz OPCUUBLANGODRF-KRWDZBQOSA-N 1 1 374.485 2.594 20 5 FFBDMO COc1cc(C[N@@H+](C)CCCCO)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000276613382 256114875 /nfs/dbraw/zinc/11/48/75/256114875.db2.gz GWOQXSKSKVUOPA-UHFFFAOYSA-N 1 1 366.336 2.749 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277571356 256212606 /nfs/dbraw/zinc/21/26/06/256212606.db2.gz OACRNYQVYVVPIY-HNNXBMFYSA-N 1 1 363.458 2.751 20 5 FFBDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000278892263 256359242 /nfs/dbraw/zinc/35/92/42/256359242.db2.gz IXSZQXAPEXVADW-INIZCTEOSA-N 1 1 365.817 2.729 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(NCc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000278955891 256366346 /nfs/dbraw/zinc/36/63/46/256366346.db2.gz NJTJNSIXQIHAME-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@H]1C[C@@H](C)O ZINC000286210666 257025916 /nfs/dbraw/zinc/02/59/16/257025916.db2.gz YHLMSFCRRCQTDN-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286667097 257048682 /nfs/dbraw/zinc/04/86/82/257048682.db2.gz UXLLRWWVENPUFZ-OCCSQVGLSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H](CO)C1 ZINC000286667097 257048683 /nfs/dbraw/zinc/04/86/83/257048683.db2.gz UXLLRWWVENPUFZ-OCCSQVGLSA-N 1 1 362.348 2.986 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC000286857160 257058989 /nfs/dbraw/zinc/05/89/89/257058989.db2.gz MREJXVMGTLGMSI-STQMWFEESA-N 1 1 362.430 2.841 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)c1 ZINC000289865337 257303512 /nfs/dbraw/zinc/30/35/12/257303512.db2.gz LLCWKZJGSBHRCI-CQSZACIVSA-N 1 1 361.377 2.514 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)Nc1cc(-c3cccc([N+](=O)[O-])c3)[nH]n1)C2 ZINC000290377060 257329106 /nfs/dbraw/zinc/32/91/06/257329106.db2.gz KNCQPNXNKBMIKS-CYBMUJFWSA-N 1 1 366.381 2.691 20 5 FFBDMO NC(=O)c1ccnc(NC[C@@H]2CCC[N@H+]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000290698562 257353385 /nfs/dbraw/zinc/35/33/85/257353385.db2.gz VOTJZNMSRXZJDF-AWEZNQCLSA-N 1 1 361.446 2.545 20 5 FFBDMO COc1cc(C[NH2+]C2(C(=O)N(C)C)CCCCC2)c([N+](=O)[O-])cc1F ZINC000295103387 257616330 /nfs/dbraw/zinc/61/63/30/257616330.db2.gz HKNLAWRXVICJGR-UHFFFAOYSA-N 1 1 353.394 2.623 20 5 FFBDMO COc1cccc([C@H](C)[NH+]2CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC2)c1 ZINC000294405009 257586517 /nfs/dbraw/zinc/58/65/17/257586517.db2.gz AEYKKSCVKJZICT-HNNXBMFYSA-N 1 1 363.458 2.736 20 5 FFBDMO CN(C)C(=O)C[NH+]1CCC(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301102335 258025258 /nfs/dbraw/zinc/02/52/58/258025258.db2.gz PGJFCCQAUQGALI-UHFFFAOYSA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000301116398 258026875 /nfs/dbraw/zinc/02/68/75/258026875.db2.gz PVVIZTYSMWCOHV-HNNXBMFYSA-N 1 1 360.458 2.975 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(CNc3ccccc3[N+](=O)[O-])c2)C1 ZINC000301204949 258034042 /nfs/dbraw/zinc/03/40/42/258034042.db2.gz OSTBLXSQVJXBPI-KRWDZBQOSA-N 1 1 368.437 2.904 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC([NH+]2CCCCC2)CC1 ZINC000299421497 257992662 /nfs/dbraw/zinc/99/26/62/257992662.db2.gz NOZYLONNENFDGA-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccncc1)C1CC1 ZINC000299727317 258020822 /nfs/dbraw/zinc/02/08/22/258020822.db2.gz VFMVEWPIQGRUCK-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO COc1cccc([C@H]2[C@H](Nc3ncc([N+](=O)[O-])cn3)CC[N@H+]2C2CC2)c1 ZINC000302236938 258097196 /nfs/dbraw/zinc/09/71/96/258097196.db2.gz WAFGPRSILACMEN-SJORKVTESA-N 1 1 355.398 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC[NH+]2CCN(c3cccc(Cl)c3)CC2)nc1 ZINC000301734350 258065520 /nfs/dbraw/zinc/06/55/20/258065520.db2.gz ZGJYGULFFDSUTO-UHFFFAOYSA-N 1 1 361.833 2.877 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301878828 258072453 /nfs/dbraw/zinc/07/24/53/258072453.db2.gz JKUUSJZCPJZXSP-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301964451 258078678 /nfs/dbraw/zinc/07/86/78/258078678.db2.gz NTATVLHSSDZEMN-ZBFHGGJFSA-N 1 1 366.425 2.960 20 5 FFBDMO COc1cc(CN2C[C@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330585614 258165921 /nfs/dbraw/zinc/16/59/21/258165921.db2.gz LJAPIOUJKGVGSN-WDEREUQCSA-N 1 1 359.373 2.729 20 5 FFBDMO CCC[N@H+]1CCC[C@@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000330918334 258173669 /nfs/dbraw/zinc/17/36/69/258173669.db2.gz MZROBBOGGSGYMI-GOSISDBHSA-N 1 1 361.442 2.839 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121799 258177526 /nfs/dbraw/zinc/17/75/26/258177526.db2.gz NDCWZDUMALLZAT-LBTNJELSSA-N 1 1 363.458 2.653 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000332065467 258212255 /nfs/dbraw/zinc/21/22/55/258212255.db2.gz SINFGDVXIGKJKM-DGCLKSJQSA-N 1 1 370.356 2.945 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000332117497 258214498 /nfs/dbraw/zinc/21/44/98/258214498.db2.gz HVEGDVCXORUCLB-IXDOHACOSA-N 1 1 374.485 2.895 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@@H]2CC[C@@H](O)C[C@@H]2C1 ZINC000332238935 258220580 /nfs/dbraw/zinc/22/05/80/258220580.db2.gz OOBSNOVTJSRJRT-ZKYQVNSYSA-N 1 1 355.232 2.950 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332263456 258222343 /nfs/dbraw/zinc/22/23/43/258222343.db2.gz DWEFOFFVOWHERZ-VXGBXAGGSA-N 1 1 355.341 2.553 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453419 258231063 /nfs/dbraw/zinc/23/10/63/258231063.db2.gz GMAHWCWWGKZQNN-ZDUSSCGKSA-N 1 1 363.462 2.743 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453419 258231064 /nfs/dbraw/zinc/23/10/64/258231064.db2.gz GMAHWCWWGKZQNN-ZDUSSCGKSA-N 1 1 363.462 2.743 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000332453419 258231065 /nfs/dbraw/zinc/23/10/65/258231065.db2.gz GMAHWCWWGKZQNN-ZDUSSCGKSA-N 1 1 363.462 2.743 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000332474804 258231857 /nfs/dbraw/zinc/23/18/57/258231857.db2.gz KZQJCBUARLCRDO-JSGCOSHPSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000332520091 258233287 /nfs/dbraw/zinc/23/32/87/258233287.db2.gz LVGMIYZVOSQESX-YPMHNXCESA-N 1 1 369.368 2.895 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cc2cn3c(n2)CCCC3)c([N+](=O)[O-])c1 ZINC000373003797 512128133 /nfs/dbraw/zinc/12/81/33/512128133.db2.gz NKISOKVWPFKKMI-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2cn3c(n2)CCCC3)c([N+](=O)[O-])c1 ZINC000373003797 512128136 /nfs/dbraw/zinc/12/81/36/512128136.db2.gz NKISOKVWPFKKMI-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C ZINC000408003329 512982632 /nfs/dbraw/zinc/98/26/32/512982632.db2.gz DZSIQOLWKVYIFY-ZJUUUORDSA-N 1 1 370.247 2.830 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000162087566 509171966 /nfs/dbraw/zinc/17/19/66/509171966.db2.gz JATZTQMGDJNWLQ-LLVKDONJSA-N 1 1 370.247 2.962 20 5 FFBDMO O=C1C[C@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1 ZINC000052835522 506260167 /nfs/dbraw/zinc/26/01/67/506260167.db2.gz QBWSKWBVKCWRND-GOSISDBHSA-N 1 1 355.394 2.537 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@]3(C2)CCCOC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000375303294 512257680 /nfs/dbraw/zinc/25/76/80/512257680.db2.gz NTUZFFYZUPKKMK-IBGZPJMESA-N 1 1 356.426 2.998 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000065881406 506384760 /nfs/dbraw/zinc/38/47/60/506384760.db2.gz HRVLYLRLDVXTJV-UHFFFAOYSA-N 1 1 357.410 2.742 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000054646709 506594029 /nfs/dbraw/zinc/59/40/29/506594029.db2.gz KIIXDXMOUIMXRI-INIZCTEOSA-N 1 1 362.474 2.949 20 5 FFBDMO COc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000009982418 506720375 /nfs/dbraw/zinc/72/03/75/506720375.db2.gz CJNHEVNFUNZPTP-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO CC(C)NS(=O)(=O)c1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000067216817 506795832 /nfs/dbraw/zinc/79/58/32/506795832.db2.gz FNZSOAAMDMXPKZ-UHFFFAOYSA-N 1 1 363.439 2.571 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2cccs2)CC1 ZINC000056302377 506979225 /nfs/dbraw/zinc/97/92/25/506979225.db2.gz UMHYLGMECJKLRX-UHFFFAOYSA-N 1 1 359.451 2.586 20 5 FFBDMO O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1CC[N@H+](C2CC2)C1 ZINC000067703048 506980827 /nfs/dbraw/zinc/98/08/27/506980827.db2.gz ANVNSFJYFZFYFA-HNNXBMFYSA-N 1 1 361.445 2.508 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000068133234 507123808 /nfs/dbraw/zinc/12/38/08/507123808.db2.gz GTGNBEMJSWIWOO-AWEZNQCLSA-N 1 1 357.414 2.562 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NCC[NH+]1Cc2ccccc2C1 ZINC000068254480 507162871 /nfs/dbraw/zinc/16/28/71/507162871.db2.gz YTNNPLZFCIZYOZ-UHFFFAOYSA-N 1 1 354.410 2.529 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](Cc2cccs2)CC1 ZINC000019540062 507177241 /nfs/dbraw/zinc/17/72/41/507177241.db2.gz ULHAJDLYQYLBAF-AWEZNQCLSA-N 1 1 374.466 2.801 20 5 FFBDMO C[C@@H](CNC(=O)CSc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)C1 ZINC000047213367 507286070 /nfs/dbraw/zinc/28/60/70/507286070.db2.gz PQWOJKFYCBQVLY-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)CC1 ZINC000047272524 507298158 /nfs/dbraw/zinc/29/81/58/507298158.db2.gz RFBHXFYXWHJRRJ-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO C[C@H](CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)[N@@H+](C)C1CC1 ZINC000057713366 507315947 /nfs/dbraw/zinc/31/59/47/507315947.db2.gz JADQBLIHSSIBRQ-OAHLLOKOSA-N 1 1 363.461 2.754 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000069138290 507417590 /nfs/dbraw/zinc/41/75/90/507417590.db2.gz NSZHHTLZMQUUIP-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000058860963 507473667 /nfs/dbraw/zinc/47/36/67/507473667.db2.gz DSOKZYPGOAADQD-UHFFFAOYSA-N 1 1 363.458 2.943 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCOc1ccccc1 ZINC000026222705 507570128 /nfs/dbraw/zinc/57/01/28/507570128.db2.gz RUOVMJQBUZESJJ-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000377617388 512356080 /nfs/dbraw/zinc/35/60/80/512356080.db2.gz APUHAJUTOSPKKB-WSSFADSRSA-N 1 1 358.486 2.708 20 5 FFBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000377617388 512356085 /nfs/dbraw/zinc/35/60/85/512356085.db2.gz APUHAJUTOSPKKB-WSSFADSRSA-N 1 1 358.486 2.708 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000029839865 507792395 /nfs/dbraw/zinc/79/23/95/507792395.db2.gz OFZFWIDHGRJZDX-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO C[N@H+](CCCOc1ccc(F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000030268512 507804444 /nfs/dbraw/zinc/80/44/44/507804444.db2.gz PFOKXJKXPKXENG-UHFFFAOYSA-N 1 1 361.373 2.734 20 5 FFBDMO C[N@@H+](CCCOc1ccc(F)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000030268512 507804447 /nfs/dbraw/zinc/80/44/47/507804447.db2.gz PFOKXJKXPKXENG-UHFFFAOYSA-N 1 1 361.373 2.734 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)c(F)c1 ZINC000089512471 507844347 /nfs/dbraw/zinc/84/43/47/507844347.db2.gz FSVVJCJSTFAERT-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072725436 507847942 /nfs/dbraw/zinc/84/79/42/507847942.db2.gz XMXZCGOLBDNOOT-CQSZACIVSA-N 1 1 368.865 2.993 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072773050 507851851 /nfs/dbraw/zinc/85/18/51/507851851.db2.gz SQGABNGFOWOMBR-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC000072773050 507851852 /nfs/dbraw/zinc/85/18/52/507851852.db2.gz SQGABNGFOWOMBR-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000072836544 507860891 /nfs/dbraw/zinc/86/08/91/507860891.db2.gz BDOFWNAUHROGGK-MRXNPFEDSA-N 1 1 365.455 2.966 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089906401 507882122 /nfs/dbraw/zinc/88/21/22/507882122.db2.gz NBZIJZORKHCRLQ-CQSZACIVSA-N 1 1 361.398 2.735 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000108341368 507888874 /nfs/dbraw/zinc/88/88/74/507888874.db2.gz JSXNORCJCVZCRN-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000079926341 508016364 /nfs/dbraw/zinc/01/63/64/508016364.db2.gz CYVPSBXFQIOJQE-CYBMUJFWSA-N 1 1 359.430 2.898 20 5 FFBDMO COCC[N@@H+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000110560219 508033495 /nfs/dbraw/zinc/03/34/95/508033495.db2.gz PITNWQIEYHYJHW-NSHDSACASA-N 1 1 358.236 2.514 20 5 FFBDMO COCC[N@H+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000110560219 508033497 /nfs/dbraw/zinc/03/34/97/508033497.db2.gz PITNWQIEYHYJHW-NSHDSACASA-N 1 1 358.236 2.514 20 5 FFBDMO COc1cccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1OC ZINC000092047934 508037947 /nfs/dbraw/zinc/03/79/47/508037947.db2.gz BJPQLIKSWIVKMZ-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000092672214 508093062 /nfs/dbraw/zinc/09/30/62/508093062.db2.gz JGTFUSXXAAMLGP-ZNNBYXKUSA-N 1 1 361.467 2.648 20 5 FFBDMO O=C([C@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-])N1CCSCC1 ZINC000092672214 508093063 /nfs/dbraw/zinc/09/30/63/508093063.db2.gz JGTFUSXXAAMLGP-ZNNBYXKUSA-N 1 1 361.467 2.648 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)C1 ZINC000075329205 508098442 /nfs/dbraw/zinc/09/84/42/508098442.db2.gz OKUQDFJXAFYYJE-CYBMUJFWSA-N 1 1 364.402 2.615 20 5 FFBDMO CCc1ccc(C2=CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000093262746 508132164 /nfs/dbraw/zinc/13/21/64/508132164.db2.gz ZASDAFUFOWGTBO-IBGZPJMESA-N 1 1 356.426 2.504 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000081128763 508141062 /nfs/dbraw/zinc/14/10/62/508141062.db2.gz BTCBUMCFSZEHCP-GOSISDBHSA-N 1 1 369.421 2.707 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000081361454 508167168 /nfs/dbraw/zinc/16/71/68/508167168.db2.gz RBCNFEFMILDJCX-CQSZACIVSA-N 1 1 360.458 2.973 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000102478843 508276665 /nfs/dbraw/zinc/27/66/65/508276665.db2.gz CZNLVLRAFNIOMF-GFCCVEGCSA-N 1 1 357.838 2.862 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000087001363 508331071 /nfs/dbraw/zinc/33/10/71/508331071.db2.gz PJXRRJYNSNWKMV-GOSISDBHSA-N 1 1 371.437 2.955 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114642780 508333692 /nfs/dbraw/zinc/33/36/92/508333692.db2.gz DLZRVUODTBARDZ-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000104684656 508341745 /nfs/dbraw/zinc/34/17/45/508341745.db2.gz IMIZDMIWNJSROO-CYBMUJFWSA-N 1 1 350.415 2.977 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104685428 508341778 /nfs/dbraw/zinc/34/17/78/508341778.db2.gz SBYKQASGXRILCY-CQSZACIVSA-N 1 1 372.425 2.770 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000077903856 508390301 /nfs/dbraw/zinc/39/03/01/508390301.db2.gz QCWJIMNODCVNLD-OAHLLOKOSA-N 1 1 370.409 2.853 20 5 FFBDMO O=C1NCCCN1C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000135406437 508600453 /nfs/dbraw/zinc/60/04/53/508600453.db2.gz NRSOCSKMTDFSNX-UHFFFAOYSA-N 1 1 352.822 2.628 20 5 FFBDMO CC[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1CC(F)F ZINC000153698803 508629136 /nfs/dbraw/zinc/62/91/36/508629136.db2.gz UILJWOYTOIEWGC-ZDUSSCGKSA-N 1 1 370.400 2.585 20 5 FFBDMO Cc1c(CC(=O)N2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000158115099 508659464 /nfs/dbraw/zinc/65/94/64/508659464.db2.gz WQVNJYHRRWFQSK-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](c2ccccc2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000123377603 508678104 /nfs/dbraw/zinc/67/81/04/508678104.db2.gz JOWGNHXKGCXMRY-AWEZNQCLSA-N 1 1 369.377 2.752 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](c2ccccc2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000123377603 508678108 /nfs/dbraw/zinc/67/81/08/508678108.db2.gz JOWGNHXKGCXMRY-AWEZNQCLSA-N 1 1 369.377 2.752 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123418513 508684474 /nfs/dbraw/zinc/68/44/74/508684474.db2.gz ZECRQZLQAFJAKE-GDBMZVCRSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@H](C)O1 ZINC000153999255 508695648 /nfs/dbraw/zinc/69/56/48/508695648.db2.gz CABLXUZKSXBJMT-ZNMIVQPWSA-N 1 1 360.410 2.597 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@H](C)O1 ZINC000153999255 508695650 /nfs/dbraw/zinc/69/56/50/508695650.db2.gz CABLXUZKSXBJMT-ZNMIVQPWSA-N 1 1 360.410 2.597 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000118984495 508701041 /nfs/dbraw/zinc/70/10/41/508701041.db2.gz DGRNOBVFWSZPSM-AWEZNQCLSA-N 1 1 360.357 2.940 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000136646567 508706284 /nfs/dbraw/zinc/70/62/84/508706284.db2.gz ROZSPSDEWBKNOY-CQSZACIVSA-N 1 1 358.442 2.809 20 5 FFBDMO CCCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000136798638 508717514 /nfs/dbraw/zinc/71/75/14/508717514.db2.gz MKKKNDFPEXODII-INIZCTEOSA-N 1 1 371.441 2.835 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](Cn2ccnn2)C1 ZINC000119092528 508724145 /nfs/dbraw/zinc/72/41/45/508724145.db2.gz SNDIJVJYBPQAKX-HNNXBMFYSA-N 1 1 359.430 2.886 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000137448855 508756493 /nfs/dbraw/zinc/75/64/93/508756493.db2.gz NUKCPRRANSFZRA-HOCLYGCPSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000119396499 508787818 /nfs/dbraw/zinc/78/78/18/508787818.db2.gz QEVNGRXUEHHRSN-KSSFIOAISA-N 1 1 360.410 2.603 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccnc(N2CCN(C)CC2)c1 ZINC000159165177 508801713 /nfs/dbraw/zinc/80/17/13/508801713.db2.gz WKSHBCDVIIPHOZ-INIZCTEOSA-N 1 1 369.469 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+](CCO)CC3)o2)c(Cl)c1 ZINC000154561770 508809515 /nfs/dbraw/zinc/80/95/15/508809515.db2.gz KTIZFEZVUARFBX-UHFFFAOYSA-N 1 1 365.817 2.618 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)C2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000141270754 508814003 /nfs/dbraw/zinc/81/40/03/508814003.db2.gz UOWCOUXJJQIHDX-UHFFFAOYSA-N 1 1 355.394 2.641 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc([N+](=O)[O-])cnc1C ZINC000143258128 508829531 /nfs/dbraw/zinc/82/95/31/508829531.db2.gz WZDNPLKZCADYCC-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO CC[N@H+](CCc1nccs1)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000159406881 508837604 /nfs/dbraw/zinc/83/76/04/508837604.db2.gz LEYBVQMYKWBKOS-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000159406881 508837606 /nfs/dbraw/zinc/83/76/06/508837606.db2.gz LEYBVQMYKWBKOS-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000144838133 508841349 /nfs/dbraw/zinc/84/13/49/508841349.db2.gz HQVBYLSIAWHTOD-HOTGVXAUSA-N 1 1 363.458 2.990 20 5 FFBDMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159517254 508852051 /nfs/dbraw/zinc/85/20/51/508852051.db2.gz AGNSKMHBZJTQLV-DGCLKSJQSA-N 1 1 360.439 2.804 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)Cc1ccccn1 ZINC000119855238 508876974 /nfs/dbraw/zinc/87/69/74/508876974.db2.gz GERHJSRMEZXYAJ-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO CCC[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000125048961 508923101 /nfs/dbraw/zinc/92/31/01/508923101.db2.gz JIPFHJHUDVOADB-MRXNPFEDSA-N 1 1 350.419 2.559 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000125070747 508926540 /nfs/dbraw/zinc/92/65/40/508926540.db2.gz FHRHQICFCVXZMH-QGZVFWFLSA-N 1 1 369.487 2.525 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000369473701 512426652 /nfs/dbraw/zinc/42/66/52/512426652.db2.gz XGMNYSVRWYMINC-OAHLLOKOSA-N 1 1 357.414 2.698 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000155138101 508932074 /nfs/dbraw/zinc/93/20/74/508932074.db2.gz SLORYHVQIPAHNS-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000120208606 508950973 /nfs/dbraw/zinc/95/09/73/508950973.db2.gz CUWYJEIZQZVJPM-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000120208606 508950975 /nfs/dbraw/zinc/95/09/75/508950975.db2.gz CUWYJEIZQZVJPM-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000160230237 508957774 /nfs/dbraw/zinc/95/77/74/508957774.db2.gz IKQPPQZZDLMUAT-KSSFIOAISA-N 1 1 368.437 2.887 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000120265507 508961515 /nfs/dbraw/zinc/96/15/15/508961515.db2.gz ASVZDYUWDCLVOB-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO CCc1nn(C)c(CC)c1C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000160435522 508986877 /nfs/dbraw/zinc/98/68/77/508986877.db2.gz TZQRHHRYVTVRHM-UHFFFAOYSA-N 1 1 357.458 2.775 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000160520285 508997862 /nfs/dbraw/zinc/99/78/62/508997862.db2.gz QOKFIWBFXMSVAC-UHFFFAOYSA-N 1 1 356.426 2.569 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000120535983 509016246 /nfs/dbraw/zinc/01/62/46/509016246.db2.gz HREQYWKQKJOAMS-JTQLQIEISA-N 1 1 358.236 2.817 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155674289 509050369 /nfs/dbraw/zinc/05/03/69/509050369.db2.gz GZGHWFUEOACTTE-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000155674289 509050372 /nfs/dbraw/zinc/05/03/72/509050372.db2.gz GZGHWFUEOACTTE-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000161927504 509164857 /nfs/dbraw/zinc/16/48/57/509164857.db2.gz NZZAUIHXTMPWOB-CZUORRHYSA-N 1 1 374.441 2.620 20 5 FFBDMO Cc1cc(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000162237514 509181225 /nfs/dbraw/zinc/18/12/25/509181225.db2.gz UWNNNOWWXCFGDE-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000191837926 509204348 /nfs/dbraw/zinc/20/43/48/509204348.db2.gz SMTIKIQJZILMKB-BBRMVZONSA-N 1 1 373.409 2.923 20 5 FFBDMO CC[C@@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182396064 509215313 /nfs/dbraw/zinc/21/53/13/509215313.db2.gz XDELZXFGFIITNO-CYBMUJFWSA-N 1 1 362.386 2.888 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1SC ZINC000264030993 509291943 /nfs/dbraw/zinc/29/19/43/509291943.db2.gz MQXHWVUCJOTMMK-NSHDSACASA-N 1 1 365.455 2.539 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000182622224 509338543 /nfs/dbraw/zinc/33/85/43/509338543.db2.gz AVIAVTMAOGAVIG-HOTGVXAUSA-N 1 1 361.442 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@@H](C)CC1 ZINC000192183813 509391496 /nfs/dbraw/zinc/39/14/96/509391496.db2.gz GEJFHINQROUUTA-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000179367570 509405267 /nfs/dbraw/zinc/40/52/67/509405267.db2.gz VEOXTEQXXPKOMN-FZKQIMNGSA-N 1 1 356.426 2.561 20 5 FFBDMO C[C@@]1(C(N)=O)CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185904641 509417645 /nfs/dbraw/zinc/41/76/45/509417645.db2.gz PZVJEJFOPAPJHE-SFHVURJKSA-N 1 1 358.398 2.522 20 5 FFBDMO CC(C)N(C)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000248820904 509497177 /nfs/dbraw/zinc/49/71/77/509497177.db2.gz FNUZEGNGKXLXQQ-MRXNPFEDSA-N 1 1 370.457 2.916 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(c2ccccc2)CC1 ZINC000189287317 509502311 /nfs/dbraw/zinc/50/23/11/509502311.db2.gz QGQARLZUYKENJP-GOSISDBHSA-N 1 1 356.422 2.998 20 5 FFBDMO COC(=O)c1cnc(NC[C@H](C)[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000189288343 509502417 /nfs/dbraw/zinc/50/24/17/509502417.db2.gz XBLIGQMGIPELRZ-ZDUSSCGKSA-N 1 1 358.398 2.709 20 5 FFBDMO Cn1cc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C(C)(C)C)n1 ZINC000179559958 509512556 /nfs/dbraw/zinc/51/25/56/509512556.db2.gz CWFWPHFBGQLVTC-UHFFFAOYSA-N 1 1 357.458 2.948 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000248875743 509523568 /nfs/dbraw/zinc/52/35/68/509523568.db2.gz RABNTDQUBHHAAN-DOTOQJQBSA-N 1 1 369.421 2.610 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173328929 509533786 /nfs/dbraw/zinc/53/37/86/509533786.db2.gz XQRURIQBUMDVED-CYBMUJFWSA-N 1 1 363.439 2.696 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000248920099 509543485 /nfs/dbraw/zinc/54/34/85/509543485.db2.gz WNDFNMFVYCTQEZ-HNAYVOBHSA-N 1 1 368.437 2.915 20 5 FFBDMO COC(=O)c1cnc(N[C@H](C)C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000189379562 509547954 /nfs/dbraw/zinc/54/79/54/509547954.db2.gz IMJULISFISTNHK-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1 ZINC000173374281 509560121 /nfs/dbraw/zinc/56/01/21/509560121.db2.gz RNAXOHAZHMEMKQ-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000165697771 509581389 /nfs/dbraw/zinc/58/13/89/509581389.db2.gz LZAXJACHHVYIEO-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO Cn1cc(CNC[C@H]2CC[N@@H+](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237769598 509732259 /nfs/dbraw/zinc/73/22/59/509732259.db2.gz NTUHYOSHKHKRAK-CQSZACIVSA-N 1 1 355.442 2.569 20 5 FFBDMO Cn1cc(CNC[C@H]2CC[N@H+](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237769598 509732264 /nfs/dbraw/zinc/73/22/64/509732264.db2.gz NTUHYOSHKHKRAK-CQSZACIVSA-N 1 1 355.442 2.569 20 5 FFBDMO COc1cc(C[N@@H+]2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180063967 509734115 /nfs/dbraw/zinc/73/41/15/509734115.db2.gz SLBYPIVMPBXMPG-NSHDSACASA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@H+]2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180063967 509734122 /nfs/dbraw/zinc/73/41/22/509734122.db2.gz SLBYPIVMPBXMPG-NSHDSACASA-N 1 1 360.357 2.858 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000249686846 509735465 /nfs/dbraw/zinc/73/54/65/509735465.db2.gz JCTBIILOVMSSRH-ZIAGYGMSSA-N 1 1 364.446 2.523 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H](c1ccccc1)[NH+](C)C ZINC000186493506 509737822 /nfs/dbraw/zinc/73/78/22/509737822.db2.gz HNTLQSQNYFOSAQ-SGTLLEGYSA-N 1 1 367.409 2.892 20 5 FFBDMO CCc1cc(N2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000249741317 509749882 /nfs/dbraw/zinc/74/98/82/509749882.db2.gz IRLKCWWUHCQBMB-KRWDZBQOSA-N 1 1 353.426 2.899 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H](C4OCCO4)C3)o2)c1 ZINC000170914847 509845600 /nfs/dbraw/zinc/84/56/00/509845600.db2.gz DIVLBMZWJNSUTQ-HNNXBMFYSA-N 1 1 373.409 2.877 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])[C@H](C)C1 ZINC000190007494 509880596 /nfs/dbraw/zinc/88/05/96/509880596.db2.gz JEAYUQVOYFNGJR-HUUCEWRRSA-N 1 1 369.487 2.562 20 5 FFBDMO COc1cccc(S(=O)(=O)CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180416427 509915210 /nfs/dbraw/zinc/91/52/10/509915210.db2.gz LYVOORWBBQIDNP-ZDUSSCGKSA-N 1 1 364.423 2.728 20 5 FFBDMO CCCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 ZINC000255515593 509928469 /nfs/dbraw/zinc/92/84/69/509928469.db2.gz YPIVKSNVZPAEID-QKIRZYONSA-N 1 1 352.456 2.897 20 5 FFBDMO CCCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1 ZINC000255515593 509928475 /nfs/dbraw/zinc/92/84/75/509928475.db2.gz YPIVKSNVZPAEID-QKIRZYONSA-N 1 1 352.456 2.897 20 5 FFBDMO Cc1nnc([C@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)[nH]1 ZINC000268528032 509990207 /nfs/dbraw/zinc/99/02/07/509990207.db2.gz YDIQDDGROWGDSB-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000268528032 509990216 /nfs/dbraw/zinc/99/02/16/509990216.db2.gz YDIQDDGROWGDSB-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000268528032 509990220 /nfs/dbraw/zinc/99/02/20/509990220.db2.gz YDIQDDGROWGDSB-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n[nH]1 ZINC000268528032 509990228 /nfs/dbraw/zinc/99/02/28/509990228.db2.gz YDIQDDGROWGDSB-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n[nH]1 ZINC000268528032 509990234 /nfs/dbraw/zinc/99/02/34/509990234.db2.gz YDIQDDGROWGDSB-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO C[C@H](C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])c1nccs1 ZINC000183938138 510047243 /nfs/dbraw/zinc/04/72/43/510047243.db2.gz CMNRERSHIQYUIH-OLZOCXBDSA-N 1 1 351.428 2.527 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000180724432 510074150 /nfs/dbraw/zinc/07/41/50/510074150.db2.gz QXNSEPSQROWBMY-CYBMUJFWSA-N 1 1 374.466 2.881 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245751071 510129296 /nfs/dbraw/zinc/12/92/96/510129296.db2.gz YTWTYGHLHOKVEF-PBHICJAKSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245751071 510129301 /nfs/dbraw/zinc/12/93/01/510129301.db2.gz YTWTYGHLHOKVEF-PBHICJAKSA-N 1 1 357.414 2.621 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC[C@@H](C)C1 ZINC000190483186 510157813 /nfs/dbraw/zinc/15/78/13/510157813.db2.gz QMOUVVFHWSDZFE-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO CCc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2ccccc2OC)cc1[N+](=O)[O-] ZINC000262073657 510168613 /nfs/dbraw/zinc/16/86/13/510168613.db2.gz XBSVYVDZOBDRDU-SFHVURJKSA-N 1 1 369.421 2.953 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000184170348 510173044 /nfs/dbraw/zinc/17/30/44/510173044.db2.gz WSIPSDCKQBTUPY-UHFFFAOYSA-N 1 1 358.345 2.754 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](C[C@H]2CCCO2)[C@H]2CCSC2)c1 ZINC000245907827 510199369 /nfs/dbraw/zinc/19/93/69/510199369.db2.gz QWJHXIDGNVROHU-DOTOQJQBSA-N 1 1 352.456 2.960 20 5 FFBDMO CCC[C@]1(C)C(=O)NCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000187330833 510199463 /nfs/dbraw/zinc/19/94/63/510199463.db2.gz YXNYHEVQDFJLCL-LJQANCHMSA-N 1 1 372.425 2.783 20 5 FFBDMO CCC[C@]1(C)C(=O)NCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000187330833 510199469 /nfs/dbraw/zinc/19/94/69/510199469.db2.gz YXNYHEVQDFJLCL-LJQANCHMSA-N 1 1 372.425 2.783 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@@H]2CCCC[C@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245920057 510207398 /nfs/dbraw/zinc/20/73/98/510207398.db2.gz GWYQKHAXGFFSRA-MAUKXSAKSA-N 1 1 358.442 2.978 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])C1CC1 ZINC000187457953 510277048 /nfs/dbraw/zinc/27/70/48/510277048.db2.gz QCQZNXZHKOJSAX-GOSISDBHSA-N 1 1 368.437 2.817 20 5 FFBDMO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174745004 510287154 /nfs/dbraw/zinc/28/71/54/510287154.db2.gz UGPZOFZXHLOSRU-ZDUSSCGKSA-N 1 1 373.240 2.981 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000184449909 510331601 /nfs/dbraw/zinc/33/16/01/510331601.db2.gz GUDPLZMRLRPOGW-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269453548 510414960 /nfs/dbraw/zinc/41/49/60/510414960.db2.gz GPTPDBXYTJCBLT-UKRRQHHQSA-N 1 1 371.441 2.834 20 5 FFBDMO Cc1cc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)ccc1[N+](=O)[O-] ZINC000175110935 510487418 /nfs/dbraw/zinc/48/74/18/510487418.db2.gz VXNVEUPIVKHDJE-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000181650197 510521563 /nfs/dbraw/zinc/52/15/63/510521563.db2.gz FXGFONYBAOFZBN-IRXDYDNUSA-N 1 1 372.421 2.833 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000175212099 510533935 /nfs/dbraw/zinc/53/39/35/510533935.db2.gz JDRPLTSESJJQDO-AWEZNQCLSA-N 1 1 371.441 2.911 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@@H](COC)c2ccccc2)c([N+](=O)[O-])c1 ZINC000181695541 510544963 /nfs/dbraw/zinc/54/49/63/510544963.db2.gz PLJRFJKYWQEOFU-KRWDZBQOSA-N 1 1 373.409 2.909 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000181776668 510586989 /nfs/dbraw/zinc/58/69/89/510586989.db2.gz AGFSUNVZTRENLA-INIZCTEOSA-N 1 1 360.410 2.518 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000194918979 510589573 /nfs/dbraw/zinc/58/95/73/510589573.db2.gz IQXAWFJVUGTMLR-GOSISDBHSA-N 1 1 365.430 2.823 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000194918991 510589744 /nfs/dbraw/zinc/58/97/44/510589744.db2.gz IQXAWFJVUGTMLR-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1ccnc1 ZINC000246656342 510605157 /nfs/dbraw/zinc/60/51/57/510605157.db2.gz CUWYJEIZQZVJPM-CZUORRHYSA-N 1 1 368.397 2.924 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000172251775 510628920 /nfs/dbraw/zinc/62/89/20/510628920.db2.gz QNFFTWOJJUWXOW-KRWDZBQOSA-N 1 1 360.410 2.613 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000191404118 510644724 /nfs/dbraw/zinc/64/47/24/510644724.db2.gz CACQELVMHHMADG-QGZVFWFLSA-N 1 1 364.446 2.690 20 5 FFBDMO Cc1[nH]nc(C(=O)Nc2ccc(OCC[N@@H+]3CC[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000266611694 510687027 /nfs/dbraw/zinc/68/70/27/510687027.db2.gz BILVYLGQXPNNDS-GFCCVEGCSA-N 1 1 373.413 2.599 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000182081299 510745955 /nfs/dbraw/zinc/74/59/55/510745955.db2.gz ZPGGWAWQIRSOPF-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000246944459 510760921 /nfs/dbraw/zinc/76/09/21/510760921.db2.gz CBMLPFOHMIGJCE-CPUCHLNUSA-N 1 1 357.414 2.701 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](C/C=C/c2ccccc2)CC1 ZINC000195330615 510788767 /nfs/dbraw/zinc/78/87/67/510788767.db2.gz QSAPSEMGYMHRQO-JXMROGBWSA-N 1 1 355.442 2.955 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000247009503 510796985 /nfs/dbraw/zinc/79/69/85/510796985.db2.gz RFDAARZQRIDTCS-IRXDYDNUSA-N 1 1 372.469 2.894 20 5 FFBDMO C[N@H+](Cc1ccc(F)c(F)c1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182204560 510812106 /nfs/dbraw/zinc/81/21/06/510812106.db2.gz MEVPNXRWFPEEQX-ZDUSSCGKSA-N 1 1 352.337 2.745 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000182235185 510826801 /nfs/dbraw/zinc/82/68/01/510826801.db2.gz ITWCBMQHPUMERF-LLVKDONJSA-N 1 1 357.357 2.610 20 5 FFBDMO CCc1ccc([C@@H]2CCCCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000247500226 510863344 /nfs/dbraw/zinc/86/33/44/510863344.db2.gz LPWLQSAWIQDKDK-WBVHZDCISA-N 1 1 362.430 2.925 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000270507039 510890362 /nfs/dbraw/zinc/89/03/62/510890362.db2.gz VWQHXXIAARAYAF-UHFFFAOYSA-N 1 1 350.438 2.729 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000361256720 511021372 /nfs/dbraw/zinc/02/13/72/511021372.db2.gz DKIKGIVMIJISKG-MRXNPFEDSA-N 1 1 354.410 2.584 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000270910309 511022602 /nfs/dbraw/zinc/02/26/02/511022602.db2.gz STVBXGWZEBCMNT-AWEZNQCLSA-N 1 1 357.414 2.979 20 5 FFBDMO COCc1cccc(CNC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282559136 511025366 /nfs/dbraw/zinc/02/53/66/511025366.db2.gz YEFVZDUSIXIMRY-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO COCc1cccc(CNC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282559136 511025369 /nfs/dbraw/zinc/02/53/69/511025369.db2.gz YEFVZDUSIXIMRY-UHFFFAOYSA-N 1 1 371.437 2.532 20 5 FFBDMO CS(=O)(=O)[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000282785221 511110764 /nfs/dbraw/zinc/11/07/64/511110764.db2.gz QRXRZSYHUJJMMQ-HNNXBMFYSA-N 1 1 366.464 2.942 20 5 FFBDMO CS(=O)(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000282785221 511110766 /nfs/dbraw/zinc/11/07/66/511110766.db2.gz QRXRZSYHUJJMMQ-HNNXBMFYSA-N 1 1 366.464 2.942 20 5 FFBDMO CCOC(=O)C1(O)CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000271179987 511110858 /nfs/dbraw/zinc/11/08/58/511110858.db2.gz HBCJSWQNYJZRNV-UHFFFAOYSA-N 1 1 374.393 2.745 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294604453 511117068 /nfs/dbraw/zinc/11/70/68/511117068.db2.gz VIIYIAKPYHDXJH-JSGCOSHPSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CCC[C@H]1C[NH+]1CCCC1 ZINC000294729423 511159166 /nfs/dbraw/zinc/15/91/66/511159166.db2.gz NGNVTKAZKDOQCR-INIZCTEOSA-N 1 1 369.425 2.685 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000279716832 511188227 /nfs/dbraw/zinc/18/82/27/511188227.db2.gz INFUBNLXAWDBFO-QWHCGFSZSA-N 1 1 353.394 2.688 20 5 FFBDMO CCN(Cc1c([N+](=O)[O-])ncn1C)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000362852293 511251562 /nfs/dbraw/zinc/25/15/62/511251562.db2.gz PTQMKMVZWUNDKC-WBVHZDCISA-N 1 1 357.458 2.986 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2C[C@@H](c3cnn(C)c3)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000365133720 511276629 /nfs/dbraw/zinc/27/66/29/511276629.db2.gz DLPGHEPLOYVIKQ-WMZOPIPTSA-N 1 1 358.442 2.660 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1SC ZINC000362958217 511279257 /nfs/dbraw/zinc/27/92/57/511279257.db2.gz PDPLYUNKRPDHQR-RYUDHWBXSA-N 1 1 365.455 2.682 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000295199259 511319487 /nfs/dbraw/zinc/31/94/87/511319487.db2.gz SGILASZIERRRFP-UHFFFAOYSA-N 1 1 372.425 2.710 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+](C2CC2)C1 ZINC000295422045 511400091 /nfs/dbraw/zinc/40/00/91/511400091.db2.gz UBMWVALXNKRCLM-CYBMUJFWSA-N 1 1 356.426 2.561 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000333984594 511413921 /nfs/dbraw/zinc/41/39/21/511413921.db2.gz CERYVZBOLRYYJN-ONGXEEELSA-N 1 1 370.247 2.878 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000291978318 511414709 /nfs/dbraw/zinc/41/47/09/511414709.db2.gz YLRDUVIGOFGZQY-DZGCQCFKSA-N 1 1 371.441 2.834 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000334042152 511435849 /nfs/dbraw/zinc/43/58/49/511435849.db2.gz GXXHGVMEUPLHPR-VHSXEESVSA-N 1 1 356.220 2.570 20 5 FFBDMO COc1cc(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000292155560 511487334 /nfs/dbraw/zinc/48/73/34/511487334.db2.gz OBAZBELCPVDBLW-QGZVFWFLSA-N 1 1 371.384 2.732 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000292280856 511535069 /nfs/dbraw/zinc/53/50/69/511535069.db2.gz SWCMSHPJDFEOBD-SFHVURJKSA-N 1 1 373.384 2.531 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)c(F)c1 ZINC000292280856 511535074 /nfs/dbraw/zinc/53/50/74/511535074.db2.gz SWCMSHPJDFEOBD-SFHVURJKSA-N 1 1 373.384 2.531 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)C2)C1 ZINC000292437241 511597173 /nfs/dbraw/zinc/59/71/73/511597173.db2.gz WPVOPACLBMFAHN-GOSISDBHSA-N 1 1 372.450 2.886 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC000365934632 511736782 /nfs/dbraw/zinc/73/67/82/511736782.db2.gz RBVVXWWKKJAMAZ-QGZVFWFLSA-N 1 1 362.817 2.595 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000281157856 511741842 /nfs/dbraw/zinc/74/18/42/511741842.db2.gz CHELTEWVFGWGKW-CVEARBPZSA-N 1 1 363.458 2.861 20 5 FFBDMO NC(=O)c1ccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311246234 511776328 /nfs/dbraw/zinc/77/63/28/511776328.db2.gz HQSXGEWNZXAWLE-MRXNPFEDSA-N 1 1 354.410 2.770 20 5 FFBDMO CC(C)N1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])c4cccnc43)C2)CC1 ZINC000364070867 511942224 /nfs/dbraw/zinc/94/22/24/511942224.db2.gz KIACMAMDNMZNIX-MRXNPFEDSA-N 1 1 369.469 2.748 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771674 512499007 /nfs/dbraw/zinc/49/90/07/512499007.db2.gz ILLYWIRJUYZEMR-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000375771674 512499009 /nfs/dbraw/zinc/49/90/09/512499009.db2.gz ILLYWIRJUYZEMR-CABCVRRESA-N 1 1 371.441 2.843 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](CC)O[C@@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806897 512514768 /nfs/dbraw/zinc/51/47/68/512514768.db2.gz TUMZEVHPYBQVMI-YJBOKZPZSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](CC)O[C@@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806897 512514773 /nfs/dbraw/zinc/51/47/73/512514773.db2.gz TUMZEVHPYBQVMI-YJBOKZPZSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc(CN2CCCC3(CC[NH+](C)CC3)C2)c([N+](=O)[O-])cc1OC ZINC000369703329 512563459 /nfs/dbraw/zinc/56/34/59/512563459.db2.gz MEZFJHAFKVHQAK-UHFFFAOYSA-N 1 1 363.458 2.920 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000374028062 512629732 /nfs/dbraw/zinc/62/97/32/512629732.db2.gz VYVMGPPATCRFJP-ZACQAIPSSA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000374028062 512629739 /nfs/dbraw/zinc/62/97/39/512629739.db2.gz VYVMGPPATCRFJP-ZACQAIPSSA-N 1 1 363.458 2.547 20 5 FFBDMO Cn1cc(CN2CCC[N@H+]3CCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000378349301 512710076 /nfs/dbraw/zinc/71/00/76/512710076.db2.gz JHJSEEJXNHGQKO-SFHVURJKSA-N 1 1 355.442 2.665 20 5 FFBDMO CCN(C(=O)c1nn(C)cc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000378406449 512743705 /nfs/dbraw/zinc/74/37/05/512743705.db2.gz UONIMWCDACWSTO-ZBFHGGJFSA-N 1 1 371.441 2.626 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000411681010 512755188 /nfs/dbraw/zinc/75/51/88/512755188.db2.gz VQHHDLBJNFAFON-KGLIPLIRSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](C4CCOCC4)C3)n2)c1 ZINC000374357719 512787487 /nfs/dbraw/zinc/78/74/87/512787487.db2.gz KBMITQPQPASLHZ-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000372296351 512801572 /nfs/dbraw/zinc/80/15/72/512801572.db2.gz VTQSXQUOHZOZCB-MRXNPFEDSA-N 1 1 355.394 2.667 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000372296351 512801577 /nfs/dbraw/zinc/80/15/77/512801577.db2.gz VTQSXQUOHZOZCB-MRXNPFEDSA-N 1 1 355.394 2.667 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccncn2)CC1 ZINC000411828963 512834977 /nfs/dbraw/zinc/83/49/77/512834977.db2.gz RTJHYEHJQGJKLD-ZDUSSCGKSA-N 1 1 355.398 2.591 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](OCc2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000376517406 512854148 /nfs/dbraw/zinc/85/41/48/512854148.db2.gz JNNIWDWPKHTABY-SFHVURJKSA-N 1 1 370.409 2.610 20 5 FFBDMO C[N@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])Cc1ccccc1 ZINC000386729154 512890354 /nfs/dbraw/zinc/89/03/54/512890354.db2.gz ASXDPOSJQXBKOE-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO C[N@@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])Cc1ccccc1 ZINC000386729154 512890357 /nfs/dbraw/zinc/89/03/57/512890357.db2.gz ASXDPOSJQXBKOE-UHFFFAOYSA-N 1 1 363.439 2.542 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1F ZINC000412055233 512934764 /nfs/dbraw/zinc/93/47/64/512934764.db2.gz OIROXQMASBYIAV-BETUJISGSA-N 1 1 367.421 2.664 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000376714932 512955108 /nfs/dbraw/zinc/95/51/08/512955108.db2.gz HVVXTDXWLHSOPL-LBPRGKRZSA-N 1 1 360.439 2.925 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C ZINC000408003329 512982631 /nfs/dbraw/zinc/98/26/31/512982631.db2.gz DZSIQOLWKVYIFY-ZJUUUORDSA-N 1 1 370.247 2.830 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450322597 513143507 /nfs/dbraw/zinc/14/35/07/513143507.db2.gz ARPCCOFAPDKLHT-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000433809034 513155127 /nfs/dbraw/zinc/15/51/27/513155127.db2.gz RTNIPQUIIUSBOH-LLVKDONJSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000433809034 513155134 /nfs/dbraw/zinc/15/51/34/513155134.db2.gz RTNIPQUIIUSBOH-LLVKDONJSA-N 1 1 355.236 2.603 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000439684850 513161754 /nfs/dbraw/zinc/16/17/54/513161754.db2.gz MKMUTHFSTGZHNP-INIZCTEOSA-N 1 1 363.458 2.990 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000428811719 513198494 /nfs/dbraw/zinc/19/84/94/513198494.db2.gz WFFIHALNFKIAHP-FQEVSTJZSA-N 1 1 354.406 2.954 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H](C)[N@@H+](CC)C[C@H]1C ZINC000439888180 513204937 /nfs/dbraw/zinc/20/49/37/513204937.db2.gz NBDQLZCZLAPOSL-QWHCGFSZSA-N 1 1 350.419 2.940 20 5 FFBDMO Cc1nc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC000450537584 513240570 /nfs/dbraw/zinc/24/05/70/513240570.db2.gz DZGPVLMVAWHSSJ-IAGOWNOFSA-N 1 1 353.426 2.652 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1C ZINC000440077454 513240910 /nfs/dbraw/zinc/24/09/10/513240910.db2.gz LFWFUPGXMAVFSJ-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(CN2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000429039196 513264289 /nfs/dbraw/zinc/26/42/89/513264289.db2.gz HIZBCVVEPVTHON-DVOMOZLQSA-N 1 1 351.422 2.905 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@]3(CCCc4ccccc43)C2)c1 ZINC000440326299 513293932 /nfs/dbraw/zinc/29/39/32/513293932.db2.gz MGKIUGDNHLQJON-ICSRJNTNSA-N 1 1 370.453 2.522 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc2O1 ZINC000429183467 513300538 /nfs/dbraw/zinc/30/05/38/513300538.db2.gz FLNWKIHXRKQASK-YOEHRIQHSA-N 1 1 358.394 2.618 20 5 FFBDMO CC[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000412885467 513323628 /nfs/dbraw/zinc/32/36/28/513323628.db2.gz YPYIPAOEIRFREO-GFCCVEGCSA-N 1 1 371.387 2.784 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC[C@@H](S(C)(=O)=O)C1 ZINC000446850457 513349083 /nfs/dbraw/zinc/34/90/83/513349083.db2.gz ZNWVMMIWJOFLPM-IDKBZEPQSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC[C@@H](S(C)(=O)=O)C1 ZINC000446850457 513349090 /nfs/dbraw/zinc/34/90/90/513349090.db2.gz ZNWVMMIWJOFLPM-IDKBZEPQSA-N 1 1 352.456 2.897 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000429366192 513354542 /nfs/dbraw/zinc/35/45/42/513354542.db2.gz QVGXFIFKMNINQQ-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+](C2CCC2)C1 ZINC000429370742 513355722 /nfs/dbraw/zinc/35/57/22/513355722.db2.gz FJSMAATWZVLBAN-KXBFYZLASA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000418105908 513373612 /nfs/dbraw/zinc/37/36/12/513373612.db2.gz BQIBKYGTTIABNK-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)CN1CCO ZINC000418105908 513373617 /nfs/dbraw/zinc/37/36/17/513373617.db2.gz BQIBKYGTTIABNK-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)CN1CCO ZINC000418105908 513373626 /nfs/dbraw/zinc/37/36/26/513373626.db2.gz BQIBKYGTTIABNK-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000451075286 513500420 /nfs/dbraw/zinc/50/04/20/513500420.db2.gz AMBOJOGFAWIDFU-KRWDZBQOSA-N 1 1 374.485 2.616 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1C1CCN(C)CC1 ZINC000413219062 513528001 /nfs/dbraw/zinc/52/80/01/513528001.db2.gz KSAYUFNKJSEDKH-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CCN1C1CC[NH+](C)CC1 ZINC000413219062 513528009 /nfs/dbraw/zinc/52/80/09/513528009.db2.gz KSAYUFNKJSEDKH-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451151179 513552929 /nfs/dbraw/zinc/55/29/29/513552929.db2.gz AQFCAUFZPYPIJW-UHFFFAOYSA-N 1 1 361.442 2.859 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000430223669 513591222 /nfs/dbraw/zinc/59/12/22/513591222.db2.gz VFNCCPDFCQSJKB-LBPRGKRZSA-N 1 1 364.423 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451277123 513646053 /nfs/dbraw/zinc/64/60/53/513646053.db2.gz ZZRKPGASKGVHQI-MOPGFXCFSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1 ZINC000451277123 513646063 /nfs/dbraw/zinc/64/60/63/513646063.db2.gz ZZRKPGASKGVHQI-MOPGFXCFSA-N 1 1 360.385 2.774 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451340595 513686935 /nfs/dbraw/zinc/68/69/35/513686935.db2.gz JVXPUFXOVAKAGL-GZOSKZMVSA-N 1 1 361.442 2.937 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000430802688 513752201 /nfs/dbraw/zinc/75/22/01/513752201.db2.gz OEYQDXTXTHPSFR-MRXNPFEDSA-N 1 1 371.437 2.919 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C1 ZINC000416415094 513761408 /nfs/dbraw/zinc/76/14/08/513761408.db2.gz SSLCSPVOMAZJHQ-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(F)cc2c(=O)c3cccc(F)c3[nH]c12)C1CC1 ZINC000436304603 513822192 /nfs/dbraw/zinc/82/21/92/513822192.db2.gz GTTHMMUDRKMTTJ-UHFFFAOYSA-N 1 1 371.387 2.784 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCCC[C@@H]1C ZINC000448699176 513852730 /nfs/dbraw/zinc/85/27/30/513852730.db2.gz SMHIYWVZXWZRMW-LSDHHAIUSA-N 1 1 371.441 2.773 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000451596106 513856304 /nfs/dbraw/zinc/85/63/04/513856304.db2.gz GDCWGGFJMVEUHP-CABCVRRESA-N 1 1 374.397 2.856 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCC[C@@H](C)C1 ZINC000448706582 513856330 /nfs/dbraw/zinc/85/63/30/513856330.db2.gz ZIGMNKISNLXKOM-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431495425 513911900 /nfs/dbraw/zinc/91/19/00/513911900.db2.gz JHIWEFPKLPDWEY-OTYXRUKQSA-N 1 1 368.231 2.570 20 5 FFBDMO NC(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCOc2ccccc21 ZINC000451707719 513926557 /nfs/dbraw/zinc/92/65/57/513926557.db2.gz IHQMWIVYRKZEMI-QGZVFWFLSA-N 1 1 373.384 2.935 20 5 FFBDMO NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCOc2ccccc21 ZINC000451707719 513926564 /nfs/dbraw/zinc/92/65/64/513926564.db2.gz IHQMWIVYRKZEMI-QGZVFWFLSA-N 1 1 373.384 2.935 20 5 FFBDMO CN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000431942251 514047191 /nfs/dbraw/zinc/04/71/91/514047191.db2.gz YWTPKNIYHBOLEB-ZDUSSCGKSA-N 1 1 368.231 2.666 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CCSC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000451963610 514098304 /nfs/dbraw/zinc/09/83/04/514098304.db2.gz HQUXUUJHQWGRNW-SFHVURJKSA-N 1 1 361.467 2.703 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCCC[C@H]2O)CC1 ZINC000449183336 514104588 /nfs/dbraw/zinc/10/45/88/514104588.db2.gz FQWYKWQCZFJELI-CDHQVMDDSA-N 1 1 361.486 2.883 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000423422506 514137505 /nfs/dbraw/zinc/13/75/05/514137505.db2.gz LGLWZWGTDAHOKZ-IIDMSEBBSA-N 1 1 357.458 2.772 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2C[C@H](C)[NH2+]Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000420466610 514158665 /nfs/dbraw/zinc/15/86/65/514158665.db2.gz XBLIMZYMVHQGKO-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000432425858 514191529 /nfs/dbraw/zinc/19/15/29/514191529.db2.gz OGQSDONGBPZGLW-UHFFFAOYSA-N 1 1 358.320 2.997 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452106528 514195375 /nfs/dbraw/zinc/19/53/75/514195375.db2.gz QUOAIJDXBUKFFY-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOC(=O)c1nn(C)cc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504887 514231351 /nfs/dbraw/zinc/23/13/51/514231351.db2.gz WMSFBPUMTRFJFG-HNNXBMFYSA-N 1 1 372.425 2.885 20 5 FFBDMO CCOC(=O)c1nn(C)cc1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449504887 514231355 /nfs/dbraw/zinc/23/13/55/514231355.db2.gz WMSFBPUMTRFJFG-HNNXBMFYSA-N 1 1 372.425 2.885 20 5 FFBDMO C[C@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn21 ZINC000449575622 514261257 /nfs/dbraw/zinc/26/12/57/514261257.db2.gz YKFRZCHVHMFVQJ-BLLLJJGKSA-N 1 1 352.398 2.987 20 5 FFBDMO Cc1cc(Br)ccc1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000444708069 514299809 /nfs/dbraw/zinc/29/98/09/514299809.db2.gz YVCNEZIUWGEEFY-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000432986393 514341874 /nfs/dbraw/zinc/34/18/74/514341874.db2.gz VVYNFTLXZJQECK-SNVBAGLBSA-N 1 1 367.203 2.877 20 5 FFBDMO CC[N@H+](CCOc1ccccc1C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000420969886 514410235 /nfs/dbraw/zinc/41/02/35/514410235.db2.gz CZQKZQUMOVUBQL-UHFFFAOYSA-N 1 1 357.410 2.903 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000420969886 514410241 /nfs/dbraw/zinc/41/02/41/514410241.db2.gz CZQKZQUMOVUBQL-UHFFFAOYSA-N 1 1 357.410 2.903 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000439484835 514562940 /nfs/dbraw/zinc/56/29/40/514562940.db2.gz FTFLJRHNYIJMST-KDOFPFPSSA-N 1 1 350.415 2.948 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000470964748 514695757 /nfs/dbraw/zinc/69/57/57/514695757.db2.gz AZNMHIGYGXBUQM-HNNXBMFYSA-N 1 1 361.442 2.988 20 5 FFBDMO CC(C)OCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000470978393 514704350 /nfs/dbraw/zinc/70/43/50/514704350.db2.gz SWWYXABDULYQFS-UHFFFAOYSA-N 1 1 365.474 2.925 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(N2CCCCC2)C1 ZINC000475564000 514716702 /nfs/dbraw/zinc/71/67/02/514716702.db2.gz RYBQTMQQJMXYSX-MXWWQKGMSA-N 1 1 360.458 2.918 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC1CC([NH+]2CCCCC2)C1 ZINC000475564000 514716713 /nfs/dbraw/zinc/71/67/13/514716713.db2.gz RYBQTMQQJMXYSX-MXWWQKGMSA-N 1 1 360.458 2.918 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000489221011 514757281 /nfs/dbraw/zinc/75/72/81/514757281.db2.gz CZFVSDNGVRMPPE-HNNXBMFYSA-N 1 1 363.458 2.978 20 5 FFBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2SCCO)cn2cc[nH+]c12 ZINC000502797774 514783130 /nfs/dbraw/zinc/78/31/30/514783130.db2.gz ZUHAARQQXVPSJQ-UHFFFAOYSA-N 1 1 372.406 2.888 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CC[C@H](C)C1 ZINC000484890433 514832457 /nfs/dbraw/zinc/83/24/57/514832457.db2.gz FJMQPTAUFUPJGB-HOCLYGCPSA-N 1 1 361.442 2.621 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3nc4ccc(F)cc4o3)C2)nc1 ZINC000466939401 514835734 /nfs/dbraw/zinc/83/57/34/514835734.db2.gz JNOMMAZHQLBPCU-GFCCVEGCSA-N 1 1 357.345 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3nc4ccc(F)cc4o3)C2)nc1 ZINC000466939401 514835742 /nfs/dbraw/zinc/83/57/42/514835742.db2.gz JNOMMAZHQLBPCU-GFCCVEGCSA-N 1 1 357.345 2.957 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919893 514845047 /nfs/dbraw/zinc/84/50/47/514845047.db2.gz MFPHFDPDUJCQFH-LSDHHAIUSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919893 514845104 /nfs/dbraw/zinc/84/51/04/514845104.db2.gz MFPHFDPDUJCQFH-LSDHHAIUSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000484919893 514845115 /nfs/dbraw/zinc/84/51/15/514845115.db2.gz MFPHFDPDUJCQFH-LSDHHAIUSA-N 1 1 351.447 2.787 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000467018943 514865244 /nfs/dbraw/zinc/86/52/44/514865244.db2.gz QXCAQBIOZZFGKK-ABAIWWIYSA-N 1 1 372.450 2.931 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000467181388 514929715 /nfs/dbraw/zinc/92/97/15/514929715.db2.gz JQDWLLNFVGRPCV-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000467181388 514929730 /nfs/dbraw/zinc/92/97/30/514929730.db2.gz JQDWLLNFVGRPCV-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000498553576 514963906 /nfs/dbraw/zinc/96/39/06/514963906.db2.gz GLRMFRUHADSWCK-CHWSQXEVSA-N 1 1 369.849 2.958 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000498553578 514965089 /nfs/dbraw/zinc/96/50/89/514965089.db2.gz GLRMFRUHADSWCK-QWHCGFSZSA-N 1 1 369.849 2.958 20 5 FFBDMO O=C1C[C@H]([N@H+]2CCC3(C2)CCCCC3)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000462273189 514969123 /nfs/dbraw/zinc/96/91/23/514969123.db2.gz BIAQARYZKNXMBG-INIZCTEOSA-N 1 1 357.410 2.883 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000498567938 514974061 /nfs/dbraw/zinc/97/40/61/514974061.db2.gz XIRNHENQJZLUNZ-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000498645320 515008356 /nfs/dbraw/zinc/00/83/56/515008356.db2.gz VUGDIMKVLPMERY-UHFFFAOYSA-N 1 1 359.405 2.753 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)[C@H](C)C1 ZINC000485418760 515033532 /nfs/dbraw/zinc/03/35/32/515033532.db2.gz VQTYRDPKGVYNPA-ZIAGYGMSSA-N 1 1 374.416 2.687 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000467547091 515043596 /nfs/dbraw/zinc/04/35/96/515043596.db2.gz FFSIEZQUOIRCMK-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000467547091 515043599 /nfs/dbraw/zinc/04/35/99/515043599.db2.gz FFSIEZQUOIRCMK-QGZVFWFLSA-N 1 1 354.378 2.526 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000480699835 515048539 /nfs/dbraw/zinc/04/85/39/515048539.db2.gz PJLIRYHJBRACAJ-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO CCOc1cc(N2CCN(c3cc(CC)[nH+]c(C)n3)CC2)ccc1[N+](=O)[O-] ZINC000480853999 515108508 /nfs/dbraw/zinc/10/85/08/515108508.db2.gz QYELTPPJXDCPEL-UHFFFAOYSA-N 1 1 371.441 2.981 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000498991531 515158200 /nfs/dbraw/zinc/15/82/00/515158200.db2.gz PEEPLKAZILSAQF-MFKMUULPSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000498991531 515158207 /nfs/dbraw/zinc/15/82/07/515158207.db2.gz PEEPLKAZILSAQF-MFKMUULPSA-N 1 1 360.357 2.798 20 5 FFBDMO CCc1cc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000462885089 515281908 /nfs/dbraw/zinc/28/19/08/515281908.db2.gz TWJLISKVLYLTLJ-CZUORRHYSA-N 1 1 355.442 2.931 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])c(N)c1F ZINC000486040709 515308441 /nfs/dbraw/zinc/30/84/41/515308441.db2.gz ZSRLGVNSSXYVHL-UGSOOPFHSA-N 1 1 359.405 2.840 20 5 FFBDMO C[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000463072974 515359048 /nfs/dbraw/zinc/35/90/48/515359048.db2.gz XRMWKVZCZJRTED-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176090 515387132 /nfs/dbraw/zinc/38/71/32/515387132.db2.gz KHDFVUKWMNMOQI-SCLBCKFNSA-N 1 1 355.394 2.551 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176090 515387143 /nfs/dbraw/zinc/38/71/43/515387143.db2.gz KHDFVUKWMNMOQI-SCLBCKFNSA-N 1 1 355.394 2.551 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](O)C2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000463236003 515412189 /nfs/dbraw/zinc/41/21/89/515412189.db2.gz OVKUNJRWUIQRGG-CQSZACIVSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](O)C2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000463236003 515412197 /nfs/dbraw/zinc/41/21/97/515412197.db2.gz OVKUNJRWUIQRGG-CQSZACIVSA-N 1 1 360.357 2.593 20 5 FFBDMO C[C@]1(c2ccccc2)CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 ZINC000510089587 515431099 /nfs/dbraw/zinc/43/10/99/515431099.db2.gz WXABREHIBCKDLP-MOPGFXCFSA-N 1 1 358.442 2.596 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1C ZINC000486432412 515481240 /nfs/dbraw/zinc/48/12/40/515481240.db2.gz YMPWEQWAMFSYPK-NEPJUHHUSA-N 1 1 355.385 2.747 20 5 FFBDMO O=C(NCC[NH+]1CCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000505399511 515522340 /nfs/dbraw/zinc/52/23/40/515522340.db2.gz JFBQSUMHOWPSHV-UHFFFAOYSA-N 1 1 354.410 2.642 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456982216 515563788 /nfs/dbraw/zinc/56/37/88/515563788.db2.gz GMXHLEUKHPXUSJ-GOSISDBHSA-N 1 1 364.405 2.723 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505517446 515567003 /nfs/dbraw/zinc/56/70/03/515567003.db2.gz TYPPMSRWUDLXQI-IBGZPJMESA-N 1 1 369.421 2.709 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000505556959 515584607 /nfs/dbraw/zinc/58/46/07/515584607.db2.gz FMSWBLFALWADAT-QGZVFWFLSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473514414 515641264 /nfs/dbraw/zinc/64/12/64/515641264.db2.gz RPYYADMZQOYIHP-QGZVFWFLSA-N 1 1 369.469 2.749 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000494045868 515717789 /nfs/dbraw/zinc/71/77/89/515717789.db2.gz CNRPIDYKQMBXLO-KXBFYZLASA-N 1 1 369.421 2.753 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511139621 515801262 /nfs/dbraw/zinc/80/12/62/515801262.db2.gz QSWODMNJGJDHLH-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511139621 515801270 /nfs/dbraw/zinc/80/12/70/515801270.db2.gz QSWODMNJGJDHLH-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO CC[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000482874599 515832460 /nfs/dbraw/zinc/83/24/60/515832460.db2.gz ORSFXRXNEOEISX-GOSISDBHSA-N 1 1 362.474 2.578 20 5 FFBDMO C[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000511471400 515917682 /nfs/dbraw/zinc/91/76/82/515917682.db2.gz AORYDJHUBHUQQH-HOTGVXAUSA-N 1 1 362.474 2.899 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000511607985 515960750 /nfs/dbraw/zinc/96/07/50/515960750.db2.gz ANQUJOVMEALUHR-NSHDSACASA-N 1 1 359.373 2.731 20 5 FFBDMO CCCCOC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000464853708 515988466 /nfs/dbraw/zinc/98/84/66/515988466.db2.gz JLRVCINGHRJHRU-GOSISDBHSA-N 1 1 361.442 2.981 20 5 FFBDMO CCCCOC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000464862305 515994165 /nfs/dbraw/zinc/99/41/65/515994165.db2.gz XZNVATANTIRGHI-UHFFFAOYSA-N 1 1 361.442 2.765 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000469849917 515995448 /nfs/dbraw/zinc/99/54/48/515995448.db2.gz TVWBMPKCFWOOHI-GOSISDBHSA-N 1 1 371.462 2.942 20 5 FFBDMO O=C(NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000469849917 515995454 /nfs/dbraw/zinc/99/54/54/515995454.db2.gz TVWBMPKCFWOOHI-GOSISDBHSA-N 1 1 371.462 2.942 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000487847887 516006916 /nfs/dbraw/zinc/00/69/16/516006916.db2.gz NCLMPVDPQCEWNT-UHFFFAOYSA-N 1 1 371.441 2.757 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474423750 516039497 /nfs/dbraw/zinc/03/94/97/516039497.db2.gz AAYGHGSGNPQDOL-HNNXBMFYSA-N 1 1 370.409 2.999 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000488082128 516108555 /nfs/dbraw/zinc/10/85/55/516108555.db2.gz CTOYTRGXCKCBCN-MRXNPFEDSA-N 1 1 369.469 2.749 20 5 FFBDMO CCC1CCC([N@@H+](CCO)C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000488160833 516139515 /nfs/dbraw/zinc/13/95/15/516139515.db2.gz UDICUQOYULUFRT-OFLPRAFFSA-N 1 1 366.458 2.598 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285498 516156601 /nfs/dbraw/zinc/15/66/01/516156601.db2.gz VDXAAVBWHNIRGJ-AUUYWEPGSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285498 516156605 /nfs/dbraw/zinc/15/66/05/516156605.db2.gz VDXAAVBWHNIRGJ-AUUYWEPGSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000507285926 516158748 /nfs/dbraw/zinc/15/87/48/516158748.db2.gz VVQAYHBELADXFU-XJKSGUPXSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000507285926 516158755 /nfs/dbraw/zinc/15/87/55/516158755.db2.gz VVQAYHBELADXFU-XJKSGUPXSA-N 1 1 355.394 2.693 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000483701148 516178822 /nfs/dbraw/zinc/17/88/22/516178822.db2.gz LVYKUQAMVXBMSM-HIFRSBDPSA-N 1 1 364.446 2.618 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCO[C@@]4(CCOC4)C3)o2)c([N+](=O)[O-])c1 ZINC000470326115 516204966 /nfs/dbraw/zinc/20/49/66/516204966.db2.gz WYPRPOVQTAYOOM-IBGZPJMESA-N 1 1 374.393 2.855 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCO[C@@]4(CCOC4)C3)o2)c([N+](=O)[O-])c1 ZINC000470326115 516204969 /nfs/dbraw/zinc/20/49/69/516204969.db2.gz WYPRPOVQTAYOOM-IBGZPJMESA-N 1 1 374.393 2.855 20 5 FFBDMO C[C@H]1C[C@H]1[N@@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747343 516299971 /nfs/dbraw/zinc/29/99/71/516299971.db2.gz FFZJONYWFFOEOW-GMXVVIOVSA-N 1 1 369.263 2.919 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2c(Br)cncc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000488747343 516299975 /nfs/dbraw/zinc/29/99/75/516299975.db2.gz FFZJONYWFFOEOW-GMXVVIOVSA-N 1 1 369.263 2.919 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C ZINC000523280132 516421455 /nfs/dbraw/zinc/42/14/55/516421455.db2.gz HNEUSECOSRNRJT-INIZCTEOSA-N 1 1 365.478 2.569 20 5 FFBDMO NC(=O)c1cccc(NC[C@H]2CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000561232495 516467902 /nfs/dbraw/zinc/46/79/02/516467902.db2.gz VSWUYTFRGNFWMM-OAHLLOKOSA-N 1 1 354.410 2.770 20 5 FFBDMO Cc1nc(N[C@@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599581 516546761 /nfs/dbraw/zinc/54/67/61/516546761.db2.gz WVXZVIZQGXZJDT-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1nc(N[C@@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599581 516546769 /nfs/dbraw/zinc/54/67/69/516546769.db2.gz WVXZVIZQGXZJDT-MAUKXSAKSA-N 1 1 356.426 3.000 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1 ZINC000558027893 516558868 /nfs/dbraw/zinc/55/88/68/516558868.db2.gz XFFMFBWSWPJWAP-YZVOILCLSA-N 1 1 370.453 2.738 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000561437800 516584609 /nfs/dbraw/zinc/58/46/09/516584609.db2.gz ZNSRDCVEAXJZSB-UHFFFAOYSA-N 1 1 371.397 2.795 20 5 FFBDMO COc1ccccc1CNC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554846440 516663374 /nfs/dbraw/zinc/66/33/74/516663374.db2.gz WTNCTJGRCWNUJQ-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000551402166 516693831 /nfs/dbraw/zinc/69/38/31/516693831.db2.gz VUIYWHUSHHPSBC-SFHVURJKSA-N 1 1 355.438 2.962 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](Cc2ccccn2)C2CC2)cc1[N+](=O)[O-] ZINC000558421082 516730820 /nfs/dbraw/zinc/73/08/20/516730820.db2.gz YYTFDHYTGIMTAR-UHFFFAOYSA-N 1 1 371.393 2.706 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](Cc2ccccn2)C2CC2)cc1[N+](=O)[O-] ZINC000558421082 516730830 /nfs/dbraw/zinc/73/08/30/516730830.db2.gz YYTFDHYTGIMTAR-UHFFFAOYSA-N 1 1 371.393 2.706 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000561746952 516744890 /nfs/dbraw/zinc/74/48/90/516744890.db2.gz PKYREHZJSOSVTR-IJEWVQPXSA-N 1 1 361.442 2.796 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)c3c[nH]nc3[N+](=O)[O-])cc2)C1 ZINC000548082297 516751306 /nfs/dbraw/zinc/75/13/06/516751306.db2.gz LUKNROKBVAFCOK-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1 ZINC000555044190 516755488 /nfs/dbraw/zinc/75/54/88/516755488.db2.gz IMXFZCNJGUQRLF-HNNXBMFYSA-N 1 1 361.442 2.797 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561762605 516756054 /nfs/dbraw/zinc/75/60/54/516756054.db2.gz PBHBWZFGSKDJHQ-ZQIUZPCESA-N 1 1 363.483 2.876 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])cn2)cc1)[NH+]1CCOCC1 ZINC000532138051 516820990 /nfs/dbraw/zinc/82/09/90/516820990.db2.gz FPUKWSLNGADTNK-ZDUSSCGKSA-N 1 1 356.382 2.635 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000541035870 516839988 /nfs/dbraw/zinc/83/99/88/516839988.db2.gz GOKPNXKBKJJDBF-WCQYABFASA-N 1 1 371.384 2.999 20 5 FFBDMO Cc1ccc(NCCCN2CCN(c3cc[nH+]cc3)CC2)c([N+](=O)[O-])c1 ZINC000514213268 516905673 /nfs/dbraw/zinc/90/56/73/516905673.db2.gz FKGAIPBFMWPGDE-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO Cc1[nH+]c2cc(Nc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])ccc2n1C ZINC000525191683 516953124 /nfs/dbraw/zinc/95/31/24/516953124.db2.gz YNTXINOALKWPQU-UHFFFAOYSA-N 1 1 360.395 2.937 20 5 FFBDMO COC(=O)c1ccc([C@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046604 517017816 /nfs/dbraw/zinc/01/78/16/517017816.db2.gz WNMAEGFKFSBUJU-RYUDHWBXSA-N 1 1 360.370 2.617 20 5 FFBDMO COC(=O)c1ccc([C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046604 517017829 /nfs/dbraw/zinc/01/78/29/517017829.db2.gz WNMAEGFKFSBUJU-RYUDHWBXSA-N 1 1 360.370 2.617 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000525397447 517029167 /nfs/dbraw/zinc/02/91/67/517029167.db2.gz PFNBQKNMEGYWTK-QWHCGFSZSA-N 1 1 372.425 2.793 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000555684932 517064193 /nfs/dbraw/zinc/06/41/93/517064193.db2.gz SRLRTDBLKLQURZ-INIZCTEOSA-N 1 1 363.801 2.563 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000541525055 517094739 /nfs/dbraw/zinc/09/47/39/517094739.db2.gz WEWAJIPSKXKSAW-UKRRQHHQSA-N 1 1 364.446 2.618 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000555808198 517135068 /nfs/dbraw/zinc/13/50/68/517135068.db2.gz FFZYLVNDIFMHGK-INIZCTEOSA-N 1 1 358.442 2.679 20 5 FFBDMO CC(C)[C@@H](O)C1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552277737 517176380 /nfs/dbraw/zinc/17/63/80/517176380.db2.gz HLBIMTAAHRWJKA-IAGOWNOFSA-N 1 1 358.442 2.804 20 5 FFBDMO CC1(C)C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]2CCC[C@@H]21 ZINC000559424969 517248602 /nfs/dbraw/zinc/24/86/02/517248602.db2.gz FTPIHDLQBCLCLL-AAEUAGOBSA-N 1 1 361.398 2.773 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000541935056 517299642 /nfs/dbraw/zinc/29/96/42/517299642.db2.gz BPAXRBXKUCJQLU-DLBZAZTESA-N 1 1 356.426 2.654 20 5 FFBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])cc3S(C)(=O)=O)ccc2n1C ZINC000526047217 517312437 /nfs/dbraw/zinc/31/24/37/517312437.db2.gz XMRAHSNSIOZGTJ-UHFFFAOYSA-N 1 1 360.395 2.937 20 5 FFBDMO COc1ccc2c(c1)C[C@H](C)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]2C ZINC000541988920 517326547 /nfs/dbraw/zinc/32/65/47/517326547.db2.gz CSZAUZCPFQDNST-KBPBESRZSA-N 1 1 357.410 2.773 20 5 FFBDMO Cn1c(C(=O)NC[C@@H]([NH2+]Cc2ccccc2)c2ccco2)ccc1[N+](=O)[O-] ZINC000552873068 517422628 /nfs/dbraw/zinc/42/26/28/517422628.db2.gz OKZHZELXNLKTBB-OAHLLOKOSA-N 1 1 368.393 2.787 20 5 FFBDMO NC(=O)[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000542234173 517451303 /nfs/dbraw/zinc/45/13/03/517451303.db2.gz OREXCLYJENMLEU-CQSZACIVSA-N 1 1 367.327 2.800 20 5 FFBDMO Cc1c(Br)c(NC[C@H]2CC[N@H+](CC(C)C)C2)ncc1[N+](=O)[O-] ZINC000542505577 517598390 /nfs/dbraw/zinc/59/83/90/517598390.db2.gz ILPVLQZCHDTMRB-GFCCVEGCSA-N 1 1 371.279 2.872 20 5 FFBDMO NC(=O)c1cccc(NCCc2[nH+]ccn2Cc2ccccc2)c1[N+](=O)[O-] ZINC000553246000 517598634 /nfs/dbraw/zinc/59/86/34/517598634.db2.gz GCQUNUVCTFEPND-UHFFFAOYSA-N 1 1 365.393 2.593 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000560178893 517623293 /nfs/dbraw/zinc/62/32/93/517623293.db2.gz AZDJEUSMYIIGRN-UHFFFAOYSA-N 1 1 357.414 2.753 20 5 FFBDMO C[C@@]1(Cc2cccc(F)c2)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000563069199 517632105 /nfs/dbraw/zinc/63/21/05/517632105.db2.gz SDAMWJBTHGWBAT-IBGZPJMESA-N 1 1 359.401 2.993 20 5 FFBDMO CC(C)OC[C@H](CO)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549612162 517638493 /nfs/dbraw/zinc/63/84/93/517638493.db2.gz MKJMSLKNEKSSLJ-ZDUSSCGKSA-N 1 1 350.337 2.831 20 5 FFBDMO CC(C)OC[C@H](CO)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549612162 517638502 /nfs/dbraw/zinc/63/85/02/517638502.db2.gz MKJMSLKNEKSSLJ-ZDUSSCGKSA-N 1 1 350.337 2.831 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000533905643 517663240 /nfs/dbraw/zinc/66/32/40/517663240.db2.gz YUKWGQJHQXWEMS-UHFFFAOYSA-N 1 1 358.442 2.951 20 5 FFBDMO O=C(NC[C@H](c1ccccc1Cl)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1 ZINC000560410705 517780494 /nfs/dbraw/zinc/78/04/94/517780494.db2.gz BTNUCOIVDVHDSI-CQSZACIVSA-N 1 1 363.805 2.538 20 5 FFBDMO CCOc1cccc(N2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000521657253 517816207 /nfs/dbraw/zinc/81/62/07/517816207.db2.gz ZYLYKMDVNKPJLJ-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO C[C@@H]1C[C@@H](N[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000560524575 517872380 /nfs/dbraw/zinc/87/23/80/517872380.db2.gz GWANERQKUTYDLY-DDUZABMNSA-N 1 1 355.442 2.633 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543031784 517874485 /nfs/dbraw/zinc/87/44/85/517874485.db2.gz CJPSCYYTJOKVFQ-LLVKDONJSA-N 1 1 357.252 2.626 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1 ZINC000557198083 517915100 /nfs/dbraw/zinc/91/51/00/517915100.db2.gz ADQAWEUFBOJEEV-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)c1 ZINC000557198083 517915107 /nfs/dbraw/zinc/91/51/07/517915107.db2.gz ADQAWEUFBOJEEV-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)C[C@@H]1C ZINC000550317245 517992528 /nfs/dbraw/zinc/99/25/28/517992528.db2.gz IZYTWFAQMLLBIZ-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C ZINC000550317245 517992533 /nfs/dbraw/zinc/99/25/33/517992533.db2.gz IZYTWFAQMLLBIZ-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000560744587 517999474 /nfs/dbraw/zinc/99/94/74/517999474.db2.gz PBHOZWWDXVQOGI-CYBMUJFWSA-N 1 1 367.421 2.618 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CC[C@@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000517070704 518011419 /nfs/dbraw/zinc/01/14/19/518011419.db2.gz NPPGCILZKPPDPP-CYBMUJFWSA-N 1 1 352.398 2.998 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000534768878 518028204 /nfs/dbraw/zinc/02/82/04/518028204.db2.gz LUYJYNDOGYSKRB-GOSISDBHSA-N 1 1 368.437 2.561 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000539435385 518048550 /nfs/dbraw/zinc/04/85/50/518048550.db2.gz WXNPEWBEZBHRKL-INIZCTEOSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000539435385 518048559 /nfs/dbraw/zinc/04/85/59/518048559.db2.gz WXNPEWBEZBHRKL-INIZCTEOSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000539435385 518048564 /nfs/dbraw/zinc/04/85/64/518048564.db2.gz WXNPEWBEZBHRKL-INIZCTEOSA-N 1 1 371.441 2.753 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000539435385 518048575 /nfs/dbraw/zinc/04/85/75/518048575.db2.gz WXNPEWBEZBHRKL-INIZCTEOSA-N 1 1 371.441 2.753 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000535042395 518134312 /nfs/dbraw/zinc/13/43/12/518134312.db2.gz GJSXODSGSCKGIR-CABCVRRESA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000535042395 518134317 /nfs/dbraw/zinc/13/43/17/518134317.db2.gz GJSXODSGSCKGIR-CABCVRRESA-N 1 1 356.426 2.668 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCN(c3[nH]cc[nH+]3)CC2)c1 ZINC000569706379 518249418 /nfs/dbraw/zinc/24/94/18/518249418.db2.gz NPIBWIAZZBADCB-UHFFFAOYSA-N 1 1 355.320 2.659 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]21 ZINC000581479435 518306272 /nfs/dbraw/zinc/30/62/72/518306272.db2.gz ADLHUQMYTHZCRW-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000584409114 518327675 /nfs/dbraw/zinc/32/76/75/518327675.db2.gz LYJSKNOPMKYMCL-GDBMZVCRSA-N 1 1 350.415 2.873 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3ccccc3[nH]c12)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000581527848 518329511 /nfs/dbraw/zinc/32/95/11/518329511.db2.gz ONFGZPVDYGQBSK-OAHLLOKOSA-N 1 1 361.445 2.990 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000564601401 518521052 /nfs/dbraw/zinc/52/10/52/518521052.db2.gz KZBXUBQZJHRZOA-AWEZNQCLSA-N 1 1 364.446 2.619 20 5 FFBDMO Cc1c(Br)c(=O)n(CC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000576332363 518540500 /nfs/dbraw/zinc/54/05/00/518540500.db2.gz LBWJNCZXRXCHGB-LLVKDONJSA-N 1 1 358.236 2.702 20 5 FFBDMO Cc1cc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000567597262 518605989 /nfs/dbraw/zinc/60/59/89/518605989.db2.gz DNDZEJVDTQFKQH-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000576524549 518634439 /nfs/dbraw/zinc/63/44/39/518634439.db2.gz VULDVDWTSBQIOR-KSSFIOAISA-N 1 1 372.450 2.936 20 5 FFBDMO CC(C)[C@@H]1CN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C2CC2)CC[N@H+]1C ZINC000576591283 518667575 /nfs/dbraw/zinc/66/75/75/518667575.db2.gz IIEPIGDCJODLFH-KRWDZBQOSA-N 1 1 370.457 2.965 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@H+](C(C)(C)C)CC2 ZINC000574033449 518955956 /nfs/dbraw/zinc/95/59/56/518955956.db2.gz DPDRHAHWOPSRCB-UHFFFAOYSA-N 1 1 363.443 2.799 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1cc2ccccc2c2cccnc12 ZINC000583066162 519059471 /nfs/dbraw/zinc/05/94/71/519059471.db2.gz QJIPMBOYDOYRFK-KRWDZBQOSA-N 1 1 363.461 2.965 20 5 FFBDMO Cc1cc(OCC(=O)N2CCC[N@@H+](CC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000580414273 519164834 /nfs/dbraw/zinc/16/48/34/519164834.db2.gz ZNKUUQXCBRLQCG-UHFFFAOYSA-N 1 1 361.442 2.616 20 5 FFBDMO COc1cncc(/C=C\CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000571758727 519261814 /nfs/dbraw/zinc/26/18/14/519261814.db2.gz UJHZLZVTXFAKMK-OUMXJLHTSA-N 1 1 369.425 2.983 20 5 FFBDMO COc1cncc(/C=C/CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000571758725 519261846 /nfs/dbraw/zinc/26/18/46/519261846.db2.gz UJHZLZVTXFAKMK-ICTCPBKTSA-N 1 1 369.425 2.983 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000568905363 519276865 /nfs/dbraw/zinc/27/68/65/519276865.db2.gz DQAXLKFWTZOSEM-UHFFFAOYSA-N 1 1 369.487 2.788 20 5 FFBDMO COc1cc(CN2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c([N+](=O)[O-])cc1OC(F)F ZINC000590600465 519284258 /nfs/dbraw/zinc/28/42/58/519284258.db2.gz XUEDQUUQKGCTQL-QWHCGFSZSA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000580656754 519288651 /nfs/dbraw/zinc/28/86/51/519288651.db2.gz FFVOGGAYXMPJKW-RDJZCZTQSA-N 1 1 357.410 2.527 20 5 FFBDMO C[C@H]1CSCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000571854742 519308959 /nfs/dbraw/zinc/30/89/59/519308959.db2.gz HPNMAMRKNWNPGF-GFCCVEGCSA-N 1 1 351.428 2.578 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)Nc1ccc(F)cc1 ZINC000580944721 519441066 /nfs/dbraw/zinc/44/10/66/519441066.db2.gz DYHBBZRXPWTYQN-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)Nc1ccc(F)cc1 ZINC000580944721 519441070 /nfs/dbraw/zinc/44/10/70/519441070.db2.gz DYHBBZRXPWTYQN-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N(C)CCC[N@@H+](C)Cc2ccco2)c1 ZINC000572107514 519446854 /nfs/dbraw/zinc/44/68/54/519446854.db2.gz WWDGPGPPFDFWON-UHFFFAOYSA-N 1 1 361.398 2.933 20 5 FFBDMO Cc1cccc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)c1[N+](=O)[O-] ZINC000569392199 519526620 /nfs/dbraw/zinc/52/66/20/519526620.db2.gz YJKCKOAZQJSEFB-INIZCTEOSA-N 1 1 355.394 2.722 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(-n2cncn2)c(F)c1 ZINC000581159330 519549467 /nfs/dbraw/zinc/54/94/67/519549467.db2.gz XDDJNOJDDVBRPI-UHFFFAOYSA-N 1 1 355.373 2.989 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@@H](C(C)(C)C)C1 ZINC000602873540 519940421 /nfs/dbraw/zinc/94/04/21/519940421.db2.gz KSEOBZREIDZUQL-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)[C@@H](C(C)(C)C)C1 ZINC000602873540 519940424 /nfs/dbraw/zinc/94/04/24/519940424.db2.gz KSEOBZREIDZUQL-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)[C@@H](C(C)(C)C)C1 ZINC000602873540 519940433 /nfs/dbraw/zinc/94/04/33/519940433.db2.gz KSEOBZREIDZUQL-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000594417294 519953896 /nfs/dbraw/zinc/95/38/96/519953896.db2.gz BKYCBSTXESAQEC-SJORKVTESA-N 1 1 370.409 2.595 20 5 FFBDMO CCn1nc(C)c(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000602926004 519976888 /nfs/dbraw/zinc/97/68/88/519976888.db2.gz MUWTWTAHIZOZPJ-UHFFFAOYSA-N 1 1 359.430 2.889 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000602997442 520012602 /nfs/dbraw/zinc/01/26/02/520012602.db2.gz JXRUGUZBSPVZQT-NJAFHUGGSA-N 1 1 361.442 2.857 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[NH+](CCCF)CC1 ZINC000600071544 520030995 /nfs/dbraw/zinc/03/09/95/520030995.db2.gz DNKUJWDSKFTGOL-GFCCVEGCSA-N 1 1 373.812 2.519 20 5 FFBDMO C[N@H+]1C[C@@H](CNc2ncnc3cccc([N+](=O)[O-])c32)[C@H](c2ccccc2)C1 ZINC000591985086 520121237 /nfs/dbraw/zinc/12/12/37/520121237.db2.gz CPDGOFBFWJMATC-CVEARBPZSA-N 1 1 363.421 2.717 20 5 FFBDMO CCn1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616786262 520138539 /nfs/dbraw/zinc/13/85/39/520138539.db2.gz RAKHLFQNZUCIRP-CYBMUJFWSA-N 1 1 360.414 2.884 20 5 FFBDMO CCn1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC000616786262 520138544 /nfs/dbraw/zinc/13/85/44/520138544.db2.gz RAKHLFQNZUCIRP-CYBMUJFWSA-N 1 1 360.414 2.884 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000600297356 520187398 /nfs/dbraw/zinc/18/73/98/520187398.db2.gz BHNYARXZEWYMOY-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000600297356 520187405 /nfs/dbraw/zinc/18/74/05/520187405.db2.gz BHNYARXZEWYMOY-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000600299150 520189878 /nfs/dbraw/zinc/18/98/78/520189878.db2.gz OZFIRBPUJVDWFI-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000600299150 520189883 /nfs/dbraw/zinc/18/98/83/520189883.db2.gz OZFIRBPUJVDWFI-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000600312983 520198471 /nfs/dbraw/zinc/19/84/71/520198471.db2.gz WLWOOBSJYFPCDH-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO Cn1cncc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132258 520206675 /nfs/dbraw/zinc/20/66/75/520206675.db2.gz FNFUKSFWSJQSAK-SAABIXHNSA-N 1 1 358.442 2.677 20 5 FFBDMO Cc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c(C)c1 ZINC000592138834 520214547 /nfs/dbraw/zinc/21/45/47/520214547.db2.gz KBNCLBOACKUHDY-LJQANCHMSA-N 1 1 360.458 2.927 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)NCc2ccccc2)C1 ZINC000592156306 520231677 /nfs/dbraw/zinc/23/16/77/520231677.db2.gz XSAUBBWPYPKFRI-KRWDZBQOSA-N 1 1 369.421 2.742 20 5 FFBDMO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CS1(=O)=O ZINC000594974465 520236153 /nfs/dbraw/zinc/23/61/53/520236153.db2.gz LUCANFQBCTYFKQ-QWHCGFSZSA-N 1 1 364.423 2.910 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000609233551 520241152 /nfs/dbraw/zinc/24/11/52/520241152.db2.gz GJBNUVJJLIMQHN-UYAOXDASSA-N 1 1 372.421 2.798 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCc2c1cnn2CCO ZINC000595019011 520258438 /nfs/dbraw/zinc/25/84/38/520258438.db2.gz VLSDPHLJNQUJQV-WBMJQRKESA-N 1 1 360.414 2.520 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000595050612 520270767 /nfs/dbraw/zinc/27/07/67/520270767.db2.gz SREDMIIONOYHMM-SJORKVTESA-N 1 1 357.458 2.880 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1C ZINC000609353277 520293318 /nfs/dbraw/zinc/29/33/18/520293318.db2.gz VORHURLLYAAZBK-OKILXGFUSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609450195 520317243 /nfs/dbraw/zinc/31/72/43/520317243.db2.gz IQXQSKJDRAMXMV-LLVKDONJSA-N 1 1 374.363 2.578 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609450195 520317249 /nfs/dbraw/zinc/31/72/49/520317249.db2.gz IQXQSKJDRAMXMV-LLVKDONJSA-N 1 1 374.363 2.578 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOc2ccccc2C1 ZINC000603909282 520399980 /nfs/dbraw/zinc/39/99/80/520399980.db2.gz QRPUERYNYZJVSQ-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)n2)c1 ZINC000592492563 520416200 /nfs/dbraw/zinc/41/62/00/520416200.db2.gz AOLFLJXJFGSSBK-CVEARBPZSA-N 1 1 371.441 2.856 20 5 FFBDMO CC1(C)C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C(C)(C)CO1 ZINC000609767291 520425798 /nfs/dbraw/zinc/42/57/98/520425798.db2.gz UBISJXIFAWHZNN-UHFFFAOYSA-N 1 1 363.414 2.782 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000604085576 520446287 /nfs/dbraw/zinc/44/62/87/520446287.db2.gz GXXUMGZVKDCCKK-UHFFFAOYSA-N 1 1 364.405 2.864 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2cccc(-c3cnc(C)c([N+](=O)[O-])c3)c2)CC1 ZINC000600794606 520473339 /nfs/dbraw/zinc/47/33/39/520473339.db2.gz RIKDFUYVWJDWBD-UHFFFAOYSA-N 1 1 354.410 2.629 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000598195941 520486289 /nfs/dbraw/zinc/48/62/89/520486289.db2.gz XEVBWXDBENKFHI-LJQANCHMSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000595503713 520514828 /nfs/dbraw/zinc/51/48/28/520514828.db2.gz ARJDEGDUERIVNO-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000604445586 520565240 /nfs/dbraw/zinc/56/52/40/520565240.db2.gz KOBKAFGMPVOGFV-GUTXKFCHSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445586 520565248 /nfs/dbraw/zinc/56/52/48/520565248.db2.gz KOBKAFGMPVOGFV-GUTXKFCHSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445586 520565254 /nfs/dbraw/zinc/56/52/54/520565254.db2.gz KOBKAFGMPVOGFV-GUTXKFCHSA-N 1 1 371.441 2.949 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000598343159 520566579 /nfs/dbraw/zinc/56/65/79/520566579.db2.gz TWJLOFARBBCURJ-LLVKDONJSA-N 1 1 370.247 2.880 20 5 FFBDMO C[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000600994442 520580183 /nfs/dbraw/zinc/58/01/83/520580183.db2.gz AHLBNGNFSRZSTR-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000600994442 520580177 /nfs/dbraw/zinc/58/01/77/520580177.db2.gz AHLBNGNFSRZSTR-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000595596569 520581519 /nfs/dbraw/zinc/58/15/19/520581519.db2.gz OTRSVYLOMUCONR-MRXNPFEDSA-N 1 1 360.410 2.518 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000601007139 520592222 /nfs/dbraw/zinc/59/22/22/520592222.db2.gz QZQKMJCHAUZQEG-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC2(CCC2)OC[C@H]1C ZINC000595680526 520644265 /nfs/dbraw/zinc/64/42/65/520644265.db2.gz IKMHYSNSIIXDQH-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@]3(C1)OCc1ccccc13)OCCO2 ZINC000613743045 520648049 /nfs/dbraw/zinc/64/80/49/520648049.db2.gz RUBJIJKPVXOBSB-FQEVSTJZSA-N 1 1 368.389 2.997 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@]3(C1)OCc1ccccc13)OCCO2 ZINC000613743045 520648055 /nfs/dbraw/zinc/64/80/55/520648055.db2.gz RUBJIJKPVXOBSB-FQEVSTJZSA-N 1 1 368.389 2.997 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1NCc1ccccc1C[N@@H+]1CCC[C@H]1CO ZINC000601140440 520655603 /nfs/dbraw/zinc/65/56/03/520655603.db2.gz ZAHXCTZGBFEOMT-INIZCTEOSA-N 1 1 360.389 2.698 20 5 FFBDMO COc1ccc(COCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000610391527 520663899 /nfs/dbraw/zinc/66/38/99/520663899.db2.gz OZUUDIKUVBKMQG-MRXNPFEDSA-N 1 1 372.425 2.701 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000595706310 520664416 /nfs/dbraw/zinc/66/44/16/520664416.db2.gz YNJZJDVHZJIIQU-AWEZNQCLSA-N 1 1 373.457 2.791 20 5 FFBDMO CNc1c(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511935 520672690 /nfs/dbraw/zinc/67/26/90/520672690.db2.gz VCJKIROMJQEUEC-HNNXBMFYSA-N 1 1 354.410 2.641 20 5 FFBDMO CNc1c(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511935 520672700 /nfs/dbraw/zinc/67/27/00/520672700.db2.gz VCJKIROMJQEUEC-HNNXBMFYSA-N 1 1 354.410 2.641 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000592996773 520675070 /nfs/dbraw/zinc/67/50/70/520675070.db2.gz AZZDQTYRZSKHOX-UHFFFAOYSA-N 1 1 357.385 2.621 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601183971 520677687 /nfs/dbraw/zinc/67/76/87/520677687.db2.gz IOTNCSYCLRXHOO-HNNXBMFYSA-N 1 1 368.315 2.648 20 5 FFBDMO O=C(C[NH2+][C@H](Cn1cccn1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610432835 520681728 /nfs/dbraw/zinc/68/17/28/520681728.db2.gz BTZKTFYGIGSJDV-QGZVFWFLSA-N 1 1 365.393 2.761 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCO)[C@H]2CCc3ccccc32)c1 ZINC000593015900 520686157 /nfs/dbraw/zinc/68/61/57/520686157.db2.gz BSIGVJKRHZQLDE-IBGZPJMESA-N 1 1 370.405 2.863 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c1 ZINC000593015900 520686162 /nfs/dbraw/zinc/68/61/62/520686162.db2.gz BSIGVJKRHZQLDE-IBGZPJMESA-N 1 1 370.405 2.863 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@@H](CCF)C1 ZINC000595757126 520701979 /nfs/dbraw/zinc/70/19/79/520701979.db2.gz ZPDMVDYFBLCEJE-ZDUSSCGKSA-N 1 1 351.378 2.964 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595756243 520702413 /nfs/dbraw/zinc/70/24/13/520702413.db2.gz FRMFUYJNALOUCD-SJCJKPOMSA-N 1 1 372.368 2.716 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](OC(C)C)C1 ZINC000593054903 520711449 /nfs/dbraw/zinc/71/14/49/520711449.db2.gz HQYIOLWWGWBHCH-HNNXBMFYSA-N 1 1 365.430 2.821 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[NH+](Cc4ccc(O)cc4)CC3)c21 ZINC000601257609 520711640 /nfs/dbraw/zinc/71/16/40/520711640.db2.gz PPZVGWQHCRCEPU-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c1 ZINC000595786560 520723618 /nfs/dbraw/zinc/72/36/18/520723618.db2.gz BIVMLKJVFLPJEQ-SZVBFZGTSA-N 1 1 364.442 2.616 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC3(CC3(F)F)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000593072557 520725212 /nfs/dbraw/zinc/72/52/12/520725212.db2.gz ICXVFJASCRLUFX-AWEZNQCLSA-N 1 1 351.353 2.821 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC000593089825 520736875 /nfs/dbraw/zinc/73/68/75/520736875.db2.gz FNPKDMTXTORGOH-WBVHZDCISA-N 1 1 356.422 2.996 20 5 FFBDMO Cc1cc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)ccn1 ZINC000598604665 520737200 /nfs/dbraw/zinc/73/72/00/520737200.db2.gz PBIFYRNWTFQUCT-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c(C)c1[N+](=O)[O-] ZINC000598614141 520743912 /nfs/dbraw/zinc/74/39/12/520743912.db2.gz JJHPMTKDTRHMQR-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593128360 520767700 /nfs/dbraw/zinc/76/77/00/520767700.db2.gz GWHKKUNERRLRSK-RDTXWAMCSA-N 1 1 371.412 2.913 20 5 FFBDMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000595857512 520772673 /nfs/dbraw/zinc/77/26/73/520772673.db2.gz YGTLDKSPORRPKM-KLPPZKSPSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000595857512 520772678 /nfs/dbraw/zinc/77/26/78/520772678.db2.gz YGTLDKSPORRPKM-KLPPZKSPSA-N 1 1 357.204 2.741 20 5 FFBDMO CCC[N@H+](C)CC(C)(C)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000595871981 520781444 /nfs/dbraw/zinc/78/14/44/520781444.db2.gz APZZNLSIYPNRMU-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000595871981 520781451 /nfs/dbraw/zinc/78/14/51/520781451.db2.gz APZZNLSIYPNRMU-UHFFFAOYSA-N 1 1 350.463 2.942 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CC2=CCSC2)c([N+](=O)[O-])c1 ZINC000595888469 520795278 /nfs/dbraw/zinc/79/52/78/520795278.db2.gz MSRMOPMUEASFAR-UHFFFAOYSA-N 1 1 351.428 2.537 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000596168166 520948586 /nfs/dbraw/zinc/94/85/86/520948586.db2.gz LVELVCSLTTZFKY-RYUDHWBXSA-N 1 1 367.833 2.955 20 5 FFBDMO CC(C)N1CC[NH+](C2CCN(c3c(Cl)cncc3[N+](=O)[O-])CC2)CC1 ZINC000596180631 520956235 /nfs/dbraw/zinc/95/62/35/520956235.db2.gz WFLZULGVRJLYKO-UHFFFAOYSA-N 1 1 367.881 2.638 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088122 520978057 /nfs/dbraw/zinc/97/80/57/520978057.db2.gz DHTZKLOWXVMMDT-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088122 520978062 /nfs/dbraw/zinc/97/80/62/520978062.db2.gz DHTZKLOWXVMMDT-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000596307339 521019141 /nfs/dbraw/zinc/01/91/41/521019141.db2.gz KSMYNZJPLSYSEM-LBPRGKRZSA-N 1 1 355.460 2.531 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)c(F)c1 ZINC000593496999 521033132 /nfs/dbraw/zinc/03/31/32/521033132.db2.gz ZFLWGULRBAOVRR-ZWKOTPCHSA-N 1 1 372.400 2.609 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599125521 521042933 /nfs/dbraw/zinc/04/29/33/521042933.db2.gz HIFQPJTWKUNSTI-SNVBAGLBSA-N 1 1 368.231 2.571 20 5 FFBDMO CCOc1cc(N(C)[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)ccc1[N+](=O)[O-] ZINC000611297289 521085952 /nfs/dbraw/zinc/08/59/52/521085952.db2.gz COTMBPVAEHNJOH-QGZVFWFLSA-N 1 1 362.474 2.598 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000596477865 521091585 /nfs/dbraw/zinc/09/15/85/521091585.db2.gz LCVHDQRFZKLGDI-CYBMUJFWSA-N 1 1 362.430 2.985 20 5 FFBDMO C[C@@H](C[NH+]1CCC(C)CC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000596488143 521096473 /nfs/dbraw/zinc/09/64/73/521096473.db2.gz MOHCBLBVMMITCN-ZDUSSCGKSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNC(=O)c1c(Br)cccc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000599303528 521138378 /nfs/dbraw/zinc/13/83/78/521138378.db2.gz RBJHTYMXXGFDRP-VIFPVBQESA-N 1 1 356.220 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@H]2CCC[N@@H+]2CCCO)C(F)(F)F)cc1 ZINC000593713125 521169695 /nfs/dbraw/zinc/16/96/95/521169695.db2.gz UXAFWIIPHFVWOZ-CABCVRRESA-N 1 1 361.364 2.635 20 5 FFBDMO Cc1cnccc1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000599370483 521179676 /nfs/dbraw/zinc/17/96/76/521179676.db2.gz IRNGBDSAIQOHTC-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000611555622 521217134 /nfs/dbraw/zinc/21/71/34/521217134.db2.gz KHQGRHJKSNKFOF-INIZCTEOSA-N 1 1 369.421 2.942 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000611555622 521217142 /nfs/dbraw/zinc/21/71/42/521217142.db2.gz KHQGRHJKSNKFOF-INIZCTEOSA-N 1 1 369.421 2.942 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599437758 521224129 /nfs/dbraw/zinc/22/41/29/521224129.db2.gz LXFDJWFJGDSTSG-LLVKDONJSA-N 1 1 370.247 2.962 20 5 FFBDMO CN(C(=O)c1c(Br)cccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000599442117 521225369 /nfs/dbraw/zinc/22/53/69/521225369.db2.gz QGCODQGTWMDPIP-NSHDSACASA-N 1 1 368.231 2.666 20 5 FFBDMO Cc1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)c(N2CCCC2)[nH+]1 ZINC000611582794 521236579 /nfs/dbraw/zinc/23/65/79/521236579.db2.gz ITOLOGITWKZGPW-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO CN(CC[NH+]1CCCCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000593883445 521270976 /nfs/dbraw/zinc/27/09/76/521270976.db2.gz OBBGJWZLNZMFON-UHFFFAOYSA-N 1 1 357.414 2.543 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553699 521295050 /nfs/dbraw/zinc/29/50/50/521295050.db2.gz YXQSJJWVXPMCRV-BNOWGMLFSA-N 1 1 365.455 2.900 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553699 521295057 /nfs/dbraw/zinc/29/50/57/521295057.db2.gz YXQSJJWVXPMCRV-BNOWGMLFSA-N 1 1 365.455 2.900 20 5 FFBDMO O=C1NCCN1C1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602430661 521341047 /nfs/dbraw/zinc/34/10/47/521341047.db2.gz LJPKZWNGMBLAOI-UHFFFAOYSA-N 1 1 372.347 2.603 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2c(O)cccc2C1 ZINC000599645852 521357188 /nfs/dbraw/zinc/35/71/88/521357188.db2.gz GOGJBHFGQZRTOO-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO COC(=O)[C@](C)(NC[C@@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000599651143 521362137 /nfs/dbraw/zinc/36/21/37/521362137.db2.gz HGTMWXDGPBRPEN-PKOBYXMFSA-N 1 1 363.458 2.836 20 5 FFBDMO Cn1cc(CN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c([N+](=O)[O-])n1 ZINC000602473066 521365932 /nfs/dbraw/zinc/36/59/32/521365932.db2.gz IMGUYQHWTYVNBS-HXUWFJFHSA-N 1 1 369.469 2.816 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c([N+](=O)[O-])n1 ZINC000602481696 521371130 /nfs/dbraw/zinc/37/11/30/521371130.db2.gz CTQRBOLFCYRHCI-PKOBYXMFSA-N 1 1 369.469 2.815 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000599671022 521386454 /nfs/dbraw/zinc/38/64/54/521386454.db2.gz VYIFYFRTVJNRTM-SFHVURJKSA-N 1 1 356.378 2.746 20 5 FFBDMO O=[N+]([O-])c1sc(CN[C@@H]2CC[N@H+](CC3CC3)C2)cc1Br ZINC000602564007 521413438 /nfs/dbraw/zinc/41/34/38/521413438.db2.gz KHOUFYXPLHOFMK-SNVBAGLBSA-N 1 1 360.277 2.993 20 5 FFBDMO O=[N+]([O-])c1sc(CN[C@@H]2CC[N@@H+](CC3CC3)C2)cc1Br ZINC000602564007 521413442 /nfs/dbraw/zinc/41/34/42/521413442.db2.gz KHOUFYXPLHOFMK-SNVBAGLBSA-N 1 1 360.277 2.993 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CC(N4CCCCC4)C3)CC2)cn1 ZINC000602637927 521451187 /nfs/dbraw/zinc/45/11/87/521451187.db2.gz KGINTXIYJUDARF-UHFFFAOYSA-N 1 1 359.474 2.565 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000594197195 521462456 /nfs/dbraw/zinc/46/24/56/521462456.db2.gz AXHSBNSJFXCAKB-DLBZAZTESA-N 1 1 372.469 2.942 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594204717 521470116 /nfs/dbraw/zinc/47/01/16/521470116.db2.gz XOKHXFBGRJYQLV-SJLPKXTDSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1(=O)=O ZINC000602711049 521490114 /nfs/dbraw/zinc/49/01/14/521490114.db2.gz WPSHGVKBAIOTDH-CABZTGNLSA-N 1 1 366.361 2.669 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000602783311 521528821 /nfs/dbraw/zinc/52/88/21/521528821.db2.gz OJYWCKPVCVCCKK-OIRASMEMSA-N 1 1 350.444 2.530 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1cn(C)nc1[N+](=O)[O-] ZINC000602813414 521548080 /nfs/dbraw/zinc/54/80/80/521548080.db2.gz XKDCFXFFRSKBMC-HWWDLCQESA-N 1 1 357.458 2.575 20 5 FFBDMO COCCC1C[NH+](Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000597183570 521562393 /nfs/dbraw/zinc/56/23/93/521562393.db2.gz LLNOTQSQQZASNU-UHFFFAOYSA-N 1 1 360.357 2.716 20 5 FFBDMO COCC[N@@H+]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000543437023 673647375 /nfs/dbraw/zinc/64/73/75/673647375.db2.gz DLXDPQQPDUPMOG-LLVKDONJSA-N 1 1 373.251 2.583 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000543437023 673647377 /nfs/dbraw/zinc/64/73/77/673647377.db2.gz DLXDPQQPDUPMOG-LLVKDONJSA-N 1 1 373.251 2.583 20 5 FFBDMO Cc1nc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164631590 719108593 /nfs/dbraw/zinc/10/85/93/719108593.db2.gz YRCOQKILAOWBTJ-AEFFLSMTSA-N 1 1 353.426 2.794 20 5 FFBDMO CC(C)[C@H](CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000043331364 727969228 /nfs/dbraw/zinc/96/92/28/727969228.db2.gz OIDPKXYCSXRLEA-HNNXBMFYSA-N 1 1 370.837 2.727 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000746535442 735491867 /nfs/dbraw/zinc/49/18/67/735491867.db2.gz ZNMSWOAIUWDJOS-INIZCTEOSA-N 1 1 362.499 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000746671950 735503711 /nfs/dbraw/zinc/50/37/11/735503711.db2.gz CQITUZMFUPZIBT-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000165132423 728971272 /nfs/dbraw/zinc/97/12/72/728971272.db2.gz MNHANZKUTFDEEP-GFCCVEGCSA-N 1 1 364.427 2.630 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000165132423 728971274 /nfs/dbraw/zinc/97/12/74/728971274.db2.gz MNHANZKUTFDEEP-GFCCVEGCSA-N 1 1 364.427 2.630 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000174858457 729081591 /nfs/dbraw/zinc/08/15/91/729081591.db2.gz HOSGBHKBGAJQRZ-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000174858457 729081594 /nfs/dbraw/zinc/08/15/94/729081594.db2.gz HOSGBHKBGAJQRZ-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO C[C@@H]1CN(c2cccc(Br)c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000856744103 730353316 /nfs/dbraw/zinc/35/33/16/730353316.db2.gz GUVJLAHDAZJVHY-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000857635688 730403448 /nfs/dbraw/zinc/40/34/48/730403448.db2.gz ZLXIIKCSBPRLBW-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860053968 730474478 /nfs/dbraw/zinc/47/44/78/730474478.db2.gz DZKKFVZFFATLTI-ZJUUUORDSA-N 1 1 350.400 2.738 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000925138528 738481127 /nfs/dbraw/zinc/48/11/27/738481127.db2.gz HINXVWRCUKEHSD-DZGCQCFKSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000925167373 738484646 /nfs/dbraw/zinc/48/46/46/738484646.db2.gz BVYCFPQPSSROPY-WQVCFCJDSA-N 1 1 364.471 2.535 20 5 FFBDMO C[NH+]1CCN(CC2CN(c3c(Cl)c(Cl)ccc3[N+](=O)[O-])C2)CC1 ZINC000865916484 731010822 /nfs/dbraw/zinc/01/08/22/731010822.db2.gz NDBZHABTKJTMMR-UHFFFAOYSA-N 1 1 359.257 2.585 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CCC1(C)C ZINC000871155494 731601061 /nfs/dbraw/zinc/60/10/61/731601061.db2.gz SHIKJAWKTUXSBN-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CCC1(C)C ZINC000871156309 731601299 /nfs/dbraw/zinc/60/12/99/731601299.db2.gz WBBVXDNCZHXEIW-UHFFFAOYSA-N 1 1 357.357 2.753 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)CCN1CCN(C)CC1 ZINC000872063839 731725493 /nfs/dbraw/zinc/72/54/93/731725493.db2.gz UEEQQZBHFAFHBF-CABCVRRESA-N 1 1 366.531 2.993 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2ncc(Br)s2)c1 ZINC000872240511 731744489 /nfs/dbraw/zinc/74/44/89/731744489.db2.gz ROYQZKVUYLLDAM-SNVBAGLBSA-N 1 1 358.217 2.637 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000878837335 732603020 /nfs/dbraw/zinc/60/30/20/732603020.db2.gz WOQSWADQCZSOOY-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000878943488 732619431 /nfs/dbraw/zinc/61/94/31/732619431.db2.gz GTMAWIDEYVWBED-HUUCEWRRSA-N 1 1 361.364 2.587 20 5 FFBDMO C[C@@]12COC[C@H]1C[N@@H+](Cc1nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o1)C2 ZINC000878949131 732620538 /nfs/dbraw/zinc/62/05/38/732620538.db2.gz IXLUSQSQGCQURP-QLJPJBMISA-N 1 1 364.789 2.767 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000880435219 732907505 /nfs/dbraw/zinc/90/75/05/732907505.db2.gz KGUYBUYTQIPRKJ-TZMCWYRMSA-N 1 1 359.220 2.593 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1 ZINC000882146620 733179173 /nfs/dbraw/zinc/17/91/73/733179173.db2.gz ANLUMJSLKONFFG-UHFFFAOYSA-N 1 1 354.426 2.704 20 5 FFBDMO O=[N+]([O-])c1c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)cccc1C(F)(F)F ZINC000884560364 733539506 /nfs/dbraw/zinc/53/95/06/733539506.db2.gz VSLWREXYEZSOBF-GFCCVEGCSA-N 1 1 359.348 2.649 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1Cl ZINC000885889163 733726525 /nfs/dbraw/zinc/72/65/25/733726525.db2.gz YFJVOXCYXOIXPX-ZDUSSCGKSA-N 1 1 367.833 2.540 20 5 FFBDMO CN(C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000885989206 733739116 /nfs/dbraw/zinc/73/91/16/733739116.db2.gz YKXGBWZKBRIMEU-CYBMUJFWSA-N 1 1 350.419 2.679 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1)C(=O)OC(C)(C)C ZINC000885989206 733739119 /nfs/dbraw/zinc/73/91/19/733739119.db2.gz YKXGBWZKBRIMEU-CYBMUJFWSA-N 1 1 350.419 2.679 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269584 733768039 /nfs/dbraw/zinc/76/80/39/733768039.db2.gz ZMPFJTBNDAPFKV-JSGCOSHPSA-N 1 1 350.419 2.867 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886269584 733768041 /nfs/dbraw/zinc/76/80/41/733768041.db2.gz ZMPFJTBNDAPFKV-JSGCOSHPSA-N 1 1 350.419 2.867 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827066 733845066 /nfs/dbraw/zinc/84/50/66/733845066.db2.gz CROXUMUWUQGQMB-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827066 733845068 /nfs/dbraw/zinc/84/50/68/733845068.db2.gz CROXUMUWUQGQMB-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO CC(C)(C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000928095253 738821455 /nfs/dbraw/zinc/82/14/55/738821455.db2.gz NRZXRWZAGSHEPF-CVEARBPZSA-N 1 1 363.483 2.568 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1[N+](=O)[O-] ZINC000894699874 734902684 /nfs/dbraw/zinc/90/26/84/734902684.db2.gz LQEGBWJLNCSPAL-RBSFLKMASA-N 1 1 350.415 2.825 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c1[N+](=O)[O-] ZINC000894866944 734929629 /nfs/dbraw/zinc/92/96/29/734929629.db2.gz GANKQWWLSKUQQF-LSDHHAIUSA-N 1 1 350.415 2.682 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1Cn1cc(C[NH+]2CCCC2)nn1 ZINC000900641195 735673476 /nfs/dbraw/zinc/67/34/76/735673476.db2.gz NXMJUZFXNKQBSQ-UHFFFAOYSA-N 1 1 366.219 2.593 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[N@H+]1C1CC1 ZINC000756952439 736376071 /nfs/dbraw/zinc/37/60/71/736376071.db2.gz SUAXAALEMUZGQS-ZYHUDNBSSA-N 1 1 352.822 2.673 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000906617309 736525068 /nfs/dbraw/zinc/52/50/68/736525068.db2.gz PROWZXZDMQNYHU-AWEZNQCLSA-N 1 1 351.834 2.781 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000907793136 736668174 /nfs/dbraw/zinc/66/81/74/736668174.db2.gz JSJZNTLAPYNPAF-HZPDHXFCSA-N 1 1 369.824 2.826 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854693 736674925 /nfs/dbraw/zinc/67/49/25/736674925.db2.gz PKDXTIZKEFBNNP-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854693 736674927 /nfs/dbraw/zinc/67/49/27/736674927.db2.gz PKDXTIZKEFBNNP-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1CCC[N@H+]1C1CCCC1 ZINC000911476063 737203479 /nfs/dbraw/zinc/20/34/79/737203479.db2.gz MDVDEHIPTMNRDZ-HNNXBMFYSA-N 1 1 353.369 2.896 20 5 FFBDMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000913533406 737416965 /nfs/dbraw/zinc/41/69/65/737416965.db2.gz PVDFAJQALIMMBK-OCAPTIKFSA-N 1 1 362.188 2.959 20 5 FFBDMO 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ZINC000929486012 738991705 /nfs/dbraw/zinc/99/17/05/738991705.db2.gz SSEULNKVAZEPGD-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000787598552 739149916 /nfs/dbraw/zinc/14/99/16/739149916.db2.gz OGHOVVVLMHIABZ-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000930882471 739177350 /nfs/dbraw/zinc/17/73/50/739177350.db2.gz LIWPNZKIHOQQQN-HUUCEWRRSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H](C)O1 ZINC000788565891 739259642 /nfs/dbraw/zinc/25/96/42/739259642.db2.gz OJSSLKNYDOUFJT-TXEJJXNPSA-N 1 1 350.444 2.750 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H](C)O1 ZINC000788565891 739259646 /nfs/dbraw/zinc/25/96/46/739259646.db2.gz OJSSLKNYDOUFJT-TXEJJXNPSA-N 1 1 350.444 2.750 20 5 FFBDMO C[C@@H]1CCSCC[N@@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000790479303 739460032 /nfs/dbraw/zinc/46/00/32/739460032.db2.gz 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O=C(C[N@H+]1CCC[C@]2(CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000832343991 745680571 /nfs/dbraw/zinc/68/05/71/745680571.db2.gz QEOQTDVRBXFKLN-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839392879 746821234 /nfs/dbraw/zinc/82/12/34/746821234.db2.gz RQGACCBKJPLJBN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839392879 746821238 /nfs/dbraw/zinc/82/12/38/746821238.db2.gz RQGACCBKJPLJBN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000839502880 746842117 /nfs/dbraw/zinc/84/21/17/746842117.db2.gz IEDPIEAYSRRDAM-JSGCOSHPSA-N 1 1 368.865 2.991 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000839640391 746878974 /nfs/dbraw/zinc/87/89/74/746878974.db2.gz KWAIYXYYHZBVAR-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO CCC[N@@H+](C)CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F ZINC000839864103 746946250 /nfs/dbraw/zinc/94/62/50/746946250.db2.gz NLEDZLRIGWQMMX-ZDUSSCGKSA-N 1 1 351.300 2.795 20 5 FFBDMO CSC[C@H]1CCC[N@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078467 746993848 /nfs/dbraw/zinc/99/38/48/746993848.db2.gz UYJQAILBSDJWDJ-SUMWQHHRSA-N 1 1 365.455 2.565 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000840078467 746993852 /nfs/dbraw/zinc/99/38/52/746993852.db2.gz UYJQAILBSDJWDJ-SUMWQHHRSA-N 1 1 365.455 2.565 20 5 FFBDMO COc1cc(Cc2noc([C@@H]([NH3+])CC(C)C)n2)c([N+](=O)[O-])c(OC)c1 ZINC000843226034 747794520 /nfs/dbraw/zinc/79/45/20/747794520.db2.gz RZEFCWVXTYWLHO-LBPRGKRZSA-N 1 1 350.375 2.632 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]2(CC2(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000844440838 748031095 /nfs/dbraw/zinc/03/10/95/748031095.db2.gz UQCBWCZHJDUAKY-INIZCTEOSA-N 1 1 351.353 2.605 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CC2(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000844440838 748031101 /nfs/dbraw/zinc/03/11/01/748031101.db2.gz UQCBWCZHJDUAKY-INIZCTEOSA-N 1 1 351.353 2.605 20 5 FFBDMO C[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847181704 748637662 /nfs/dbraw/zinc/63/76/62/748637662.db2.gz SBHJPNMPBGVENG-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847181704 748637668 /nfs/dbraw/zinc/63/76/68/748637668.db2.gz SBHJPNMPBGVENG-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC000824414157 946697179 /nfs/dbraw/zinc/69/71/79/946697179.db2.gz VSSWUCYRHBDOIY-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000896755314 971692689 /nfs/dbraw/zinc/69/26/89/971692689.db2.gz KGMPQEZFBMSPON-CYBMUJFWSA-N 1 1 356.426 2.744 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759892810 971912037 /nfs/dbraw/zinc/91/20/37/971912037.db2.gz BWJJSJYFNGBAQS-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000759892810 971912044 /nfs/dbraw/zinc/91/20/44/971912044.db2.gz BWJJSJYFNGBAQS-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCn3cccn3)CC2)c(C(F)(F)F)c1 ZINC000066854686 971978486 /nfs/dbraw/zinc/97/84/86/971978486.db2.gz WIYQMSKTPQQFCE-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001116021082 1032067898 /nfs/dbraw/zinc/06/78/98/1032067898.db2.gz DVHQUJRJOCXELA-GJZGRUSLSA-N 1 1 372.425 2.833 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174965863 1013355760 /nfs/dbraw/zinc/35/57/60/1013355760.db2.gz UYJCULJDGQMKIJ-NSHDSACASA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174965863 1013355771 /nfs/dbraw/zinc/35/57/71/1013355771.db2.gz UYJCULJDGQMKIJ-NSHDSACASA-N 1 1 362.361 2.623 20 5 FFBDMO CN(C(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000135194307 963823038 /nfs/dbraw/zinc/82/30/38/963823038.db2.gz FFLZTWXYFUHBGU-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc([N+](=O)[O-])cc1 ZINC000873261707 1013450804 /nfs/dbraw/zinc/45/08/04/1013450804.db2.gz QTKUEGNXJSHTNW-DNMXQMFDSA-N 1 1 355.442 2.538 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001022064174 964196249 /nfs/dbraw/zinc/19/62/49/964196249.db2.gz ZIMKSCAKHFJDAE-LORHWOILSA-N 1 1 353.422 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000051233728 964422405 /nfs/dbraw/zinc/42/24/05/964422405.db2.gz PTIRWOQUZMFWQJ-UHFFFAOYSA-N 1 1 372.381 2.704 20 5 FFBDMO C[N@@H+](CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC000255771315 968859055 /nfs/dbraw/zinc/85/90/55/968859055.db2.gz KDPZBZKNKBURSI-WDZFZDKYSA-N 1 1 357.385 2.995 20 5 FFBDMO Cn1c2ccccc2c(N2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1=O ZINC000892621069 969622808 /nfs/dbraw/zinc/62/28/08/969622808.db2.gz DMIWOGQVNRDBMI-UHFFFAOYSA-N 1 1 370.453 2.901 20 5 FFBDMO Cc1cc(N2CCC[C@H](OC(=O)c3ccccc3[N+](=O)[O-])C2)nc(C)[nH+]1 ZINC000066730871 970100201 /nfs/dbraw/zinc/10/02/01/970100201.db2.gz ANKIFNZLCAMAGV-AWEZNQCLSA-N 1 1 356.382 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3nc(F)c(F)cc3F)CC2)cc1 ZINC000759967563 976436023 /nfs/dbraw/zinc/43/60/23/976436023.db2.gz CAKPJBFKRIPICQ-UHFFFAOYSA-N 1 1 366.343 2.772 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001152052737 1032091191 /nfs/dbraw/zinc/09/11/91/1032091191.db2.gz IGGQYOHXPDHWHK-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001152052737 1032091209 /nfs/dbraw/zinc/09/12/09/1032091209.db2.gz IGGQYOHXPDHWHK-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO CC[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000261701527 977677626 /nfs/dbraw/zinc/67/76/26/977677626.db2.gz TYXKAJKRJFJRRE-QGZVFWFLSA-N 1 1 357.458 2.959 20 5 FFBDMO C[C@H](CC[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)N(C)Cc1ccccc1 ZINC000877079673 1014471093 /nfs/dbraw/zinc/47/10/93/1014471093.db2.gz ITHJLSISUDDYOG-FAEJEUNOSA-N 1 1 357.458 2.995 20 5 FFBDMO COc1cc(CN2CC[C@H](C[NH3+])[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000904411381 980270261 /nfs/dbraw/zinc/27/02/61/980270261.db2.gz UXAMTQGVUXTRKZ-VXGBXAGGSA-N 1 1 373.400 2.664 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000073306158 984081933 /nfs/dbraw/zinc/08/19/33/984081933.db2.gz PUFKKRPIKXCYES-LFYBBSHMSA-N 1 1 368.393 2.747 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@H](c3ccc(O)cc3)C2)c1C ZINC000913478043 984277017 /nfs/dbraw/zinc/27/70/17/984277017.db2.gz BHTYVRLHZYECRX-INIZCTEOSA-N 1 1 355.394 2.704 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)c1F ZINC000764584630 984580684 /nfs/dbraw/zinc/58/06/84/984580684.db2.gz DQBKNIDYYBNCCG-UHFFFAOYSA-N 1 1 374.372 2.795 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761294535 985132750 /nfs/dbraw/zinc/13/27/50/985132750.db2.gz XHRHCXHTHDJAMR-MRXNPFEDSA-N 1 1 357.458 2.874 20 5 FFBDMO Cc1nn(CN2CC[C@@H](C3CC[NH+](C)CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761294535 985132754 /nfs/dbraw/zinc/13/27/54/985132754.db2.gz XHRHCXHTHDJAMR-MRXNPFEDSA-N 1 1 357.458 2.874 20 5 FFBDMO CC[N@@H+](CCCNS(=O)(=O)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001212400400 986103320 /nfs/dbraw/zinc/10/33/20/986103320.db2.gz VGHCAFNOTMJPKO-UHFFFAOYSA-N 1 1 369.487 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)COc1cccc3[nH]ccc31)CC2 ZINC000152244078 987096456 /nfs/dbraw/zinc/09/64/56/987096456.db2.gz CCRYLSHSNDDWOC-QGZVFWFLSA-N 1 1 367.405 2.874 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)COc1cccc3[nH]ccc31)CC2 ZINC000152244078 987096473 /nfs/dbraw/zinc/09/64/73/987096473.db2.gz CCRYLSHSNDDWOC-QGZVFWFLSA-N 1 1 367.405 2.874 20 5 FFBDMO C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@@H+]1CCc2ccccc2C1 ZINC000130265038 987543813 /nfs/dbraw/zinc/54/38/13/987543813.db2.gz HKDGGEPKQMALPD-HNNXBMFYSA-N 1 1 365.433 2.926 20 5 FFBDMO C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCc2ccccc2C1 ZINC000130265038 987543818 /nfs/dbraw/zinc/54/38/18/987543818.db2.gz HKDGGEPKQMALPD-HNNXBMFYSA-N 1 1 365.433 2.926 20 5 FFBDMO Nc1ccc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000010135996 987785214 /nfs/dbraw/zinc/78/52/14/987785214.db2.gz GXMDUEOUFIGSTD-MRXNPFEDSA-N 1 1 358.398 2.727 20 5 FFBDMO C[C@H]1CC2(CCC2)C[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000762147244 988154725 /nfs/dbraw/zinc/15/47/25/988154725.db2.gz XXBMDPXQKYFKLW-UGSOOPFHSA-N 1 1 372.425 2.584 20 5 FFBDMO COc1cccc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000193846230 989090627 /nfs/dbraw/zinc/09/06/27/989090627.db2.gz VGOKDHPDOKDUMX-CQSZACIVSA-N 1 1 359.382 2.763 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000702628440 990010621 /nfs/dbraw/zinc/01/06/21/990010621.db2.gz LSRAFPLWVSKGCM-SFHVURJKSA-N 1 1 372.381 2.552 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN2CCC[N@@H+](C[C@H]3CCCO3)CC2)cc1 ZINC000918021446 990318646 /nfs/dbraw/zinc/31/86/46/990318646.db2.gz ILVNYUHHVFBZMW-LJQANCHMSA-N 1 1 363.458 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCN(C[C@H]3CCCO3)CC2)cc1 ZINC000918021446 990318651 /nfs/dbraw/zinc/31/86/51/990318651.db2.gz ILVNYUHHVFBZMW-LJQANCHMSA-N 1 1 363.458 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCN(C[C@H]3CCCO3)CC2)cc1 ZINC000918021446 990318654 /nfs/dbraw/zinc/31/86/54/990318654.db2.gz ILVNYUHHVFBZMW-LJQANCHMSA-N 1 1 363.458 2.550 20 5 FFBDMO CCC(CC)[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000918179377 990351545 /nfs/dbraw/zinc/35/15/45/990351545.db2.gz OWFAQEKREZDJSV-LJQANCHMSA-N 1 1 374.441 2.972 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)cc1C ZINC001035186966 990410068 /nfs/dbraw/zinc/41/00/68/990410068.db2.gz NWTNXQOQTAXZFR-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1C ZINC001035186966 990410072 /nfs/dbraw/zinc/41/00/72/990410072.db2.gz NWTNXQOQTAXZFR-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1C ZINC001035186966 990410074 /nfs/dbraw/zinc/41/00/74/990410074.db2.gz NWTNXQOQTAXZFR-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@@H](Cn4ccnn4)C3)c2c1 ZINC000154921121 990591160 /nfs/dbraw/zinc/59/11/60/990591160.db2.gz KBHKLHQQERVALJ-GFCCVEGCSA-N 1 1 374.426 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@@H](Cn4ccnn4)C3)c2c1 ZINC000154921121 990591164 /nfs/dbraw/zinc/59/11/64/990591164.db2.gz KBHKLHQQERVALJ-GFCCVEGCSA-N 1 1 374.426 2.833 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879575102 1015591931 /nfs/dbraw/zinc/59/19/31/1015591931.db2.gz GONKOHABASDEKG-INWMFGNUSA-N 1 1 357.414 2.732 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000179544216 991290308 /nfs/dbraw/zinc/29/03/08/991290308.db2.gz DNNBAJMAGGWAEH-ZDUSSCGKSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000179544216 991290314 /nfs/dbraw/zinc/29/03/14/991290314.db2.gz DNNBAJMAGGWAEH-ZDUSSCGKSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000070828024 992315405 /nfs/dbraw/zinc/31/54/05/992315405.db2.gz FTLYGIIUQVPTRJ-UHFFFAOYSA-N 1 1 364.402 2.806 20 5 FFBDMO C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1c1cc[nH+]cc1 ZINC000880258791 1015791776 /nfs/dbraw/zinc/79/17/76/1015791776.db2.gz CJZBVHCDOICJKG-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H](C3CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000880576017 1015877248 /nfs/dbraw/zinc/87/72/48/1015877248.db2.gz NOQFEIROKYOSLA-MRXNPFEDSA-N 1 1 361.442 2.722 20 5 FFBDMO COc1ccc(C[N@@H+]2CCCC[C@H]2COC(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000810037880 994684048 /nfs/dbraw/zinc/68/40/48/994684048.db2.gz GRCIHUUOMPOHPY-HNNXBMFYSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1ccc(C[N@H+]2CCCC[C@H]2COC(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000810037880 994684057 /nfs/dbraw/zinc/68/40/57/994684057.db2.gz GRCIHUUOMPOHPY-HNNXBMFYSA-N 1 1 363.414 2.847 20 5 FFBDMO Cc1cc(NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810323989 994755713 /nfs/dbraw/zinc/75/57/13/994755713.db2.gz ALHMXRGKFIXOLN-KBPBESRZSA-N 1 1 357.414 2.758 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810618787 994841510 /nfs/dbraw/zinc/84/15/10/994841510.db2.gz UNJZQTBLZMDVAC-LBPRGKRZSA-N 1 1 355.354 2.531 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000811600309 995192161 /nfs/dbraw/zinc/19/21/61/995192161.db2.gz HQXLTBWOPDYMSF-LLVKDONJSA-N 1 1 366.418 2.970 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)n2)c1 ZINC000747823589 995552427 /nfs/dbraw/zinc/55/24/27/995552427.db2.gz HEYTZARVOLHIPZ-JKSUJKDBSA-N 1 1 357.414 2.559 20 5 FFBDMO CCn1nc(C)cc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172306 995633102 /nfs/dbraw/zinc/63/31/02/995633102.db2.gz DVZHVMIXAJQTNG-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO CCn1nc(C)cc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172306 995633107 /nfs/dbraw/zinc/63/31/07/995633107.db2.gz DVZHVMIXAJQTNG-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2cc[nH]c2n1 ZINC000813171395 995633626 /nfs/dbraw/zinc/63/36/26/995633626.db2.gz JZHYPYCRFWQVTD-INIZCTEOSA-N 1 1 366.377 2.902 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc2cc[nH]c2n1 ZINC000813171395 995633630 /nfs/dbraw/zinc/63/36/30/995633630.db2.gz JZHYPYCRFWQVTD-INIZCTEOSA-N 1 1 366.377 2.902 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000845735487 998642019 /nfs/dbraw/zinc/64/20/19/998642019.db2.gz NFDVLYCYIMPAQG-OAHLLOKOSA-N 1 1 358.398 2.810 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1c1nc2ccccn2c1[N+](=O)[O-] ZINC000733191043 998917206 /nfs/dbraw/zinc/91/72/06/998917206.db2.gz NGBZDNQGLXZGRK-OAHLLOKOSA-N 1 1 351.410 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@H](n4ccnc4)C3)c2)cc1 ZINC000738159233 999622179 /nfs/dbraw/zinc/62/21/79/999622179.db2.gz REGVOSDXTUMUKO-SFHVURJKSA-N 1 1 352.398 2.949 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H](n4ccnc4)C3)c2)cc1 ZINC000738159233 999622182 /nfs/dbraw/zinc/62/21/82/999622182.db2.gz REGVOSDXTUMUKO-SFHVURJKSA-N 1 1 352.398 2.949 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H](C)[NH+]1CCCCCC1 ZINC000741030450 999701177 /nfs/dbraw/zinc/70/11/77/999701177.db2.gz VZRACIWUZGHFFN-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC000741014932 999702684 /nfs/dbraw/zinc/70/26/84/999702684.db2.gz SGIFIKMKPPVJNT-QGZVFWFLSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741017211 999702856 /nfs/dbraw/zinc/70/28/56/999702856.db2.gz MGEWFMGAZZJMTE-UPJWGTAASA-N 1 1 374.397 2.949 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741019621 999703041 /nfs/dbraw/zinc/70/30/41/999703041.db2.gz WMVZOZORCFJOHP-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741019621 999703043 /nfs/dbraw/zinc/70/30/43/999703043.db2.gz WMVZOZORCFJOHP-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000744390552 999854087 /nfs/dbraw/zinc/85/40/87/999854087.db2.gz LZAKDNSZDJIYDM-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCN(c3c(Cl)cncc3Cl)CC2)C1 ZINC001169036693 1000016546 /nfs/dbraw/zinc/01/65/46/1000016546.db2.gz PPOHJXSFWSFZHA-VXGBXAGGSA-N 1 1 359.257 2.956 20 5 FFBDMO O=C1OC[C@@H]2[C@H]([N@H+](Cc3ccccc3)[C@H]3CC[C@H](C[N+](=O)[O-])C3)CCCN12 ZINC001169038578 1000016899 /nfs/dbraw/zinc/01/68/99/1000016899.db2.gz ZTBKLFBDOODUJR-INDMIFKZSA-N 1 1 373.453 2.917 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](Oc3cc(C(F)(F)F)ncn3)C2)C1 ZINC001169053587 1000019064 /nfs/dbraw/zinc/01/90/64/1000019064.db2.gz JCZJIHQAQVXYIL-JHJVBQTASA-N 1 1 374.363 2.784 20 5 FFBDMO Cc1nn(C[NH+]2CCC(c3cccnc3)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000768469246 1000264592 /nfs/dbraw/zinc/26/45/92/1000264592.db2.gz RVHLVNKQFAWJJY-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000769662106 1000572287 /nfs/dbraw/zinc/57/22/87/1000572287.db2.gz KGHZCFKENFNKSL-OAHLLOKOSA-N 1 1 360.458 2.798 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1nc2ccccn2c1[N+](=O)[O-] ZINC000770471255 1000799722 /nfs/dbraw/zinc/79/97/22/1000799722.db2.gz QLDLNKQDMPAEJD-UHFFFAOYSA-N 1 1 354.370 2.526 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001147633024 1000933427 /nfs/dbraw/zinc/93/34/27/1000933427.db2.gz PRUIAHJELUXPKK-UHFFFAOYSA-N 1 1 350.806 2.892 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1 ZINC000787577717 1001699791 /nfs/dbraw/zinc/69/97/91/1001699791.db2.gz CZZRYHRGXZMLIP-TWGQIWQCSA-N 1 1 361.442 2.567 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1OC ZINC000788113768 1001763684 /nfs/dbraw/zinc/76/36/84/1001763684.db2.gz BWRPFHAQPZZLTL-OLZOCXBDSA-N 1 1 364.398 2.786 20 5 FFBDMO O=C1N(C[NH+]2CCC3(CCOCC3)CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000789531834 1002109482 /nfs/dbraw/zinc/10/94/82/1002109482.db2.gz VYLDDGLIAFOLSZ-UHFFFAOYSA-N 1 1 374.441 2.687 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CO[NH+]=C(N)CCNC(=O)OC(C)(C)C ZINC000789651423 1002148179 /nfs/dbraw/zinc/14/81/79/1002148179.db2.gz HBSGGIAZLWDKAI-UHFFFAOYSA-N 1 1 368.390 2.517 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000774579345 1002181394 /nfs/dbraw/zinc/18/13/94/1002181394.db2.gz YBUAGDAACWRFOP-UHFFFAOYSA-N 1 1 364.402 2.663 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000791058120 1002563587 /nfs/dbraw/zinc/56/35/87/1002563587.db2.gz ARQYOVLDJWLOLX-OAHLLOKOSA-N 1 1 364.402 2.662 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345851 1003131466 /nfs/dbraw/zinc/13/14/66/1003131466.db2.gz MZYFFZWUTCYGAL-ACJLOTCBSA-N 1 1 350.415 2.810 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])[C@H]2C1 ZINC001186571356 1003348538 /nfs/dbraw/zinc/34/85/38/1003348538.db2.gz IGQQDROIGDIOFU-APWZRJJASA-N 1 1 351.406 2.966 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nnc(N)o2)C1 ZINC001196526349 1003808259 /nfs/dbraw/zinc/80/82/59/1003808259.db2.gz OTLZSZXOGCRGIG-GFCCVEGCSA-N 1 1 361.402 2.727 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1C ZINC001191896784 1003993252 /nfs/dbraw/zinc/99/32/52/1003993252.db2.gz SPBXFBYRGGMJNH-HZPDHXFCSA-N 1 1 367.471 2.507 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1noc(C)n1 ZINC001192000526 1004016765 /nfs/dbraw/zinc/01/67/65/1004016765.db2.gz VEGRFSXSGNTNJQ-UHFFFAOYSA-N 1 1 363.377 2.635 20 5 FFBDMO CC(C)(C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCC1 ZINC000805614185 1004071603 /nfs/dbraw/zinc/07/16/03/1004071603.db2.gz CMYOIEQRPKPQLZ-UHFFFAOYSA-N 1 1 360.370 2.562 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000747423194 1004684556 /nfs/dbraw/zinc/68/45/56/1004684556.db2.gz QHEJWFYYTCIDMW-GCTDCNCDSA-N 1 1 373.453 2.708 20 5 FFBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275134 1005342229 /nfs/dbraw/zinc/34/22/29/1005342229.db2.gz JJYJYYWHIXVVDU-IFXJQAMLSA-N 1 1 367.409 2.902 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCN(C[C@H]2CCCO2)CC1 ZINC000850434494 1005815468 /nfs/dbraw/zinc/81/54/68/1005815468.db2.gz UKQYXDDELKCIGT-RHSMWYFYSA-N 1 1 363.458 2.897 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2C[N@H+](Cc3ccccc3C)CCO2)c1[N+](=O)[O-] ZINC001187361495 1006036836 /nfs/dbraw/zinc/03/68/36/1006036836.db2.gz LMCDFYJUEBJUMU-MRXNPFEDSA-N 1 1 373.457 2.512 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2C[N@@H+](Cc3ccccc3C)CCO2)c1[N+](=O)[O-] ZINC001187361495 1006036850 /nfs/dbraw/zinc/03/68/50/1006036850.db2.gz LMCDFYJUEBJUMU-MRXNPFEDSA-N 1 1 373.457 2.512 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)nc1-c1ccccn1 ZINC000853517493 1006423491 /nfs/dbraw/zinc/42/34/91/1006423491.db2.gz VEVMZJRHZJRNFH-YXJHDRRASA-N 1 1 371.441 2.826 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000853796515 1006538628 /nfs/dbraw/zinc/53/86/28/1006538628.db2.gz WQXJEYSLKDMRAS-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO Cc1nn(C)c(Nc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)c1[N+](=O)[O-] ZINC000882944281 1006571078 /nfs/dbraw/zinc/57/10/78/1006571078.db2.gz AUFATLHOEOTUHU-MRXNPFEDSA-N 1 1 356.430 2.665 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2ccnc(N3CCCC3)c2)c1[N+](=O)[O-] ZINC001206134824 1032154400 /nfs/dbraw/zinc/15/44/00/1032154400.db2.gz CFCVDQZKLNDLJS-UHFFFAOYSA-N 1 1 358.398 2.594 20 5 FFBDMO C/C(=C/C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000854571025 1006896942 /nfs/dbraw/zinc/89/69/42/1006896942.db2.gz SYAKQUHEVBLLGH-UGEDRFTOSA-N 1 1 373.453 2.710 20 5 FFBDMO C[C@@H]1[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000816468350 1007050556 /nfs/dbraw/zinc/05/05/56/1007050556.db2.gz FWSZBMFVKUVYBS-CRAIPNDOSA-N 1 1 372.425 2.778 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000855160981 1007141740 /nfs/dbraw/zinc/14/17/40/1007141740.db2.gz IEUGSOFFHXAYIE-LBPRGKRZSA-N 1 1 366.437 2.650 20 5 FFBDMO CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000855360378 1007301467 /nfs/dbraw/zinc/30/14/67/1007301467.db2.gz KKRZKYCNOQJPRI-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO CCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000855490283 1007366899 /nfs/dbraw/zinc/36/68/99/1007366899.db2.gz GAODDUFMUVFVID-GFCCVEGCSA-N 1 1 357.813 2.873 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCC[N@H+]2C)CC1 ZINC000817492645 1007619965 /nfs/dbraw/zinc/61/99/65/1007619965.db2.gz ZOPZPGZXIZWWGC-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ncccc3[N+](=O)[O-])C2)ccn1 ZINC000856535234 1007876023 /nfs/dbraw/zinc/87/60/23/1007876023.db2.gz SFNHNXYSPMAIKH-KRWDZBQOSA-N 1 1 371.441 2.883 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856542499 1007878021 /nfs/dbraw/zinc/87/80/21/1007878021.db2.gz ARALNNTXHALCLY-VNQPRFMTSA-N 1 1 354.410 2.506 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856542499 1007878032 /nfs/dbraw/zinc/87/80/32/1007878032.db2.gz ARALNNTXHALCLY-VNQPRFMTSA-N 1 1 354.410 2.506 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000819015666 1008023400 /nfs/dbraw/zinc/02/34/00/1008023400.db2.gz MZCXRZIISUKCMA-NQIIRXRSSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1 ZINC000819015666 1008023411 /nfs/dbraw/zinc/02/34/11/1008023411.db2.gz MZCXRZIISUKCMA-NQIIRXRSSA-N 1 1 369.465 2.782 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)[C@@H]2C1 ZINC000819717787 1008218438 /nfs/dbraw/zinc/21/84/38/1008218438.db2.gz LWLZEZJRPHBIFZ-HNAYVOBHSA-N 1 1 372.469 2.751 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H]3C[N@H+]4CCC[C@@H]4CO3)o2)c1 ZINC001177749464 1008731455 /nfs/dbraw/zinc/73/14/55/1008731455.db2.gz VWRCNUQKZFQYOQ-SJLPKXTDSA-N 1 1 357.410 2.808 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000859955036 1008742605 /nfs/dbraw/zinc/74/26/05/1008742605.db2.gz RQOMFMINLJHDBN-RRFJBIMHSA-N 1 1 363.370 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000859955036 1008742613 /nfs/dbraw/zinc/74/26/13/1008742613.db2.gz RQOMFMINLJHDBN-RRFJBIMHSA-N 1 1 363.370 2.667 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 ZINC001136690233 1008973768 /nfs/dbraw/zinc/97/37/68/1008973768.db2.gz GGDHVVXCUMFNFV-UHFFFAOYSA-N 1 1 374.397 2.506 20 5 FFBDMO CCCc1nc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cs1 ZINC001178458543 1008995768 /nfs/dbraw/zinc/99/57/68/1008995768.db2.gz KWFVEBPEGWTGJF-HUUCEWRRSA-N 1 1 368.503 2.527 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)(C)C1 ZINC001178709396 1009100047 /nfs/dbraw/zinc/10/00/47/1009100047.db2.gz NNHVVJQDVMBOHB-IBGZPJMESA-N 1 1 363.461 2.611 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126446529 1009229828 /nfs/dbraw/zinc/22/98/28/1009229828.db2.gz LKTWDQGBDIXHFH-LPHOPBHVSA-N 1 1 372.469 2.796 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@H](C)O1 ZINC000861396645 1009390195 /nfs/dbraw/zinc/39/01/95/1009390195.db2.gz GESVAKMSJQOPOV-GASCZTMLSA-N 1 1 371.437 2.929 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)c2cc([N+](=O)[O-])cc3ccccc32)C[C@H](C)O1 ZINC000861396645 1009390207 /nfs/dbraw/zinc/39/02/07/1009390207.db2.gz GESVAKMSJQOPOV-GASCZTMLSA-N 1 1 371.437 2.929 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000889623031 1010032934 /nfs/dbraw/zinc/03/29/34/1010032934.db2.gz RPFFDCBIXOTFLZ-RHSMWYFYSA-N 1 1 368.437 2.887 20 5 FFBDMO CC(C)CC[C@@H]([NH3+])c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000863675780 1010284648 /nfs/dbraw/zinc/28/46/48/1010284648.db2.gz YRILWCNDLSBBHA-GFCCVEGCSA-N 1 1 357.374 2.662 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N(C)CCCn1cc[nH+]c1C ZINC000120212375 1010571547 /nfs/dbraw/zinc/57/15/47/1010571547.db2.gz IMKLWSZGJONBQM-UHFFFAOYSA-N 1 1 364.377 2.942 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1 ZINC000865564384 1010817783 /nfs/dbraw/zinc/81/77/83/1010817783.db2.gz BWHLDUMUFOIIMV-MRXNPFEDSA-N 1 1 359.401 2.937 20 5 FFBDMO Cc1cc(N2CCC([NH+]3CCN(C)CC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000866213502 1010952808 /nfs/dbraw/zinc/95/28/08/1010952808.db2.gz WSIXTRQNSRXCDC-UHFFFAOYSA-N 1 1 369.469 2.668 20 5 FFBDMO CCC(=O)c1ccc(N(C)CC[NH+]2CC3(C2)CCOCC3)c([N+](=O)[O-])c1 ZINC000866258224 1010964053 /nfs/dbraw/zinc/96/40/53/1010964053.db2.gz SATGCFRPIIRVCK-UHFFFAOYSA-N 1 1 361.442 2.736 20 5 FFBDMO CC(C)(C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccccc1[N+](=O)[O-] ZINC000870090784 1012122685 /nfs/dbraw/zinc/12/26/85/1012122685.db2.gz SGORJEOVPMCLJU-QGZVFWFLSA-N 1 1 369.421 2.751 20 5 FFBDMO CN(C)C(=O)N[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172911747 1012125903 /nfs/dbraw/zinc/12/59/03/1012125903.db2.gz FQLZBYRIVNNLNU-IAGOWNOFSA-N 1 1 360.458 2.578 20 5 FFBDMO CN1CCC[C@H](C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173011154 1012181449 /nfs/dbraw/zinc/18/14/49/1012181449.db2.gz RNNFSJQURIHOGC-CYBMUJFWSA-N 1 1 368.428 2.773 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3C[C@H]4CC[C@@H](C3)O4)CC2)c(F)c1 ZINC001173010618 1012182402 /nfs/dbraw/zinc/18/24/02/1012182402.db2.gz WAHZRWGDEZIGMZ-OKILXGFUSA-N 1 1 353.369 2.705 20 5 FFBDMO CC[C@@H]1COCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015447 1012186620 /nfs/dbraw/zinc/18/66/20/1012186620.db2.gz QPBDWYCMPCSICQ-GFCCVEGCSA-N 1 1 355.385 2.953 20 5 FFBDMO C[C@@H]1C[C@@H](O)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018630 1012190183 /nfs/dbraw/zinc/19/01/83/1012190183.db2.gz XRZREGGGRIXDPZ-RISCZKNCSA-N 1 1 355.385 2.687 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[NH2+]2)cc1 ZINC000870144414 1012194377 /nfs/dbraw/zinc/19/43/77/1012194377.db2.gz CSCMGMJIKBYOGA-KRWDZBQOSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2ncc(F)cn2)c1F ZINC001173183801 1012327482 /nfs/dbraw/zinc/32/74/82/1012327482.db2.gz NQAMQGGIGODBPF-VHSXEESVSA-N 1 1 352.341 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H]2CC[N@H+](CC(C)C)C2)c1F ZINC001173182280 1012327609 /nfs/dbraw/zinc/32/76/09/1012327609.db2.gz REWRUEKEJDIZAL-KGLIPLIRSA-N 1 1 353.438 2.993 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N[C@H]2CC[N@@H+](CC(C)C)C2)c1F ZINC001173182280 1012327630 /nfs/dbraw/zinc/32/76/30/1012327630.db2.gz REWRUEKEJDIZAL-KGLIPLIRSA-N 1 1 353.438 2.993 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)C2CCN(C(C)=O)CC2)c1F ZINC001173188105 1012329301 /nfs/dbraw/zinc/32/93/01/1012329301.db2.gz CMUOAYXHGDKBLT-GFCCVEGCSA-N 1 1 367.421 2.616 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2c1cnn2C ZINC001173220718 1012351505 /nfs/dbraw/zinc/35/15/05/1012351505.db2.gz BUVZUAGKQMYRQU-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCC([NH3+])(Cc2ccccn2)CC1 ZINC001173224080 1012356907 /nfs/dbraw/zinc/35/69/07/1012356907.db2.gz LLEOWPIEDMYYBC-MRXNPFEDSA-N 1 1 354.454 2.957 20 5 FFBDMO CCn1ncc2c1[C@H](COC)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173227229 1012362533 /nfs/dbraw/zinc/36/25/33/1012362533.db2.gz UELNFKBLEMRCFA-PBHICJAKSA-N 1 1 358.442 2.988 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)CC[C@@H]21 ZINC000827364123 1017772291 /nfs/dbraw/zinc/77/22/91/1017772291.db2.gz FSVDXLMXTDJSLZ-QAPCUYQASA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928436245 1018977812 /nfs/dbraw/zinc/97/78/12/1018977812.db2.gz BDTMIPRRJYZQNH-KDOFPFPSSA-N 1 1 369.421 2.996 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000827925955 1019010645 /nfs/dbraw/zinc/01/06/45/1019010645.db2.gz FJLXYUXPPAXMNC-INIZCTEOSA-N 1 1 373.434 2.809 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801602277 1019161621 /nfs/dbraw/zinc/16/16/21/1019161621.db2.gz ZJDATQHHWZTALK-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801602277 1019161628 /nfs/dbraw/zinc/16/16/28/1019161628.db2.gz ZJDATQHHWZTALK-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO C[C@]1(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000406048463 1032845845 /nfs/dbraw/zinc/84/58/45/1032845845.db2.gz XCACOWCCZUQMNO-IBGZPJMESA-N 1 1 354.410 2.571 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CCC[C@@H](C(F)(F)F)O3)C2)nc1 ZINC000929989943 1019797184 /nfs/dbraw/zinc/79/71/84/1019797184.db2.gz TYSHQFMLJZIBCS-BNOWGMLFSA-N 1 1 374.363 2.976 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)CC[C@H](O)c1ccccc1)C2 ZINC000930100426 1019869388 /nfs/dbraw/zinc/86/93/88/1019869388.db2.gz VQBYGNWNYISNTJ-PXNSSMCTSA-N 1 1 356.422 2.828 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)CC[C@@H](O)c1ccccc1)C2 ZINC000930100425 1019870080 /nfs/dbraw/zinc/87/00/80/1019870080.db2.gz VQBYGNWNYISNTJ-FXAWDEMLSA-N 1 1 356.422 2.828 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)CC[C@H](O)c1ccccc1 ZINC000930442224 1020034763 /nfs/dbraw/zinc/03/47/63/1020034763.db2.gz WHWBIOZAOLPYIX-QUCCMNQESA-N 1 1 358.438 2.944 20 5 FFBDMO COc1ccc(NC(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000930769526 1020169924 /nfs/dbraw/zinc/16/99/24/1020169924.db2.gz PQCSRFNHFIBMBR-AWEZNQCLSA-N 1 1 362.430 2.799 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000902537727 1020265276 /nfs/dbraw/zinc/26/52/76/1020265276.db2.gz DJEXXCWCXNVUQC-RBUKOAKNSA-N 1 1 374.485 2.530 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000902537721 1020265490 /nfs/dbraw/zinc/26/54/90/1020265490.db2.gz DJEXXCWCXNVUQC-MOPGFXCFSA-N 1 1 374.485 2.530 20 5 FFBDMO Cc1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2 ZINC001048525503 1020276422 /nfs/dbraw/zinc/27/64/22/1020276422.db2.gz XOLRFPSREANIJD-RSRPTUBKSA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1ccccc1C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525503 1020276425 /nfs/dbraw/zinc/27/64/25/1020276425.db2.gz XOLRFPSREANIJD-RSRPTUBKSA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1ccccc1C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2 ZINC001048525503 1020276435 /nfs/dbraw/zinc/27/64/35/1020276435.db2.gz XOLRFPSREANIJD-RSRPTUBKSA-N 1 1 357.454 2.519 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1 ZINC000931796558 1020590152 /nfs/dbraw/zinc/59/01/52/1020590152.db2.gz OGJOOOAFSOUKSC-QUCCMNQESA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCc3nc[nH]c3[C@@H]2c2ccccc2)cc1 ZINC000931796558 1020590160 /nfs/dbraw/zinc/59/01/60/1020590160.db2.gz OGJOOOAFSOUKSC-QUCCMNQESA-N 1 1 364.405 2.999 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]CC2(N3CCCC3)CCOCC2)cc([N+](=O)[O-])c1 ZINC000903090844 1020672517 /nfs/dbraw/zinc/67/25/17/1020672517.db2.gz IDGMDDPKSDBHCK-OAHLLOKOSA-N 1 1 363.458 2.899 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)cccc1[N+](=O)[O-] ZINC000932134628 1020714370 /nfs/dbraw/zinc/71/43/70/1020714370.db2.gz LYNUISPEWWTMMH-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO O=C(CC[N@@H+]1CCn2nc(C3CC3)cc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000932603301 1020845670 /nfs/dbraw/zinc/84/56/70/1020845670.db2.gz SCSMBGLFURIZMK-UHFFFAOYSA-N 1 1 373.388 2.652 20 5 FFBDMO O=C(CC[N@H+]1CCn2nc(C3CC3)cc2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000932603301 1020845673 /nfs/dbraw/zinc/84/56/73/1020845673.db2.gz SCSMBGLFURIZMK-UHFFFAOYSA-N 1 1 373.388 2.652 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Cc2nccs2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934337010 1021201500 /nfs/dbraw/zinc/20/15/00/1021201500.db2.gz VJOWTMJKRFYYDL-CYBMUJFWSA-N 1 1 372.450 2.505 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Cc2nccs2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934337010 1021201506 /nfs/dbraw/zinc/20/15/06/1021201506.db2.gz VJOWTMJKRFYYDL-CYBMUJFWSA-N 1 1 372.450 2.505 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2ccccc2N2CCCC2)CC1 ZINC001117830545 1021926149 /nfs/dbraw/zinc/92/61/49/1021926149.db2.gz DUSLXOVOLJFGCZ-UHFFFAOYSA-N 1 1 367.453 2.912 20 5 FFBDMO COCCC[N@@H+](C)CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001118528760 1022274335 /nfs/dbraw/zinc/27/43/35/1022274335.db2.gz DVPJQTPLFDRVSV-UHFFFAOYSA-N 1 1 353.810 2.572 20 5 FFBDMO C[N@H+](CCN1C(=O)c2ccccc2C1=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000158940455 1022594615 /nfs/dbraw/zinc/59/46/15/1022594615.db2.gz QVFJBHDLXKEIOS-UHFFFAOYSA-N 1 1 373.796 2.976 20 5 FFBDMO C[N@@H+](CCN1C(=O)c2ccccc2C1=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000158940455 1022594622 /nfs/dbraw/zinc/59/46/22/1022594622.db2.gz QVFJBHDLXKEIOS-UHFFFAOYSA-N 1 1 373.796 2.976 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1C1CC1 ZINC001039583229 1022766341 /nfs/dbraw/zinc/76/63/41/1022766341.db2.gz ICEPFCBWCIIAOT-PIKOESSRSA-N 1 1 369.465 2.795 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1C1CC1 ZINC001039583229 1022766353 /nfs/dbraw/zinc/76/63/53/1022766353.db2.gz ICEPFCBWCIIAOT-PIKOESSRSA-N 1 1 369.465 2.795 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccccc1C1CC1 ZINC001039583229 1022766359 /nfs/dbraw/zinc/76/63/59/1022766359.db2.gz ICEPFCBWCIIAOT-PIKOESSRSA-N 1 1 369.465 2.795 20 5 FFBDMO C[NH+](C)CCCC1CCN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000160025260 1022876069 /nfs/dbraw/zinc/87/60/69/1022876069.db2.gz YQLXUKFKQCRTKK-UHFFFAOYSA-N 1 1 372.473 2.865 20 5 FFBDMO C[C@@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001218296358 1033090722 /nfs/dbraw/zinc/09/07/22/1033090722.db2.gz JWZKBOJINZSXOB-KUHUBIRLSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001218296358 1033090738 /nfs/dbraw/zinc/09/07/38/1033090738.db2.gz JWZKBOJINZSXOB-KUHUBIRLSA-N 1 1 357.410 2.845 20 5 FFBDMO CNc1ccc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001120754541 1023451532 /nfs/dbraw/zinc/45/15/32/1023451532.db2.gz CKHOLQWCMVKJHC-KDURUIRLSA-N 1 1 358.442 2.585 20 5 FFBDMO Cc1ccnc(C2CC[NH+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)n1 ZINC000757928787 1023885147 /nfs/dbraw/zinc/88/51/47/1023885147.db2.gz ZRARLWOPRKHUBM-UHFFFAOYSA-N 1 1 370.409 2.844 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000079945151 1024422845 /nfs/dbraw/zinc/42/28/45/1024422845.db2.gz BXUXZKUKBQEZPH-YOEHRIQHSA-N 1 1 368.437 2.960 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000193575394 1024573250 /nfs/dbraw/zinc/57/32/50/1024573250.db2.gz MSWJYBIMGUWYHQ-UHFFFAOYSA-N 1 1 356.382 2.821 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000837184888 1025638355 /nfs/dbraw/zinc/63/83/55/1025638355.db2.gz ORZGEPVTLWCQCP-INIZCTEOSA-N 1 1 360.458 2.750 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246230731 1025899475 /nfs/dbraw/zinc/89/94/75/1025899475.db2.gz GBAXXMSLKISJGD-RHSMWYFYSA-N 1 1 363.458 2.503 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246313416 1026006048 /nfs/dbraw/zinc/00/60/48/1026006048.db2.gz QYNKGWKWXNQMIG-OXQOHEQNSA-N 1 1 355.438 2.835 20 5 FFBDMO CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)OCC[C@H]1CCCC[N@@H+]1C ZINC000838096678 1026204696 /nfs/dbraw/zinc/20/46/96/1026204696.db2.gz OUIGQQNGTWCTEA-GFCCVEGCSA-N 1 1 367.377 2.724 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@H](Nc2cc([N+](=O)[O-])ccn2)C1 ZINC001158586516 1027068890 /nfs/dbraw/zinc/06/88/90/1027068890.db2.gz ZKKYNWOCKSAJSH-DOTOQJQBSA-N 1 1 370.409 2.861 20 5 FFBDMO O=C(NCCC1=CC[N@H+](Cc2sccc2Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097457 1027588778 /nfs/dbraw/zinc/58/87/78/1027588778.db2.gz JVXLFPYSHGXUQB-TZMCWYRMSA-N 1 1 369.874 2.705 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2sccc2Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097457 1027588792 /nfs/dbraw/zinc/58/87/92/1027588792.db2.gz JVXLFPYSHGXUQB-TZMCWYRMSA-N 1 1 369.874 2.705 20 5 FFBDMO Cc1ccc(CCC[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001160097862 1027589293 /nfs/dbraw/zinc/58/92/93/1027589293.db2.gz MQFHSENQWTXWMB-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1ccc(CCC[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160097862 1027589310 /nfs/dbraw/zinc/58/93/10/1027589310.db2.gz MQFHSENQWTXWMB-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1ccc(CCC[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160097862 1027589325 /nfs/dbraw/zinc/58/93/25/1027589325.db2.gz MQFHSENQWTXWMB-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000248894317 1027873293 /nfs/dbraw/zinc/87/32/93/1027873293.db2.gz SYRLSGNTKNCUSP-CXAGYDPISA-N 1 1 357.385 2.984 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CC[C@@](F)(C[NH3+])C1 ZINC001161245775 1028090851 /nfs/dbraw/zinc/09/08/51/1028090851.db2.gz GBSYMMNGETWSHU-RBBKRZOGSA-N 1 1 365.452 2.762 20 5 FFBDMO Cc1nn(CN(C)CCC[N@@H+](C)Cc2ccco2)c2ncc([N+](=O)[O-])cc12 ZINC000795751830 1028092563 /nfs/dbraw/zinc/09/25/63/1028092563.db2.gz KEVQFLKBANUKBN-UHFFFAOYSA-N 1 1 372.429 2.652 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCCN(C)Cc2ccco2)c2ncc([N+](=O)[O-])cc12 ZINC000795751830 1028092580 /nfs/dbraw/zinc/09/25/80/1028092580.db2.gz KEVQFLKBANUKBN-UHFFFAOYSA-N 1 1 372.429 2.652 20 5 FFBDMO Cc1nn(C[N@H+](C)CCCN(C)Cc2ccco2)c2ncc([N+](=O)[O-])cc12 ZINC000795751830 1028092599 /nfs/dbraw/zinc/09/25/99/1028092599.db2.gz KEVQFLKBANUKBN-UHFFFAOYSA-N 1 1 372.429 2.652 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@@H](CCO)c2ccc(N)cc2)ncc1[N+](=O)[O-] ZINC001161434688 1028170686 /nfs/dbraw/zinc/17/06/86/1028170686.db2.gz FTNLPKWHFSUFSI-DYLHUKMJSA-N 1 1 357.414 2.640 20 5 FFBDMO Cc1cccc(N2CCN(c3ccc([N+](=O)[O-])c(OC(C)C)n3)CC2)[nH+]1 ZINC001163668558 1029015676 /nfs/dbraw/zinc/01/56/76/1029015676.db2.gz VFVFMXRNGMUZIO-UHFFFAOYSA-N 1 1 357.414 2.807 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC001163672158 1029018385 /nfs/dbraw/zinc/01/83/85/1029018385.db2.gz IUUOOWHPPXUSGP-QGZVFWFLSA-N 1 1 370.409 2.660 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001163672158 1029018400 /nfs/dbraw/zinc/01/84/00/1029018400.db2.gz IUUOOWHPPXUSGP-QGZVFWFLSA-N 1 1 370.409 2.660 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001156316652 1029140965 /nfs/dbraw/zinc/14/09/65/1029140965.db2.gz HIXCKAVUGPEHOW-YXJHDRRASA-N 1 1 353.426 2.895 20 5 FFBDMO [NH3+][C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CCC1(F)F ZINC001164327317 1029248025 /nfs/dbraw/zinc/24/80/25/1029248025.db2.gz NBSBVEFIWKMCSM-CYBMUJFWSA-N 1 1 352.316 2.969 20 5 FFBDMO CCc1cc(N2CCC(F)(F)[C@H]([NH3+])C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164327120 1029248207 /nfs/dbraw/zinc/24/82/07/1029248207.db2.gz LVFQBOIBGAJPLZ-CQSZACIVSA-N 1 1 363.368 2.787 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccccc2C2CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494580 1029298875 /nfs/dbraw/zinc/29/88/75/1029298875.db2.gz NIXITOJKQBIBAR-QZTJIDSGSA-N 1 1 357.454 2.605 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)nc1N1C[C@H]2[C@@H](CC[N@H+]2Cc2ccccc2)C1 ZINC001165086699 1029374751 /nfs/dbraw/zinc/37/47/51/1029374751.db2.gz OAJMABLYWAEDDP-ZFWWWQNUSA-N 1 1 359.817 2.749 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC([N@H+]3CCc4ccccc4C3)CC2)n1 ZINC001165150855 1029423821 /nfs/dbraw/zinc/42/38/21/1029423821.db2.gz QLCKILDGNYMKGZ-UHFFFAOYSA-N 1 1 353.426 2.720 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1)C1CCN(c2ccc([N+](=O)[O-])c(N)n2)CC1 ZINC001157074563 1029458534 /nfs/dbraw/zinc/45/85/34/1029458534.db2.gz KKMOSQZZPADNJF-UHFFFAOYSA-N 1 1 359.405 2.812 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N(C)CC[N@@H+](C)Cc1ccccc1 ZINC001157556626 1029616989 /nfs/dbraw/zinc/61/69/89/1029616989.db2.gz LFIBXPZNFPWTGA-UHFFFAOYSA-N 1 1 372.425 2.735 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](Cc4ccncc4)C3)n2)c1 ZINC000782292501 1029645654 /nfs/dbraw/zinc/64/56/54/1029645654.db2.gz UULFREIVRQMLML-MRXNPFEDSA-N 1 1 364.409 2.770 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2ncc([N+](=O)[O-])cc2F)c2ccccc12 ZINC001158238087 1029767644 /nfs/dbraw/zinc/76/76/44/1029767644.db2.gz WKVRKHXPOZZORU-GOSISDBHSA-N 1 1 372.356 2.506 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)nc1-c1ccncc1 ZINC000842620348 1030832440 /nfs/dbraw/zinc/83/24/40/1030832440.db2.gz ZZKCNXDMRPBSTA-CVEARBPZSA-N 1 1 357.414 2.702 20 5 FFBDMO Cn1c(C(=O)NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000798523611 1031445414 /nfs/dbraw/zinc/44/54/14/1031445414.db2.gz LIKBMVJFEGYSBS-IBGZPJMESA-N 1 1 356.426 2.575 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000798965080 1031597572 /nfs/dbraw/zinc/59/75/72/1031597572.db2.gz XXGXYEQYVCEJET-HNNXBMFYSA-N 1 1 371.393 2.531 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CC/C=C\c2ccccc2)CC1 ZINC001205230351 1031613130 /nfs/dbraw/zinc/61/31/30/1031613130.db2.gz OFRZNOORMDGIMC-HUPPCRNXSA-N 1 1 357.454 2.583 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799194740 1031691742 /nfs/dbraw/zinc/69/17/42/1031691742.db2.gz XOVYNJGFFZZRMD-AWEZNQCLSA-N 1 1 370.409 2.817 20 5 FFBDMO O=C(NCC1([NH2+]Cc2sccc2Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530711 1031787523 /nfs/dbraw/zinc/78/75/23/1031787523.db2.gz NALVSXFVPSTFCF-DGCLKSJQSA-N 1 1 371.890 2.975 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@H]2CCCC[N@H+]2Cc2ccccc2)n1 ZINC000799632783 1031846466 /nfs/dbraw/zinc/84/64/66/1031846466.db2.gz PNIKHNCHYNPJRB-OAHLLOKOSA-N 1 1 358.398 2.540 20 5 FFBDMO O=C1OCCN1C[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000830125051 1033474800 /nfs/dbraw/zinc/47/48/00/1033474800.db2.gz TZMSWSAQHPLYOG-ZDUSSCGKSA-N 1 1 372.381 2.524 20 5 FFBDMO O=C1OCCN1C[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000830125051 1033474810 /nfs/dbraw/zinc/47/48/10/1033474810.db2.gz TZMSWSAQHPLYOG-ZDUSSCGKSA-N 1 1 372.381 2.524 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])ccc3Cl)C[C@H]1[N@H+]2C ZINC001226810725 1034849518 /nfs/dbraw/zinc/84/95/18/1034849518.db2.gz RGVHIIHQAXFWND-CAVOSLQRSA-N 1 1 354.790 2.794 20 5 FFBDMO C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111684 1034939556 /nfs/dbraw/zinc/93/95/56/1034939556.db2.gz QBZKMIPYZORFNM-WCQYABFASA-N 1 1 359.342 2.507 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111684 1034939564 /nfs/dbraw/zinc/93/95/64/1034939564.db2.gz QBZKMIPYZORFNM-WCQYABFASA-N 1 1 359.342 2.507 20 5 FFBDMO OC[C@H]1CCn2nccc2C[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232229318 1035507284 /nfs/dbraw/zinc/50/72/84/1035507284.db2.gz ZWWZTQGYZYEFNZ-LJQANCHMSA-N 1 1 359.433 2.746 20 5 FFBDMO OC[C@H]1CCn2nccc2C[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232229318 1035507289 /nfs/dbraw/zinc/50/72/89/1035507289.db2.gz ZWWZTQGYZYEFNZ-LJQANCHMSA-N 1 1 359.433 2.746 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1cc[n+]([O-])cc1[N+](=O)[O-] ZINC001229453000 1036684010 /nfs/dbraw/zinc/68/40/10/1036684010.db2.gz ZHYYLWRETIERTP-SFHVURJKSA-N 1 1 357.410 2.908 20 5 FFBDMO COC(=O)c1cc(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c(F)cc1[N+](=O)[O-] ZINC001229937981 1036989576 /nfs/dbraw/zinc/98/95/76/1036989576.db2.gz FWPRILRYEAWHFU-CULMDFNYSA-N 1 1 352.362 2.630 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCn4c(C)ncc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256093458 1038379578 /nfs/dbraw/zinc/37/95/78/1038379578.db2.gz LSWLPPJHIGLEQM-UHFFFAOYSA-N 1 1 371.441 2.593 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCn4c(C)ncc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256093458 1038379589 /nfs/dbraw/zinc/37/95/89/1038379589.db2.gz LSWLPPJHIGLEQM-UHFFFAOYSA-N 1 1 371.441 2.593 20 5 FFBDMO COc1cc(N2CCC(N3CCn4c(C)[nH+]cc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256093458 1038379603 /nfs/dbraw/zinc/37/96/03/1038379603.db2.gz LSWLPPJHIGLEQM-UHFFFAOYSA-N 1 1 371.441 2.593 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H]4CN(C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100863 1038385358 /nfs/dbraw/zinc/38/53/58/1038385358.db2.gz RHHGCIFOZYNJAW-HNAYVOBHSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@H]4C[N@H+](C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100863 1038385369 /nfs/dbraw/zinc/38/53/69/1038385369.db2.gz RHHGCIFOZYNJAW-HNAYVOBHSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@H]4C[N@@H+](C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100863 1038385376 /nfs/dbraw/zinc/38/53/76/1038385376.db2.gz RHHGCIFOZYNJAW-HNAYVOBHSA-N 1 1 374.485 2.598 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)n1 ZINC001276658580 1039068266 /nfs/dbraw/zinc/06/82/66/1039068266.db2.gz NWYNJAJEHOVYPF-APWZRJJASA-N 1 1 366.421 2.645 20 5 FFBDMO C[C@H]1C[NH+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC001258012636 1039109342 /nfs/dbraw/zinc/10/93/42/1039109342.db2.gz QVHVKBAJTVNXAZ-NSDHSQQOSA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1cc(Cc2nnc(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)o2)ccc1[N+](=O)[O-] ZINC001258071881 1039153926 /nfs/dbraw/zinc/15/39/26/1039153926.db2.gz NQLVJIOVHSHRPD-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1cc(Cc2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)ccc1[N+](=O)[O-] ZINC001258071881 1039153933 /nfs/dbraw/zinc/15/39/33/1039153933.db2.gz NQLVJIOVHSHRPD-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO C[N@@H+](CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)Cc1ccccc1 ZINC001252254612 1039465044 /nfs/dbraw/zinc/46/50/44/1039465044.db2.gz FNDXKLBJNHPNOY-UHFFFAOYSA-N 1 1 354.410 2.752 20 5 FFBDMO C[C@@H]1CNC[C@@H](C)[NH+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246877417 1039514084 /nfs/dbraw/zinc/51/40/84/1039514084.db2.gz AZWSMDGDQLVHAH-VXGBXAGGSA-N 1 1 354.401 2.524 20 5 FFBDMO Cn1ncc2ccc(-c3noc([C@@H]([NH3+])Cc4ccccc4[N+](=O)[O-])n3)cc21 ZINC001247667091 1039875895 /nfs/dbraw/zinc/87/58/95/1039875895.db2.gz VDQUJCJRYUOLOY-AWEZNQCLSA-N 1 1 364.365 2.774 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254479733 1040745008 /nfs/dbraw/zinc/74/50/08/1040745008.db2.gz JXAHPTNEEHOHQC-SFHVURJKSA-N 1 1 361.442 2.981 20 5 FFBDMO COC(=O)CC[C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480162 1040747880 /nfs/dbraw/zinc/74/78/80/1040747880.db2.gz WQCOAIDYONJFQR-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](Oc4ncccn4)C3)CC2)cc1 ZINC001254483746 1040749279 /nfs/dbraw/zinc/74/92/79/1040749279.db2.gz XKPQKPWXBNYJHN-SFHVURJKSA-N 1 1 369.425 2.507 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(CCN2c2ncccn2)C1 ZINC001254562717 1040800391 /nfs/dbraw/zinc/80/03/91/1040800391.db2.gz SYPSZJTYARKWOI-DNVCBOLYSA-N 1 1 353.426 2.671 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)N2CCCC2)C1 ZINC001254570068 1040805451 /nfs/dbraw/zinc/80/54/51/1040805451.db2.gz MHLDCNALSYFQTM-NVXWUHKLSA-N 1 1 360.458 2.796 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595829 1040823958 /nfs/dbraw/zinc/82/39/58/1040823958.db2.gz NKATXSABTHLIGP-GOSISDBHSA-N 1 1 369.469 2.615 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@@H]2COC ZINC001254599340 1040830264 /nfs/dbraw/zinc/83/02/64/1040830264.db2.gz YDQSJTNNKVBGDB-WBVHZDCISA-N 1 1 356.426 2.524 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@@H]2COC ZINC001254599340 1040830275 /nfs/dbraw/zinc/83/02/75/1040830275.db2.gz YDQSJTNNKVBGDB-WBVHZDCISA-N 1 1 356.426 2.524 20 5 FFBDMO Cc1c(-c2nc(-c3ccc(N)c([N+](=O)[O-])c3)no2)cnn1-c1cc[nH+]cc1 ZINC001254814913 1040975656 /nfs/dbraw/zinc/97/56/56/1040975656.db2.gz HCHMCLVYTPMHOT-UHFFFAOYSA-N 1 1 363.337 2.783 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001216792722 1042123165 /nfs/dbraw/zinc/12/31/65/1042123165.db2.gz GOZYYEWEGMADOR-UHFFFAOYSA-N 1 1 364.446 2.950 20 5 FFBDMO C[C@H](CNC(=O)c1cnn(-c2cc[nH+]cc2)c1)c1ccccc1[N+](=O)[O-] ZINC001538849592 1070504701 /nfs/dbraw/zinc/50/47/01/1070504701.db2.gz IUUWQQAIHJMBEH-CYBMUJFWSA-N 1 1 351.366 2.709 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC001319574568 1045200537 /nfs/dbraw/zinc/20/05/37/1045200537.db2.gz ZUYHLWHXKXHYIN-ROUUACIJSA-N 1 1 372.400 2.979 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCc1cccc(C[NH+]2CCN(C)CC2)c1 ZINC001319746782 1045260188 /nfs/dbraw/zinc/26/01/88/1045260188.db2.gz AQESLYJFHXPABT-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001321114641 1045552237 /nfs/dbraw/zinc/55/22/37/1045552237.db2.gz YFGYKTMTBQFIQY-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001321114641 1045552250 /nfs/dbraw/zinc/55/22/50/1045552250.db2.gz YFGYKTMTBQFIQY-WMZOPIPTSA-N 1 1 373.384 2.918 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001284533237 1046564920 /nfs/dbraw/zinc/56/49/20/1046564920.db2.gz HSIXUVPOYTWEJK-HZPDHXFCSA-N 1 1 353.850 2.674 20 5 FFBDMO CC(C)N(CC[N@H+](C)Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533237 1046564934 /nfs/dbraw/zinc/56/49/34/1046564934.db2.gz HSIXUVPOYTWEJK-HZPDHXFCSA-N 1 1 353.850 2.674 20 5 FFBDMO CC(C)N(CC[N@@H+](C)Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001284533237 1046564945 /nfs/dbraw/zinc/56/49/45/1046564945.db2.gz HSIXUVPOYTWEJK-HZPDHXFCSA-N 1 1 353.850 2.674 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001331552415 1047998479 /nfs/dbraw/zinc/99/84/79/1047998479.db2.gz FRJNUOOQOSILLZ-GOSISDBHSA-N 1 1 358.442 2.679 20 5 FFBDMO O=C1N(C[N@@H+]2CCC[C@@H](CCF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001328023010 1048140482 /nfs/dbraw/zinc/14/04/82/1048140482.db2.gz DYSRWLWONWGPOM-AWEZNQCLSA-N 1 1 350.394 2.866 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H](CCF)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC001328023010 1048140490 /nfs/dbraw/zinc/14/04/90/1048140490.db2.gz DYSRWLWONWGPOM-AWEZNQCLSA-N 1 1 350.394 2.866 20 5 FFBDMO C[C@H](CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1)[N@H+]1CCCC[C@@H]1C ZINC001540833307 1071015306 /nfs/dbraw/zinc/01/53/06/1071015306.db2.gz LUMTUHRXJKXOCW-UONOGXRCSA-N 1 1 371.441 2.978 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC3(CCCCO3)CC2)nc1-c1ccccn1 ZINC001331058849 1049456339 /nfs/dbraw/zinc/45/63/39/1049456339.db2.gz OVJNXGPMVSWLJH-UHFFFAOYSA-N 1 1 357.414 2.846 20 5 FFBDMO CC(C)[N@@H+](CCO)CC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001307214956 1050080406 /nfs/dbraw/zinc/08/04/06/1050080406.db2.gz ZYPVNNIEPQXIQI-UHFFFAOYSA-N 1 1 357.401 2.792 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001297065001 1050117433 /nfs/dbraw/zinc/11/74/33/1050117433.db2.gz ARGYWLLQLURGGB-UHFFFAOYSA-N 1 1 354.838 2.682 20 5 FFBDMO CC[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C(C)(C)C1 ZINC001304042378 1051510441 /nfs/dbraw/zinc/51/04/41/1051510441.db2.gz HUJMBKPGDYLARE-CYBMUJFWSA-N 1 1 357.357 2.656 20 5 FFBDMO COC[C@H]([NH2+]Cc1c(Br)cccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC001341427786 1051783578 /nfs/dbraw/zinc/78/35/78/1051783578.db2.gz PMVFXTRNKMQRRU-GXTWGEPZSA-N 1 1 359.220 2.641 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1c2cc(F)ccc2ncc1[N+](=O)[O-] ZINC001307109312 1052252763 /nfs/dbraw/zinc/25/27/63/1052252763.db2.gz JIDWRELXSTWQIV-UHFFFAOYSA-N 1 1 362.405 2.829 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1c2cc(F)ccc2ncc1[N+](=O)[O-] ZINC001307109312 1052252767 /nfs/dbraw/zinc/25/27/67/1052252767.db2.gz JIDWRELXSTWQIV-UHFFFAOYSA-N 1 1 362.405 2.829 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNc1c2ccc(Br)cc2ncc1[N+](=O)[O-] ZINC001307166412 1052261056 /nfs/dbraw/zinc/26/10/56/1052261056.db2.gz VQAPWUSIVGCJMC-LLVKDONJSA-N 1 1 365.231 2.834 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C1CCCC1 ZINC001307210655 1052269307 /nfs/dbraw/zinc/26/93/07/1052269307.db2.gz UFPGRWWTDFDKRM-AWEZNQCLSA-N 1 1 372.469 2.940 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001308052649 1052394852 /nfs/dbraw/zinc/39/48/52/1052394852.db2.gz URLYGRNCCUOXBR-ZDUSSCGKSA-N 1 1 374.397 2.810 20 5 FFBDMO Cc1cc(C)nc(N2CC[NH+](Cc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC001308634344 1052480666 /nfs/dbraw/zinc/48/06/66/1052480666.db2.gz DUQOOFFMPZFICF-UHFFFAOYSA-N 1 1 355.442 2.941 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC001309059992 1052547486 /nfs/dbraw/zinc/54/74/86/1052547486.db2.gz KGVTURDNGKIXRU-CABCVRRESA-N 1 1 369.487 2.753 20 5 FFBDMO O=C(N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)c1ccc([N+](=O)[O-])[nH]1 ZINC001334858729 1053119092 /nfs/dbraw/zinc/11/90/92/1053119092.db2.gz MKSADZHKHABNEU-IXDOHACOSA-N 1 1 368.437 2.953 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CCC[N@@H+](Cc2ccc(C)cc2)CC1 ZINC001336770926 1054212495 /nfs/dbraw/zinc/21/24/95/1054212495.db2.gz PPSHYPFOJIMCSD-UHFFFAOYSA-N 1 1 357.458 2.616 20 5 FFBDMO Nc1c(C(=O)N2CC[NH+](C3CCC3)CC2)cc2ccccc2c1[N+](=O)[O-] ZINC001543415990 1071470152 /nfs/dbraw/zinc/47/01/52/1071470152.db2.gz ALKRHDYHEMGYND-UHFFFAOYSA-N 1 1 354.410 2.641 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)[C@H](C)C1 ZINC001338153339 1055275891 /nfs/dbraw/zinc/27/58/91/1055275891.db2.gz LLWFCSMTEAHQMM-CJNGLKHVSA-N 1 1 372.473 2.865 20 5 FFBDMO CCc1cc(NC(=O)[C@H]2CCC[N@H+]2C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC001357970466 1056084380 /nfs/dbraw/zinc/08/43/80/1056084380.db2.gz WAWODVMSIOUFOK-GOSISDBHSA-N 1 1 356.426 2.939 20 5 FFBDMO O=C(/C=C\c1nccs1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001514774431 1059089650 /nfs/dbraw/zinc/08/96/50/1059089650.db2.gz JIPBQFPTQBKDON-XVWMLYKFSA-N 1 1 359.407 2.882 20 5 FFBDMO O=C(/C=C\c1nccs1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001514774431 1059089675 /nfs/dbraw/zinc/08/96/75/1059089675.db2.gz JIPBQFPTQBKDON-XVWMLYKFSA-N 1 1 359.407 2.882 20 5 FFBDMO O=C(NC[C@@]12CC[N@@H+](C1)CCC2)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001520323094 1059610531 /nfs/dbraw/zinc/61/05/31/1059610531.db2.gz AKSRUHWRTQKGAX-OAHLLOKOSA-N 1 1 357.332 2.829 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCC2)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001455703864 1059882704 /nfs/dbraw/zinc/88/27/04/1059882704.db2.gz DBVVCZCPMCUHGW-UHFFFAOYSA-N 1 1 355.181 2.974 20 5 FFBDMO Cn1cc(C[C@H]2CC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)cn1 ZINC000848480692 1060114854 /nfs/dbraw/zinc/11/48/54/1060114854.db2.gz QNWLHJFTIQYUAE-OAHLLOKOSA-N 1 1 366.425 2.714 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)CC[C@@H]21 ZINC000848483118 1060121553 /nfs/dbraw/zinc/12/15/53/1060121553.db2.gz YOPUFPMYXUHPKC-QAPCUYQASA-N 1 1 355.442 2.832 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483147 1060122171 /nfs/dbraw/zinc/12/21/71/1060122171.db2.gz YUPQNXYUUYPKQJ-YJBOKZPZSA-N 1 1 355.442 2.832 20 5 FFBDMO CCOC1(C)CC[NH+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848488078 1060136593 /nfs/dbraw/zinc/13/65/93/1060136593.db2.gz AJGPCHYZEWWJBH-QGZVFWFLSA-N 1 1 361.442 2.759 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000848487805 1060138109 /nfs/dbraw/zinc/13/81/09/1060138109.db2.gz XLFLJOFZAUPGIC-SJLPKXTDSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000848487805 1060138116 /nfs/dbraw/zinc/13/81/16/1060138116.db2.gz XLFLJOFZAUPGIC-SJLPKXTDSA-N 1 1 366.421 2.753 20 5 FFBDMO Cc1cc(NC(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC001457704060 1060429382 /nfs/dbraw/zinc/42/93/82/1060429382.db2.gz PAQRBQNEVWURGE-UHFFFAOYSA-N 1 1 364.199 2.972 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)[C@@H]2[NH2+]CCOc3ccccc32)cc1[N+](=O)[O-] ZINC001521402545 1060576879 /nfs/dbraw/zinc/57/68/79/1060576879.db2.gz STWOGSFLDUMBFU-SCLBCKFNSA-N 1 1 355.394 2.804 20 5 FFBDMO Cc1cnc(COC(=O)c2cnn(-c3cc[nH+]cc3)c2)c(C)c1[N+](=O)[O-] ZINC001459105342 1060709053 /nfs/dbraw/zinc/70/90/53/1060709053.db2.gz BGQJCWNLDDJWJM-UHFFFAOYSA-N 1 1 353.338 2.544 20 5 FFBDMO COc1ccc(C[C@@H]2CC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001459656045 1060788699 /nfs/dbraw/zinc/78/86/99/1060788699.db2.gz OTECNLBVYGBCKH-DLBZAZTESA-N 1 1 372.421 2.660 20 5 FFBDMO C[C@H](C[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC001460296179 1060947733 /nfs/dbraw/zinc/94/77/33/1060947733.db2.gz OVCSOJVADHDUAU-AWEZNQCLSA-N 1 1 371.503 2.877 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@@H]2C[C@@H](O)C23CCC3)o1 ZINC001460424361 1060989199 /nfs/dbraw/zinc/98/91/99/1060989199.db2.gz AFNDCRBKXPKBGC-CHWSQXEVSA-N 1 1 364.789 2.691 20 5 FFBDMO Cc1[nH]c(C2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC001464546382 1062678018 /nfs/dbraw/zinc/67/80/18/1062678018.db2.gz PZSYHOAXBGLCFD-UHFFFAOYSA-N 1 1 364.427 2.503 20 5 FFBDMO CC[NH+](CC)CCN(Cc1ccc(Cl)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001437561167 1062881212 /nfs/dbraw/zinc/88/12/12/1062881212.db2.gz FITVQVKDEYNLQW-HZPDHXFCSA-N 1 1 353.850 2.676 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NCC[N@H+]1CCc2ccccc2C1 ZINC001441050807 1063391619 /nfs/dbraw/zinc/39/16/19/1063391619.db2.gz RTBJDUNUCPIZNY-UHFFFAOYSA-N 1 1 373.840 2.965 20 5 FFBDMO C[C@H]1CN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC[N@H+](C2CC2)C1 ZINC001468522756 1063999664 /nfs/dbraw/zinc/99/96/64/1063999664.db2.gz OJIUODUOSRKDCY-OAHLLOKOSA-N 1 1 357.454 2.959 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001471030880 1064530826 /nfs/dbraw/zinc/53/08/26/1064530826.db2.gz OBGMUKUVZNQCOQ-HOCLYGCPSA-N 1 1 368.437 2.675 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC001471788406 1064790203 /nfs/dbraw/zinc/79/02/03/1064790203.db2.gz OLNPZCRXLVIDNV-UHFFFAOYSA-N 1 1 364.427 2.514 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CCCCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001473708445 1065326840 /nfs/dbraw/zinc/32/68/40/1065326840.db2.gz CIJHAPCNIRBNPV-AWEZNQCLSA-N 1 1 367.450 2.561 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCc3cc(O)c(OC)cc3C2)c([N+](=O)[O-])c1 ZINC001473802452 1065369294 /nfs/dbraw/zinc/36/92/94/1065369294.db2.gz SAZUPPUYKBJHPL-UHFFFAOYSA-N 1 1 374.393 2.755 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCc3cc(O)c(OC)cc3C2)c([N+](=O)[O-])c1 ZINC001473802452 1065369312 /nfs/dbraw/zinc/36/93/12/1065369312.db2.gz SAZUPPUYKBJHPL-UHFFFAOYSA-N 1 1 374.393 2.755 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ncccc1C ZINC001473879788 1065402759 /nfs/dbraw/zinc/40/27/59/1065402759.db2.gz MPNUVFLTTAYWDE-OLZOCXBDSA-N 1 1 358.398 2.985 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NCc1c(Br)cccc1[N+](=O)[O-] ZINC001474060809 1065449005 /nfs/dbraw/zinc/44/90/05/1065449005.db2.gz BJPMDCKOBHMODW-QMTHXVAHSA-N 1 1 354.248 2.930 20 5 FFBDMO C[N@@H+](CCc1cccc(-c2nn[nH]n2)c1)Cc1ccc([N+](=O)[O-])cc1F ZINC001579231862 1078595350 /nfs/dbraw/zinc/59/53/50/1078595350.db2.gz NYWMTYUZYDZIEO-UHFFFAOYSA-N 1 1 356.361 2.589 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001556734801 1075770049 /nfs/dbraw/zinc/77/00/49/1075770049.db2.gz NGJNHUYFVTWPKJ-BWTSREIZSA-N 1 1 351.406 2.763 20 5 FFBDMO CC(C)(CNc1c2cccc(Cl)c2ncc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC001559048973 1076121326 /nfs/dbraw/zinc/12/13/26/1076121326.db2.gz HZUHBQMOOWBFNI-UHFFFAOYSA-N 1 1 364.833 2.741 20 5 FFBDMO CCOc1cc(C[N@@H+](CCC(=O)OC)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] ZINC001559546080 1076171455 /nfs/dbraw/zinc/17/14/55/1076171455.db2.gz NMNRICYMVFDZND-HNNXBMFYSA-N 1 1 366.414 2.538 20 5 FFBDMO C[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCC(C)(C)C1 ZINC001559806941 1076192708 /nfs/dbraw/zinc/19/27/08/1076192708.db2.gz NLANNNBNYJYFDT-SFHVURJKSA-N 1 1 374.485 2.754 20 5 FFBDMO COC[C@]1(C(=O)OC(C)(C)C)CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001560059002 1076219042 /nfs/dbraw/zinc/21/90/42/1076219042.db2.gz KUIDOAUOZCVHFQ-SFHVURJKSA-N 1 1 368.405 2.914 20 5 FFBDMO COC[C@]1(C(=O)OC(C)(C)C)CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001560059002 1076219045 /nfs/dbraw/zinc/21/90/45/1076219045.db2.gz KUIDOAUOZCVHFQ-SFHVURJKSA-N 1 1 368.405 2.914 20 5 FFBDMO CCOc1cccnc1N1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC001560144936 1076235413 /nfs/dbraw/zinc/23/54/13/1076235413.db2.gz UPBNTNXONKHIJO-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO O=C(CC[N@@H+]1CCS[C@@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560147070 1076236110 /nfs/dbraw/zinc/23/61/10/1076236110.db2.gz HMMORGKNXVDWIF-GFCCVEGCSA-N 1 1 363.361 2.903 20 5 FFBDMO O=C(CC[N@H+]1CCS[C@@H](C(F)(F)F)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001560147070 1076236114 /nfs/dbraw/zinc/23/61/14/1076236114.db2.gz HMMORGKNXVDWIF-GFCCVEGCSA-N 1 1 363.361 2.903 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2Cc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001560217031 1076248044 /nfs/dbraw/zinc/24/80/44/1076248044.db2.gz PIALFCBDRYYIPL-KRWDZBQOSA-N 1 1 369.421 2.997 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC001560736069 1076295048 /nfs/dbraw/zinc/29/50/48/1076295048.db2.gz GAQJCHCNANGZKR-WMLDXEAASA-N 1 1 371.437 2.919 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC001560736069 1076295049 /nfs/dbraw/zinc/29/50/49/1076295049.db2.gz GAQJCHCNANGZKR-WMLDXEAASA-N 1 1 371.437 2.919 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1[N+](=O)[O-] ZINC001560865203 1076304724 /nfs/dbraw/zinc/30/47/24/1076304724.db2.gz SXVYKOYBZOHRPD-MRXNPFEDSA-N 1 1 369.421 2.946 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001561474304 1076381392 /nfs/dbraw/zinc/38/13/92/1076381392.db2.gz ATOXSZNSVCBZEX-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001586659860 1079664202 /nfs/dbraw/zinc/66/42/02/1079664202.db2.gz PSZLUXJPVCEPQD-LJQANCHMSA-N 1 1 367.449 2.831 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001586659860 1079664204 /nfs/dbraw/zinc/66/42/04/1079664204.db2.gz PSZLUXJPVCEPQD-LJQANCHMSA-N 1 1 367.449 2.831 20 5 FFBDMO COc1cc(C(=O)NCCCNc2ccc(C)c[nH+]2)c([N+](=O)[O-])cc1OC ZINC000530884182 540061984 /nfs/dbraw/zinc/06/19/84/540061984.db2.gz UYMUNZTXRUHURR-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO NC(=O)C[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093808463 250045725 /nfs/dbraw/zinc/04/57/25/250045725.db2.gz ONERBNTXQPGQOK-GFCCVEGCSA-N 1 1 360.439 2.806 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H](n4cncn4)C3)o2)c1 ZINC000106217946 250260294 /nfs/dbraw/zinc/26/02/94/250260294.db2.gz CRUOJNRLMIVQCQ-MRXNPFEDSA-N 1 1 368.397 2.721 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000106891400 250296907 /nfs/dbraw/zinc/29/69/07/250296907.db2.gz AZNBMNWLDZCWHU-LLVKDONJSA-N 1 1 373.862 2.543 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000117286077 250340694 /nfs/dbraw/zinc/34/06/94/250340694.db2.gz KWXLEOBVXDJZHO-AWEZNQCLSA-N 1 1 363.458 2.685 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000117286077 250340697 /nfs/dbraw/zinc/34/06/97/250340697.db2.gz KWXLEOBVXDJZHO-AWEZNQCLSA-N 1 1 363.458 2.685 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000132100657 251044372 /nfs/dbraw/zinc/04/43/72/251044372.db2.gz VFLVUEGQRIVAHB-UHFFFAOYSA-N 1 1 373.253 2.573 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000132100657 251044373 /nfs/dbraw/zinc/04/43/73/251044373.db2.gz VFLVUEGQRIVAHB-UHFFFAOYSA-N 1 1 373.253 2.573 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262718 251118947 /nfs/dbraw/zinc/11/89/47/251118947.db2.gz YJZGQSCPYWGRFP-WOPDTQHZSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262718 251118949 /nfs/dbraw/zinc/11/89/49/251118949.db2.gz YJZGQSCPYWGRFP-WOPDTQHZSA-N 1 1 355.822 2.811 20 5 FFBDMO CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCC[N@@H+](C)C1 ZINC000153414305 251135188 /nfs/dbraw/zinc/13/51/88/251135188.db2.gz CATXVTZJKNGVJM-AWEZNQCLSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[C@@H]1C[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])CCN1CC(F)F ZINC000153424465 251135455 /nfs/dbraw/zinc/13/54/55/251135455.db2.gz GIPACIOSLVHAQE-CYBMUJFWSA-N 1 1 373.400 2.644 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])CCN1CC(F)F ZINC000153424465 251135459 /nfs/dbraw/zinc/13/54/59/251135459.db2.gz GIPACIOSLVHAQE-CYBMUJFWSA-N 1 1 373.400 2.644 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)Nc2cc(C)on2)CC1 ZINC000192600596 251293525 /nfs/dbraw/zinc/29/35/25/251293525.db2.gz SUFIWWNVJZVSMC-UHFFFAOYSA-N 1 1 374.397 2.751 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272474556 252046985 /nfs/dbraw/zinc/04/69/85/252046985.db2.gz IRGQZQWHUKLYML-BBRMVZONSA-N 1 1 366.849 2.526 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000272565362 252068709 /nfs/dbraw/zinc/06/87/09/252068709.db2.gz UVKGOPXUJGZQFV-QZTJIDSGSA-N 1 1 374.441 2.593 20 5 FFBDMO Cc1cc(C[C@@H](C)[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000272586840 252074691 /nfs/dbraw/zinc/07/46/91/252074691.db2.gz ZHNFVBHJJFSIHO-PXAZEXFGSA-N 1 1 354.414 2.670 20 5 FFBDMO Cc1cc(N2CC[C@H](CN3CCOCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272881447 252155273 /nfs/dbraw/zinc/15/52/73/252155273.db2.gz VQVXYNHCLTZCFQ-OAHLLOKOSA-N 1 1 356.426 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@H+]1CCC[C@H]1CO ZINC000273079658 252209564 /nfs/dbraw/zinc/20/95/64/252209564.db2.gz HDBPKLIURKBYES-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](CCC(F)(F)F)CC1CC1 ZINC000273390018 252296917 /nfs/dbraw/zinc/29/69/17/252296917.db2.gz UQUBJSMPWOSZDF-ZDUSSCGKSA-N 1 1 362.348 2.999 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000273522426 252323680 /nfs/dbraw/zinc/32/36/80/252323680.db2.gz YVBSTAXUCBRCLU-UHFFFAOYSA-N 1 1 368.409 2.556 20 5 FFBDMO O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000278139427 256281175 /nfs/dbraw/zinc/28/11/75/256281175.db2.gz NHNDRUVTEZNIHU-CYBMUJFWSA-N 1 1 371.441 2.742 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NCc1ccccc1C[N@@H+]1CC[C@@H](O)C1)CCN2 ZINC000278192433 256286049 /nfs/dbraw/zinc/28/60/49/256286049.db2.gz DODJOCLGXUMLKE-MRXNPFEDSA-N 1 1 368.437 2.742 20 5 FFBDMO Nc1c(F)c(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000278399612 256308311 /nfs/dbraw/zinc/30/83/11/256308311.db2.gz MUKSWTQYDMJIPV-HNNXBMFYSA-N 1 1 374.416 2.885 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(NCc3ccccc3C[N@@H+]3CC[C@H](O)C3)nc2c1 ZINC000278431709 256311774 /nfs/dbraw/zinc/31/17/74/256311774.db2.gz JNRGVABUPYHPEM-INIZCTEOSA-N 1 1 367.409 2.650 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000278725691 256341840 /nfs/dbraw/zinc/34/18/40/256341840.db2.gz HOXFEFRFSQVENI-GFCCVEGCSA-N 1 1 371.384 2.886 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1[C@H]1CCCO1)Nc1cc([N+](=O)[O-])ccc1F ZINC000284656779 256941489 /nfs/dbraw/zinc/94/14/89/256941489.db2.gz GGFNXNNIDIKCNZ-JKSUJKDBSA-N 1 1 351.378 2.706 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000286708925 257050766 /nfs/dbraw/zinc/05/07/66/257050766.db2.gz OFDZHSZXKKKFGZ-ALOPSCKCSA-N 1 1 360.458 2.794 20 5 FFBDMO Nc1ccc(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c([N+](=O)[O-])c1 ZINC000287628064 257099582 /nfs/dbraw/zinc/09/95/82/257099582.db2.gz GZYWZKFBBOMQFA-KRWDZBQOSA-N 1 1 356.426 2.880 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288735463 257222505 /nfs/dbraw/zinc/22/25/05/257222505.db2.gz FIIVCZQHMGBQJV-VBNZEHGJSA-N 1 1 365.430 2.616 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288735463 257222507 /nfs/dbraw/zinc/22/25/07/257222507.db2.gz FIIVCZQHMGBQJV-VBNZEHGJSA-N 1 1 365.430 2.616 20 5 FFBDMO CCC[C@@]1(CO)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000288852273 257232344 /nfs/dbraw/zinc/23/23/44/257232344.db2.gz PFZRWRCSSUUHEF-QGZVFWFLSA-N 1 1 353.394 2.547 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](c3ccncc3)C2)c1 ZINC000289358053 257276541 /nfs/dbraw/zinc/27/65/41/257276541.db2.gz NVOMIBKVQJTHOR-WMZOPIPTSA-N 1 1 357.410 2.609 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000289387345 257278200 /nfs/dbraw/zinc/27/82/00/257278200.db2.gz OXIBOPVNCOAJOQ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@H](C)C1 ZINC000289387345 257278201 /nfs/dbraw/zinc/27/82/01/257278201.db2.gz OXIBOPVNCOAJOQ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1 ZINC000289403843 257279189 /nfs/dbraw/zinc/27/91/89/257279189.db2.gz GDZWVQIKPIXANS-AZUAARDMSA-N 1 1 353.422 2.765 20 5 FFBDMO Cc1c(C[N@H+]2CCC[C@H](CNC(=O)C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000289513439 257284975 /nfs/dbraw/zinc/28/49/75/257284975.db2.gz RCOQFJPKHVKQJP-GFCCVEGCSA-N 1 1 359.348 2.794 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC(C)(C)C1 ZINC000289944438 257307929 /nfs/dbraw/zinc/30/79/29/257307929.db2.gz VQNGXYQNMCMPRL-GJZGRUSLSA-N 1 1 352.431 2.614 20 5 FFBDMO O=C([C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1)N1CCCC1 ZINC000290397745 257329710 /nfs/dbraw/zinc/32/97/10/257329710.db2.gz JFSDBQITUMBADI-GFCCVEGCSA-N 1 1 369.368 2.641 20 5 FFBDMO O=C([C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1)N1CCCC1 ZINC000290397745 257329711 /nfs/dbraw/zinc/32/97/11/257329711.db2.gz JFSDBQITUMBADI-GFCCVEGCSA-N 1 1 369.368 2.641 20 5 FFBDMO COc1cc(CN2CC[C@H](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])cc1OC ZINC000290486794 257334729 /nfs/dbraw/zinc/33/47/29/257334729.db2.gz OIVXLQYONLKKFZ-HNNXBMFYSA-N 1 1 363.458 2.776 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000291265558 257394741 /nfs/dbraw/zinc/39/47/41/257394741.db2.gz NGTXNSIXVVULPS-HXUWFJFHSA-N 1 1 372.421 2.748 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000292965102 257524946 /nfs/dbraw/zinc/52/49/46/257524946.db2.gz LUCLEQFNZNAGCJ-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO Cc1ccnc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000301306895 258041406 /nfs/dbraw/zinc/04/14/06/258041406.db2.gz VFUFMKVUASFQHV-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+]2CCc3sccc3C2)c1 ZINC000302101733 258088095 /nfs/dbraw/zinc/08/80/95/258088095.db2.gz QENCINYVUMFVLI-UHFFFAOYSA-N 1 1 361.423 2.913 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCc3sccc3C2)c1 ZINC000302101733 258088096 /nfs/dbraw/zinc/08/80/96/258088096.db2.gz QENCINYVUMFVLI-UHFFFAOYSA-N 1 1 361.423 2.913 20 5 FFBDMO Cc1cc(N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302840812 258112250 /nfs/dbraw/zinc/11/22/50/258112250.db2.gz CQUIGEKWGBUFIN-GASCZTMLSA-N 1 1 358.442 2.997 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1[NH+]1CCOCC1 ZINC000301544108 258054878 /nfs/dbraw/zinc/05/48/78/258054878.db2.gz DABSSHPIQHBLRV-ABAIWWIYSA-N 1 1 359.348 2.771 20 5 FFBDMO CC1(C)CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1Cc1ccccc1 ZINC000302009769 258081814 /nfs/dbraw/zinc/08/18/14/258081814.db2.gz VRXUMMFBYBYDHN-UHFFFAOYSA-N 1 1 366.425 2.738 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330585612 258165939 /nfs/dbraw/zinc/16/59/39/258165939.db2.gz LJAPIOUJKGVGSN-MNOVXSKESA-N 1 1 359.373 2.729 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2CCCC[N@@H+]2C[C@@H]1C ZINC000331980676 258208665 /nfs/dbraw/zinc/20/86/65/258208665.db2.gz FHXJGHDTRNFKDV-DOTOQJQBSA-N 1 1 360.458 2.790 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000332065468 258212098 /nfs/dbraw/zinc/21/20/98/258212098.db2.gz SINFGDVXIGKJKM-WCQYABFASA-N 1 1 370.356 2.945 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@H](C)[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389544 258228308 /nfs/dbraw/zinc/22/83/08/258228308.db2.gz LFWQEFSCEVWQIS-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@H](C)[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389544 258228309 /nfs/dbraw/zinc/22/83/09/258228309.db2.gz LFWQEFSCEVWQIS-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000332408409 258229243 /nfs/dbraw/zinc/22/92/43/258229243.db2.gz ZUFHYNHPMLJQJF-HNNXBMFYSA-N 1 1 361.442 2.537 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069484 512993002 /nfs/dbraw/zinc/99/30/02/512993002.db2.gz BVICIIPKITXWPG-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069484 512992999 /nfs/dbraw/zinc/99/29/99/512992999.db2.gz BVICIIPKITXWPG-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000064957591 506244231 /nfs/dbraw/zinc/24/42/31/506244231.db2.gz AAVZCHBKOIYPAH-OKILXGFUSA-N 1 1 369.487 2.630 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NCCC[N@H+]1CCc2ccccc2C1 ZINC000032398959 506248774 /nfs/dbraw/zinc/24/87/74/506248774.db2.gz ROQFGILRUUHHSR-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+]2CCO)c(Br)c1 ZINC000450613668 513273129 /nfs/dbraw/zinc/27/31/29/513273129.db2.gz MDOOECKTYLMLNH-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2CCO)c(Br)c1 ZINC000450613668 513273135 /nfs/dbraw/zinc/27/31/35/513273135.db2.gz MDOOECKTYLMLNH-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1 ZINC000065881183 506384404 /nfs/dbraw/zinc/38/44/04/506384404.db2.gz PTNBNIFWZBQUJM-UHFFFAOYSA-N 1 1 360.389 2.698 20 5 FFBDMO CNC(=O)c1ccc(NC[C@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000053558303 506405391 /nfs/dbraw/zinc/40/53/91/506405391.db2.gz NLIMTSTWTARIQB-AWEZNQCLSA-N 1 1 368.437 2.813 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000054059331 506485614 /nfs/dbraw/zinc/48/56/14/506485614.db2.gz IRADDXBSSJYOFE-MRXNPFEDSA-N 1 1 361.373 2.775 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000371231546 512280576 /nfs/dbraw/zinc/28/05/76/512280576.db2.gz PIARUMCMEGJTNI-WMLDXEAASA-N 1 1 366.368 2.658 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2c2ccc(F)cc2F)c1 ZINC000371231546 512280580 /nfs/dbraw/zinc/28/05/80/512280580.db2.gz PIARUMCMEGJTNI-WMLDXEAASA-N 1 1 366.368 2.658 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000041577013 506533529 /nfs/dbraw/zinc/53/35/29/506533529.db2.gz VEAFNJSQGJNGBU-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1scnc1C ZINC000066564647 506555471 /nfs/dbraw/zinc/55/54/71/506555471.db2.gz DUXQGKDWILJNGD-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO NC(=O)c1ccc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000011172515 506767351 /nfs/dbraw/zinc/76/73/51/506767351.db2.gz XCDHBBWXHMLXNW-UHFFFAOYSA-N 1 1 372.400 2.545 20 5 FFBDMO COc1cccc(C2=CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)CC2)c1 ZINC000371284759 512307013 /nfs/dbraw/zinc/30/70/13/512307013.db2.gz UOQBEKUMZSIKEP-UHFFFAOYSA-N 1 1 355.394 2.554 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067922872 507054005 /nfs/dbraw/zinc/05/40/05/507054005.db2.gz XEFMULXKWXHXTE-INIZCTEOSA-N 1 1 363.458 2.917 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000025136682 507470710 /nfs/dbraw/zinc/47/07/10/507470710.db2.gz BTFPUJJMRPCRJN-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026923491 507622458 /nfs/dbraw/zinc/62/24/58/507622458.db2.gz RYTJIFDWKUNDRG-GFCCVEGCSA-N 1 1 357.366 2.955 20 5 FFBDMO C[C@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026923491 507622461 /nfs/dbraw/zinc/62/24/61/507622461.db2.gz RYTJIFDWKUNDRG-GFCCVEGCSA-N 1 1 357.366 2.955 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000029050225 507755761 /nfs/dbraw/zinc/75/57/61/507755761.db2.gz WJCYZMLMQZHTST-OAHLLOKOSA-N 1 1 350.806 2.619 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[NH+]1CCOCC1 ZINC000029208229 507768586 /nfs/dbraw/zinc/76/85/86/507768586.db2.gz GPFREXDZFMPYRQ-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000052101365 507797551 /nfs/dbraw/zinc/79/75/51/507797551.db2.gz WACWAVKHZJNGQC-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000052101365 507797553 /nfs/dbraw/zinc/79/75/53/507797553.db2.gz WACWAVKHZJNGQC-OLZOCXBDSA-N 1 1 355.460 2.673 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000072706097 507844929 /nfs/dbraw/zinc/84/49/29/507844929.db2.gz QATAYYHSGXJJMP-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO O=C(CCN1CC[C@H](C[NH+]2CCCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000072718493 507846695 /nfs/dbraw/zinc/84/66/95/507846695.db2.gz NZYHBHOXTFNXSC-MRXNPFEDSA-N 1 1 360.458 2.731 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000089619532 507851026 /nfs/dbraw/zinc/85/10/26/507851026.db2.gz ZPAOEMCYBUDYOS-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C1CC1 ZINC000078402418 507868684 /nfs/dbraw/zinc/86/86/84/507868684.db2.gz GHKTUWHPLNJRON-UHFFFAOYSA-N 1 1 353.444 2.539 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000108305871 507886139 /nfs/dbraw/zinc/88/61/39/507886139.db2.gz IRJKUBKZTNWJIQ-RISCZKNCSA-N 1 1 367.833 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H](C[NH+]3CCOCC3)C2)nc1-c1ccccc1 ZINC000090095862 507908371 /nfs/dbraw/zinc/90/83/71/507908371.db2.gz ZMTQVYBYFKCWFJ-MRXNPFEDSA-N 1 1 368.437 2.815 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)ccc1SC ZINC000090522341 507925411 /nfs/dbraw/zinc/92/54/11/507925411.db2.gz ZXTMSWLKQIZWIM-UHFFFAOYSA-N 1 1 363.439 2.619 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(c2[nH+]ccn2C)CC1 ZINC000373509935 512369997 /nfs/dbraw/zinc/36/99/97/512369997.db2.gz QACGWLLRHSMHIE-BUHFOSPRSA-N 1 1 369.425 2.517 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000073988704 507974571 /nfs/dbraw/zinc/97/45/71/507974571.db2.gz VYWSNFKSNFBQNB-BNOWGMLFSA-N 1 1 367.833 2.711 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000091479772 507988555 /nfs/dbraw/zinc/98/85/55/507988555.db2.gz FUKJDDKYVPTHKO-LBPRGKRZSA-N 1 1 357.370 2.659 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000091856875 508019516 /nfs/dbraw/zinc/01/95/16/508019516.db2.gz XJLFQRLZRXPDFO-HNNXBMFYSA-N 1 1 362.817 2.595 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000110354008 508022849 /nfs/dbraw/zinc/02/28/49/508022849.db2.gz XCRPOLVMCQTOSR-AWEZNQCLSA-N 1 1 357.410 2.854 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000080491225 508078219 /nfs/dbraw/zinc/07/82/19/508078219.db2.gz GNGAXCOVBDSFAZ-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000080491225 508078221 /nfs/dbraw/zinc/07/82/21/508078221.db2.gz GNGAXCOVBDSFAZ-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000080491230 508078593 /nfs/dbraw/zinc/07/85/93/508078593.db2.gz GNGAXCOVBDSFAZ-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000080491230 508078595 /nfs/dbraw/zinc/07/85/95/508078595.db2.gz GNGAXCOVBDSFAZ-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+](Cc1ccncc1)C1CC1 ZINC000093221343 508128936 /nfs/dbraw/zinc/12/89/36/508128936.db2.gz UNQVJHYPESXATR-UHFFFAOYSA-N 1 1 368.393 2.952 20 5 FFBDMO C[C@H](c1cccnc1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000093226769 508129395 /nfs/dbraw/zinc/12/93/95/508129395.db2.gz XSPPZFCKFPRJLT-CYBMUJFWSA-N 1 1 356.382 2.981 20 5 FFBDMO NC(=O)c1ccc(N2CC[NH+](C/C=C/c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000093533919 508147276 /nfs/dbraw/zinc/14/72/76/508147276.db2.gz QYFQLIJZIIPWEP-HWKANZROSA-N 1 1 366.421 2.529 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000081289729 508156125 /nfs/dbraw/zinc/15/61/25/508156125.db2.gz HAWRPXOEFJOORS-MRXNPFEDSA-N 1 1 361.442 2.988 20 5 FFBDMO CCC[N@H+](C)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000081568917 508191162 /nfs/dbraw/zinc/19/11/62/508191162.db2.gz XBIDZCGFFFSKCX-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000081568917 508191165 /nfs/dbraw/zinc/19/11/65/508191165.db2.gz XBIDZCGFFFSKCX-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@H](C[N@@H+](C)CC2CC2)C1 ZINC000081629855 508198662 /nfs/dbraw/zinc/19/86/62/508198662.db2.gz WWDZHLGMIBQDLG-GOEBONIOSA-N 1 1 360.458 2.586 20 5 FFBDMO COC(=O)CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000114197325 508298887 /nfs/dbraw/zinc/29/88/87/508298887.db2.gz FOWMUQFTQCJJKC-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000085407157 508307149 /nfs/dbraw/zinc/30/71/49/508307149.db2.gz NEDLHSYWAYDNOL-YJBOKZPZSA-N 1 1 362.474 2.899 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@H]2[C@@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460661 508317225 /nfs/dbraw/zinc/31/72/25/508317225.db2.gz CUJHIZRBXHTJSG-RDJZCZTQSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@H]2[C@@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460661 508317227 /nfs/dbraw/zinc/31/72/27/508317227.db2.gz CUJHIZRBXHTJSG-RDJZCZTQSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000114466924 508318094 /nfs/dbraw/zinc/31/80/94/508318094.db2.gz MPMRPCBOQSVGPO-KRWDZBQOSA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000114466924 508318095 /nfs/dbraw/zinc/31/80/95/508318095.db2.gz MPMRPCBOQSVGPO-KRWDZBQOSA-N 1 1 369.421 2.824 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000087032878 508332383 /nfs/dbraw/zinc/33/23/83/508332383.db2.gz UQBOSAXWRLVRSM-HUUCEWRRSA-N 1 1 363.458 2.531 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645145 508333595 /nfs/dbraw/zinc/33/35/95/508333595.db2.gz IRVUOZIOKBUIOW-GOSISDBHSA-N 1 1 369.421 2.754 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088606075 508379184 /nfs/dbraw/zinc/37/91/84/508379184.db2.gz BGTSCZJBOZEYNN-SFHVURJKSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088606075 508379186 /nfs/dbraw/zinc/37/91/86/508379186.db2.gz BGTSCZJBOZEYNN-SFHVURJKSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])[C@H](C)C1 ZINC000115271983 508379737 /nfs/dbraw/zinc/37/97/37/508379737.db2.gz FUXHSHZKBUDKAW-WBVHZDCISA-N 1 1 363.458 2.770 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000115274216 508380530 /nfs/dbraw/zinc/38/05/30/508380530.db2.gz IPNVHXXLZHDRDH-WBVHZDCISA-N 1 1 363.458 2.770 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000077928733 508392642 /nfs/dbraw/zinc/39/26/42/508392642.db2.gz ABURXHSMVUAFAU-QWHCGFSZSA-N 1 1 350.419 2.699 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](Oc3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000156394577 508413900 /nfs/dbraw/zinc/41/39/00/508413900.db2.gz AXDHNQJZERCPOJ-MRXNPFEDSA-N 1 1 370.409 2.780 20 5 FFBDMO COc1cc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000133971220 508475395 /nfs/dbraw/zinc/47/53/95/508475395.db2.gz PYZJZODABRWOMM-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCN(c4cccnn4)CC3)o2)c1 ZINC000127973590 508529109 /nfs/dbraw/zinc/52/91/09/508529109.db2.gz SVVZQBUWGPCVAE-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](C)C1 ZINC000135650021 508636831 /nfs/dbraw/zinc/63/68/31/508636831.db2.gz CVIPXINHGGMJOJ-ACJLOTCBSA-N 1 1 358.442 2.807 20 5 FFBDMO C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCC1CCOCC1 ZINC000128892393 508656493 /nfs/dbraw/zinc/65/64/93/508656493.db2.gz XSYKYMWTCAKMCM-UHFFFAOYSA-N 1 1 353.394 2.811 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C[N@H+]1C1CC1 ZINC000154241635 508743233 /nfs/dbraw/zinc/74/32/33/508743233.db2.gz IUVIJSUCHKKNRE-HIFRSBDPSA-N 1 1 358.442 2.894 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)CC2)c1 ZINC000158727301 508744831 /nfs/dbraw/zinc/74/48/31/508744831.db2.gz PUMDPYJMEMDFMR-UHFFFAOYSA-N 1 1 360.801 2.914 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000137432836 508756105 /nfs/dbraw/zinc/75/61/05/508756105.db2.gz YEOILEHXMYXTIN-NVXWUHKLSA-N 1 1 368.437 2.786 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000119372424 508782473 /nfs/dbraw/zinc/78/24/73/508782473.db2.gz UXUJMHVITOZJOA-CJNGLKHVSA-N 1 1 355.398 2.632 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000119396610 508787961 /nfs/dbraw/zinc/78/79/61/508787961.db2.gz QEVNGRXUEHHRSN-KDOFPFPSSA-N 1 1 360.410 2.603 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@H]1CCC[N@@H+](C)C1 ZINC000159103317 508792678 /nfs/dbraw/zinc/79/26/78/508792678.db2.gz SFITXCZQJQCYBZ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000142092550 508820898 /nfs/dbraw/zinc/82/08/98/508820898.db2.gz RQMWWRMDKNFFNZ-MRXNPFEDSA-N 1 1 358.442 2.505 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130662667 508828234 /nfs/dbraw/zinc/82/82/34/508828234.db2.gz LBTUWULMVWVQAH-KRWDZBQOSA-N 1 1 369.425 2.661 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130662667 508828239 /nfs/dbraw/zinc/82/82/39/508828239.db2.gz LBTUWULMVWVQAH-KRWDZBQOSA-N 1 1 369.425 2.661 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000124541694 508848926 /nfs/dbraw/zinc/84/89/26/508848926.db2.gz NMEMTOSAXWTQHN-YJBOKZPZSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)COc1cccc([N+](=O)[O-])c1 ZINC000119768977 508859402 /nfs/dbraw/zinc/85/94/02/508859402.db2.gz AFZKVOPMXUGHAO-BEFAXECRSA-N 1 1 369.421 2.610 20 5 FFBDMO COc1cc(C(=O)Nc2cccnc2-n2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000160551938 509002068 /nfs/dbraw/zinc/00/20/68/509002068.db2.gz YXJGFHJYGWDSIU-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)c1 ZINC000155536206 509021545 /nfs/dbraw/zinc/02/15/45/509021545.db2.gz YXWBKGMHMVBVIS-QGZVFWFLSA-N 1 1 359.426 2.533 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000151610012 509052453 /nfs/dbraw/zinc/05/24/53/509052453.db2.gz WZRZJBNVVQROLG-UHFFFAOYSA-N 1 1 369.487 2.669 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120734024 509054122 /nfs/dbraw/zinc/05/41/22/509054122.db2.gz WIABWWZCEXOVNE-AWEZNQCLSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)[N@@H+](C)C1CC1 ZINC000120991998 509104898 /nfs/dbraw/zinc/10/48/98/509104898.db2.gz LWFKQGZWWLSLKE-VIFPVBQESA-N 1 1 356.220 2.570 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1c([N+](=O)[O-])cnn1C ZINC000162185666 509175264 /nfs/dbraw/zinc/17/52/64/509175264.db2.gz VYLCORVOHGPTOH-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172802762 509245194 /nfs/dbraw/zinc/24/51/94/509245194.db2.gz LLPXYKKWZXEULX-XJKSGUPXSA-N 1 1 357.414 2.876 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000248182124 509257695 /nfs/dbraw/zinc/25/76/95/509257695.db2.gz WPNPIWPFMAVVIH-WMLDXEAASA-N 1 1 358.442 2.725 20 5 FFBDMO CC(C)(C)OC1CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000162617398 509265836 /nfs/dbraw/zinc/26/58/36/509265836.db2.gz KLFYTJWKVADERG-KRWDZBQOSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176004333 509269203 /nfs/dbraw/zinc/26/92/03/509269203.db2.gz XBPQWHLJSFMMEP-MFKMUULPSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cccc(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)c1[N+](=O)[O-] ZINC000185698785 509310051 /nfs/dbraw/zinc/31/00/51/509310051.db2.gz TWIRPYLWBZMSJZ-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000248454784 509329394 /nfs/dbraw/zinc/32/93/94/509329394.db2.gz KMJBRXNBKHOJHO-HZPDHXFCSA-N 1 1 352.431 2.616 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000182651299 509350485 /nfs/dbraw/zinc/35/04/85/509350485.db2.gz ULVRHVQOBIMIAC-HNNXBMFYSA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650066 509350933 /nfs/dbraw/zinc/35/09/33/509350933.db2.gz XXNOLVSIKLBXSV-AAEUAGOBSA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650066 509350940 /nfs/dbraw/zinc/35/09/40/509350940.db2.gz XXNOLVSIKLBXSV-AAEUAGOBSA-N 1 1 374.384 2.983 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)CC[C@@H]21 ZINC000179292211 509359601 /nfs/dbraw/zinc/35/96/01/509359601.db2.gz ZEDGMNHWNUPXDM-UGSOOPFHSA-N 1 1 356.426 2.561 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000248555312 509361584 /nfs/dbraw/zinc/36/15/84/509361584.db2.gz BEEDVTMZOPOBMS-SWLSCSKDSA-N 1 1 350.419 2.797 20 5 FFBDMO C[C@@H](c1ccc(Cl)cc1)N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000176269715 509413832 /nfs/dbraw/zinc/41/38/32/509413832.db2.gz FWNMXAJIUMKHBL-AWEZNQCLSA-N 1 1 363.849 2.824 20 5 FFBDMO NC(=O)c1ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000264261655 509420387 /nfs/dbraw/zinc/42/03/87/509420387.db2.gz DAYCIXBYCXIOEU-MRXNPFEDSA-N 1 1 368.437 2.670 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000267276372 509423516 /nfs/dbraw/zinc/42/35/16/509423516.db2.gz UHCRAJVONBJKLG-CABCVRRESA-N 1 1 360.458 2.904 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000248719144 509451803 /nfs/dbraw/zinc/45/18/03/509451803.db2.gz CELXJNXCAQZVCB-BLLLJJGKSA-N 1 1 372.400 2.566 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248741061 509464374 /nfs/dbraw/zinc/46/43/74/509464374.db2.gz PWACOEKXJVXMIV-QAPCUYQASA-N 1 1 352.431 2.616 20 5 FFBDMO COc1cccc(N(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000186164289 509556151 /nfs/dbraw/zinc/55/61/51/509556151.db2.gz CWFPJCAXKGRMDG-FQEVSTJZSA-N 1 1 371.437 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000179688144 509575736 /nfs/dbraw/zinc/57/57/36/509575736.db2.gz XNTWRNBNXRFLEI-UHFFFAOYSA-N 1 1 359.357 2.960 20 5 FFBDMO C[C@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[NH+]1CCCC1 ZINC000237561744 509677343 /nfs/dbraw/zinc/67/73/43/509677343.db2.gz ZQZITQXIWIDAEI-OAHLLOKOSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268108148 509760718 /nfs/dbraw/zinc/76/07/18/509760718.db2.gz GDBGPBFXHSNRHW-ABAIWWIYSA-N 1 1 354.838 2.730 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000264950875 509792318 /nfs/dbraw/zinc/79/23/18/509792318.db2.gz JYBYWLQZZHBBBR-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183583691 509871804 /nfs/dbraw/zinc/87/18/04/509871804.db2.gz ZVTMLWYAYCCLNY-MRXNPFEDSA-N 1 1 369.425 2.976 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000180477169 509946065 /nfs/dbraw/zinc/94/60/65/509946065.db2.gz AZYULNZXWRYSJH-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000180507590 509959855 /nfs/dbraw/zinc/95/98/55/509959855.db2.gz PWIRLQJYIZOMSU-ZDUSSCGKSA-N 1 1 363.414 2.708 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585510 509978027 /nfs/dbraw/zinc/97/80/27/509978027.db2.gz WMGFXUMCOKJTJF-KGLIPLIRSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cccc1[N+](=O)[O-] ZINC000193585510 509978035 /nfs/dbraw/zinc/97/80/35/509978035.db2.gz WMGFXUMCOKJTJF-KGLIPLIRSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000180582581 509997193 /nfs/dbraw/zinc/99/71/93/509997193.db2.gz KOKGHMRJITZKNB-LLVKDONJSA-N 1 1 366.381 2.557 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@H]2CC(=O)c2cccs2)c([N+](=O)[O-])c1 ZINC000177391844 510032543 /nfs/dbraw/zinc/03/25/43/510032543.db2.gz KXWCRLIWGJVFGX-AWEZNQCLSA-N 1 1 373.434 2.993 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)c([N+](=O)[O-])c1 ZINC000177391844 510032551 /nfs/dbraw/zinc/03/25/51/510032551.db2.gz KXWCRLIWGJVFGX-AWEZNQCLSA-N 1 1 373.434 2.993 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000262024788 510150381 /nfs/dbraw/zinc/15/03/81/510150381.db2.gz RUTUWQPPTINGAK-QGZVFWFLSA-N 1 1 359.813 2.964 20 5 FFBDMO COCCCOC1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184221467 510200994 /nfs/dbraw/zinc/20/09/94/510200994.db2.gz UYRNJSCQRCJTTI-UHFFFAOYSA-N 1 1 356.394 2.760 20 5 FFBDMO CC(C)[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])N1CC[NH+](C)CC1 ZINC000194262591 510284345 /nfs/dbraw/zinc/28/43/45/510284345.db2.gz HWROSQFWMIMGEG-GOSISDBHSA-N 1 1 357.458 2.827 20 5 FFBDMO CC[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000184385780 510296974 /nfs/dbraw/zinc/29/69/74/510296974.db2.gz QNEDNPJUTIDAGS-CQSZACIVSA-N 1 1 369.468 2.874 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c([N+](=O)[O-])cc1F ZINC000184404250 510307569 /nfs/dbraw/zinc/30/75/69/510307569.db2.gz HDWHRHNQMYRHTH-ZDUSSCGKSA-N 1 1 354.378 2.718 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000246255294 510392226 /nfs/dbraw/zinc/39/22/26/510392226.db2.gz UBHJHXDLEJKOET-HZPDHXFCSA-N 1 1 362.474 2.894 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000266087566 510402229 /nfs/dbraw/zinc/40/22/29/510402229.db2.gz PIHKQAZBXSLQME-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccncc3)CC2)cc1OC(F)F ZINC000266097373 510408035 /nfs/dbraw/zinc/40/80/35/510408035.db2.gz GQEZAOXTJXVNFI-UHFFFAOYSA-N 1 1 364.352 2.913 20 5 FFBDMO CC(C)[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000194635570 510458316 /nfs/dbraw/zinc/45/83/16/510458316.db2.gz IGWGVXRPYUPZED-DAYGRLMNSA-N 1 1 363.458 2.687 20 5 FFBDMO CC(C)[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000194635570 510458326 /nfs/dbraw/zinc/45/83/26/510458326.db2.gz IGWGVXRPYUPZED-DAYGRLMNSA-N 1 1 363.458 2.687 20 5 FFBDMO C[C@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181547839 510465969 /nfs/dbraw/zinc/46/59/69/510465969.db2.gz IWEGGORCUWLMNP-JKSUJKDBSA-N 1 1 374.485 2.800 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000184730316 510487770 /nfs/dbraw/zinc/48/77/70/510487770.db2.gz VRIKDTPKIJSWMD-NSHDSACASA-N 1 1 352.822 2.532 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000175156444 510509418 /nfs/dbraw/zinc/50/94/18/510509418.db2.gz RTJALHGLYPIFBI-OAHLLOKOSA-N 1 1 363.458 2.978 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CNC(=O)C(C)C)C1 ZINC000175156444 510509423 /nfs/dbraw/zinc/50/94/23/510509423.db2.gz RTJALHGLYPIFBI-OAHLLOKOSA-N 1 1 363.458 2.978 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000194747084 510509794 /nfs/dbraw/zinc/50/97/94/510509794.db2.gz CGYFZLBKCSDJKP-AWEZNQCLSA-N 1 1 372.400 2.568 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000181974391 510686707 /nfs/dbraw/zinc/68/67/07/510686707.db2.gz VXKVPDHTNGIDCL-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000181974391 510686713 /nfs/dbraw/zinc/68/67/13/510686713.db2.gz VXKVPDHTNGIDCL-UHFFFAOYSA-N 1 1 357.410 2.645 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000172421889 510718738 /nfs/dbraw/zinc/71/87/38/510718738.db2.gz XRDYTAQMGODDDI-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO O=c1cc(C[N@@H+]2CCO[C@@]3(CCOC3)C2)c2c(ccc3ccccc32)o1 ZINC000185177266 510729796 /nfs/dbraw/zinc/72/97/96/510729796.db2.gz DASBXDBGPZXXDJ-NRFANRHFSA-N 1 1 351.402 2.938 20 5 FFBDMO O=c1cc(C[N@H+]2CCO[C@@]3(CCOC3)C2)c2c(ccc3ccccc32)o1 ZINC000185177266 510729805 /nfs/dbraw/zinc/72/98/05/510729805.db2.gz DASBXDBGPZXXDJ-NRFANRHFSA-N 1 1 351.402 2.938 20 5 FFBDMO Cc1cc(N2CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000263564719 510750450 /nfs/dbraw/zinc/75/04/50/510750450.db2.gz VBQRZISTLPRSOV-CQSZACIVSA-N 1 1 372.425 2.827 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000185306498 510799653 /nfs/dbraw/zinc/79/96/53/510799653.db2.gz XYLSXRGKHYLWJQ-CYBMUJFWSA-N 1 1 361.348 2.961 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](c3c(F)cccc3F)C2)c([N+](=O)[O-])c1 ZINC000185306498 510799658 /nfs/dbraw/zinc/79/96/58/510799658.db2.gz XYLSXRGKHYLWJQ-CYBMUJFWSA-N 1 1 361.348 2.961 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000182190916 510805373 /nfs/dbraw/zinc/80/53/73/510805373.db2.gz ZTHKRDUEMGHUST-INIZCTEOSA-N 1 1 360.410 2.654 20 5 FFBDMO COc1cccc(N2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000185335489 510812010 /nfs/dbraw/zinc/81/20/10/510812010.db2.gz HQKDAJKKIDNYSB-GASCZTMLSA-N 1 1 363.458 2.929 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2C[N@@H+](C)C(C)C)n1 ZINC000191774202 510825367 /nfs/dbraw/zinc/82/53/67/510825367.db2.gz HNIOJLUZNNDISL-UHFFFAOYSA-N 1 1 359.430 2.581 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](CC)C2)c1[N+](=O)[O-] ZINC000185445767 510846558 /nfs/dbraw/zinc/84/65/58/510846558.db2.gz ACSHSMIDNNQRIO-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](CC)C2)c1[N+](=O)[O-] ZINC000185445767 510846559 /nfs/dbraw/zinc/84/65/59/510846559.db2.gz ACSHSMIDNNQRIO-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](CC)C2)c1[N+](=O)[O-] ZINC000185445767 510846561 /nfs/dbraw/zinc/84/65/61/510846561.db2.gz ACSHSMIDNNQRIO-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](CC)C2)c1[N+](=O)[O-] ZINC000185445767 510846562 /nfs/dbraw/zinc/84/65/62/510846562.db2.gz ACSHSMIDNNQRIO-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO COc1ccccc1C[C@H](C)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247486885 510862764 /nfs/dbraw/zinc/86/27/64/510862764.db2.gz KQKPZJQNADDTID-MAUKXSAKSA-N 1 1 374.437 2.906 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000360341609 510899768 /nfs/dbraw/zinc/89/97/68/510899768.db2.gz GOUYEPYYYAUQFJ-RYUDHWBXSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CCC[N@H+](C)CCN(C)C ZINC000297343061 510910281 /nfs/dbraw/zinc/91/02/81/510910281.db2.gz DPPZBULDLYWSDT-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CCCN(C)CC[NH+](C)C ZINC000297343061 510910285 /nfs/dbraw/zinc/91/02/85/510910285.db2.gz DPPZBULDLYWSDT-UHFFFAOYSA-N 1 1 365.478 2.559 20 5 FFBDMO CO[C@@H](C)C[N@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000285451498 510911683 /nfs/dbraw/zinc/91/16/83/510911683.db2.gz ABFOPFLQVLZHBR-NSHDSACASA-N 1 1 364.427 2.624 20 5 FFBDMO CO[C@@H](C)C[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000285451498 510911685 /nfs/dbraw/zinc/91/16/85/510911685.db2.gz ABFOPFLQVLZHBR-NSHDSACASA-N 1 1 364.427 2.624 20 5 FFBDMO COCC[N@@H+]1CC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275760640 510916456 /nfs/dbraw/zinc/91/64/56/510916456.db2.gz FLWBBRWBBGORTL-HNNXBMFYSA-N 1 1 365.433 2.544 20 5 FFBDMO COCC[N@H+]1CC[C@H](NC(=O)c2ccc3[nH]c4ccccc4c(=O)c3c2)C1 ZINC000275760640 510916460 /nfs/dbraw/zinc/91/64/60/510916460.db2.gz FLWBBRWBBGORTL-HNNXBMFYSA-N 1 1 365.433 2.544 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270798351 510987241 /nfs/dbraw/zinc/98/72/41/510987241.db2.gz LLJKXJZITBJPPU-UHFFFAOYSA-N 1 1 357.414 2.864 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC2(CCOCC2)O1 ZINC000279066520 511018122 /nfs/dbraw/zinc/01/81/22/511018122.db2.gz ABLDQHGAAATZPN-OAHLLOKOSA-N 1 1 350.415 2.634 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000364761139 511066462 /nfs/dbraw/zinc/06/64/62/511066462.db2.gz UJMJZHJCYWQPJV-KRWDZBQOSA-N 1 1 361.329 2.736 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000364761139 511066464 /nfs/dbraw/zinc/06/64/64/511066464.db2.gz UJMJZHJCYWQPJV-KRWDZBQOSA-N 1 1 361.329 2.736 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000362390240 511185221 /nfs/dbraw/zinc/18/52/21/511185221.db2.gz UBMSUHNAWKJXIH-IRXDYDNUSA-N 1 1 372.469 2.554 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000279716830 511188346 /nfs/dbraw/zinc/18/83/46/511188346.db2.gz INFUBNLXAWDBFO-CHWSQXEVSA-N 1 1 353.394 2.688 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000365099731 511256616 /nfs/dbraw/zinc/25/66/16/511256616.db2.gz MROLQGGKUUVPTR-NEPJUHHUSA-N 1 1 355.797 2.673 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)n1 ZINC000365120895 511269339 /nfs/dbraw/zinc/26/93/39/511269339.db2.gz MLNBCUBJXJENFW-UHFFFAOYSA-N 1 1 361.358 2.748 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000295140375 511296021 /nfs/dbraw/zinc/29/60/21/511296021.db2.gz OLZADTSOGNCDQA-ONGXEEELSA-N 1 1 357.332 2.969 20 5 FFBDMO O=C(c1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000363021319 511301314 /nfs/dbraw/zinc/30/13/14/511301314.db2.gz KZZOMSODTICKCX-JKSUJKDBSA-N 1 1 358.442 2.870 20 5 FFBDMO COC(=O)CCCN1CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000271785899 511323999 /nfs/dbraw/zinc/32/39/99/511323999.db2.gz HTKRIWWXTAHEFA-UHFFFAOYSA-N 1 1 369.849 2.755 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])C2)C1 ZINC000295223219 511327282 /nfs/dbraw/zinc/32/72/82/511327282.db2.gz BHEUAZHFCBKNHB-HNNXBMFYSA-N 1 1 357.332 2.781 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@](CO)(c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000291817946 511350651 /nfs/dbraw/zinc/35/06/51/511350651.db2.gz NSMGKTAYVCQMEB-HXUWFJFHSA-N 1 1 369.421 2.559 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@](CO)(c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000291817944 511351198 /nfs/dbraw/zinc/35/11/98/511351198.db2.gz NSMGKTAYVCQMEB-FQEVSTJZSA-N 1 1 369.421 2.559 20 5 FFBDMO CCc1ccc(C(=O)NCc2ccc(-n3cc[nH+]c3C)nc2)cc1[N+](=O)[O-] ZINC000363129604 511371683 /nfs/dbraw/zinc/37/16/83/511371683.db2.gz JHANLOPUOUFKQR-UHFFFAOYSA-N 1 1 365.393 2.976 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000291908884 511387132 /nfs/dbraw/zinc/38/71/32/511387132.db2.gz RQUXHPOWPDIOTI-IBGZPJMESA-N 1 1 360.385 2.879 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000291908884 511387136 /nfs/dbraw/zinc/38/71/36/511387136.db2.gz RQUXHPOWPDIOTI-IBGZPJMESA-N 1 1 360.385 2.879 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NCC3=CC[N@@H+](C)CC3)cc2[N+](=O)[O-])CC1 ZINC000272052854 511415084 /nfs/dbraw/zinc/41/50/84/511415084.db2.gz ZVZBQOQYUKAPSH-UHFFFAOYSA-N 1 1 372.469 2.823 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000363271885 511454994 /nfs/dbraw/zinc/45/49/94/511454994.db2.gz VRSWUOXASQTPPP-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000365480206 511475220 /nfs/dbraw/zinc/47/52/20/511475220.db2.gz HAURZZXRCARDLP-OAHLLOKOSA-N 1 1 360.458 2.872 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000363390000 511520501 /nfs/dbraw/zinc/52/05/01/511520501.db2.gz HQSKLIJHDNPTMO-HNNXBMFYSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284060460 511592436 /nfs/dbraw/zinc/59/24/36/511592436.db2.gz QZQZDSCGRVEUCF-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000284060460 511592442 /nfs/dbraw/zinc/59/24/42/511592442.db2.gz QZQZDSCGRVEUCF-ZDUSSCGKSA-N 1 1 372.400 2.663 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292463840 511606703 /nfs/dbraw/zinc/60/67/03/511606703.db2.gz AEJQPSPANMIXOO-CYBMUJFWSA-N 1 1 362.430 2.942 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)CC[C@@H]21 ZINC000273852531 511631855 /nfs/dbraw/zinc/63/18/55/511631855.db2.gz LUCDHSZCBDYIBY-GUYCJALGSA-N 1 1 363.433 2.954 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)CC[C@H]21 ZINC000273852534 511632675 /nfs/dbraw/zinc/63/26/75/511632675.db2.gz LUCDHSZCBDYIBY-SUMWQHHRSA-N 1 1 363.433 2.954 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000280958107 511667340 /nfs/dbraw/zinc/66/73/40/511667340.db2.gz JKDRNTJSEKQQJC-NUJGCVRESA-N 1 1 361.442 2.599 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000280958093 511667383 /nfs/dbraw/zinc/66/73/83/511667383.db2.gz JKDRNTJSEKQQJC-JZXOWHBKSA-N 1 1 361.442 2.599 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000281064362 511708168 /nfs/dbraw/zinc/70/81/68/511708168.db2.gz SHAWSGCGRRAHLW-RDTXWAMCSA-N 1 1 370.409 2.608 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000281064362 511708174 /nfs/dbraw/zinc/70/81/74/511708174.db2.gz SHAWSGCGRRAHLW-RDTXWAMCSA-N 1 1 370.409 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCC4CCOCC4)CC3)nc2c1 ZINC000292862026 511749078 /nfs/dbraw/zinc/74/90/78/511749078.db2.gz GVDWIVURQFCZIG-UHFFFAOYSA-N 1 1 373.457 2.800 20 5 FFBDMO COc1cccc(-c2nc([C@@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)c1[N+](=O)[O-] ZINC000350346476 511785698 /nfs/dbraw/zinc/78/56/98/511785698.db2.gz ARINAHLAGUCPHW-GUYCJALGSA-N 1 1 360.370 2.579 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cn2)cc1 ZINC000363876278 511824429 /nfs/dbraw/zinc/82/44/29/511824429.db2.gz PTJVVWCVUXWMLA-GFCCVEGCSA-N 1 1 351.366 2.975 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000364053267 511931655 /nfs/dbraw/zinc/93/16/55/511931655.db2.gz GRIDTLDJXYXCTE-IEBWSBKVSA-N 1 1 369.421 2.782 20 5 FFBDMO Cc1cccnc1C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274798810 511946073 /nfs/dbraw/zinc/94/60/73/511946073.db2.gz DYAALLIJLNMIPB-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO Cn1nccc1[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000281963377 512029346 /nfs/dbraw/zinc/02/93/46/512029346.db2.gz GJJMIIZSGZYKIF-KRWDZBQOSA-N 1 1 357.414 2.884 20 5 FFBDMO O=C(c1cc(Br)cc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000366511995 512062122 /nfs/dbraw/zinc/06/21/22/512062122.db2.gz SXSSOBYKRLPXPE-ZDUSSCGKSA-N 1 1 368.231 2.668 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](CC)O[C@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806893 512514899 /nfs/dbraw/zinc/51/48/99/512514899.db2.gz TUMZEVHPYBQVMI-MAUKXSAKSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](CC)O[C@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806893 512514902 /nfs/dbraw/zinc/51/49/02/512514902.db2.gz TUMZEVHPYBQVMI-MAUKXSAKSA-N 1 1 350.415 2.763 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC3(CCC[N@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000371689983 512528780 /nfs/dbraw/zinc/52/87/80/512528780.db2.gz UQUQRPYTICISQF-HNNXBMFYSA-N 1 1 360.458 2.790 20 5 FFBDMO CCOc1ccccc1NC(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000411479014 512655375 /nfs/dbraw/zinc/65/53/75/512655375.db2.gz LRIHCPXFTAWIGD-UHFFFAOYSA-N 1 1 370.409 2.775 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000378288105 512677827 /nfs/dbraw/zinc/67/78/27/512677827.db2.gz JOAVRBNWXNRZAX-LJQANCHMSA-N 1 1 364.405 2.922 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000378288105 512677833 /nfs/dbraw/zinc/67/78/33/512677833.db2.gz JOAVRBNWXNRZAX-LJQANCHMSA-N 1 1 364.405 2.922 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000374354017 512785247 /nfs/dbraw/zinc/78/52/47/512785247.db2.gz SZZPQFURWASALR-CQSZACIVSA-N 1 1 369.425 2.558 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000374356449 512786987 /nfs/dbraw/zinc/78/69/87/512786987.db2.gz IDRBWOYXGJNHJX-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000411963904 512892776 /nfs/dbraw/zinc/89/27/76/512892776.db2.gz IADPXPPUHVLHII-GOSISDBHSA-N 1 1 359.813 2.877 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000389952305 512904107 /nfs/dbraw/zinc/90/41/07/512904107.db2.gz SNMINEUWGIKXND-KDOFPFPSSA-N 1 1 368.437 2.887 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CC[C@@H](O)C[C@@H]4C3)o2)c1 ZINC000412051300 512933600 /nfs/dbraw/zinc/93/36/00/512933600.db2.gz WGYXRCQMSXUIHN-ZMSDIMECSA-N 1 1 357.410 2.885 20 5 FFBDMO C[C@H]1C[C@H](c2cccnc2)[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446344 512938779 /nfs/dbraw/zinc/93/87/79/512938779.db2.gz CODWTJWTHWFVOP-KBXCAEBGSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446344 512938783 /nfs/dbraw/zinc/93/87/83/512938783.db2.gz CODWTJWTHWFVOP-KBXCAEBGSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@]1(NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000406030314 512973284 /nfs/dbraw/zinc/97/32/84/512973284.db2.gz JUPMPPWNYQSRLS-LJQANCHMSA-N 1 1 354.410 2.571 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000368848225 513120996 /nfs/dbraw/zinc/12/09/96/513120996.db2.gz VBGHIJQQJDMJDQ-QGZVFWFLSA-N 1 1 361.398 2.870 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)C2CCCCC2)c1[N+](=O)[O-] ZINC000433748766 513141463 /nfs/dbraw/zinc/14/14/63/513141463.db2.gz MHBQAHWTUMRYRY-UHFFFAOYSA-N 1 1 351.451 2.778 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H](C)C1 ZINC000450459019 513204052 /nfs/dbraw/zinc/20/40/52/513204052.db2.gz VTXBGMDCMNBDQZ-QWHCGFSZSA-N 1 1 362.455 2.610 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@H](C)C1 ZINC000450459017 513204632 /nfs/dbraw/zinc/20/46/32/513204632.db2.gz VTXBGMDCMNBDQZ-CHWSQXEVSA-N 1 1 362.455 2.610 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1C ZINC000440080057 513243632 /nfs/dbraw/zinc/24/36/32/513243632.db2.gz QJAMHRIVIRAFSB-GXTWGEPZSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000428994675 513243915 /nfs/dbraw/zinc/24/39/15/513243915.db2.gz PJOYOFYKABARLM-JCKWVBRZSA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429022035 513257167 /nfs/dbraw/zinc/25/71/67/513257167.db2.gz RBXIZWHAVKIKAC-JCKWVBRZSA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429024030 513259067 /nfs/dbraw/zinc/25/90/67/513259067.db2.gz GKGYHMQRHGBYCR-YSVLISHTSA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429024028 513260279 /nfs/dbraw/zinc/26/02/79/513260279.db2.gz GKGYHMQRHGBYCR-UKPHBRMFSA-N 1 1 360.458 2.504 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3Cc4cccc(O)c4C3)n2)c1 ZINC000429317164 513337645 /nfs/dbraw/zinc/33/76/45/513337645.db2.gz XPPXCBCZSGPMTN-CYBMUJFWSA-N 1 1 352.350 2.607 20 5 FFBDMO C[C@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+](C2CCC2)C1 ZINC000429370539 513355777 /nfs/dbraw/zinc/35/57/77/513355777.db2.gz FJSMAATWZVLBAN-BEFAXECRSA-N 1 1 372.469 2.506 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194869 513510398 /nfs/dbraw/zinc/51/03/98/513510398.db2.gz JTKFSDLXOZZRIG-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194869 513510404 /nfs/dbraw/zinc/51/04/04/513510404.db2.gz JTKFSDLXOZZRIG-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C1CCN(C)CC1 ZINC000413219385 513527953 /nfs/dbraw/zinc/52/79/53/513527953.db2.gz MJEKWXZPVSRUAK-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C1CCN(C)CC1 ZINC000413219385 513527961 /nfs/dbraw/zinc/52/79/61/513527961.db2.gz MJEKWXZPVSRUAK-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[N@H+](Cc1ncccn1)[C@H]1CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413256298 513551506 /nfs/dbraw/zinc/55/15/06/513551506.db2.gz CHAVZRMXLNFNFR-AWEZNQCLSA-N 1 1 364.409 2.644 20 5 FFBDMO C[N@@H+](Cc1ncccn1)[C@H]1CCN(c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413256298 513551513 /nfs/dbraw/zinc/55/15/13/513551513.db2.gz CHAVZRMXLNFNFR-AWEZNQCLSA-N 1 1 364.409 2.644 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425467145 513581894 /nfs/dbraw/zinc/58/18/94/513581894.db2.gz BIHFCZXPSHOZCX-CYBMUJFWSA-N 1 1 361.236 2.575 20 5 FFBDMO CC(C)OC[C@@H](CO)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425467145 513581896 /nfs/dbraw/zinc/58/18/96/513581896.db2.gz BIHFCZXPSHOZCX-CYBMUJFWSA-N 1 1 361.236 2.575 20 5 FFBDMO CCNC(=O)[C@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000425549379 513634278 /nfs/dbraw/zinc/63/42/78/513634278.db2.gz ZPEOQYSDNFNHDQ-LJQANCHMSA-N 1 1 353.422 2.700 20 5 FFBDMO CCNC(=O)[C@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000425549379 513634284 /nfs/dbraw/zinc/63/42/84/513634284.db2.gz ZPEOQYSDNFNHDQ-LJQANCHMSA-N 1 1 353.422 2.700 20 5 FFBDMO COc1cccc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000435903321 513711659 /nfs/dbraw/zinc/71/16/59/513711659.db2.gz QQDSMACQWQSIRS-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1 ZINC000448257182 513720878 /nfs/dbraw/zinc/72/08/78/513720878.db2.gz QBXOIUQZIOGCOM-UHFFFAOYSA-N 1 1 367.409 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@@H]3O)o2)cc1 ZINC000451413369 513734390 /nfs/dbraw/zinc/73/43/90/513734390.db2.gz GYWMJTHVVZRYPU-OAGGEKHMSA-N 1 1 358.398 2.770 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1 ZINC000448419314 513753761 /nfs/dbraw/zinc/75/37/61/513753761.db2.gz VQIGTTRZBFWOBZ-ZDUSSCGKSA-N 1 1 351.451 2.539 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCC[N@H+]2C2CCCCC2)cc(F)cc1[N+](=O)[O-] ZINC000436230358 513802873 /nfs/dbraw/zinc/80/28/73/513802873.db2.gz HUQXDYGJVBXZHR-AWEZNQCLSA-N 1 1 364.421 2.843 20 5 FFBDMO Cc1cccc(CC[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000449028953 514036684 /nfs/dbraw/zinc/03/66/84/514036684.db2.gz NIGDKXGWGDNEBT-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1cccc([N+](=O)[O-])c1C ZINC000420456578 514153501 /nfs/dbraw/zinc/15/35/01/514153501.db2.gz HLQOMINVRFLALM-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+]Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000420466620 514158703 /nfs/dbraw/zinc/15/87/03/514158703.db2.gz XCQYSUBVXUSSGE-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO Cc1cccc(CC[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000449345882 514175923 /nfs/dbraw/zinc/17/59/23/514175923.db2.gz XNFKKFSVVHOHQH-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](O)[C@@H](CO)C3)o2)c(Cl)c1 ZINC000414561207 514180256 /nfs/dbraw/zinc/18/02/56/514180256.db2.gz SBNZLUUSILYRBG-BZNIZROVSA-N 1 1 366.801 2.683 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)[C@H](CO)C3)o2)c(Cl)c1 ZINC000414561209 514180285 /nfs/dbraw/zinc/18/02/85/514180285.db2.gz SBNZLUUSILYRBG-MEDUHNTESA-N 1 1 366.801 2.683 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000420621028 514204517 /nfs/dbraw/zinc/20/45/17/514204517.db2.gz FNPCXCDWNMPHLI-OAHLLOKOSA-N 1 1 354.410 2.628 20 5 FFBDMO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449455038 514216527 /nfs/dbraw/zinc/21/65/27/514216527.db2.gz QDEHKNKMTXWWEV-SFHVURJKSA-N 1 1 350.415 2.730 20 5 FFBDMO C[C@H]1CN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+](C2CC2)C1 ZINC000452167758 514225588 /nfs/dbraw/zinc/22/55/88/514225588.db2.gz CGVFRKMJDLAOGR-CYBMUJFWSA-N 1 1 363.433 2.954 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000427492953 514232714 /nfs/dbraw/zinc/23/27/14/514232714.db2.gz ONHKAOJZXGBMFQ-GFCCVEGCSA-N 1 1 357.838 2.862 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CCCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000449791132 514352977 /nfs/dbraw/zinc/35/29/77/514352977.db2.gz NSJIURRKMOAUNU-LLVKDONJSA-N 1 1 360.357 2.799 20 5 FFBDMO COc1ccc(CNC(=O)NCC[N@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000444989655 514383686 /nfs/dbraw/zinc/38/36/86/514383686.db2.gz QXEAAKCNDANHRP-UHFFFAOYSA-N 1 1 364.446 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(CN3CCOCC3)cc1)CC2 ZINC000420938797 514389199 /nfs/dbraw/zinc/38/91/99/514389199.db2.gz PRSGBLJGNDRWGC-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(CN3CCOCC3)cc1)CC2 ZINC000420938797 514389205 /nfs/dbraw/zinc/38/92/05/514389205.db2.gz PRSGBLJGNDRWGC-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000420997622 514431122 /nfs/dbraw/zinc/43/11/22/514431122.db2.gz ACXPAYQUMHXREH-SLTAFYQDSA-N 1 1 352.431 2.612 20 5 FFBDMO NC(=O)c1cccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439161712 514502340 /nfs/dbraw/zinc/50/23/40/514502340.db2.gz YALBEKXZZAUSIV-INIZCTEOSA-N 1 1 368.437 2.670 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000475107452 514559733 /nfs/dbraw/zinc/55/97/33/514559733.db2.gz HYXJSNIGDKPBTK-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000475107452 514559738 /nfs/dbraw/zinc/55/97/38/514559738.db2.gz HYXJSNIGDKPBTK-CYBMUJFWSA-N 1 1 359.382 2.735 20 5 FFBDMO C[NH+](C)[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000461398200 514592172 /nfs/dbraw/zinc/59/21/72/514592172.db2.gz FKCNPSHFZNZRHR-GOSISDBHSA-N 1 1 355.394 2.619 20 5 FFBDMO CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475307867 514612883 /nfs/dbraw/zinc/61/28/83/514612883.db2.gz IGHCWKAVUHFAGQ-IBGZPJMESA-N 1 1 353.422 2.870 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000458238089 514653654 /nfs/dbraw/zinc/65/36/54/514653654.db2.gz ZNHFQWBUFVVXML-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)Nc1ccc2c(c1)CCC2 ZINC000488988377 514663103 /nfs/dbraw/zinc/66/31/03/514663103.db2.gz WGRJDOSJOOFOOY-UHFFFAOYSA-N 1 1 369.425 2.556 20 5 FFBDMO Cc1cccc(-c2noc(C[NH+]3CCC(n4ccc([N+](=O)[O-])n4)CC3)n2)c1 ZINC000489014009 514673083 /nfs/dbraw/zinc/67/30/83/514673083.db2.gz QMMRJKSTJGZOLM-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000470957187 514694080 /nfs/dbraw/zinc/69/40/80/514694080.db2.gz FWSWAIOVBZXLOU-OAHLLOKOSA-N 1 1 371.441 2.809 20 5 FFBDMO Cc1cc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC000461775402 514732049 /nfs/dbraw/zinc/73/20/49/514732049.db2.gz MTKGOCFTFPPJCZ-MRXNPFEDSA-N 1 1 359.401 2.873 20 5 FFBDMO C[C@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1 ZINC000498140446 514776044 /nfs/dbraw/zinc/77/60/44/514776044.db2.gz NYRWQJYFJPLWJC-MLGOLLRUSA-N 1 1 367.496 2.606 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CC[C@@H](C)C1 ZINC000484855050 514816275 /nfs/dbraw/zinc/81/62/75/514816275.db2.gz GLUZLZDUXSJTQR-ZBFHGGJFSA-N 1 1 361.442 2.621 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919892 514844975 /nfs/dbraw/zinc/84/49/75/514844975.db2.gz MFPHFDPDUJCQFH-HUUCEWRRSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919892 514845020 /nfs/dbraw/zinc/84/50/20/514845020.db2.gz MFPHFDPDUJCQFH-HUUCEWRRSA-N 1 1 351.447 2.787 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000484919892 514845030 /nfs/dbraw/zinc/84/50/30/514845030.db2.gz MFPHFDPDUJCQFH-HUUCEWRRSA-N 1 1 351.447 2.787 20 5 FFBDMO COCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCO[C@@H]1C ZINC000489481866 514862883 /nfs/dbraw/zinc/86/28/83/514862883.db2.gz NSCXLJHHLAMEBF-DYVFJYSZSA-N 1 1 361.398 2.876 20 5 FFBDMO COCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCO[C@@H]1C ZINC000489481866 514862895 /nfs/dbraw/zinc/86/28/95/514862895.db2.gz NSCXLJHHLAMEBF-DYVFJYSZSA-N 1 1 361.398 2.876 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCOc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000503092631 514916330 /nfs/dbraw/zinc/91/63/30/514916330.db2.gz ALJOWOZZIXNARZ-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000462190958 514932377 /nfs/dbraw/zinc/93/23/77/514932377.db2.gz RNCWPDHHSNVFGO-SCLBCKFNSA-N 1 1 357.385 2.984 20 5 FFBDMO CCC[C@@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000508966578 514968647 /nfs/dbraw/zinc/96/86/47/514968647.db2.gz PBACGYWBXMCIQC-CYBMUJFWSA-N 1 1 357.401 2.806 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000498566550 514972618 /nfs/dbraw/zinc/97/26/18/514972618.db2.gz LIQZVJFBCGBESP-RWMBFGLXSA-N 1 1 369.849 2.957 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000498567941 514974847 /nfs/dbraw/zinc/97/48/47/514974847.db2.gz XIRNHENQJZLUNZ-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000480511651 514982340 /nfs/dbraw/zinc/98/23/40/514982340.db2.gz MILYCYVXEZVTNI-AWEZNQCLSA-N 1 1 371.441 2.703 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000467409382 514998972 /nfs/dbraw/zinc/99/89/72/514998972.db2.gz WSBVLWHOGLXQKL-GHMZBOCLSA-N 1 1 361.489 2.506 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000467409382 514998983 /nfs/dbraw/zinc/99/89/83/514998983.db2.gz WSBVLWHOGLXQKL-GHMZBOCLSA-N 1 1 361.489 2.506 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)CC[C@@H]1C ZINC000498711318 515036193 /nfs/dbraw/zinc/03/61/93/515036193.db2.gz SYBGJLSVFUIZMJ-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[NH+](CC)CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462484047 515076921 /nfs/dbraw/zinc/07/69/21/515076921.db2.gz PKLLDDFFCIAUOB-UHFFFAOYSA-N 1 1 370.258 2.522 20 5 FFBDMO COc1cc(CN(CC[NH+]2CCOCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000490088610 515100300 /nfs/dbraw/zinc/10/03/00/515100300.db2.gz PUQUUJUCPWWHGJ-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000476570283 515108651 /nfs/dbraw/zinc/10/86/51/515108651.db2.gz UKSUVSMCYFDUSD-NSHDSACASA-N 1 1 368.397 2.622 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000456351321 515118303 /nfs/dbraw/zinc/11/83/03/515118303.db2.gz MKZZBBCOUYNYSX-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])nn2C)c1 ZINC000476647541 515140817 /nfs/dbraw/zinc/14/08/17/515140817.db2.gz USEQXZCJFKIDQV-UHFFFAOYSA-N 1 1 373.457 2.880 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000481039720 515183221 /nfs/dbraw/zinc/18/32/21/515183221.db2.gz OBDLGICHQJMMJN-LSDHHAIUSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C ZINC000509638077 515267750 /nfs/dbraw/zinc/26/77/50/515267750.db2.gz BGKJWXXFFZREBG-SRVKXCTJSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C ZINC000509638077 515267756 /nfs/dbraw/zinc/26/77/56/515267756.db2.gz BGKJWXXFFZREBG-SRVKXCTJSA-N 1 1 355.822 2.567 20 5 FFBDMO COc1ccc(OCCN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000472488142 515289009 /nfs/dbraw/zinc/28/90/09/515289009.db2.gz WPIPMWNMYMCHDW-MRXNPFEDSA-N 1 1 363.458 2.646 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2OCC[N@@H+](CC)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000490722782 515291732 /nfs/dbraw/zinc/29/17/32/515291732.db2.gz NWPMMGBGLCPGQC-IRXDYDNUSA-N 1 1 373.457 2.765 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2OCC[N@H+](CC)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000490722782 515291738 /nfs/dbraw/zinc/29/17/38/515291738.db2.gz NWPMMGBGLCPGQC-IRXDYDNUSA-N 1 1 373.457 2.765 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000477147856 515347535 /nfs/dbraw/zinc/34/75/35/515347535.db2.gz ACVWPTVJPJCKIR-UHFFFAOYSA-N 1 1 358.333 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)n1 ZINC000481698514 515429935 /nfs/dbraw/zinc/42/99/35/515429935.db2.gz YWVBRTJETDWUCV-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO CNC(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000468689100 515470790 /nfs/dbraw/zinc/47/07/90/515470790.db2.gz SACJTIWEYNPXEA-LBPRGKRZSA-N 1 1 360.439 2.827 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+](Cc2ccccc2Cl)CC2CC2)c1 ZINC000510224784 515474116 /nfs/dbraw/zinc/47/41/16/515474116.db2.gz VKVCBJBVTVQNTG-MRXNPFEDSA-N 1 1 364.833 2.718 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486488950 515507288 /nfs/dbraw/zinc/50/72/88/515507288.db2.gz PFFPVEXKQULAKS-GFCCVEGCSA-N 1 1 355.385 2.796 20 5 FFBDMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473155603 515518428 /nfs/dbraw/zinc/51/84/28/515518428.db2.gz AZMPEDLFUVRISX-OTYXRUKQSA-N 1 1 369.830 2.960 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454644264 515634756 /nfs/dbraw/zinc/63/47/56/515634756.db2.gz OHVKKPSVJDNAMI-CVEARBPZSA-N 1 1 358.442 2.721 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1CC1 ZINC000457173370 515703498 /nfs/dbraw/zinc/70/34/98/515703498.db2.gz KTUNSGGGWGNVEK-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C(C)(C)C1 ZINC000500508202 515745481 /nfs/dbraw/zinc/74/54/81/515745481.db2.gz NJRHHYCIQUCCOY-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C(C)(C)C1 ZINC000500508202 515745495 /nfs/dbraw/zinc/74/54/95/515745495.db2.gz NJRHHYCIQUCCOY-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511066979 515763517 /nfs/dbraw/zinc/76/35/17/515763517.db2.gz SVDDYOVXOSAVJE-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1cccc(CN(C)C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511066979 515763525 /nfs/dbraw/zinc/76/35/25/515763525.db2.gz SVDDYOVXOSAVJE-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000459796203 515809771 /nfs/dbraw/zinc/80/97/71/515809771.db2.gz PPESSRZYQBRGQF-GBESFXJTSA-N 1 1 373.453 2.573 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459814178 515825295 /nfs/dbraw/zinc/82/52/95/515825295.db2.gz UDHDWCKMHMXBJL-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459814178 515825307 /nfs/dbraw/zinc/82/53/07/515825307.db2.gz UDHDWCKMHMXBJL-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C3(CC3)C2)cc1OC ZINC000494683633 515922844 /nfs/dbraw/zinc/92/28/44/515922844.db2.gz WHLQXCYGDIJTOW-ACJLOTCBSA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C3(CC3)C2)cc1OC ZINC000494683633 515922855 /nfs/dbraw/zinc/92/28/55/515922855.db2.gz WHLQXCYGDIJTOW-ACJLOTCBSA-N 1 1 364.442 2.985 20 5 FFBDMO CCc1cc(N[C@H]2CCC[N@H+](CC)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506977439 516043209 /nfs/dbraw/zinc/04/32/09/516043209.db2.gz NCJATENJXAVNSA-INIZCTEOSA-N 1 1 355.442 2.932 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[C@H]1C ZINC000487959907 516053126 /nfs/dbraw/zinc/05/31/26/516053126.db2.gz SJHNMFFPFCZGFS-PBHICJAKSA-N 1 1 361.442 2.621 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000460203428 516066538 /nfs/dbraw/zinc/06/65/38/516066538.db2.gz IZLRHPQMCCAQAQ-INIZCTEOSA-N 1 1 356.430 2.546 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000507096257 516088359 /nfs/dbraw/zinc/08/83/59/516088359.db2.gz BWLOHORGJHZSLS-UHFFFAOYSA-N 1 1 356.426 2.704 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N(C)CC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000474564499 516097025 /nfs/dbraw/zinc/09/70/25/516097025.db2.gz TZPSEJBHPHFXPL-HNNXBMFYSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccncc4)CC3)nc2c1 ZINC000460348420 516125283 /nfs/dbraw/zinc/12/52/83/516125283.db2.gz FZTPDCPREVTFKX-UHFFFAOYSA-N 1 1 352.398 2.578 20 5 FFBDMO C[C@H](CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000501510802 516132000 /nfs/dbraw/zinc/13/20/00/516132000.db2.gz GENIVHUUFMKSFQ-LSDHHAIUSA-N 1 1 363.462 2.569 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285500 516156856 /nfs/dbraw/zinc/15/68/56/516156856.db2.gz VDXAAVBWHNIRGJ-KUHUBIRLSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285500 516156866 /nfs/dbraw/zinc/15/68/66/516156866.db2.gz VDXAAVBWHNIRGJ-KUHUBIRLSA-N 1 1 369.421 2.941 20 5 FFBDMO CCN1CCN([C@@H]2CC[N@H+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169869 516158207 /nfs/dbraw/zinc/15/82/07/516158207.db2.gz LFPLDUYDOIDYMO-MBGNVJMVSA-N 1 1 358.486 2.710 20 5 FFBDMO CCN1CCN([C@@H]2CC[N@@H+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169869 516158213 /nfs/dbraw/zinc/15/82/13/516158213.db2.gz LFPLDUYDOIDYMO-MBGNVJMVSA-N 1 1 358.486 2.710 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000512118135 516158982 /nfs/dbraw/zinc/15/89/82/516158982.db2.gz GNSNPHMBQWVICG-NWDGAFQWSA-N 1 1 367.833 2.782 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488666285 516284272 /nfs/dbraw/zinc/28/42/72/516284272.db2.gz FLSXRSNTAGFSCU-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000488666285 516284278 /nfs/dbraw/zinc/28/42/78/516284278.db2.gz FLSXRSNTAGFSCU-GOSISDBHSA-N 1 1 373.384 2.850 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000488748221 516299659 /nfs/dbraw/zinc/29/96/59/516299659.db2.gz KAQGBVBDNNWCTE-XJKCOSOUSA-N 1 1 361.442 2.856 20 5 FFBDMO COC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000488748786 516300278 /nfs/dbraw/zinc/30/02/78/516300278.db2.gz HORQCXVJBQHLFO-OGHNNQOOSA-N 1 1 361.442 2.856 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1C[C@@H](OCC)C1(C)C ZINC000535583774 516411299 /nfs/dbraw/zinc/41/12/99/516411299.db2.gz WEBKUOHWMGCBRD-JKSUJKDBSA-N 1 1 351.447 2.672 20 5 FFBDMO C[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000517718996 516423781 /nfs/dbraw/zinc/42/37/81/516423781.db2.gz GIKBXKPRPWTQHC-OAHLLOKOSA-N 1 1 369.421 2.537 20 5 FFBDMO C[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000517718996 516423790 /nfs/dbraw/zinc/42/37/90/516423790.db2.gz GIKBXKPRPWTQHC-OAHLLOKOSA-N 1 1 369.421 2.537 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000543903476 516490590 /nfs/dbraw/zinc/49/05/90/516490590.db2.gz ICUXCKCXMLMMFN-OKILXGFUSA-N 1 1 365.430 2.683 20 5 FFBDMO COc1cc(C[N@@H+](Cc2ccccc2)C[C@H](C)O)c([N+](=O)[O-])cc1OC ZINC000535804936 516516801 /nfs/dbraw/zinc/51/68/01/516516801.db2.gz HFZCTELWNGCBNA-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@H+](Cc2ccccc2)C[C@H](C)O)c([N+](=O)[O-])cc1OC ZINC000535804936 516516804 /nfs/dbraw/zinc/51/68/04/516516804.db2.gz HFZCTELWNGCBNA-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO Cc1ccnc(N2CCN(CC[N@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000523755361 516568807 /nfs/dbraw/zinc/56/88/07/516568807.db2.gz TWUFZRYFYHSKHB-UHFFFAOYSA-N 1 1 369.469 2.552 20 5 FFBDMO CCc1cc(NCC2=CC[N@@H+](C)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000540494111 516584124 /nfs/dbraw/zinc/58/41/24/516584124.db2.gz UTPWSDDBXAYSCT-UHFFFAOYSA-N 1 1 353.426 2.710 20 5 FFBDMO C[C@@]1(c2ccccc2)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544144007 516612038 /nfs/dbraw/zinc/61/20/38/516612038.db2.gz MEFUQULTKIVYCV-YLJYHZDGSA-N 1 1 356.422 2.998 20 5 FFBDMO CCc1ccc([C@H](NC[C@@H]2C[N@@H+](C)CCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544360842 516721755 /nfs/dbraw/zinc/72/17/55/516721755.db2.gz SDLPLYGWONDUJW-YLJYHZDGSA-N 1 1 372.469 2.675 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@H+](C)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000544393284 516739825 /nfs/dbraw/zinc/73/98/25/516739825.db2.gz FNFIUCLANFGYRZ-KOLCDFICSA-N 1 1 357.252 2.837 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000544392829 516739194 /nfs/dbraw/zinc/73/91/94/516739194.db2.gz BFBMFHMWOUIOFE-MWLCHTKSSA-N 1 1 357.252 2.980 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441005 516760490 /nfs/dbraw/zinc/76/04/90/516760490.db2.gz UYRCYIHUWTWMDY-JJRVBVJISA-N 1 1 363.458 2.959 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441005 516760496 /nfs/dbraw/zinc/76/04/96/516760496.db2.gz UYRCYIHUWTWMDY-JJRVBVJISA-N 1 1 363.458 2.959 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000518786364 516773877 /nfs/dbraw/zinc/77/38/77/516773877.db2.gz YTYDEGSSGRPEOG-CYBMUJFWSA-N 1 1 363.414 2.708 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000518833756 516792371 /nfs/dbraw/zinc/79/23/71/516792371.db2.gz RCRMYMIPRFFEBW-YUTCNCBUSA-N 1 1 367.833 2.759 20 5 FFBDMO C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000524708485 516796133 /nfs/dbraw/zinc/79/61/33/516796133.db2.gz KQUWLAKUHANKEI-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)c1 ZINC000555376947 516906322 /nfs/dbraw/zinc/90/63/22/516906322.db2.gz GWQMHGGYWJMCQV-OAHLLOKOSA-N 1 1 373.375 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2CN2CCOCC2)c1 ZINC000555376947 516906331 /nfs/dbraw/zinc/90/63/31/516906331.db2.gz GWQMHGGYWJMCQV-OAHLLOKOSA-N 1 1 373.375 2.910 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N[C@H]1CCOc2ccccc21 ZINC000558739218 516923093 /nfs/dbraw/zinc/92/30/93/516923093.db2.gz GQFULRIQOIXFJQ-SFHVURJKSA-N 1 1 369.421 2.709 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)N[C@H]1CCOc2ccccc21 ZINC000558739218 516923103 /nfs/dbraw/zinc/92/31/03/516923103.db2.gz GQFULRIQOIXFJQ-SFHVURJKSA-N 1 1 369.421 2.709 20 5 FFBDMO Cn1nc(C(C)(C)C)cc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558740398 516923409 /nfs/dbraw/zinc/92/34/09/516923409.db2.gz IIAAFCFBUSMSPI-UHFFFAOYSA-N 1 1 373.457 2.739 20 5 FFBDMO Cn1nc(C(C)(C)C)cc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558740398 516923421 /nfs/dbraw/zinc/92/34/21/516923421.db2.gz IIAAFCFBUSMSPI-UHFFFAOYSA-N 1 1 373.457 2.739 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000555469442 516937374 /nfs/dbraw/zinc/93/73/74/516937374.db2.gz MVSSOTSPSALCGR-LLVKDONJSA-N 1 1 358.236 2.782 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[C@]3(C2)CCC[N@@H+](C)C3)cccc1[N+](=O)[O-] ZINC000555598145 517004785 /nfs/dbraw/zinc/00/47/85/517004785.db2.gz PBWDGTYUBDKFDD-HNAYVOBHSA-N 1 1 360.458 2.648 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000532540900 517025844 /nfs/dbraw/zinc/02/58/44/517025844.db2.gz QNAQJGOIOBHCHD-IBGZPJMESA-N 1 1 374.485 2.752 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c([N+](=O)[O-])c1 ZINC000514752253 517038264 /nfs/dbraw/zinc/03/82/64/517038264.db2.gz QGEJOVSOYGFIOQ-BBRMVZONSA-N 1 1 370.409 2.851 20 5 FFBDMO CN1CC[N@H+](C)C[C@@H]1c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000545089764 517047766 /nfs/dbraw/zinc/04/77/66/517047766.db2.gz KVOMMGYEPHQCRD-GFCCVEGCSA-N 1 1 371.319 2.582 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000545089764 517047775 /nfs/dbraw/zinc/04/77/75/517047775.db2.gz KVOMMGYEPHQCRD-GFCCVEGCSA-N 1 1 371.319 2.582 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000555665865 517055401 /nfs/dbraw/zinc/05/54/01/517055401.db2.gz COOICTMBKXLTII-TXEJJXNPSA-N 1 1 373.400 2.772 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc(NC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000548885520 517279387 /nfs/dbraw/zinc/27/93/87/517279387.db2.gz KEHKFHPQEPPGOM-SFHVURJKSA-N 1 1 368.437 2.986 20 5 FFBDMO C[C@@H]1C[C@H](CCNC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000533114547 517303105 /nfs/dbraw/zinc/30/31/05/517303105.db2.gz YBEQVECVFSDZRX-WBVHZDCISA-N 1 1 370.453 2.964 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1F)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000542210165 517437847 /nfs/dbraw/zinc/43/78/47/517437847.db2.gz PZSHDCWBZMLSFS-AWEZNQCLSA-N 1 1 352.337 2.745 20 5 FFBDMO C[N@H+](Cc1ccc(F)cc1F)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000542210165 517437859 /nfs/dbraw/zinc/43/78/59/517437859.db2.gz PZSHDCWBZMLSFS-AWEZNQCLSA-N 1 1 352.337 2.745 20 5 FFBDMO Cc1c(Br)c(=O)n(CC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000542221319 517444825 /nfs/dbraw/zinc/44/48/25/517444825.db2.gz YENNRGGPIDOFIX-UHFFFAOYSA-N 1 1 358.236 2.559 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)n1 ZINC000552961448 517455505 /nfs/dbraw/zinc/45/55/05/517455505.db2.gz CWTDJHOTTDVMHW-BETUJISGSA-N 1 1 350.419 2.556 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000556588312 517506086 /nfs/dbraw/zinc/50/60/86/517506086.db2.gz CDNKYTHZSKPTBL-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000556588312 517506094 /nfs/dbraw/zinc/50/60/94/517506094.db2.gz CDNKYTHZSKPTBL-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000556588310 517506238 /nfs/dbraw/zinc/50/62/38/517506238.db2.gz CDNKYTHZSKPTBL-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000556588310 517506246 /nfs/dbraw/zinc/50/62/46/517506246.db2.gz CDNKYTHZSKPTBL-IBGZPJMESA-N 1 1 353.422 2.523 20 5 FFBDMO CC[C@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000553161374 517552079 /nfs/dbraw/zinc/55/20/79/517552079.db2.gz MZVSQYPVUIUSQQ-INIZCTEOSA-N 1 1 368.437 2.795 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000553210998 517578027 /nfs/dbraw/zinc/57/80/27/517578027.db2.gz ZXPBVQOUZNYKQY-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO C[NH+](C)CCOc1cc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])ccn1 ZINC000521370497 517709043 /nfs/dbraw/zinc/70/90/43/517709043.db2.gz VVSPKIUYPMQHRK-QGZVFWFLSA-N 1 1 356.426 2.707 20 5 FFBDMO COc1cc(C[N@@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000549829564 517733242 /nfs/dbraw/zinc/73/32/42/517733242.db2.gz XFTYVXYFGKDIHP-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1cc(C[N@H+]2CCCNC(=O)[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000549829564 517733251 /nfs/dbraw/zinc/73/32/51/517733251.db2.gz XFTYVXYFGKDIHP-GOSISDBHSA-N 1 1 369.421 2.537 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1)CC(C)C ZINC000556951725 517770330 /nfs/dbraw/zinc/77/03/30/517770330.db2.gz QBFQLYHWYCHQEF-UHFFFAOYSA-N 1 1 351.451 2.538 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000549974705 517811470 /nfs/dbraw/zinc/81/14/70/517811470.db2.gz NLFOAMIAKQGOCF-PHIMTYICSA-N 1 1 359.373 2.729 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553768744 517892865 /nfs/dbraw/zinc/89/28/65/517892865.db2.gz SZTYJEMKCCNRTC-HEHGZKQESA-N 1 1 361.442 2.714 20 5 FFBDMO CC(C)(C)[N@H+]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])cn3)sc2C1 ZINC000521996269 517938306 /nfs/dbraw/zinc/93/83/06/517938306.db2.gz HORCXQFRTFITMO-UHFFFAOYSA-N 1 1 361.427 2.855 20 5 FFBDMO CCOc1cc(C(=O)N2[C@H](C)C[N@H+](CC)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000516994180 517965521 /nfs/dbraw/zinc/96/55/21/517965521.db2.gz NNJWTYFMXVBIAA-BETUJISGSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000543437169 518091267 /nfs/dbraw/zinc/09/12/67/518091267.db2.gz SAWBGHOSHTYCNP-JQWIXIFHSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000543437169 518091275 /nfs/dbraw/zinc/09/12/75/518091275.db2.gz SAWBGHOSHTYCNP-JQWIXIFHSA-N 1 1 355.236 2.591 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000563794615 518126691 /nfs/dbraw/zinc/12/66/91/518126691.db2.gz WAVFVITXKQVYDS-HNNXBMFYSA-N 1 1 350.463 2.899 20 5 FFBDMO CCc1ccc(-c2noc([C@@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)cc1 ZINC000543548824 518134382 /nfs/dbraw/zinc/13/43/82/518134382.db2.gz LRDSFJXWNRMPHQ-GFCCVEGCSA-N 1 1 356.386 2.755 20 5 FFBDMO C[NH+](C)CCOc1cnccc1CNC/C=C\c1ccccc1[N+](=O)[O-] ZINC000584195033 518222848 /nfs/dbraw/zinc/22/28/48/518222848.db2.gz KDFZBJVFLUSXHV-ALCCZGGFSA-N 1 1 356.426 2.733 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000578569179 518269275 /nfs/dbraw/zinc/26/92/75/518269275.db2.gz MJMZNQQUDIBHSM-UKRRQHHQSA-N 1 1 373.457 2.743 20 5 FFBDMO CN(C)Cc1ccc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1F ZINC000569803329 518299985 /nfs/dbraw/zinc/29/99/85/518299985.db2.gz NVFFAIZQGHZOCU-UHFFFAOYSA-N 1 1 374.416 2.914 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CC[C@@H](O)C1 ZINC000564587239 518514591 /nfs/dbraw/zinc/51/45/91/518514591.db2.gz XXTMKHSIQTYEBR-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(N3CC[N@H+]4CCCC[C@@H]4C3)n2C2CC2)cc1 ZINC000576354135 518553098 /nfs/dbraw/zinc/55/30/98/518553098.db2.gz OLLQJLFQBCSPCD-QGZVFWFLSA-N 1 1 368.441 2.863 20 5 FFBDMO O=C(CC[NH2+]Cc1ncc(C(F)(F)F)cn1)Nc1ccccc1[N+](=O)[O-] ZINC000579463896 518694201 /nfs/dbraw/zinc/69/42/01/518694201.db2.gz PZVKMVOPNRCRHW-UHFFFAOYSA-N 1 1 369.303 2.522 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000567771053 518702321 /nfs/dbraw/zinc/70/23/21/518702321.db2.gz OCRJMEHEABPQPG-UKRRQHHQSA-N 1 1 369.487 2.651 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000570736245 518754355 /nfs/dbraw/zinc/75/43/55/518754355.db2.gz LFCIQQSHVPZGKJ-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c1 ZINC000570886858 518824998 /nfs/dbraw/zinc/82/49/98/518824998.db2.gz MTDIYGSDRKTDSF-UHFFFAOYSA-N 1 1 361.442 2.942 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000582859141 518957570 /nfs/dbraw/zinc/95/75/70/518957570.db2.gz SRMPIDWTWDLWAQ-GFCCVEGCSA-N 1 1 374.384 2.842 20 5 FFBDMO O=[N+]([O-])c1cc(I)cc(C[NH2+]Cc2ccccn2)c1 ZINC000589309562 518978532 /nfs/dbraw/zinc/97/85/32/518978532.db2.gz SVIJFYOCZMBWBD-UHFFFAOYSA-N 1 1 369.162 2.884 20 5 FFBDMO C[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCCC[C@H]1C ZINC000565502248 518988223 /nfs/dbraw/zinc/98/82/23/518988223.db2.gz ABTQXLHMEPZTKM-VXGBXAGGSA-N 1 1 355.385 2.795 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000580090199 519003229 /nfs/dbraw/zinc/00/32/29/519003229.db2.gz NWNNUIHVWNSWFZ-MRXNPFEDSA-N 1 1 366.421 2.677 20 5 FFBDMO Cc1ccnc([C@@H]2CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)c1 ZINC000580090199 519003236 /nfs/dbraw/zinc/00/32/36/519003236.db2.gz NWNNUIHVWNSWFZ-MRXNPFEDSA-N 1 1 366.421 2.677 20 5 FFBDMO CCCC[C@@H](C(=O)Nc1cc(C)on1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565544984 519010728 /nfs/dbraw/zinc/01/07/28/519010728.db2.gz PTNKTZWULQBNLU-KRWDZBQOSA-N 1 1 374.441 2.985 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509785 519075834 /nfs/dbraw/zinc/07/58/34/519075834.db2.gz ZVXNFKRHBGCQSM-JQWIXIFHSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509785 519075841 /nfs/dbraw/zinc/07/58/41/519075841.db2.gz ZVXNFKRHBGCQSM-JQWIXIFHSA-N 1 1 373.862 2.639 20 5 FFBDMO NC(=O)c1cccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000574304255 519090014 /nfs/dbraw/zinc/09/00/14/519090014.db2.gz XHUZDTRFTCEYDG-OAHLLOKOSA-N 1 1 354.410 2.628 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000574329648 519102519 /nfs/dbraw/zinc/10/25/19/519102519.db2.gz DWCNDCFYUYSDCT-MRXNPFEDSA-N 1 1 356.426 2.801 20 5 FFBDMO CN(CCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000580321319 519118791 /nfs/dbraw/zinc/11/87/91/519118791.db2.gz CDJYJTHIQPJNMK-UHFFFAOYSA-N 1 1 355.442 2.638 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c2ccccc2C1 ZINC000565796850 519136896 /nfs/dbraw/zinc/13/68/96/519136896.db2.gz GPGMSGYKNAUOLZ-UHFFFAOYSA-N 1 1 361.348 2.894 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c2ccccc2C1 ZINC000565796850 519136900 /nfs/dbraw/zinc/13/69/00/519136900.db2.gz GPGMSGYKNAUOLZ-UHFFFAOYSA-N 1 1 361.348 2.894 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H](C)C1 ZINC000574473714 519172037 /nfs/dbraw/zinc/17/20/37/519172037.db2.gz FZTPMPAMXGDTQG-JCGVRSQUSA-N 1 1 356.426 2.878 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590229343 519178297 /nfs/dbraw/zinc/17/82/97/519178297.db2.gz GQSKORACIYRODI-NSHDSACASA-N 1 1 357.332 2.828 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c1 ZINC000590377235 519209599 /nfs/dbraw/zinc/20/95/99/519209599.db2.gz AABSMYKNMSUTCD-GOSISDBHSA-N 1 1 350.415 2.612 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@H]4C[N@@H+](C)C[C@@H]43)cc2[N+](=O)[O-])C1 ZINC000590447594 519235197 /nfs/dbraw/zinc/23/51/97/519235197.db2.gz ZLQTZWLYMKXIPQ-ALKREAHSSA-N 1 1 372.469 2.607 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1 ZINC000590656888 519303645 /nfs/dbraw/zinc/30/36/45/519303645.db2.gz FSEXDIZUDBNOHP-KBAYOESNSA-N 1 1 362.426 2.897 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H](O)[C@H](C3CCCC3)C1)OCCO2 ZINC000590971999 519464419 /nfs/dbraw/zinc/46/44/19/519464419.db2.gz WTZBCUUGQUTPRL-DOTOQJQBSA-N 1 1 362.426 2.739 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602881312 519946950 /nfs/dbraw/zinc/94/69/50/519946950.db2.gz GKALNNQSFROIFG-OAHLLOKOSA-N 1 1 352.398 2.532 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CC[N@@H+](CC3CC3)C2)ncc1[N+](=O)[O-] ZINC000612444226 519961374 /nfs/dbraw/zinc/96/13/74/519961374.db2.gz KXMOQVQEKGRADQ-LLVKDONJSA-N 1 1 355.236 2.957 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594482972 519992185 /nfs/dbraw/zinc/99/21/85/519992185.db2.gz GSLZUZDGZIDMNJ-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1C(F)(F)F)N1CC[NH+](CCCF)CC1 ZINC000600075432 520032208 /nfs/dbraw/zinc/03/22/08/520032208.db2.gz DRQKXSDCBUUPRX-UHFFFAOYSA-N 1 1 363.311 2.731 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000600252558 520159478 /nfs/dbraw/zinc/15/94/78/520159478.db2.gz JSYLLJUVZJSINE-LJQANCHMSA-N 1 1 368.437 2.972 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1 ZINC000600298795 520189813 /nfs/dbraw/zinc/18/98/13/520189813.db2.gz MPZJLODTTYRVHY-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1 ZINC000600298795 520189821 /nfs/dbraw/zinc/18/98/21/520189821.db2.gz MPZJLODTTYRVHY-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C2 ZINC000597711499 520191759 /nfs/dbraw/zinc/19/17/59/520191759.db2.gz TZBKDTPYZKXWBR-LJQANCHMSA-N 1 1 359.426 2.502 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000600314173 520200776 /nfs/dbraw/zinc/20/07/76/520200776.db2.gz MFOBVCBHZZHDFA-QWHCGFSZSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000609133336 520202094 /nfs/dbraw/zinc/20/20/94/520202094.db2.gz NDXFLWLYQVYDLV-UHFFFAOYSA-N 1 1 355.394 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000609133336 520202098 /nfs/dbraw/zinc/20/20/98/520202098.db2.gz NDXFLWLYQVYDLV-UHFFFAOYSA-N 1 1 355.394 2.648 20 5 FFBDMO CC(C)(C)NC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130370 520205583 /nfs/dbraw/zinc/20/55/83/520205583.db2.gz FOXLEMLVZIXYDE-WKILWMFISA-N 1 1 363.458 2.615 20 5 FFBDMO CC(C)(C)NC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130370 520205588 /nfs/dbraw/zinc/20/55/88/520205588.db2.gz FOXLEMLVZIXYDE-WKILWMFISA-N 1 1 363.458 2.615 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000592154804 520233144 /nfs/dbraw/zinc/23/31/44/520233144.db2.gz KCAQAYMZGBWOGM-INIZCTEOSA-N 1 1 357.385 2.872 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)C(=O)N(C)C ZINC000595015384 520256495 /nfs/dbraw/zinc/25/64/95/520256495.db2.gz DEXNOHVNCOFEHD-RDTXWAMCSA-N 1 1 371.437 2.954 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000595048851 520270690 /nfs/dbraw/zinc/27/06/90/520270690.db2.gz RQAZIEOAYOASLM-GJZGRUSLSA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000597857638 520287317 /nfs/dbraw/zinc/28/73/17/520287317.db2.gz HSUKRNBUEDPMML-GFCCVEGCSA-N 1 1 370.247 2.960 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000609354814 520293338 /nfs/dbraw/zinc/29/33/38/520293338.db2.gz LSFOHGKDQMZRCX-BETUJISGSA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000609509297 520336609 /nfs/dbraw/zinc/33/66/09/520336609.db2.gz NMUUMCBCYDROIU-FZMZJTMJSA-N 1 1 367.833 2.711 20 5 FFBDMO CCN(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597945580 520344209 /nfs/dbraw/zinc/34/42/09/520344209.db2.gz ITDLLUNPUSVAKO-YPMHNXCESA-N 1 1 355.822 2.568 20 5 FFBDMO COc1ccc(CNC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000609547914 520352646 /nfs/dbraw/zinc/35/26/46/520352646.db2.gz OATOXVCNTBQZHY-AWEZNQCLSA-N 1 1 369.421 2.666 20 5 FFBDMO COc1ccc(CNC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000609547914 520352655 /nfs/dbraw/zinc/35/26/55/520352655.db2.gz OATOXVCNTBQZHY-AWEZNQCLSA-N 1 1 369.421 2.666 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000609599234 520373837 /nfs/dbraw/zinc/37/38/37/520373837.db2.gz GWTLCHPDKHVJCE-HNNXBMFYSA-N 1 1 364.446 2.537 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@@]2(CO)CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000609625535 520384819 /nfs/dbraw/zinc/38/48/19/520384819.db2.gz UZZVXBOFQPTBSW-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000609625535 520384823 /nfs/dbraw/zinc/38/48/23/520384823.db2.gz UZZVXBOFQPTBSW-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO Cc1nn(C)c(NCC2([N@H+]3CCOC(C)(C)C3)CCCCC2)c1[N+](=O)[O-] ZINC000609631115 520387656 /nfs/dbraw/zinc/38/76/56/520387656.db2.gz IZGFHCHUNKPVEZ-UHFFFAOYSA-N 1 1 365.478 2.862 20 5 FFBDMO COc1cccc(SCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000595288620 520387802 /nfs/dbraw/zinc/38/78/02/520387802.db2.gz QIKPTMZMGPHRSN-UHFFFAOYSA-N 1 1 374.466 2.913 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)n2)c1 ZINC000592492566 520416577 /nfs/dbraw/zinc/41/65/77/520416577.db2.gz AOLFLJXJFGSSBK-JKSUJKDBSA-N 1 1 371.441 2.856 20 5 FFBDMO Cc1noc(C[NH+]2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000595370354 520434217 /nfs/dbraw/zinc/43/42/17/520434217.db2.gz KQSRVYCCTITKAM-UHFFFAOYSA-N 1 1 362.361 2.881 20 5 FFBDMO CC(C)(C)C(=O)N1CCC[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000595424454 520463652 /nfs/dbraw/zinc/46/36/52/520463652.db2.gz MSVZSDPJGYAHIC-CQSZACIVSA-N 1 1 360.458 2.633 20 5 FFBDMO CC(C)(C)C(=O)N1CCC[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000595424454 520463656 /nfs/dbraw/zinc/46/36/56/520463656.db2.gz MSVZSDPJGYAHIC-CQSZACIVSA-N 1 1 360.458 2.633 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595439142 520471585 /nfs/dbraw/zinc/47/15/85/520471585.db2.gz FTGZMGZZKWEJDV-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595439142 520471590 /nfs/dbraw/zinc/47/15/90/520471590.db2.gz FTGZMGZZKWEJDV-UHFFFAOYSA-N 1 1 362.357 2.918 20 5 FFBDMO CC(C)(CO)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccnc1 ZINC000595498523 520509104 /nfs/dbraw/zinc/50/91/04/520509104.db2.gz DPVYWCAXEGGQMO-KRWDZBQOSA-N 1 1 355.398 2.716 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](c1cccnc1)C(C)(C)CO ZINC000595498646 520510874 /nfs/dbraw/zinc/51/08/74/520510874.db2.gz HOEJHBRQWBXJAG-GOSISDBHSA-N 1 1 372.425 2.586 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000610044964 520515614 /nfs/dbraw/zinc/51/56/14/520515614.db2.gz KEDNKCLDFQKQDR-GFCCVEGCSA-N 1 1 368.231 2.666 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000610100367 520539753 /nfs/dbraw/zinc/53/97/53/520539753.db2.gz WYQVHIKUZLVESH-ROUUACIJSA-N 1 1 360.458 2.844 20 5 FFBDMO C[N@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595554287 520549499 /nfs/dbraw/zinc/54/94/99/520549499.db2.gz UHPXOZDQJRRSOD-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595554287 520549510 /nfs/dbraw/zinc/54/95/10/520549510.db2.gz UHPXOZDQJRRSOD-UHFFFAOYSA-N 1 1 371.368 2.852 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000610129634 520552699 /nfs/dbraw/zinc/55/26/99/520552699.db2.gz VOVCXNLGXULQHT-NWDGAFQWSA-N 1 1 351.378 2.949 20 5 FFBDMO Cc1ccc(S(=O)(=O)Nc2cccc3c2CC[N@@H+](C)C3)cc1[N+](=O)[O-] ZINC000604490767 520577406 /nfs/dbraw/zinc/57/74/06/520577406.db2.gz NSAKRBXDDSYWRS-UHFFFAOYSA-N 1 1 361.423 2.692 20 5 FFBDMO Cc1ccc(S(=O)(=O)Nc2cccc3c2CC[N@H+](C)C3)cc1[N+](=O)[O-] ZINC000604490767 520577410 /nfs/dbraw/zinc/57/74/10/520577410.db2.gz NSAKRBXDDSYWRS-UHFFFAOYSA-N 1 1 361.423 2.692 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000610296594 520626076 /nfs/dbraw/zinc/62/60/76/520626076.db2.gz HCJNPXLNNBGDAP-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000595659502 520628592 /nfs/dbraw/zinc/62/85/92/520628592.db2.gz NPHNCJQIMGVWTN-UHFFFAOYSA-N 1 1 370.240 2.920 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(C(=O)OCC)cc([N+](=O)[O-])c1 ZINC000598465669 520629967 /nfs/dbraw/zinc/62/99/67/520629967.db2.gz HQWCWKGTHPUIDN-UHFFFAOYSA-N 1 1 365.430 2.622 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670798 520636625 /nfs/dbraw/zinc/63/66/25/520636625.db2.gz DLUZKWOKUDSBLL-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595670798 520636630 /nfs/dbraw/zinc/63/66/30/520636630.db2.gz DLUZKWOKUDSBLL-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595752086 520700123 /nfs/dbraw/zinc/70/01/23/520700123.db2.gz SCEAAYIRRBNOKB-KZULUSFZSA-N 1 1 358.398 2.943 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000610476289 520704722 /nfs/dbraw/zinc/70/47/22/520704722.db2.gz VASYXCZOHKUADB-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@@H](CC)CO1 ZINC000593059998 520715050 /nfs/dbraw/zinc/71/50/50/520715050.db2.gz VAWQTONCGXKLJK-UONOGXRCSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cccc([N+](=O)[O-])c1N ZINC000610520616 520724858 /nfs/dbraw/zinc/72/48/58/520724858.db2.gz OPUXCAISCPMJNB-UHFFFAOYSA-N 1 1 351.366 2.601 20 5 FFBDMO C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593088503 520735785 /nfs/dbraw/zinc/73/57/85/520735785.db2.gz FMMJHHBRNWWRLQ-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593088503 520735793 /nfs/dbraw/zinc/73/57/93/520735793.db2.gz FMMJHHBRNWWRLQ-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593088503 520735800 /nfs/dbraw/zinc/73/58/00/520735800.db2.gz FMMJHHBRNWWRLQ-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c1[N+](=O)[O-] ZINC000598627702 520751226 /nfs/dbraw/zinc/75/12/26/520751226.db2.gz XQUMAXHIDPYDHV-CJNGLKHVSA-N 1 1 370.409 2.851 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595834421 520755876 /nfs/dbraw/zinc/75/58/76/520755876.db2.gz ZKYYICYADDGLBE-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](Oc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595834421 520755883 /nfs/dbraw/zinc/75/58/83/520755883.db2.gz ZKYYICYADDGLBE-GOSISDBHSA-N 1 1 355.394 2.711 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595836686 520757317 /nfs/dbraw/zinc/75/73/17/520757317.db2.gz YEEMWFUUHDQLHZ-DGCLKSJQSA-N 1 1 372.368 2.716 20 5 FFBDMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000595850481 520766990 /nfs/dbraw/zinc/76/69/90/520766990.db2.gz DUXOJLWKLFZTPW-JGZJWPJOSA-N 1 1 374.340 2.588 20 5 FFBDMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000595850481 520766999 /nfs/dbraw/zinc/76/69/99/520766999.db2.gz DUXOJLWKLFZTPW-JGZJWPJOSA-N 1 1 374.340 2.588 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH2+]Cc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000598716255 520806377 /nfs/dbraw/zinc/80/63/77/520806377.db2.gz FCZLOEAPICJRTO-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO CCOc1cc(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000593187404 520811071 /nfs/dbraw/zinc/81/10/71/520811071.db2.gz KCGOVPXLLHNWAQ-AGIUHOORSA-N 1 1 365.430 2.555 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)CC1 ZINC000598770548 520838593 /nfs/dbraw/zinc/83/85/93/520838593.db2.gz YGWSTXYDHPAJSD-UHFFFAOYSA-N 1 1 374.485 2.999 20 5 FFBDMO CC[N@@H+](CCCNC(=O)CCn1cc([N+](=O)[O-])nc1C)C1CCCCC1 ZINC000593251902 520858794 /nfs/dbraw/zinc/85/87/94/520858794.db2.gz VVGWANCEGJDTHY-UHFFFAOYSA-N 1 1 365.478 2.651 20 5 FFBDMO O=[N+]([O-])c1cncc(Cl)c1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000596062414 520889269 /nfs/dbraw/zinc/88/92/69/520889269.db2.gz QSKQRRZJCDYLPM-UHFFFAOYSA-N 1 1 362.817 2.509 20 5 FFBDMO Cc1cc(NCc2ccc(C(=O)N3CC[NH+](C)CC3)cc2)c([N+](=O)[O-])s1 ZINC000596077356 520897667 /nfs/dbraw/zinc/89/76/67/520897667.db2.gz UUJNKOLVODIALW-UHFFFAOYSA-N 1 1 374.466 2.964 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000593316805 520905318 /nfs/dbraw/zinc/90/53/18/520905318.db2.gz XSTOSIDBOQRWFF-ZSZQSSIHSA-N 1 1 363.458 2.712 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593324499 520911806 /nfs/dbraw/zinc/91/18/06/520911806.db2.gz WQKCCLSWJUJFJZ-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593324499 520911809 /nfs/dbraw/zinc/91/18/09/520911809.db2.gz WQKCCLSWJUJFJZ-KRWDZBQOSA-N 1 1 369.421 2.602 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596123943 520927760 /nfs/dbraw/zinc/92/77/60/520927760.db2.gz SZCMKPFUIUUJMM-LLVKDONJSA-N 1 1 353.806 2.708 20 5 FFBDMO Cc1cc(N[C@@H](C)C[NH+]2CCN(c3ccccn3)CC2)c([N+](=O)[O-])s1 ZINC000596131214 520931818 /nfs/dbraw/zinc/93/18/18/520931818.db2.gz KDXYPHBOVHZIGT-ZDUSSCGKSA-N 1 1 361.471 2.982 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599025095 520987452 /nfs/dbraw/zinc/98/74/52/520987452.db2.gz ZOJVUKFJLORPPG-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO Cn1c[nH+]cc1CCOc1ccc(I)cc1[N+](=O)[O-] ZINC000596270112 521002117 /nfs/dbraw/zinc/00/21/17/521002117.db2.gz IEZZYFVPGFBRKQ-UHFFFAOYSA-N 1 1 373.150 2.554 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000611185038 521029574 /nfs/dbraw/zinc/02/95/74/521029574.db2.gz OOVYGDWAERFRHL-YLJYHZDGSA-N 1 1 371.437 2.856 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000599157264 521061592 /nfs/dbraw/zinc/06/15/92/521061592.db2.gz QJYONIFZHSGRDC-CQSZACIVSA-N 1 1 373.457 2.650 20 5 FFBDMO COc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c([N+](=O)[O-])cc1C ZINC000596513620 521106651 /nfs/dbraw/zinc/10/66/51/521106651.db2.gz AEDPKSGLEYOLPD-QZTJIDSGSA-N 1 1 361.442 2.967 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596514897 521108226 /nfs/dbraw/zinc/10/82/26/521108226.db2.gz OKRPMLFGNIHMPA-ZIAGYGMSSA-N 1 1 352.822 2.699 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1 ZINC000599395763 521197623 /nfs/dbraw/zinc/19/76/23/521197623.db2.gz JVEKQQHBQCYZQA-HXUWFJFHSA-N 1 1 372.421 2.627 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614716 521249329 /nfs/dbraw/zinc/24/93/29/521249329.db2.gz CLMDHNWBGLIFOZ-RYUDHWBXSA-N 1 1 355.341 2.553 20 5 FFBDMO C[C@@H]1C[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H](C)C1(F)F ZINC000599512151 521267730 /nfs/dbraw/zinc/26/77/30/521267730.db2.gz DFVHOVXBAYNGSR-VXGBXAGGSA-N 1 1 353.369 2.707 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2Cc3ccc(O)cc3C2)c([N+](=O)[O-])c1 ZINC000599536889 521282485 /nfs/dbraw/zinc/28/24/85/521282485.db2.gz WCKQJFYHKZLIDK-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2Cc3ccc(O)cc3C2)c([N+](=O)[O-])c1 ZINC000599536889 521282493 /nfs/dbraw/zinc/28/24/93/521282493.db2.gz WCKQJFYHKZLIDK-UHFFFAOYSA-N 1 1 357.366 2.653 20 5 FFBDMO CCOc1cc(C[N@H+]2CC3(CCOCC3)CC[C@H]2CO)ccc1[N+](=O)[O-] ZINC000599543148 521284979 /nfs/dbraw/zinc/28/49/79/521284979.db2.gz MOLFBRMFLFDWPN-INIZCTEOSA-N 1 1 364.442 2.747 20 5 FFBDMO CN(C(=O)c1c(Br)cccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000599576516 521308996 /nfs/dbraw/zinc/30/89/96/521308996.db2.gz ONVAJPFKTDSVBI-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccnn3CC3CCC3)C2)nc1 ZINC000602474656 521366648 /nfs/dbraw/zinc/36/66/48/521366648.db2.gz QZHJFBFLGXKLFV-OAHLLOKOSA-N 1 1 356.430 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccnn3CC3CCC3)C2)nc1 ZINC000602474656 521366653 /nfs/dbraw/zinc/36/66/53/521366653.db2.gz QZHJFBFLGXKLFV-OAHLLOKOSA-N 1 1 356.430 2.673 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCSC[C@H]1CCO ZINC000602484634 521373368 /nfs/dbraw/zinc/37/33/68/521373368.db2.gz LCCFGYDCVOPXRD-GFCCVEGCSA-N 1 1 350.362 2.913 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCSC[C@H]1CCO ZINC000602484634 521373371 /nfs/dbraw/zinc/37/33/71/521373371.db2.gz LCCFGYDCVOPXRD-GFCCVEGCSA-N 1 1 350.362 2.913 20 5 FFBDMO CC(C)N1CC[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C1=O ZINC000602555401 521410241 /nfs/dbraw/zinc/41/02/41/521410241.db2.gz PUOPSXQCFIMYCD-JTQLQIEISA-N 1 1 362.249 2.518 20 5 FFBDMO C[C@H]1OCC[C@]12C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H](C)O2 ZINC000619175818 521433869 /nfs/dbraw/zinc/43/38/69/521433869.db2.gz QAJGADKAROAKEV-RKVPGOIHSA-N 1 1 350.415 2.632 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000612031650 521446491 /nfs/dbraw/zinc/44/64/91/521446491.db2.gz OOCPLDIECPXBIX-SFHVURJKSA-N 1 1 366.421 2.951 20 5 FFBDMO COc1cc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(Cl)cc1O ZINC000602635737 521449318 /nfs/dbraw/zinc/44/93/18/521449318.db2.gz BOUMVUXBYUAZBE-UHFFFAOYSA-N 1 1 366.805 2.996 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000594198965 521465148 /nfs/dbraw/zinc/46/51/48/521465148.db2.gz WQICGJKXWJUHKM-KGLIPLIRSA-N 1 1 369.368 2.943 20 5 FFBDMO Cn1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c([N+](=O)[O-])n1 ZINC000602691200 521481632 /nfs/dbraw/zinc/48/16/32/521481632.db2.gz OCEYCHATQBAPRO-LBPRGKRZSA-N 1 1 362.352 2.509 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c([N+](=O)[O-])n1 ZINC000602691200 521481638 /nfs/dbraw/zinc/48/16/38/521481638.db2.gz OCEYCHATQBAPRO-LBPRGKRZSA-N 1 1 362.352 2.509 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599830658 521500095 /nfs/dbraw/zinc/50/00/95/521500095.db2.gz WGIBPAJTDDCFSM-ZDUSSCGKSA-N 1 1 357.414 2.949 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]([NH+]3CCOCC3)C2)nc1-c1ccc(F)cc1 ZINC000619527579 521753096 /nfs/dbraw/zinc/75/30/96/521753096.db2.gz XRFDHQMCUWPJHW-MRXNPFEDSA-N 1 1 372.400 2.707 20 5 FFBDMO Cc1cc[nH+]c(N2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000619745302 521850281 /nfs/dbraw/zinc/85/02/81/521850281.db2.gz XTGKGIGASXNXOS-UHFFFAOYSA-N 1 1 352.398 2.891 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932513 721855203 /nfs/dbraw/zinc/85/52/03/721855203.db2.gz YNOSJQLJNVGIQI-RTBURBONSA-N 1 1 369.469 2.666 20 5 FFBDMO Cc1cc(N2CC[C@@H]3[C@H]2CCN3CC[NH+](C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001164932513 721855205 /nfs/dbraw/zinc/85/52/05/721855205.db2.gz YNOSJQLJNVGIQI-RTBURBONSA-N 1 1 369.469 2.666 20 5 FFBDMO Cc1nc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)ncc1[N+](=O)[O-] ZINC001164958750 722023884 /nfs/dbraw/zinc/02/38/84/722023884.db2.gz FVIGFWALOJTJBK-UHFFFAOYSA-N 1 1 368.441 2.581 20 5 FFBDMO O=C(OCC[NH+]1CCSCC1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000158256942 728885305 /nfs/dbraw/zinc/88/53/05/728885305.db2.gz BIISRHYHGPRMEY-UHFFFAOYSA-N 1 1 364.345 2.819 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000159144600 728901703 /nfs/dbraw/zinc/90/17/03/728901703.db2.gz ZQHUTIDDTCVHAQ-NXEZZACHSA-N 1 1 356.220 2.570 20 5 FFBDMO CCC[N@@H+](CC)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000080677950 728330369 /nfs/dbraw/zinc/33/03/69/728330369.db2.gz VFBDJWKNMQLZTK-UHFFFAOYSA-N 1 1 365.402 2.735 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000091672675 728461017 /nfs/dbraw/zinc/46/10/17/728461017.db2.gz YTOONPZCDIWBCI-VXGBXAGGSA-N 1 1 356.220 2.632 20 5 FFBDMO CCc1ccc(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)cc1[N+](=O)[O-] ZINC000747119164 735535479 /nfs/dbraw/zinc/53/54/79/735535479.db2.gz RXSIWKIYVHOPET-INIZCTEOSA-N 1 1 350.415 2.671 20 5 FFBDMO O=[N+]([O-])c1cc(S(=O)(=O)N2CC[NH+](CC3CCCCC3)CC2)cs1 ZINC000119632653 728597672 /nfs/dbraw/zinc/59/76/72/728597672.db2.gz WXHNFXATLREWLG-UHFFFAOYSA-N 1 1 373.500 2.543 20 5 FFBDMO CC[NH+](CC)[C@@H](CNS(=O)(=O)c1csc([N+](=O)[O-])c1)c1ccco1 ZINC000119661539 728598214 /nfs/dbraw/zinc/59/82/14/728598214.db2.gz HBNBPHBSYWRHBC-LBPRGKRZSA-N 1 1 373.456 2.611 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1csc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000120308563 728609653 /nfs/dbraw/zinc/60/96/53/728609653.db2.gz IFHZWWMZUHARGS-NEPJUHHUSA-N 1 1 373.500 2.588 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000178771961 729169538 /nfs/dbraw/zinc/16/95/38/729169538.db2.gz JLTSPRDFZGJSCO-SNVBAGLBSA-N 1 1 351.384 2.857 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]1Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000178771961 729169540 /nfs/dbraw/zinc/16/95/40/729169540.db2.gz JLTSPRDFZGJSCO-SNVBAGLBSA-N 1 1 351.384 2.857 20 5 FFBDMO COCC[N@H+]1CCCN(c2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856724131 730350299 /nfs/dbraw/zinc/35/02/99/730350299.db2.gz URAOBYLOVMTNOQ-UHFFFAOYSA-N 1 1 358.236 2.516 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000857303714 730390147 /nfs/dbraw/zinc/39/01/47/730390147.db2.gz LTLKTIPQZXIBLN-JTQLQIEISA-N 1 1 370.247 2.960 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000857634723 730403324 /nfs/dbraw/zinc/40/33/24/730403324.db2.gz MISRELFAPSDUQA-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)cc1SC ZINC000871153331 731600411 /nfs/dbraw/zinc/60/04/11/731600411.db2.gz LPPFDQORENZCJR-UHFFFAOYSA-N 1 1 367.471 2.882 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CCC1(C)C ZINC000871155587 731600876 /nfs/dbraw/zinc/60/08/76/731600876.db2.gz TXHZSPBMWHNRLN-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)N1CCN(C)CC1 ZINC000872033405 731722517 /nfs/dbraw/zinc/72/25/17/731722517.db2.gz GRCLEUJSUHOTJM-KBPBESRZSA-N 1 1 352.504 2.603 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000872033933 731722930 /nfs/dbraw/zinc/72/29/30/731722930.db2.gz KKZZUQLTOWVPST-QEJZJMRPSA-N 1 1 351.472 2.831 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CN2CCC[C@H]2CO1 ZINC000872033933 731722933 /nfs/dbraw/zinc/72/29/33/731722933.db2.gz KKZZUQLTOWVPST-QEJZJMRPSA-N 1 1 351.472 2.831 20 5 FFBDMO C[C@H]([NH2+]CCN1C[C@H]2CCCCN2C1=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872088827 731728672 /nfs/dbraw/zinc/72/86/72/731728672.db2.gz RIRRSKVJUNPNIE-QWHCGFSZSA-N 1 1 350.394 2.675 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000874825287 732104270 /nfs/dbraw/zinc/10/42/70/732104270.db2.gz ITZLMAKJJMOMKW-UONOGXRCSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000874839249 732106335 /nfs/dbraw/zinc/10/63/35/732106335.db2.gz UPBQAJVRTYQZAX-UONOGXRCSA-N 1 1 367.833 2.712 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878655805 732572892 /nfs/dbraw/zinc/57/28/92/732572892.db2.gz ADCRMPFSZQJRJJ-LBPRGKRZSA-N 1 1 365.821 2.824 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3cccc([N+](=O)[O-])c3Br)CC[C@@H]21 ZINC000879579079 732728674 /nfs/dbraw/zinc/72/86/74/732728674.db2.gz JOGUXXVIHKTPHR-YPMHNXCESA-N 1 1 354.248 2.883 20 5 FFBDMO COc1ccccc1[C@@H]1CSCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000880174529 732859891 /nfs/dbraw/zinc/85/98/91/732859891.db2.gz PKVDQDUBEIRFLD-HNNXBMFYSA-N 1 1 362.455 2.980 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000880437534 732908166 /nfs/dbraw/zinc/90/81/66/732908166.db2.gz MMQLHCIJCCPMNS-GXTWGEPZSA-N 1 1 359.220 2.593 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000886025940 733741282 /nfs/dbraw/zinc/74/12/82/733741282.db2.gz MTMJKSBFAFWZJN-AWEZNQCLSA-N 1 1 350.419 2.821 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000886025940 733741284 /nfs/dbraw/zinc/74/12/84/733741284.db2.gz MTMJKSBFAFWZJN-AWEZNQCLSA-N 1 1 350.419 2.821 20 5 FFBDMO COCC[N@H+](C)CCCC1CCN(Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886097723 733748456 /nfs/dbraw/zinc/74/84/56/733748456.db2.gz CUYICCWCETWWCA-UHFFFAOYSA-N 1 1 350.463 2.560 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886097723 733748460 /nfs/dbraw/zinc/74/84/60/733748460.db2.gz CUYICCWCETWWCA-UHFFFAOYSA-N 1 1 350.463 2.560 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886561515 733802671 /nfs/dbraw/zinc/80/26/71/733802671.db2.gz AGLJVDNZLVURMU-MXWKQRLJSA-N 1 1 355.847 2.870 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886561515 733802675 /nfs/dbraw/zinc/80/26/75/733802675.db2.gz AGLJVDNZLVURMU-MXWKQRLJSA-N 1 1 355.847 2.870 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000927646679 738765689 /nfs/dbraw/zinc/76/56/89/738765689.db2.gz WFZMMGDMONQNTA-CYBMUJFWSA-N 1 1 368.821 2.623 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082300 738817644 /nfs/dbraw/zinc/81/76/44/738817644.db2.gz QOVRSANIHALXBJ-WCQYABFASA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082300 738817648 /nfs/dbraw/zinc/81/76/48/738817648.db2.gz QOVRSANIHALXBJ-WCQYABFASA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095507 738822243 /nfs/dbraw/zinc/82/22/43/738822243.db2.gz KFHMFSBRIOOVSM-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095507 738822246 /nfs/dbraw/zinc/82/22/46/738822246.db2.gz KFHMFSBRIOOVSM-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000740886553 735095414 /nfs/dbraw/zinc/09/54/14/735095414.db2.gz UEZPBVNWESJBRW-TZMCWYRMSA-N 1 1 368.865 2.991 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cc1C(F)(F)F ZINC000897221195 735208074 /nfs/dbraw/zinc/20/80/74/735208074.db2.gz JFFGCOWIDLFFBF-CABCVRRESA-N 1 1 359.348 2.649 20 5 FFBDMO CO[C@@]1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCSC1 ZINC000903314408 736074622 /nfs/dbraw/zinc/07/46/22/736074622.db2.gz NHFOOVVNVHAQCR-DOTOQJQBSA-N 1 1 362.455 2.529 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000755022773 736227403 /nfs/dbraw/zinc/22/74/03/736227403.db2.gz YDYGWDMXXXPJDK-VIFPVBQESA-N 1 1 374.210 2.568 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000906845400 736550586 /nfs/dbraw/zinc/55/05/86/736550586.db2.gz MCTVPMNXMNAVEX-LLVKDONJSA-N 1 1 354.838 2.634 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH+](CCCF)CC1 ZINC000911588387 737214588 /nfs/dbraw/zinc/21/45/88/737214588.db2.gz OBMKCFSHCOZFEX-UHFFFAOYSA-N 1 1 357.813 2.685 20 5 FFBDMO C[C@](O)(C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1)C(F)(F)F ZINC000767903882 737381013 /nfs/dbraw/zinc/38/10/13/737381013.db2.gz UVOBHSLAYRLFRM-CABCVRRESA-N 1 1 362.348 2.654 20 5 FFBDMO CN(CC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000768757613 737455475 /nfs/dbraw/zinc/45/54/75/737455475.db2.gz JIFOZWGNGXYRCW-UHFFFAOYSA-N 1 1 353.419 2.772 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC[N@H+]1C ZINC000922226254 738108141 /nfs/dbraw/zinc/10/81/41/738108141.db2.gz USWXYTVQZPSAJK-RNCFNFMXSA-N 1 1 360.336 2.505 20 5 FFBDMO CC[N@@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@@H]1C(C)C ZINC000922394544 738137000 /nfs/dbraw/zinc/13/70/00/738137000.db2.gz XBJASLBKKKGERX-TXCZRRACSA-N 1 1 353.488 2.616 20 5 FFBDMO CC[N@H+]1C[C@@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@@H]1C(C)C ZINC000922394544 738137002 /nfs/dbraw/zinc/13/70/02/738137002.db2.gz XBJASLBKKKGERX-TXCZRRACSA-N 1 1 353.488 2.616 20 5 FFBDMO C[C@@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000923982876 738352949 /nfs/dbraw/zinc/35/29/49/738352949.db2.gz IYJPYGBXHDGTAL-XNRPHZJLSA-N 1 1 364.471 2.535 20 5 FFBDMO C[C@@H]1C[C@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)C[C@H](C)O1 ZINC000929262413 738961781 /nfs/dbraw/zinc/96/17/81/738961781.db2.gz RBXVHSRTKUMKGL-WDNDVIMCSA-N 1 1 367.471 2.618 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000785732032 738992056 /nfs/dbraw/zinc/99/20/56/738992056.db2.gz IZFLLVHSGPOUPJ-GHMZBOCLSA-N 1 1 369.805 2.603 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)s1 ZINC000932669809 739489595 /nfs/dbraw/zinc/48/95/95/739489595.db2.gz RWYCZODQYZQQFG-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)s1 ZINC000932669809 739489598 /nfs/dbraw/zinc/48/95/98/739489598.db2.gz RWYCZODQYZQQFG-LLVKDONJSA-N 1 1 365.386 2.967 20 5 FFBDMO CCc1ccc(N2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)cc1Cl ZINC000796134951 740105867 /nfs/dbraw/zinc/10/58/67/740105867.db2.gz FLHMOPLVOCBLPU-UHFFFAOYSA-N 1 1 363.849 2.829 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C ZINC000797518962 740252766 /nfs/dbraw/zinc/25/27/66/740252766.db2.gz PNIIILWAPUSLRX-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C ZINC000797518962 740252769 /nfs/dbraw/zinc/25/27/69/740252769.db2.gz PNIIILWAPUSLRX-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO CCOC(=O)N(C)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000797517888 740252797 /nfs/dbraw/zinc/25/27/97/740252797.db2.gz RIGTZDHRNGIQFD-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000797637763 740260848 /nfs/dbraw/zinc/26/08/48/740260848.db2.gz LWCVLQZLGXYASV-UHFFFAOYSA-N 1 1 369.219 2.741 20 5 FFBDMO COCC[N@H+]1CC[C@@H](Nc2ccc(C)c(Br)c2[N+](=O)[O-])C1 ZINC000804442285 740874467 /nfs/dbraw/zinc/87/44/67/740874467.db2.gz ULRSYVKVJLWCER-LLVKDONJSA-N 1 1 358.236 2.798 20 5 FFBDMO CC(C)(C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCCC1 ZINC000805612769 740991969 /nfs/dbraw/zinc/99/19/69/740991969.db2.gz ZPNKJBUPRRLLRX-UHFFFAOYSA-N 1 1 369.805 2.604 20 5 FFBDMO COC(=O)C[C@@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOC1 ZINC000809978439 741368800 /nfs/dbraw/zinc/36/88/00/741368800.db2.gz WXTDSTFPAWERMC-AWEZNQCLSA-N 1 1 363.197 2.713 20 5 FFBDMO C[N@@H+](CCC1CCCCCC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985426164 741394673 /nfs/dbraw/zinc/39/46/73/741394673.db2.gz MCVHKANIDSBRAR-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO C[N@H+](CCC1CCCCCC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426164 741394676 /nfs/dbraw/zinc/39/46/76/741394676.db2.gz MCVHKANIDSBRAR-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO C[N@@H+](CCC1CCCCCC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426164 741394678 /nfs/dbraw/zinc/39/46/78/741394678.db2.gz MCVHKANIDSBRAR-QZTJIDSGSA-N 1 1 351.491 2.935 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000811447890 741523091 /nfs/dbraw/zinc/52/30/91/741523091.db2.gz PGCQKNBNJPJOCU-KRWDZBQOSA-N 1 1 354.378 2.729 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C ZINC000812384612 741616082 /nfs/dbraw/zinc/61/60/82/741616082.db2.gz TYZVXUNPUOVNRX-LLVKDONJSA-N 1 1 352.391 2.662 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)c1cc(C[NH+]2CCCC2)on1 ZINC000812531958 741630732 /nfs/dbraw/zinc/63/07/32/741630732.db2.gz CMETYYWQJSLAEC-UHFFFAOYSA-N 1 1 364.789 2.762 20 5 FFBDMO C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000814655904 741854672 /nfs/dbraw/zinc/85/46/72/741854672.db2.gz KDEUMTMERGXNIX-ZANVPECISA-N 1 1 367.203 2.532 20 5 FFBDMO CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](C)C1 ZINC000823500002 742927468 /nfs/dbraw/zinc/92/74/68/742927468.db2.gz RNNWCSNWMLSRNK-SECBINFHSA-N 1 1 358.801 2.526 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1CCC[N@@H+]1CCCO ZINC000824564269 743106509 /nfs/dbraw/zinc/10/65/09/743106509.db2.gz HFFLCSBIOHXKQU-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCCN1CCCO ZINC000824564269 743106514 /nfs/dbraw/zinc/10/65/14/743106514.db2.gz HFFLCSBIOHXKQU-ZDUSSCGKSA-N 1 1 362.257 2.838 20 5 FFBDMO C[N@@H+](Cc1ccsc1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001050243644 743506174 /nfs/dbraw/zinc/50/61/74/743506174.db2.gz BPDHYYRFYRECIB-IAGOWNOFSA-N 1 1 359.451 2.662 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000827300400 743551459 /nfs/dbraw/zinc/55/14/59/743551459.db2.gz MQXLNXZWLBHPBT-YGRLFVJLSA-N 1 1 368.231 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(NC[C@H]3C[N@H+]4CCC[C@@H]4CO3)n2)cc1 ZINC000827497332 743589978 /nfs/dbraw/zinc/58/99/78/743589978.db2.gz UMPHOOYDKAPDKA-CABCVRRESA-N 1 1 360.439 2.993 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC2(CCC2)O1 ZINC000830734185 745421677 /nfs/dbraw/zinc/42/16/77/745421677.db2.gz HIMNNAVIFAGLMC-GFCCVEGCSA-N 1 1 351.378 2.706 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000834595326 745864349 /nfs/dbraw/zinc/86/43/49/745864349.db2.gz XHEOFQACJZSHOC-UONOGXRCSA-N 1 1 355.797 2.815 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839141084 746787037 /nfs/dbraw/zinc/78/70/37/746787037.db2.gz XWJURDJKBWZSLW-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000839141084 746787040 /nfs/dbraw/zinc/78/70/40/746787040.db2.gz XWJURDJKBWZSLW-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](C2CCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839622248 746874192 /nfs/dbraw/zinc/87/41/92/746874192.db2.gz AXKQBXBEZIPQFQ-MRXNPFEDSA-N 1 1 351.378 2.563 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])c2c([nH+]1)CCCC2 ZINC000840951374 747240006 /nfs/dbraw/zinc/24/00/06/747240006.db2.gz XCNBYNWRRAMKCK-UHFFFAOYSA-N 1 1 365.386 2.539 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000844022196 747951578 /nfs/dbraw/zinc/95/15/78/747951578.db2.gz KZSHVQIYFPVDPH-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000844022196 747951579 /nfs/dbraw/zinc/95/15/79/747951579.db2.gz KZSHVQIYFPVDPH-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000847256368 748663060 /nfs/dbraw/zinc/66/30/60/748663060.db2.gz PQAUIAJXFKYYSM-HUUCEWRRSA-N 1 1 353.369 2.820 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848490626 748939720 /nfs/dbraw/zinc/93/97/20/748939720.db2.gz QAHFZGYLBWFKRG-YOEHRIQHSA-N 1 1 363.483 2.943 20 5 FFBDMO Cn1cc([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C2(CO)CCC2)cn1 ZINC000852073149 749767476 /nfs/dbraw/zinc/76/74/76/749767476.db2.gz BSVDOAWPVQYWRV-MRXNPFEDSA-N 1 1 364.833 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)c1Br ZINC000852346095 749840466 /nfs/dbraw/zinc/84/04/66/749840466.db2.gz WOGCRQKHRKFPOX-KGYLQXTDSA-N 1 1 355.232 2.950 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1F ZINC000854735302 750361168 /nfs/dbraw/zinc/36/11/68/750361168.db2.gz NARIDLIPUIBSHP-KRWDZBQOSA-N 1 1 353.369 2.739 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc([N+](=O)[O-])c1 ZINC000873262395 1013450215 /nfs/dbraw/zinc/45/02/15/1013450215.db2.gz YNAJRNFCDQQYDT-DNMXQMFDSA-N 1 1 355.442 2.538 20 5 FFBDMO CC(C)c1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001482218573 964148296 /nfs/dbraw/zinc/14/82/96/964148296.db2.gz RFMQHVBIQFKIGT-QZTJIDSGSA-N 1 1 359.470 2.994 20 5 FFBDMO O=C(NCCC1CC[NH+](CC2CCCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001270111506 964698983 /nfs/dbraw/zinc/69/89/83/964698983.db2.gz PBNZHSNJMNENFO-QZTJIDSGSA-N 1 1 351.491 2.840 20 5 FFBDMO Nc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067361840 966094685 /nfs/dbraw/zinc/09/46/85/966094685.db2.gz BDSALKSXEKRCDI-INIZCTEOSA-N 1 1 368.437 2.819 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001176154997 1013647843 /nfs/dbraw/zinc/64/78/43/1013647843.db2.gz TVZBNJJDKFURJY-CABCVRRESA-N 1 1 360.458 2.871 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901222 968104453 /nfs/dbraw/zinc/10/44/53/968104453.db2.gz AHXFCSGMUBLMCX-ZBFHGGJFSA-N 1 1 373.457 2.919 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901222 968104458 /nfs/dbraw/zinc/10/44/58/968104458.db2.gz AHXFCSGMUBLMCX-ZBFHGGJFSA-N 1 1 373.457 2.919 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)Cc1c[nH]cn1 ZINC001176832077 1013784440 /nfs/dbraw/zinc/78/44/40/1013784440.db2.gz HCWJQLAOSUYOGE-UHFFFAOYSA-N 1 1 361.405 2.861 20 5 FFBDMO C[N@@H+](CC1CCCCC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000027080423 973030344 /nfs/dbraw/zinc/03/03/44/973030344.db2.gz JUMLELABIMBQGA-LJQANCHMSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1)c1ccccc1[N+](=O)[O-] ZINC000897060943 973204552 /nfs/dbraw/zinc/20/45/52/973204552.db2.gz DOSMQOGNWVHTEB-HLLBOEOZSA-N 1 1 360.458 2.824 20 5 FFBDMO COc1cc([N+](=O)[O-])cnc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000893567930 975429909 /nfs/dbraw/zinc/42/99/09/975429909.db2.gz QDGPUPBGAPZPBN-UHFFFAOYSA-N 1 1 357.414 2.915 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)Nc1nccc2cc([N+](=O)[O-])ccc21 ZINC000899219305 977017253 /nfs/dbraw/zinc/01/72/53/977017253.db2.gz SCWOAABIHMTKKX-UHFFFAOYSA-N 1 1 358.398 2.584 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001152052738 1032091014 /nfs/dbraw/zinc/09/10/14/1032091014.db2.gz IGGQYOHXPDHWHK-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001152052738 1032091027 /nfs/dbraw/zinc/09/10/27/1032091027.db2.gz IGGQYOHXPDHWHK-SFHVURJKSA-N 1 1 350.378 2.993 20 5 FFBDMO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCCN(Cc4ccccc4)C3)C2)c1 ZINC000876988550 1014441769 /nfs/dbraw/zinc/44/17/69/1014441769.db2.gz GFEZVDCPZVIGJX-VIQWUECVSA-N 1 1 369.469 2.997 20 5 FFBDMO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000877168440 1014497268 /nfs/dbraw/zinc/49/72/68/1014497268.db2.gz UJBNMZSALXHTEE-XMZVIZOASA-N 1 1 369.469 2.995 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1C ZINC001212026042 981461139 /nfs/dbraw/zinc/46/11/39/981461139.db2.gz RSRZLTUMRYXGJK-CYBMUJFWSA-N 1 1 357.476 2.610 20 5 FFBDMO C[N@H+]1CCCC12CCN(Cc1nnc(-c3ccccc3[N+](=O)[O-])o1)CC2 ZINC000878339455 1014992740 /nfs/dbraw/zinc/99/27/40/1014992740.db2.gz MHKUNTARJYDGOA-UHFFFAOYSA-N 1 1 357.414 2.705 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)c1F ZINC000764045375 984254571 /nfs/dbraw/zinc/25/45/71/984254571.db2.gz YMOMHPJIFNJRMN-CHWSQXEVSA-N 1 1 367.421 2.660 20 5 FFBDMO Nc1ccc(C(=O)Nc2ccccc2C[NH+]2CCSCC2)cc1[N+](=O)[O-] ZINC000061571304 985280102 /nfs/dbraw/zinc/28/01/02/985280102.db2.gz YRDOJINOBSXILI-UHFFFAOYSA-N 1 1 372.450 2.978 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000173508324 985854497 /nfs/dbraw/zinc/85/44/97/985854497.db2.gz QMFHOEOBXJYGCZ-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)NC(=O)OC(C)(C)C ZINC000785443710 986329952 /nfs/dbraw/zinc/32/99/52/986329952.db2.gz ZMKOGDRNXDBZBO-AWEZNQCLSA-N 1 1 364.446 2.630 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000152219150 987087191 /nfs/dbraw/zinc/08/71/91/987087191.db2.gz LJENJKSGYCDLLE-HXUWFJFHSA-N 1 1 366.421 2.951 20 5 FFBDMO CCc1cc(N2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000193518071 988524874 /nfs/dbraw/zinc/52/48/74/988524874.db2.gz IRLKCWWUHCQBMB-QGZVFWFLSA-N 1 1 353.426 2.899 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)cc1C ZINC000946589332 988765931 /nfs/dbraw/zinc/76/59/31/988765931.db2.gz SQXVVFUCHRUTHQ-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)cc1C ZINC000946589332 988765939 /nfs/dbraw/zinc/76/59/39/988765939.db2.gz SQXVVFUCHRUTHQ-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)cc1C ZINC000946589332 988765946 /nfs/dbraw/zinc/76/59/46/988765946.db2.gz SQXVVFUCHRUTHQ-IYWMVGAKSA-N 1 1 371.481 2.639 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000918577715 990436167 /nfs/dbraw/zinc/43/61/67/990436167.db2.gz NWUVFSUMBNWUFZ-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373105466 990717341 /nfs/dbraw/zinc/71/73/41/990717341.db2.gz YHCHDCTWFNWBKQ-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373105466 990717346 /nfs/dbraw/zinc/71/73/46/990717346.db2.gz YHCHDCTWFNWBKQ-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000920455890 990852210 /nfs/dbraw/zinc/85/22/10/990852210.db2.gz GBTFTLIQIADFOD-UHFFFAOYSA-N 1 1 373.457 2.667 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000068964563 991554386 /nfs/dbraw/zinc/55/43/86/991554386.db2.gz PBCIAAFSNOMPBT-CABCVRRESA-N 1 1 373.457 2.919 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810844482 994950741 /nfs/dbraw/zinc/95/07/41/994950741.db2.gz NWXKAYNKIOHPBR-CVEARBPZSA-N 1 1 356.382 2.564 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812853528 995556399 /nfs/dbraw/zinc/55/63/99/995556399.db2.gz RMXSKMQXOFANBL-BPAFIMBUSA-N 1 1 374.437 2.779 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494641 995559502 /nfs/dbraw/zinc/55/95/02/995559502.db2.gz PWAIMDDZUSYVDE-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494641 995559510 /nfs/dbraw/zinc/55/95/10/995559510.db2.gz PWAIMDDZUSYVDE-OCCSQVGLSA-N 1 1 355.847 2.558 20 5 FFBDMO C[C@@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCOCC1 ZINC000813172631 995633975 /nfs/dbraw/zinc/63/39/75/995633975.db2.gz LTIXVDDMQXLDSS-KDOFPFPSSA-N 1 1 362.426 2.775 20 5 FFBDMO C[C@@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCOCC1 ZINC000813172631 995633976 /nfs/dbraw/zinc/63/39/76/995633976.db2.gz LTIXVDDMQXLDSS-KDOFPFPSSA-N 1 1 362.426 2.775 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@@H]1N2C(=O)c1cc([N+](=O)[O-])cn1C ZINC000824415871 996947509 /nfs/dbraw/zinc/94/75/09/996947509.db2.gz KUCZCSNEEFIHMB-WBVHZDCISA-N 1 1 354.410 2.690 20 5 FFBDMO Cc1ccccc1[C@@H]1CN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[NH2+]1 ZINC000825154403 997246495 /nfs/dbraw/zinc/24/64/95/997246495.db2.gz UNIMIAAGDDWJFV-KRWDZBQOSA-N 1 1 357.385 2.758 20 5 FFBDMO COc1ccc(COCC[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000731028864 997629091 /nfs/dbraw/zinc/62/90/91/997629091.db2.gz SNRZOAMAKSBBLV-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000844428545 997899679 /nfs/dbraw/zinc/89/96/79/997899679.db2.gz WZJYWPXXVDUSKW-IPMKNSEASA-N 1 1 370.405 2.517 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000844925468 998232897 /nfs/dbraw/zinc/23/28/97/998232897.db2.gz QDGFJDYQEFRXIX-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC000844925468 998232908 /nfs/dbraw/zinc/23/29/08/998232908.db2.gz QDGFJDYQEFRXIX-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000845738310 998630212 /nfs/dbraw/zinc/63/02/12/998630212.db2.gz DYAFHDHSTCKROA-AWEZNQCLSA-N 1 1 358.398 2.810 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000744399737 999855228 /nfs/dbraw/zinc/85/52/28/999855228.db2.gz ANWUFGMMHBBXHB-UHFFFAOYSA-N 1 1 357.414 2.919 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@@H]1C ZINC000766558005 1000012926 /nfs/dbraw/zinc/01/29/26/1000012926.db2.gz YEFJWXFUIXNQFO-WDEREUQCSA-N 1 1 364.402 2.675 20 5 FFBDMO Nc1ccc(Br)c2c1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2 ZINC001169038627 1000017030 /nfs/dbraw/zinc/01/70/30/1000017030.db2.gz JKRXFXNOTIKVGU-QWRGUYRKSA-N 1 1 354.248 2.835 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cnn(CC3CC3)c21 ZINC001169018261 1000017289 /nfs/dbraw/zinc/01/72/89/1000017289.db2.gz AJHDBIKSNIBXSZ-NJAFHUGGSA-N 1 1 362.474 2.674 20 5 FFBDMO CC(=O)N1CC[C@]2(c3ccccc3)CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]12 ZINC001169024885 1000018107 /nfs/dbraw/zinc/01/81/07/1000018107.db2.gz RZHPPLDTBKZRMH-KCLUMXDGSA-N 1 1 371.481 2.696 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccccc1C[NH+]1CCOCC1 ZINC000804330119 1000056557 /nfs/dbraw/zinc/05/65/57/1000056557.db2.gz LOVVTKDMCAQKKO-UHFFFAOYSA-N 1 1 372.381 2.947 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117229 1000100211 /nfs/dbraw/zinc/10/02/11/1000100211.db2.gz CDSCAIKMLPAHND-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117229 1000100213 /nfs/dbraw/zinc/10/02/13/1000100213.db2.gz CDSCAIKMLPAHND-GJZGRUSLSA-N 1 1 368.437 2.912 20 5 FFBDMO O=C1OCC[C@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000770393181 1000767487 /nfs/dbraw/zinc/76/74/87/1000767487.db2.gz ROLYAEXMJRZGSC-HNNXBMFYSA-N 1 1 357.366 2.881 20 5 FFBDMO O=C1OCC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000770393181 1000767493 /nfs/dbraw/zinc/76/74/93/1000767493.db2.gz ROLYAEXMJRZGSC-HNNXBMFYSA-N 1 1 357.366 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)s1 ZINC000771223083 1001055308 /nfs/dbraw/zinc/05/53/08/1001055308.db2.gz CCMVEOMNQWCRLV-KRWDZBQOSA-N 1 1 372.406 2.800 20 5 FFBDMO NC(=[NH2+])Nc1ccc(C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc1 ZINC001148650495 1001180171 /nfs/dbraw/zinc/18/01/71/1001180171.db2.gz OQPLSWODOPWAEA-UHFFFAOYSA-N 1 1 371.400 2.682 20 5 FFBDMO Cc1cc(F)ccc1[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000746669446 1001681968 /nfs/dbraw/zinc/68/19/68/1001681968.db2.gz CLPAQVNUVQOFET-WMLDXEAASA-N 1 1 360.389 2.657 20 5 FFBDMO CCc1nc(C[NH+]2CCC(CNc3nn(C)cc3[N+](=O)[O-])CC2)cs1 ZINC001185375932 1002924762 /nfs/dbraw/zinc/92/47/62/1002924762.db2.gz HWTVGRAQGYWLKS-UHFFFAOYSA-N 1 1 364.475 2.671 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@H]21 ZINC001185701244 1003026614 /nfs/dbraw/zinc/02/66/14/1003026614.db2.gz FTCIVELAEORKBH-BLLLJJGKSA-N 1 1 371.397 2.972 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](Oc3ncccn3)C2)c([N+](=O)[O-])c1 ZINC001170354851 1003123076 /nfs/dbraw/zinc/12/30/76/1003123076.db2.gz QGXXZYUAXYJQSO-YOEHRIQHSA-N 1 1 372.425 2.868 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341985 1003129740 /nfs/dbraw/zinc/12/97/40/1003129740.db2.gz LHANOAOVCCIOQZ-GJZGRUSLSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341985 1003129744 /nfs/dbraw/zinc/12/97/44/1003129744.db2.gz LHANOAOVCCIOQZ-GJZGRUSLSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@H]1C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2cn(C)nc21 ZINC001170341347 1003130531 /nfs/dbraw/zinc/13/05/31/1003130531.db2.gz PIXPYBFEHIAACG-XJKSGUPXSA-N 1 1 374.441 2.514 20 5 FFBDMO O=C1N(C[N@@H+]2CCOC[C@H](C3CCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000793748403 1003490132 /nfs/dbraw/zinc/49/01/32/1003490132.db2.gz XYVLYMCXKDLEHH-MRXNPFEDSA-N 1 1 374.441 2.543 20 5 FFBDMO O=C1N(C[N@H+]2CCOC[C@H](C3CCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000793748403 1003490135 /nfs/dbraw/zinc/49/01/35/1003490135.db2.gz XYVLYMCXKDLEHH-MRXNPFEDSA-N 1 1 374.441 2.543 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ccc(N)cc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000804542133 1003723943 /nfs/dbraw/zinc/72/39/43/1003723943.db2.gz JRYYVZGOWQODPV-HNNXBMFYSA-N 1 1 372.425 2.881 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccc(N)cc3[N+](=O)[O-])C2)cc(OC)c1 ZINC000804542136 1003724486 /nfs/dbraw/zinc/72/44/86/1003724486.db2.gz JRYYVZGOWQODPV-OAHLLOKOSA-N 1 1 372.425 2.881 20 5 FFBDMO O=C(NCc1ccc(C[NH2+]CC2=CCCCC2)cc1F)[C@@H]1CC1[N+](=O)[O-] ZINC001001525737 1016829184 /nfs/dbraw/zinc/82/91/84/1016829184.db2.gz YVIGQARVJPUUQE-SJLPKXTDSA-N 1 1 361.417 2.697 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000805774392 1004127440 /nfs/dbraw/zinc/12/74/40/1004127440.db2.gz JECKRNZVVVGLFU-HNNXBMFYSA-N 1 1 365.430 2.964 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC[C@@H]2C2CCC2)C1=O ZINC000102886121 1004209424 /nfs/dbraw/zinc/20/94/24/1004209424.db2.gz LHSOAHUWIQPKPZ-VQIMIIECSA-N 1 1 372.425 2.584 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580727 1005960829 /nfs/dbraw/zinc/96/08/29/1005960829.db2.gz ZHVKUBLQBCEJRC-KYJSFNMBSA-N 1 1 363.458 2.645 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC001187379592 1006046423 /nfs/dbraw/zinc/04/64/23/1006046423.db2.gz DSPJAHOVMPEQHF-UHFFFAOYSA-N 1 1 358.354 2.531 20 5 FFBDMO C[N@@H+](Cc1cn(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)nn1)C1CCCCC1 ZINC000881399064 1006081726 /nfs/dbraw/zinc/08/17/26/1006081726.db2.gz VUPOLTIYCPVTIF-GOSISDBHSA-N 1 1 359.430 2.684 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](Cc1cc3ccccc3o1)CC2 ZINC001050517375 1017035009 /nfs/dbraw/zinc/03/50/09/1017035009.db2.gz QQQYCVQBWKCTLS-IAGOWNOFSA-N 1 1 369.421 2.522 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CC1CCC3(CC3)CC1)CC2 ZINC001050516759 1017035869 /nfs/dbraw/zinc/03/58/69/1017035869.db2.gz IWNIXTIFUHAQCW-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@@H]3CCOC3)CC2)nc1-c1ccccn1 ZINC000853507574 1006419235 /nfs/dbraw/zinc/41/92/35/1006419235.db2.gz ZWGFRIMHWVKBFI-OAHLLOKOSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cc([N+](=O)[O-])c(-c4ccccn4)n3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000853516007 1006423113 /nfs/dbraw/zinc/42/31/13/1006423113.db2.gz IJBQGRQAYSLGJS-GJRWTSMGSA-N 1 1 351.410 2.955 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)nc1-c1ccccn1 ZINC000853517710 1006423320 /nfs/dbraw/zinc/42/33/20/1006423320.db2.gz BUMWRRKLBAJKBQ-HOCLYGCPSA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)C1 ZINC000805570449 1006485181 /nfs/dbraw/zinc/48/51/81/1006485181.db2.gz YROGLGWUAUTDOP-CQSZACIVSA-N 1 1 361.398 2.590 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1F ZINC000026713357 1006635776 /nfs/dbraw/zinc/63/57/76/1006635776.db2.gz YGUBGBKRMTTYDO-HNNXBMFYSA-N 1 1 364.373 2.614 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1 ZINC000854570239 1006895201 /nfs/dbraw/zinc/89/52/01/1006895201.db2.gz NTYOQVBTRSYOHI-UGEDRFTOSA-N 1 1 373.453 2.710 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2 ZINC000854736790 1006966119 /nfs/dbraw/zinc/96/61/19/1006966119.db2.gz JJITULUGDNKBCD-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000855162455 1007141699 /nfs/dbraw/zinc/14/16/99/1007141699.db2.gz JZVAYZKYUXPPAA-GFCCVEGCSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000817288912 1007510257 /nfs/dbraw/zinc/51/02/57/1007510257.db2.gz OWMMJTVIQKUWMJ-KMFMINBZSA-N 1 1 364.442 2.928 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000855735355 1007531716 /nfs/dbraw/zinc/53/17/16/1007531716.db2.gz SACJVNILNLWOGC-KRWDZBQOSA-N 1 1 368.437 2.566 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000856353660 1007783667 /nfs/dbraw/zinc/78/36/67/1007783667.db2.gz FSJVPKIVYWTQNC-KRWDZBQOSA-N 1 1 368.437 2.665 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000856353660 1007783678 /nfs/dbraw/zinc/78/36/78/1007783678.db2.gz FSJVPKIVYWTQNC-KRWDZBQOSA-N 1 1 368.437 2.665 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856555824 1007884716 /nfs/dbraw/zinc/88/47/16/1007884716.db2.gz HKODBHJCJHUMNZ-FHLIZLRMSA-N 1 1 368.437 2.815 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856555824 1007884719 /nfs/dbraw/zinc/88/47/19/1007884719.db2.gz HKODBHJCJHUMNZ-FHLIZLRMSA-N 1 1 368.437 2.815 20 5 FFBDMO N[C@H](CCC[NH3+])Nc1nnc(-c2ccccc2[N+](=O)[O-])cc1C(F)(F)F ZINC001170898192 1007896633 /nfs/dbraw/zinc/89/66/33/1007896633.db2.gz BXVMUSGTUJTFPT-ZDUSSCGKSA-N 1 1 370.335 2.506 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)c([N+](=O)[O-])c1 ZINC000858036586 1008285609 /nfs/dbraw/zinc/28/56/09/1008285609.db2.gz PAIBJSCZWZGLOO-MRXNPFEDSA-N 1 1 373.409 2.839 20 5 FFBDMO CCN1CCN([C@H](C)C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC001177257213 1008542173 /nfs/dbraw/zinc/54/21/73/1008542173.db2.gz RFYIZVJMEMOLGP-MRXNPFEDSA-N 1 1 372.469 2.970 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)c1 ZINC000136897651 1008555374 /nfs/dbraw/zinc/55/53/74/1008555374.db2.gz IDYSAGGAMNNLCZ-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2CCC[N@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000136897651 1008555382 /nfs/dbraw/zinc/55/53/82/1008555382.db2.gz IDYSAGGAMNNLCZ-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)c1 ZINC000136897651 1008555387 /nfs/dbraw/zinc/55/53/87/1008555387.db2.gz IDYSAGGAMNNLCZ-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO Cc1ccccc1[C@@H](CO)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000886435999 1008682458 /nfs/dbraw/zinc/68/24/58/1008682458.db2.gz OFARSJZYPDNQIN-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO C[N@@H+](CCCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)Cc1ccccc1 ZINC000824009032 1009292791 /nfs/dbraw/zinc/29/27/91/1009292791.db2.gz ZVQCNCIGCLKCCW-UHFFFAOYSA-N 1 1 357.414 2.821 20 5 FFBDMO CC(C)(O)C[N@@H+]1CC[C@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001179328019 1009319685 /nfs/dbraw/zinc/31/96/85/1009319685.db2.gz IJWYEXFRWNDZSY-HNNXBMFYSA-N 1 1 359.426 2.790 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001179328019 1009319698 /nfs/dbraw/zinc/31/96/98/1009319698.db2.gz IJWYEXFRWNDZSY-HNNXBMFYSA-N 1 1 359.426 2.790 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@@]1(C)C[C@@H](OC)C[N@H+]1C ZINC000861348303 1009364253 /nfs/dbraw/zinc/36/42/53/1009364253.db2.gz NZBJXQKSXAWCAH-SZVBFZGTSA-N 1 1 364.442 2.816 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000889164064 1009845669 /nfs/dbraw/zinc/84/56/69/1009845669.db2.gz XFSDFHNIPOHGDK-JSGCOSHPSA-N 1 1 356.426 2.885 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CCCC[N@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000862792772 1009978256 /nfs/dbraw/zinc/97/82/56/1009978256.db2.gz ZHDHGXIAEGMEQR-ZDUSSCGKSA-N 1 1 364.402 2.582 20 5 FFBDMO C[C@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000865697265 1010844031 /nfs/dbraw/zinc/84/40/31/1010844031.db2.gz VKDXAVVWARTBJL-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905497 1012077523 /nfs/dbraw/zinc/07/75/23/1012077523.db2.gz CQFSINVMJNCVOT-YJBOKZPZSA-N 1 1 370.453 2.817 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172905497 1012077541 /nfs/dbraw/zinc/07/75/41/1012077541.db2.gz CQFSINVMJNCVOT-YJBOKZPZSA-N 1 1 370.453 2.817 20 5 FFBDMO CCOC(=O)[C@@H]1CSCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921348 1012102091 /nfs/dbraw/zinc/10/20/91/1012102091.db2.gz PAIFPNQHMCQBHI-RDJZCZTQSA-N 1 1 364.467 2.823 20 5 FFBDMO CCOC(=O)[C@@H]1CSCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921348 1012102094 /nfs/dbraw/zinc/10/20/94/1012102094.db2.gz PAIFPNQHMCQBHI-RDJZCZTQSA-N 1 1 364.467 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H]4CCO[C@H]4C3)CC2)c(F)c1 ZINC001173009799 1012178566 /nfs/dbraw/zinc/17/85/66/1012178566.db2.gz HKAHFMLTOABKGZ-PXAZEXFGSA-N 1 1 367.396 2.953 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3CC[C@@H](F)[C@@H](O)CC3)CC2)c(F)c1 ZINC001173010151 1012179389 /nfs/dbraw/zinc/17/93/89/1012179389.db2.gz NCXLQIAVZKAYIZ-CJNGLKHVSA-N 1 1 373.375 2.637 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H]4OCC[C@H]4C3)CC2)c(F)c1 ZINC001173015435 1012186566 /nfs/dbraw/zinc/18/65/66/1012186566.db2.gz QCNRIJFFDAAGMO-SJCJKPOMSA-N 1 1 367.396 2.953 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3C[C@H]4[C@H](CF)[C@H]4C3)CC2)c(F)c1 ZINC001173014772 1012186736 /nfs/dbraw/zinc/18/67/36/1012186736.db2.gz BCIZMDDHBDCXGY-ZSOGYDGISA-N 1 1 355.360 2.989 20 5 FFBDMO C[N@@H+](Cc1ccncn1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173019965 1012192264 /nfs/dbraw/zinc/19/22/64/1012192264.db2.gz NEQAGUCLYCCSRZ-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173190325 1012331921 /nfs/dbraw/zinc/33/19/21/1012331921.db2.gz SUSLOGAQHRZUOK-QWHCGFSZSA-N 1 1 368.405 2.949 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cnn(C)c21 ZINC001173224345 1012357739 /nfs/dbraw/zinc/35/77/39/1012357739.db2.gz JOYUKZMMMCRNJK-PBHICJAKSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2ccncc2)C1 ZINC001173237468 1012384667 /nfs/dbraw/zinc/38/46/67/1012384667.db2.gz KEAVDFVCISQGHM-MAUKXSAKSA-N 1 1 368.437 2.815 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)[C@](C)(N)c2cccc([N+](=O)[O-])c2)C1 ZINC000870920327 1012636879 /nfs/dbraw/zinc/63/68/79/1012636879.db2.gz CTFQDUONBQXZMU-BAAGSCJXSA-N 1 1 374.485 2.633 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC([C@@H]2CCCCO2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000870955444 1012650155 /nfs/dbraw/zinc/65/01/55/1012650155.db2.gz XEOUPOPRYXGRAW-PKOBYXMFSA-N 1 1 361.442 2.576 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1cccc([N+](=O)[O-])c1 ZINC000926917164 1018292561 /nfs/dbraw/zinc/29/25/61/1018292561.db2.gz XNGLDUCQADJGLX-ZIFCJYIRSA-N 1 1 356.426 2.967 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777735246 1019207636 /nfs/dbraw/zinc/20/76/36/1019207636.db2.gz XSGVUJYFWDBUIX-DJJJIMSYSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777735246 1019207642 /nfs/dbraw/zinc/20/76/42/1019207642.db2.gz XSGVUJYFWDBUIX-DJJJIMSYSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@@H](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)Cc1ccccc1 ZINC000801914258 1019507393 /nfs/dbraw/zinc/50/73/93/1019507393.db2.gz VHUHBBBSBDOPQF-ZDUSSCGKSA-N 1 1 374.416 2.957 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000801981619 1019573715 /nfs/dbraw/zinc/57/37/15/1019573715.db2.gz RGSUJVVXHYIUBQ-CYBMUJFWSA-N 1 1 364.421 2.843 20 5 FFBDMO C[C@@]1(NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000406045879 1032846546 /nfs/dbraw/zinc/84/65/46/1032846546.db2.gz UZTCIQBUAQRDBL-LJQANCHMSA-N 1 1 354.410 2.571 20 5 FFBDMO O=C1O[C@H](C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CC12CC2 ZINC000828817142 1032854321 /nfs/dbraw/zinc/85/43/21/1032854321.db2.gz LKJMKTGHMUKOHJ-ULQDDVLXSA-N 1 1 374.437 2.796 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)CC[C@@H](O)c1ccccc1 ZINC000930442222 1020035238 /nfs/dbraw/zinc/03/52/38/1020035238.db2.gz WHWBIOZAOLPYIX-AZUAARDMSA-N 1 1 358.438 2.944 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccc(C3CCC3)cc1)C2 ZINC001072725863 1020294429 /nfs/dbraw/zinc/29/44/29/1020294429.db2.gz UNNIAWJRRJYEGK-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1ccc(C3CCC3)cc1)C2 ZINC001072725863 1020294440 /nfs/dbraw/zinc/29/44/40/1020294440.db2.gz UNNIAWJRRJYEGK-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccc(C3CCC3)cc1)C2 ZINC001072725863 1020294448 /nfs/dbraw/zinc/29/44/48/1020294448.db2.gz UNNIAWJRRJYEGK-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000802748911 1020382270 /nfs/dbraw/zinc/38/22/70/1020382270.db2.gz FYSOYNAIIWDNLV-CVEARBPZSA-N 1 1 364.409 2.956 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000802748911 1020382280 /nfs/dbraw/zinc/38/22/80/1020382280.db2.gz FYSOYNAIIWDNLV-CVEARBPZSA-N 1 1 364.409 2.956 20 5 FFBDMO COCCO[C@@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000800849783 1020592946 /nfs/dbraw/zinc/59/29/46/1020592946.db2.gz GDYVRGNGUMXZIM-GOSISDBHSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000800849783 1020592953 /nfs/dbraw/zinc/59/29/53/1020592953.db2.gz GDYVRGNGUMXZIM-GOSISDBHSA-N 1 1 360.414 2.543 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)COC(=O)N1 ZINC000932016179 1020666907 /nfs/dbraw/zinc/66/69/07/1020666907.db2.gz JJYNESCJPRKCDK-KSSFIOAISA-N 1 1 363.414 2.574 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1c1ccnn1C ZINC000932265045 1020759572 /nfs/dbraw/zinc/75/95/72/1020759572.db2.gz DWUARLKAXCMGNX-QGZVFWFLSA-N 1 1 357.414 2.802 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933079001 1020952528 /nfs/dbraw/zinc/95/25/28/1020952528.db2.gz IKSHDOXHBPNVHH-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933079001 1020952532 /nfs/dbraw/zinc/95/25/32/1020952532.db2.gz IKSHDOXHBPNVHH-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@@H]([C@H]2CCCO2)C1 ZINC000933183024 1020974550 /nfs/dbraw/zinc/97/45/50/1020974550.db2.gz ZVKNIKACKZMOPW-ZTFGCOKTSA-N 1 1 362.426 2.836 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000933945120 1021118405 /nfs/dbraw/zinc/11/84/05/1021118405.db2.gz QRVAKMQUDZRZQV-OAHLLOKOSA-N 1 1 363.433 2.857 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000750056645 1021284600 /nfs/dbraw/zinc/28/46/00/1021284600.db2.gz YNPLNVLMPJXANG-SFHVURJKSA-N 1 1 358.394 2.694 20 5 FFBDMO CON1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001117867601 1021952182 /nfs/dbraw/zinc/95/21/82/1021952182.db2.gz FYMWCQHQAJRJOP-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001117867601 1021952193 /nfs/dbraw/zinc/95/21/93/1021952193.db2.gz FYMWCQHQAJRJOP-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001020139364 1022563978 /nfs/dbraw/zinc/56/39/78/1022563978.db2.gz ZIMKSCAKHFJDAE-FXRXJOCMSA-N 1 1 353.422 2.550 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@]1(O)CCc2ccccc21 ZINC000829319739 1033099503 /nfs/dbraw/zinc/09/95/03/1033099503.db2.gz SSLVHUGNRVXHKC-HXUWFJFHSA-N 1 1 370.405 2.727 20 5 FFBDMO C[C@H](CCNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@@H+](C)Cc1ccccc1 ZINC000188216940 1023042311 /nfs/dbraw/zinc/04/23/11/1023042311.db2.gz BSNLWAKEBMKZFB-CQSZACIVSA-N 1 1 356.426 2.817 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351111 1033114414 /nfs/dbraw/zinc/11/44/14/1033114414.db2.gz TZBSJMTUJHLVIZ-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351111 1033114421 /nfs/dbraw/zinc/11/44/21/1033114421.db2.gz TZBSJMTUJHLVIZ-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829349962 1033111563 /nfs/dbraw/zinc/11/15/63/1033111563.db2.gz LCHXEZUDPWEBLE-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829349962 1033111568 /nfs/dbraw/zinc/11/15/68/1033111568.db2.gz LCHXEZUDPWEBLE-HXUWFJFHSA-N 1 1 369.421 2.608 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)OCCCc2[nH+]cc(C)c(OC)c2C)n1 ZINC000755834494 1023642770 /nfs/dbraw/zinc/64/27/70/1023642770.db2.gz NDPQAUHHSHGQIP-UHFFFAOYSA-N 1 1 362.386 2.621 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C2OCCO2)CC1 ZINC000195157985 1024949179 /nfs/dbraw/zinc/94/91/79/1024949179.db2.gz COMHQIALQCZFLU-GFCCVEGCSA-N 1 1 374.397 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(OC[C@H]4CCCO4)CC3)c2c1 ZINC000083630439 1025066903 /nfs/dbraw/zinc/06/69/03/1025066903.db2.gz ZDAVSXJTCPWODX-QGZVFWFLSA-N 1 1 360.414 2.562 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000837432737 1025801591 /nfs/dbraw/zinc/80/15/91/1025801591.db2.gz XYPLEVHGMVDDAL-INIZCTEOSA-N 1 1 360.414 2.751 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000839854334 1026848526 /nfs/dbraw/zinc/84/85/26/1026848526.db2.gz PEJGSMLDPMGHCL-OAHLLOKOSA-N 1 1 368.437 2.832 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c(N)c([N+](=O)[O-])c1 ZINC000839854334 1026848531 /nfs/dbraw/zinc/84/85/31/1026848531.db2.gz PEJGSMLDPMGHCL-OAHLLOKOSA-N 1 1 368.437 2.832 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCCc2ccccc2CC1 ZINC000840135049 1026973913 /nfs/dbraw/zinc/97/39/13/1026973913.db2.gz XNRCJWRCEHDPOO-UHFFFAOYSA-N 1 1 353.378 2.951 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCCc2ccccc2CC1 ZINC000840135049 1026973920 /nfs/dbraw/zinc/97/39/20/1026973920.db2.gz XNRCJWRCEHDPOO-UHFFFAOYSA-N 1 1 353.378 2.951 20 5 FFBDMO CCOC(=O)C1=C(Nc2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC[NH2+]C1 ZINC001159452962 1027395256 /nfs/dbraw/zinc/39/52/56/1027395256.db2.gz LIJOJWSWYOQHCW-UHFFFAOYSA-N 1 1 361.185 2.519 20 5 FFBDMO CCc1cc(NCC[C@H]2CCC[N@H+]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001160971189 1027954766 /nfs/dbraw/zinc/95/47/66/1027954766.db2.gz YSZKVPYDCAOJRI-MRXNPFEDSA-N 1 1 355.442 2.932 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC=C(c4ccncc4)C3)n2)c1 ZINC000795735735 1028073884 /nfs/dbraw/zinc/07/38/84/1028073884.db2.gz PXDPKOUHUYRCMQ-UHFFFAOYSA-N 1 1 362.393 2.995 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC=C(c4ccncc4)C3)n2)c1 ZINC000795735735 1028073903 /nfs/dbraw/zinc/07/39/03/1028073903.db2.gz PXDPKOUHUYRCMQ-UHFFFAOYSA-N 1 1 362.393 2.995 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CC1CCCCC1)CC2 ZINC000957550395 1028328574 /nfs/dbraw/zinc/32/85/74/1028328574.db2.gz YOVQLRVPCXROMH-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249943421 1028406465 /nfs/dbraw/zinc/40/64/65/1028406465.db2.gz XHWFCKSHZXPAKH-VXGBXAGGSA-N 1 1 364.402 2.662 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1nnc2ccccn21 ZINC001162185148 1028462904 /nfs/dbraw/zinc/46/29/04/1028462904.db2.gz BFHINNCTELTOCW-GFCCVEGCSA-N 1 1 352.398 2.799 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1nnc2ccccn21 ZINC001162185148 1028462908 /nfs/dbraw/zinc/46/29/08/1028462908.db2.gz BFHINNCTELTOCW-GFCCVEGCSA-N 1 1 352.398 2.799 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N[C@@]1(C)CCC[N@@H+](C)C1 ZINC001162341329 1028507946 /nfs/dbraw/zinc/50/79/46/1028507946.db2.gz KRAVQBUKVFFNDP-HNNXBMFYSA-N 1 1 356.810 2.716 20 5 FFBDMO Cc1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])c3c1CC[N@@H+](C)C3)C(=O)N2 ZINC001162573667 1028583905 /nfs/dbraw/zinc/58/39/05/1028583905.db2.gz CCEZGEDCDGOXPB-GOSISDBHSA-N 1 1 352.394 2.996 20 5 FFBDMO Cc1ccc2c(c1)[C@@H](Nc1ccc([N+](=O)[O-])c3c1CC[N@H+](C)C3)C(=O)N2 ZINC001162573667 1028583914 /nfs/dbraw/zinc/58/39/14/1028583914.db2.gz CCEZGEDCDGOXPB-GOSISDBHSA-N 1 1 352.394 2.996 20 5 FFBDMO CC/C=C\CC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162809983 1028664038 /nfs/dbraw/zinc/66/40/38/1028664038.db2.gz AWPGCKPYDZXUOH-IFEVLTCRSA-N 1 1 359.470 2.669 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001163437081 1028926482 /nfs/dbraw/zinc/92/64/82/1028926482.db2.gz JRRZWZNDCMGMBT-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO CN(CCCN(C)c1cccc(C(F)(F)F)c1[N+](=O)[O-])CC[NH+](C)C ZINC001163437081 1028926494 /nfs/dbraw/zinc/92/64/94/1028926494.db2.gz JRRZWZNDCMGMBT-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])c1 ZINC001163831721 1029083469 /nfs/dbraw/zinc/08/34/69/1029083469.db2.gz UHTGSUHTAPTLSX-KRWDZBQOSA-N 1 1 368.437 2.949 20 5 FFBDMO Cc1cc(N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164378881 1029267816 /nfs/dbraw/zinc/26/78/16/1029267816.db2.gz DAEFHPVTASFRST-BHYGNILZSA-N 1 1 353.426 2.534 20 5 FFBDMO Cc1cc(N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164378885 1029268219 /nfs/dbraw/zinc/26/82/19/1029268219.db2.gz DAEFHPVTASFRST-HYVNUMGLSA-N 1 1 353.426 2.534 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC001165109356 1029397042 /nfs/dbraw/zinc/39/70/42/1029397042.db2.gz UOVUQINSPUKOBH-ZDUSSCGKSA-N 1 1 354.838 2.723 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3nc(Cl)nc(SC)c3[N+](=O)[O-])C[C@H]2C1 ZINC001157690868 1029646655 /nfs/dbraw/zinc/64/66/55/1029646655.db2.gz GHLYCHPDLBEFAM-AOOOYVTPSA-N 1 1 357.867 2.538 20 5 FFBDMO O=C(NCCC[NH2+]Cc1csc2c1cccc2Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001157775243 1029661105 /nfs/dbraw/zinc/66/11/05/1029661105.db2.gz MJKGLPPYBSWHIO-TZMCWYRMSA-N 1 1 367.858 2.816 20 5 FFBDMO O=C(CC[N@H+]1CCOCC2(CCCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782543722 1029740570 /nfs/dbraw/zinc/74/05/70/1029740570.db2.gz OBYGQWRKBGTJOH-UHFFFAOYSA-N 1 1 365.405 2.955 20 5 FFBDMO O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001142263271 1030234937 /nfs/dbraw/zinc/23/49/37/1030234937.db2.gz ACWXKFKIPCUYON-MRXNPFEDSA-N 1 1 350.378 2.863 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCOCC4(CCOCC4)C3)c2)c1 ZINC000784045055 1030438382 /nfs/dbraw/zinc/43/83/82/1030438382.db2.gz NFNJTNZJUAIXSN-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCOCC4(CCOCC4)C3)c2)c1 ZINC000784045055 1030438388 /nfs/dbraw/zinc/43/83/88/1030438388.db2.gz NFNJTNZJUAIXSN-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@H](Oc4ccccc4)C3)n2)cc1 ZINC000842619343 1030835203 /nfs/dbraw/zinc/83/52/03/1030835203.db2.gz ZYOBOABFDXTECC-SFHVURJKSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@H](Oc4ccccc4)C3)n2)cc1 ZINC000842619343 1030835222 /nfs/dbraw/zinc/83/52/22/1030835222.db2.gz ZYOBOABFDXTECC-SFHVURJKSA-N 1 1 365.393 2.964 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC001534856211 1069693249 /nfs/dbraw/zinc/69/32/49/1069693249.db2.gz AJBRGQFJWFFFCJ-PBHICJAKSA-N 1 1 368.437 2.796 20 5 FFBDMO C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@](C)(O)c1ccccc1 ZINC000842626963 1030851268 /nfs/dbraw/zinc/85/12/68/1030851268.db2.gz QNCLIUIDPCPAPZ-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796715560 1030893806 /nfs/dbraw/zinc/89/38/06/1030893806.db2.gz GIGDVFVFWCVOJU-MRXNPFEDSA-N 1 1 365.430 2.963 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)[C@H]1CCC(=O)N1 ZINC001143128595 1031254875 /nfs/dbraw/zinc/25/48/75/1031254875.db2.gz KEQVSRWMIGXEGY-MRXNPFEDSA-N 1 1 362.433 2.980 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193830 1031689313 /nfs/dbraw/zinc/68/93/13/1031689313.db2.gz BDYQYXUQVWWYOZ-AWEZNQCLSA-N 1 1 370.409 2.817 20 5 FFBDMO O=C([C@@H]1CCCC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001138247074 1034015687 /nfs/dbraw/zinc/01/56/87/1034015687.db2.gz AOERMUDTRUXGCK-IBGZPJMESA-N 1 1 373.453 2.982 20 5 FFBDMO Cc1ccc(N2CCC(Oc3ncc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)[nH+]c1 ZINC001227110882 1034939218 /nfs/dbraw/zinc/93/92/18/1034939218.db2.gz FWFSUWOXEXQBSW-UHFFFAOYSA-N 1 1 359.342 2.649 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001227502282 1035589264 /nfs/dbraw/zinc/58/92/64/1035589264.db2.gz ZPZCNWFDSPQTAZ-MSRIBSCDSA-N 1 1 366.330 2.520 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC001140895721 1036403571 /nfs/dbraw/zinc/40/35/71/1036403571.db2.gz GAWKMCWKICXDBQ-HNNXBMFYSA-N 1 1 368.437 2.771 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377418 1036640925 /nfs/dbraw/zinc/64/09/25/1036640925.db2.gz CWKRXDGMDPPCOQ-OWCLPIDISA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377418 1036640931 /nfs/dbraw/zinc/64/09/31/1036640931.db2.gz CWKRXDGMDPPCOQ-OWCLPIDISA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377418 1036640937 /nfs/dbraw/zinc/64/09/37/1036640937.db2.gz CWKRXDGMDPPCOQ-OWCLPIDISA-N 1 1 370.409 2.688 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2nc3c[nH]cc([N+](=O)[O-])c-3n2)C1 ZINC001230231708 1037163535 /nfs/dbraw/zinc/16/35/35/1037163535.db2.gz QDTVAZSPLRWHKD-QWHCGFSZSA-N 1 1 368.397 2.866 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H](N(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256098684 1038382407 /nfs/dbraw/zinc/38/24/07/1038382407.db2.gz CMDJAILBWKANLK-QGZVFWFLSA-N 1 1 362.474 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@H]([NH+](C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256098684 1038382415 /nfs/dbraw/zinc/38/24/15/1038382415.db2.gz CMDJAILBWKANLK-QGZVFWFLSA-N 1 1 362.474 2.598 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCN4CCCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099172 1038385065 /nfs/dbraw/zinc/38/50/65/1038385065.db2.gz MBILKKXIPNUZML-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[N@@H+]4CCCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099172 1038385077 /nfs/dbraw/zinc/38/50/77/1038385077.db2.gz MBILKKXIPNUZML-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC(N3CC[N@H+]4CCCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099172 1038385087 /nfs/dbraw/zinc/38/50/87/1038385087.db2.gz MBILKKXIPNUZML-GOSISDBHSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346745 1038486012 /nfs/dbraw/zinc/48/60/12/1038486012.db2.gz KYXCKOTXOOSSSN-WBVHZDCISA-N 1 1 373.384 2.918 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346745 1038486017 /nfs/dbraw/zinc/48/60/17/1038486017.db2.gz KYXCKOTXOOSSSN-WBVHZDCISA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cccc(Cc2nnc(CC[NH+]3C[C@H](C)O[C@@H](C)C3)o2)c1[N+](=O)[O-] ZINC001258101845 1039173176 /nfs/dbraw/zinc/17/31/76/1039173176.db2.gz NKCYENDXOAJJDN-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCNC[C@H]3C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001246692276 1039438903 /nfs/dbraw/zinc/43/89/03/1039438903.db2.gz GIJXLAFZWLVDIO-SFHVURJKSA-N 1 1 362.474 2.502 20 5 FFBDMO COc1cc(N2CCC(N3CC[NH2+]C[C@H]3C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001246692276 1039438907 /nfs/dbraw/zinc/43/89/07/1039438907.db2.gz GIJXLAFZWLVDIO-SFHVURJKSA-N 1 1 362.474 2.502 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1-c1noc(CCc2ccc3c([nH+]2)NCCC3)n1 ZINC001247273743 1039685629 /nfs/dbraw/zinc/68/56/29/1039685629.db2.gz WVMQNHXEZKSCSS-UHFFFAOYSA-N 1 1 370.344 2.717 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479889 1040745918 /nfs/dbraw/zinc/74/59/18/1040745918.db2.gz PFXNHPWZAAPREY-GJZGRUSLSA-N 1 1 361.442 2.695 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncc(Br)cn1 ZINC001254539469 1040789160 /nfs/dbraw/zinc/78/91/60/1040789160.db2.gz HPXLFGGSXMPAEO-SNVBAGLBSA-N 1 1 351.204 2.868 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001254560586 1040797002 /nfs/dbraw/zinc/79/70/02/1040797002.db2.gz VZBAEUFFYGDYNM-HNNXBMFYSA-N 1 1 357.410 2.967 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCCN(C(=O)c2ccco2)CC1 ZINC001254560586 1040797022 /nfs/dbraw/zinc/79/70/22/1040797022.db2.gz VZBAEUFFYGDYNM-HNNXBMFYSA-N 1 1 357.410 2.967 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2ccccn2)C1 ZINC001254568423 1040805143 /nfs/dbraw/zinc/80/51/43/1040805143.db2.gz FRXBQXXMLJEDSE-DOTOQJQBSA-N 1 1 368.437 2.815 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2ccncc2)C1 ZINC001254568507 1040806502 /nfs/dbraw/zinc/80/65/02/1040806502.db2.gz GJYXQNCTIGCXPS-MAUKXSAKSA-N 1 1 368.437 2.815 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(CCc3ccccc3)CC1)C2 ZINC001254600760 1040831795 /nfs/dbraw/zinc/83/17/95/1040831795.db2.gz RHPYQNNESWXRIU-OAQYLSRUSA-N 1 1 351.450 2.922 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254610637 1040839546 /nfs/dbraw/zinc/83/95/46/1040839546.db2.gz LWUUXAVMBHRENC-HYVNUMGLSA-N 1 1 359.426 2.613 20 5 FFBDMO CC(C)[N@H+]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2CC2CC2)CC1 ZINC001263677333 1042431887 /nfs/dbraw/zinc/43/18/87/1042431887.db2.gz NQHPYVQZXQPMEC-UHFFFAOYSA-N 1 1 374.445 2.777 20 5 FFBDMO CCOc1cc(NC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OCC ZINC001309999359 1043621394 /nfs/dbraw/zinc/62/13/94/1043621394.db2.gz BIEXEXYXHKCTRY-NEPJUHHUSA-N 1 1 366.418 2.606 20 5 FFBDMO Cc1cc(NC(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC001311321026 1043885613 /nfs/dbraw/zinc/88/56/13/1043885613.db2.gz PRVHKQFFCVCGOH-DLBZAZTESA-N 1 1 362.430 2.668 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC001311321029 1043886018 /nfs/dbraw/zinc/88/60/18/1043886018.db2.gz PRVHKQFFCVCGOH-SJORKVTESA-N 1 1 362.430 2.668 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256845 1045376683 /nfs/dbraw/zinc/37/66/83/1045376683.db2.gz DBPUTWAEOATGSO-QAPCUYQASA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256845 1045376688 /nfs/dbraw/zinc/37/66/88/1045376688.db2.gz DBPUTWAEOATGSO-QAPCUYQASA-N 1 1 372.400 2.951 20 5 FFBDMO Cc1c(C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1cc[nH+]cc1 ZINC001323454782 1045597165 /nfs/dbraw/zinc/59/71/65/1045597165.db2.gz BQUCBQFXHLYDFZ-UHFFFAOYSA-N 1 1 366.333 2.524 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2c(C)cncc2[N+](=O)[O-])CC1 ZINC001324253794 1045939352 /nfs/dbraw/zinc/93/93/52/1045939352.db2.gz IGHMWVRYLDIGJG-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001744 1046302426 /nfs/dbraw/zinc/30/24/26/1046302426.db2.gz AGISPAYCDKQONJ-FUHWJXTLSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323001744 1046302435 /nfs/dbraw/zinc/30/24/35/1046302435.db2.gz AGISPAYCDKQONJ-FUHWJXTLSA-N 1 1 372.400 2.951 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001325525621 1046539854 /nfs/dbraw/zinc/53/98/54/1046539854.db2.gz JFXMDOWZYGPKRY-ZDUSSCGKSA-N 1 1 354.838 2.603 20 5 FFBDMO COC[C@@H]([NH2+]Cc1c(Br)cccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC001341427791 1051783711 /nfs/dbraw/zinc/78/37/11/1051783711.db2.gz PMVFXTRNKMQRRU-TZMCWYRMSA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001306858375 1052202810 /nfs/dbraw/zinc/20/28/10/1052202810.db2.gz DOJLSHQNNGOVAS-AWEZNQCLSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001306858375 1052202816 /nfs/dbraw/zinc/20/28/16/1052202816.db2.gz DOJLSHQNNGOVAS-AWEZNQCLSA-N 1 1 358.442 2.504 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@]12C[C@H]1COC21CCC1 ZINC001343650303 1052356246 /nfs/dbraw/zinc/35/62/46/1052356246.db2.gz MTFLNLFDKOAOGJ-KNBMTAEXSA-N 1 1 372.421 2.672 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@]12C[C@H]1COC21CCC1 ZINC001343650303 1052356249 /nfs/dbraw/zinc/35/62/49/1052356249.db2.gz MTFLNLFDKOAOGJ-KNBMTAEXSA-N 1 1 372.421 2.672 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC001307929414 1052367295 /nfs/dbraw/zinc/36/72/95/1052367295.db2.gz YHXWIMKBHPTTEV-ZGMNHVEMSA-N 1 1 358.398 2.799 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001307935977 1052368173 /nfs/dbraw/zinc/36/81/73/1052368173.db2.gz GFCYOEYDMMXBSL-UHFFFAOYSA-N 1 1 353.419 2.820 20 5 FFBDMO C[N@H+](CCOCCNC(=O)OC(C)(C)C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001307992232 1052378132 /nfs/dbraw/zinc/37/81/32/1052378132.db2.gz PPMYOOZGACFUSL-UHFFFAOYSA-N 1 1 371.409 2.707 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001307992232 1052378133 /nfs/dbraw/zinc/37/81/33/1052378133.db2.gz PPMYOOZGACFUSL-UHFFFAOYSA-N 1 1 371.409 2.707 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCCCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1 ZINC001307994212 1052379158 /nfs/dbraw/zinc/37/91/58/1052379158.db2.gz ZWHBFEUWFWYEFJ-CQSZACIVSA-N 1 1 367.450 2.561 20 5 FFBDMO COc1nscc1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001308110107 1052409136 /nfs/dbraw/zinc/40/91/36/1052409136.db2.gz VNESFRVNVXVNON-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1nscc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001308110107 1052409141 /nfs/dbraw/zinc/40/91/41/1052409141.db2.gz VNESFRVNVXVNON-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO O=C(CC[NH2+][C@@H](CO)c1cc(F)ccc1F)Nc1ccc([N+](=O)[O-])cc1 ZINC001308158691 1052420286 /nfs/dbraw/zinc/42/02/86/1052420286.db2.gz RHYVARLDPTXIFT-INIZCTEOSA-N 1 1 365.336 2.525 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC001308578992 1052472277 /nfs/dbraw/zinc/47/22/77/1052472277.db2.gz WHFCELZBXKQCNS-HNNXBMFYSA-N 1 1 373.375 2.910 20 5 FFBDMO COC(=O)[C@@H]1[C@@H](C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1(F)F ZINC001308774214 1052497981 /nfs/dbraw/zinc/49/79/81/1052497981.db2.gz QTDPQVVMCINCAI-YUELXQCFSA-N 1 1 354.353 2.829 20 5 FFBDMO Cn1c([C@@H]2CCC[N@@H+]2C)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001338769626 1055798056 /nfs/dbraw/zinc/79/80/56/1055798056.db2.gz LYHWXDFKMAYDCW-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO Cn1c([C@@H]2CCC[N@H+]2C)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001338769626 1055798068 /nfs/dbraw/zinc/79/80/68/1055798068.db2.gz LYHWXDFKMAYDCW-INIZCTEOSA-N 1 1 356.430 2.659 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001543997504 1071579848 /nfs/dbraw/zinc/57/98/48/1071579848.db2.gz MPJSZVMPIXSIDJ-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CNc1cc2c(nn1)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C2 ZINC000609269787 1056416526 /nfs/dbraw/zinc/41/65/26/1056416526.db2.gz UYBREZJDTBRIBX-UHFFFAOYSA-N 1 1 357.414 2.772 20 5 FFBDMO CNc1cc2c(nn1)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C2 ZINC000609269787 1056416536 /nfs/dbraw/zinc/41/65/36/1056416536.db2.gz UYBREZJDTBRIBX-UHFFFAOYSA-N 1 1 357.414 2.772 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001339466505 1056481675 /nfs/dbraw/zinc/48/16/75/1056481675.db2.gz GTUSPKGDNOEWHO-UHFFFAOYSA-N 1 1 362.434 2.777 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@H+](C)CCO1 ZINC000619527316 1056555716 /nfs/dbraw/zinc/55/57/16/1056555716.db2.gz HHABEHLAVPCCIL-MLGOLLRUSA-N 1 1 360.389 2.927 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H]1C[N@@H+](C)CCO1 ZINC000619527316 1056555724 /nfs/dbraw/zinc/55/57/24/1056555724.db2.gz HHABEHLAVPCCIL-MLGOLLRUSA-N 1 1 360.389 2.927 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)CC1(C)C ZINC001456172974 1060036963 /nfs/dbraw/zinc/03/69/63/1060036963.db2.gz FQGCVJJOZDAOGV-ZDUSSCGKSA-N 1 1 370.247 2.736 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000848478486 1060109268 /nfs/dbraw/zinc/10/92/68/1060109268.db2.gz NYMVISCJJPZYKL-WBVHZDCISA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000848478486 1060109286 /nfs/dbraw/zinc/10/92/86/1060109286.db2.gz NYMVISCJJPZYKL-WBVHZDCISA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@H](OCC2CC2)C1 ZINC000848485262 1060126582 /nfs/dbraw/zinc/12/65/82/1060126582.db2.gz XFTNUYWYGQKLCP-RBUKOAKNSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H](OCC2CC2)C1 ZINC000848485262 1060126590 /nfs/dbraw/zinc/12/65/90/1060126590.db2.gz XFTNUYWYGQKLCP-RBUKOAKNSA-N 1 1 373.453 2.759 20 5 FFBDMO C[C@]12CC[N@H+](CN3CC[C@H](c4ccc([N+](=O)[O-])cc4)C3=O)C[C@H]1C2(F)F ZINC000848491872 1060150107 /nfs/dbraw/zinc/15/01/07/1060150107.db2.gz ZLVZZKBFMIAAOL-INMHGKMJSA-N 1 1 365.380 2.845 20 5 FFBDMO C[C@]12CC[N@@H+](CN3CC[C@H](c4ccc([N+](=O)[O-])cc4)C3=O)C[C@H]1C2(F)F ZINC000848491872 1060150113 /nfs/dbraw/zinc/15/01/13/1060150113.db2.gz ZLVZZKBFMIAAOL-INMHGKMJSA-N 1 1 365.380 2.845 20 5 FFBDMO CC1(C)CN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC[N@H+]1CCO ZINC001458321419 1060565036 /nfs/dbraw/zinc/56/50/36/1060565036.db2.gz HUEZSIXRIPCBGT-UHFFFAOYSA-N 1 1 364.833 2.689 20 5 FFBDMO Nc1nc(N[C@@H]2CCCCC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC001458536591 1060615392 /nfs/dbraw/zinc/61/53/92/1060615392.db2.gz PBBJGTOEDRAMDF-OAHLLOKOSA-N 1 1 356.430 2.824 20 5 FFBDMO O=C(COC(=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000848774734 1060660768 /nfs/dbraw/zinc/66/07/68/1060660768.db2.gz QZCPCYPKWWXMEY-KRWDZBQOSA-N 1 1 368.389 2.843 20 5 FFBDMO O=C(COC(=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000848774849 1060661492 /nfs/dbraw/zinc/66/14/92/1060661492.db2.gz NYFDKYZYOLVAQR-KRWDZBQOSA-N 1 1 368.389 2.843 20 5 FFBDMO C[N@@H+](CCOCCNC(=O)OC(C)(C)C)Cc1cccc([N+](=O)[O-])c1 ZINC001460602565 1061028274 /nfs/dbraw/zinc/02/82/74/1061028274.db2.gz HUZZMMAMHRSHGH-UHFFFAOYSA-N 1 1 353.419 2.568 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001475502699 1061117285 /nfs/dbraw/zinc/11/72/85/1061117285.db2.gz IMXOAENFMMMAIO-INIZCTEOSA-N 1 1 367.471 2.589 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2C[C@H]3CSC[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001460900292 1061144403 /nfs/dbraw/zinc/14/44/03/1061144403.db2.gz ZQJLQGXIILKWDE-BWACUDIHSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2C[C@H]3CSC[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001460900292 1061144410 /nfs/dbraw/zinc/14/44/10/1061144410.db2.gz ZQJLQGXIILKWDE-BWACUDIHSA-N 1 1 365.455 2.615 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001546208131 1061310290 /nfs/dbraw/zinc/31/02/90/1061310290.db2.gz GMCQQGRNPUGWEX-GDBMZVCRSA-N 1 1 368.437 2.817 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2ccc(N3CCOC3=O)cc2)c1[N+](=O)[O-] ZINC001461993928 1061473152 /nfs/dbraw/zinc/47/31/52/1061473152.db2.gz XDQQWKONGVPXHM-UHFFFAOYSA-N 1 1 373.365 2.555 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)n1 ZINC001464876129 1062888224 /nfs/dbraw/zinc/88/82/24/1062888224.db2.gz YSXTXVUCBKRCQR-QGZVFWFLSA-N 1 1 368.437 2.593 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)CC1 ZINC001464893405 1062897335 /nfs/dbraw/zinc/89/73/35/1062897335.db2.gz YMINPILFIXSNRD-UHFFFAOYSA-N 1 1 357.842 2.555 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1N)c1ccccc1Cl ZINC001440374226 1063298451 /nfs/dbraw/zinc/29/84/51/1063298451.db2.gz LDYTWADFIVQXST-MRXNPFEDSA-N 1 1 362.817 2.863 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[N@H+]1CCCC[C@H]1C ZINC001441491723 1063446801 /nfs/dbraw/zinc/44/68/01/1063446801.db2.gz HACSXYXWKJUTBJ-ZJUUUORDSA-N 1 1 372.828 2.962 20 5 FFBDMO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969473 1078182457 /nfs/dbraw/zinc/18/24/57/1078182457.db2.gz KGCOSJRIBJAGFI-OUAUKWLOSA-N 1 1 365.463 2.615 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969473 1078182460 /nfs/dbraw/zinc/18/24/60/1078182460.db2.gz KGCOSJRIBJAGFI-OUAUKWLOSA-N 1 1 365.463 2.615 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+](Cc2ccc(O)cc2)CC1 ZINC001473734680 1065340882 /nfs/dbraw/zinc/34/08/82/1065340882.db2.gz KMTYWVWVBOOPQT-UHFFFAOYSA-N 1 1 357.410 2.627 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NCc1c(Br)cccc1[N+](=O)[O-] ZINC001474060807 1065448761 /nfs/dbraw/zinc/44/87/61/1065448761.db2.gz BJPMDCKOBHMODW-HZMBPMFUSA-N 1 1 354.248 2.930 20 5 FFBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC001582804886 1079111423 /nfs/dbraw/zinc/11/14/23/1079111423.db2.gz QDIWDQKTINPBSV-NSHDSACASA-N 1 1 363.447 2.655 20 5 FFBDMO O=[N+]([O-])c1sc(-c2nn[nH]n2)cc1NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001582804886 1079111424 /nfs/dbraw/zinc/11/14/24/1079111424.db2.gz QDIWDQKTINPBSV-NSHDSACASA-N 1 1 363.447 2.655 20 5 FFBDMO CON(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CC[N@@H+](C)C1CCCC1 ZINC001555761069 1075679174 /nfs/dbraw/zinc/67/91/74/1075679174.db2.gz JEQJPWJIZFKJOU-UHFFFAOYSA-N 1 1 374.445 2.725 20 5 FFBDMO C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)C[N@H+]2C1 ZINC001557207955 1075822339 /nfs/dbraw/zinc/82/23/39/1075822339.db2.gz GLOGPCTUGLUVII-WZRBSPASSA-N 1 1 353.369 2.610 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001559235062 1076137755 /nfs/dbraw/zinc/13/77/55/1076137755.db2.gz IUZFHAMITAWPIN-LBPRGKRZSA-N 1 1 359.386 2.758 20 5 FFBDMO Nc1nc(N[C@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001559300481 1076147953 /nfs/dbraw/zinc/14/79/53/1076147953.db2.gz RQBLICGGBFDYLZ-PMPSAXMXSA-N 1 1 368.441 2.680 20 5 FFBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)C(=O)OCC ZINC001559806414 1076192789 /nfs/dbraw/zinc/19/27/89/1076192789.db2.gz VHBBMRCBIXHCRM-AWEZNQCLSA-N 1 1 365.430 2.895 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001560116640 1076230049 /nfs/dbraw/zinc/23/00/49/1076230049.db2.gz FRPZEOZSICESOT-LBPRGKRZSA-N 1 1 351.359 2.668 20 5 FFBDMO CN(C(=O)C[N@@H+]1C[C@H]2C[C@@]2(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001560137671 1076233676 /nfs/dbraw/zinc/23/36/76/1076233676.db2.gz IHSSAOKJMAERPI-UZLBHIALSA-N 1 1 351.406 2.831 20 5 FFBDMO CN(C(=O)C[N@H+]1C[C@H]2C[C@@]2(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001560137671 1076233680 /nfs/dbraw/zinc/23/36/80/1076233680.db2.gz IHSSAOKJMAERPI-UZLBHIALSA-N 1 1 351.406 2.831 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c(C)cc1[N+](=O)[O-] ZINC001561170359 1076342147 /nfs/dbraw/zinc/34/21/47/1076342147.db2.gz FZSJIMKBULDZAG-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001561350440 1076366431 /nfs/dbraw/zinc/36/64/31/1076366431.db2.gz KNHKNPNTDANAFQ-MJBXVCDLSA-N 1 1 369.487 2.548 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCCn1cc[nH+]c1C(C)C ZINC001561946152 1076451286 /nfs/dbraw/zinc/45/12/86/1076451286.db2.gz YHDXZJGTFCBSGX-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO Cc1ccc(NCCCNC(=O)Cn2cc[nH+]c2C(C)C)c([N+](=O)[O-])c1 ZINC001586525992 1079645240 /nfs/dbraw/zinc/64/52/40/1079645240.db2.gz XBQSOKQYHZZDEJ-UHFFFAOYSA-N 1 1 359.430 2.842 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001586784935 1079685733 /nfs/dbraw/zinc/68/57/33/1079685733.db2.gz ZZXQFXVQPFJBNC-MRXNPFEDSA-N 1 1 351.422 2.903 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC001587223802 1079756946 /nfs/dbraw/zinc/75/69/46/1079756946.db2.gz VVQIYBQFTJNMRY-UHFFFAOYSA-N 1 1 367.405 2.561 20 5 FFBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590166170 1081065642 /nfs/dbraw/zinc/06/56/42/1081065642.db2.gz VTLCRCUSEVJLBZ-KWQFWETISA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)C1 ZINC001590227878 1081108733 /nfs/dbraw/zinc/10/87/33/1081108733.db2.gz TYEXLYDSSSQAKE-VNHYZAJKSA-N 1 1 371.445 2.617 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@H](C)[C@H]2C)c([N+](=O)[O-])c1 ZINC000411283158 512561254 /nfs/dbraw/zinc/56/12/54/512561254.db2.gz YNWNCYDEWCXVSO-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000109286421 209302875 /nfs/dbraw/zinc/30/28/75/209302875.db2.gz QLNPDCZVFROJDF-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO C[N@H+]1CCCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000096952891 209164816 /nfs/dbraw/zinc/16/48/16/209164816.db2.gz YHSMVYPTTDJOLV-UHFFFAOYSA-N 1 1 374.363 2.580 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093755764 250045014 /nfs/dbraw/zinc/04/50/14/250045014.db2.gz OMDXQILNNPLGPT-LBPRGKRZSA-N 1 1 360.357 2.681 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000093755764 250045021 /nfs/dbraw/zinc/04/50/21/250045021.db2.gz OMDXQILNNPLGPT-LBPRGKRZSA-N 1 1 360.357 2.681 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186809104 251266449 /nfs/dbraw/zinc/26/64/49/251266449.db2.gz MABKMLNLSLXYBU-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCSC2(CCOCC2)C1 ZINC000186809104 251266453 /nfs/dbraw/zinc/26/64/53/251266453.db2.gz MABKMLNLSLXYBU-ZDUSSCGKSA-N 1 1 365.455 2.520 20 5 FFBDMO Cc1noc(C)c1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272474387 252047914 /nfs/dbraw/zinc/04/79/14/252047914.db2.gz AZXZGFLSUCOMNJ-KRWDZBQOSA-N 1 1 355.398 2.855 20 5 FFBDMO Cc1cc(C[C@H](C)[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000272586849 252074068 /nfs/dbraw/zinc/07/40/68/252074068.db2.gz ZHNFVBHJJFSIHO-YVEFUNNKSA-N 1 1 354.414 2.670 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000272917342 252164179 /nfs/dbraw/zinc/16/41/79/252164179.db2.gz DQRSOEWTJFIDMO-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC000273067436 252207432 /nfs/dbraw/zinc/20/74/32/252207432.db2.gz FBCOBHXGVIMFAZ-HNNXBMFYSA-N 1 1 362.817 2.822 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276232602 256082464 /nfs/dbraw/zinc/08/24/64/256082464.db2.gz KTUATPMLHQFDGM-ZDUSSCGKSA-N 1 1 364.402 2.691 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000276232602 256082466 /nfs/dbraw/zinc/08/24/66/256082466.db2.gz KTUATPMLHQFDGM-ZDUSSCGKSA-N 1 1 364.402 2.691 20 5 FFBDMO CSc1ccc(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000277654157 256222562 /nfs/dbraw/zinc/22/25/62/256222562.db2.gz SVFLIIBILFSUNY-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278485918 256317564 /nfs/dbraw/zinc/31/75/64/256317564.db2.gz SNKCGSATBZLCRU-GFCCVEGCSA-N 1 1 360.336 2.507 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@@H](C)OC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000279124214 256383900 /nfs/dbraw/zinc/38/39/00/256383900.db2.gz UVRMWKYHCBNDAI-CQSZACIVSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@@H](C)OC3(CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000279124214 256383902 /nfs/dbraw/zinc/38/39/02/256383902.db2.gz UVRMWKYHCBNDAI-CQSZACIVSA-N 1 1 350.415 2.763 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000286461475 257038121 /nfs/dbraw/zinc/03/81/21/257038121.db2.gz KKRDMXVILFUFDW-RFLUGMABSA-N 1 1 356.382 2.500 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1nccc(C(N)=O)c1[N+](=O)[O-] ZINC000290973192 257369515 /nfs/dbraw/zinc/36/95/15/257369515.db2.gz QGSMGZCDHJRXQT-MRXNPFEDSA-N 1 1 371.441 2.657 20 5 FFBDMO Cc1cc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cc(N2CCCC2)[nH+]1 ZINC000290485652 257334722 /nfs/dbraw/zinc/33/47/22/257334722.db2.gz HPJDZDLPGKACOJ-UHFFFAOYSA-N 1 1 373.388 2.550 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294618867 257595468 /nfs/dbraw/zinc/59/54/68/257595468.db2.gz XTOMBEVXNDPZID-CYBMUJFWSA-N 1 1 358.398 2.515 20 5 FFBDMO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301109624 258025958 /nfs/dbraw/zinc/02/59/58/258025958.db2.gz RPNVWZZJBIHVHB-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000301109624 258025960 /nfs/dbraw/zinc/02/59/60/258025960.db2.gz RPNVWZZJBIHVHB-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc(N[C@H](C)[C@@H](C)[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301187210 258032716 /nfs/dbraw/zinc/03/27/16/258032716.db2.gz KFNMUTZQGMYGDJ-HUUCEWRRSA-N 1 1 371.441 2.881 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccn2)CC1)Nc1cccc(F)c1[N+](=O)[O-] ZINC000301299651 258041019 /nfs/dbraw/zinc/04/10/19/258041019.db2.gz UHTLQJRNAJCPDW-CQSZACIVSA-N 1 1 359.405 2.752 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000302195416 258093883 /nfs/dbraw/zinc/09/38/83/258093883.db2.gz SIKKGOJPXNILNB-HOCLYGCPSA-N 1 1 359.426 2.835 20 5 FFBDMO COC(=O)c1cc(NCCc2cn3c([nH+]2)CCCC3)cc(C)c1[N+](=O)[O-] ZINC000302640288 258107159 /nfs/dbraw/zinc/10/71/59/258107159.db2.gz ICYVSDDPUBISJX-UHFFFAOYSA-N 1 1 358.398 2.877 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302772842 258110337 /nfs/dbraw/zinc/11/03/37/258110337.db2.gz NOBVUFNJDONXBR-CZUORRHYSA-N 1 1 370.409 2.851 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1)CCN2 ZINC000302882843 258113543 /nfs/dbraw/zinc/11/35/43/258113543.db2.gz KGOXRUGFHDRWFC-CVEARBPZSA-N 1 1 368.437 2.610 20 5 FFBDMO CS(=O)(=O)c1cccc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000301866930 258071712 /nfs/dbraw/zinc/07/17/12/258071712.db2.gz GDUFMSDBQBRAQW-AWEZNQCLSA-N 1 1 367.471 2.675 20 5 FFBDMO CN(c1ccc2ncc([N+](=O)[O-])n2n1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000301965578 258078394 /nfs/dbraw/zinc/07/83/94/258078394.db2.gz KDAPNYZNHHYGRA-INIZCTEOSA-N 1 1 366.425 2.738 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000330691302 258168526 /nfs/dbraw/zinc/16/85/26/258168526.db2.gz BCWRWYNUVGNVTC-NVXWUHKLSA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000332030112 258211082 /nfs/dbraw/zinc/21/10/82/258211082.db2.gz HLIPLDNLUDOWGI-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000065734344 506352900 /nfs/dbraw/zinc/35/29/00/506352900.db2.gz ZUXNVKBDEJVSDL-CQSZACIVSA-N 1 1 371.441 2.970 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000369066565 512210785 /nfs/dbraw/zinc/21/07/85/512210785.db2.gz RUBOLJVQMZJRKS-HNNXBMFYSA-N 1 1 369.425 2.527 20 5 FFBDMO CNC(=O)c1ccc(NCCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000053552970 506404354 /nfs/dbraw/zinc/40/43/54/506404354.db2.gz IBFQFWFGEMURPQ-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000053666772 506424386 /nfs/dbraw/zinc/42/43/86/506424386.db2.gz OEJJPEJTMMEIDU-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000007685848 506579814 /nfs/dbraw/zinc/57/98/14/506579814.db2.gz ZABBWPMYGXPBNF-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000007685848 506579818 /nfs/dbraw/zinc/57/98/18/506579818.db2.gz ZABBWPMYGXPBNF-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000054677493 506601026 /nfs/dbraw/zinc/60/10/26/506601026.db2.gz LKCMXDVRTVYUNV-GFCCVEGCSA-N 1 1 360.370 2.532 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000054677493 506601035 /nfs/dbraw/zinc/60/10/35/506601035.db2.gz LKCMXDVRTVYUNV-GFCCVEGCSA-N 1 1 360.370 2.532 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[NH+](C)C ZINC000010448119 506742423 /nfs/dbraw/zinc/74/24/23/506742423.db2.gz KEDFYLKYQXZMTK-INIZCTEOSA-N 1 1 373.409 2.645 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000055642706 506811462 /nfs/dbraw/zinc/81/14/62/506811462.db2.gz ACSPVEVTPNMFEU-UHFFFAOYSA-N 1 1 359.451 2.586 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1 ZINC000367026222 512301969 /nfs/dbraw/zinc/30/19/69/512301969.db2.gz KSXPQPGINKIDEV-IBGZPJMESA-N 1 1 368.437 2.655 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1 ZINC000367026222 512301974 /nfs/dbraw/zinc/30/19/74/512301974.db2.gz KSXPQPGINKIDEV-IBGZPJMESA-N 1 1 368.437 2.655 20 5 FFBDMO CC(C)COC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000067377758 506850793 /nfs/dbraw/zinc/85/07/93/506850793.db2.gz JDANLIXVLNDBBL-GOSISDBHSA-N 1 1 361.442 2.837 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000045455527 506969972 /nfs/dbraw/zinc/96/99/72/506969972.db2.gz RVMQVAADVYWXLP-UHFFFAOYSA-N 1 1 368.437 2.865 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000068085107 507104538 /nfs/dbraw/zinc/10/45/38/507104538.db2.gz IJYJWKHHQABEEK-ZDUSSCGKSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@H]1CCC[N@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085107 507104542 /nfs/dbraw/zinc/10/45/42/507104542.db2.gz IJYJWKHHQABEEK-ZDUSSCGKSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085107 507104551 /nfs/dbraw/zinc/10/45/51/507104551.db2.gz IJYJWKHHQABEEK-ZDUSSCGKSA-N 1 1 359.430 2.713 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269018 512321147 /nfs/dbraw/zinc/32/11/47/512321147.db2.gz VCSFWQYZYXFMKC-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO C[NH+]1CCC(N2CC[C@H](Nc3ccc4ncccc4c3[N+](=O)[O-])C2)CC1 ZINC000369269018 512321151 /nfs/dbraw/zinc/32/11/51/512321151.db2.gz VCSFWQYZYXFMKC-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)CNc2ccccc2[N+](=O)[O-])cn1 ZINC000068216649 507152020 /nfs/dbraw/zinc/15/20/20/507152020.db2.gz QSDSCRWUHJMYOS-UHFFFAOYSA-N 1 1 352.354 2.535 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCOC1)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000047405768 507324372 /nfs/dbraw/zinc/32/43/72/507324372.db2.gz XUJWXRVYMVLHNB-NSHDSACASA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(NC1CC[NH+](CC2CCCC2)CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068811315 507331989 /nfs/dbraw/zinc/33/19/89/507331989.db2.gz CMXCYMWYGZYZFC-UHFFFAOYSA-N 1 1 371.441 2.856 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CC(=O)Nc1ccccc1 ZINC000047593103 507362301 /nfs/dbraw/zinc/36/23/01/507362301.db2.gz HJQAGZMTPZQXFA-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC(=O)Nc1ccccc1 ZINC000047593103 507362307 /nfs/dbraw/zinc/36/23/07/507362307.db2.gz HJQAGZMTPZQXFA-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000023691850 507364779 /nfs/dbraw/zinc/36/47/79/507364779.db2.gz OHZDXBPNSZVLCW-QGZVFWFLSA-N 1 1 357.410 2.565 20 5 FFBDMO Cc1cc(C)cc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1 ZINC000026486997 507591625 /nfs/dbraw/zinc/59/16/25/507591625.db2.gz QIYPVGPXAWFFFF-UHFFFAOYSA-N 1 1 356.426 2.808 20 5 FFBDMO O=C(C[N@H+](Cc1ccccc1)C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026918436 507622296 /nfs/dbraw/zinc/62/22/96/507622296.db2.gz LHDFSWKUQYFJSU-UHFFFAOYSA-N 1 1 369.377 2.927 20 5 FFBDMO O=C(C[N@@H+](Cc1ccccc1)C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026918436 507622301 /nfs/dbraw/zinc/62/23/01/507622301.db2.gz LHDFSWKUQYFJSU-UHFFFAOYSA-N 1 1 369.377 2.927 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[NH+](CC2CCCCC2)CC1 ZINC000070826309 507645275 /nfs/dbraw/zinc/64/52/75/507645275.db2.gz ZCSWARRGRLOHPK-UHFFFAOYSA-N 1 1 371.441 2.809 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F ZINC000063254733 507706518 /nfs/dbraw/zinc/70/65/18/507706518.db2.gz RBZIDTUOQSVLKU-UHFFFAOYSA-N 1 1 369.356 2.939 20 5 FFBDMO Cc1ccc(NC(=O)C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000030542470 507810342 /nfs/dbraw/zinc/81/03/42/507810342.db2.gz FAMUCWANVVIYJW-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1ccc(NC(=O)C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000030542470 507810344 /nfs/dbraw/zinc/81/03/44/507810344.db2.gz FAMUCWANVVIYJW-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO CC(=O)c1ccc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000089643910 507853288 /nfs/dbraw/zinc/85/32/88/507853288.db2.gz LIZOKBMDPBKRFD-MSOLQXFVSA-N 1 1 369.421 2.845 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000089644543 507853314 /nfs/dbraw/zinc/85/33/14/507853314.db2.gz KLDXLFRYXUQKOJ-CABCVRRESA-N 1 1 362.817 2.691 20 5 FFBDMO CC(=O)N(C)C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089891255 507879525 /nfs/dbraw/zinc/87/95/25/507879525.db2.gz ZTHPWWIZAYYRLK-UHFFFAOYSA-N 1 1 358.398 2.693 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000089925450 507884921 /nfs/dbraw/zinc/88/49/21/507884921.db2.gz PLVIQAOAKUZTNH-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000078674823 507896114 /nfs/dbraw/zinc/89/61/14/507896114.db2.gz CRULWRMTANTCJH-INIZCTEOSA-N 1 1 368.437 2.652 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC000073306563 507913036 /nfs/dbraw/zinc/91/30/36/507913036.db2.gz RXOMIAFGXPIJOZ-UHFFFAOYSA-N 1 1 356.382 2.656 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000108821346 507920298 /nfs/dbraw/zinc/92/02/98/507920298.db2.gz TUQJROWQPGNDJQ-GASCZTMLSA-N 1 1 363.458 2.846 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)Cc1ccc(OC)cc1 ZINC000090548633 507926887 /nfs/dbraw/zinc/92/68/87/507926887.db2.gz SEDFHBGOXAIXCU-OAHLLOKOSA-N 1 1 359.426 2.718 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000091167051 507961809 /nfs/dbraw/zinc/96/18/09/507961809.db2.gz GYZHRSAHQYQHNA-UHFFFAOYSA-N 1 1 358.345 2.756 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(n4ccnc4)CC3)n2)cc1 ZINC000109796208 507988151 /nfs/dbraw/zinc/98/81/51/507988151.db2.gz YUDXGYOUQBDWME-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000074327208 508012463 /nfs/dbraw/zinc/01/24/63/508012463.db2.gz DDOBIYXUWGAQCQ-MRXNPFEDSA-N 1 1 360.458 2.587 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092098492 508043195 /nfs/dbraw/zinc/04/31/95/508043195.db2.gz RGORDFJXCUVFNQ-OAHLLOKOSA-N 1 1 359.382 2.574 20 5 FFBDMO CNC(=O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000092098492 508043198 /nfs/dbraw/zinc/04/31/98/508043198.db2.gz RGORDFJXCUVFNQ-OAHLLOKOSA-N 1 1 359.382 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCCC[C@H]2C[NH+]2CCOCC2)cc1OC(F)F ZINC000092652981 508090694 /nfs/dbraw/zinc/09/06/94/508090694.db2.gz QTZOCZCDAXZGRQ-AWEZNQCLSA-N 1 1 371.384 2.887 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000111458602 508100832 /nfs/dbraw/zinc/10/08/32/508100832.db2.gz IMAVSGMOAQZDIF-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCCN[C@H](c2nnc[nH]2)c2ccccc2)cc1 ZINC000375527135 512378246 /nfs/dbraw/zinc/37/82/46/512378246.db2.gz WNGGNQZJQFIYFE-KRWDZBQOSA-N 1 1 353.382 2.861 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)nc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000080915134 508111857 /nfs/dbraw/zinc/11/18/57/508111857.db2.gz XDAZXZDFVNPGNO-CQSZACIVSA-N 1 1 351.790 2.515 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)n2)cc1 ZINC000080961724 508117803 /nfs/dbraw/zinc/11/78/03/508117803.db2.gz MQSDZVDUQVIURO-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)n2)cc1 ZINC000080961724 508117805 /nfs/dbraw/zinc/11/78/05/508117805.db2.gz MQSDZVDUQVIURO-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO CC[C@H](c1ccccc1)[C@H]1CCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075675207 508127685 /nfs/dbraw/zinc/12/76/85/508127685.db2.gz UIGBNJQJUQRWTH-IPMKNSEASA-N 1 1 358.442 2.810 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000081096031 508136527 /nfs/dbraw/zinc/13/65/27/508136527.db2.gz UAPKAZZVTKUAJJ-DOMZBBRYSA-N 1 1 368.865 2.849 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075860889 508138201 /nfs/dbraw/zinc/13/82/01/508138201.db2.gz MIEODZKNSOKLLC-HNNXBMFYSA-N 1 1 359.430 2.951 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1OC ZINC000093534595 508148365 /nfs/dbraw/zinc/14/83/65/508148365.db2.gz MPXBSXGTIZUYGG-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccnc(N2CC[NH+](C)CC2)c1 ZINC000112268198 508166082 /nfs/dbraw/zinc/16/60/82/508166082.db2.gz AHSKTNTWXYQFDF-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO CCc1nn(C)c(N2CC[NH+](C/C=C/c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000094131290 508170098 /nfs/dbraw/zinc/17/00/98/508170098.db2.gz LMEPCTKCRICHKM-JXMROGBWSA-N 1 1 355.442 2.726 20 5 FFBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112654653 508205989 /nfs/dbraw/zinc/20/59/89/508205989.db2.gz BOFUMBBLBGSZQA-CABCVRRESA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112654653 508205992 /nfs/dbraw/zinc/20/59/92/508205992.db2.gz BOFUMBBLBGSZQA-CABCVRRESA-N 1 1 369.425 2.812 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000101953506 508261942 /nfs/dbraw/zinc/26/19/42/508261942.db2.gz NAMWPIXSMOMNPK-UHFFFAOYSA-N 1 1 363.336 2.606 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000101955967 508261948 /nfs/dbraw/zinc/26/19/48/508261948.db2.gz SFRRCYFOWQNGOH-UHFFFAOYSA-N 1 1 362.474 2.901 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCc2ccccc2C1 ZINC000114488725 508321336 /nfs/dbraw/zinc/32/13/36/508321336.db2.gz PGGOIKVOWDEILF-SFHVURJKSA-N 1 1 365.433 2.973 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000087001362 508331005 /nfs/dbraw/zinc/33/10/05/508331005.db2.gz PJXRRJYNSNWKMV-SFHVURJKSA-N 1 1 371.437 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)COCc1ccccc1F)CC2 ZINC000088616505 508379528 /nfs/dbraw/zinc/37/95/28/508379528.db2.gz TVHBYXVJYOCIIO-GOSISDBHSA-N 1 1 360.385 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)COCc1ccccc1F)CC2 ZINC000088616505 508379530 /nfs/dbraw/zinc/37/95/30/508379530.db2.gz TVHBYXVJYOCIIO-GOSISDBHSA-N 1 1 360.385 2.670 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])nc3)C2)cc(OC)c1 ZINC000088751404 508381761 /nfs/dbraw/zinc/38/17/61/508381761.db2.gz KNFVWYRJUDYIAS-HNNXBMFYSA-N 1 1 358.398 2.693 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000077903860 508390370 /nfs/dbraw/zinc/39/03/70/508390370.db2.gz QCWJIMNODCVNLD-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000115414903 508391940 /nfs/dbraw/zinc/39/19/40/508391940.db2.gz KNYLJHMRGBTAJE-TXEJJXNPSA-N 1 1 352.391 2.803 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000115414903 508391941 /nfs/dbraw/zinc/39/19/41/508391941.db2.gz KNYLJHMRGBTAJE-TXEJJXNPSA-N 1 1 352.391 2.803 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(CC[N@@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000133553603 508415449 /nfs/dbraw/zinc/41/54/49/508415449.db2.gz YIDFXTJAXXYRIZ-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO COc1cc(CN(C)C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000152374110 508433311 /nfs/dbraw/zinc/43/33/11/508433311.db2.gz QZARPZAOMNARQL-GFCCVEGCSA-N 1 1 373.400 2.978 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000127563374 508468749 /nfs/dbraw/zinc/46/87/49/508468749.db2.gz GCTGEYCUARKANE-OAHLLOKOSA-N 1 1 364.446 2.570 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000127563605 508469358 /nfs/dbraw/zinc/46/93/58/508469358.db2.gz GCTGEYCUARKANE-HNNXBMFYSA-N 1 1 364.446 2.570 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3cc(C)c([N+](=O)[O-])cn3)CC2)c1 ZINC000152617421 508479403 /nfs/dbraw/zinc/47/94/03/508479403.db2.gz ULYDGAZFLFSRMK-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000156922156 508497313 /nfs/dbraw/zinc/49/73/13/508497313.db2.gz OMVRBLWMYODRRH-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO CCC1(CO)CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000127991836 508532312 /nfs/dbraw/zinc/53/23/12/508532312.db2.gz RSUVNBKVHRSBEH-UHFFFAOYSA-N 1 1 355.822 2.671 20 5 FFBDMO Cc1c(Br)cc(C(=O)NC[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000122526174 508548998 /nfs/dbraw/zinc/54/89/98/508548998.db2.gz HPSKRAKGRHWPMF-NSHDSACASA-N 1 1 370.247 2.737 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153293705 508569263 /nfs/dbraw/zinc/56/92/63/508569263.db2.gz SIFUCHCSLNGXQY-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1cccc(COC[C@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000153293705 508569266 /nfs/dbraw/zinc/56/92/66/508569266.db2.gz SIFUCHCSLNGXQY-QGZVFWFLSA-N 1 1 372.421 2.539 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCCc3c2cnn3C)cccc1[N+](=O)[O-] ZINC000135563818 508624707 /nfs/dbraw/zinc/62/47/07/508624707.db2.gz JDILXTWDKGCAIT-QGZVFWFLSA-N 1 1 371.441 2.975 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000153742921 508639302 /nfs/dbraw/zinc/63/93/02/508639302.db2.gz XQPASSXLDGGKPT-ZDUSSCGKSA-N 1 1 363.414 2.505 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H]1CCC[N@@H+](C)C1 ZINC000153751194 508641881 /nfs/dbraw/zinc/64/18/81/508641881.db2.gz YSWKXSOLLNGEMU-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000129618550 508746994 /nfs/dbraw/zinc/74/69/94/508746994.db2.gz XSOBULNJHPURNJ-SUMWQHHRSA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000129618550 508746998 /nfs/dbraw/zinc/74/69/98/508746998.db2.gz XSOBULNJHPURNJ-SUMWQHHRSA-N 1 1 357.414 2.621 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000137485062 508758655 /nfs/dbraw/zinc/75/86/55/508758655.db2.gz OEGGFTCSDLVUIT-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000159114047 508794347 /nfs/dbraw/zinc/79/43/47/508794347.db2.gz OWZLPPXFLVIDPU-ICSRJNTNSA-N 1 1 369.469 2.778 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000139915972 508797006 /nfs/dbraw/zinc/79/70/06/508797006.db2.gz XBOHXWFQSDKPJU-LRDDRELGSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Br)cc1 ZINC000159724745 508880548 /nfs/dbraw/zinc/88/05/48/508880548.db2.gz UMVVYRHXAAGLKE-UHFFFAOYSA-N 1 1 366.215 2.651 20 5 FFBDMO CS(=O)(=O)C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000154959772 508892404 /nfs/dbraw/zinc/89/24/04/508892404.db2.gz PYNMDZQWPWBYRV-VDZSZVPASA-N 1 1 360.435 2.984 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)Cc2cccc(N(C)C)c2)c([N+](=O)[O-])c1 ZINC000159812808 508894486 /nfs/dbraw/zinc/89/44/86/508894486.db2.gz UCDMVWHSDUTXKU-UHFFFAOYSA-N 1 1 372.425 2.740 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)Cc2cccc(N(C)C)c2)c([N+](=O)[O-])c1 ZINC000159812808 508894491 /nfs/dbraw/zinc/89/44/91/508894491.db2.gz UCDMVWHSDUTXKU-UHFFFAOYSA-N 1 1 372.425 2.740 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000150979605 508934505 /nfs/dbraw/zinc/93/45/05/508934505.db2.gz ODGMJEIEJNKIGU-NSHDSACASA-N 1 1 372.263 2.746 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000155480552 509009781 /nfs/dbraw/zinc/00/97/81/509009781.db2.gz GNXDJCMMWUPCKO-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000155480552 509009784 /nfs/dbraw/zinc/00/97/84/509009784.db2.gz GNXDJCMMWUPCKO-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000160911499 509047495 /nfs/dbraw/zinc/04/74/95/509047495.db2.gz FTHQDDXZLQILOV-RDTXWAMCSA-N 1 1 350.415 2.609 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCC1CCOCC1 ZINC000120705561 509049145 /nfs/dbraw/zinc/04/91/45/509049145.db2.gz DCCMGANZWWDCDP-ZDUSSCGKSA-N 1 1 365.430 2.679 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nc(-c4ccc(F)cc4)no3)CC2)n1 ZINC000369488962 512435028 /nfs/dbraw/zinc/43/50/28/512435028.db2.gz BFRIXSFLTXDRCR-UHFFFAOYSA-N 1 1 372.360 2.818 20 5 FFBDMO O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126554719 509094954 /nfs/dbraw/zinc/09/49/54/509094954.db2.gz VGGAHBQSHMIICP-SJCJKPOMSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000126554719 509094959 /nfs/dbraw/zinc/09/49/59/509094959.db2.gz VGGAHBQSHMIICP-SJCJKPOMSA-N 1 1 369.425 2.560 20 5 FFBDMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126554719 509094962 /nfs/dbraw/zinc/09/49/62/509094962.db2.gz VGGAHBQSHMIICP-SJCJKPOMSA-N 1 1 369.425 2.560 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000247957708 509200496 /nfs/dbraw/zinc/20/04/96/509200496.db2.gz FTHQDDXZLQILOV-KBXCAEBGSA-N 1 1 350.415 2.609 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000247975477 509206103 /nfs/dbraw/zinc/20/61/03/509206103.db2.gz GIARMDDTWZXIQX-CRAIPNDOSA-N 1 1 355.394 2.779 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000172843333 509268574 /nfs/dbraw/zinc/26/85/74/509268574.db2.gz XLHIKKINBIUTAT-INIZCTEOSA-N 1 1 371.441 2.727 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000248356596 509274572 /nfs/dbraw/zinc/27/45/72/509274572.db2.gz OMLJYRJFIKNSHO-GOEBONIOSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000248401231 509296225 /nfs/dbraw/zinc/29/62/25/509296225.db2.gz ZDBBRSPCMYJARD-SUMWQHHRSA-N 1 1 354.410 2.626 20 5 FFBDMO C[C@H](C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000248466738 509334913 /nfs/dbraw/zinc/33/49/13/509334913.db2.gz SMGDPOUMUPCBHZ-TZMCWYRMSA-N 1 1 351.428 2.527 20 5 FFBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248478862 509337739 /nfs/dbraw/zinc/33/77/39/509337739.db2.gz ZMNKOMKOODNARP-WBVHZDCISA-N 1 1 359.426 2.900 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000185837958 509378895 /nfs/dbraw/zinc/37/88/95/509378895.db2.gz JNIJYKWZJMJAOO-PWSUYJOCSA-N 1 1 352.822 2.673 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000163540183 509389743 /nfs/dbraw/zinc/38/97/43/509389743.db2.gz ZXSSNEAKYWXCOH-INIZCTEOSA-N 1 1 362.474 2.515 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(c3cc(C)[nH+]c(C)n3)CC2)c1 ZINC000267346871 509458178 /nfs/dbraw/zinc/45/81/78/509458178.db2.gz JFLYIDHTXVFFHU-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183015018 509548628 /nfs/dbraw/zinc/54/86/28/509548628.db2.gz LQRMGJATSBQXRF-KBPBESRZSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173377975 509562155 /nfs/dbraw/zinc/56/21/55/509562155.db2.gz GOVCWHQQABPWKV-HNNXBMFYSA-N 1 1 370.453 2.737 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000192707276 509606137 /nfs/dbraw/zinc/60/61/37/509606137.db2.gz STGGKVIMXMAJIM-KRWDZBQOSA-N 1 1 360.410 2.613 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267937889 509678561 /nfs/dbraw/zinc/67/85/61/509678561.db2.gz NFKQBSKKCSVRKH-SNVBAGLBSA-N 1 1 374.210 2.711 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNC(=O)c3cccc([N+](=O)[O-])c3)CC2)oc1C ZINC000264778533 509698855 /nfs/dbraw/zinc/69/88/55/509698855.db2.gz RIJVVGLVJNAWGZ-UHFFFAOYSA-N 1 1 372.425 2.842 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268045690 509733453 /nfs/dbraw/zinc/73/34/53/509733453.db2.gz ZKIQKUSCJINTAH-ONGXEEELSA-N 1 1 368.231 2.712 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000177019238 509823134 /nfs/dbraw/zinc/82/31/34/509823134.db2.gz HTAZGAYCUPDEHV-INIZCTEOSA-N 1 1 368.437 2.914 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1SC ZINC000177073658 509854859 /nfs/dbraw/zinc/85/48/59/509854859.db2.gz VURIHQHJSWRKDB-GHMZBOCLSA-N 1 1 365.455 2.680 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000180425830 509920838 /nfs/dbraw/zinc/92/08/38/509920838.db2.gz FEPRIYSOIGCFTA-NSHDSACASA-N 1 1 363.443 2.934 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446098 509940680 /nfs/dbraw/zinc/94/06/80/509940680.db2.gz ZMQCLQMABAHUAS-XJKSGUPXSA-N 1 1 359.430 2.807 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000177324639 509997617 /nfs/dbraw/zinc/99/76/17/509997617.db2.gz NFSYGJRUAWKFSG-KGLIPLIRSA-N 1 1 366.849 2.745 20 5 FFBDMO COc1cccc2c1CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000193706618 510030284 /nfs/dbraw/zinc/03/02/84/510030284.db2.gz YITYKCITIFNGJG-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1cccc2c1CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000193706618 510030290 /nfs/dbraw/zinc/03/02/90/510030290.db2.gz YITYKCITIFNGJG-UHFFFAOYSA-N 1 1 369.421 2.951 20 5 FFBDMO COc1ccc(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000268622710 510040646 /nfs/dbraw/zinc/04/06/46/510040646.db2.gz YNIVBKSWMBCANO-QGZVFWFLSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000193838479 510095104 /nfs/dbraw/zinc/09/51/04/510095104.db2.gz RPPFLBICQGLOPY-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000268842756 510095613 /nfs/dbraw/zinc/09/56/13/510095613.db2.gz OYUQRJPWLZMUCQ-JKSUJKDBSA-N 1 1 360.458 2.654 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268847591 510097354 /nfs/dbraw/zinc/09/73/54/510097354.db2.gz PXYPUVCDOQVYOU-IRXDYDNUSA-N 1 1 355.442 2.819 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3c(N)cccc3[N+](=O)[O-])cc2)CC1 ZINC000180941466 510197355 /nfs/dbraw/zinc/19/73/55/510197355.db2.gz GHVCGUYDEOPKJL-UHFFFAOYSA-N 1 1 369.425 2.571 20 5 FFBDMO O=[N+]([O-])c1cc(CN[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)cs1 ZINC000265760796 510216103 /nfs/dbraw/zinc/21/61/03/510216103.db2.gz JUECEDWMOBRPBH-IAGOWNOFSA-N 1 1 361.467 2.629 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1cccc2[nH]ccc21 ZINC000177737708 510227095 /nfs/dbraw/zinc/22/70/95/510227095.db2.gz DXUXNZHNXRESGQ-HNNXBMFYSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COc1cccc2[nH]ccc21 ZINC000177737708 510227103 /nfs/dbraw/zinc/22/71/03/510227103.db2.gz DXUXNZHNXRESGQ-HNNXBMFYSA-N 1 1 355.394 2.948 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000269091041 510231312 /nfs/dbraw/zinc/23/13/12/510231312.db2.gz LAHYQIPGLPIXIU-GXFFZTMASA-N 1 1 355.236 2.673 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174658058 510234460 /nfs/dbraw/zinc/23/44/60/510234460.db2.gz UPKCYKPQEWXJLJ-GFCCVEGCSA-N 1 1 359.213 2.591 20 5 FFBDMO COc1cc(C[NH2+]C(C)(C)C(=O)NCC(C)(C)C)c([N+](=O)[O-])cc1F ZINC000184292428 510244298 /nfs/dbraw/zinc/24/42/98/510244298.db2.gz DLDCOESUUVXHPR-UHFFFAOYSA-N 1 1 355.410 2.773 20 5 FFBDMO CCOc1cccc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000181212623 510305493 /nfs/dbraw/zinc/30/54/93/510305493.db2.gz YDYDICRSNPTZBD-INIZCTEOSA-N 1 1 350.463 2.677 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000174786209 510309715 /nfs/dbraw/zinc/30/97/15/510309715.db2.gz JPMDPRWWHRBGFI-CMPLNLGQSA-N 1 1 370.356 2.897 20 5 FFBDMO CC[C@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000187539333 510321670 /nfs/dbraw/zinc/32/16/70/510321670.db2.gz CCUNRNSSCFRLTM-INIZCTEOSA-N 1 1 355.822 2.671 20 5 FFBDMO CC[C@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000187539333 510321679 /nfs/dbraw/zinc/32/16/79/510321679.db2.gz CCUNRNSSCFRLTM-INIZCTEOSA-N 1 1 355.822 2.671 20 5 FFBDMO C[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000174870565 510356274 /nfs/dbraw/zinc/35/62/74/510356274.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870565 510356279 /nfs/dbraw/zinc/35/62/79/510356279.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870565 510356282 /nfs/dbraw/zinc/35/62/82/510356282.db2.gz PNJOUZXSNYLMQL-AEFFLSMTSA-N 1 1 357.458 2.776 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000174923340 510388193 /nfs/dbraw/zinc/38/81/93/510388193.db2.gz KANWWOQLTABXPM-MRXNPFEDSA-N 1 1 368.437 2.771 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000246302247 510415862 /nfs/dbraw/zinc/41/58/62/510415862.db2.gz BVUHBQNXFSGIKS-MSOLQXFVSA-N 1 1 361.442 2.837 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000246302247 510415870 /nfs/dbraw/zinc/41/58/70/510415870.db2.gz BVUHBQNXFSGIKS-MSOLQXFVSA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@@H](NCC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000184622141 510422349 /nfs/dbraw/zinc/42/23/49/510422349.db2.gz OEHKPWIMDFYBGN-BEFAXECRSA-N 1 1 370.453 2.665 20 5 FFBDMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194604280 510441009 /nfs/dbraw/zinc/44/10/09/510441009.db2.gz ABJSAQGGFPPUSH-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C[NH+]3CCN(C)CC3)cc2)n1 ZINC000178172542 510471808 /nfs/dbraw/zinc/47/18/08/510471808.db2.gz GPQJFROILDZGSZ-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO Cc1[nH+]cn(CC(=O)Nc2ccc([N+](=O)[O-])cc2Br)c1C ZINC000171992967 510489239 /nfs/dbraw/zinc/48/92/39/510489239.db2.gz XYCUMOJBCVVPRW-UHFFFAOYSA-N 1 1 353.176 2.809 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000194735999 510501897 /nfs/dbraw/zinc/50/18/97/510501897.db2.gz VNUKBCPTSYDOIY-UXLLHSPISA-N 1 1 374.485 2.901 20 5 FFBDMO C[N@H+]1CCCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000181637084 510515477 /nfs/dbraw/zinc/51/54/77/510515477.db2.gz QRAPBQCTIVYXQE-UHFFFAOYSA-N 1 1 357.208 2.527 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccccc1 ZINC000181665612 510529602 /nfs/dbraw/zinc/52/96/02/510529602.db2.gz WMYFGMOJLOYCQK-INIZCTEOSA-N 1 1 359.382 2.519 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000246535346 510541014 /nfs/dbraw/zinc/54/10/14/510541014.db2.gz LBXJJXJFPFEYRV-HFAKWTLXSA-N 1 1 355.822 2.668 20 5 FFBDMO Cc1ccc(N2CCC(NC(=O)NCc3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1 ZINC000175264696 510559923 /nfs/dbraw/zinc/55/99/23/510559923.db2.gz IAQDCWLMPSSHRM-UHFFFAOYSA-N 1 1 369.425 2.766 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000175272318 510563443 /nfs/dbraw/zinc/56/34/43/510563443.db2.gz LQLQVJSWUHLARN-HIFRSBDPSA-N 1 1 371.441 2.663 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000172164728 510578441 /nfs/dbraw/zinc/57/84/41/510578441.db2.gz WWUHAFMOMORZDA-OCCSQVGLSA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000191365876 510624256 /nfs/dbraw/zinc/62/42/56/510624256.db2.gz SOZNRSLNLGELPA-GASCZTMLSA-N 1 1 364.446 2.832 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181952416 510676810 /nfs/dbraw/zinc/67/68/10/510676810.db2.gz STLODMCIXKGSGD-NSHDSACASA-N 1 1 357.357 2.610 20 5 FFBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000188294627 510694310 /nfs/dbraw/zinc/69/43/10/510694310.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC000188294627 510694319 /nfs/dbraw/zinc/69/43/19/510694319.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1ccc([N+](=O)[O-])cc1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188294627 510694324 /nfs/dbraw/zinc/69/43/24/510694324.db2.gz VWAKRLKPMDSNCZ-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000182022887 510715514 /nfs/dbraw/zinc/71/55/14/510715514.db2.gz MEMCCIZYMURHED-BMGDILEWSA-N 1 1 364.442 2.614 20 5 FFBDMO CCC1(CC)C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000185240170 510766356 /nfs/dbraw/zinc/76/63/56/510766356.db2.gz AJWGGISHQHXCDM-RUZDIDTESA-N 1 1 367.471 2.547 20 5 FFBDMO CCC1(CC)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[S@]1=O ZINC000185240170 510766359 /nfs/dbraw/zinc/76/63/59/510766359.db2.gz AJWGGISHQHXCDM-RUZDIDTESA-N 1 1 367.471 2.547 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000175751870 510771513 /nfs/dbraw/zinc/77/15/13/510771513.db2.gz GNIJFYBKDLMKHC-NSHDSACASA-N 1 1 368.397 2.865 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000270358890 510775517 /nfs/dbraw/zinc/77/55/17/510775517.db2.gz JOIMURXCRMDTPO-UHFFFAOYSA-N 1 1 352.192 2.859 20 5 FFBDMO CN(C(=O)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000246993765 510788723 /nfs/dbraw/zinc/78/87/23/510788723.db2.gz WNZXZSBSQSZGGJ-KXBFYZLASA-N 1 1 372.469 2.506 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)n1 ZINC000191717873 510800384 /nfs/dbraw/zinc/80/03/84/510800384.db2.gz UNUQODGUIFMRIX-IBGZPJMESA-N 1 1 371.441 2.596 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)C2)C1 ZINC000293926724 510900973 /nfs/dbraw/zinc/90/09/73/510900973.db2.gz IVPBBNLCCKMDSR-LJQANCHMSA-N 1 1 356.426 2.563 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](CO)(C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000294028914 510933764 /nfs/dbraw/zinc/93/37/64/510933764.db2.gz OBMYEXVPPRXFOY-GOSISDBHSA-N 1 1 352.431 2.843 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000297702932 511040128 /nfs/dbraw/zinc/04/01/28/511040128.db2.gz AVCIOPUDOSADIB-RDJZCZTQSA-N 1 1 363.414 2.575 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2ccncn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000361653693 511076155 /nfs/dbraw/zinc/07/61/55/511076155.db2.gz VCCCULUWYVSRNN-AWEZNQCLSA-N 1 1 355.398 2.593 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(N2CCCC[C@@H]([NH+]3CCCC3)C2)s1 ZINC000271242890 511135297 /nfs/dbraw/zinc/13/52/97/511135297.db2.gz HZKSBFUDEGFQSS-GFCCVEGCSA-N 1 1 373.500 2.515 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4CCc5[nH+]ccn5C4)n3)c2c1 ZINC000364892213 511137118 /nfs/dbraw/zinc/13/71/18/511137118.db2.gz FRYXCSKHUYGFQF-LLVKDONJSA-N 1 1 364.365 2.976 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000294899161 511213155 /nfs/dbraw/zinc/21/31/55/511213155.db2.gz JCOMFGGXOXHSFG-GFCCVEGCSA-N 1 1 353.394 2.546 20 5 FFBDMO O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279801211 511220446 /nfs/dbraw/zinc/22/04/46/511220446.db2.gz YXJYEHWEGQEPDP-IYBDPMFKSA-N 1 1 369.396 2.938 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CNC[C@H]3C[N@H+]4CCC[C@H]4CO3)cs2)c1 ZINC000362719298 511224660 /nfs/dbraw/zinc/22/46/60/511224660.db2.gz IGTGPQPUVQPKDS-IRXDYDNUSA-N 1 1 374.466 2.671 20 5 FFBDMO COCC[N@@H+](C)CCCNC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000291516861 511228716 /nfs/dbraw/zinc/22/87/16/511228716.db2.gz REAHGSTXOKNULC-UHFFFAOYSA-N 1 1 364.229 2.600 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CC23CCOCC3)cn1 ZINC000294943769 511228945 /nfs/dbraw/zinc/22/89/45/511228945.db2.gz HBJFTYCCRQWMKZ-SFHVURJKSA-N 1 1 356.426 2.725 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000363097937 511352724 /nfs/dbraw/zinc/35/27/24/511352724.db2.gz RUKYGYOJSYWCCH-HOTGVXAUSA-N 1 1 358.442 2.552 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000298667489 511368465 /nfs/dbraw/zinc/36/84/65/511368465.db2.gz YHBKQLQPQKGCEC-NVXWUHKLSA-N 1 1 363.414 2.575 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000295372930 511381033 /nfs/dbraw/zinc/38/10/33/511381033.db2.gz RVXTVXPZFHUCSX-CQSZACIVSA-N 1 1 371.441 2.789 20 5 FFBDMO CCC[N@H+](C)C[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295372930 511381037 /nfs/dbraw/zinc/38/10/37/511381037.db2.gz RVXTVXPZFHUCSX-CQSZACIVSA-N 1 1 371.441 2.789 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295372930 511381042 /nfs/dbraw/zinc/38/10/42/511381042.db2.gz RVXTVXPZFHUCSX-CQSZACIVSA-N 1 1 371.441 2.789 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000292023457 511435302 /nfs/dbraw/zinc/43/53/02/511435302.db2.gz YMYUEPUXBILDAS-FQEVSTJZSA-N 1 1 372.421 2.618 20 5 FFBDMO C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292335060 511556899 /nfs/dbraw/zinc/55/68/99/511556899.db2.gz OWOIUVVQPBUNIG-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO CCn1cc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000296106298 511622084 /nfs/dbraw/zinc/62/20/84/511622084.db2.gz QESXMAXJRJENQV-SNVBAGLBSA-N 1 1 351.794 2.754 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273867403 511637582 /nfs/dbraw/zinc/63/75/82/511637582.db2.gz PINZQPXLUNBDMB-ZDUSSCGKSA-N 1 1 351.422 2.812 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCOCC2)[C@H]1C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000296220213 511661467 /nfs/dbraw/zinc/66/14/67/511661467.db2.gz PGBYOOGHEAGDOJ-GOSISDBHSA-N 1 1 359.426 2.814 20 5 FFBDMO C[C@@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365822981 511670101 /nfs/dbraw/zinc/67/01/01/511670101.db2.gz UBHDZMCBBJUNDD-LBPRGKRZSA-N 1 1 369.385 2.634 20 5 FFBDMO Cc1cc(NC2CC[NH+]([C@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000363663801 511692234 /nfs/dbraw/zinc/69/22/34/511692234.db2.gz GKVXXWNHLGDLEH-INIZCTEOSA-N 1 1 356.426 2.539 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000281064348 511707219 /nfs/dbraw/zinc/70/72/19/511707219.db2.gz SHAWSGCGRRAHLW-KBXCAEBGSA-N 1 1 370.409 2.608 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000281064348 511707226 /nfs/dbraw/zinc/70/72/26/511707226.db2.gz SHAWSGCGRRAHLW-KBXCAEBGSA-N 1 1 370.409 2.608 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000284452007 511728722 /nfs/dbraw/zinc/72/87/22/511728722.db2.gz RBTHUKZCYIZYGP-CQSZACIVSA-N 1 1 372.400 2.663 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000284654047 511810343 /nfs/dbraw/zinc/81/03/43/511810343.db2.gz GCVCAGJKMGNHKJ-HNNXBMFYSA-N 1 1 373.413 2.526 20 5 FFBDMO C[C@@H]1CN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000296699749 511860563 /nfs/dbraw/zinc/86/05/63/511860563.db2.gz KVMPOSYPTANAKJ-GFCCVEGCSA-N 1 1 366.849 2.603 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285335545 512079824 /nfs/dbraw/zinc/07/98/24/512079824.db2.gz OGLRFXCSRIMRLB-CQSZACIVSA-N 1 1 359.430 2.874 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285335545 512079829 /nfs/dbraw/zinc/07/98/29/512079829.db2.gz OGLRFXCSRIMRLB-CQSZACIVSA-N 1 1 359.430 2.874 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000377776704 512444477 /nfs/dbraw/zinc/44/44/77/512444477.db2.gz HFWOULXORHIHEJ-WDEREUQCSA-N 1 1 368.231 2.714 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](CC)C[C@@H]2CC)cc1OC ZINC000411068685 512458751 /nfs/dbraw/zinc/45/87/51/512458751.db2.gz XSQOTMXUVGUMNB-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](CC)C[C@@H]2CC)cc1OC ZINC000411068685 512458755 /nfs/dbraw/zinc/45/87/55/512458755.db2.gz XSQOTMXUVGUMNB-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375757484 512489219 /nfs/dbraw/zinc/48/92/19/512489219.db2.gz JRVCAMASPSGTIP-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000375757484 512489226 /nfs/dbraw/zinc/48/92/26/512489226.db2.gz JRVCAMASPSGTIP-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375758917 512490699 /nfs/dbraw/zinc/49/06/99/512490699.db2.gz BLZIZJVGBHGMDS-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375758917 512490702 /nfs/dbraw/zinc/49/07/02/512490702.db2.gz BLZIZJVGBHGMDS-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000373760736 512492340 /nfs/dbraw/zinc/49/23/40/512492340.db2.gz MAZABDGXZMHTLW-AWEZNQCLSA-N 1 1 357.414 2.979 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000375830526 512528601 /nfs/dbraw/zinc/52/86/01/512528601.db2.gz KLRVPZBMJABWGJ-JKSUJKDBSA-N 1 1 361.442 2.696 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000375830524 512528763 /nfs/dbraw/zinc/52/87/63/512528763.db2.gz KLRVPZBMJABWGJ-HOTGVXAUSA-N 1 1 361.442 2.696 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000367827846 512679262 /nfs/dbraw/zinc/67/92/62/512679262.db2.gz YXACJFFLBZAOAT-MRXNPFEDSA-N 1 1 351.366 2.842 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000367827846 512679267 /nfs/dbraw/zinc/67/92/67/512679267.db2.gz YXACJFFLBZAOAT-MRXNPFEDSA-N 1 1 351.366 2.842 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(Cc2cccnc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000378415077 512747741 /nfs/dbraw/zinc/74/77/41/512747741.db2.gz FEAHNMQQVXGOHQ-UHFFFAOYSA-N 1 1 368.437 2.907 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC2(CCC[N@@H+]2C)CC1 ZINC000378431351 512755591 /nfs/dbraw/zinc/75/55/91/512755591.db2.gz PFWLXTDXQARXGY-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN[C@@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000374533414 512878122 /nfs/dbraw/zinc/87/81/22/512878122.db2.gz BHMNPKBLGNPNCS-QGZVFWFLSA-N 1 1 357.458 2.719 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060924 512938414 /nfs/dbraw/zinc/93/84/14/512938414.db2.gz HDXUECYVQUFODX-UGSOOPFHSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412060924 512938417 /nfs/dbraw/zinc/93/84/17/512938417.db2.gz HDXUECYVQUFODX-UGSOOPFHSA-N 1 1 363.414 2.505 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000408049469 512989682 /nfs/dbraw/zinc/98/96/82/512989682.db2.gz ACAIQUCWMHYPOQ-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000408049469 512989688 /nfs/dbraw/zinc/98/96/88/512989688.db2.gz ACAIQUCWMHYPOQ-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1 ZINC000412194132 512992871 /nfs/dbraw/zinc/99/28/71/512992871.db2.gz GOAAFMHJFLMUDM-ZWKOTPCHSA-N 1 1 368.437 2.913 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000368602573 513021295 /nfs/dbraw/zinc/02/12/95/513021295.db2.gz KCCKKCXWPMYAQS-FQEVSTJZSA-N 1 1 366.421 2.728 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412351197 513050753 /nfs/dbraw/zinc/05/07/53/513050753.db2.gz ANIQCFRQEVXBOU-LBPRGKRZSA-N 1 1 355.410 2.522 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445904613 513143768 /nfs/dbraw/zinc/14/37/68/513143768.db2.gz RXVGSNZSQCQTAM-GASCZTMLSA-N 1 1 360.458 2.925 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000433828105 513160836 /nfs/dbraw/zinc/16/08/36/513160836.db2.gz HMYGITCQCIOKOP-ZDUSSCGKSA-N 1 1 351.451 2.683 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000433832095 513162163 /nfs/dbraw/zinc/16/21/63/513162163.db2.gz HGRMBDUQAIETPA-BETUJISGSA-N 1 1 351.451 2.539 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]([C@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429001792 513248797 /nfs/dbraw/zinc/24/87/97/513248797.db2.gz WZHFBRAJVKXBPV-FSZRXZPDSA-N 1 1 360.458 2.584 20 5 FFBDMO C[N@@H+](CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569715 513255238 /nfs/dbraw/zinc/25/52/38/513255238.db2.gz OKIHSCKEXFDHCU-KRWDZBQOSA-N 1 1 355.442 2.608 20 5 FFBDMO CN(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569715 513255247 /nfs/dbraw/zinc/25/52/47/513255247.db2.gz OKIHSCKEXFDHCU-KRWDZBQOSA-N 1 1 355.442 2.608 20 5 FFBDMO CN(CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000450569715 513255254 /nfs/dbraw/zinc/25/52/54/513255254.db2.gz OKIHSCKEXFDHCU-KRWDZBQOSA-N 1 1 355.442 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCOCCOc3ccccc3)C2)nc1 ZINC000440505133 513337915 /nfs/dbraw/zinc/33/79/15/513337915.db2.gz YFWCFIPMPYGCQO-INIZCTEOSA-N 1 1 372.425 2.572 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC[C@@H](S(C)(=O)=O)C1 ZINC000446850458 513349901 /nfs/dbraw/zinc/34/99/01/513349901.db2.gz ZNWVMMIWJOFLPM-OOXMNIKJSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC[C@@H](S(C)(=O)=O)C1 ZINC000446850458 513349904 /nfs/dbraw/zinc/34/99/04/513349904.db2.gz ZNWVMMIWJOFLPM-OOXMNIKJSA-N 1 1 352.456 2.897 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@]3(CO)CCCc4ccccc43)nc2c1 ZINC000440822367 513415396 /nfs/dbraw/zinc/41/53/96/513415396.db2.gz TTYMVAITIPALFW-LJQANCHMSA-N 1 1 352.394 2.785 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@H+](C(C)C)C2)ncc1[N+](=O)[O-] ZINC000450951887 513423010 /nfs/dbraw/zinc/42/30/10/513423010.db2.gz GUQVSSAAQPYVFB-LLVKDONJSA-N 1 1 357.252 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)o2)cc1 ZINC000441205335 513513495 /nfs/dbraw/zinc/51/34/95/513513495.db2.gz OGZIFMWTPNFVLU-LSDHHAIUSA-N 1 1 358.398 2.893 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCO[C@H]1C ZINC000425467614 513581917 /nfs/dbraw/zinc/58/19/17/513581917.db2.gz BTVHMGLPICWUMY-FZMZJTMJSA-N 1 1 373.247 2.983 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@H]1CCO[C@H]1C ZINC000425467614 513581918 /nfs/dbraw/zinc/58/19/18/513581918.db2.gz BTVHMGLPICWUMY-FZMZJTMJSA-N 1 1 373.247 2.983 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CC(=O)N(C)C)c1ccccc1 ZINC000430198460 513586512 /nfs/dbraw/zinc/58/65/12/513586512.db2.gz YNTVJHCCZHYZPX-KRWDZBQOSA-N 1 1 357.410 2.913 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000447828090 513586637 /nfs/dbraw/zinc/58/66/37/513586637.db2.gz DIZUQTZHEPBLQK-MRXNPFEDSA-N 1 1 365.430 2.679 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430204075 513588912 /nfs/dbraw/zinc/58/89/12/513588912.db2.gz KIFYDJSYWQNQRV-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430204075 513588914 /nfs/dbraw/zinc/58/89/14/513588914.db2.gz KIFYDJSYWQNQRV-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CCC(CC[NH+]2CCOCC2)CC1 ZINC000430224473 513591675 /nfs/dbraw/zinc/59/16/75/513591675.db2.gz KDLCMKFWQCZJNT-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](n2ccnn2)C1 ZINC000425497120 513601824 /nfs/dbraw/zinc/60/18/24/513601824.db2.gz CAVNCQNJIDJHBW-IUODEOHRSA-N 1 1 369.385 2.634 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](n2ccnn2)C1 ZINC000425497120 513601830 /nfs/dbraw/zinc/60/18/30/513601830.db2.gz CAVNCQNJIDJHBW-IUODEOHRSA-N 1 1 369.385 2.634 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000451265902 513636369 /nfs/dbraw/zinc/63/63/69/513636369.db2.gz ONYKDNKIMGUMGV-RBUKOAKNSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c1 ZINC000451265902 513636374 /nfs/dbraw/zinc/63/63/74/513636374.db2.gz ONYKDNKIMGUMGV-RBUKOAKNSA-N 1 1 360.385 2.774 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000419340196 513783125 /nfs/dbraw/zinc/78/31/25/513783125.db2.gz NAYPZTJSWGAJKH-RYUDHWBXSA-N 1 1 361.364 2.501 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436255181 513807119 /nfs/dbraw/zinc/80/71/19/513807119.db2.gz WOEFZHNHZHYEKR-KRWDZBQOSA-N 1 1 361.442 2.887 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000426127791 513855089 /nfs/dbraw/zinc/85/50/89/513855089.db2.gz NQBYMQRFNDVLDQ-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000426127791 513855095 /nfs/dbraw/zinc/85/50/95/513855095.db2.gz NQBYMQRFNDVLDQ-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000426193912 513868725 /nfs/dbraw/zinc/86/87/25/513868725.db2.gz KTXVNCIJQLJHBU-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000451691486 513914255 /nfs/dbraw/zinc/91/42/55/513914255.db2.gz CHAPOFQEYSACFM-OWCLPIDISA-N 1 1 361.442 2.715 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(OC)c(O)c2)c([N+](=O)[O-])c1 ZINC000427001204 514089196 /nfs/dbraw/zinc/08/91/96/514089196.db2.gz RHHSVGHWEXRRPS-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000427095927 514114725 /nfs/dbraw/zinc/11/47/25/514114725.db2.gz ZALMWWCCLFCZDZ-ZBFHGGJFSA-N 1 1 369.421 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H]3CCC[N@H+]3CCCO)o2)c1 ZINC000449385088 514188849 /nfs/dbraw/zinc/18/88/49/514188849.db2.gz DPDOCVNVCRAUJX-QGZVFWFLSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H]3CCC[N@@H+]3CCCO)o2)c1 ZINC000449385088 514188856 /nfs/dbraw/zinc/18/88/56/514188856.db2.gz DPDOCVNVCRAUJX-QGZVFWFLSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c2c(c1)COCO2 ZINC000449455052 514217117 /nfs/dbraw/zinc/21/71/17/514217117.db2.gz QEBYSMRJMBFYSK-RCCFBDPRSA-N 1 1 362.426 2.977 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000449542638 514247727 /nfs/dbraw/zinc/24/77/27/514247727.db2.gz QUYKEFHRFITTCE-KXBFYZLASA-N 1 1 360.410 2.767 20 5 FFBDMO Cc1cc(Br)ccc1C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000444710129 514301772 /nfs/dbraw/zinc/30/17/72/514301772.db2.gz ULYIHRQODHSZPB-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO COC[C@@]1(CO)CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000449700692 514311435 /nfs/dbraw/zinc/31/14/35/514311435.db2.gz ROPKSOXESDKBJZ-KRWDZBQOSA-N 1 1 363.439 2.549 20 5 FFBDMO COC[C@@]1(CO)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000449700692 514311441 /nfs/dbraw/zinc/31/14/41/514311441.db2.gz ROPKSOXESDKBJZ-KRWDZBQOSA-N 1 1 363.439 2.549 20 5 FFBDMO Cc1cc(N(C)[C@@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000432914328 514321230 /nfs/dbraw/zinc/32/12/30/514321230.db2.gz APPSLPUMEKVVIS-HNNXBMFYSA-N 1 1 371.441 2.517 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000420830619 514324467 /nfs/dbraw/zinc/32/44/67/514324467.db2.gz AMYDOKYTAAJIDZ-ZDUSSCGKSA-N 1 1 374.363 2.849 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000427910113 514345407 /nfs/dbraw/zinc/34/54/07/514345407.db2.gz WVUXZQSHUCQPMZ-HOTGVXAUSA-N 1 1 354.410 2.517 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@H]1CCC[N@H+]1C ZINC000420994430 514429299 /nfs/dbraw/zinc/42/92/99/514429299.db2.gz CDQFXFDDXJBCGC-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)C2CC(OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000420999037 514430357 /nfs/dbraw/zinc/43/03/57/514430357.db2.gz BWNYDLGJPPQGOQ-UHFFFAOYSA-N 1 1 365.430 2.820 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)C2CC(OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000420999037 514430366 /nfs/dbraw/zinc/43/03/66/514430366.db2.gz BWNYDLGJPPQGOQ-UHFFFAOYSA-N 1 1 365.430 2.820 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CNCCO2)ccc1Oc1ccc(F)cc1 ZINC000415095370 514440795 /nfs/dbraw/zinc/44/07/95/514440795.db2.gz MJQSLJCNJGPCSF-INIZCTEOSA-N 1 1 361.373 2.604 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000449973933 514448876 /nfs/dbraw/zinc/44/88/76/514448876.db2.gz SYSMDXLAEWFQEE-GOEBONIOSA-N 1 1 361.442 2.889 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)[C@H](C)C1 ZINC000449990730 514456133 /nfs/dbraw/zinc/45/61/33/514456133.db2.gz XCZKLNOJLSTKLW-ZBFHGGJFSA-N 1 1 371.441 2.583 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000421112824 514489126 /nfs/dbraw/zinc/48/91/26/514489126.db2.gz RGPLJNIMFJXGPG-LBPRGKRZSA-N 1 1 371.235 2.915 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2cccc(C(N)=O)c2[N+](=O)[O-])cc1F ZINC000439099129 514492926 /nfs/dbraw/zinc/49/29/26/514492926.db2.gz JGVLYKKAUNAJCH-UHFFFAOYSA-N 1 1 369.356 2.939 20 5 FFBDMO COC(=O)Cc1ccc(NCC[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000450247962 514564151 /nfs/dbraw/zinc/56/41/51/514564151.db2.gz PHHRNJSLCYLEFG-UHFFFAOYSA-N 1 1 369.421 2.781 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1 ZINC000453293054 514591974 /nfs/dbraw/zinc/59/19/74/514591974.db2.gz WQFOKDZDGBDQGS-YQQAZPJKSA-N 1 1 353.422 2.807 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458181049 514607028 /nfs/dbraw/zinc/60/70/28/514607028.db2.gz ZHJWKUSCHQARBA-CYBMUJFWSA-N 1 1 369.849 2.865 20 5 FFBDMO COC(=O)CC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000497727945 514612435 /nfs/dbraw/zinc/61/24/35/514612435.db2.gz QABHAGGWFKMUND-GFCCVEGCSA-N 1 1 374.397 2.981 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[C@H]1CCC[N@@H+](C)C1 ZINC000458192865 514616351 /nfs/dbraw/zinc/61/63/51/514616351.db2.gz PGKUOJKALXYNMH-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000470964749 514695999 /nfs/dbraw/zinc/69/59/99/514695999.db2.gz AZNMHIGYGXBUQM-OAHLLOKOSA-N 1 1 361.442 2.988 20 5 FFBDMO CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475546130 514710760 /nfs/dbraw/zinc/71/07/60/514710760.db2.gz GDPIUYZEDHPUPJ-QGZVFWFLSA-N 1 1 368.437 2.740 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000489188791 514744499 /nfs/dbraw/zinc/74/44/99/514744499.db2.gz ZRCCWQGXQBJYGL-MRXNPFEDSA-N 1 1 358.341 2.552 20 5 FFBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)Cc1ccncc1 ZINC000502770742 514768601 /nfs/dbraw/zinc/76/86/01/514768601.db2.gz QKFKMWNFFIFXQY-UHFFFAOYSA-N 1 1 356.382 2.810 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000489315716 514793884 /nfs/dbraw/zinc/79/38/84/514793884.db2.gz REZQVKYPECBJOV-SWLSCSKDSA-N 1 1 369.849 2.814 20 5 FFBDMO COc1cc(OCC(=O)Nc2cc(C)c3[nH+]ccn3c2)ccc1[N+](=O)[O-] ZINC000502838920 514803956 /nfs/dbraw/zinc/80/39/56/514803956.db2.gz MDSZEIYAEQXCIH-UHFFFAOYSA-N 1 1 356.338 2.577 20 5 FFBDMO CCc1ccc(C(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000471358310 514849965 /nfs/dbraw/zinc/84/99/65/514849965.db2.gz SYGYWWRKMZBUFM-ZIAGYGMSSA-N 1 1 363.458 2.775 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000467018946 514866048 /nfs/dbraw/zinc/86/60/48/514866048.db2.gz QXCAQBIOZZFGKK-XHDPSFHLSA-N 1 1 372.450 2.931 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467409384 514998610 /nfs/dbraw/zinc/99/86/10/514998610.db2.gz WSBVLWHOGLXQKL-QWRGUYRKSA-N 1 1 361.489 2.506 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000467409384 514998620 /nfs/dbraw/zinc/99/86/20/514998620.db2.gz WSBVLWHOGLXQKL-QWRGUYRKSA-N 1 1 361.489 2.506 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H](C)[NH+]1CCOCC1 ZINC000485419493 515034258 /nfs/dbraw/zinc/03/42/58/515034258.db2.gz TZOWTUUBEIWACY-ZIAGYGMSSA-N 1 1 374.416 2.739 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]4C(=O)NC[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000467522304 515034934 /nfs/dbraw/zinc/03/49/34/515034934.db2.gz OUZZWGHLLWGZNY-NVXWUHKLSA-N 1 1 371.393 2.574 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000490198269 515138041 /nfs/dbraw/zinc/13/80/41/515138041.db2.gz CJGVYZBCRXWGJA-CQSZACIVSA-N 1 1 360.458 2.919 20 5 FFBDMO COc1c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000476696891 515162803 /nfs/dbraw/zinc/16/28/03/515162803.db2.gz VVZAFWUDJXDZOG-PBHICJAKSA-N 1 1 369.421 2.854 20 5 FFBDMO Cc1nn(C)c(C(=O)Nc2ccc(-n3c[nH+]c(C)c3C)cc2)c1[N+](=O)[O-] ZINC000462764643 515229164 /nfs/dbraw/zinc/22/91/64/515229164.db2.gz GSJMUNPBSDPJKY-UHFFFAOYSA-N 1 1 354.370 2.692 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)c1 ZINC000485878585 515230947 /nfs/dbraw/zinc/23/09/47/515230947.db2.gz YBLSXIIAQALGEU-UAFMIMERSA-N 1 1 370.453 2.810 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000462776125 515237532 /nfs/dbraw/zinc/23/75/32/515237532.db2.gz DWOSZURTWAOTNI-CRAIPNDOSA-N 1 1 354.410 2.812 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC[N@@H+]2CC=C(C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000476923084 515250549 /nfs/dbraw/zinc/25/05/49/515250549.db2.gz NIVWWZQWIQCZAG-UHFFFAOYSA-N 1 1 363.462 2.678 20 5 FFBDMO CNc1c(C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000462902922 515289451 /nfs/dbraw/zinc/28/94/51/515289451.db2.gz ARRHZWOYIYTVHS-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO CNc1c(C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000462902922 515289458 /nfs/dbraw/zinc/28/94/58/515289458.db2.gz ARRHZWOYIYTVHS-LBPRGKRZSA-N 1 1 374.466 2.875 20 5 FFBDMO COc1cc(C[N@@H+](C[C@@H](C)O)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491089731 515376027 /nfs/dbraw/zinc/37/60/27/515376027.db2.gz NGVIPJXWPBHPOQ-LLVKDONJSA-N 1 1 362.373 2.839 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000463141449 515378974 /nfs/dbraw/zinc/37/89/74/515378974.db2.gz KECKTUYEISUNPG-HNNXBMFYSA-N 1 1 362.474 2.658 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000468488082 515383330 /nfs/dbraw/zinc/38/33/30/515383330.db2.gz PBJLIEOQDOORSS-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1cccc([C@@H]2[C@H](NC(=O)c3cc([N+](=O)[O-])c[nH]3)CC[N@H+]2C2CC2)c1 ZINC000481941351 515521619 /nfs/dbraw/zinc/52/16/19/515521619.db2.gz HPVRDGKCELLSKB-SJLPKXTDSA-N 1 1 370.409 2.639 20 5 FFBDMO CN(C)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000505445369 515536695 /nfs/dbraw/zinc/53/66/95/515536695.db2.gz JHCWSSOWWICXLF-MRXNPFEDSA-N 1 1 363.801 2.987 20 5 FFBDMO CN1CC[NH+](Cc2ccc(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)cc2)CC1 ZINC000473339145 515582197 /nfs/dbraw/zinc/58/21/97/515582197.db2.gz HYAIIUKGMHIZBZ-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000500121234 515599743 /nfs/dbraw/zinc/59/97/43/515599743.db2.gz KVPOXMUTUFQLGJ-ZIAGYGMSSA-N 1 1 371.441 2.550 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000457063485 515618454 /nfs/dbraw/zinc/61/84/54/515618454.db2.gz VTVVPLYKRFETCW-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO COC(=O)[C@@H]([N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528584 515621240 /nfs/dbraw/zinc/62/12/40/515621240.db2.gz ZNCZPOIXCQANBM-NVXWUHKLSA-N 1 1 362.426 2.885 20 5 FFBDMO COC(=O)[C@@H]([N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528584 515621249 /nfs/dbraw/zinc/62/12/49/515621249.db2.gz ZNCZPOIXCQANBM-NVXWUHKLSA-N 1 1 362.426 2.885 20 5 FFBDMO CC[C@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1N1CCOCC1 ZINC000493365549 515624995 /nfs/dbraw/zinc/62/49/95/515624995.db2.gz QUNSEXUJHGFBHA-SUMWQHHRSA-N 1 1 353.850 2.791 20 5 FFBDMO C[N@H+](Cc1ccccc1)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1 ZINC000482252924 515625652 /nfs/dbraw/zinc/62/56/52/515625652.db2.gz DDROTCYPBHAXBM-LJQANCHMSA-N 1 1 369.421 2.941 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1 ZINC000482252924 515625661 /nfs/dbraw/zinc/62/56/61/515625661.db2.gz DDROTCYPBHAXBM-LJQANCHMSA-N 1 1 369.421 2.941 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454644268 515636061 /nfs/dbraw/zinc/63/60/61/515636061.db2.gz OHVKKPSVJDNAMI-HZPDHXFCSA-N 1 1 358.442 2.721 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc1Cl ZINC000478038980 515679388 /nfs/dbraw/zinc/67/93/88/515679388.db2.gz WPIPEKUYVIYMAP-UHFFFAOYSA-N 1 1 365.821 2.880 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@H]2COc3ccccc3O2)c([N+](=O)[O-])c1 ZINC000482626375 515742250 /nfs/dbraw/zinc/74/22/50/515742250.db2.gz AJQCHKDRIKBRIS-HNNXBMFYSA-N 1 1 374.393 2.754 20 5 FFBDMO C[N@@H+](CCCCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000454802167 515752274 /nfs/dbraw/zinc/75/22/74/515752274.db2.gz RZHGAFBGANOODG-UHFFFAOYSA-N 1 1 354.838 2.922 20 5 FFBDMO COc1ccccc1[C@H](C)NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511064542 515763403 /nfs/dbraw/zinc/76/34/03/515763403.db2.gz KYDFKEOYAWGPFV-HNNXBMFYSA-N 1 1 371.437 2.955 20 5 FFBDMO COc1ccccc1[C@H](C)NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511064542 515763407 /nfs/dbraw/zinc/76/34/07/515763407.db2.gz KYDFKEOYAWGPFV-HNNXBMFYSA-N 1 1 371.437 2.955 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)CCc1ccccc1[N+](=O)[O-] ZINC000511073304 515766298 /nfs/dbraw/zinc/76/62/98/515766298.db2.gz KKTGLCKWVILGGP-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO C[C@H](C(=O)NCc1ccccc1F)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073841 515768283 /nfs/dbraw/zinc/76/82/83/515768283.db2.gz NDCYOKARWQKOFI-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO C[C@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073841 515768290 /nfs/dbraw/zinc/76/82/90/515768290.db2.gz NDCYOKARWQKOFI-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO CCOC[C@H]1CCCC[N@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000459728269 515773628 /nfs/dbraw/zinc/77/36/28/515773628.db2.gz ZFHQRRATNKQRJX-OAHLLOKOSA-N 1 1 363.414 2.784 20 5 FFBDMO CO[C@@H]1C[C@@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000459780958 515801282 /nfs/dbraw/zinc/80/12/82/515801282.db2.gz MCRGSLCHNPLBSM-BRWVUGGUSA-N 1 1 356.426 2.965 20 5 FFBDMO C[NH+](C)CCc1ccc(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1 ZINC000469484822 515835192 /nfs/dbraw/zinc/83/51/92/515835192.db2.gz YPWSMPSFHKSSAO-UHFFFAOYSA-N 1 1 367.409 2.505 20 5 FFBDMO C[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506471347 515890667 /nfs/dbraw/zinc/89/06/67/515890667.db2.gz PLSGUXSXEVNJLW-AWEZNQCLSA-N 1 1 355.394 2.647 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000511428218 515900643 /nfs/dbraw/zinc/90/06/43/515900643.db2.gz WUTJVKBZAAAWRF-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000501010913 515936581 /nfs/dbraw/zinc/93/65/81/515936581.db2.gz NZYQDFJZRNOTDK-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO CCCCOC1CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000464846941 515986442 /nfs/dbraw/zinc/98/64/42/515986442.db2.gz BOHLPIVEEDCGCQ-UHFFFAOYSA-N 1 1 361.442 2.765 20 5 FFBDMO CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCCOC2)O1 ZINC000483357929 516048899 /nfs/dbraw/zinc/04/88/99/516048899.db2.gz QOFSOYZXHQKIRY-SFHVURJKSA-N 1 1 350.415 2.634 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000470007120 516079037 /nfs/dbraw/zinc/07/90/37/516079037.db2.gz ARRMNEODRJVJJM-MWLCHTKSSA-N 1 1 374.340 2.588 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000470007120 516079045 /nfs/dbraw/zinc/07/90/45/516079045.db2.gz ARRMNEODRJVJJM-MWLCHTKSSA-N 1 1 374.340 2.588 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000488075355 516106944 /nfs/dbraw/zinc/10/69/44/516106944.db2.gz OKSGYIPEDQKAIL-GJZGRUSLSA-N 1 1 366.849 2.717 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000470131168 516133797 /nfs/dbraw/zinc/13/37/97/516133797.db2.gz FSCHRMJYMOIHEC-QBIMZIAESA-N 1 1 355.394 2.941 20 5 FFBDMO CCN1CCN([C@H]2CC[N@H+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169871 516157849 /nfs/dbraw/zinc/15/78/49/516157849.db2.gz LFPLDUYDOIDYMO-QUHSPFQSSA-N 1 1 358.486 2.710 20 5 FFBDMO CCN1CCN([C@H]2CC[N@@H+](C/C(C)=C\c3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000470169871 516157858 /nfs/dbraw/zinc/15/78/58/516157858.db2.gz LFPLDUYDOIDYMO-QUHSPFQSSA-N 1 1 358.486 2.710 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCSC[C@H]3CCO)o2)c1 ZINC000470205168 516172287 /nfs/dbraw/zinc/17/22/87/516172287.db2.gz COFJJLHGFFWQCG-OAHLLOKOSA-N 1 1 363.439 2.592 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000488713932 516291372 /nfs/dbraw/zinc/29/13/72/516291372.db2.gz MJTOOYAYMUBKKG-COPLHBTASA-N 1 1 369.263 2.919 20 5 FFBDMO CC(=O)c1ccc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000484090088 516295298 /nfs/dbraw/zinc/29/52/98/516295298.db2.gz YSUPVTYNSMXGHM-HXUWFJFHSA-N 1 1 369.421 2.846 20 5 FFBDMO Cc1c(Br)c(N[C@H]2CCc3[nH+]c[nH]c3C2)ncc1[N+](=O)[O-] ZINC000517449688 516331042 /nfs/dbraw/zinc/33/10/42/516331042.db2.gz XHAXJCDAXXWHBG-QMMMGPOBSA-N 1 1 352.192 2.753 20 5 FFBDMO Cc1c(Br)c(N[C@H]2CCc3[nH]c[nH+]c3C2)ncc1[N+](=O)[O-] ZINC000517449688 516331049 /nfs/dbraw/zinc/33/10/49/516331049.db2.gz XHAXJCDAXXWHBG-QMMMGPOBSA-N 1 1 352.192 2.753 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cccc(Cl)c2F)cc1 ZINC000543620242 516331889 /nfs/dbraw/zinc/33/18/89/516331889.db2.gz YSJBATDLPYDKHW-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000557740811 516413252 /nfs/dbraw/zinc/41/32/52/516413252.db2.gz CQXBUPCUTFMUBH-INIZCTEOSA-N 1 1 371.441 2.600 20 5 FFBDMO COc1ccc(NC(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000543892050 516482874 /nfs/dbraw/zinc/48/28/74/516482874.db2.gz LCRDKKDDIZEWOI-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000540365956 516528724 /nfs/dbraw/zinc/52/87/24/516528724.db2.gz LIXONKUUXSQKGS-GFCCVEGCSA-N 1 1 373.409 2.952 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000540478251 516572632 /nfs/dbraw/zinc/57/26/32/516572632.db2.gz PKRJACHQLJWZTE-QGZVFWFLSA-N 1 1 373.384 2.600 20 5 FFBDMO COc1ccc(CN(C)C(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000540479954 516575050 /nfs/dbraw/zinc/57/50/50/516575050.db2.gz CWZQRVNTUGETNG-CQSZACIVSA-N 1 1 357.410 2.913 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1O ZINC000544186411 516633429 /nfs/dbraw/zinc/63/34/29/516633429.db2.gz ZYTOGYCYYCSXFD-CYBMUJFWSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1O ZINC000544186411 516633442 /nfs/dbraw/zinc/63/34/42/516633442.db2.gz ZYTOGYCYYCSXFD-CYBMUJFWSA-N 1 1 373.409 2.811 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000513518357 516659859 /nfs/dbraw/zinc/65/98/59/516659859.db2.gz DLEIFQBENVFTLL-LJQANCHMSA-N 1 1 354.410 2.661 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000544298835 516687230 /nfs/dbraw/zinc/68/72/30/516687230.db2.gz GSDGHAAOEQYZJH-KGLIPLIRSA-N 1 1 364.446 2.666 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561762602 516756661 /nfs/dbraw/zinc/75/66/61/516756661.db2.gz PBHBWZFGSKDJHQ-GRDNDAEWSA-N 1 1 363.483 2.876 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000518788642 516776610 /nfs/dbraw/zinc/77/66/10/516776610.db2.gz YHHHSZYSCATGAZ-CYBMUJFWSA-N 1 1 363.414 2.565 20 5 FFBDMO Cc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)cc2[nH]1 ZINC000532186546 516848276 /nfs/dbraw/zinc/84/82/76/516848276.db2.gz ZXMGNRNFTQBYTJ-UHFFFAOYSA-N 1 1 354.322 2.803 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000541097892 516873576 /nfs/dbraw/zinc/87/35/76/516873576.db2.gz FISWLYNZQHJTPW-OAHLLOKOSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000541097892 516873584 /nfs/dbraw/zinc/87/35/84/516873584.db2.gz FISWLYNZQHJTPW-OAHLLOKOSA-N 1 1 356.382 2.912 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCNC(=O)[C@@H]1Cc1ccccc1 ZINC000519198471 516920157 /nfs/dbraw/zinc/92/01/57/516920157.db2.gz HVGMJNHTATULCH-IBGZPJMESA-N 1 1 353.422 2.836 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000562214791 516961498 /nfs/dbraw/zinc/96/14/98/516961498.db2.gz VEPWXUKCGRWVNA-OAHLLOKOSA-N 1 1 358.442 2.999 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000562272871 516999137 /nfs/dbraw/zinc/99/91/37/516999137.db2.gz JGYWQCVJRCKRHM-SFHVURJKSA-N 1 1 373.457 2.600 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)C1CC1 ZINC000548501866 517020597 /nfs/dbraw/zinc/02/05/97/517020597.db2.gz LGPSSVOXRRNATK-GOSISDBHSA-N 1 1 354.410 2.630 20 5 FFBDMO C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525468560 517051435 /nfs/dbraw/zinc/05/14/35/517051435.db2.gz AHALPUOEIGRXDI-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525468560 517051447 /nfs/dbraw/zinc/05/14/47/517051447.db2.gz AHALPUOEIGRXDI-KXBFYZLASA-N 1 1 369.421 2.614 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000562394715 517075899 /nfs/dbraw/zinc/07/58/99/517075899.db2.gz DTELQAWOAURUPR-YJBOKZPZSA-N 1 1 363.458 2.561 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000532699190 517102775 /nfs/dbraw/zinc/10/27/75/517102775.db2.gz GJQIJYJODBVSAT-XHSDSOJGSA-N 1 1 360.458 2.871 20 5 FFBDMO Cc1c(Br)c(NCC[N@H+]2CCC[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000541576984 517122250 /nfs/dbraw/zinc/12/22/50/517122250.db2.gz YKHBDJXPEWECHF-SNVBAGLBSA-N 1 1 357.252 2.626 20 5 FFBDMO Cc1c(Br)c(NCC[N@@H+]2CCC[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000541576984 517122264 /nfs/dbraw/zinc/12/22/64/517122264.db2.gz YKHBDJXPEWECHF-SNVBAGLBSA-N 1 1 357.252 2.626 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1[C@@H]1C[C@@H]1c1ccccc1 ZINC000537315848 517141549 /nfs/dbraw/zinc/14/15/49/517141549.db2.gz YAJXXHYKKQTXOA-ARFHVFGLSA-N 1 1 357.435 2.903 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)CC1 ZINC000555868998 517161289 /nfs/dbraw/zinc/16/12/89/517161289.db2.gz KCTDZBXODMIZHF-UHFFFAOYSA-N 1 1 370.247 2.834 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C ZINC000555928400 517188007 /nfs/dbraw/zinc/18/80/07/517188007.db2.gz OWEGTGRQSGEUNU-QWRGUYRKSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C ZINC000555928400 517188011 /nfs/dbraw/zinc/18/80/11/517188011.db2.gz OWEGTGRQSGEUNU-QWRGUYRKSA-N 1 1 370.247 2.830 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000515262154 517276952 /nfs/dbraw/zinc/27/69/52/517276952.db2.gz JLMGXLWGBMBBIT-OAHLLOKOSA-N 1 1 350.463 2.899 20 5 FFBDMO C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000548933616 517311248 /nfs/dbraw/zinc/31/12/48/517311248.db2.gz HZKIWELOOXQKFE-UHFFFAOYSA-N 1 1 370.409 2.808 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000515537736 517397430 /nfs/dbraw/zinc/39/74/30/517397430.db2.gz PSMWDVARUNKFQK-UHFFFAOYSA-N 1 1 363.393 2.578 20 5 FFBDMO CO[C@H](C)C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C(C)C ZINC000533429079 517457964 /nfs/dbraw/zinc/45/79/64/517457964.db2.gz CAIOCYDPRXUQFW-CYBMUJFWSA-N 1 1 351.403 2.638 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000527089998 517498594 /nfs/dbraw/zinc/49/85/94/517498594.db2.gz JLPDEUBJCPMLGG-DLBZAZTESA-N 1 1 362.430 2.668 20 5 FFBDMO Cn1ccnc1[C@H](NCc1c[nH+]c2n1CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000556619292 517523051 /nfs/dbraw/zinc/52/30/51/517523051.db2.gz RVIXAXSYHDYYSH-GOSISDBHSA-N 1 1 366.425 2.740 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000538276752 517536103 /nfs/dbraw/zinc/53/61/03/517536103.db2.gz SKAFZDIEJIUVAC-GFCCVEGCSA-N 1 1 356.382 2.843 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000563002137 517573112 /nfs/dbraw/zinc/57/31/12/517573112.db2.gz CFEXHXMGWRXRGM-JTQLQIEISA-N 1 1 374.290 2.681 20 5 FFBDMO COC(=O)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000553254264 517604629 /nfs/dbraw/zinc/60/46/29/517604629.db2.gz TWLOXJJJGPESCN-ZDUSSCGKSA-N 1 1 363.414 2.505 20 5 FFBDMO CC(C)(C)[C@@H]1CCC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000527284010 517614487 /nfs/dbraw/zinc/61/44/87/517614487.db2.gz VFHQADJVHYJKGF-CJNGLKHVSA-N 1 1 359.426 2.985 20 5 FFBDMO CN1CCC(CCO)([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000516490646 517707976 /nfs/dbraw/zinc/70/79/76/517707976.db2.gz LPIFYVBOLYGFGY-UHFFFAOYSA-N 1 1 359.426 2.791 20 5 FFBDMO CN(c1ccccc1)c1ccc(CNC[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000546563320 517726723 /nfs/dbraw/zinc/72/67/23/517726723.db2.gz JQUCDZQFCWBJIV-HXUWFJFHSA-N 1 1 370.453 2.519 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH2+]C[C@]2(O)CCN(C)C2)cc1[N+](=O)[O-] ZINC000546563320 517726733 /nfs/dbraw/zinc/72/67/33/517726733.db2.gz JQUCDZQFCWBJIV-HXUWFJFHSA-N 1 1 370.453 2.519 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C[C@@H]2C)cc1OC ZINC000530361344 517728524 /nfs/dbraw/zinc/72/85/24/517728524.db2.gz VNASMJWGDKDPJW-KCQAQPDRSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C[C@@H]2C)cc1OC ZINC000530361344 517728533 /nfs/dbraw/zinc/72/85/33/517728533.db2.gz VNASMJWGDKDPJW-KCQAQPDRSA-N 1 1 352.431 2.983 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(OCCO)CC3)cs2)c1 ZINC000538724866 517748031 /nfs/dbraw/zinc/74/80/31/517748031.db2.gz GUQYIKKTKJVXGT-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000557197895 517914539 /nfs/dbraw/zinc/91/45/39/517914539.db2.gz UWVMINJIBOSYNV-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000557197895 517914548 /nfs/dbraw/zinc/91/45/48/517914548.db2.gz UWVMINJIBOSYNV-QGZVFWFLSA-N 1 1 368.437 2.635 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000530709897 517932709 /nfs/dbraw/zinc/93/27/09/517932709.db2.gz KJSDWHRIPIZBGT-HOCLYGCPSA-N 1 1 356.426 2.716 20 5 FFBDMO C[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@H+]1CCc2sccc2C1 ZINC000543438726 518091078 /nfs/dbraw/zinc/09/10/78/518091078.db2.gz TYAGFZHROMEVNX-GFCCVEGCSA-N 1 1 369.450 2.880 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558263 518111272 /nfs/dbraw/zinc/11/12/72/518111272.db2.gz FPNFCBZDYRRKKI-CXAGYDPISA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558263 518111281 /nfs/dbraw/zinc/11/12/81/518111281.db2.gz FPNFCBZDYRRKKI-CXAGYDPISA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](Nc3c([N+](=O)[O-])ncn3C)CC[N@H+]2C2CC2)c1 ZINC000539773768 518158674 /nfs/dbraw/zinc/15/86/74/518158674.db2.gz FQQHDPKXLWZVBG-JKSUJKDBSA-N 1 1 357.414 2.727 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000581675607 518403995 /nfs/dbraw/zinc/40/39/95/518403995.db2.gz YIGRGYFPKVHJPV-INIZCTEOSA-N 1 1 369.421 2.742 20 5 FFBDMO C[C@H](C(=O)N[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000573158584 518531823 /nfs/dbraw/zinc/53/18/23/518531823.db2.gz DTYWGWKNYPLSDT-KYNGSXCRSA-N 1 1 353.422 2.912 20 5 FFBDMO Cc1ccc(C(=O)Nc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000576366481 518558657 /nfs/dbraw/zinc/55/86/57/518558657.db2.gz AEWDORYLROYTCM-QGZVFWFLSA-N 1 1 355.394 2.722 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2cnn(C(C)C)c2)c([N+](=O)[O-])c1 ZINC000582208148 518637371 /nfs/dbraw/zinc/63/73/71/518637371.db2.gz JNPUNRNILFGFGS-LBPRGKRZSA-N 1 1 361.402 2.670 20 5 FFBDMO CO[C@@H](C)c1nc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cs1 ZINC000564849584 518651736 /nfs/dbraw/zinc/65/17/36/518651736.db2.gz MIARISUAIOPKRC-NSHDSACASA-N 1 1 364.427 2.877 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N2CC[NH+](Cc3cccs3)CC2)s1 ZINC000587010232 518675349 /nfs/dbraw/zinc/67/53/49/518675349.db2.gz YUJULCQUUBBUNX-UHFFFAOYSA-N 1 1 361.452 2.983 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000588007564 518699594 /nfs/dbraw/zinc/69/95/94/518699594.db2.gz HMRSSSALSLPDNY-OAHLLOKOSA-N 1 1 356.382 2.683 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000588007564 518699596 /nfs/dbraw/zinc/69/95/96/518699596.db2.gz HMRSSSALSLPDNY-OAHLLOKOSA-N 1 1 356.382 2.683 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000567784736 518708786 /nfs/dbraw/zinc/70/87/86/518708786.db2.gz UKKUHKSPXNMLFO-AWEZNQCLSA-N 1 1 373.457 2.650 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC=C(c3cccnc3)C2)c1 ZINC000589163606 518935305 /nfs/dbraw/zinc/93/53/05/518935305.db2.gz YXVOYFXRJRMEFZ-SFHVURJKSA-N 1 1 355.394 2.519 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589187592 518944350 /nfs/dbraw/zinc/94/43/50/518944350.db2.gz BCCPRWHRCSTQOU-HIFRSBDPSA-N 1 1 350.415 2.882 20 5 FFBDMO C[C@@H](C(=O)NCCc1cccs1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000574139340 519006614 /nfs/dbraw/zinc/00/66/14/519006614.db2.gz DIUXRWQBQUSLPP-AWEZNQCLSA-N 1 1 361.467 2.878 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)Nc1c[nH+]ccc1-n1cccn1 ZINC000565560542 519017164 /nfs/dbraw/zinc/01/71/64/519017164.db2.gz FOSDHAOVWZQSSP-UHFFFAOYSA-N 1 1 359.292 2.635 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000568460505 519046787 /nfs/dbraw/zinc/04/67/87/519046787.db2.gz YQIKYJFLWSAMPF-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000589634571 519048865 /nfs/dbraw/zinc/04/88/65/519048865.db2.gz HBZHWONMHYAJBG-HUUCEWRRSA-N 1 1 371.441 2.545 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000577389887 519057157 /nfs/dbraw/zinc/05/71/57/519057157.db2.gz BXWSELGHVYGDNJ-BBRMVZONSA-N 1 1 369.487 2.508 20 5 FFBDMO C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1Cc1ccccc1 ZINC000583100591 519076630 /nfs/dbraw/zinc/07/66/30/519076630.db2.gz RMAAOHKZVCRUJN-INIZCTEOSA-N 1 1 351.410 2.834 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1 ZINC000589997204 519123532 /nfs/dbraw/zinc/12/35/32/519123532.db2.gz ZRPGRSVMHTVMLT-QGZVFWFLSA-N 1 1 355.394 2.722 20 5 FFBDMO COc1ccc(-c2ccc(CN3CC[C@@H]4C[N@@H+](C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052741 519137361 /nfs/dbraw/zinc/13/73/61/519137361.db2.gz KENXLDSQUBEHBK-ACJLOTCBSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4CN(C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052741 519137367 /nfs/dbraw/zinc/13/73/67/519137367.db2.gz KENXLDSQUBEHBK-ACJLOTCBSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]4CN(C)C[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052741 519137377 /nfs/dbraw/zinc/13/73/77/519137377.db2.gz KENXLDSQUBEHBK-ACJLOTCBSA-N 1 1 357.410 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH+]c[nH]c3C2)nc1OCc1ccccc1 ZINC000577568357 519141734 /nfs/dbraw/zinc/14/17/34/519141734.db2.gz QCOQSLARLQQUIX-AWEZNQCLSA-N 1 1 365.393 2.683 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3[nH]c[nH+]c3C2)nc1OCc1ccccc1 ZINC000577568357 519141736 /nfs/dbraw/zinc/14/17/36/519141736.db2.gz QCOQSLARLQQUIX-AWEZNQCLSA-N 1 1 365.393 2.683 20 5 FFBDMO Cc1cc(N2CC[NH+]([C@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590137866 519159951 /nfs/dbraw/zinc/15/99/51/519159951.db2.gz HCPYHBKTGBYKAF-LBPRGKRZSA-N 1 1 359.348 2.833 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590158195 519164439 /nfs/dbraw/zinc/16/44/39/519164439.db2.gz FTMVXKVELBDBID-QWRGUYRKSA-N 1 1 357.332 2.970 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000590446469 519235837 /nfs/dbraw/zinc/23/58/37/519235837.db2.gz VOBVPFYNTLEUHX-GXFFZTMASA-N 1 1 355.847 2.503 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000590578800 519273632 /nfs/dbraw/zinc/27/36/32/519273632.db2.gz RPUGSCIIDVFILR-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000574725598 519301219 /nfs/dbraw/zinc/30/12/19/519301219.db2.gz GTQFKJZYHVDINF-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000574725598 519301224 /nfs/dbraw/zinc/30/12/24/519301224.db2.gz GTQFKJZYHVDINF-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000590685688 519316561 /nfs/dbraw/zinc/31/65/61/519316561.db2.gz SHDKAVBCHAQYFO-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCCN(c3nc(N4CCOCC4)cc[nH+]3)C2)cc1 ZINC000590717446 519331002 /nfs/dbraw/zinc/33/10/02/519331002.db2.gz PSNCJSDNWHUDMZ-INIZCTEOSA-N 1 1 369.425 2.605 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000569118611 519388786 /nfs/dbraw/zinc/38/87/86/519388786.db2.gz BNWHJGLBJJKMEI-UHFFFAOYSA-N 1 1 359.426 2.963 20 5 FFBDMO COc1cc(CN(C)CCC[NH3+])ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000569118611 519388792 /nfs/dbraw/zinc/38/87/92/519388792.db2.gz BNWHJGLBJJKMEI-UHFFFAOYSA-N 1 1 359.426 2.963 20 5 FFBDMO CC(C)(C)c1csc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000583866715 519474545 /nfs/dbraw/zinc/47/45/45/519474545.db2.gz DZXUHGAXOOJQGN-ZDUSSCGKSA-N 1 1 365.455 2.878 20 5 FFBDMO CO[C@@H](C)C[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000581161084 519551636 /nfs/dbraw/zinc/55/16/36/519551636.db2.gz ZDYWDAMBGCASAV-VIFPVBQESA-N 1 1 364.183 2.666 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873235 519939779 /nfs/dbraw/zinc/93/97/79/519939779.db2.gz ICMRPOQAXLFAQC-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873235 519939787 /nfs/dbraw/zinc/93/97/87/519939787.db2.gz ICMRPOQAXLFAQC-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C)[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000602873235 519939795 /nfs/dbraw/zinc/93/97/95/519939795.db2.gz ICMRPOQAXLFAQC-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1(C)C ZINC000599898245 519941216 /nfs/dbraw/zinc/94/12/16/519941216.db2.gz DAAHNQYTIFEBLU-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1(C)C ZINC000599898245 519941222 /nfs/dbraw/zinc/94/12/22/519941222.db2.gz DAAHNQYTIFEBLU-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccncc1)C1(CO)CCC1 ZINC000602903371 519962863 /nfs/dbraw/zinc/96/28/63/519962863.db2.gz RMBODIOLYAQUPA-SFHVURJKSA-N 1 1 357.410 2.992 20 5 FFBDMO COc1ncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000602962118 519995209 /nfs/dbraw/zinc/99/52/09/519995209.db2.gz HQJSBIZVCOSDGY-INIZCTEOSA-N 1 1 351.790 2.649 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000602965452 519997589 /nfs/dbraw/zinc/99/75/89/519997589.db2.gz GEDLOAYQWDLOEG-QGZVFWFLSA-N 1 1 364.785 2.974 20 5 FFBDMO O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1 ZINC000600075231 520031611 /nfs/dbraw/zinc/03/16/11/520031611.db2.gz ASGNBDPVPGIYLN-UHFFFAOYSA-N 1 1 363.311 2.731 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594604059 520049931 /nfs/dbraw/zinc/04/99/31/520049931.db2.gz XRPKZDRUBPUBKI-PKOBYXMFSA-N 1 1 374.485 2.856 20 5 FFBDMO CSc1cccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)c1[N+](=O)[O-] ZINC000597581036 520117176 /nfs/dbraw/zinc/11/71/76/520117176.db2.gz OSDJVPXOVUOLIA-QWHCGFSZSA-N 1 1 353.419 2.575 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCc4ccc(O)cc4CC3)n2)c1 ZINC000608866715 520148915 /nfs/dbraw/zinc/14/89/15/520148915.db2.gz VMRREXFOWTUAPU-UHFFFAOYSA-N 1 1 366.377 2.951 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252755 520159411 /nfs/dbraw/zinc/15/94/11/520159411.db2.gz NEIXDABCEIJAIG-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252755 520159429 /nfs/dbraw/zinc/15/94/29/520159429.db2.gz NEIXDABCEIJAIG-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C(C)C)C2)c1[N+](=O)[O-] ZINC000600252755 520159434 /nfs/dbraw/zinc/15/94/34/520159434.db2.gz NEIXDABCEIJAIG-MRXNPFEDSA-N 1 1 371.441 2.609 20 5 FFBDMO CCOc1cc(Cn2cc(C[NH2+]Cc3ccccc3)nn2)ccc1[N+](=O)[O-] ZINC000603239187 520174069 /nfs/dbraw/zinc/17/40/69/520174069.db2.gz UVZFGEIYHJVBJL-UHFFFAOYSA-N 1 1 367.409 2.923 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000594854521 520191056 /nfs/dbraw/zinc/19/10/56/520191056.db2.gz OYRJRVDCIWWSTG-CQSZACIVSA-N 1 1 367.471 2.589 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CCCC[N@@H+](C)C1 ZINC000600311263 520197442 /nfs/dbraw/zinc/19/74/42/520197442.db2.gz ONCJQALHURYYPL-KBPBESRZSA-N 1 1 351.472 2.924 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000600311202 520197942 /nfs/dbraw/zinc/19/79/42/520197942.db2.gz OKQBIKFVZRYIIF-INIZCTEOSA-N 1 1 374.485 2.659 20 5 FFBDMO CCc1ccc(C[N@@H+](CC(C)C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000592138994 520213900 /nfs/dbraw/zinc/21/39/00/520213900.db2.gz UMAMMIKKXZOMQN-IBGZPJMESA-N 1 1 360.458 2.873 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000603400383 520248170 /nfs/dbraw/zinc/24/81/70/520248170.db2.gz HDEXKNRYJMDOOL-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO CC1(C)[C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@H]1[NH+]1CCOCC1 ZINC000603408393 520253073 /nfs/dbraw/zinc/25/30/73/520253073.db2.gz WZGXXCLGHILQDW-VXGBXAGGSA-N 1 1 363.443 2.511 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000609310300 520270158 /nfs/dbraw/zinc/27/01/58/520270158.db2.gz ZXNZQVNXLSZYJZ-MRXNPFEDSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000600470720 520278229 /nfs/dbraw/zinc/27/82/29/520278229.db2.gz ICDZZVCYILPDBF-QGZVFWFLSA-N 1 1 372.469 2.942 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1OC ZINC000597859347 520287031 /nfs/dbraw/zinc/28/70/31/520287031.db2.gz VBSAJZRPLOTJST-LBPRGKRZSA-N 1 1 365.430 2.605 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000609476783 520323730 /nfs/dbraw/zinc/32/37/30/520323730.db2.gz REXKPCAQHDTPFP-LBPRGKRZSA-N 1 1 351.451 2.511 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000597925412 520326296 /nfs/dbraw/zinc/32/62/96/520326296.db2.gz ORVKVVCCVSRKJT-HNNXBMFYSA-N 1 1 360.458 2.798 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000597926029 520327187 /nfs/dbraw/zinc/32/71/87/520327187.db2.gz ZRILEDGOMYCRJY-ZDUSSCGKSA-N 1 1 357.414 2.588 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])cc(Br)c1C)[C@H]1CC[N@@H+](C)C1 ZINC000597945057 520344386 /nfs/dbraw/zinc/34/43/86/520344386.db2.gz HFPXRLXJPWASII-NSHDSACASA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@@H+](CCn1cnc2sc([N+](=O)[O-])cc2c1=O)Cc1ccc(F)cc1 ZINC000592357965 520348841 /nfs/dbraw/zinc/34/88/41/520348841.db2.gz YPELKDYQGDJJKM-UHFFFAOYSA-N 1 1 362.386 2.637 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000613199632 520380915 /nfs/dbraw/zinc/38/09/15/520380915.db2.gz ONUMISOIRANFIS-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO O=[N+]([O-])c1ncccc1NCCCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000603867510 520385118 /nfs/dbraw/zinc/38/51/18/520385118.db2.gz WMQHCCLIAFBCKY-UHFFFAOYSA-N 1 1 369.469 3.000 20 5 FFBDMO CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000598040544 520389492 /nfs/dbraw/zinc/38/94/92/520389492.db2.gz HTNPBLQEPSNTMB-GXTWGEPZSA-N 1 1 369.849 2.958 20 5 FFBDMO CNc1c(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)cccc1[N+](=O)[O-] ZINC000613239982 520406006 /nfs/dbraw/zinc/40/60/06/520406006.db2.gz KUQVLAZIGUIMPU-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)n2)cc1 ZINC000592492984 520416541 /nfs/dbraw/zinc/41/65/41/520416541.db2.gz LAFKKPKJURYOSQ-HOTGVXAUSA-N 1 1 371.441 2.856 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000609758132 520423032 /nfs/dbraw/zinc/42/30/32/520423032.db2.gz LBPIPTADTRSQFF-CJNGLKHVSA-N 1 1 358.442 2.868 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604198970 520483037 /nfs/dbraw/zinc/48/30/37/520483037.db2.gz NCPBBWDWEGDPGM-UXLLHSPISA-N 1 1 374.485 2.901 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000610044965 520515461 /nfs/dbraw/zinc/51/54/61/520515461.db2.gz KEDNKCLDFQKQDR-LBPRGKRZSA-N 1 1 368.231 2.666 20 5 FFBDMO O=C(C[N@H+](C1CC1)C1(CO)CCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595532995 520531715 /nfs/dbraw/zinc/53/17/15/520531715.db2.gz DWWPVQPKIXIIHA-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+](C1CC1)C1(CO)CCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595532995 520531723 /nfs/dbraw/zinc/53/17/23/520531723.db2.gz DWWPVQPKIXIIHA-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO COCC[C@@H]1CCCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000613503380 520533105 /nfs/dbraw/zinc/53/31/05/520533105.db2.gz QZYJAJBHOCHWDB-MAUKXSAKSA-N 1 1 361.442 2.839 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(CNc3ccc([N+](=O)[O-])s3)cc2)CC1 ZINC000604409320 520555522 /nfs/dbraw/zinc/55/55/22/520555522.db2.gz XPUNMLNJDQEKAI-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000598341461 520564471 /nfs/dbraw/zinc/56/44/71/520564471.db2.gz BZXRNBKORAMFIP-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO C[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000600991551 520578215 /nfs/dbraw/zinc/57/82/15/520578215.db2.gz CHKBNJBWPPSYFS-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO C[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000600991551 520578224 /nfs/dbraw/zinc/57/82/24/520578224.db2.gz CHKBNJBWPPSYFS-ZDUSSCGKSA-N 1 1 357.385 2.911 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000610359985 520649695 /nfs/dbraw/zinc/64/96/95/520649695.db2.gz GZBDHCHWULFIHR-RDJZCZTQSA-N 1 1 356.426 2.635 20 5 FFBDMO CCCC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccc(C)o1 ZINC000610368246 520653092 /nfs/dbraw/zinc/65/30/92/520653092.db2.gz PYDQZVDCNOYKHN-ZBFHGGJFSA-N 1 1 350.419 2.917 20 5 FFBDMO C[NH+](C)CCOc1ccc(CN[C@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1 ZINC000601149159 520660448 /nfs/dbraw/zinc/66/04/48/520660448.db2.gz KAFYMHBDZRYOMJ-HXUWFJFHSA-N 1 1 373.453 2.533 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000610392184 520664107 /nfs/dbraw/zinc/66/41/07/520664107.db2.gz ALPZMZZSBXXEMV-NVXWUHKLSA-N 1 1 369.425 2.513 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598509680 520668776 /nfs/dbraw/zinc/66/87/76/520668776.db2.gz KXAUQFJDSULXMG-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598509680 520668784 /nfs/dbraw/zinc/66/87/84/520668784.db2.gz KXAUQFJDSULXMG-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000610413143 520673438 /nfs/dbraw/zinc/67/34/38/520673438.db2.gz FWYBDRZCCBZQHY-CVEARBPZSA-N 1 1 360.458 2.789 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CCO)c2ccc(OC)cc2)c1 ZINC000593018989 520687063 /nfs/dbraw/zinc/68/70/63/520687063.db2.gz HLJTVPRYMWCMDU-QGZVFWFLSA-N 1 1 374.393 2.603 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557118 520702666 /nfs/dbraw/zinc/70/26/66/520702666.db2.gz AFMVKZUCBYHFPN-ZDUSSCGKSA-N 1 1 367.396 2.654 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595786253 520723241 /nfs/dbraw/zinc/72/32/41/520723241.db2.gz HDASYRNGCNDLSF-ATZDWAIDSA-N 1 1 373.453 2.981 20 5 FFBDMO O=C1[C@H]([NH+]2CCC3(CC3(F)F)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000593072559 520724334 /nfs/dbraw/zinc/72/43/34/520724334.db2.gz ICXVFJASCRLUFX-CQSZACIVSA-N 1 1 351.353 2.821 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](n1cncn1)C(F)(F)F ZINC000601294702 520729250 /nfs/dbraw/zinc/72/92/50/520729250.db2.gz PUFREKSMDKGYDJ-ZANVPECISA-N 1 1 359.308 2.649 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNc2nccc(C(=O)OC)c2[N+](=O)[O-])c1 ZINC000598590088 520729349 /nfs/dbraw/zinc/72/93/49/520729349.db2.gz WZPICHLOKQXOLT-UHFFFAOYSA-N 1 1 358.398 2.840 20 5 FFBDMO O=C(CC[N@H+]1CCOC(C2CC2)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000595822619 520747085 /nfs/dbraw/zinc/74/70/85/520747085.db2.gz YFOMVPNSPJCHME-UHFFFAOYSA-N 1 1 359.426 2.814 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593115980 520756491 /nfs/dbraw/zinc/75/64/91/520756491.db2.gz KCSYMNGYXJVJSJ-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@]3(CC3(F)F)C2)c([N+](=O)[O-])c1 ZINC000593119234 520758277 /nfs/dbraw/zinc/75/82/77/520758277.db2.gz VUEHGGGKGWKFTF-OAHLLOKOSA-N 1 1 355.341 2.663 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CCN(Cc2cccc3c2CC[NH2+]C3)CC1 ZINC000595893886 520800539 /nfs/dbraw/zinc/80/05/39/520800539.db2.gz ZECJMHWATUVYHG-UHFFFAOYSA-N 1 1 352.438 2.563 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1c(F)cccc1[N+](=O)[O-])CCC(F)(F)F ZINC000601526981 520826553 /nfs/dbraw/zinc/82/65/53/520826553.db2.gz DYPULAOEROEOOU-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO CCN1CC[NH+](CCCNc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596074377 520894830 /nfs/dbraw/zinc/89/48/30/520894830.db2.gz SGPFASKXCLCQSF-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[N@H+]1CCc2sccc2C1 ZINC000596075319 520897896 /nfs/dbraw/zinc/89/78/96/520897896.db2.gz MFJGLNXXDBHSPH-NSHDSACASA-N 1 1 360.439 2.614 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596083290 520903020 /nfs/dbraw/zinc/90/30/20/520903020.db2.gz ZPBIRIQJERWDAI-ZDUSSCGKSA-N 1 1 370.881 2.942 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@H](c3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000596175624 520951613 /nfs/dbraw/zinc/95/16/13/520951613.db2.gz VHKYFRCYTHXTRO-JTQLQIEISA-N 1 1 364.789 2.762 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088103 520978116 /nfs/dbraw/zinc/97/81/16/520978116.db2.gz CSBDSTFLWPNUJF-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088103 520978122 /nfs/dbraw/zinc/97/81/22/520978122.db2.gz CSBDSTFLWPNUJF-INIZCTEOSA-N 1 1 374.485 2.997 20 5 FFBDMO NC(=O)c1cc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000596223607 520979413 /nfs/dbraw/zinc/97/94/13/520979413.db2.gz PTCUKSJFOGSIMW-HNNXBMFYSA-N 1 1 354.410 2.628 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)c(C(F)(F)F)c1 ZINC000596269366 521002431 /nfs/dbraw/zinc/00/24/31/521002431.db2.gz RVJLVZHCDPCQGT-UHFFFAOYSA-N 1 1 374.363 2.700 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599059200 521004935 /nfs/dbraw/zinc/00/49/35/521004935.db2.gz PAZNMUQSXQCSOV-UHFFFAOYSA-N 1 1 358.442 2.938 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@@H]3CCOC3)CC2)nc1-c1ccccc1 ZINC000611182456 521027262 /nfs/dbraw/zinc/02/72/62/521027262.db2.gz LUMFEZAXBUXCGK-MRXNPFEDSA-N 1 1 354.410 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@H]3CCOC3)CC2)nc1-c1ccccc1 ZINC000611182455 521027998 /nfs/dbraw/zinc/02/79/98/521027998.db2.gz LUMFEZAXBUXCGK-INIZCTEOSA-N 1 1 354.410 2.568 20 5 FFBDMO Cc1nc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000593496582 521031422 /nfs/dbraw/zinc/03/14/22/521031422.db2.gz SNBAZHDMXYKIDF-RBUKOAKNSA-N 1 1 368.437 2.778 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599218812 521092999 /nfs/dbraw/zinc/09/29/99/521092999.db2.gz CNPWFABNLJESCW-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO O=[N+]([O-])c1cnc(NC2(C[NH+]3CCN(c4ccccc4)CC3)CC2)c(F)c1 ZINC000596502730 521102863 /nfs/dbraw/zinc/10/28/63/521102863.db2.gz FUYOCWVJCMFSDT-UHFFFAOYSA-N 1 1 371.416 2.896 20 5 FFBDMO COC(=O)Cc1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000596558298 521129638 /nfs/dbraw/zinc/12/96/38/521129638.db2.gz QDNVZBQVLFGKSU-KRWDZBQOSA-N 1 1 369.421 2.997 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)O1 ZINC000596614475 521165298 /nfs/dbraw/zinc/16/52/98/521165298.db2.gz RNAMKJCIXIKOOC-WBMJQRKESA-N 1 1 369.381 2.935 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H](c2noc(-c3cc([N+](=O)[O-])c[nH]3)n2)O1 ZINC000596614475 521165307 /nfs/dbraw/zinc/16/53/07/521165307.db2.gz RNAMKJCIXIKOOC-WBMJQRKESA-N 1 1 369.381 2.935 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000611555623 521217194 /nfs/dbraw/zinc/21/71/94/521217194.db2.gz KHQGRHJKSNKFOF-MRXNPFEDSA-N 1 1 369.421 2.942 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000611555623 521217200 /nfs/dbraw/zinc/21/72/00/521217200.db2.gz KHQGRHJKSNKFOF-MRXNPFEDSA-N 1 1 369.421 2.942 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](OC(F)F)C2)c([N+](=O)[O-])c1 ZINC000611577756 521231843 /nfs/dbraw/zinc/23/18/43/521231843.db2.gz KRZUYVRLPSNVTL-GFCCVEGCSA-N 1 1 373.356 2.636 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611579128 521232439 /nfs/dbraw/zinc/23/24/39/521232439.db2.gz IWNCRXAWWUAACY-LBPRGKRZSA-N 1 1 371.340 2.596 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c(C)cc1[N+](=O)[O-] ZINC000599464516 521240931 /nfs/dbraw/zinc/24/09/31/521240931.db2.gz NAHGDEJMKATVJF-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)[C@@H](C)C2)cc1OC ZINC000611668762 521272615 /nfs/dbraw/zinc/27/26/15/521272615.db2.gz VGXCGRFESWXFMH-XEZPLFJOSA-N 1 1 352.431 2.841 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)[C@@H](C)C2)cc1OC ZINC000611668762 521272623 /nfs/dbraw/zinc/27/26/23/521272623.db2.gz VGXCGRFESWXFMH-XEZPLFJOSA-N 1 1 352.431 2.841 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCCC[C@H]3[NH+]3CCOCC3)c2c1 ZINC000611711367 521292259 /nfs/dbraw/zinc/29/22/59/521292259.db2.gz LCTYZJQHXCKTJQ-IAGOWNOFSA-N 1 1 357.414 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N[C@@H]3CCCC[C@@H]3[NH+]3CCOCC3)c2c1 ZINC000611711374 521292454 /nfs/dbraw/zinc/29/24/54/521292454.db2.gz LCTYZJQHXCKTJQ-SJORKVTESA-N 1 1 357.414 2.593 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553752 521296582 /nfs/dbraw/zinc/29/65/82/521296582.db2.gz ZWVWNFOBUONPQJ-OLZOCXBDSA-N 1 1 351.428 2.512 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553752 521296589 /nfs/dbraw/zinc/29/65/89/521296589.db2.gz ZWVWNFOBUONPQJ-OLZOCXBDSA-N 1 1 351.428 2.512 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000602472322 521364279 /nfs/dbraw/zinc/36/42/79/521364279.db2.gz DZEJDPCQHDCLRZ-QAPCUYQASA-N 1 1 357.458 2.813 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCCCN1CCOCC1 ZINC000602514749 521389883 /nfs/dbraw/zinc/38/98/83/521389883.db2.gz QGFLBPWPRHJEIB-UHFFFAOYSA-N 1 1 361.364 2.816 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739585 521441056 /nfs/dbraw/zinc/44/10/56/521441056.db2.gz NQTRZVPGPCWRDD-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599739585 521441063 /nfs/dbraw/zinc/44/10/63/521441063.db2.gz NQTRZVPGPCWRDD-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(=O)N1CCCC1 ZINC000602646260 521455531 /nfs/dbraw/zinc/45/55/31/521455531.db2.gz BWZFXYYZFCDSKH-QMMMGPOBSA-N 1 1 362.249 2.519 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000599830642 521499573 /nfs/dbraw/zinc/49/95/73/521499573.db2.gz WDVWCRSWKHRAPH-CYBMUJFWSA-N 1 1 355.398 2.749 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597103911 521509172 /nfs/dbraw/zinc/50/91/72/521509172.db2.gz MQUMWIRNVRHAFU-KOLCDFICSA-N 1 1 355.826 2.777 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000602834304 521560386 /nfs/dbraw/zinc/56/03/86/521560386.db2.gz YKLOTPVMLQSGHR-SQNIBIBYSA-N 1 1 356.426 2.604 20 5 FFBDMO COc1c(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000619442454 521570547 /nfs/dbraw/zinc/57/05/47/521570547.db2.gz VNIXBDCAZMXSLA-KGLIPLIRSA-N 1 1 361.442 2.986 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]2N1 ZINC000597204843 521572530 /nfs/dbraw/zinc/57/25/30/521572530.db2.gz GGAOTVBBYQQQIC-RHSMWYFYSA-N 1 1 355.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000615996190 521597728 /nfs/dbraw/zinc/59/77/28/521597728.db2.gz VNDCHFCVFPHSTQ-UHFFFAOYSA-N 1 1 371.441 2.534 20 5 FFBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(-c2nn[nH]n2)c1 ZINC000821613495 606315852 /nfs/dbraw/zinc/31/58/52/606315852.db2.gz PSYSUSFFZBDBBG-UHFFFAOYSA-N 1 1 365.353 2.548 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(-c2nn[nH]n2)c1 ZINC000821613495 606315853 /nfs/dbraw/zinc/31/58/53/606315853.db2.gz PSYSUSFFZBDBBG-UHFFFAOYSA-N 1 1 365.353 2.548 20 5 FFBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(-c2nn[nH]n2)cc1 ZINC000824633978 608464334 /nfs/dbraw/zinc/46/43/34/608464334.db2.gz SJBWJVLIVDZSKP-JTQLQIEISA-N 1 1 365.353 2.767 20 5 FFBDMO Cc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164631594 719108316 /nfs/dbraw/zinc/10/83/16/719108316.db2.gz YRCOQKILAOWBTJ-WMZOPIPTSA-N 1 1 353.426 2.794 20 5 FFBDMO COC[C@@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1nc(C)cc(C)c1[N+](=O)[O-])C2 ZINC001164807454 720126497 /nfs/dbraw/zinc/12/64/97/720126497.db2.gz CLLNUJRNILCXSS-PXNSSMCTSA-N 1 1 374.485 2.791 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc([N+](=O)[O-])cc1F)[C@@H]2C ZINC001164859282 720948060 /nfs/dbraw/zinc/94/80/60/720948060.db2.gz MASUJKRNPBEQDY-GFCCVEGCSA-N 1 1 362.409 2.747 20 5 FFBDMO Cc1nc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC001164896264 721511951 /nfs/dbraw/zinc/51/19/51/721511951.db2.gz AESSGNGEUAHDJU-DOTOQJQBSA-N 1 1 372.400 2.779 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000898513776 735373517 /nfs/dbraw/zinc/37/35/17/735373517.db2.gz YEOKOPMMSHXVFA-DZGCQCFKSA-N 1 1 350.415 2.948 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000073194662 728218680 /nfs/dbraw/zinc/21/86/80/728218680.db2.gz MJJLWXFZQZPSAM-CYBMUJFWSA-N 1 1 356.806 2.762 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000110508285 728532173 /nfs/dbraw/zinc/53/21/73/728532173.db2.gz AFYJQGYSHHKINB-SNVBAGLBSA-N 1 1 365.402 2.733 20 5 FFBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000131397507 728722157 /nfs/dbraw/zinc/72/21/57/728722157.db2.gz CSNSJAPKSWRURF-LLVKDONJSA-N 1 1 369.468 2.757 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000778787992 738411636 /nfs/dbraw/zinc/41/16/36/738411636.db2.gz LERBQYTZHDUJTO-UHFFFAOYSA-N 1 1 351.334 2.641 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000760814742 736670453 /nfs/dbraw/zinc/67/04/53/736670453.db2.gz BLSHKTMHMVOKQR-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1cccc(Br)c1[N+](=O)[O-] ZINC000856728636 730350903 /nfs/dbraw/zinc/35/09/03/730350903.db2.gz XCUIOPURIVIRTB-LLVKDONJSA-N 1 1 358.236 2.880 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2cccc([N+](=O)[O-])c2Cl)C[C@H](C)O1 ZINC000859942399 730469951 /nfs/dbraw/zinc/46/99/51/730469951.db2.gz UCRDVDALUSVBMH-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000861345977 730602253 /nfs/dbraw/zinc/60/22/53/730602253.db2.gz BXUMUVXWNGKSAY-CRAIPNDOSA-N 1 1 350.415 2.525 20 5 FFBDMO Cc1c(NC(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000925138531 738481370 /nfs/dbraw/zinc/48/13/70/738481370.db2.gz HINXVWRCUKEHSD-ZFWWWQNUSA-N 1 1 350.444 2.605 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC000864883410 730888217 /nfs/dbraw/zinc/88/82/17/730888217.db2.gz AWEIZSPXSMVIFD-AWEZNQCLSA-N 1 1 351.422 2.905 20 5 FFBDMO C[C@H]([NH2+]C[C@H](N1CCOCC1)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872071522 731726681 /nfs/dbraw/zinc/72/66/81/731726681.db2.gz QQKPBNKPKGSILT-GWCFXTLKSA-N 1 1 365.327 2.648 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000874832579 732105087 /nfs/dbraw/zinc/10/50/87/732105087.db2.gz FXRPAPWJXNNTGN-STQMWFEESA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000874837187 732105748 /nfs/dbraw/zinc/10/57/48/732105748.db2.gz IZUFOJFYQPPDAK-CHWSQXEVSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000877742376 732422393 /nfs/dbraw/zinc/42/23/93/732422393.db2.gz DABYVQCXJPUQLD-TZMCWYRMSA-N 1 1 354.248 2.883 20 5 FFBDMO CONC(=O)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000877784828 732430484 /nfs/dbraw/zinc/43/04/84/732430484.db2.gz MQBAMYLLZIXJFH-UHFFFAOYSA-N 1 1 361.320 2.503 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)o1 ZINC000878759408 732590098 /nfs/dbraw/zinc/59/00/98/732590098.db2.gz RORSCNVVEWOIOV-YGRLFVJLSA-N 1 1 364.789 2.909 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)o1 ZINC000878759408 732590103 /nfs/dbraw/zinc/59/01/03/732590103.db2.gz RORSCNVVEWOIOV-YGRLFVJLSA-N 1 1 364.789 2.909 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000888288151 734032363 /nfs/dbraw/zinc/03/23/63/734032363.db2.gz CQBGLVFOVSDULT-NWDGAFQWSA-N 1 1 368.821 2.541 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](C3OCCO3)C2)c1Br ZINC000718980629 734377081 /nfs/dbraw/zinc/37/70/81/734377081.db2.gz QXRMJNVJUIDBSN-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783680057 738826030 /nfs/dbraw/zinc/82/60/30/738826030.db2.gz PBLUWYAHWAAPMN-JTQLQIEISA-N 1 1 365.739 2.749 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678300 738826113 /nfs/dbraw/zinc/82/61/13/738826113.db2.gz ZBFBVNGXOPGCCK-QWHCGFSZSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678300 738826120 /nfs/dbraw/zinc/82/61/20/738826120.db2.gz ZBFBVNGXOPGCCK-QWHCGFSZSA-N 1 1 356.806 2.791 20 5 FFBDMO CC(C)(C)OC(=O)NCC[N@H+](CCO)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783676773 738826370 /nfs/dbraw/zinc/82/63/70/738826370.db2.gz OVLNLPKDTOAOSA-UHFFFAOYSA-N 1 1 373.837 2.567 20 5 FFBDMO CC(C)(C)OC(=O)NCC[N@@H+](CCO)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783676773 738826375 /nfs/dbraw/zinc/82/63/75/738826375.db2.gz OVLNLPKDTOAOSA-UHFFFAOYSA-N 1 1 373.837 2.567 20 5 FFBDMO O=[N+]([O-])c1nn(C[N@H+](C[C@H]2CCCO2)C2CCCC2)cc1Br ZINC000742166683 735208492 /nfs/dbraw/zinc/20/84/92/735208492.db2.gz QKKNNMQCVBQJJQ-GFCCVEGCSA-N 1 1 373.251 2.935 20 5 FFBDMO O=[N+]([O-])c1nn(C[N@@H+](C[C@H]2CCCO2)C2CCCC2)cc1Br ZINC000742166683 735208494 /nfs/dbraw/zinc/20/84/94/735208494.db2.gz QKKNNMQCVBQJJQ-GFCCVEGCSA-N 1 1 373.251 2.935 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)[C@H]2C1 ZINC000897826192 735280907 /nfs/dbraw/zinc/28/09/07/735280907.db2.gz VAUXOWMCXWLPML-XCBNKYQSSA-N 1 1 362.188 2.817 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558412 735731058 /nfs/dbraw/zinc/73/10/58/735731058.db2.gz JAQWYGMYISJDEA-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000749558412 735731062 /nfs/dbraw/zinc/73/10/62/735731062.db2.gz JAQWYGMYISJDEA-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO COc1cc([C@@H](C)NCCC[N@H+]2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160469 736044777 /nfs/dbraw/zinc/04/47/77/736044777.db2.gz MMOYSLOTQZGUPN-LSDHHAIUSA-N 1 1 351.447 2.755 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]CCCN2CCCO[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160469 736044784 /nfs/dbraw/zinc/04/47/84/736044784.db2.gz MMOYSLOTQZGUPN-LSDHHAIUSA-N 1 1 351.447 2.755 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000754222801 736136685 /nfs/dbraw/zinc/13/66/85/736136685.db2.gz FBLBVRIZWWXXDV-VIFPVBQESA-N 1 1 374.210 2.663 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@@H]1C ZINC000754222801 736136687 /nfs/dbraw/zinc/13/66/87/736136687.db2.gz FBLBVRIZWWXXDV-VIFPVBQESA-N 1 1 374.210 2.663 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](C2CCOCC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000755057162 736229454 /nfs/dbraw/zinc/22/94/54/736229454.db2.gz LZEHCLRRJZKZSG-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](C2CCOCC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000755057162 736229456 /nfs/dbraw/zinc/22/94/56/736229456.db2.gz LZEHCLRRJZKZSG-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756778357 736360928 /nfs/dbraw/zinc/36/09/28/736360928.db2.gz UZWDZKMYAJTNRK-GFCCVEGCSA-N 1 1 354.838 2.922 20 5 FFBDMO COC(=O)C1=C(C)O[C@@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000759855116 736599621 /nfs/dbraw/zinc/59/96/21/736599621.db2.gz MPEGTWLVDVVZRI-CYBMUJFWSA-N 1 1 354.790 2.916 20 5 FFBDMO COC(=O)C1=C(C)O[C@@H](C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000759855116 736599624 /nfs/dbraw/zinc/59/96/24/736599624.db2.gz MPEGTWLVDVVZRI-CYBMUJFWSA-N 1 1 354.790 2.916 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761049273 736690807 /nfs/dbraw/zinc/69/08/07/736690807.db2.gz PCTWUFMMWNPGJI-JTQLQIEISA-N 1 1 361.320 2.816 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000908362012 736764043 /nfs/dbraw/zinc/76/40/43/736764043.db2.gz GTDJVWPMQZOIGY-KRWDZBQOSA-N 1 1 351.834 2.735 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)c([N+](=O)[O-])c1 ZINC000763377428 736933259 /nfs/dbraw/zinc/93/32/59/736933259.db2.gz YBJCPMZOOKAITQ-UKRRQHHQSA-N 1 1 350.375 2.558 20 5 FFBDMO O=C(N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000764294488 737009343 /nfs/dbraw/zinc/00/93/43/737009343.db2.gz VYDFEWIKKFMILK-ZBFHGGJFSA-N 1 1 367.833 2.621 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2[C@@H](CC[NH+](C)C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000912650114 737327648 /nfs/dbraw/zinc/32/76/48/737327648.db2.gz IENIDKPWAODAPC-QWHCGFSZSA-N 1 1 351.451 2.776 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000772017383 737777131 /nfs/dbraw/zinc/77/71/31/737777131.db2.gz FQSUTACLWASDTR-UHFFFAOYSA-N 1 1 354.160 2.719 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000923267469 738264010 /nfs/dbraw/zinc/26/40/10/738264010.db2.gz WNIWRXRWFUTYAG-CMPLNLGQSA-N 1 1 357.332 2.922 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000777923769 738331792 /nfs/dbraw/zinc/33/17/92/738331792.db2.gz SIYXXBQVBOLJAZ-CQSZACIVSA-N 1 1 370.906 2.739 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000785732036 738992270 /nfs/dbraw/zinc/99/22/70/738992270.db2.gz IZFLLVHSGPOUPJ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000785732036 738992274 /nfs/dbraw/zinc/99/22/74/738992274.db2.gz IZFLLVHSGPOUPJ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@H]1CC[C@H](C)[NH+]1CC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000785741174 738994235 /nfs/dbraw/zinc/99/42/35/738994235.db2.gz FOWHIDKLNPVCCQ-QWRGUYRKSA-N 1 1 369.805 2.603 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000932662935 739487460 /nfs/dbraw/zinc/48/74/60/739487460.db2.gz KYLRIKWGLMENRU-ZDUSSCGKSA-N 1 1 361.423 2.870 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)s1 ZINC000932671667 739490672 /nfs/dbraw/zinc/49/06/72/739490672.db2.gz UNNCLMXFINXYNC-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)s1 ZINC000932671667 739490675 /nfs/dbraw/zinc/49/06/75/739490675.db2.gz UNNCLMXFINXYNC-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO O=C1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCCCCN1 ZINC000934155443 739737415 /nfs/dbraw/zinc/73/74/15/739737415.db2.gz GFFSGIAREYBENG-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO O=C1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCCCCN1 ZINC000934155443 739737417 /nfs/dbraw/zinc/73/74/17/739737417.db2.gz GFFSGIAREYBENG-UHFFFAOYSA-N 1 1 370.247 2.850 20 5 FFBDMO CC(C)[N@H+]1CCO[C@@H](COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000802140869 740677840 /nfs/dbraw/zinc/67/78/40/740677840.db2.gz MOCWKRXMIYATQV-DZGCQCFKSA-N 1 1 368.455 2.728 20 5 FFBDMO Cn1nc(Br)cc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000809688855 741331871 /nfs/dbraw/zinc/33/18/71/741331871.db2.gz QEKYQZQAKFICGY-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO Cn1nc(Br)cc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000809688855 741331872 /nfs/dbraw/zinc/33/18/72/741331872.db2.gz QEKYQZQAKFICGY-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000811448646 741523747 /nfs/dbraw/zinc/52/37/47/741523747.db2.gz ZLBXXYDUZMMBCX-KRWDZBQOSA-N 1 1 352.362 2.533 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000811448646 741523749 /nfs/dbraw/zinc/52/37/49/741523749.db2.gz ZLBXXYDUZMMBCX-KRWDZBQOSA-N 1 1 352.362 2.533 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000811859445 741568607 /nfs/dbraw/zinc/56/86/07/741568607.db2.gz RVWGHAMRTQHBDQ-SNVBAGLBSA-N 1 1 365.402 2.732 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)Nc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000811866145 741569025 /nfs/dbraw/zinc/56/90/25/741569025.db2.gz DILZDRRYGUOTBE-NSHDSACASA-N 1 1 354.407 2.836 20 5 FFBDMO C[C@H](COC(=O)c1ccccc1OCC[N@H+]1CCCC[C@@H]1C)[N+](=O)[O-] ZINC000813109036 741678052 /nfs/dbraw/zinc/67/80/52/741678052.db2.gz NRIGLLBQWYLRPM-LSDHHAIUSA-N 1 1 350.415 2.762 20 5 FFBDMO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000814655903 741854589 /nfs/dbraw/zinc/85/45/89/741854589.db2.gz KDEUMTMERGXNIX-TVQRCGJNSA-N 1 1 367.203 2.532 20 5 FFBDMO NC(=[NH+]OCc1ccc(Br)cc1[N+](=O)[O-])C1CCOCC1 ZINC000818077349 742235294 /nfs/dbraw/zinc/23/52/94/742235294.db2.gz CDFHPSZJQOTZQK-UHFFFAOYSA-N 1 1 358.192 2.782 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827321127 743554777 /nfs/dbraw/zinc/55/47/77/743554777.db2.gz UNAYYXCVPCNWAK-GXTWGEPZSA-N 1 1 367.833 2.570 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000831159549 745492620 /nfs/dbraw/zinc/49/26/20/745492620.db2.gz WTGLYMFSMYURSH-BJJXKVORSA-N 1 1 367.833 2.812 20 5 FFBDMO CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000839105060 746775856 /nfs/dbraw/zinc/77/58/56/746775856.db2.gz OEICIYCKWSHDSF-CRAIPNDOSA-N 1 1 350.415 2.682 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839484485 746836247 /nfs/dbraw/zinc/83/62/47/746836247.db2.gz PPVVIBTWCGQIFS-UHFFFAOYSA-N 1 1 372.263 2.511 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000839532337 746848753 /nfs/dbraw/zinc/84/87/53/746848753.db2.gz WQEYIRSHFRGJFY-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590010 746865111 /nfs/dbraw/zinc/86/51/11/746865111.db2.gz MFZFDXOEZHDWQV-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839590010 746865116 /nfs/dbraw/zinc/86/51/16/746865116.db2.gz MFZFDXOEZHDWQV-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000840789646 747184050 /nfs/dbraw/zinc/18/40/50/747184050.db2.gz ICCXDEILYKDDBZ-LLVKDONJSA-N 1 1 357.867 2.524 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNc1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000845578932 748285112 /nfs/dbraw/zinc/28/51/12/748285112.db2.gz MOGMMLVULFJCIQ-UHFFFAOYSA-N 1 1 350.419 2.941 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851743633 749659009 /nfs/dbraw/zinc/65/90/09/749659009.db2.gz WBIRDBDGGDDUPC-GFCCVEGCSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851743633 749659012 /nfs/dbraw/zinc/65/90/12/749659012.db2.gz WBIRDBDGGDDUPC-GFCCVEGCSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[NH2+][C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1[N+](=O)[O-] ZINC000851844163 749700953 /nfs/dbraw/zinc/70/09/53/749700953.db2.gz QFNOGOHHRYNOKS-INIZCTEOSA-N 1 1 356.423 2.920 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000852108581 749775636 /nfs/dbraw/zinc/77/56/36/749775636.db2.gz HWDPOVFDDCQFAR-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CCO ZINC000852455079 749863447 /nfs/dbraw/zinc/86/34/47/749863447.db2.gz DMQMQMAVTHEEAA-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CCO ZINC000852455079 749863450 /nfs/dbraw/zinc/86/34/50/749863450.db2.gz DMQMQMAVTHEEAA-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1CCO ZINC000852455997 749863936 /nfs/dbraw/zinc/86/39/36/749863936.db2.gz HMVUSVQQZSNFIB-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1CCO ZINC000852455997 749863941 /nfs/dbraw/zinc/86/39/41/749863941.db2.gz HMVUSVQQZSNFIB-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1cnc(CC[N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)s1 ZINC000853504969 750077221 /nfs/dbraw/zinc/07/72/21/750077221.db2.gz QHTJCOYAMNHPNZ-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO Cc1cnc(CC[N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)s1 ZINC000853504969 750077228 /nfs/dbraw/zinc/07/72/28/750077228.db2.gz QHTJCOYAMNHPNZ-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000053683039 971842810 /nfs/dbraw/zinc/84/28/10/971842810.db2.gz ZOALTBGCZPOSLI-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000053683039 971842814 /nfs/dbraw/zinc/84/28/14/971842814.db2.gz ZOALTBGCZPOSLI-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](OC2CCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000872280819 1013197742 /nfs/dbraw/zinc/19/77/42/1013197742.db2.gz VJUSRDFJSNGZEI-SFHVURJKSA-N 1 1 373.453 2.908 20 5 FFBDMO O=C1N(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCC12CCC2 ZINC000872587636 1013231184 /nfs/dbraw/zinc/23/11/84/1013231184.db2.gz SKBMFKASXWFPTL-UHFFFAOYSA-N 1 1 359.426 2.798 20 5 FFBDMO CN(CCC[NH2+]Cc1cc(Cl)ccc1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001276000884 1013269965 /nfs/dbraw/zinc/26/99/65/1013269965.db2.gz BARXPRWQJYBTMA-TZMCWYRMSA-N 1 1 360.241 2.597 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH2+]CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001276001919 1013270770 /nfs/dbraw/zinc/27/07/70/1013270770.db2.gz MHDFIZBFEKWERM-IEBWSBKVSA-N 1 1 355.438 2.752 20 5 FFBDMO CCN(CC)C(=O)C1CC[NH+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000121138494 962126354 /nfs/dbraw/zinc/12/63/54/962126354.db2.gz ZQUASGGWLOVSSH-UHFFFAOYSA-N 1 1 373.457 2.791 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCN1C(=O)OC(C)(C)C ZINC000933467409 964427544 /nfs/dbraw/zinc/42/75/44/964427544.db2.gz KVUWJYYEPFEWFX-HOTGVXAUSA-N 1 1 365.430 2.569 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001176155001 1013647532 /nfs/dbraw/zinc/64/75/32/1013647532.db2.gz TVZBNJJDKFURJY-HUUCEWRRSA-N 1 1 360.458 2.871 20 5 FFBDMO Cc1noc(C[NH2+][C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)c1[N+](=O)[O-] ZINC001177038484 1013835031 /nfs/dbraw/zinc/83/50/31/1013835031.db2.gz BEPGWTWBILZEKE-DYVFJYSZSA-N 1 1 366.418 2.913 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000311652736 970097816 /nfs/dbraw/zinc/09/78/16/970097816.db2.gz UNZVYTPBQZCPSV-FZKQIMNGSA-N 1 1 354.410 2.570 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000825764731 1013968177 /nfs/dbraw/zinc/96/81/77/1013968177.db2.gz MLPLVEUZPHUBGK-BETUJISGSA-N 1 1 366.437 2.793 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000875745067 1014070728 /nfs/dbraw/zinc/07/07/28/1014070728.db2.gz HRXTUZHZPANRSR-DLBZAZTESA-N 1 1 371.441 2.565 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000111169980 975626166 /nfs/dbraw/zinc/62/61/66/975626166.db2.gz HMYQJGHGMLZDPI-SFHVURJKSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000111169980 975626173 /nfs/dbraw/zinc/62/61/73/975626173.db2.gz HMYQJGHGMLZDPI-SFHVURJKSA-N 1 1 369.425 2.503 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)n1 ZINC001126869301 976428820 /nfs/dbraw/zinc/42/88/20/976428820.db2.gz PZRXFPYNLMXDDI-OAHLLOKOSA-N 1 1 356.426 2.939 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982279001 977376066 /nfs/dbraw/zinc/37/60/66/977376066.db2.gz XBUNHCBLJLGCKT-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982279001 977376071 /nfs/dbraw/zinc/37/60/71/977376071.db2.gz XBUNHCBLJLGCKT-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982279001 977376074 /nfs/dbraw/zinc/37/60/74/977376074.db2.gz XBUNHCBLJLGCKT-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO CC(C)(NC(=O)c1cnn(-c2cc[nH+]cc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC001126920050 979171292 /nfs/dbraw/zinc/17/12/92/979171292.db2.gz VHJOCNVGXZQFOW-UHFFFAOYSA-N 1 1 351.366 2.841 20 5 FFBDMO CC(C)n1cc(C2=CCC[N@H+](C3CC(n4cc([N+](=O)[O-])cn4)C3)CC2)nn1 ZINC000877565415 1014629619 /nfs/dbraw/zinc/62/96/19/1014629619.db2.gz YOBXTRPYHXOXKN-UHFFFAOYSA-N 1 1 371.445 2.847 20 5 FFBDMO C[N@H+](Cc1ccc2c(c1)CCC2)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964765 980156487 /nfs/dbraw/zinc/15/64/87/980156487.db2.gz YHPFDYJDGISEHH-WOJBJXKFSA-N 1 1 371.481 2.511 20 5 FFBDMO C[N@@H+](Cc1ccc2c(c1)CCC2)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964765 980156490 /nfs/dbraw/zinc/15/64/90/980156490.db2.gz YHPFDYJDGISEHH-WOJBJXKFSA-N 1 1 371.481 2.511 20 5 FFBDMO C[N@H+](Cc1ccc2c(c1)CCC2)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964765 980156496 /nfs/dbraw/zinc/15/64/96/980156496.db2.gz YHPFDYJDGISEHH-WOJBJXKFSA-N 1 1 371.481 2.511 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(C2(O)CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000897528529 981551458 /nfs/dbraw/zinc/55/14/58/981551458.db2.gz KCZXRGUVUMXKAS-MRXNPFEDSA-N 1 1 356.426 2.703 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000898035090 982599650 /nfs/dbraw/zinc/59/96/50/982599650.db2.gz KPPDMGAVSNNLQS-KRWDZBQOSA-N 1 1 357.458 2.739 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)C[C@@]2(C)C1 ZINC000913284759 984231652 /nfs/dbraw/zinc/23/16/52/984231652.db2.gz QGGYJYHBXADFCZ-KDURUIRLSA-N 1 1 354.410 2.557 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000044582735 984325170 /nfs/dbraw/zinc/32/51/70/984325170.db2.gz OHNNGSYPGCHOQJ-BETUJISGSA-N 1 1 364.402 2.601 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@H+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000764920205 984811581 /nfs/dbraw/zinc/81/15/81/984811581.db2.gz MYTUPQCCGQASSJ-CYBMUJFWSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000764920205 984811598 /nfs/dbraw/zinc/81/15/98/984811598.db2.gz MYTUPQCCGQASSJ-CYBMUJFWSA-N 1 1 356.386 2.781 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000765086112 984956625 /nfs/dbraw/zinc/95/66/25/984956625.db2.gz DJKDSDZCJFJYBI-ZDUSSCGKSA-N 1 1 374.466 2.899 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123201 984968797 /nfs/dbraw/zinc/96/87/97/984968797.db2.gz HLDMTKPPCNBRGJ-JKSUJKDBSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000765123201 984968800 /nfs/dbraw/zinc/96/88/00/984968800.db2.gz HLDMTKPPCNBRGJ-JKSUJKDBSA-N 1 1 363.414 2.986 20 5 FFBDMO C[NH+](C)[C@@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000062331427 985470866 /nfs/dbraw/zinc/47/08/66/985470866.db2.gz ILDPAPOJYYIHLS-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)NC(=O)OC(C)(C)C ZINC000785443714 986329673 /nfs/dbraw/zinc/32/96/73/986329673.db2.gz ZMKOGDRNXDBZBO-CQSZACIVSA-N 1 1 364.446 2.630 20 5 FFBDMO CCc1cccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589281 988763454 /nfs/dbraw/zinc/76/34/54/988763454.db2.gz PSXWXOLWKKIFBA-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1cccc(C[N@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589281 988763460 /nfs/dbraw/zinc/76/34/60/988763460.db2.gz PSXWXOLWKKIFBA-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1cccc(C[N@@H+]2C[C@@H]3CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC[C@@H]3C2)c1 ZINC000946589281 988763469 /nfs/dbraw/zinc/76/34/69/988763469.db2.gz PSXWXOLWKKIFBA-IYWMVGAKSA-N 1 1 371.481 2.585 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000766029577 989263135 /nfs/dbraw/zinc/26/31/35/989263135.db2.gz BVZLOSPYCRHLNN-UHFFFAOYSA-N 1 1 360.414 2.699 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000766029577 989263142 /nfs/dbraw/zinc/26/31/42/989263142.db2.gz BVZLOSPYCRHLNN-UHFFFAOYSA-N 1 1 360.414 2.699 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154264337 990110838 /nfs/dbraw/zinc/11/08/38/990110838.db2.gz GBAXXMSLKISJGD-YOEHRIQHSA-N 1 1 363.458 2.503 20 5 FFBDMO CCCc1ccc(C[NH+]2CC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)cc1 ZINC001035704761 990528299 /nfs/dbraw/zinc/52/82/99/990528299.db2.gz WWVXRGOXPDPTIQ-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CC(C)c1ccccc1C[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035706728 990529911 /nfs/dbraw/zinc/52/99/11/990529911.db2.gz KCHDHWDXEAHCQW-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000154878340 990556706 /nfs/dbraw/zinc/55/67/06/990556706.db2.gz YZXWYMAICBDBPG-CQSZACIVSA-N 1 1 360.414 2.957 20 5 FFBDMO Cc1noc(COC(=O)[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000923851167 990841866 /nfs/dbraw/zinc/84/18/66/990841866.db2.gz QJWGWUGKVSQISP-WFASDCNBSA-N 1 1 359.382 2.703 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC000879575104 1015592867 /nfs/dbraw/zinc/59/28/67/1015592867.db2.gz GONKOHABASDEKG-XNRPHZJLSA-N 1 1 357.414 2.732 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)O[C@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC001127564599 991200312 /nfs/dbraw/zinc/20/03/12/991200312.db2.gz KSOQHUNTMYQGFQ-GOSISDBHSA-N 1 1 352.350 2.828 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000179543238 991290249 /nfs/dbraw/zinc/29/02/49/991290249.db2.gz ZOSAUDKQIQOJCF-UHFFFAOYSA-N 1 1 371.441 2.545 20 5 FFBDMO COc1cc2c(cc1OC)[C@@H](C)[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000880088084 1015752388 /nfs/dbraw/zinc/75/23/88/1015752388.db2.gz IVRSSVBILJBKOO-GFCCVEGCSA-N 1 1 360.414 2.736 20 5 FFBDMO COc1cc2c(cc1OC)[C@@H](C)[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2 ZINC000880088084 1015752395 /nfs/dbraw/zinc/75/23/95/1015752395.db2.gz IVRSSVBILJBKOO-GFCCVEGCSA-N 1 1 360.414 2.736 20 5 FFBDMO O=C(C[NH+]1CCC2(CCCCO2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000880456975 1015839706 /nfs/dbraw/zinc/83/97/06/1015839706.db2.gz GRBDQORLANXJGP-UHFFFAOYSA-N 1 1 359.426 2.519 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000888833181 1015959181 /nfs/dbraw/zinc/95/91/81/1015959181.db2.gz XXKCOZICDDGXQF-ZFWWWQNUSA-N 1 1 362.430 2.942 20 5 FFBDMO CC(C)n1nccc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174339 995634830 /nfs/dbraw/zinc/63/48/30/995634830.db2.gz XVEATTDHZWFNDF-INIZCTEOSA-N 1 1 358.398 2.804 20 5 FFBDMO CC(C)n1nccc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813174339 995634831 /nfs/dbraw/zinc/63/48/31/995634831.db2.gz XVEATTDHZWFNDF-INIZCTEOSA-N 1 1 358.398 2.804 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000813414714 995684577 /nfs/dbraw/zinc/68/45/77/995684577.db2.gz QLRHUVMUXCKNFI-UHFFFAOYSA-N 1 1 373.319 2.943 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc(Cn2nc([N+](=O)[O-])cc2C)c1)C(C)C ZINC000845509046 998569620 /nfs/dbraw/zinc/56/96/20/998569620.db2.gz AGWZSGZIVFAKAZ-UHFFFAOYSA-N 1 1 373.457 2.608 20 5 FFBDMO Cc1ccccc1C[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001000150651 1016244959 /nfs/dbraw/zinc/24/49/59/1016244959.db2.gz SEXSEEBSJPHAAP-QZTJIDSGSA-N 1 1 357.454 2.521 20 5 FFBDMO CCc1ccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cc1 ZINC001000148603 1016245273 /nfs/dbraw/zinc/24/52/73/1016245273.db2.gz GYIZVOHHBULRTJ-RTBURBONSA-N 1 1 371.481 2.775 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000734145943 999216371 /nfs/dbraw/zinc/21/63/71/999216371.db2.gz AYHFELWFOYWRRM-CQSZACIVSA-N 1 1 352.398 2.521 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)[C@@H](C)C1 ZINC000734401465 999284366 /nfs/dbraw/zinc/28/43/66/999284366.db2.gz HKJJHSHNKWYUTF-GUYCJALGSA-N 1 1 367.421 2.601 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)C1 ZINC000734483325 999295147 /nfs/dbraw/zinc/29/51/47/999295147.db2.gz YSZLMUOOXCPPMD-GJZGRUSLSA-N 1 1 361.446 2.791 20 5 FFBDMO COc1ccc([C@H]2[C@H](COC(=O)c3ccc([N+](=O)[O-])n3C)CC[N@H+]2C)cc1 ZINC000741120413 999709676 /nfs/dbraw/zinc/70/96/76/999709676.db2.gz GDBLFSODIDKNKH-KSSFIOAISA-N 1 1 373.409 2.792 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]CCc2ccc3ccccc3c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086084245 999754936 /nfs/dbraw/zinc/75/49/36/999754936.db2.gz JFABKQRCCBNMOA-XWPNQZOQSA-N 1 1 367.449 2.532 20 5 FFBDMO COCCCOC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000742153009 999761991 /nfs/dbraw/zinc/76/19/91/999761991.db2.gz QEPBQPOFCKRPKE-UHFFFAOYSA-N 1 1 374.441 2.933 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000742155138 999762333 /nfs/dbraw/zinc/76/23/33/999762333.db2.gz PNTNHTMIXHSZSG-BIENJYKASA-N 1 1 374.441 2.830 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC(OCC4CC4)CC3)n2)cc1 ZINC000743406269 999818331 /nfs/dbraw/zinc/81/83/31/999818331.db2.gz IHNLICXZBCABOW-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000745085791 999891356 /nfs/dbraw/zinc/89/13/56/999891356.db2.gz GBWWCHVSAOIRRZ-BBRMVZONSA-N 1 1 363.414 2.585 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169011908 1000015651 /nfs/dbraw/zinc/01/56/51/1000015651.db2.gz NHCSVVAZHMBHEO-HUUCEWRRSA-N 1 1 353.463 2.907 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169030282 1000016079 /nfs/dbraw/zinc/01/60/79/1000016079.db2.gz XWLBPDBIYOJUJE-YVWKXTFCSA-N 1 1 357.454 2.869 20 5 FFBDMO CCn1ncc2c1C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169021686 1000017588 /nfs/dbraw/zinc/01/75/88/1000017588.db2.gz PKYRZNXQZPFUHB-GVDBMIGSSA-N 1 1 362.474 2.674 20 5 FFBDMO CCn1ncc2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COCC1CC1 ZINC001169021686 1000017589 /nfs/dbraw/zinc/01/75/89/1000017589.db2.gz PKYRZNXQZPFUHB-GVDBMIGSSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019811 1000017693 /nfs/dbraw/zinc/01/76/93/1000017693.db2.gz JSYGEFBUXICUAU-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2CC1CC1 ZINC001169019811 1000017694 /nfs/dbraw/zinc/01/76/94/1000017694.db2.gz JSYGEFBUXICUAU-ULQDDVLXSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCC3(CCN(c4ncccn4)CC3)C2)C1 ZINC001169022266 1000017881 /nfs/dbraw/zinc/01/78/81/1000017881.db2.gz RLRKVYGVOWXDKG-DLBZAZTESA-N 1 1 359.474 2.604 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCC1(F)F ZINC001169046380 1000018390 /nfs/dbraw/zinc/01/83/90/1000018390.db2.gz LNWLJXXPSAKAPE-RWMBFGLXSA-N 1 1 363.405 2.666 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](Oc3cc(C(F)(F)F)ncn3)C2)C1 ZINC001169053586 1000018906 /nfs/dbraw/zinc/01/89/06/1000018906.db2.gz JCZJIHQAQVXYIL-FRRDWIJNSA-N 1 1 374.363 2.784 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001169240224 1000033802 /nfs/dbraw/zinc/03/38/02/1000033802.db2.gz RKDUWGKCUNAWTM-INIZCTEOSA-N 1 1 367.361 2.833 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ccncn1 ZINC001148172791 1001052356 /nfs/dbraw/zinc/05/23/56/1001052356.db2.gz POCFVWAEUYAJTQ-UHFFFAOYSA-N 1 1 359.389 2.733 20 5 FFBDMO CN(CC(=O)O[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000772661170 1001439744 /nfs/dbraw/zinc/43/97/44/1001439744.db2.gz TVIWPVZLARWRHU-QGZVFWFLSA-N 1 1 369.421 2.849 20 5 FFBDMO CC[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@H+]1CCc2ccccc2C1 ZINC000786761385 1001623621 /nfs/dbraw/zinc/62/36/21/1001623621.db2.gz PEZBIBJRCIHGMG-INIZCTEOSA-N 1 1 368.437 2.744 20 5 FFBDMO C/C(=C\C(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790121836 1002291126 /nfs/dbraw/zinc/29/11/26/1002291126.db2.gz MWIBPYJYKGTVQD-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO C/C(=C\C(=O)N(C)CC[N@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790121836 1002291137 /nfs/dbraw/zinc/29/11/37/1002291137.db2.gz MWIBPYJYKGTVQD-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccc2ccccc2c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001273507735 1003021691 /nfs/dbraw/zinc/02/16/91/1003021691.db2.gz LERDUTFEKYKAPF-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO CN(CCC[N@H+](C)Cc1ccc2ccccc2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273507735 1003021704 /nfs/dbraw/zinc/02/17/04/1003021704.db2.gz LERDUTFEKYKAPF-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccc2ccccc2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273507735 1003021716 /nfs/dbraw/zinc/02/17/16/1003021716.db2.gz LERDUTFEKYKAPF-RTBURBONSA-N 1 1 355.438 2.785 20 5 FFBDMO COC(=O)CC[C@H]1CC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352801 1003121392 /nfs/dbraw/zinc/12/13/92/1003121392.db2.gz QQPBAYFSRSSACT-KBPBESRZSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](Oc3nccc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001170356058 1003122707 /nfs/dbraw/zinc/12/27/07/1003122707.db2.gz VIMLCEKHFNDGGJ-RHSMWYFYSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](Oc3ncncc3C)C2)c([N+](=O)[O-])c1 ZINC001170355009 1003123174 /nfs/dbraw/zinc/12/31/74/1003123174.db2.gz UIAJYXLOWWALAS-YOEHRIQHSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC3CC2(C(=O)N2CCCC2)C3)c([N+](=O)[O-])c1 ZINC001170338475 1003128270 /nfs/dbraw/zinc/12/82/70/1003128270.db2.gz BIVTYXOTNTVSFF-ZUIJCZDSSA-N 1 1 373.453 2.621 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](NC(=O)C(C)C)C2)c([N+](=O)[O-])c1 ZINC001170351481 1003137429 /nfs/dbraw/zinc/13/74/29/1003137429.db2.gz CRLZADSEBUXOJH-GDBMZVCRSA-N 1 1 363.458 2.771 20 5 FFBDMO Cc1ccccc1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(F)c1 ZINC001001522944 1016828792 /nfs/dbraw/zinc/82/87/92/1016828792.db2.gz KSABPKVKALAVSE-IEBWSBKVSA-N 1 1 371.412 2.705 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1C ZINC001191896782 1003993548 /nfs/dbraw/zinc/99/35/48/1003993548.db2.gz SPBXFBYRGGMJNH-CVEARBPZSA-N 1 1 367.471 2.507 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCc2ccc3c(c2)OCO3)c1 ZINC001197836914 1004375841 /nfs/dbraw/zinc/37/58/41/1004375841.db2.gz HQDRIJHTFYIDGB-UHFFFAOYSA-N 1 1 372.377 2.785 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC001197863354 1004405258 /nfs/dbraw/zinc/40/52/58/1004405258.db2.gz FUZZAKYKXLJGLD-GHMZBOCLSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC001197863354 1004405266 /nfs/dbraw/zinc/40/52/66/1004405266.db2.gz FUZZAKYKXLJGLD-GHMZBOCLSA-N 1 1 371.231 2.988 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)c1 ZINC000104148041 1004436310 /nfs/dbraw/zinc/43/63/10/1004436310.db2.gz OGRLEBAXQVALJN-UHFFFAOYSA-N 1 1 356.426 2.867 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001198583693 1004683528 /nfs/dbraw/zinc/68/35/28/1004683528.db2.gz FJNOTRUTWZAGGD-JTQLQIEISA-N 1 1 358.345 2.802 20 5 FFBDMO CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001198862809 1004757900 /nfs/dbraw/zinc/75/79/00/1004757900.db2.gz LSNHTYNCAZNFSS-AWEZNQCLSA-N 1 1 367.450 2.550 20 5 FFBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC001198862809 1004757903 /nfs/dbraw/zinc/75/79/03/1004757903.db2.gz LSNHTYNCAZNFSS-AWEZNQCLSA-N 1 1 367.450 2.550 20 5 FFBDMO COC(=O)C[C@@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cccnc1 ZINC001198890373 1004774745 /nfs/dbraw/zinc/77/47/45/1004774745.db2.gz FBBDDKYKNSAVAB-GOSISDBHSA-N 1 1 359.382 2.567 20 5 FFBDMO C[C@H]1C[C@@H](O)C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001195195675 1004914527 /nfs/dbraw/zinc/91/45/27/1004914527.db2.gz FIFNVLIKORNLEL-GXSJLCMTSA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@H]1C[C@@H](O)C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001195195675 1004914531 /nfs/dbraw/zinc/91/45/31/1004914531.db2.gz FIFNVLIKORNLEL-GXSJLCMTSA-N 1 1 352.778 2.501 20 5 FFBDMO Cc1ccccc1C[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001050245080 1016930005 /nfs/dbraw/zinc/93/00/05/1016930005.db2.gz ZBYMHLUTSGRIIV-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1ccccc1C[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245080 1016930015 /nfs/dbraw/zinc/93/00/15/1016930015.db2.gz ZBYMHLUTSGRIIV-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO Cc1ccccc1C[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245080 1016930028 /nfs/dbraw/zinc/93/00/28/1016930028.db2.gz ZBYMHLUTSGRIIV-WOJBJXKFSA-N 1 1 367.449 2.908 20 5 FFBDMO CC1(C)OC[C@H]2C[C@]21C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035658 1005858077 /nfs/dbraw/zinc/85/80/77/1005858077.db2.gz UPYSCCWRUVLOGK-SIXWZSSISA-N 1 1 360.410 2.527 20 5 FFBDMO CC1(C)OC[C@H]2C[C@]21C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000851035658 1005858078 /nfs/dbraw/zinc/85/80/78/1005858078.db2.gz UPYSCCWRUVLOGK-SIXWZSSISA-N 1 1 360.410 2.527 20 5 FFBDMO COc1ccc(CC(=O)OC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000851467249 1005889609 /nfs/dbraw/zinc/88/96/09/1005889609.db2.gz SFLPNNNKULZKBK-QGZVFWFLSA-N 1 1 370.405 2.964 20 5 FFBDMO O=C1CN([C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000851936437 1005924514 /nfs/dbraw/zinc/92/45/14/1005924514.db2.gz MZXJOOXLIIXBQX-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO O=C1CN([C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)c2ccccc2N1 ZINC000851936437 1005924517 /nfs/dbraw/zinc/92/45/17/1005924517.db2.gz MZXJOOXLIIXBQX-HNNXBMFYSA-N 1 1 370.384 2.767 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+](C2CCC2)C1 ZINC000813630765 1006006102 /nfs/dbraw/zinc/00/61/02/1006006102.db2.gz QMLWQPYCKJGMQU-AWEZNQCLSA-N 1 1 372.469 2.798 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(NCc3cc(N(C)C)cc[nH+]3)c2c1 ZINC001187625453 1006177727 /nfs/dbraw/zinc/17/77/27/1006177727.db2.gz WSIHBWUPMFENBG-UHFFFAOYSA-N 1 1 353.382 2.647 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])ccc1OCCO ZINC000775190721 1006671522 /nfs/dbraw/zinc/67/15/22/1006671522.db2.gz BUNJVJCZKMUQGB-GFCCVEGCSA-N 1 1 364.373 2.964 20 5 FFBDMO COC(=O)c1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)n(C)c1C ZINC000883346442 1006764539 /nfs/dbraw/zinc/76/45/39/1006764539.db2.gz ZMNWXGHBSVVOMT-LLVKDONJSA-N 1 1 361.398 2.888 20 5 FFBDMO C/C(=C\C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000854571024 1006895937 /nfs/dbraw/zinc/89/59/37/1006895937.db2.gz SYAKQUHEVBLLGH-QJPKHSJYSA-N 1 1 373.453 2.710 20 5 FFBDMO CO[C@H]1CCC[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092418 1006898279 /nfs/dbraw/zinc/89/82/79/1006898279.db2.gz CMNAMOMJJJFGRZ-NJAFHUGGSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@H]1CCC[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092418 1006898293 /nfs/dbraw/zinc/89/82/93/1006898293.db2.gz CMNAMOMJJJFGRZ-NJAFHUGGSA-N 1 1 362.426 2.918 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000112694923 1006999722 /nfs/dbraw/zinc/99/97/22/1006999722.db2.gz LPFKFMHDHNVNAE-CQSZACIVSA-N 1 1 373.457 2.776 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000112694923 1006999739 /nfs/dbraw/zinc/99/97/39/1006999739.db2.gz LPFKFMHDHNVNAE-CQSZACIVSA-N 1 1 373.457 2.776 20 5 FFBDMO C[C@H]1[C@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000816468351 1007051340 /nfs/dbraw/zinc/05/13/40/1007051340.db2.gz FWSZBMFVKUVYBS-MAUKXSAKSA-N 1 1 372.425 2.778 20 5 FFBDMO CCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000855490285 1007366237 /nfs/dbraw/zinc/36/62/37/1007366237.db2.gz GAODDUFMUVFVID-LBPRGKRZSA-N 1 1 357.813 2.873 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000855735828 1007532654 /nfs/dbraw/zinc/53/26/54/1007532654.db2.gz WZIOHACPAMEBSE-QGZVFWFLSA-N 1 1 368.437 2.566 20 5 FFBDMO Cc1cc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)cn2cc[nH+]c12 ZINC000818045895 1007869458 /nfs/dbraw/zinc/86/94/58/1007869458.db2.gz UDMFVOKPDONYPU-UHFFFAOYSA-N 1 1 350.338 2.539 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856673834 1007942870 /nfs/dbraw/zinc/94/28/70/1007942870.db2.gz FDBZTELEWFVFQI-UGSOOPFHSA-N 1 1 360.414 2.671 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NCC[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001136160919 1007975685 /nfs/dbraw/zinc/97/56/85/1007975685.db2.gz WWKXZLMRQPFIIN-UHFFFAOYSA-N 1 1 374.828 2.619 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001136160919 1007975691 /nfs/dbraw/zinc/97/56/91/1007975691.db2.gz WWKXZLMRQPFIIN-UHFFFAOYSA-N 1 1 374.828 2.619 20 5 FFBDMO CCC1([NH+]2CCOCC2)CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC000858822512 1008430632 /nfs/dbraw/zinc/43/06/32/1008430632.db2.gz FJDMDDFHXONBCG-UHFFFAOYSA-N 1 1 361.442 2.879 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])ccc1F ZINC000821468978 1008467881 /nfs/dbraw/zinc/46/78/81/1008467881.db2.gz FXYOUAPOOSVUEW-UHFFFAOYSA-N 1 1 357.385 2.912 20 5 FFBDMO COc1ccc([C@H](O)C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC000886213478 1008603380 /nfs/dbraw/zinc/60/33/80/1008603380.db2.gz ULAVXZMFWZFJRL-SFHVURJKSA-N 1 1 357.410 2.944 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000137441399 1008610260 /nfs/dbraw/zinc/61/02/60/1008610260.db2.gz ACLZBQHOAQMMQK-XJKSGUPXSA-N 1 1 354.410 2.570 20 5 FFBDMO CC(C)(CCC(=O)NCC1([N@H+]2CCOC(C)(C)C2)CCCCC1)[N+](=O)[O-] ZINC000823204674 1008966512 /nfs/dbraw/zinc/96/65/12/1008966512.db2.gz KXQSIWKSDGWXCY-UHFFFAOYSA-N 1 1 369.506 2.752 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCCc1ccsc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464229 1008998605 /nfs/dbraw/zinc/99/86/05/1008998605.db2.gz REQTVVHAUWIVJG-HZPDHXFCSA-N 1 1 353.488 2.612 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1Cc2ccccc2OC2(CCC2)C1 ZINC000887149582 1009052139 /nfs/dbraw/zinc/05/21/39/1009052139.db2.gz BTKPWBLYOCBVRZ-UHFFFAOYSA-N 1 1 355.394 2.574 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@](C)(O)c1ccccc1 ZINC000823597839 1009134697 /nfs/dbraw/zinc/13/46/97/1009134697.db2.gz CHQCAGZYBANELQ-LJQANCHMSA-N 1 1 357.410 2.763 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780626 1009150046 /nfs/dbraw/zinc/15/00/46/1009150046.db2.gz MLKMWHZAOFGVNA-OSARJHGOSA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780626 1009150053 /nfs/dbraw/zinc/15/00/53/1009150053.db2.gz MLKMWHZAOFGVNA-OSARJHGOSA-N 1 1 362.426 2.772 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000126446325 1009229046 /nfs/dbraw/zinc/22/90/46/1009229046.db2.gz LKTWDQGBDIXHFH-QFBILLFUSA-N 1 1 372.469 2.796 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126445859 1009229086 /nfs/dbraw/zinc/22/90/86/1009229086.db2.gz LKTWDQGBDIXHFH-VQIMIIECSA-N 1 1 372.469 2.796 20 5 FFBDMO C[C@]1(NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000823921526 1009283003 /nfs/dbraw/zinc/28/30/03/1009283003.db2.gz WQDGNGLQPKZSML-IBGZPJMESA-N 1 1 369.425 2.963 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000824008729 1009291273 /nfs/dbraw/zinc/29/12/73/1009291273.db2.gz UNCBRFBYEQIUCQ-QGZVFWFLSA-N 1 1 355.398 2.698 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000824008729 1009291283 /nfs/dbraw/zinc/29/12/83/1009291283.db2.gz UNCBRFBYEQIUCQ-QGZVFWFLSA-N 1 1 355.398 2.698 20 5 FFBDMO Cn1cc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000129901269 1009304110 /nfs/dbraw/zinc/30/41/10/1009304110.db2.gz SWECGYWJTCMRBB-AWEZNQCLSA-N 1 1 356.426 2.996 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861743552 1009535340 /nfs/dbraw/zinc/53/53/40/1009535340.db2.gz OUUVVWZQUYTARH-UHFFFAOYSA-N 1 1 372.469 2.704 20 5 FFBDMO CN(CCCN(C)C(=O)c1cc([N+](=O)[O-])cc2ccccc21)CC[NH+](C)C ZINC000861743552 1009535350 /nfs/dbraw/zinc/53/53/50/1009535350.db2.gz OUUVVWZQUYTARH-UHFFFAOYSA-N 1 1 372.469 2.704 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889158580 1009843317 /nfs/dbraw/zinc/84/33/17/1009843317.db2.gz OTZNPRPDFSQIRI-BLLLJJGKSA-N 1 1 356.426 2.742 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CCCC[N@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000862792771 1009977690 /nfs/dbraw/zinc/97/76/90/1009977690.db2.gz ZHDHGXIAEGMEQR-CYBMUJFWSA-N 1 1 364.402 2.582 20 5 FFBDMO COCCC1CC[NH+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000863269314 1010149914 /nfs/dbraw/zinc/14/99/14/1010149914.db2.gz BEQRGGQNPVRVLX-SFHVURJKSA-N 1 1 361.442 2.617 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H](C[C@@H]4CCOC4)C3)n2)c1 ZINC000773255391 1010898363 /nfs/dbraw/zinc/89/83/63/1010898363.db2.gz AINXNQCOBYUTHX-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@H](O)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000866639859 1011028801 /nfs/dbraw/zinc/02/88/01/1011028801.db2.gz XWCVKPILKYKLAX-ROUUACIJSA-N 1 1 358.442 2.949 20 5 FFBDMO CN1C[C@]2(CC1=O)CCCC[N@H+]2[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908881 1012080569 /nfs/dbraw/zinc/08/05/69/1012080569.db2.gz OUPLGBACSOHGRD-FXAWDEMLSA-N 1 1 357.454 2.929 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](Oc3ncccn3)C1)CC2 ZINC001172914092 1012095987 /nfs/dbraw/zinc/09/59/87/1012095987.db2.gz ZBJPWDCENSRFSD-AEFFLSMTSA-N 1 1 354.410 2.786 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1)C1CC1 ZINC001172913966 1012097106 /nfs/dbraw/zinc/09/71/06/1012097106.db2.gz WNCDQNDWZDSJMW-MSOLQXFVSA-N 1 1 357.454 2.833 20 5 FFBDMO C[C@@H](C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000870087701 1012116492 /nfs/dbraw/zinc/11/64/92/1012116492.db2.gz UALLBCNGCRRYKR-KZULUSFZSA-N 1 1 373.384 2.716 20 5 FFBDMO CCOC(=O)[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCS1 ZINC001172911619 1012123596 /nfs/dbraw/zinc/12/35/96/1012123596.db2.gz DBFRKMKXRPOFFE-DOTOQJQBSA-N 1 1 364.467 2.823 20 5 FFBDMO C[C@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1O ZINC001173010580 1012178705 /nfs/dbraw/zinc/17/87/05/1012178705.db2.gz VLHVJDAPEPGJQD-SJCJKPOMSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@H]1C[C@@H](CO)[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010141 1012178770 /nfs/dbraw/zinc/17/87/70/1012178770.db2.gz NAJXRGPYNJXNQJ-FZMZJTMJSA-N 1 1 355.385 2.545 20 5 FFBDMO C[C@@H]1CC[C@H](O)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009343 1012178847 /nfs/dbraw/zinc/17/88/47/1012178847.db2.gz BHMYZMMKPVGYHF-RISCZKNCSA-N 1 1 355.385 2.687 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC(C[NH+](C)C)CC2)c1F ZINC001173189649 1012331607 /nfs/dbraw/zinc/33/16/07/1012331607.db2.gz LLPCHNBNMDIWJU-CYBMUJFWSA-N 1 1 353.438 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@H]([N@@H+](C)C3CC3)C2)c1F ZINC001173192114 1012335097 /nfs/dbraw/zinc/33/50/97/1012335097.db2.gz IGMNMOLOKYITOV-JSGCOSHPSA-N 1 1 351.422 2.842 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192837 1012336228 /nfs/dbraw/zinc/33/62/28/1012336228.db2.gz KXQKNWDLSMGYKP-APPDUMDISA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195698 1012337010 /nfs/dbraw/zinc/33/70/10/1012337010.db2.gz ISOYDZHYXDKQKR-XIKOKIGWSA-N 1 1 368.405 2.949 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@]3(CCC(=O)O3)C2)c1F ZINC001173194134 1012337975 /nfs/dbraw/zinc/33/79/75/1012337975.db2.gz XSYAXCPQRMLIOF-SGTLLEGYSA-N 1 1 366.389 2.845 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC001173223111 1012354880 /nfs/dbraw/zinc/35/48/80/1012354880.db2.gz XXUNDXQHMGYGSY-VDNDLQMASA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1 ZINC001173228530 1012363751 /nfs/dbraw/zinc/36/37/51/1012363751.db2.gz YVFYSBMWCUNEOL-YTQUADARSA-N 1 1 366.465 2.985 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(Cc2cccc(N)c2)CC1 ZINC001173237743 1012384540 /nfs/dbraw/zinc/38/45/40/1012384540.db2.gz LTGILNZIDUHLGS-MRXNPFEDSA-N 1 1 354.454 2.926 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)OC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC000870734082 1012542328 /nfs/dbraw/zinc/54/23/28/1012542328.db2.gz YRHDYMNNNRWRIE-INIZCTEOSA-N 1 1 364.446 2.830 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCC(N3CC[NH+](C)CC3)CC2)cc1[N+](=O)[O-] ZINC000827439577 1018033090 /nfs/dbraw/zinc/03/30/90/1018033090.db2.gz GDSGYTXOACGXOC-UHFFFAOYSA-N 1 1 374.485 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@](CO)(c4ccccc4)C3)nc2c1 ZINC000801579823 1019138107 /nfs/dbraw/zinc/13/81/07/1019138107.db2.gz YHWGQWPUTOICLT-HXUWFJFHSA-N 1 1 366.421 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@](CO)(c4ccccc4)C3)nc2c1 ZINC000801579823 1019138117 /nfs/dbraw/zinc/13/81/17/1019138117.db2.gz YHWGQWPUTOICLT-HXUWFJFHSA-N 1 1 366.421 2.997 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000932195679 1020739741 /nfs/dbraw/zinc/73/97/41/1020739741.db2.gz HLQXLQAAUWOOSP-CQSZACIVSA-N 1 1 374.466 2.969 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](Cc2nccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000932195679 1020739748 /nfs/dbraw/zinc/73/97/48/1020739748.db2.gz HLQXLQAAUWOOSP-CQSZACIVSA-N 1 1 374.466 2.969 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCn3nc(C4CC4)cc3C2)cccc1[N+](=O)[O-] ZINC000932604612 1020845622 /nfs/dbraw/zinc/84/56/22/1020845622.db2.gz DDGMEGMUPZHGKO-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCn3nc(C4CC4)cc3C2)cccc1[N+](=O)[O-] ZINC000932604612 1020845627 /nfs/dbraw/zinc/84/56/27/1020845627.db2.gz DDGMEGMUPZHGKO-UHFFFAOYSA-N 1 1 369.425 2.822 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)[C@H]([C@@H]2CCCO2)C1 ZINC000933183022 1020974192 /nfs/dbraw/zinc/97/41/92/1020974192.db2.gz ZVKNIKACKZMOPW-JLSDUUJJSA-N 1 1 362.426 2.836 20 5 FFBDMO Cc1nn(CN2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000749958101 1021166391 /nfs/dbraw/zinc/16/63/91/1021166391.db2.gz GTGPTGNVTWGPAE-CABCVRRESA-N 1 1 358.446 2.553 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336375 1021199706 /nfs/dbraw/zinc/19/97/06/1021199706.db2.gz PJTQDZZEOQDPLF-BBRMVZONSA-N 1 1 372.450 2.721 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](Cc3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000934336375 1021199712 /nfs/dbraw/zinc/19/97/12/1021199712.db2.gz PJTQDZZEOQDPLF-BBRMVZONSA-N 1 1 372.450 2.721 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Cc2nccs2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934337012 1021201199 /nfs/dbraw/zinc/20/11/99/1021201199.db2.gz VJOWTMJKRFYYDL-ZDUSSCGKSA-N 1 1 372.450 2.505 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Cc2nccs2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000934337012 1021201207 /nfs/dbraw/zinc/20/12/07/1021201207.db2.gz VJOWTMJKRFYYDL-ZDUSSCGKSA-N 1 1 372.450 2.505 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]12CC[C@@H]1CC[N@@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660779 1021328613 /nfs/dbraw/zinc/32/86/13/1021328613.db2.gz ZTQSGDQRSNJCGQ-KDOFPFPSSA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]12CC[C@@H]1CC[N@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660779 1021328632 /nfs/dbraw/zinc/32/86/32/1021328632.db2.gz ZTQSGDQRSNJCGQ-KDOFPFPSSA-N 1 1 362.430 2.869 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)c1 ZINC000156033242 1022316657 /nfs/dbraw/zinc/31/66/57/1022316657.db2.gz LVMMOPYPBKELBB-PMACEKPBSA-N 1 1 356.422 2.901 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC([N@@H+](CC2CC2)CC2CCCCC2)CC1 ZINC001039485719 1022760567 /nfs/dbraw/zinc/76/05/67/1022760567.db2.gz MIIUTFSSBPONAH-RTBURBONSA-N 1 1 363.502 2.935 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@H+](CC2CC2)CC2CCCCC2)CC1 ZINC001039485719 1022760572 /nfs/dbraw/zinc/76/05/72/1022760572.db2.gz MIIUTFSSBPONAH-RTBURBONSA-N 1 1 363.502 2.935 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@@H+](CC2CC2)CC2CCCCC2)CC1 ZINC001039485719 1022760590 /nfs/dbraw/zinc/76/05/90/1022760590.db2.gz MIIUTFSSBPONAH-RTBURBONSA-N 1 1 363.502 2.935 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CC1CCCCCC1)CC2 ZINC001040701144 1022954881 /nfs/dbraw/zinc/95/48/81/1022954881.db2.gz UYXFOCITRJTCNX-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1Cc1ccccc1 ZINC000188328664 1023056537 /nfs/dbraw/zinc/05/65/37/1023056537.db2.gz AJKOXLSZBHKRKE-DZGCQCFKSA-N 1 1 354.410 2.570 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000754360884 1023459849 /nfs/dbraw/zinc/45/98/49/1023459849.db2.gz OMGZBCHTFGOQGY-ILDQDYJLSA-N 1 1 373.453 2.758 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]CCCCc1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001121087850 1023598992 /nfs/dbraw/zinc/59/89/92/1023598992.db2.gz XDWHFCFUJCCZBA-JGQKGBITSA-N 1 1 371.481 2.692 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)OC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000755676490 1023622338 /nfs/dbraw/zinc/62/23/38/1023622338.db2.gz AIBWXOLTQIDJCN-SPQRHKFCSA-N 1 1 362.426 2.898 20 5 FFBDMO C[C@@H](c1nnc(N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1C)[N+](=O)[O-] ZINC001121296101 1023692727 /nfs/dbraw/zinc/69/27/27/1023692727.db2.gz DZBGQDPMLZFLOY-HLLBOEOZSA-N 1 1 372.473 2.642 20 5 FFBDMO COc1ccc(OC)c([C@@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000757168082 1023807987 /nfs/dbraw/zinc/80/79/87/1023807987.db2.gz SKBREIWOPVMFKH-SFHVURJKSA-N 1 1 358.394 2.704 20 5 FFBDMO COc1ccc(OC)c([C@@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000757168082 1023807993 /nfs/dbraw/zinc/80/79/93/1023807993.db2.gz SKBREIWOPVMFKH-SFHVURJKSA-N 1 1 358.394 2.704 20 5 FFBDMO CCC[C@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000757610435 1023836824 /nfs/dbraw/zinc/83/68/24/1023836824.db2.gz MWSUHVDWGANHBP-LIRRHRJNSA-N 1 1 374.441 2.831 20 5 FFBDMO CCn1c([C@@H]2CCC[N@@H+]2C)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001121801699 1024040233 /nfs/dbraw/zinc/04/02/33/1024040233.db2.gz UZGUYUUENGHKTD-INIZCTEOSA-N 1 1 358.446 2.652 20 5 FFBDMO CCn1c([C@@H]2CCC[N@H+]2C)nnc1N(C)CCc1ccccc1[N+](=O)[O-] ZINC001121801699 1024040242 /nfs/dbraw/zinc/04/02/42/1024040242.db2.gz UZGUYUUENGHKTD-INIZCTEOSA-N 1 1 358.446 2.652 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000247010277 1026618895 /nfs/dbraw/zinc/61/88/95/1026618895.db2.gz LDOUXNSCMXYNRX-IEBWSBKVSA-N 1 1 355.442 2.735 20 5 FFBDMO O=C1C[C@@]2(CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643900 1026771858 /nfs/dbraw/zinc/77/18/58/1026771858.db2.gz MSYWOPXGQJDMFW-UYAOXDASSA-N 1 1 368.389 2.738 20 5 FFBDMO O=C1C[C@@]2(CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)Oc2ccccc21 ZINC000839643900 1026771864 /nfs/dbraw/zinc/77/18/64/1026771864.db2.gz MSYWOPXGQJDMFW-UYAOXDASSA-N 1 1 368.389 2.738 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)c2cc([N+](=O)[O-])ccc12 ZINC000840108119 1026959670 /nfs/dbraw/zinc/95/96/70/1026959670.db2.gz IEYZQDNTMNCIRI-CQSZACIVSA-N 1 1 373.457 2.824 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)nc1-c1ccncc1 ZINC000840113700 1026962139 /nfs/dbraw/zinc/96/21/39/1026962139.db2.gz CBQUNPLTBXKMRI-LZLYRXPVSA-N 1 1 371.441 2.826 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[N@@H+](CC)CC1(C)C ZINC001158561140 1027060543 /nfs/dbraw/zinc/06/05/43/1027060543.db2.gz KHKDZPPXWUQNBW-UHFFFAOYSA-N 1 1 370.837 2.740 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC2CCN(C(=O)C3CCC3)CC2)ncc1[N+](=O)[O-] ZINC001161116068 1028021048 /nfs/dbraw/zinc/02/10/48/1028021048.db2.gz WWDXKFYNQQVVNB-RMKNXTFCSA-N 1 1 373.457 2.725 20 5 FFBDMO COc1cccc(C[N@H+]2CC[C@H](Nc3ncc(OC)cc3[N+](=O)[O-])C2)c1 ZINC001161187332 1028058969 /nfs/dbraw/zinc/05/89/69/1028058969.db2.gz DSPRJSXGPBTELJ-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO CN(C(=O)[C@@H](N)Cc1c2ccccc2cc2ccccc21)[C@@H]1[C@H]2C[NH2+]C[C@H]21 ZINC001161220424 1028073699 /nfs/dbraw/zinc/07/36/99/1028073699.db2.gz BYRRGYNBNLTSGA-LNRXMEIDSA-N 1 1 359.473 2.539 20 5 FFBDMO Cc1cccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c1 ZINC000957547681 1028324392 /nfs/dbraw/zinc/32/43/92/1028324392.db2.gz LTJOKGACJUAUOT-RTBURBONSA-N 1 1 371.481 2.865 20 5 FFBDMO COc1ccc(CCNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cc1O ZINC001163732328 1029045178 /nfs/dbraw/zinc/04/51/78/1029045178.db2.gz URNVSBMXYXDEKR-UHFFFAOYSA-N 1 1 357.410 2.952 20 5 FFBDMO COc1ccc(CCNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cc1O ZINC001163732328 1029045190 /nfs/dbraw/zinc/04/51/90/1029045190.db2.gz URNVSBMXYXDEKR-UHFFFAOYSA-N 1 1 357.410 2.952 20 5 FFBDMO CC(C)Oc1nc(N2CCC[N@@H+](Cc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC001163828861 1029080439 /nfs/dbraw/zinc/08/04/39/1029080439.db2.gz RMBDGOWEHVHMKV-UHFFFAOYSA-N 1 1 371.441 2.884 20 5 FFBDMO COc1nc(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)ncc1[N+](=O)[O-] ZINC001156314330 1029139446 /nfs/dbraw/zinc/13/94/46/1029139446.db2.gz FWWKPOVBHCCGQM-OWCLPIDISA-N 1 1 369.425 2.716 20 5 FFBDMO [NH3+][C@@H]1CN(c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)nn2)CCC1(F)F ZINC001164326966 1029245313 /nfs/dbraw/zinc/24/53/13/1029245313.db2.gz KUFLAZSECQQSQX-CYBMUJFWSA-N 1 1 369.759 2.878 20 5 FFBDMO O=C(NCCC1(C[NH2+]CC/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494882 1029299002 /nfs/dbraw/zinc/29/90/02/1029299002.db2.gz XDSAOYOCYDHSLZ-PLDKWVJVSA-N 1 1 357.454 2.631 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2cc(Br)no2)ncc1[N+](=O)[O-] ZINC001156687461 1029307323 /nfs/dbraw/zinc/30/73/23/1029307323.db2.gz ZDIOPAVQYJOTIV-ONEGZZNKSA-N 1 1 368.191 2.885 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1 ZINC001165106824 1029391884 /nfs/dbraw/zinc/39/18/84/1029391884.db2.gz BBQFYKLEJMOJPD-INIZCTEOSA-N 1 1 371.441 2.618 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC([N@@H+](C)Cc2ccc(F)cc2)CC1 ZINC001157074497 1029458480 /nfs/dbraw/zinc/45/84/80/1029458480.db2.gz HMSZCKMQBGFERZ-UHFFFAOYSA-N 1 1 374.416 2.777 20 5 FFBDMO COC(=O)Cc1ccc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)cc1 ZINC001157769166 1029659139 /nfs/dbraw/zinc/65/91/39/1029659139.db2.gz CBBKXPXORYSXTO-CMDGGOBGSA-N 1 1 370.409 2.850 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782526169 1029732619 /nfs/dbraw/zinc/73/26/19/1029732619.db2.gz HQSNWAAABQPTGK-ZIAGYGMSSA-N 1 1 365.405 2.811 20 5 FFBDMO CC(C)[N@@H+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C[C@H]1C ZINC001165199770 1029886995 /nfs/dbraw/zinc/88/69/95/1029886995.db2.gz LJEDBBPWAIMQEZ-MRVPVSSYSA-N 1 1 367.759 2.976 20 5 FFBDMO CC(C)[N@H+]1CCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C[C@H]1C ZINC001165199770 1029887002 /nfs/dbraw/zinc/88/70/02/1029887002.db2.gz LJEDBBPWAIMQEZ-MRVPVSSYSA-N 1 1 367.759 2.976 20 5 FFBDMO O=C1CN(C[N@H+]2CCCC3(CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000783544265 1030145965 /nfs/dbraw/zinc/14/59/65/1030145965.db2.gz TYCVXQSFDPNDAK-UHFFFAOYSA-N 1 1 372.425 2.977 20 5 FFBDMO O=C1C[C@H]2C[C@H](OCc3ccc([N+](=O)[O-])nc3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001224113826 1033720737 /nfs/dbraw/zinc/72/07/37/1033720737.db2.gz KUZSGNDTECUANJ-UHOSZYNNSA-N 1 1 367.405 2.881 20 5 FFBDMO CC[N@@H+]1CC[C@H](Oc2c(Br)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226268354 1034603500 /nfs/dbraw/zinc/60/35/00/1034603500.db2.gz QSJLYKNKOSBWGE-JTQLQIEISA-N 1 1 373.203 2.617 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2c(Br)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226268354 1034603508 /nfs/dbraw/zinc/60/35/08/1034603508.db2.gz QSJLYKNKOSBWGE-JTQLQIEISA-N 1 1 373.203 2.617 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1OC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226751634 1034820560 /nfs/dbraw/zinc/82/05/60/1034820560.db2.gz NTNPEWJCIOJEIA-MRXNPFEDSA-N 1 1 361.373 2.799 20 5 FFBDMO O=[N+]([O-])c1cc(F)cnc1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226751633 1034820636 /nfs/dbraw/zinc/82/06/36/1034820636.db2.gz NTNPEWJCIOJEIA-INIZCTEOSA-N 1 1 361.373 2.799 20 5 FFBDMO C[C@H](c1ccccn1)[N@@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111664 1034939305 /nfs/dbraw/zinc/93/93/05/1034939305.db2.gz PUWPBLMGGHSKQI-TZMCWYRMSA-N 1 1 373.369 2.897 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111664 1034939312 /nfs/dbraw/zinc/93/93/12/1034939312.db2.gz PUWPBLMGGHSKQI-TZMCWYRMSA-N 1 1 373.369 2.897 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc(F)c([N+](=O)[O-])cc1NC(C)=O ZINC000832865395 1035004112 /nfs/dbraw/zinc/00/41/12/1035004112.db2.gz BUCMJEWTTFHHLL-LLVKDONJSA-N 1 1 368.409 2.543 20 5 FFBDMO C[N@H+](Cc1ccc2ccc3cccnc3c2n1)C1CCS(=O)(=O)CC1 ZINC001232221973 1035503682 /nfs/dbraw/zinc/50/36/82/1035503682.db2.gz HHSRKJBBJSVTHZ-UHFFFAOYSA-N 1 1 355.463 2.792 20 5 FFBDMO C[N@@H+](Cc1ccc2ccc3cccnc3c2n1)C1CCS(=O)(=O)CC1 ZINC001232221973 1035503688 /nfs/dbraw/zinc/50/36/88/1035503688.db2.gz HHSRKJBBJSVTHZ-UHFFFAOYSA-N 1 1 355.463 2.792 20 5 FFBDMO COc1cc(O[C@@H]2CCC[N@@H+](C)C2)c2c(c1)oc1c(O)ccc(O)c1c2=O ZINC001227645976 1035653003 /nfs/dbraw/zinc/65/30/03/1035653003.db2.gz LTBPZXUKOKBYMT-LLVKDONJSA-N 1 1 371.389 2.839 20 5 FFBDMO Cc1ccc(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000835458118 1035777109 /nfs/dbraw/zinc/77/71/09/1035777109.db2.gz OTYHNGNTFBEYGI-SFHVURJKSA-N 1 1 355.394 2.658 20 5 FFBDMO Cc1ccc(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000835458118 1035777118 /nfs/dbraw/zinc/77/71/18/1035777118.db2.gz OTYHNGNTFBEYGI-SFHVURJKSA-N 1 1 355.394 2.658 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685332 1036254843 /nfs/dbraw/zinc/25/48/43/1036254843.db2.gz GDLIYDQQSTUJQT-WMLDXEAASA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685332 1036254861 /nfs/dbraw/zinc/25/48/61/1036254861.db2.gz GDLIYDQQSTUJQT-WMLDXEAASA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380308 1036642441 /nfs/dbraw/zinc/64/24/41/1036642441.db2.gz KQMBGZJPRQSHCW-WFASDCNBSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380308 1036642447 /nfs/dbraw/zinc/64/24/47/1036642447.db2.gz KQMBGZJPRQSHCW-WFASDCNBSA-N 1 1 358.398 2.688 20 5 FFBDMO COC(=O)c1cnc(O[C@H]2CCCN(c3ccc(C)c[nH+]3)C2)c([N+](=O)[O-])c1 ZINC001233867090 1036795775 /nfs/dbraw/zinc/79/57/75/1036795775.db2.gz SGZNLUGHBNIYOD-AWEZNQCLSA-N 1 1 372.381 2.528 20 5 FFBDMO CO[C@@H]1CC[N@H+](CCOc2ccc3c(c2)oc(=O)c2cc(O)ccc32)C1 ZINC001229798134 1036904959 /nfs/dbraw/zinc/90/49/59/1036904959.db2.gz RYLXXQAMLNZCBH-OAHLLOKOSA-N 1 1 355.390 2.751 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2ccc3c(c2)oc(=O)c2cc(O)ccc32)C1 ZINC001229798134 1036904961 /nfs/dbraw/zinc/90/49/61/1036904961.db2.gz RYLXXQAMLNZCBH-OAHLLOKOSA-N 1 1 355.390 2.751 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1 ZINC001536807686 1070061656 /nfs/dbraw/zinc/06/16/56/1070061656.db2.gz ILBHDMZSTTWZCG-UHFFFAOYSA-N 1 1 357.395 2.886 20 5 FFBDMO C[NH+]1CCN(c2ncc(-c3ncnc4cc5ccccc5cc43)cn2)CC1 ZINC001235916403 1037829881 /nfs/dbraw/zinc/82/98/81/1037829881.db2.gz IPHQBEAIVBKNDC-UHFFFAOYSA-N 1 1 356.433 2.992 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@]4(CCO4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100363 1038384067 /nfs/dbraw/zinc/38/40/67/1038384067.db2.gz GVYGUKNARHELOI-IBGZPJMESA-N 1 1 361.442 2.827 20 5 FFBDMO Cc1cc(N2CCOCC2)cc2[nH+]c(-c3cccc([N+](=O)[O-])c3N)[nH]c21 ZINC001250952348 1038848326 /nfs/dbraw/zinc/84/83/26/1038848326.db2.gz GBFFVHACKRBTEO-UHFFFAOYSA-N 1 1 353.382 2.865 20 5 FFBDMO Cn1cnc(C[C@H]([NH3+])c2nc(-c3ccc4ccc5cccnc5c4n3)no2)c1 ZINC001247291606 1039692292 /nfs/dbraw/zinc/69/22/92/1039692292.db2.gz LNBNPEDXZWMEHB-HNNXBMFYSA-N 1 1 371.404 2.809 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC001213137861 1040272520 /nfs/dbraw/zinc/27/25/20/1040272520.db2.gz JLQYMONWQMJMSZ-INIZCTEOSA-N 1 1 367.471 2.589 20 5 FFBDMO C[C@H](Cc1ccccc1)[N@@H+](C)Cc1cn(-c2ccc(O)cc2[N+](=O)[O-])nn1 ZINC001254167027 1040593716 /nfs/dbraw/zinc/59/37/16/1040593716.db2.gz AUQNEEAULOAXTL-CQSZACIVSA-N 1 1 367.409 2.944 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@](CO)(C(F)(F)F)C3)CC2)cc1 ZINC001254475082 1040742271 /nfs/dbraw/zinc/74/22/71/1040742271.db2.gz ZYFYDPZZQGBOCM-INIZCTEOSA-N 1 1 373.375 2.810 20 5 FFBDMO COC(=O)[C@H]1CC[C@@H](C)[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479711 1040746045 /nfs/dbraw/zinc/74/60/45/1040746045.db2.gz IPFRDRVPMWQSFN-CABCVRRESA-N 1 1 361.442 2.837 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2CN1c1ccsc1 ZINC001254593856 1040821649 /nfs/dbraw/zinc/82/16/49/1040821649.db2.gz COWWVZSBKUZGBG-WBAXXEDZSA-N 1 1 369.446 2.718 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CC3(C1)CCN(Cc1cccnc1)C3)C2 ZINC001254593918 1040822727 /nfs/dbraw/zinc/82/27/27/1040822727.db2.gz BTHJVZLWVHWAJN-HXUWFJFHSA-N 1 1 364.449 2.665 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCc3ncnc(C4CC4)c3CC1)C2 ZINC001254596864 1040827095 /nfs/dbraw/zinc/82/70/95/1040827095.db2.gz SFHWGBMRXCSQRN-KRWDZBQOSA-N 1 1 350.422 2.830 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cn(CC)nc21 ZINC001254597137 1040827257 /nfs/dbraw/zinc/82/72/57/1040827257.db2.gz UTUUDVGPXOABHV-HKUYNNGSSA-N 1 1 370.453 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCOCCO)C2CCC2)c(Br)c1 ZINC001261640812 1041346084 /nfs/dbraw/zinc/34/60/84/1041346084.db2.gz ONXATFPLRGAOFY-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](CCOCCO)C2CCC2)c(Br)c1 ZINC001261640812 1041346093 /nfs/dbraw/zinc/34/60/93/1041346093.db2.gz ONXATFPLRGAOFY-UHFFFAOYSA-N 1 1 373.247 2.721 20 5 FFBDMO CCC(C)(C)[NH+]1CCN(S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC001309634871 1043463415 /nfs/dbraw/zinc/46/34/15/1043463415.db2.gz XXERFCFRVYEBHX-UHFFFAOYSA-N 1 1 369.487 2.707 20 5 FFBDMO Cc1ccc(NC(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cc1[N+](=O)[O-] ZINC001310095967 1043635095 /nfs/dbraw/zinc/63/50/95/1043635095.db2.gz CVOXGVHXVHWZLH-HIFRSBDPSA-N 1 1 350.444 2.605 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)c1ccn(-c2cc[nH+]cc2)n1 ZINC001280077730 1044175937 /nfs/dbraw/zinc/17/59/37/1044175937.db2.gz RDZHVZQFGUHDJA-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890847 1044925720 /nfs/dbraw/zinc/92/57/20/1044925720.db2.gz RVWYOFUEBNJFLN-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890847 1044925735 /nfs/dbraw/zinc/92/57/35/1044925735.db2.gz RVWYOFUEBNJFLN-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)CCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001281789638 1045134457 /nfs/dbraw/zinc/13/44/57/1045134457.db2.gz HBQDMCNXFVSAPZ-IAGOWNOFSA-N 1 1 351.491 2.792 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001321114600 1045551465 /nfs/dbraw/zinc/55/14/65/1045551465.db2.gz YFGYKTMTBQFIQY-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001321114600 1045551478 /nfs/dbraw/zinc/55/14/78/1045551478.db2.gz YFGYKTMTBQFIQY-AEFFLSMTSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)cc1 ZINC001323595401 1045653418 /nfs/dbraw/zinc/65/34/18/1045653418.db2.gz LYJHFPAVHSTTMT-UHFFFAOYSA-N 1 1 369.421 2.957 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)cc1 ZINC001323595401 1045653421 /nfs/dbraw/zinc/65/34/21/1045653421.db2.gz LYJHFPAVHSTTMT-UHFFFAOYSA-N 1 1 369.421 2.957 20 5 FFBDMO COc1ccc(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)cn1 ZINC001331314131 1047857920 /nfs/dbraw/zinc/85/79/20/1047857920.db2.gz GEPTVPHLKNDTAN-GOSISDBHSA-N 1 1 367.409 2.654 20 5 FFBDMO Cc1noc(C[NH+]2CCC([C@@H]3C(=O)Nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC001327544777 1047941536 /nfs/dbraw/zinc/94/15/36/1047941536.db2.gz BEKXVUKMGCHHPI-INIZCTEOSA-N 1 1 356.382 2.839 20 5 FFBDMO O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001331555092 1048001368 /nfs/dbraw/zinc/00/13/68/1048001368.db2.gz VCNXBYBXKDPAMC-LLVKDONJSA-N 1 1 368.231 2.668 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])[C@H](C)C1 ZINC001333706603 1049067739 /nfs/dbraw/zinc/06/77/39/1049067739.db2.gz KAQGKDNDLBUIAW-HIFRSBDPSA-N 1 1 358.442 2.613 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H]1c1ccc(F)cc1 ZINC001333709473 1049069617 /nfs/dbraw/zinc/06/96/17/1049069617.db2.gz MLIOSXFIIGTDBY-WBVHZDCISA-N 1 1 358.373 2.690 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC001297010021 1050112235 /nfs/dbraw/zinc/11/22/35/1050112235.db2.gz ZGRPZKYXJYAJFG-INIZCTEOSA-N 1 1 372.400 2.665 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1 ZINC001307234540 1050255125 /nfs/dbraw/zinc/25/51/25/1050255125.db2.gz NXEUBJRGVPGZOB-KDURUIRLSA-N 1 1 359.426 2.694 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC001340122177 1050526172 /nfs/dbraw/zinc/52/61/72/1050526172.db2.gz BUULGHBMAQLQTJ-CYBMUJFWSA-N 1 1 373.461 2.553 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@H](C)[N+](=O)[O-])n2Cc2ccccc2)C[C@H]1C ZINC001342144906 1050739391 /nfs/dbraw/zinc/73/93/91/1050739391.db2.gz OVQZCUWABBTDJB-PMPSAXMXSA-N 1 1 372.473 2.583 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001301878152 1051009060 /nfs/dbraw/zinc/00/90/60/1051009060.db2.gz BMAFVEBQPORVRG-WMLDXEAASA-N 1 1 368.437 2.817 20 5 FFBDMO C[NH+](C)Cc1ccc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)o1 ZINC001303181092 1051297506 /nfs/dbraw/zinc/29/75/06/1051297506.db2.gz VPNMOOXIQMPVMT-UHFFFAOYSA-N 1 1 355.354 2.892 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC001303540295 1051379484 /nfs/dbraw/zinc/37/94/84/1051379484.db2.gz OQYBTJCQUBSPOW-LBPRGKRZSA-N 1 1 365.405 2.831 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@H]1C[N@@H+](Cc2ccccc2)CC12CCC2 ZINC001303575513 1051392786 /nfs/dbraw/zinc/39/27/86/1051392786.db2.gz ZOZQWTIKWJCQDU-CQSZACIVSA-N 1 1 355.398 2.559 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)c1 ZINC001344928320 1052139013 /nfs/dbraw/zinc/13/90/13/1052139013.db2.gz CZFKRLQMCNMYDI-ZDUSSCGKSA-N 1 1 366.439 2.727 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3COC4(CCCCC4)O3)C2)nc1 ZINC001307544198 1052319546 /nfs/dbraw/zinc/31/95/46/1052319546.db2.gz DPRQZOCNYYDXKJ-GDBMZVCRSA-N 1 1 362.430 2.552 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001307986407 1052376445 /nfs/dbraw/zinc/37/64/45/1052376445.db2.gz GGPADQXMNNINOX-UONOGXRCSA-N 1 1 365.430 2.961 20 5 FFBDMO C[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CCN1c1cc[nH+]cc1 ZINC001308039588 1052389648 /nfs/dbraw/zinc/38/96/48/1052389648.db2.gz GYAIJBWHDJGRQC-MRXNPFEDSA-N 1 1 356.426 2.969 20 5 FFBDMO Cc1c(NC(=O)CC[NH2+][C@@H](c2ncccn2)C2CC2)cccc1[N+](=O)[O-] ZINC001308093298 1052405121 /nfs/dbraw/zinc/40/51/21/1052405121.db2.gz RLRYSTDACJBQFN-QGZVFWFLSA-N 1 1 355.398 2.763 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO ZINC001346068356 1052731389 /nfs/dbraw/zinc/73/13/89/1052731389.db2.gz MPDVNYXPZIHNJX-CHWSQXEVSA-N 1 1 359.348 2.649 20 5 FFBDMO COc1ccc([C@H](C[NH+](C)C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335414554 1053347623 /nfs/dbraw/zinc/34/76/23/1053347623.db2.gz YUXPQRAPGUFFDG-OALUTQOASA-N 1 1 359.426 2.529 20 5 FFBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC001347239007 1053748141 /nfs/dbraw/zinc/74/81/41/1053748141.db2.gz TWKOMCRUXTUNNF-GUYCJALGSA-N 1 1 351.378 2.561 20 5 FFBDMO O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@@H](CCF)C1 ZINC001347239007 1053748147 /nfs/dbraw/zinc/74/81/47/1053748147.db2.gz TWKOMCRUXTUNNF-GUYCJALGSA-N 1 1 351.378 2.561 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001336293171 1053905046 /nfs/dbraw/zinc/90/50/46/1053905046.db2.gz ARWCZARLTNOZKQ-KDURUIRLSA-N 1 1 359.426 2.551 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCc2ccc3c(c2)OCO3)c2ncc([N+](=O)[O-])cc12 ZINC001337779490 1055012874 /nfs/dbraw/zinc/01/28/74/1055012874.db2.gz JCAXISXMMOHOBB-UHFFFAOYSA-N 1 1 369.381 2.509 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC001352452851 1055489667 /nfs/dbraw/zinc/48/96/67/1055489667.db2.gz LNRGNUHRTYRAJR-JYJNAYRXSA-N 1 1 372.473 2.735 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001544801426 1071694211 /nfs/dbraw/zinc/69/42/11/1071694211.db2.gz SPAKQZFAUQTZLQ-GFCCVEGCSA-N 1 1 354.838 2.777 20 5 FFBDMO CCC(CC)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001499526354 1058339021 /nfs/dbraw/zinc/33/90/21/1058339021.db2.gz SPTLESXPSCSPNR-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CCC(CC)C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001499526354 1058339041 /nfs/dbraw/zinc/33/90/41/1058339041.db2.gz SPTLESXPSCSPNR-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CCC(CC)C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001499526354 1058339056 /nfs/dbraw/zinc/33/90/56/1058339056.db2.gz SPTLESXPSCSPNR-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC1 ZINC001444850739 1058342101 /nfs/dbraw/zinc/34/21/01/1058342101.db2.gz VOJUFZLZPQXPIJ-OAHLLOKOSA-N 1 1 357.414 2.535 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 ZINC001444850739 1058342122 /nfs/dbraw/zinc/34/21/22/1058342122.db2.gz VOJUFZLZPQXPIJ-OAHLLOKOSA-N 1 1 357.414 2.535 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001444843862 1058342288 /nfs/dbraw/zinc/34/22/88/1058342288.db2.gz COGBYEWRCGFKBC-JTQLQIEISA-N 1 1 372.828 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)n1 ZINC001518643023 1058449186 /nfs/dbraw/zinc/44/91/86/1058449186.db2.gz PFGIARDXZYANQE-ZBFHGGJFSA-N 1 1 354.410 2.864 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3NC)CC[NH2+]2)cc1 ZINC001448456027 1058779162 /nfs/dbraw/zinc/77/91/62/1058779162.db2.gz XAEYQAQXWNXDSZ-IBGZPJMESA-N 1 1 368.437 2.986 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC001452844621 1059306778 /nfs/dbraw/zinc/30/67/78/1059306778.db2.gz PMNJSZPVOQIJIR-QGZVFWFLSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](Cc2ccccc2)C1 ZINC001452844621 1059306791 /nfs/dbraw/zinc/30/67/91/1059306791.db2.gz PMNJSZPVOQIJIR-QGZVFWFLSA-N 1 1 371.412 2.662 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC001455009349 1059669641 /nfs/dbraw/zinc/66/96/41/1059669641.db2.gz MOHLCEAJHNMULN-SFHVURJKSA-N 1 1 371.412 2.976 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848475180 1060090944 /nfs/dbraw/zinc/09/09/44/1060090944.db2.gz KQCOTSHZKDMANR-HNNXBMFYSA-N 1 1 358.398 2.833 20 5 FFBDMO COC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000848475180 1060090966 /nfs/dbraw/zinc/09/09/66/1060090966.db2.gz KQCOTSHZKDMANR-HNNXBMFYSA-N 1 1 358.398 2.833 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCC[C@H](C3OCCO3)C2)c1 ZINC000848479253 1060107462 /nfs/dbraw/zinc/10/74/62/1060107462.db2.gz VERLBCNACQQREF-AWEZNQCLSA-N 1 1 358.398 2.501 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483140 1060121363 /nfs/dbraw/zinc/12/13/63/1060121363.db2.gz YUPQNXYUUYPKQJ-CRAIPNDOSA-N 1 1 355.442 2.832 20 5 FFBDMO CO[C@@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488112 1060136622 /nfs/dbraw/zinc/13/66/22/1060136622.db2.gz GIRWRFGDTGPHFP-IAGOWNOFSA-N 1 1 361.442 2.615 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488112 1060136632 /nfs/dbraw/zinc/13/66/32/1060136632.db2.gz GIRWRFGDTGPHFP-IAGOWNOFSA-N 1 1 361.442 2.615 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000848487806 1060138805 /nfs/dbraw/zinc/13/88/05/1060138805.db2.gz XLFLJOFZAUPGIC-WMZOPIPTSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000848487806 1060138821 /nfs/dbraw/zinc/13/88/21/1060138821.db2.gz XLFLJOFZAUPGIC-WMZOPIPTSA-N 1 1 366.421 2.753 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)c1 ZINC000848491689 1060150288 /nfs/dbraw/zinc/15/02/88/1060150288.db2.gz YMADPXKMYVAFMC-MRXNPFEDSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)c1 ZINC000848491689 1060150296 /nfs/dbraw/zinc/15/02/96/1060150296.db2.gz YMADPXKMYVAFMC-MRXNPFEDSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1ccc(NC(=O)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(N)c1[N+](=O)[O-] ZINC001456751980 1060189181 /nfs/dbraw/zinc/18/91/81/1060189181.db2.gz SSRAGLZQKJZIRX-HNNXBMFYSA-N 1 1 354.410 2.946 20 5 FFBDMO Cc1nnc(N(C)CCc2ccccc2[N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1C ZINC001511792687 1060414197 /nfs/dbraw/zinc/41/41/97/1060414197.db2.gz DOXGNTPHNCAQFC-HNNXBMFYSA-N 1 1 372.473 2.658 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848784345 1060689889 /nfs/dbraw/zinc/68/98/89/1060689889.db2.gz ZIZRZWZLSWGIJR-HOCLYGCPSA-N 1 1 360.414 2.980 20 5 FFBDMO COc1cc2c(cc1OC)[C@H](C1CC1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC001460755520 1061089686 /nfs/dbraw/zinc/08/96/86/1061089686.db2.gz ARIUKINNWSFUMP-IBGZPJMESA-N 1 1 372.425 2.818 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC001476520639 1061426118 /nfs/dbraw/zinc/42/61/18/1061426118.db2.gz DDJPHNYNPVRNPM-LLVKDONJSA-N 1 1 371.235 2.881 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1C[NH+]1CCSCC1 ZINC001464567696 1062688288 /nfs/dbraw/zinc/68/82/88/1062688288.db2.gz VIJYVPAFLITGDS-UHFFFAOYSA-N 1 1 372.450 2.978 20 5 FFBDMO Cc1cc(C)c(C[N@@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)c(C)c1 ZINC001479868689 1063008985 /nfs/dbraw/zinc/00/89/85/1063008985.db2.gz KGHUGXRKFUGGGN-IEBWSBKVSA-N 1 1 359.470 2.748 20 5 FFBDMO Cc1cc(C)c(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)c1 ZINC001479868689 1063009006 /nfs/dbraw/zinc/00/90/06/1063009006.db2.gz KGHUGXRKFUGGGN-IEBWSBKVSA-N 1 1 359.470 2.748 20 5 FFBDMO Cc1cc(C)c(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)c1 ZINC001479868689 1063009029 /nfs/dbraw/zinc/00/90/29/1063009029.db2.gz KGHUGXRKFUGGGN-IEBWSBKVSA-N 1 1 359.470 2.748 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001532368585 1063048264 /nfs/dbraw/zinc/04/82/64/1063048264.db2.gz DSIVQFUXPKJGJX-GOSISDBHSA-N 1 1 354.410 2.700 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001532368585 1063048279 /nfs/dbraw/zinc/04/82/79/1063048279.db2.gz DSIVQFUXPKJGJX-GOSISDBHSA-N 1 1 354.410 2.700 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC001493291399 1063128857 /nfs/dbraw/zinc/12/88/57/1063128857.db2.gz QPYLLOPLTVMKJI-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC001493291399 1063128861 /nfs/dbraw/zinc/12/88/61/1063128861.db2.gz QPYLLOPLTVMKJI-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC001493291399 1063128873 /nfs/dbraw/zinc/12/88/73/1063128873.db2.gz QPYLLOPLTVMKJI-RTBURBONSA-N 1 1 355.438 2.833 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001468766699 1064035434 /nfs/dbraw/zinc/03/54/34/1064035434.db2.gz LQQWJRZAKPLBSC-ZDUSSCGKSA-N 1 1 369.849 2.960 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001470781684 1064448598 /nfs/dbraw/zinc/44/85/98/1064448598.db2.gz XYPKRKSYSRHBEO-KUHUBIRLSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[nH+]c1 ZINC001472013074 1064891805 /nfs/dbraw/zinc/89/18/05/1064891805.db2.gz VSJPHYXAEPBNGK-UHFFFAOYSA-N 1 1 367.768 2.515 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COc1ccc2cc[nH]c2c1 ZINC001473415885 1065259296 /nfs/dbraw/zinc/25/92/96/1065259296.db2.gz FWDCBPNGHIIWTE-GOSISDBHSA-N 1 1 369.421 2.990 20 5 FFBDMO COC(=O)C[C@@](C)([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(OC)c1 ZINC001473521065 1065278642 /nfs/dbraw/zinc/27/86/42/1065278642.db2.gz KACPSIKVGCDZRX-GOSISDBHSA-N 1 1 359.382 2.567 20 5 FFBDMO C[C@@](CO)([NH2+]CC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC001473714623 1065329790 /nfs/dbraw/zinc/32/97/90/1065329790.db2.gz VUHWHJSRWLEGTL-KRWDZBQOSA-N 1 1 363.801 2.684 20 5 FFBDMO Cc1cc(F)cc2c1CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001579612705 1078650220 /nfs/dbraw/zinc/65/02/20/1078650220.db2.gz RQZOUFFOFAUAKF-IBGZPJMESA-N 1 1 357.385 2.801 20 5 FFBDMO CNc1nccc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)c1[N+](=O)[O-] ZINC001556070674 1075697188 /nfs/dbraw/zinc/69/71/88/1075697188.db2.gz JHCLYJFZWFNSIV-UHFFFAOYSA-N 1 1 353.382 2.762 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)n1 ZINC001556897481 1075786970 /nfs/dbraw/zinc/78/69/70/1075786970.db2.gz LYDAPZQLQGEOOV-WMLDXEAASA-N 1 1 354.410 2.691 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)n1 ZINC001559075538 1076123080 /nfs/dbraw/zinc/12/30/80/1076123080.db2.gz LOQPFOUQNSPIAP-UHFFFAOYSA-N 1 1 351.357 2.683 20 5 FFBDMO CCOc1cc(C[N@@H+](CCC(=O)OC)C[C@H]2CCCO2)ccc1[N+](=O)[O-] ZINC001559546081 1076171545 /nfs/dbraw/zinc/17/15/45/1076171545.db2.gz NMNRICYMVFDZND-OAHLLOKOSA-N 1 1 366.414 2.538 20 5 FFBDMO Cc1ccc(NC(=O)C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC001560065920 1076221153 /nfs/dbraw/zinc/22/11/53/1076221153.db2.gz BXQGIUFIKHOMDS-LJQANCHMSA-N 1 1 357.410 2.647 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3ncccn3)CC2)cccc1[N+](=O)[O-] ZINC001560157449 1076238140 /nfs/dbraw/zinc/23/81/40/1076238140.db2.gz AFBWPPDQHIMHLU-AWEZNQCLSA-N 1 1 369.425 2.900 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001561699926 1076409230 /nfs/dbraw/zinc/40/92/30/1076409230.db2.gz GBWWIQGQLYTJAI-JKSUJKDBSA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(F)c(Cl)c1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001566587758 1076969263 /nfs/dbraw/zinc/96/92/63/1076969263.db2.gz QWPGMHOJHUEULJ-CZUORRHYSA-N 1 1 369.824 2.615 20 5 FFBDMO O=C(NCCC[N@H+](Cc1ccc(F)c(Cl)c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001566587758 1076969265 /nfs/dbraw/zinc/96/92/65/1076969265.db2.gz QWPGMHOJHUEULJ-CZUORRHYSA-N 1 1 369.824 2.615 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(F)c(Cl)c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001566587758 1076969267 /nfs/dbraw/zinc/96/92/67/1076969267.db2.gz QWPGMHOJHUEULJ-CZUORRHYSA-N 1 1 369.824 2.615 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC001566697478 1076975341 /nfs/dbraw/zinc/97/53/41/1076975341.db2.gz AXKKLKVBPFSURH-QZTJIDSGSA-N 1 1 363.433 2.694 20 5 FFBDMO O=C(NC/C=C\C[NH2+]Cc1ccc(C2CCCC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001568847930 1077113883 /nfs/dbraw/zinc/11/38/83/1077113883.db2.gz BRYOGUQCAFBCDH-IFEVLTCRSA-N 1 1 357.454 2.771 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001586420034 1079623945 /nfs/dbraw/zinc/62/39/45/1079623945.db2.gz CTYKYVLHBBELSR-CYBMUJFWSA-N 1 1 353.850 2.981 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000375011257 512118117 /nfs/dbraw/zinc/11/81/17/512118117.db2.gz FBYVFGUUSKILAC-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000375011257 512118118 /nfs/dbraw/zinc/11/81/18/512118118.db2.gz FBYVFGUUSKILAC-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H]1C[C@@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000093643727 250037969 /nfs/dbraw/zinc/03/79/69/250037969.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643727 250037970 /nfs/dbraw/zinc/03/79/70/250037970.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643727 250037974 /nfs/dbraw/zinc/03/79/74/250037974.db2.gz HMVXHNNZSXELAV-KDOFPFPSSA-N 1 1 357.458 2.910 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c2ccccc2C1 ZINC000103447046 250150990 /nfs/dbraw/zinc/15/09/90/250150990.db2.gz LQSZODZCGCPFHX-UHFFFAOYSA-N 1 1 351.366 2.563 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c2ccccc2C1 ZINC000103447046 250150995 /nfs/dbraw/zinc/15/09/95/250150995.db2.gz LQSZODZCGCPFHX-UHFFFAOYSA-N 1 1 351.366 2.563 20 5 FFBDMO C[C@@H](c1ccc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1)[NH+]1CCOCC1 ZINC000106450078 250271057 /nfs/dbraw/zinc/27/10/57/250271057.db2.gz YJCLUDWMZCPSPB-ZDUSSCGKSA-N 1 1 370.409 2.823 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NCc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000181144203 251248617 /nfs/dbraw/zinc/24/86/17/251248617.db2.gz YUVIOUJOIVICFJ-IBGZPJMESA-N 1 1 371.437 2.920 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000192528838 251284284 /nfs/dbraw/zinc/28/42/84/251284284.db2.gz MMTDZTVRQMRHOC-CQSZACIVSA-N 1 1 373.457 2.952 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000192528838 251284290 /nfs/dbraw/zinc/28/42/90/251284290.db2.gz MMTDZTVRQMRHOC-CQSZACIVSA-N 1 1 373.457 2.952 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000264603988 251321672 /nfs/dbraw/zinc/32/16/72/251321672.db2.gz KWXGZPMKONXLMZ-HNNXBMFYSA-N 1 1 371.441 2.665 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272470415 252046151 /nfs/dbraw/zinc/04/61/51/252046151.db2.gz AFPATKFGHWACMD-IEBWSBKVSA-N 1 1 366.421 2.783 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@H]2C1 ZINC000272496057 252052509 /nfs/dbraw/zinc/05/25/09/252052509.db2.gz VCVCVOZYXSYEMY-MFKMUULPSA-N 1 1 370.356 2.754 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272576464 252072695 /nfs/dbraw/zinc/07/26/95/252072695.db2.gz XGPLEQZJHZAMMJ-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO COc1cc(CN2CC[C@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000272634383 252085980 /nfs/dbraw/zinc/08/59/80/252085980.db2.gz NOMHMQKGRILEIG-BXUZGUMPSA-N 1 1 371.384 2.731 20 5 FFBDMO COc1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000272634386 252086628 /nfs/dbraw/zinc/08/66/28/252086628.db2.gz NOMHMQKGRILEIG-FZMZJTMJSA-N 1 1 371.384 2.731 20 5 FFBDMO C[C@@H](NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1 ZINC000272882173 252155204 /nfs/dbraw/zinc/15/52/04/252155204.db2.gz YDIPADWPIFCUCK-OAHLLOKOSA-N 1 1 360.458 2.867 20 5 FFBDMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273467566 252312450 /nfs/dbraw/zinc/31/24/50/252312450.db2.gz IOGKGTBLISJIFO-MLGOLLRUSA-N 1 1 364.423 2.875 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](N3CCCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000285706850 257000814 /nfs/dbraw/zinc/00/08/14/257000814.db2.gz WENXHQLBWCYLER-HOCLYGCPSA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](N3CCCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000285706850 257000815 /nfs/dbraw/zinc/00/08/15/257000815.db2.gz WENXHQLBWCYLER-HOCLYGCPSA-N 1 1 360.458 2.790 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)ccc1[N+](=O)[O-] ZINC000276894235 256140116 /nfs/dbraw/zinc/14/01/16/256140116.db2.gz KSKIMKVPWLCIDE-OAHLLOKOSA-N 1 1 350.415 2.969 20 5 FFBDMO CCOc1cc(C[N@H+](C)Cc2ccc(C(=O)NC)cc2)ccc1[N+](=O)[O-] ZINC000276987937 256149860 /nfs/dbraw/zinc/14/98/60/256149860.db2.gz ZOPHVJIIDNCBFI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(C(=O)NC)cc2)ccc1[N+](=O)[O-] ZINC000276987937 256149861 /nfs/dbraw/zinc/14/98/61/256149861.db2.gz ZOPHVJIIDNCBFI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO Cn1cc(C[N@H+]2CCc3cc[nH]c(=O)c3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000277060923 256156916 /nfs/dbraw/zinc/15/69/16/256156916.db2.gz QGRWMPQUXWEEMR-UHFFFAOYSA-N 1 1 365.393 2.654 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277381725 256191799 /nfs/dbraw/zinc/19/17/99/256191799.db2.gz WJJUKNHJBWLWDU-BXKDBHETSA-N 1 1 368.231 2.570 20 5 FFBDMO Cc1c(NC(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000277517006 256206656 /nfs/dbraw/zinc/20/66/56/256206656.db2.gz OZGHORLHGTUGQZ-CYBMUJFWSA-N 1 1 350.419 2.526 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000286461480 257038257 /nfs/dbraw/zinc/03/82/57/257038257.db2.gz KKRDMXVILFUFDW-SAYFZHNOSA-N 1 1 356.382 2.500 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@@H]2C1 ZINC000286492288 257039753 /nfs/dbraw/zinc/03/97/53/257039753.db2.gz TXFMIZAAQNCUHW-WMLDXEAASA-N 1 1 366.421 2.823 20 5 FFBDMO CCC[C@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000288832049 257231194 /nfs/dbraw/zinc/23/11/94/257231194.db2.gz NZRKAFRJZHCAOP-INIZCTEOSA-N 1 1 355.822 2.671 20 5 FFBDMO CCC[C@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000288832049 257231196 /nfs/dbraw/zinc/23/11/96/257231196.db2.gz NZRKAFRJZHCAOP-INIZCTEOSA-N 1 1 355.822 2.671 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000289788051 257299379 /nfs/dbraw/zinc/29/93/79/257299379.db2.gz HPPIEDVKQAPGIL-HNNXBMFYSA-N 1 1 354.370 2.597 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)c1 ZINC000289788051 257299380 /nfs/dbraw/zinc/29/93/80/257299380.db2.gz HPPIEDVKQAPGIL-HNNXBMFYSA-N 1 1 354.370 2.597 20 5 FFBDMO NC(=O)c1ccnc(NC[C@H]2CCC[N@H+]2CC2CCCCC2)c1[N+](=O)[O-] ZINC000290698565 257353510 /nfs/dbraw/zinc/35/35/10/257353510.db2.gz VOTJZNMSRXZJDF-CQSZACIVSA-N 1 1 361.446 2.545 20 5 FFBDMO C[C@H]1C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000290829212 257359918 /nfs/dbraw/zinc/35/99/18/257359918.db2.gz UIQJRQGIXLMTJB-ZFWWWQNUSA-N 1 1 369.425 2.554 20 5 FFBDMO Cc1cc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000291121191 257384275 /nfs/dbraw/zinc/38/42/75/257384275.db2.gz METHQKJYJIXHCW-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+](C2CC2)C1 ZINC000295510351 257635783 /nfs/dbraw/zinc/63/57/83/257635783.db2.gz HMOHSEWKQWIZRT-GFCCVEGCSA-N 1 1 351.834 2.733 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000301105313 258025357 /nfs/dbraw/zinc/02/53/57/258025357.db2.gz IRUGEHZHIZZLSG-GASCZTMLSA-N 1 1 350.438 2.729 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301377374 258046137 /nfs/dbraw/zinc/04/61/37/258046137.db2.gz WWBVLKNQYCMKCP-UHFFFAOYSA-N 1 1 355.320 2.674 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)[C@H](C)C1 ZINC000302438393 258101724 /nfs/dbraw/zinc/10/17/24/258101724.db2.gz MRQSALZXLUXKPU-HUUCEWRRSA-N 1 1 356.426 2.548 20 5 FFBDMO Cc1ccc(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302444190 258101799 /nfs/dbraw/zinc/10/17/99/258101799.db2.gz NRLLIHYEELDBAK-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO Cc1cc(N2CC[N@H+](CC(C)(C)O)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302512897 258104737 /nfs/dbraw/zinc/10/47/37/258104737.db2.gz TZMZQNRNCAMXAU-AWEZNQCLSA-N 1 1 358.442 2.733 20 5 FFBDMO Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302512897 258104739 /nfs/dbraw/zinc/10/47/39/258104739.db2.gz TZMZQNRNCAMXAU-AWEZNQCLSA-N 1 1 358.442 2.733 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301443564 258050134 /nfs/dbraw/zinc/05/01/34/258050134.db2.gz PXOFHJCYPAYZQJ-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1ncc([N+](=O)[O-])cc1Br ZINC000301578478 258056652 /nfs/dbraw/zinc/05/66/52/258056652.db2.gz OISJUFTYQJGDJK-MNOVXSKESA-N 1 1 355.236 2.815 20 5 FFBDMO O=c1[nH]cnc2cc(N3CC[C@@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c([N+](=O)[O-])cc21 ZINC000301795544 258067754 /nfs/dbraw/zinc/06/77/54/258067754.db2.gz SVPORBXAIBOZTG-BLLLJJGKSA-N 1 1 369.425 2.697 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2c(Br)cncc2[N+](=O)[O-])C1 ZINC000301903796 258073893 /nfs/dbraw/zinc/07/38/93/258073893.db2.gz XPRCCEXCNGLENI-NSHDSACASA-N 1 1 373.251 2.521 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000330703347 258168740 /nfs/dbraw/zinc/16/87/40/258168740.db2.gz JBJJVTWLFBESQT-RHSMWYFYSA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000332099838 258214058 /nfs/dbraw/zinc/21/40/58/258214058.db2.gz YGUAHYJQQJGTBI-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000332264126 258222091 /nfs/dbraw/zinc/22/20/91/258222091.db2.gz ODOMQPFAVLOSNW-KBPBESRZSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000032169465 506232930 /nfs/dbraw/zinc/23/29/30/506232930.db2.gz PVUVIGMSZWENSU-INIZCTEOSA-N 1 1 369.421 2.879 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)[C@H]1CCC[N@@H+](C)C1 ZINC000053245507 506342231 /nfs/dbraw/zinc/34/22/31/506342231.db2.gz DVJAHCHGTBVXHX-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-] ZINC000375220717 512218226 /nfs/dbraw/zinc/21/82/26/512218226.db2.gz DFEBFEZOLGAMNX-ZDUSSCGKSA-N 1 1 357.414 2.996 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(Cc3cscn3)CC2)cc1 ZINC000065952458 506401397 /nfs/dbraw/zinc/40/13/97/506401397.db2.gz BKTRQXUFTUIWBD-UHFFFAOYSA-N 1 1 362.455 2.638 20 5 FFBDMO CCCC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)C1 ZINC000066543606 506549869 /nfs/dbraw/zinc/54/98/69/506549869.db2.gz QJOCAMQWOKQITD-INIZCTEOSA-N 1 1 370.471 2.653 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000043126911 506703517 /nfs/dbraw/zinc/70/35/17/506703517.db2.gz LZECXJHVZRHHQF-OAHLLOKOSA-N 1 1 370.409 2.999 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](CC(C)C)[NH+]1CCOCC1 ZINC000043149451 506709297 /nfs/dbraw/zinc/70/92/97/506709297.db2.gz JYJYWULMHILGKB-INIZCTEOSA-N 1 1 364.446 2.772 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000055402216 506743918 /nfs/dbraw/zinc/74/39/18/506743918.db2.gz XWTVORWYCAUNKQ-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000045126155 506921082 /nfs/dbraw/zinc/92/10/82/506921082.db2.gz XUVDIEZKXYAWGO-UHFFFAOYSA-N 1 1 356.426 2.916 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCOc1ccccc1C ZINC000015099235 507020131 /nfs/dbraw/zinc/02/01/31/507020131.db2.gz HXSDWWYCTFWECL-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCOc1ccccc1C ZINC000015099235 507020134 /nfs/dbraw/zinc/02/01/34/507020134.db2.gz HXSDWWYCTFWECL-UHFFFAOYSA-N 1 1 373.409 2.861 20 5 FFBDMO COc1ccc(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)cc1[N+](=O)[O-] ZINC000023144427 507334578 /nfs/dbraw/zinc/33/45/78/507334578.db2.gz ZTMIRPREQZKSEH-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000371328814 512333696 /nfs/dbraw/zinc/33/36/96/512333696.db2.gz ZGRFKVMFUPHXBK-JKSUJKDBSA-N 1 1 356.426 2.854 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])[NH+](C)C ZINC000023691853 507365446 /nfs/dbraw/zinc/36/54/46/507365446.db2.gz OHZDXBPNSZVLCW-KRWDZBQOSA-N 1 1 357.410 2.565 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000069530644 507509536 /nfs/dbraw/zinc/50/95/36/507509536.db2.gz NFDJTPRGYRKQKC-CQSZACIVSA-N 1 1 363.439 2.650 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051049558 507727186 /nfs/dbraw/zinc/72/71/86/507727186.db2.gz NQLVPFXVEBTJCG-JKSUJKDBSA-N 1 1 363.458 2.990 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000052192632 507802345 /nfs/dbraw/zinc/80/23/45/507802345.db2.gz QDXQKASBNPKSKM-CQSZACIVSA-N 1 1 371.441 2.766 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)[C@H]1CCc2ccccc21 ZINC000072632202 507834096 /nfs/dbraw/zinc/83/40/96/507834096.db2.gz ZYEBKORRBKXEGB-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000072632202 507834098 /nfs/dbraw/zinc/83/40/98/507834098.db2.gz ZYEBKORRBKXEGB-IBGZPJMESA-N 1 1 369.421 2.824 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000089644391 507853235 /nfs/dbraw/zinc/85/32/35/507853235.db2.gz IQSAFIQKFWUUFE-RTBURBONSA-N 1 1 371.437 2.789 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000078333600 507861363 /nfs/dbraw/zinc/86/13/63/507861363.db2.gz HHPWNFFBQPISFY-UHFFFAOYSA-N 1 1 357.414 2.838 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089906402 507881957 /nfs/dbraw/zinc/88/19/57/507881957.db2.gz NBZIJZORKHCRLQ-AWEZNQCLSA-N 1 1 361.398 2.735 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCS[C@@H]4COCC[C@@H]43)co2)cc1 ZINC000089910204 507882504 /nfs/dbraw/zinc/88/25/04/507882504.db2.gz SMCKWUFUDGNRKU-JKSUJKDBSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@@H]4COCC[C@@H]43)co2)cc1 ZINC000089910204 507882506 /nfs/dbraw/zinc/88/25/06/507882506.db2.gz SMCKWUFUDGNRKU-JKSUJKDBSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](C[C@H]1CCCO1)[C@@H]1CCSC1 ZINC000089952932 507889944 /nfs/dbraw/zinc/88/99/44/507889944.db2.gz XNJRZFVBNBUUJQ-HUUCEWRRSA-N 1 1 352.456 2.960 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000078674826 507896180 /nfs/dbraw/zinc/89/61/80/507896180.db2.gz CRULWRMTANTCJH-MRXNPFEDSA-N 1 1 368.437 2.652 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000108818991 507920236 /nfs/dbraw/zinc/92/02/36/507920236.db2.gz NLXRFVOHDFARJP-BETUJISGSA-N 1 1 373.457 2.957 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000108818991 507920240 /nfs/dbraw/zinc/92/02/40/507920240.db2.gz NLXRFVOHDFARJP-BETUJISGSA-N 1 1 373.457 2.957 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000108818991 507920244 /nfs/dbraw/zinc/92/02/44/507920244.db2.gz NLXRFVOHDFARJP-BETUJISGSA-N 1 1 373.457 2.957 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])c1 ZINC000079707544 507994231 /nfs/dbraw/zinc/99/42/31/507994231.db2.gz DEQBPRCMJRUDTM-UHFFFAOYSA-N 1 1 370.453 2.799 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000074327204 508012497 /nfs/dbraw/zinc/01/24/97/508012497.db2.gz DDOBIYXUWGAQCQ-INIZCTEOSA-N 1 1 360.458 2.587 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000110519390 508032157 /nfs/dbraw/zinc/03/21/57/508032157.db2.gz AKOWHFWODBGSJV-GASCZTMLSA-N 1 1 362.474 2.879 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080106358 508039020 /nfs/dbraw/zinc/03/90/20/508039020.db2.gz FPONDXVLYSLOCW-CYBMUJFWSA-N 1 1 359.430 2.970 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cn2c(n1)CCCC2 ZINC000369367144 512375043 /nfs/dbraw/zinc/37/50/43/512375043.db2.gz WOPRWOKTICYZAH-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1cn2c(n1)CCCC2 ZINC000369367144 512375044 /nfs/dbraw/zinc/37/50/44/512375044.db2.gz WOPRWOKTICYZAH-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111415230 508096860 /nfs/dbraw/zinc/09/68/60/508096860.db2.gz RVKACDKDOPWEHP-CYBMUJFWSA-N 1 1 370.837 2.607 20 5 FFBDMO C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000111480059 508103145 /nfs/dbraw/zinc/10/31/45/508103145.db2.gz ZMILJPGJYZMGOK-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000075890499 508141446 /nfs/dbraw/zinc/14/14/46/508141446.db2.gz RVUJLTUVDUEBSB-SFHVURJKSA-N 1 1 363.458 2.679 20 5 FFBDMO CCc1nn(C)c(NC[C@H](C)[NH+]2CCN(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000094135709 508170437 /nfs/dbraw/zinc/17/04/37/508170437.db2.gz FOOXBZIRWJTQOT-HNNXBMFYSA-N 1 1 372.473 2.513 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000112918582 508233467 /nfs/dbraw/zinc/23/34/67/508233467.db2.gz KRDBDPAAFIJYSB-UHFFFAOYSA-N 1 1 366.437 2.900 20 5 FFBDMO C[N@@H+](CCNc1ccc(I)cc1[N+](=O)[O-])C1CC1 ZINC000083420441 508245386 /nfs/dbraw/zinc/24/53/86/508245386.db2.gz UATZWQUEUOPIFY-UHFFFAOYSA-N 1 1 361.183 2.706 20 5 FFBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000077321866 508300466 /nfs/dbraw/zinc/30/04/66/508300466.db2.gz HVSACGIIUOEUJR-UAGQMJEPSA-N 1 1 361.442 2.719 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000085407156 508307289 /nfs/dbraw/zinc/30/72/89/508307289.db2.gz NEDLHSYWAYDNOL-QAPCUYQASA-N 1 1 362.474 2.899 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000085620006 508314587 /nfs/dbraw/zinc/31/45/87/508314587.db2.gz UJPCJHMLFSJYQA-OKILXGFUSA-N 1 1 364.446 2.832 20 5 FFBDMO CN(C(=O)C[N@H+](CCO)[C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000114467274 508318112 /nfs/dbraw/zinc/31/81/12/508318112.db2.gz KGKHFBSRUVBHBP-LJQANCHMSA-N 1 1 369.421 2.539 20 5 FFBDMO CN(C(=O)C[N@@H+](CCO)[C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000114467274 508318114 /nfs/dbraw/zinc/31/81/14/508318114.db2.gz KGKHFBSRUVBHBP-LJQANCHMSA-N 1 1 369.421 2.539 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000115444069 508394742 /nfs/dbraw/zinc/39/47/42/508394742.db2.gz GXQUQTCIROWGJU-OAHLLOKOSA-N 1 1 360.458 2.609 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1ccnc1 ZINC000156454912 508423544 /nfs/dbraw/zinc/42/35/44/508423544.db2.gz BLEBKEBRXYASDH-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1n1ccnc1 ZINC000156454912 508423547 /nfs/dbraw/zinc/42/35/47/508423547.db2.gz BLEBKEBRXYASDH-BBRMVZONSA-N 1 1 368.397 2.924 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000156906059 508494325 /nfs/dbraw/zinc/49/43/25/508494325.db2.gz IMFIILHRNFTMNZ-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000156906059 508494328 /nfs/dbraw/zinc/49/43/28/508494328.db2.gz IMFIILHRNFTMNZ-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000122237010 508504084 /nfs/dbraw/zinc/50/40/84/508504084.db2.gz MHROBRORCZKYFH-BXUZGUMPSA-N 1 1 364.402 2.614 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000116732716 508551800 /nfs/dbraw/zinc/55/18/00/508551800.db2.gz ZWGMACUNTOKVGK-GFCCVEGCSA-N 1 1 367.833 2.618 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157792324 508612430 /nfs/dbraw/zinc/61/24/30/508612430.db2.gz WPVUEUSVGHNRFI-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1CC(F)F ZINC000153698715 508628957 /nfs/dbraw/zinc/62/89/57/508628957.db2.gz UILJWOYTOIEWGC-CYBMUJFWSA-N 1 1 370.400 2.585 20 5 FFBDMO CC(=O)c1ccc(OC[C@@H](O)C[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000153845131 508661146 /nfs/dbraw/zinc/66/11/46/508661146.db2.gz CJHCMUYROYKJHO-KRWDZBQOSA-N 1 1 358.394 2.669 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[NH+](C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000123266965 508661322 /nfs/dbraw/zinc/66/13/22/508661322.db2.gz VPEGQGITHGJVHD-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+](CCO)Cc2ccc(Cl)c(Cl)c2)n1 ZINC000158196009 508670576 /nfs/dbraw/zinc/67/05/76/508670576.db2.gz HWHHTGNCNKNASK-UHFFFAOYSA-N 1 1 359.213 2.593 20 5 FFBDMO COC(=O)c1cc(NC(=O)[C@H](c2ccccc2)[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000136152601 508674243 /nfs/dbraw/zinc/67/42/43/508674243.db2.gz PIDUBBNAZZTXIT-INIZCTEOSA-N 1 1 357.366 2.623 20 5 FFBDMO C[NH+](C)[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000129071428 508678710 /nfs/dbraw/zinc/67/87/10/508678710.db2.gz QXGYSUNLTYCXMZ-ZDUSSCGKSA-N 1 1 369.468 2.775 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153931122 508679422 /nfs/dbraw/zinc/67/94/22/508679422.db2.gz ZOKAQECTMHJLMK-MRXNPFEDSA-N 1 1 365.430 2.571 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153931122 508679428 /nfs/dbraw/zinc/67/94/28/508679428.db2.gz ZOKAQECTMHJLMK-MRXNPFEDSA-N 1 1 365.430 2.571 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C[N@H+]1C1CC1 ZINC000123435679 508686944 /nfs/dbraw/zinc/68/69/44/508686944.db2.gz DCBZCEJZKQHZFA-HIFRSBDPSA-N 1 1 358.442 2.894 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(F)c1 ZINC000136402555 508692927 /nfs/dbraw/zinc/69/29/27/508692927.db2.gz JCHDRCGENNKDBF-CQSZACIVSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(F)c1 ZINC000136402555 508692930 /nfs/dbraw/zinc/69/29/30/508692930.db2.gz JCHDRCGENNKDBF-CQSZACIVSA-N 1 1 374.372 2.602 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997572 508694726 /nfs/dbraw/zinc/69/47/26/508694726.db2.gz VUSWKWLMXUESLT-IRXDYDNUSA-N 1 1 361.442 2.837 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000153997572 508694728 /nfs/dbraw/zinc/69/47/28/508694728.db2.gz VUSWKWLMXUESLT-IRXDYDNUSA-N 1 1 361.442 2.837 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000123493293 508694751 /nfs/dbraw/zinc/69/47/51/508694751.db2.gz WJXFDAQRJMYAJX-UHFFFAOYSA-N 1 1 373.384 2.861 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000119023942 508709068 /nfs/dbraw/zinc/70/90/68/508709068.db2.gz YNHMLBMVTKCZFR-OAHLLOKOSA-N 1 1 366.893 2.850 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000129365671 508718999 /nfs/dbraw/zinc/71/89/99/508718999.db2.gz YTWTYGHLHOKVEF-WMLDXEAASA-N 1 1 357.414 2.621 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000129365671 508719004 /nfs/dbraw/zinc/71/90/04/508719004.db2.gz YTWTYGHLHOKVEF-WMLDXEAASA-N 1 1 357.414 2.621 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000137476620 508757070 /nfs/dbraw/zinc/75/70/70/508757070.db2.gz WLSZNRQAIHCRDW-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000142388669 508823440 /nfs/dbraw/zinc/82/34/40/508823440.db2.gz IHBKNVMBQBKJEK-QGZVFWFLSA-N 1 1 372.469 2.508 20 5 FFBDMO CC(C)(C)[C@@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000154708851 508838957 /nfs/dbraw/zinc/83/89/57/508838957.db2.gz IWHQMOZHCVMGQU-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO CC(C)(C)[C@@H](C[N@@H+]1CCc2ccccc2C1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000154708851 508838960 /nfs/dbraw/zinc/83/89/60/508838960.db2.gz IWHQMOZHCVMGQU-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO CC(C)(C)[C@@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000154708851 508838964 /nfs/dbraw/zinc/83/89/64/508838964.db2.gz IWHQMOZHCVMGQU-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H](C(N)=O)CC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000159603986 508864552 /nfs/dbraw/zinc/86/45/52/508864552.db2.gz KTFZZGLSCLWPBM-OLZOCXBDSA-N 1 1 373.409 2.949 20 5 FFBDMO CS(=O)(=O)c1ccc(NCCNc2cc[nH+]cc2Cl)c([N+](=O)[O-])c1 ZINC000131010958 508877057 /nfs/dbraw/zinc/87/70/57/508877057.db2.gz YMYAUPBCLVGSNL-UHFFFAOYSA-N 1 1 370.818 2.571 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000120040778 508915428 /nfs/dbraw/zinc/91/54/28/508915428.db2.gz UJIRKVKBEZNBIC-KRWDZBQOSA-N 1 1 364.446 2.690 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)CCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000150957097 508931012 /nfs/dbraw/zinc/93/10/12/508931012.db2.gz FTRLGRWVLQJFEI-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO CCc1ccc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000160174298 508949891 /nfs/dbraw/zinc/94/98/91/508949891.db2.gz YGLTVHKROPEPEY-UHFFFAOYSA-N 1 1 363.458 2.588 20 5 FFBDMO COC(=O)c1oc([C@@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000125224390 508951120 /nfs/dbraw/zinc/95/11/20/508951120.db2.gz BYAIICYGMHFCGC-OLZOCXBDSA-N 1 1 374.397 2.925 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000160492046 508994623 /nfs/dbraw/zinc/99/46/23/508994623.db2.gz NTDYGWTULWEGOR-BZPMIXESSA-N 1 1 354.838 2.721 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151627905 509055634 /nfs/dbraw/zinc/05/56/34/509055634.db2.gz HDZZCZGKLGPFOO-ZDUSSCGKSA-N 1 1 370.247 2.500 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000126685470 509113573 /nfs/dbraw/zinc/11/35/73/509113573.db2.gz AJVKVTYPWSTOOQ-AWEZNQCLSA-N 1 1 358.442 2.713 20 5 FFBDMO COc1cc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000133474252 509164033 /nfs/dbraw/zinc/16/40/33/509164033.db2.gz SWFDEOHHGNKLBU-OAHLLOKOSA-N 1 1 359.382 2.763 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000185448234 509182144 /nfs/dbraw/zinc/18/21/44/509182144.db2.gz CWZNDBQDJMFBHG-AWEZNQCLSA-N 1 1 374.466 2.974 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000247915503 509190741 /nfs/dbraw/zinc/19/07/41/509190741.db2.gz AXLFVZDXEIDHHF-HNAYVOBHSA-N 1 1 355.394 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185492762 509203146 /nfs/dbraw/zinc/20/31/46/509203146.db2.gz XOKCCZAPMMDGKS-HNNXBMFYSA-N 1 1 369.421 2.905 20 5 FFBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])cnc3N)c2C1 ZINC000185550875 509232304 /nfs/dbraw/zinc/23/23/04/509232304.db2.gz PXPJCVKHDMKWHF-UHFFFAOYSA-N 1 1 355.398 2.796 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000182670291 509361298 /nfs/dbraw/zinc/36/12/98/509361298.db2.gz FGMUGXDMKMFWSV-DGCLKSJQSA-N 1 1 369.368 2.895 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccco1 ZINC000164704513 509526022 /nfs/dbraw/zinc/52/60/22/509526022.db2.gz KHQKKFOXDACHDK-UHFFFAOYSA-N 1 1 361.398 2.973 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N(C)C)c1 ZINC000173328916 509533426 /nfs/dbraw/zinc/53/34/26/509533426.db2.gz XQRURIQBUMDVED-ZDUSSCGKSA-N 1 1 363.439 2.696 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]CC(=O)NC(C)(C)C)o2)c([N+](=O)[O-])c1 ZINC000237287118 509614071 /nfs/dbraw/zinc/61/40/71/509614071.db2.gz KFHDUHKJIYNROF-UHFFFAOYSA-N 1 1 361.398 2.868 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000192808018 509652564 /nfs/dbraw/zinc/65/25/64/509652564.db2.gz SIRDNWQOYDLZJU-BBRMVZONSA-N 1 1 359.426 2.692 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000179880257 509658230 /nfs/dbraw/zinc/65/82/30/509658230.db2.gz HWVFKGMVRIWHDC-ZDUSSCGKSA-N 1 1 374.384 2.984 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000249488394 509692850 /nfs/dbraw/zinc/69/28/50/509692850.db2.gz XTOGNNOLWFPITI-UKRRQHHQSA-N 1 1 363.439 2.937 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])cs1 ZINC000249488394 509692859 /nfs/dbraw/zinc/69/28/59/509692859.db2.gz XTOGNNOLWFPITI-UKRRQHHQSA-N 1 1 363.439 2.937 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000170647280 509696925 /nfs/dbraw/zinc/69/69/25/509696925.db2.gz YEKQDMSPDQAGDY-CQSZACIVSA-N 1 1 365.430 2.820 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000183304722 509705754 /nfs/dbraw/zinc/70/57/54/509705754.db2.gz SCBBUXVKSXVUPM-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1cccc(S(N)(=O)=O)c1 ZINC000183304722 509705760 /nfs/dbraw/zinc/70/57/60/509705760.db2.gz SCBBUXVKSXVUPM-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1[nH+]ccn1Cc1ccccc1 ZINC000192963668 509718277 /nfs/dbraw/zinc/71/82/77/509718277.db2.gz DXVJZOKHKYKDQK-UHFFFAOYSA-N 1 1 361.361 2.598 20 5 FFBDMO COc1ccc(OC)c(C[N@H+](CCO)Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000183341869 509727590 /nfs/dbraw/zinc/72/75/90/509727590.db2.gz VNQHJZBMHNTYLV-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO COc1ccc(OC)c(C[N@@H+](CCO)Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000183341869 509727601 /nfs/dbraw/zinc/72/76/01/509727601.db2.gz VNQHJZBMHNTYLV-UHFFFAOYSA-N 1 1 360.410 2.915 20 5 FFBDMO CC(C)C[C@H]1C(=O)NCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189825387 509772380 /nfs/dbraw/zinc/77/23/80/509772380.db2.gz QNYRMJVAETUQRL-INIZCTEOSA-N 1 1 372.425 2.639 20 5 FFBDMO CC(C)C[C@H]1C(=O)NCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189825387 509772386 /nfs/dbraw/zinc/77/23/86/509772386.db2.gz QNYRMJVAETUQRL-INIZCTEOSA-N 1 1 372.425 2.639 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000177054980 509844670 /nfs/dbraw/zinc/84/46/70/509844670.db2.gz ZAGKUSFYCSNDFP-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO O=C(C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)NCC(F)(F)F ZINC000180290563 509852665 /nfs/dbraw/zinc/85/26/65/509852665.db2.gz DOINKHQEBLEIHO-MRXNPFEDSA-N 1 1 367.327 2.952 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000186691389 509856531 /nfs/dbraw/zinc/85/65/31/509856531.db2.gz GPQZKRDPGASXKE-CYBMUJFWSA-N 1 1 364.446 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](c4nnc5n4CCC5)C3)nc2c1 ZINC000177078180 509858179 /nfs/dbraw/zinc/85/81/79/509858179.db2.gz ASRCIVIKHCYQAV-LBPRGKRZSA-N 1 1 368.397 2.653 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](c4nnc5n4CCC5)C3)nc2c1 ZINC000177078180 509858186 /nfs/dbraw/zinc/85/81/86/509858186.db2.gz ASRCIVIKHCYQAV-LBPRGKRZSA-N 1 1 368.397 2.653 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C1 ZINC000173950959 509872495 /nfs/dbraw/zinc/87/24/95/509872495.db2.gz NCSOMBHAELAGGE-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO Cc1nnc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)[nH]1 ZINC000268417392 509917012 /nfs/dbraw/zinc/91/70/12/509917012.db2.gz BYJYEALDACWMGT-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000268417392 509917022 /nfs/dbraw/zinc/91/70/22/509917022.db2.gz BYJYEALDACWMGT-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000268417392 509917031 /nfs/dbraw/zinc/91/70/31/509917031.db2.gz BYJYEALDACWMGT-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n[nH]1 ZINC000268417392 509917043 /nfs/dbraw/zinc/91/70/43/509917043.db2.gz BYJYEALDACWMGT-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n[nH]1 ZINC000268417392 509917049 /nfs/dbraw/zinc/91/70/49/509917049.db2.gz BYJYEALDACWMGT-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO C[N@@H+](CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000177190955 509926925 /nfs/dbraw/zinc/92/69/25/509926925.db2.gz SUDVRLUCSMHZKW-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000245436443 509934201 /nfs/dbraw/zinc/93/42/01/509934201.db2.gz QZEDUSYWWSDMSM-MAUKXSAKSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1 ZINC000245436443 509934208 /nfs/dbraw/zinc/93/42/08/509934208.db2.gz QZEDUSYWWSDMSM-MAUKXSAKSA-N 1 1 362.474 2.894 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000174124456 509958063 /nfs/dbraw/zinc/95/80/63/509958063.db2.gz LONAAWQMMWUVEG-CQSZACIVSA-N 1 1 362.430 2.989 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CC(C)(C)O ZINC000186944019 509966407 /nfs/dbraw/zinc/96/64/07/509966407.db2.gz XMUNDZUEZWTXQS-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180531294 509968897 /nfs/dbraw/zinc/96/88/97/509968897.db2.gz AMKFTGFBTZPLDF-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1cc([C@@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000183807025 509985658 /nfs/dbraw/zinc/98/56/58/509985658.db2.gz SDVKYBDDHVCVSJ-GFCCVEGCSA-N 1 1 352.412 2.929 20 5 FFBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988311 /nfs/dbraw/zinc/98/83/11/509988311.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988324 /nfs/dbraw/zinc/98/83/24/509988324.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000177304975 509988338 /nfs/dbraw/zinc/98/83/38/509988338.db2.gz KKPKQSJJZVNNPL-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000180595048 510005122 /nfs/dbraw/zinc/00/51/22/510005122.db2.gz CNPIHDYAZXXZDE-OAHLLOKOSA-N 1 1 358.398 2.727 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000177427335 510051991 /nfs/dbraw/zinc/05/19/91/510051991.db2.gz ZSECVFFEADPNMJ-SFHVURJKSA-N 1 1 359.382 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000193835661 510093864 /nfs/dbraw/zinc/09/38/64/510093864.db2.gz TWWVDHLHWFSFHS-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO COc1cc(N2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)ncn1 ZINC000184069389 510115837 /nfs/dbraw/zinc/11/58/37/510115837.db2.gz QUAFYMZIEBQEDE-AWEZNQCLSA-N 1 1 357.414 2.585 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000261921594 510116802 /nfs/dbraw/zinc/11/68/02/510116802.db2.gz IPIBTRSMXXVFRK-KRWDZBQOSA-N 1 1 359.813 2.964 20 5 FFBDMO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000245779947 510143775 /nfs/dbraw/zinc/14/37/75/510143775.db2.gz ZWGOUKXEPLBBLX-TZMCWYRMSA-N 1 1 367.475 2.734 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C1 ZINC000171479443 510185937 /nfs/dbraw/zinc/18/59/37/510185937.db2.gz ZJRFYYDUSFITLY-NSHDSACASA-N 1 1 353.444 2.539 20 5 FFBDMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000180936724 510192786 /nfs/dbraw/zinc/19/27/86/510192786.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000180936724 510192792 /nfs/dbraw/zinc/19/27/92/510192792.db2.gz IICKVJNNDDVAIH-UHFFFAOYSA-N 1 1 354.882 2.706 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000184250854 510217671 /nfs/dbraw/zinc/21/76/71/510217671.db2.gz YRWCUATXTDNZIB-NSHDSACASA-N 1 1 350.350 2.814 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000184250854 510217676 /nfs/dbraw/zinc/21/76/76/510217676.db2.gz YRWCUATXTDNZIB-NSHDSACASA-N 1 1 350.350 2.814 20 5 FFBDMO C[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000174870579 510356229 /nfs/dbraw/zinc/35/62/29/510356229.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870579 510356234 /nfs/dbraw/zinc/35/62/34/510356234.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870579 510356237 /nfs/dbraw/zinc/35/62/37/510356237.db2.gz PNJOUZXSNYLMQL-WMZOPIPTSA-N 1 1 357.458 2.776 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000269466824 510420852 /nfs/dbraw/zinc/42/08/52/510420852.db2.gz ASWNIGUSMBLFOJ-UHFFFAOYSA-N 1 1 355.398 2.603 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000246371618 510452809 /nfs/dbraw/zinc/45/28/09/510452809.db2.gz LWVUMMULJBMCBS-HUUCEWRRSA-N 1 1 360.458 2.904 20 5 FFBDMO C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181540771 510463833 /nfs/dbraw/zinc/46/38/33/510463833.db2.gz OYXSVIOISWLUPG-GJZGRUSLSA-N 1 1 361.442 2.743 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000184812413 510527540 /nfs/dbraw/zinc/52/75/40/510527540.db2.gz AVFXJMBCOLPTEU-JQWIXIFHSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000181673240 510533108 /nfs/dbraw/zinc/53/31/08/510533108.db2.gz AAGRVIRNFKFMGS-HIFRSBDPSA-N 1 1 361.442 2.986 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000184921395 510586652 /nfs/dbraw/zinc/58/66/52/510586652.db2.gz GPIXAQQGWDDNOM-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000184921395 510586657 /nfs/dbraw/zinc/58/66/57/510586657.db2.gz GPIXAQQGWDDNOM-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000194927208 510595328 /nfs/dbraw/zinc/59/53/28/510595328.db2.gz PWACOEKXJVXMIV-YJBOKZPZSA-N 1 1 352.431 2.616 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2ccc([S@@](C)=O)cc2)c([N+](=O)[O-])cc1O ZINC000270126559 510685753 /nfs/dbraw/zinc/68/57/53/510685753.db2.gz PAIZAILWGXYXKP-JPQMIFPKSA-N 1 1 364.423 2.897 20 5 FFBDMO CC(C)(C)c1ccc2c(c1)C[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC2 ZINC000182251007 510833862 /nfs/dbraw/zinc/83/38/62/510833862.db2.gz XXUVGIZGMQRLKS-SFHVURJKSA-N 1 1 358.442 2.508 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@@H](C)C1 ZINC000247239062 510853724 /nfs/dbraw/zinc/85/37/24/510853724.db2.gz DGOMFXLTEIGFAL-KSSFIOAISA-N 1 1 371.441 2.583 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OC(F)F ZINC000247246093 510854022 /nfs/dbraw/zinc/85/40/22/510854022.db2.gz ZSFNGCBDQBEYJN-ZWNOBZJWSA-N 1 1 360.357 2.798 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000360341607 510898477 /nfs/dbraw/zinc/89/84/77/510898477.db2.gz GOUYEPYYYAUQFJ-NEPJUHHUSA-N 1 1 368.231 2.714 20 5 FFBDMO CC(=O)c1cccc(OC[C@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282341366 510938254 /nfs/dbraw/zinc/93/82/54/510938254.db2.gz BWNDEVRHRYYSPQ-LJQANCHMSA-N 1 1 372.421 2.712 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000294084669 510950417 /nfs/dbraw/zinc/95/04/17/510950417.db2.gz JVSQXERGWUWWEU-QGZVFWFLSA-N 1 1 351.834 2.735 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CC=C(c3ccnn3C)CC2)c([N+](=O)[O-])c1 ZINC000285606392 510975935 /nfs/dbraw/zinc/97/59/35/510975935.db2.gz MILRTAMAXLWJLP-UHFFFAOYSA-N 1 1 358.398 2.505 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000361067448 510988647 /nfs/dbraw/zinc/98/86/47/510988647.db2.gz NADYXNLPAFHAKC-GHMZBOCLSA-N 1 1 355.341 2.553 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCO[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000297702935 511040314 /nfs/dbraw/zinc/04/03/14/511040314.db2.gz AVCIOPUDOSADIB-WBVHZDCISA-N 1 1 363.414 2.575 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000271008803 511054988 /nfs/dbraw/zinc/05/49/88/511054988.db2.gz XHDJIROVYFMNIF-NSHDSACASA-N 1 1 355.236 2.817 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000332445723 511082328 /nfs/dbraw/zinc/08/23/28/511082328.db2.gz MDFPMZASZQHKCB-ZDUSSCGKSA-N 1 1 359.348 2.915 20 5 FFBDMO CC(C)[NH+]1CCN(C2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)CC2)CC1 ZINC000283148427 511254940 /nfs/dbraw/zinc/25/49/40/511254940.db2.gz OJUWCSHXOWPILB-UHFFFAOYSA-N 1 1 364.465 2.724 20 5 FFBDMO C[C@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000291616624 511269470 /nfs/dbraw/zinc/26/94/70/511269470.db2.gz AJXJMKCIKOYVFY-CQSZACIVSA-N 1 1 372.469 2.798 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291762539 511327887 /nfs/dbraw/zinc/32/78/87/511327887.db2.gz LGPMXEOESRVMEP-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291762539 511327890 /nfs/dbraw/zinc/32/78/90/511327890.db2.gz LGPMXEOESRVMEP-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000363099618 511352223 /nfs/dbraw/zinc/35/22/23/511352223.db2.gz WUANTXJMKLOOLW-GHMZBOCLSA-N 1 1 370.356 2.945 20 5 FFBDMO O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000298866617 511435990 /nfs/dbraw/zinc/43/59/90/511435990.db2.gz SNJMWXPROLZOJI-UHFFFAOYSA-N 1 1 361.423 2.783 20 5 FFBDMO Cc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000292273632 511532630 /nfs/dbraw/zinc/53/26/30/511532630.db2.gz QIVJQLXUQMREHO-INIZCTEOSA-N 1 1 371.441 2.658 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@](C)(OC)CC1 ZINC000280628569 511539536 /nfs/dbraw/zinc/53/95/36/511539536.db2.gz XEENFRYNHJCTCB-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292300148 511543597 /nfs/dbraw/zinc/54/35/97/511543597.db2.gz MRZLQBOALJXTLI-HUUCEWRRSA-N 1 1 360.458 2.728 20 5 FFBDMO C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC[N@H+](C2CCC2)C1 ZINC000295967808 511572652 /nfs/dbraw/zinc/57/26/52/511572652.db2.gz NPMTVOSSHGBMOB-AWEZNQCLSA-N 1 1 370.457 2.701 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2nnc3n2CCC3)CC1 ZINC000363727808 511727744 /nfs/dbraw/zinc/72/77/44/511727744.db2.gz NRLVMKINXPKVPB-UHFFFAOYSA-N 1 1 371.441 2.911 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000296409036 511732016 /nfs/dbraw/zinc/73/20/16/511732016.db2.gz UHUOLXWVMOWHSJ-DLBZAZTESA-N 1 1 350.802 2.947 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000292839331 511740024 /nfs/dbraw/zinc/74/00/24/511740024.db2.gz SBOFEZKJLWGODX-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CS(=O)(=O)C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000292839331 511740028 /nfs/dbraw/zinc/74/00/28/511740028.db2.gz SBOFEZKJLWGODX-CYBMUJFWSA-N 1 1 364.423 2.721 20 5 FFBDMO CCOc1ccc(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350381685 511798152 /nfs/dbraw/zinc/79/81/52/511798152.db2.gz FEUGGKRVAUTMBJ-CRAIPNDOSA-N 1 1 374.397 2.969 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)C[C@H]21 ZINC000284797594 511873683 /nfs/dbraw/zinc/87/36/83/511873683.db2.gz OITJSTREGISUNN-MOPGFXCFSA-N 1 1 364.445 2.851 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cn1 ZINC000364404779 512106837 /nfs/dbraw/zinc/10/68/37/512106837.db2.gz PCFCPYZMRVSISL-PBHICJAKSA-N 1 1 354.410 2.630 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 ZINC000373776420 512499970 /nfs/dbraw/zinc/49/99/70/512499970.db2.gz HBNKLKGCHOGGSE-SUMWQHHRSA-N 1 1 359.426 2.579 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@H+](C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000377942394 512522537 /nfs/dbraw/zinc/52/25/37/512522537.db2.gz GUVMOQQGVMESTC-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 ZINC000377942394 512522540 /nfs/dbraw/zinc/52/25/40/512522540.db2.gz GUVMOQQGVMESTC-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H]1CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411214220 512523681 /nfs/dbraw/zinc/52/36/81/512523681.db2.gz DYXGQJISWUTUEE-GOSISDBHSA-N 1 1 360.458 2.874 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H]1CN1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411214220 512523687 /nfs/dbraw/zinc/52/36/87/512523687.db2.gz DYXGQJISWUTUEE-GOSISDBHSA-N 1 1 360.458 2.874 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2CSC)c([N+](=O)[O-])c1 ZINC000411318128 512578347 /nfs/dbraw/zinc/57/83/47/512578347.db2.gz DHEHHBVNLFXBAO-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](c4ccncn4)C3)n2)c1 ZINC000373939079 512582486 /nfs/dbraw/zinc/58/24/86/512582486.db2.gz QIFULFJWELMLQS-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](c4ccncn4)C3)n2)c1 ZINC000373939079 512582488 /nfs/dbraw/zinc/58/24/88/512582488.db2.gz QIFULFJWELMLQS-AWEZNQCLSA-N 1 1 366.381 2.814 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000373942517 512584138 /nfs/dbraw/zinc/58/41/38/512584138.db2.gz HBGFQVZRSKPCQY-JKSUJKDBSA-N 1 1 361.442 2.615 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000374028434 512629565 /nfs/dbraw/zinc/62/95/65/512629565.db2.gz QBJFLZCZPWXGDR-VKJFTORMSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000374028434 512629573 /nfs/dbraw/zinc/62/95/73/512629573.db2.gz QBJFLZCZPWXGDR-VKJFTORMSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000374028432 512630488 /nfs/dbraw/zinc/63/04/88/512630488.db2.gz QBJFLZCZPWXGDR-RKVPGOIHSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](C)O2 ZINC000374028432 512630492 /nfs/dbraw/zinc/63/04/92/512630492.db2.gz QBJFLZCZPWXGDR-RKVPGOIHSA-N 1 1 350.415 2.632 20 5 FFBDMO CC[C@H](NCC(=O)NC1CC[NH+](C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000411472013 512652476 /nfs/dbraw/zinc/65/24/76/512652476.db2.gz GTNJUAAXMZTSIE-SFHVURJKSA-N 1 1 362.474 2.625 20 5 FFBDMO CC(=O)c1ccc2c(c1)CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000374352151 512784218 /nfs/dbraw/zinc/78/42/18/512784218.db2.gz OJZXWVIEFMFCNH-HXUWFJFHSA-N 1 1 354.406 2.932 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000382009669 512876569 /nfs/dbraw/zinc/87/65/69/512876569.db2.gz MTXQVNILKBBGJS-XJKSGUPXSA-N 1 1 354.410 2.570 20 5 FFBDMO CNc1ccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000389952307 512903273 /nfs/dbraw/zinc/90/32/73/512903273.db2.gz SNMINEUWGIKXND-KSSFIOAISA-N 1 1 368.437 2.887 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC([C@@H]4CCOC4)CC3)o2)cc1 ZINC000374595705 512909238 /nfs/dbraw/zinc/90/92/38/512909238.db2.gz PQRUHZXEKVQICO-OAHLLOKOSA-N 1 1 358.398 2.893 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000368364992 512914949 /nfs/dbraw/zinc/91/49/49/512914949.db2.gz OORUGWSGCSLVBP-QAPCUYQASA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 ZINC000368364992 512914953 /nfs/dbraw/zinc/91/49/53/512914953.db2.gz OORUGWSGCSLVBP-QAPCUYQASA-N 1 1 357.410 2.813 20 5 FFBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC(=O)N1 ZINC000412064307 512939695 /nfs/dbraw/zinc/93/96/95/512939695.db2.gz CBQBTSHJSWVTCY-HNNXBMFYSA-N 1 1 372.425 2.781 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000396612278 512942002 /nfs/dbraw/zinc/94/20/02/512942002.db2.gz HRPUMWOOWGAKRX-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000396612278 512942007 /nfs/dbraw/zinc/94/20/07/512942007.db2.gz HRPUMWOOWGAKRX-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000412192645 512992835 /nfs/dbraw/zinc/99/28/35/512992835.db2.gz KMIKDVQIROZJOE-HOTGVXAUSA-N 1 1 361.442 2.938 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069485 512993781 /nfs/dbraw/zinc/99/37/81/512993781.db2.gz BVICIIPKITXWPG-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069485 512993786 /nfs/dbraw/zinc/99/37/86/512993786.db2.gz BVICIIPKITXWPG-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374865742 513044798 /nfs/dbraw/zinc/04/47/98/513044798.db2.gz SMBUCWNPFOYTFH-PBHICJAKSA-N 1 1 368.437 2.939 20 5 FFBDMO COCC[C@@H]1CCCC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000368678318 513058132 /nfs/dbraw/zinc/05/81/32/513058132.db2.gz UUBOBUJEWRPRPG-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CC1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000370739690 513077988 /nfs/dbraw/zinc/07/79/88/513077988.db2.gz OJBTYIZMKQZFMD-YJBOKZPZSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccncc1 ZINC000370739690 513077992 /nfs/dbraw/zinc/07/79/92/513077992.db2.gz OJBTYIZMKQZFMD-YJBOKZPZSA-N 1 1 357.410 2.813 20 5 FFBDMO Cc1c(C[NH+]2CCC3(CC2)CCS(=O)(=O)CC3)cccc1[N+](=O)[O-] ZINC000428700138 513167561 /nfs/dbraw/zinc/16/75/61/513167561.db2.gz MZJAANXVUGIXFI-UHFFFAOYSA-N 1 1 352.456 2.694 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000428779101 513188740 /nfs/dbraw/zinc/18/87/40/513188740.db2.gz DUSMSIIZDJITBN-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000428779101 513188742 /nfs/dbraw/zinc/18/87/42/513188742.db2.gz DUSMSIIZDJITBN-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000428811577 513198258 /nfs/dbraw/zinc/19/82/58/513198258.db2.gz JOUFLYILCDWNMP-FQEVSTJZSA-N 1 1 370.405 2.790 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@H](C)C1 ZINC000450459018 513204669 /nfs/dbraw/zinc/20/46/69/513204669.db2.gz VTXBGMDCMNBDQZ-OLZOCXBDSA-N 1 1 362.455 2.610 20 5 FFBDMO Cc1nc(N(C)C[C@@H]2C[C@H](F)C[N@@H+]2Cc2cccs2)ncc1[N+](=O)[O-] ZINC000450465871 513208753 /nfs/dbraw/zinc/20/87/53/513208753.db2.gz GSRJKECLUIUEKD-STQMWFEESA-N 1 1 365.434 2.804 20 5 FFBDMO Cc1nc(N(C)C[C@@H]2C[C@H](F)C[N@H+]2Cc2cccs2)ncc1[N+](=O)[O-] ZINC000450465871 513208763 /nfs/dbraw/zinc/20/87/63/513208763.db2.gz GSRJKECLUIUEKD-STQMWFEESA-N 1 1 365.434 2.804 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000412697958 513230921 /nfs/dbraw/zinc/23/09/21/513230921.db2.gz MYPLRAZGXNDWND-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000412697958 513230928 /nfs/dbraw/zinc/23/09/28/513230928.db2.gz MYPLRAZGXNDWND-INIZCTEOSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000428992583 513243114 /nfs/dbraw/zinc/24/31/14/513243114.db2.gz BHAUZZYUBWEZOP-CPUCHLNUSA-N 1 1 371.441 2.807 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020146 513258609 /nfs/dbraw/zinc/25/86/09/513258609.db2.gz MQHBXDXHCUTVDK-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@@H]1N1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020146 513258614 /nfs/dbraw/zinc/25/86/14/513258614.db2.gz MQHBXDXHCUTVDK-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@@H]1N1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000429020146 513258620 /nfs/dbraw/zinc/25/86/20/513258620.db2.gz MQHBXDXHCUTVDK-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCCN(c3cc[nH+]c(N4CCOCC4)n3)C2)cc1 ZINC000450757748 513326953 /nfs/dbraw/zinc/32/69/53/513326953.db2.gz LGVPVXQGJBBNDR-INIZCTEOSA-N 1 1 369.425 2.605 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+](C3CCC3)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000429354814 513348547 /nfs/dbraw/zinc/34/85/47/513348547.db2.gz PAKCRGZTXGJPTQ-OAHLLOKOSA-N 1 1 363.458 2.788 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000425059279 513396464 /nfs/dbraw/zinc/39/64/64/513396464.db2.gz RATYDPPWOLGGBK-XJKSGUPXSA-N 1 1 372.450 2.885 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@]2([NH+]3CCOCC3)CCSC2)c2cccnc21 ZINC000413063614 513418109 /nfs/dbraw/zinc/41/81/09/513418109.db2.gz AVGKHOQQDFZMHV-SFHVURJKSA-N 1 1 374.466 2.763 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c1C ZINC000434777474 513426963 /nfs/dbraw/zinc/42/69/63/513426963.db2.gz UPIMJSYEOBIEOO-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1C ZINC000434777474 513426969 /nfs/dbraw/zinc/42/69/69/513426969.db2.gz UPIMJSYEOBIEOO-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c(C(F)(F)F)c1 ZINC000413146623 513480897 /nfs/dbraw/zinc/48/08/97/513480897.db2.gz XNHFPADPFCQFBP-GFCCVEGCSA-N 1 1 374.363 2.557 20 5 FFBDMO CN(C)C(=O)CC[NH+]1CCC(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447532210 513501050 /nfs/dbraw/zinc/50/10/50/513501050.db2.gz VBBMJKIISUERKU-LJQANCHMSA-N 1 1 374.485 2.505 20 5 FFBDMO O=[N+]([O-])c1cnc(NCC2(C[NH+]3CCOCC3)CCCCC2)c(F)c1 ZINC000413183918 513505339 /nfs/dbraw/zinc/50/53/39/513505339.db2.gz WKHGLRAQOHQLPV-UHFFFAOYSA-N 1 1 352.410 2.824 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)n2)c1 ZINC000441197560 513509147 /nfs/dbraw/zinc/50/91/47/513509147.db2.gz AXLDZGXMWAWUJV-LSDHHAIUSA-N 1 1 358.398 2.893 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000416167494 513616029 /nfs/dbraw/zinc/61/60/29/513616029.db2.gz SCRWFQJFWSEPRT-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])cc1F ZINC000451294019 513659496 /nfs/dbraw/zinc/65/94/96/513659496.db2.gz ISOICFZDTIRGFS-OAHLLOKOSA-N 1 1 353.394 2.593 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1 ZINC000451429464 513745511 /nfs/dbraw/zinc/74/55/11/513745511.db2.gz XJFUIENKAIMNBX-UXLLHSPISA-N 1 1 350.415 2.608 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@H+](Cc3ccccc3)CCO1)CCN2 ZINC000436271581 513813628 /nfs/dbraw/zinc/81/36/28/513813628.db2.gz PZAPMDVAOOYFQJ-INIZCTEOSA-N 1 1 368.437 2.876 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@@H+](Cc3ccccc3)CCO1)CCN2 ZINC000436271581 513813632 /nfs/dbraw/zinc/81/36/32/513813632.db2.gz PZAPMDVAOOYFQJ-INIZCTEOSA-N 1 1 368.437 2.876 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C ZINC000451552578 513827435 /nfs/dbraw/zinc/82/74/35/513827435.db2.gz YWVCWUMXJCMTQA-CJNGLKHVSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448780393 513894114 /nfs/dbraw/zinc/89/41/14/513894114.db2.gz JTEABVRVSHWLKH-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)o2)cc1 ZINC000451714598 513933388 /nfs/dbraw/zinc/93/33/88/513933388.db2.gz SIBCTDXKSSOTIX-YCPHGPKFSA-N 1 1 358.398 2.628 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)N=c1cc(-c2cccc([N+](=O)[O-])c2)[nH][nH]1 ZINC000431786287 514001591 /nfs/dbraw/zinc/00/15/91/514001591.db2.gz SACQPYJKXQZINJ-AWEZNQCLSA-N 1 1 357.414 2.610 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@@]3(CCSC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451963917 514098517 /nfs/dbraw/zinc/09/85/17/514098517.db2.gz IFCUVJNFIAGETF-FUHWJXTLSA-N 1 1 361.467 2.919 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000423426007 514139401 /nfs/dbraw/zinc/13/94/01/514139401.db2.gz OSBFRNIOAKUNNA-MPGHIAIKSA-N 1 1 357.458 2.772 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432319859 514158027 /nfs/dbraw/zinc/15/80/27/514158027.db2.gz JLNFEFOZHVXNJB-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO Cc1cc(S(=O)(=O)N2C[C@H](C)[NH2+]Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000420466622 514158623 /nfs/dbraw/zinc/15/86/23/514158623.db2.gz XCQYSUBVXUSSGE-ZDUSSCGKSA-N 1 1 361.423 2.590 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452055980 514165924 /nfs/dbraw/zinc/16/59/24/514165924.db2.gz VOFCRNHPMOPZJL-QUHUKJRKSA-N 1 1 359.426 2.910 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432346659 514168419 /nfs/dbraw/zinc/16/84/19/514168419.db2.gz LSEVFTFPFGUJGY-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c2c(c1)COCO2 ZINC000449455050 514217193 /nfs/dbraw/zinc/21/71/93/514217193.db2.gz QEBYSMRJMBFYSK-KURKYZTESA-N 1 1 362.426 2.977 20 5 FFBDMO CN(CC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000437854713 514251324 /nfs/dbraw/zinc/25/13/24/514251324.db2.gz ZWMMBCCJVSQSFB-QGZVFWFLSA-N 1 1 374.485 2.944 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444608526 514272905 /nfs/dbraw/zinc/27/29/05/514272905.db2.gz LHWPWIRVOSFCFR-ZDUSSCGKSA-N 1 1 359.430 2.599 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444608526 514272913 /nfs/dbraw/zinc/27/29/13/514272913.db2.gz LHWPWIRVOSFCFR-ZDUSSCGKSA-N 1 1 359.430 2.599 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@@H]1c1ccncc1 ZINC000423959598 514309056 /nfs/dbraw/zinc/30/90/56/514309056.db2.gz CLSKKZRLGXDLDJ-SUMWQHHRSA-N 1 1 372.450 2.644 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N[C@H](C[NH+]3CCOCC3)c3ccccc3)nc2c1 ZINC000427981436 514366123 /nfs/dbraw/zinc/36/61/23/514366123.db2.gz CZHBFDBQKRHRNB-GOSISDBHSA-N 1 1 367.409 2.957 20 5 FFBDMO CC(C)c1ccc(CNC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000414986642 514387774 /nfs/dbraw/zinc/38/77/74/514387774.db2.gz NWRHHNIQYOMOMO-MRXNPFEDSA-N 1 1 374.407 2.644 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NCC2([N@@H+](C)Cc3ccccc3)CCC2)n1 ZINC000452732732 514478215 /nfs/dbraw/zinc/47/82/15/514478215.db2.gz QIXKZLZASZLFOB-UHFFFAOYSA-N 1 1 371.441 2.596 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000428533447 514490831 /nfs/dbraw/zinc/49/08/31/514490831.db2.gz DNEXTWIYIXAIPN-UHFFFAOYSA-N 1 1 354.815 2.942 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C(C)C ZINC000453023699 514607046 /nfs/dbraw/zinc/60/70/46/514607046.db2.gz CJHJBNRLDLFVPK-IRXDYDNUSA-N 1 1 354.472 2.981 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]1C(C)C ZINC000453023699 514607059 /nfs/dbraw/zinc/60/70/59/514607059.db2.gz CJHJBNRLDLFVPK-IRXDYDNUSA-N 1 1 354.472 2.981 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+][C@@H](C)C(=O)N3CCCC3)o2)c([N+](=O)[O-])c1 ZINC000466391266 514633778 /nfs/dbraw/zinc/63/37/78/514633778.db2.gz XVOSFSVELBIWOC-ZDUSSCGKSA-N 1 1 373.409 2.964 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000484642772 514725869 /nfs/dbraw/zinc/72/58/69/514725869.db2.gz VRBSXXNQACPRGS-OAHLLOKOSA-N 1 1 368.437 2.795 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000484717680 514761444 /nfs/dbraw/zinc/76/14/44/514761444.db2.gz YPUKDLCKKOCSFG-UHFFFAOYSA-N 1 1 368.437 2.663 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000471382454 514860318 /nfs/dbraw/zinc/86/03/18/514860318.db2.gz PMLXVVYXCFVZBJ-KDURUIRLSA-N 1 1 365.433 2.728 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000498567939 514975147 /nfs/dbraw/zinc/97/51/47/514975147.db2.gz XIRNHENQJZLUNZ-GJZGRUSLSA-N 1 1 360.458 2.750 20 5 FFBDMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H]1CCSC1 ZINC000456192246 515013519 /nfs/dbraw/zinc/01/35/19/515013519.db2.gz ROFWONADMCQRNM-CYBMUJFWSA-N 1 1 352.460 2.791 20 5 FFBDMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H]1CCSC1 ZINC000456192246 515013528 /nfs/dbraw/zinc/01/35/28/515013528.db2.gz ROFWONADMCQRNM-CYBMUJFWSA-N 1 1 352.460 2.791 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000490204020 515140337 /nfs/dbraw/zinc/14/03/37/515140337.db2.gz SKPSJCBKKVNGSV-QWQRMKEZSA-N 1 1 360.458 2.775 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1C ZINC000480936773 515142131 /nfs/dbraw/zinc/14/21/31/515142131.db2.gz PBLYPVCNVNZIEX-CQSZACIVSA-N 1 1 369.487 2.754 20 5 FFBDMO C[C@@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849781 515146664 /nfs/dbraw/zinc/14/66/64/515146664.db2.gz IRKZSXCAQWFDJD-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849781 515146666 /nfs/dbraw/zinc/14/66/66/515146666.db2.gz IRKZSXCAQWFDJD-OXQOHEQNSA-N 1 1 355.438 2.882 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000481009001 515171725 /nfs/dbraw/zinc/17/17/25/515171725.db2.gz FRIGKNOAGPTEJA-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000472340590 515234691 /nfs/dbraw/zinc/23/46/91/515234691.db2.gz NMGIIXQONJYFML-QGZVFWFLSA-N 1 1 362.474 2.713 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC000509638079 515268036 /nfs/dbraw/zinc/26/80/36/515268036.db2.gz BGKJWXXFFZREBG-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C ZINC000509638079 515268044 /nfs/dbraw/zinc/26/80/44/515268044.db2.gz BGKJWXXFFZREBG-TUAOUCFPSA-N 1 1 355.822 2.567 20 5 FFBDMO COc1cc(C[NH2+]Cc2c3c(nn2C)CCCC3)c([N+](=O)[O-])cc1OC ZINC000462870971 515276069 /nfs/dbraw/zinc/27/60/69/515276069.db2.gz MNCJUOQAUVMDCS-UHFFFAOYSA-N 1 1 360.414 2.514 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653477 515277243 /nfs/dbraw/zinc/27/72/43/515277243.db2.gz ANIWQEDARCDFSL-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653477 515277252 /nfs/dbraw/zinc/27/72/52/515277252.db2.gz ANIWQEDARCDFSL-RYUDHWBXSA-N 1 1 360.439 2.883 20 5 FFBDMO CNc1c(C(=O)NC2CCN(c3cccc(C)[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000462984867 515322773 /nfs/dbraw/zinc/32/27/73/515322773.db2.gz DAVNBTIWKWWCRR-UHFFFAOYSA-N 1 1 369.425 2.739 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491061870 515365954 /nfs/dbraw/zinc/36/59/54/515365954.db2.gz TYDXZYGYAPIKAH-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO CCN1CCC[C@@H]1C[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491061870 515365964 /nfs/dbraw/zinc/36/59/64/515365964.db2.gz TYDXZYGYAPIKAH-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000468456739 515366331 /nfs/dbraw/zinc/36/63/31/515366331.db2.gz IONUGPFPMVSVHU-QGZVFWFLSA-N 1 1 358.442 2.786 20 5 FFBDMO CCOc1ccc(C(=O)N[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481714290 515434267 /nfs/dbraw/zinc/43/42/67/515434267.db2.gz NQZGTSPIJBFFKK-DLBZAZTESA-N 1 1 369.421 2.821 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@@H+]1CCCC[C@@H]1C ZINC000468710788 515481907 /nfs/dbraw/zinc/48/19/07/515481907.db2.gz IHXNCVXCMSCVOL-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[N@H+]1CCCC[C@@H]1C ZINC000468710788 515481915 /nfs/dbraw/zinc/48/19/15/515481915.db2.gz IHXNCVXCMSCVOL-QWHCGFSZSA-N 1 1 355.460 2.673 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC000468740936 515497673 /nfs/dbraw/zinc/49/76/73/515497673.db2.gz VERKGYDSJZPMPG-KFZAOVKASA-N 1 1 359.470 2.966 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000468740936 515497683 /nfs/dbraw/zinc/49/76/83/515497683.db2.gz VERKGYDSJZPMPG-KFZAOVKASA-N 1 1 359.470 2.966 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486488952 515507875 /nfs/dbraw/zinc/50/78/75/515507875.db2.gz PFFPVEXKQULAKS-LBPRGKRZSA-N 1 1 355.385 2.796 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000481985227 515537945 /nfs/dbraw/zinc/53/79/45/515537945.db2.gz XTJFQTHCAWAIDZ-CYBMUJFWSA-N 1 1 368.397 2.837 20 5 FFBDMO CCOc1cc(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000500122866 515599616 /nfs/dbraw/zinc/59/96/16/515599616.db2.gz QAYBRNPHBFVTLU-CHWSQXEVSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@H]2C)cc1OC ZINC000500124133 515601539 /nfs/dbraw/zinc/60/15/39/515601539.db2.gz UTFVEKWHFGEIJZ-QWHCGFSZSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C(NCc1ccccc1C[NH+]1CCCC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505752406 515656840 /nfs/dbraw/zinc/65/68/40/515656840.db2.gz DWBSTRMBISYSQH-UHFFFAOYSA-N 1 1 355.394 2.826 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000486876631 515670021 /nfs/dbraw/zinc/67/00/21/515670021.db2.gz WLMFEHYEFKUERV-NSHDSACASA-N 1 1 366.418 2.542 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)n1 ZINC000478036304 515676326 /nfs/dbraw/zinc/67/63/26/515676326.db2.gz YGGKTHVIHGFIJS-UHFFFAOYSA-N 1 1 351.794 2.779 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](COc3ccccc3)C2)c1 ZINC000505861688 515700658 /nfs/dbraw/zinc/70/06/58/515700658.db2.gz FIXCDQCAKZAZGB-AEFFLSMTSA-N 1 1 372.421 2.735 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1ccc(Br)cc1[N+](=O)[O-])C1CC1 ZINC000457168937 515701141 /nfs/dbraw/zinc/70/11/41/515701141.db2.gz OXBSNVLDLSFFHE-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1cccc(CNC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511071383 515767998 /nfs/dbraw/zinc/76/79/98/515767998.db2.gz DLCPIWUQZSIKRF-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO COc1cccc(CNC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511071383 515768007 /nfs/dbraw/zinc/76/80/07/515768007.db2.gz DLCPIWUQZSIKRF-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO Cn1nc(C(C)(C)C)cc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511109411 515786092 /nfs/dbraw/zinc/78/60/92/515786092.db2.gz RUYXDFMWSWBZSF-UHFFFAOYSA-N 1 1 373.457 2.739 20 5 FFBDMO Cn1nc(C(C)(C)C)cc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511109411 515786097 /nfs/dbraw/zinc/78/60/97/515786097.db2.gz RUYXDFMWSWBZSF-UHFFFAOYSA-N 1 1 373.457 2.739 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](CN(C)S(C)(=O)=O)C1 ZINC000511124729 515793464 /nfs/dbraw/zinc/79/34/64/515793464.db2.gz LTDUJBQQKDPEOL-LSDHHAIUSA-N 1 1 369.487 2.568 20 5 FFBDMO CO[C@@H]1C[C@@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000459780960 515801741 /nfs/dbraw/zinc/80/17/41/515801741.db2.gz MCRGSLCHNPLBSM-ZACQAIPSSA-N 1 1 356.426 2.965 20 5 FFBDMO C[NH+](C)CCCOc1ccc(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC000506190627 515810390 /nfs/dbraw/zinc/81/03/90/515810390.db2.gz LRHYWVAZPJTBIA-UHFFFAOYSA-N 1 1 373.409 2.561 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459808458 515822552 /nfs/dbraw/zinc/82/25/52/515822552.db2.gz OWISYXUYBKGMAO-QWHCGFSZSA-N 1 1 365.430 2.831 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)n1 ZINC000500753077 515842103 /nfs/dbraw/zinc/84/21/03/515842103.db2.gz ZZMKTXQNEGDMMU-UHFFFAOYSA-N 1 1 351.794 2.779 20 5 FFBDMO CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000469508709 515846617 /nfs/dbraw/zinc/84/66/17/515846617.db2.gz OSEYIXGCGREOMR-MRXNPFEDSA-N 1 1 358.442 2.820 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000511368533 515880939 /nfs/dbraw/zinc/88/09/39/515880939.db2.gz FKXGSKGPWJMMND-CYBMUJFWSA-N 1 1 369.425 2.622 20 5 FFBDMO Cc1ccncc1C[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000483050549 515903153 /nfs/dbraw/zinc/90/31/53/515903153.db2.gz RBRGVXRVGIMUBS-UHFFFAOYSA-N 1 1 356.382 2.728 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)ncc1[N+](=O)[O-] ZINC000474152234 515907370 /nfs/dbraw/zinc/90/73/70/515907370.db2.gz TZWLQGASRSYUCW-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000483115965 515934908 /nfs/dbraw/zinc/93/49/08/515934908.db2.gz DMXIYHUAFHIBFI-YJBOKZPZSA-N 1 1 360.385 2.963 20 5 FFBDMO C[C@@H](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000506699609 515957777 /nfs/dbraw/zinc/95/77/77/515957777.db2.gz UQPXQXKPMMNAFL-AWEZNQCLSA-N 1 1 357.410 2.941 20 5 FFBDMO C[C@@H](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000506699609 515957786 /nfs/dbraw/zinc/95/77/86/515957786.db2.gz UQPXQXKPMMNAFL-AWEZNQCLSA-N 1 1 357.410 2.941 20 5 FFBDMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000469996613 516068912 /nfs/dbraw/zinc/06/89/12/516068912.db2.gz PBASSNOBLMKARE-TZMCWYRMSA-N 1 1 362.348 2.997 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1C[C@H](C)[N@@H+](CC)C[C@H]1C ZINC000460208859 516069191 /nfs/dbraw/zinc/06/91/91/516069191.db2.gz HPXRHCGOIZWVCR-UONOGXRCSA-N 1 1 358.446 2.792 20 5 FFBDMO CNC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000507104192 516090276 /nfs/dbraw/zinc/09/02/76/516090276.db2.gz QKKAGYWYICBARL-MRXNPFEDSA-N 1 1 373.409 2.964 20 5 FFBDMO CNC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000507104192 516090286 /nfs/dbraw/zinc/09/02/86/516090286.db2.gz QKKAGYWYICBARL-MRXNPFEDSA-N 1 1 373.409 2.964 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3c4ccccc4ncc3[N+](=O)[O-])CC2)CCO1 ZINC000488063182 516102193 /nfs/dbraw/zinc/10/21/93/516102193.db2.gz JGZLOBBVGVJYFT-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO CCOCC[N@H+]1CCN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@H]1CC ZINC000470123314 516129352 /nfs/dbraw/zinc/12/93/52/516129352.db2.gz DVCFFYSDBNMUNG-OAHLLOKOSA-N 1 1 368.409 2.699 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512147842 516173541 /nfs/dbraw/zinc/17/35/41/516173541.db2.gz VJSLXMYJUPBDTD-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C[C@H]1C ZINC000495473973 516175420 /nfs/dbraw/zinc/17/54/20/516175420.db2.gz KSTISRNWMBNZTH-HUUCEWRRSA-N 1 1 371.441 2.725 20 5 FFBDMO Cc1ccc2c(c1)C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CCO2 ZINC000512294131 516227313 /nfs/dbraw/zinc/22/73/13/516227313.db2.gz VYSVWHBIQIGBDI-KRWDZBQOSA-N 1 1 358.394 2.538 20 5 FFBDMO Cc1ccc2c(c1)C[N@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CCO2 ZINC000512294131 516227321 /nfs/dbraw/zinc/22/73/21/516227321.db2.gz VYSVWHBIQIGBDI-KRWDZBQOSA-N 1 1 358.394 2.538 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000507603734 516260739 /nfs/dbraw/zinc/26/07/39/516260739.db2.gz KFQDIVDRBRRBRL-DOTOQJQBSA-N 1 1 369.421 2.925 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@@H]1C ZINC000535383500 516334377 /nfs/dbraw/zinc/33/43/77/516334377.db2.gz CJWIJJGCCGTMPC-DZGCQCFKSA-N 1 1 358.442 2.950 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](COC(F)F)C3)n2)c1 ZINC000512811832 516369891 /nfs/dbraw/zinc/36/98/91/516369891.db2.gz LTHBXOLXXNEJNK-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](COC(F)F)C3)n2)c1 ZINC000512811832 516369900 /nfs/dbraw/zinc/36/99/00/516369900.db2.gz LTHBXOLXXNEJNK-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](COC(F)F)C1 ZINC000512822376 516375350 /nfs/dbraw/zinc/37/53/50/516375350.db2.gz GJTNQEQZWPUNDJ-GFCCVEGCSA-N 1 1 357.357 2.793 20 5 FFBDMO CC[N@@H+](CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(C)C ZINC000523291403 516425695 /nfs/dbraw/zinc/42/56/95/516425695.db2.gz IFYZQSJXXXAJQM-UHFFFAOYSA-N 1 1 362.474 2.658 20 5 FFBDMO CCCn1nc(C)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1C ZINC000535785466 516509531 /nfs/dbraw/zinc/50/95/31/516509531.db2.gz OKFWGHNISZZZKN-UHFFFAOYSA-N 1 1 358.446 2.535 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000523595145 516515426 /nfs/dbraw/zinc/51/54/26/516515426.db2.gz SUXLISMTCMHKBB-XHSDSOJGSA-N 1 1 362.474 2.803 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000547764846 516549047 /nfs/dbraw/zinc/54/90/47/516549047.db2.gz DKXCZVXABLOYHB-QGZVFWFLSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000547764846 516549056 /nfs/dbraw/zinc/54/90/56/516549056.db2.gz DKXCZVXABLOYHB-QGZVFWFLSA-N 1 1 354.410 2.623 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000531607032 516550713 /nfs/dbraw/zinc/55/07/13/516550713.db2.gz XCPJBBWNIGKHJN-QWHZDKJVSA-N 1 1 370.453 2.820 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccnc(N2CCOCC2)c1 ZINC000554686816 516586522 /nfs/dbraw/zinc/58/65/22/516586522.db2.gz YEIHFINVSGDJQJ-UHFFFAOYSA-N 1 1 372.425 2.515 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000536034248 516600328 /nfs/dbraw/zinc/60/03/28/516600328.db2.gz FISZDKFCPAJYGS-KRWDZBQOSA-N 1 1 354.410 2.700 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000536034248 516600334 /nfs/dbraw/zinc/60/03/34/516600334.db2.gz FISZDKFCPAJYGS-KRWDZBQOSA-N 1 1 354.410 2.700 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000518505358 516685263 /nfs/dbraw/zinc/68/52/63/516685263.db2.gz PNMRKFINUBDHIV-MRXNPFEDSA-N 1 1 368.437 2.652 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000551402165 516693401 /nfs/dbraw/zinc/69/34/01/516693401.db2.gz VUIYWHUSHHPSBC-GOSISDBHSA-N 1 1 355.438 2.962 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c1 ZINC000554962274 516721231 /nfs/dbraw/zinc/72/12/31/516721231.db2.gz RTOVMBRMNRWQFC-UHFFFAOYSA-N 1 1 370.409 2.659 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000544393283 516739852 /nfs/dbraw/zinc/73/98/52/516739852.db2.gz FNFIUCLANFGYRZ-GXSJLCMTSA-N 1 1 357.252 2.837 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C[C@@H](C)C1 ZINC000561749738 516747380 /nfs/dbraw/zinc/74/73/80/516747380.db2.gz ZARHAHARDYIDOX-IYOUNJFTSA-N 1 1 368.437 2.945 20 5 FFBDMO Cc1cc(NCCC[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555119236 516791218 /nfs/dbraw/zinc/79/12/18/516791218.db2.gz AYWYOYUPHDDHRF-UHFFFAOYSA-N 1 1 360.380 2.971 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])cn3C)cc2)C1 ZINC000524770152 516823904 /nfs/dbraw/zinc/82/39/04/516823904.db2.gz GACYYJSNTGBBSH-CQSZACIVSA-N 1 1 372.425 2.906 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1cccc(F)c1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000541019117 516832172 /nfs/dbraw/zinc/83/21/72/516832172.db2.gz GFGWWBVXIFZQNL-CQSZACIVSA-N 1 1 367.764 2.649 20 5 FFBDMO CN(C)CC[NH+]1CCC(N[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000514608266 516961428 /nfs/dbraw/zinc/96/14/28/516961428.db2.gz MPQVORVYTRZOLB-INIZCTEOSA-N 1 1 374.407 2.814 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234657 516971677 /nfs/dbraw/zinc/97/16/77/516971677.db2.gz XYWDZGPBJIBBDW-HNNXBMFYSA-N 1 1 350.463 2.569 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000532540901 517025933 /nfs/dbraw/zinc/02/59/33/517025933.db2.gz QNAQJGOIOBHCHD-LJQANCHMSA-N 1 1 374.485 2.752 20 5 FFBDMO C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000525468557 517051820 /nfs/dbraw/zinc/05/18/20/517051820.db2.gz AHALPUOEIGRXDI-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO C[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000525468557 517051829 /nfs/dbraw/zinc/05/18/29/517051829.db2.gz AHALPUOEIGRXDI-BEFAXECRSA-N 1 1 369.421 2.614 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000537174303 517069309 /nfs/dbraw/zinc/06/93/09/517069309.db2.gz FCFAIJMOMYMXKE-OAHLLOKOSA-N 1 1 361.373 2.958 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cc1ccccc1[N+](=O)[O-] ZINC000552112193 517086024 /nfs/dbraw/zinc/08/60/24/517086024.db2.gz QYRSGLNWMVUVGO-UHFFFAOYSA-N 1 1 356.426 2.513 20 5 FFBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC1 ZINC000514880025 517106987 /nfs/dbraw/zinc/10/69/87/517106987.db2.gz DQFTXVOWVMBEIC-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000537312126 517139543 /nfs/dbraw/zinc/13/95/43/517139543.db2.gz QZRAOTFSGRGIPN-OAHLLOKOSA-N 1 1 361.442 2.805 20 5 FFBDMO CC[N@@H+](CCc1cccs1)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000519905518 517238612 /nfs/dbraw/zinc/23/86/12/517238612.db2.gz PIYMLXKXFZYWRD-HNNXBMFYSA-N 1 1 350.440 2.961 20 5 FFBDMO COc1ccc(CC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000532991011 517241962 /nfs/dbraw/zinc/24/19/62/517241962.db2.gz CVSQWZHDWXAWST-RDJZCZTQSA-N 1 1 373.453 2.621 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccc(O)cc2C1 ZINC000533071272 517278470 /nfs/dbraw/zinc/27/84/70/517278470.db2.gz PUMFYQIIJYHWRT-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541924623 517294210 /nfs/dbraw/zinc/29/42/10/517294210.db2.gz HYRXRJHSJBMNJW-LSDHHAIUSA-N 1 1 369.425 2.538 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000541956680 517311010 /nfs/dbraw/zinc/31/10/10/517311010.db2.gz VXUOZBCXCZFAPX-OAHLLOKOSA-N 1 1 367.764 2.649 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H]1C ZINC000520274584 517326866 /nfs/dbraw/zinc/32/68/66/517326866.db2.gz MRKPMEXVRJFTEY-KDOFPFPSSA-N 1 1 369.421 2.996 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000542030228 517346705 /nfs/dbraw/zinc/34/67/05/517346705.db2.gz RGKFLFWBTVVKQR-CHWSQXEVSA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000552973324 517460507 /nfs/dbraw/zinc/46/05/07/517460507.db2.gz RNWGMLUQKCKGEJ-LLVKDONJSA-N 1 1 360.439 2.614 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2n[nH]cc2Br)n1 ZINC000520720103 517489576 /nfs/dbraw/zinc/48/95/76/517489576.db2.gz NEJCNZKZSDWYNK-CMPLNLGQSA-N 1 1 369.223 2.550 20 5 FFBDMO O=C(c1ccc(F)cc1)N1CCCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC000549336982 517518210 /nfs/dbraw/zinc/51/82/10/517518210.db2.gz FILCFIVMQDIVAX-UHFFFAOYSA-N 1 1 373.384 2.788 20 5 FFBDMO O=C(NC[C@H]([NH2+]Cc1ccccc1)c1ccco1)c1ccc([N+](=O)[O-])[nH]1 ZINC000553212815 517578728 /nfs/dbraw/zinc/57/87/28/517578728.db2.gz XXAOAFYVVQBGAF-HNNXBMFYSA-N 1 1 354.366 2.777 20 5 FFBDMO COc1ccc(CNC(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000521131645 517624172 /nfs/dbraw/zinc/62/41/72/517624172.db2.gz NAOIWFIXPCXQNJ-QGZVFWFLSA-N 1 1 369.421 2.884 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC(C[N@H+](C)C(C)C)CC1 ZINC000521210550 517651239 /nfs/dbraw/zinc/65/12/39/517651239.db2.gz UFBBJHMVPHKYNP-UHFFFAOYSA-N 1 1 369.487 2.644 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000516500814 517712645 /nfs/dbraw/zinc/71/26/45/517712645.db2.gz OLMPWWDAEBKMAH-SJORKVTESA-N 1 1 372.469 2.554 20 5 FFBDMO CCC[C@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC[N@H+]1Cc1ccccc1 ZINC000553622444 517817513 /nfs/dbraw/zinc/81/75/13/517817513.db2.gz WJXCQMZMRMKGSA-KRWDZBQOSA-N 1 1 357.458 2.815 20 5 FFBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000534271727 517818737 /nfs/dbraw/zinc/81/87/37/517818737.db2.gz FWVCYQSBLAGEMP-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920912 517844740 /nfs/dbraw/zinc/84/47/40/517844740.db2.gz ZPBUZUKKNPTTHY-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920912 517844749 /nfs/dbraw/zinc/84/47/49/517844749.db2.gz ZPBUZUKKNPTTHY-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccc(S(N)(=O)=O)c1 ZINC000543063324 517890841 /nfs/dbraw/zinc/89/08/41/517890841.db2.gz LYKRLKGJOZSRPZ-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])n2C)cc1)[NH+]1CCOCC1 ZINC000522020348 517953955 /nfs/dbraw/zinc/95/39/55/517953955.db2.gz PZMIEQWBIAYBFN-CYBMUJFWSA-N 1 1 358.398 2.579 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000522200995 518030306 /nfs/dbraw/zinc/03/03/06/518030306.db2.gz BBJGUZMIHRNKMQ-CHWSQXEVSA-N 1 1 369.849 2.862 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCc3ccccc3C2)n1 ZINC000557520241 518050953 /nfs/dbraw/zinc/05/09/53/518050953.db2.gz ZEXGSGWLISMTMJ-UHFFFAOYSA-N 1 1 370.409 2.637 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000543437168 518090443 /nfs/dbraw/zinc/09/04/43/518090443.db2.gz SAWBGHOSHTYCNP-CMPLNLGQSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3CC[N@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC000543437168 518090444 /nfs/dbraw/zinc/09/04/44/518090444.db2.gz SAWBGHOSHTYCNP-CMPLNLGQSA-N 1 1 355.236 2.591 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccc(NCc3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000539669585 518134907 /nfs/dbraw/zinc/13/49/07/518134907.db2.gz CAABGCSOGMNJFV-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCCC[C@H]1C ZINC000535282374 518173101 /nfs/dbraw/zinc/17/31/01/518173101.db2.gz VVUAHSCYWNADNB-CABCVRRESA-N 1 1 360.458 2.925 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000535294330 518173505 /nfs/dbraw/zinc/17/35/05/518173505.db2.gz NFKIONFUIYLOCM-LJQANCHMSA-N 1 1 366.421 2.849 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000535294330 518173507 /nfs/dbraw/zinc/17/35/07/518173507.db2.gz NFKIONFUIYLOCM-LJQANCHMSA-N 1 1 366.421 2.849 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569674768 518232531 /nfs/dbraw/zinc/23/25/31/518232531.db2.gz WGHVZNHPQUFWPF-GFCCVEGCSA-N 1 1 353.394 2.689 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584677002 518424635 /nfs/dbraw/zinc/42/46/35/518424635.db2.gz HHRXONDGPLHDDQ-CYBMUJFWSA-N 1 1 361.446 2.648 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000582010426 518545294 /nfs/dbraw/zinc/54/52/94/518545294.db2.gz AZAPOQVMSVSQNP-JTQLQIEISA-N 1 1 358.236 2.816 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376485 518651431 /nfs/dbraw/zinc/65/14/31/518651431.db2.gz SPDCCAOKOPDTNM-PZJWPPBQSA-N 1 1 367.449 2.809 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000579376485 518651435 /nfs/dbraw/zinc/65/14/35/518651435.db2.gz SPDCCAOKOPDTNM-PZJWPPBQSA-N 1 1 367.449 2.809 20 5 FFBDMO O=C(C[N@H+]1CCSC2(CCC2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000576604710 518673731 /nfs/dbraw/zinc/67/37/31/518673731.db2.gz VQBNLMHXGJDMAB-UHFFFAOYSA-N 1 1 361.467 2.846 20 5 FFBDMO C[C@@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1 ZINC000570591085 518682478 /nfs/dbraw/zinc/68/24/78/518682478.db2.gz DQVRRWMYTQQORM-HOTGVXAUSA-N 1 1 362.474 2.899 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000588007563 518698885 /nfs/dbraw/zinc/69/88/85/518698885.db2.gz HMRSSSALSLPDNY-HNNXBMFYSA-N 1 1 356.382 2.683 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000588007563 518698890 /nfs/dbraw/zinc/69/88/90/518698890.db2.gz HMRSSSALSLPDNY-HNNXBMFYSA-N 1 1 356.382 2.683 20 5 FFBDMO CCc1cc(N[C@@H]2CCc3c[nH+]cn3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000588067778 518714786 /nfs/dbraw/zinc/71/47/86/518714786.db2.gz PBBQCRZCFZNZCI-OAHLLOKOSA-N 1 1 364.409 2.660 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000573852970 518865911 /nfs/dbraw/zinc/86/59/11/518865911.db2.gz JJIVMJBOJKNIRH-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO COc1cccc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000582708313 518883517 /nfs/dbraw/zinc/88/35/17/518883517.db2.gz XTUUDSGBBAWKNI-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCCO1 ZINC000579858520 518890619 /nfs/dbraw/zinc/89/06/19/518890619.db2.gz FDFJXHKPAYMXHH-KRWDZBQOSA-N 1 1 363.414 2.640 20 5 FFBDMO Cc1c(C[N@@H+](C)CCn2cc(Br)cn2)cccc1[N+](=O)[O-] ZINC000568321278 518979242 /nfs/dbraw/zinc/97/92/42/518979242.db2.gz HDBBTLXYPJRRLK-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO COCc1nc(C[NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)cs1 ZINC000589348875 518985813 /nfs/dbraw/zinc/98/58/13/518985813.db2.gz QJURSINSASHZAL-LLVKDONJSA-N 1 1 364.427 2.705 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000577315307 519018129 /nfs/dbraw/zinc/01/81/29/519018129.db2.gz TZBSIUWCGJMKBA-INIZCTEOSA-N 1 1 373.457 2.792 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCCC[C@H]2C[C@H](C)O)c1 ZINC000589518592 519023960 /nfs/dbraw/zinc/02/39/60/519023960.db2.gz ZVZJQDJXLLWYLH-BBRMVZONSA-N 1 1 350.415 2.897 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCC3(C2)Oc2ccccc2O3)c([N+](=O)[O-])c1 ZINC000571359699 519056107 /nfs/dbraw/zinc/05/61/07/519056107.db2.gz RLBKAXIRRQDHIT-UHFFFAOYSA-N 1 1 372.377 2.856 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC3(C2)Oc2ccccc2O3)c([N+](=O)[O-])c1 ZINC000571359699 519056113 /nfs/dbraw/zinc/05/61/13/519056113.db2.gz RLBKAXIRRQDHIT-UHFFFAOYSA-N 1 1 372.377 2.856 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000583232107 519140912 /nfs/dbraw/zinc/14/09/12/519140912.db2.gz VAHGXHGJKFEXOL-NSHDSACASA-N 1 1 357.357 2.909 20 5 FFBDMO COc1ccc(CC(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000577597548 519158381 /nfs/dbraw/zinc/15/83/81/519158381.db2.gz FNTBWCVPOOUMBE-OAHLLOKOSA-N 1 1 371.437 2.783 20 5 FFBDMO Cc1cc(N2CC[NH+]([C@@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590137865 519160481 /nfs/dbraw/zinc/16/04/81/519160481.db2.gz HCPYHBKTGBYKAF-GFCCVEGCSA-N 1 1 359.348 2.833 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590158193 519164228 /nfs/dbraw/zinc/16/42/28/519164228.db2.gz FTMVXKVELBDBID-MNOVXSKESA-N 1 1 357.332 2.970 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000590579368 519273991 /nfs/dbraw/zinc/27/39/91/519273991.db2.gz YSMFMZLILOKTIC-OAHLLOKOSA-N 1 1 370.409 2.853 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000590602690 519286297 /nfs/dbraw/zinc/28/62/97/519286297.db2.gz VTQMLTRXAQRLKZ-DOTOQJQBSA-N 1 1 357.410 2.609 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CC[C@H]3CCS(=O)(=O)C3)C2)cc1 ZINC000590757601 519353014 /nfs/dbraw/zinc/35/30/14/519353014.db2.gz CHVBIQPNVKTPNP-GOEBONIOSA-N 1 1 352.456 2.599 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238686 519449612 /nfs/dbraw/zinc/44/96/12/519449612.db2.gz PIIWAZPZXFFRSC-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238686 519449616 /nfs/dbraw/zinc/44/96/16/519449616.db2.gz PIIWAZPZXFFRSC-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO Cn1cc(C[NH+]2CCC(Cc3nc4ccccc4[nH]3)CC2)c([N+](=O)[O-])n1 ZINC000602847869 519924218 /nfs/dbraw/zinc/92/42/18/519924218.db2.gz UREAUKHRXATJJG-UHFFFAOYSA-N 1 1 354.414 2.659 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000594417278 519952324 /nfs/dbraw/zinc/95/23/24/519952324.db2.gz BKYCBSTXESAQEC-DLBZAZTESA-N 1 1 370.409 2.595 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594419215 519953287 /nfs/dbraw/zinc/95/32/87/519953287.db2.gz PIKLCMFPNBITGP-DLBZAZTESA-N 1 1 359.426 2.691 20 5 FFBDMO COc1ncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1Cl ZINC000602962119 519995355 /nfs/dbraw/zinc/99/53/55/519995355.db2.gz HQJSBIZVCOSDGY-MRXNPFEDSA-N 1 1 351.790 2.649 20 5 FFBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594588934 520040434 /nfs/dbraw/zinc/04/04/34/520040434.db2.gz GIDXXHNWZQQCMP-GARJFASQSA-N 1 1 362.352 2.918 20 5 FFBDMO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594588934 520040440 /nfs/dbraw/zinc/04/04/40/520040440.db2.gz GIDXXHNWZQQCMP-GARJFASQSA-N 1 1 362.352 2.918 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600228466 520140461 /nfs/dbraw/zinc/14/04/61/520140461.db2.gz AYOSVGPIIUHGBZ-CYBMUJFWSA-N 1 1 367.396 2.939 20 5 FFBDMO CCCN(C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[N@@H+](C)C1 ZINC000592024736 520140605 /nfs/dbraw/zinc/14/06/05/520140605.db2.gz YBHTZBVMPLNQMB-MRXNPFEDSA-N 1 1 373.457 2.744 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1 ZINC000608860478 520147031 /nfs/dbraw/zinc/14/70/31/520147031.db2.gz PNHMDNWEESLRBG-IBGZPJMESA-N 1 1 366.421 2.951 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609075651 520185987 /nfs/dbraw/zinc/18/59/87/520185987.db2.gz OLHYDZOXKXPLEN-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO COc1ccccc1CN1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609075651 520185994 /nfs/dbraw/zinc/18/59/94/520185994.db2.gz OLHYDZOXKXPLEN-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)c1 ZINC000597717014 520193395 /nfs/dbraw/zinc/19/33/95/520193395.db2.gz VZQPRRDMMRVYAW-LJQANCHMSA-N 1 1 361.442 2.616 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC000592130647 520206084 /nfs/dbraw/zinc/20/60/84/520206084.db2.gz JLCSRACDQCQHQC-HNNXBMFYSA-N 1 1 355.385 2.907 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC000592130647 520206093 /nfs/dbraw/zinc/20/60/93/520206093.db2.gz JLCSRACDQCQHQC-HNNXBMFYSA-N 1 1 355.385 2.907 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993104 520245511 /nfs/dbraw/zinc/24/55/11/520245511.db2.gz BKXMMJCUIKBBKA-FQEVSTJZSA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2ccc([N+](=O)[O-])cc2)C1 ZINC000594993104 520245518 /nfs/dbraw/zinc/24/55/18/520245518.db2.gz BKXMMJCUIKBBKA-FQEVSTJZSA-N 1 1 354.454 2.501 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1cccnc1C ZINC000595049149 520270568 /nfs/dbraw/zinc/27/05/68/520270568.db2.gz CAUJSGQYZIEFFZ-YPMHNXCESA-N 1 1 358.398 2.985 20 5 FFBDMO C[N@@H+](Cc1ccc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2c1)C1CC1 ZINC000598028449 520384212 /nfs/dbraw/zinc/38/42/12/520384212.db2.gz NBVAFACHSBEDCP-UHFFFAOYSA-N 1 1 372.410 2.774 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000592479449 520407018 /nfs/dbraw/zinc/40/70/18/520407018.db2.gz ZQFOKSJASCDSOH-NVXWUHKLSA-N 1 1 360.458 2.696 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000592493966 520417008 /nfs/dbraw/zinc/41/70/08/520417008.db2.gz XYYBOBQYTZPRSZ-YESZJQIVSA-N 1 1 374.485 2.942 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595342180 520418206 /nfs/dbraw/zinc/41/82/06/520418206.db2.gz LAHIOOJBRODNSS-CQSZACIVSA-N 1 1 358.398 2.533 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@H](CNC(=O)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000595342180 520418215 /nfs/dbraw/zinc/41/82/15/520418215.db2.gz LAHIOOJBRODNSS-CQSZACIVSA-N 1 1 358.398 2.533 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000609758168 520422721 /nfs/dbraw/zinc/42/27/21/520422721.db2.gz NOUKHRXLUCVXKX-PBHICJAKSA-N 1 1 356.426 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cnc4ccccc4n3)C2)nc1 ZINC000595371688 520436104 /nfs/dbraw/zinc/43/61/04/520436104.db2.gz RCBYLGMTOOSOGM-CYBMUJFWSA-N 1 1 350.382 2.619 20 5 FFBDMO O=[N+]([O-])c1cc(CNC[C@H]2COCC[NH2+]2)ccc1Oc1ccc(F)cc1 ZINC000600773381 520461678 /nfs/dbraw/zinc/46/16/78/520461678.db2.gz HJLAXOYMDBJNPQ-HNNXBMFYSA-N 1 1 361.373 2.604 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3COCC[NH2+]3)o2)c(Cl)c1 ZINC000600777621 520462557 /nfs/dbraw/zinc/46/25/57/520462557.db2.gz VNGQIABLTOZGIC-LLVKDONJSA-N 1 1 351.790 2.586 20 5 FFBDMO CCN(CC)C(=O)CCC1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595426047 520463142 /nfs/dbraw/zinc/46/31/42/520463142.db2.gz OMEUHEATKJHWFC-UHFFFAOYSA-N 1 1 352.435 2.752 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000609908709 520476526 /nfs/dbraw/zinc/47/65/26/520476526.db2.gz AHGWVIRQAZSRAV-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000609908709 520476534 /nfs/dbraw/zinc/47/65/34/520476534.db2.gz AHGWVIRQAZSRAV-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO CCOc1cc(C[NH2+][C@@](C)(CC(=O)OC)c2ccncc2)ccc1[N+](=O)[O-] ZINC000595486110 520502276 /nfs/dbraw/zinc/50/22/76/520502276.db2.gz INAGVXPGGTUPEZ-IBGZPJMESA-N 1 1 373.409 2.957 20 5 FFBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610161469 520564397 /nfs/dbraw/zinc/56/43/97/520564397.db2.gz VVGWTVJLMFAGNX-AWEZNQCLSA-N 1 1 358.394 2.844 20 5 FFBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610161469 520564401 /nfs/dbraw/zinc/56/44/01/520564401.db2.gz VVGWTVJLMFAGNX-AWEZNQCLSA-N 1 1 358.394 2.844 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000598342706 520566817 /nfs/dbraw/zinc/56/68/17/520566817.db2.gz PEDGJYFGEITAMZ-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO COCCC[N@@H+](C)CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000610208278 520580988 /nfs/dbraw/zinc/58/09/88/520580988.db2.gz SUJMKWNLFZCNBN-UHFFFAOYSA-N 1 1 351.447 2.590 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3ccccc3OC)CC2)c1 ZINC000610275919 520618532 /nfs/dbraw/zinc/61/85/32/520618532.db2.gz GDAJZAQPMQLUGP-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000601068539 520622465 /nfs/dbraw/zinc/62/24/65/520622465.db2.gz GOYQBMOSNMHCKD-HXUWFJFHSA-N 1 1 370.405 2.813 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@]3(C1)OCc1ccccc13)OCCO2 ZINC000613743046 520648601 /nfs/dbraw/zinc/64/86/01/520648601.db2.gz RUBJIJKPVXOBSB-HXUWFJFHSA-N 1 1 368.389 2.997 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@]3(C1)OCc1ccccc13)OCCO2 ZINC000613743046 520648607 /nfs/dbraw/zinc/64/86/07/520648607.db2.gz RUBJIJKPVXOBSB-HXUWFJFHSA-N 1 1 368.389 2.997 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000598557363 520703851 /nfs/dbraw/zinc/70/38/51/520703851.db2.gz FSVVIFAFCZTFGV-INIZCTEOSA-N 1 1 361.442 2.520 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598558026 520704160 /nfs/dbraw/zinc/70/41/60/520704160.db2.gz BLBQXITUOCKFPA-INIZCTEOSA-N 1 1 360.458 2.635 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](n1cncn1)C(F)(F)F ZINC000601294701 520728575 /nfs/dbraw/zinc/72/85/75/520728575.db2.gz PUFREKSMDKGYDJ-TVQRCGJNSA-N 1 1 359.308 2.649 20 5 FFBDMO CCOc1cc(C[N@@H+](CCN2CCOCC2)CC2CC2)ccc1[N+](=O)[O-] ZINC000595806769 520740063 /nfs/dbraw/zinc/74/00/63/520740063.db2.gz GCBRIWMZIYDVHE-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119418 520759008 /nfs/dbraw/zinc/75/90/08/520759008.db2.gz YHUDPPYXTKEVEZ-HNNXBMFYSA-N 1 1 355.341 2.663 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595875155 520783109 /nfs/dbraw/zinc/78/31/09/520783109.db2.gz PUUKXAOPVDVDSO-QFYYESIMSA-N 1 1 360.357 2.655 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]2C)cc1OC ZINC000593188157 520810874 /nfs/dbraw/zinc/81/08/74/520810874.db2.gz WWZMRGRAPJDZFP-AGIUHOORSA-N 1 1 365.430 2.555 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000595916024 520822144 /nfs/dbraw/zinc/82/21/44/520822144.db2.gz KTXZGVAFIVZSCA-SJKOYZFVSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000595916024 520822151 /nfs/dbraw/zinc/82/21/51/520822151.db2.gz KTXZGVAFIVZSCA-SJKOYZFVSA-N 1 1 371.384 2.976 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000593209825 520831513 /nfs/dbraw/zinc/83/15/13/520831513.db2.gz VGAGCLKNKAHZAC-UHFFFAOYSA-N 1 1 362.474 2.903 20 5 FFBDMO NC(=O)c1cc(N2CCC[N@@H+](CC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000596084214 520902857 /nfs/dbraw/zinc/90/28/57/520902857.db2.gz XWZAFYCEDWKRHS-UHFFFAOYSA-N 1 1 360.458 2.786 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C(C)(C)C1 ZINC000593339044 520919908 /nfs/dbraw/zinc/91/99/08/520919908.db2.gz NAQCWYWADCAZRP-UHFFFAOYSA-N 1 1 361.398 2.524 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C(C)(C)C1 ZINC000593339044 520919913 /nfs/dbraw/zinc/91/99/13/520919913.db2.gz NAQCWYWADCAZRP-UHFFFAOYSA-N 1 1 361.398 2.524 20 5 FFBDMO COc1cccc(C(=O)N[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000593337159 520920301 /nfs/dbraw/zinc/92/03/01/520920301.db2.gz PGFVRWRARRNVQJ-HXUWFJFHSA-N 1 1 369.421 2.998 20 5 FFBDMO CC(C)c1ncc2c(n1)CC[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2 ZINC000598934668 520929387 /nfs/dbraw/zinc/92/93/87/520929387.db2.gz AGMCRGFKUNAOTB-UHFFFAOYSA-N 1 1 370.409 2.933 20 5 FFBDMO CC(C)c1ncc2c(n1)CC[N@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2 ZINC000598934668 520929392 /nfs/dbraw/zinc/92/93/92/520929392.db2.gz AGMCRGFKUNAOTB-UHFFFAOYSA-N 1 1 370.409 2.933 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](n4cncn4)C3)o2)c([N+](=O)[O-])c1 ZINC000614453115 520974405 /nfs/dbraw/zinc/97/44/05/520974405.db2.gz OEUFKMMEXRAVDL-CYBMUJFWSA-N 1 1 369.381 2.902 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1 ZINC000596217320 520977788 /nfs/dbraw/zinc/97/77/88/520977788.db2.gz CKYXDZNQFUFIEH-LBPRGKRZSA-N 1 1 360.439 2.638 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000618296968 520988791 /nfs/dbraw/zinc/98/87/91/520988791.db2.gz SNXJOGMTRPUATH-LBPRGKRZSA-N 1 1 360.414 2.882 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000618296968 520988800 /nfs/dbraw/zinc/98/88/00/520988800.db2.gz SNXJOGMTRPUATH-LBPRGKRZSA-N 1 1 360.414 2.882 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599042144 520995724 /nfs/dbraw/zinc/99/57/24/520995724.db2.gz KLHBYBLYIUUXCR-QGZVFWFLSA-N 1 1 369.469 2.749 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1c(Br)cccc1[N+](=O)[O-] ZINC000599081000 521020976 /nfs/dbraw/zinc/02/09/76/521020976.db2.gz RNZFMPSWJROURB-RYUDHWBXSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C(F)F)CC1 ZINC000601971035 521048410 /nfs/dbraw/zinc/04/84/10/521048410.db2.gz ABRZHGJWFBJRMF-AWEZNQCLSA-N 1 1 357.357 2.588 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000596424575 521065411 /nfs/dbraw/zinc/06/54/11/521065411.db2.gz SJRVMQXYIWWAMZ-INIZCTEOSA-N 1 1 357.410 2.782 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599194026 521080599 /nfs/dbraw/zinc/08/05/99/521080599.db2.gz NTIOBGGRYNXKGK-NSHDSACASA-N 1 1 370.247 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3ccc(F)cn3)CC2)cc1 ZINC000611407215 521139370 /nfs/dbraw/zinc/13/93/70/521139370.db2.gz QOZDSSHHKIUGMT-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)c([N+](=O)[O-])c1 ZINC000593689391 521158322 /nfs/dbraw/zinc/15/83/22/521158322.db2.gz TURPKLFESLMJGC-YVJJPDMGSA-N 1 1 362.407 2.569 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@H]3C[S@@]4=O)o2)c([N+](=O)[O-])c1 ZINC000593689391 521158332 /nfs/dbraw/zinc/15/83/32/521158332.db2.gz TURPKLFESLMJGC-YVJJPDMGSA-N 1 1 362.407 2.569 20 5 FFBDMO Nc1cc(N2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc(CO)c1[N+](=O)[O-] ZINC000611525553 521204008 /nfs/dbraw/zinc/20/40/08/521204008.db2.gz ZKXAGQSSCMFFAN-UHFFFAOYSA-N 1 1 374.416 2.521 20 5 FFBDMO CCCN(CC(F)(F)F)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000599412899 521205507 /nfs/dbraw/zinc/20/55/07/521205507.db2.gz QDSURIVJZJCRGW-UHFFFAOYSA-N 1 1 361.364 2.870 20 5 FFBDMO CCCN(CC(F)(F)F)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000599412899 521205513 /nfs/dbraw/zinc/20/55/13/521205513.db2.gz QDSURIVJZJCRGW-UHFFFAOYSA-N 1 1 361.364 2.870 20 5 FFBDMO CC(C)[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000599550660 521292281 /nfs/dbraw/zinc/29/22/81/521292281.db2.gz XGYXOABTXBAOJD-IBGZPJMESA-N 1 1 357.458 2.634 20 5 FFBDMO O=c1ccc([C@@H]2OCC[C@H]2[NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)c[nH]1 ZINC000599630948 521342366 /nfs/dbraw/zinc/34/23/66/521342366.db2.gz QAVNQVYZVYKBBM-ZBFHGGJFSA-N 1 1 351.309 2.593 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(CC)[C@H]1CC[N@@H+](CC)C1 ZINC000596890183 521359537 /nfs/dbraw/zinc/35/95/37/521359537.db2.gz LDIGDGKZGDWQME-AWEZNQCLSA-N 1 1 350.419 2.942 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2cc(F)ccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000599686413 521401532 /nfs/dbraw/zinc/40/15/32/521401532.db2.gz DUBUPKOLTZCZAT-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2cc(F)ccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000599686413 521401538 /nfs/dbraw/zinc/40/15/38/521401538.db2.gz DUBUPKOLTZCZAT-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@H+]1C ZINC000607688856 521430039 /nfs/dbraw/zinc/43/00/39/521430039.db2.gz YRGSADQOVQSAEQ-HOTGVXAUSA-N 1 1 363.461 2.754 20 5 FFBDMO C[C@H]1c2ccccc2OCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612030191 521447282 /nfs/dbraw/zinc/44/72/82/521447282.db2.gz ABLFUYVACQPYNO-LSDHHAIUSA-N 1 1 358.394 2.790 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000594199235 521465498 /nfs/dbraw/zinc/46/54/98/521465498.db2.gz IGRAZEJQHLSKPD-ROUUACIJSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]Cc3cccc(N4CCOCC4)c3)nc2c1 ZINC000602673001 521472258 /nfs/dbraw/zinc/47/22/58/521472258.db2.gz AQKUVRJXNHSNDD-UHFFFAOYSA-N 1 1 368.393 2.862 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000612094697 521478127 /nfs/dbraw/zinc/47/81/27/521478127.db2.gz RDOLKPSJLCNFGU-IAGOWNOFSA-N 1 1 358.394 2.877 20 5 FFBDMO COC(=O)[C@@H](CC(C)(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602700646 521485181 /nfs/dbraw/zinc/48/51/81/521485181.db2.gz MZPKGQVORGXKQW-OAHLLOKOSA-N 1 1 364.446 2.526 20 5 FFBDMO CC[C@H](C)C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(=O)OC ZINC000602702038 521486052 /nfs/dbraw/zinc/48/60/52/521486052.db2.gz MWLMKTQSKWJVTF-XJKSGUPXSA-N 1 1 364.446 2.526 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612121696 521494004 /nfs/dbraw/zinc/49/40/04/521494004.db2.gz LHDBLEULJFWQIL-FRRDWIJNSA-N 1 1 362.348 2.997 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000599831170 521499624 /nfs/dbraw/zinc/49/96/24/521499624.db2.gz OXRQKZZJQGANMF-RDJZCZTQSA-N 1 1 355.398 2.891 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597102836 521507455 /nfs/dbraw/zinc/50/74/55/521507455.db2.gz YYSSGWSQDXIJHC-ZDUSSCGKSA-N 1 1 355.826 2.634 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]CCn3ccc(C(F)(F)F)n3)nc2c1 ZINC000602752210 521514239 /nfs/dbraw/zinc/51/42/39/521514239.db2.gz WAMHQCHYBXULKT-UHFFFAOYSA-N 1 1 355.276 2.741 20 5 FFBDMO COc1ccc(OC)c(C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C2CC2)c1 ZINC000602756802 521515907 /nfs/dbraw/zinc/51/59/07/521515907.db2.gz QFZIOEWNRAQOIA-UHFFFAOYSA-N 1 1 360.414 2.782 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594284290 521536583 /nfs/dbraw/zinc/53/65/83/521536583.db2.gz UXLCAVWDTNONJK-QZTJIDSGSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000602821684 521553219 /nfs/dbraw/zinc/55/32/19/521553219.db2.gz QLDNUAIJWJPTKS-UHFFFAOYSA-N 1 1 362.405 2.920 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)o1 ZINC000597173055 521554278 /nfs/dbraw/zinc/55/42/78/521554278.db2.gz CXMACPSGGBPNCI-CQSZACIVSA-N 1 1 353.382 2.968 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000602828606 521557320 /nfs/dbraw/zinc/55/73/20/521557320.db2.gz HXDRXXVRNFRZOX-HXUWFJFHSA-N 1 1 369.469 2.698 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@](C)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597181029 521558948 /nfs/dbraw/zinc/55/89/48/521558948.db2.gz ZHWFSAWUDMIQCY-IBGZPJMESA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@](C)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597181029 521558952 /nfs/dbraw/zinc/55/89/52/521558952.db2.gz ZHWFSAWUDMIQCY-IBGZPJMESA-N 1 1 356.426 2.996 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)o1 ZINC000597203403 521571750 /nfs/dbraw/zinc/57/17/50/521571750.db2.gz PIWPUAUCFMVXBS-OAHLLOKOSA-N 1 1 357.410 2.761 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]2N1 ZINC000597204734 521573431 /nfs/dbraw/zinc/57/34/31/521573431.db2.gz FTIYXYURHZAXIG-CJNGLKHVSA-N 1 1 355.394 2.955 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCC([N@H+]4CC[C@H](O)C4)CC3)o2)c1 ZINC000597234861 521588300 /nfs/dbraw/zinc/58/83/00/521588300.db2.gz CEJIGTOWIVWPOV-SFHVURJKSA-N 1 1 371.437 2.886 20 5 FFBDMO Cn1cc(C[N@@H+]2CCCc3n[nH]cc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597257535 521599558 /nfs/dbraw/zinc/59/95/58/521599558.db2.gz GFHZMJQPSKMAGM-UHFFFAOYSA-N 1 1 352.398 2.667 20 5 FFBDMO Cn1cc(C[N@H+]2CCCc3n[nH]cc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597257535 521599564 /nfs/dbraw/zinc/59/95/64/521599564.db2.gz GFHZMJQPSKMAGM-UHFFFAOYSA-N 1 1 352.398 2.667 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(-c2nn[nH]n2)cc1 ZINC000821846549 599370500 /nfs/dbraw/zinc/37/05/00/599370500.db2.gz UGLBGIZNHNBFFW-LLVKDONJSA-N 1 1 354.370 2.634 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccnc(-c2nn[nH]n2)c1 ZINC000824296663 607488145 /nfs/dbraw/zinc/48/81/45/607488145.db2.gz KAPXGEAEIZJMNJ-UHFFFAOYSA-N 1 1 353.386 2.581 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cc(-c3nn[nH]n3)cs2)c1 ZINC000823640211 606772707 /nfs/dbraw/zinc/77/27/07/606772707.db2.gz XJCQOCJGDBIBJH-UHFFFAOYSA-N 1 1 350.791 2.780 20 5 FFBDMO Cc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001164631592 719108849 /nfs/dbraw/zinc/10/88/49/719108849.db2.gz YRCOQKILAOWBTJ-FUHWJXTLSA-N 1 1 353.426 2.794 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398297 735295509 /nfs/dbraw/zinc/29/55/09/735295509.db2.gz GJKNFXYTMSVZQY-DGCLKSJQSA-N 1 1 363.439 2.754 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1 ZINC000743398297 735295512 /nfs/dbraw/zinc/29/55/12/735295512.db2.gz GJKNFXYTMSVZQY-DGCLKSJQSA-N 1 1 363.439 2.754 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000112209254 728543193 /nfs/dbraw/zinc/54/31/93/728543193.db2.gz YCAFIDOFSBCMIU-NEPJUHHUSA-N 1 1 356.220 2.632 20 5 FFBDMO O=C(OCC[NH+]1CCSCC1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000127900477 728707551 /nfs/dbraw/zinc/70/75/51/728707551.db2.gz AGXSKOWVLBPJSX-UHFFFAOYSA-N 1 1 364.345 2.819 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@@H](O)c3ccc(Cl)cc3)C2)nc1 ZINC000173462981 729047589 /nfs/dbraw/zinc/04/75/89/729047589.db2.gz HSMKHPHUIUAFNR-GOEBONIOSA-N 1 1 362.817 2.863 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)c1 ZINC000174847745 729081115 /nfs/dbraw/zinc/08/11/15/729081115.db2.gz ASABLFWNZKMGQB-UHFFFAOYSA-N 1 1 362.817 2.974 20 5 FFBDMO CCN(C[C@H]1CC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1)CC(F)(F)F ZINC000177639635 729142001 /nfs/dbraw/zinc/14/20/01/729142001.db2.gz IBTQLKBEECNJJL-CYBMUJFWSA-N 1 1 363.384 2.572 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1)CC(F)(F)F ZINC000177639635 729142003 /nfs/dbraw/zinc/14/20/03/729142003.db2.gz IBTQLKBEECNJJL-CYBMUJFWSA-N 1 1 363.384 2.572 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000856797451 730358422 /nfs/dbraw/zinc/35/84/22/730358422.db2.gz BNVBBBDAZGLOBW-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO CC1(C)CC[C@H](CO)[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000856803220 730358884 /nfs/dbraw/zinc/35/88/84/730358884.db2.gz BGPNGQFPDKALRU-CYBMUJFWSA-N 1 1 353.394 2.545 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)C1 ZINC000861340488 730600949 /nfs/dbraw/zinc/60/09/49/730600949.db2.gz HYSXHYBICRLLNI-MLGOLLRUSA-N 1 1 354.428 2.583 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)Cc3cccc(F)c3[N+](=O)[O-])sc2C1 ZINC000864617927 730865777 /nfs/dbraw/zinc/86/57/77/730865777.db2.gz VMBAVLUKCJUSHY-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)Cc3cccc(F)c3[N+](=O)[O-])sc2C1 ZINC000864617927 730865779 /nfs/dbraw/zinc/86/57/79/730865779.db2.gz VMBAVLUKCJUSHY-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1Cl ZINC000866205018 731040469 /nfs/dbraw/zinc/04/04/69/731040469.db2.gz IUDIKVAHRIGUDD-GWCFXTLKSA-N 1 1 353.806 2.565 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CCC1(C)C ZINC000871154294 731600539 /nfs/dbraw/zinc/60/05/39/731600539.db2.gz SCAUVECVKAVVER-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCS(=O)(=O)CC1CC1 ZINC000872047394 731723615 /nfs/dbraw/zinc/72/36/15/731723615.db2.gz AWAJKNZOHWDJPA-LLVKDONJSA-N 1 1 358.485 2.792 20 5 FFBDMO CC(C)C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C[C@@H](O)c1ccc(F)cc1 ZINC000876744944 732275663 /nfs/dbraw/zinc/27/56/63/732275663.db2.gz HVFYMWREBIMJRP-MRXNPFEDSA-N 1 1 350.394 2.659 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880144357 732854789 /nfs/dbraw/zinc/85/47/89/732854789.db2.gz CULUTMXKMIRCRC-MNOVXSKESA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H](C(C)(C)O)C1 ZINC000880144357 732854795 /nfs/dbraw/zinc/85/47/95/732854795.db2.gz CULUTMXKMIRCRC-MNOVXSKESA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(NS(C)(=O)=O)c1 ZINC000781915571 738671976 /nfs/dbraw/zinc/67/19/76/738671976.db2.gz DAROJCYGKJMFKL-NSHDSACASA-N 1 1 367.402 2.956 20 5 FFBDMO COC(=O)c1cnc([C@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)s1 ZINC000886288822 733770501 /nfs/dbraw/zinc/77/05/01/733770501.db2.gz IDHOEZLXJAQVFR-LBPRGKRZSA-N 1 1 362.411 2.613 20 5 FFBDMO COC(=O)c1cnc([C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)s1 ZINC000886288822 733770504 /nfs/dbraw/zinc/77/05/04/733770504.db2.gz IDHOEZLXJAQVFR-LBPRGKRZSA-N 1 1 362.411 2.613 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000886822465 733843958 /nfs/dbraw/zinc/84/39/58/733843958.db2.gz QRUJSEVMMKLXPF-LRDDRELGSA-N 1 1 351.378 2.563 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@H]2CCCO2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000886829648 733846194 /nfs/dbraw/zinc/84/61/94/733846194.db2.gz DTAHCHCJZBRYFN-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(S(N)(=O)=O)c1 ZINC000782977900 738769688 /nfs/dbraw/zinc/76/96/88/738769688.db2.gz BJACEKFTYOOBPI-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[N@@H+](C)C(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000888830306 734103117 /nfs/dbraw/zinc/10/31/17/734103117.db2.gz SNQYYFXSCAFLEF-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH+]1CCC(C2OCCO2)CC1 ZINC000719012416 734376984 /nfs/dbraw/zinc/37/69/84/734376984.db2.gz SKAPQMXCIACJQG-UHFFFAOYSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)c1Br ZINC000719025950 734377263 /nfs/dbraw/zinc/37/72/63/734377263.db2.gz XCZMYGIBZKNCLJ-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c1Br ZINC000719025950 734377266 /nfs/dbraw/zinc/37/72/66/734377266.db2.gz XCZMYGIBZKNCLJ-GFCCVEGCSA-N 1 1 371.231 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cc1Cl ZINC000783526978 738811764 /nfs/dbraw/zinc/81/17/64/738811764.db2.gz JRSODMUOHXONOB-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO CSc1cccc(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c1[N+](=O)[O-] ZINC000928089015 738819811 /nfs/dbraw/zinc/81/98/11/738819811.db2.gz IPOJDDUCFQSPTL-STQMWFEESA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1cccc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-] ZINC000928089015 738819814 /nfs/dbraw/zinc/81/98/14/738819814.db2.gz IPOJDDUCFQSPTL-STQMWFEESA-N 1 1 367.496 2.626 20 5 FFBDMO C[C@]1(Br)C[C@@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078501 734512622 /nfs/dbraw/zinc/51/26/22/734512622.db2.gz NNZPRCFSJWHBIQ-SUNKGSAMSA-N 1 1 355.236 2.650 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000893601813 734725163 /nfs/dbraw/zinc/72/51/63/734725163.db2.gz JLIOJJYXIARYQW-CABCVRRESA-N 1 1 352.822 2.626 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2CC[N@H+]2C2CCOCC2)c(C(F)(F)F)c1 ZINC000896521036 735172421 /nfs/dbraw/zinc/17/24/21/735172421.db2.gz CAKQQGUZQWCOQE-LLVKDONJSA-N 1 1 360.336 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1OC(F)F ZINC000896520513 735172486 /nfs/dbraw/zinc/17/24/86/735172486.db2.gz DADGEHSMCNFLGV-ZDUSSCGKSA-N 1 1 357.357 2.861 20 5 FFBDMO Cn1c[nH+]cc1CCCOc1cc(Br)cc([N+](=O)[O-])c1N ZINC000902399610 735942050 /nfs/dbraw/zinc/94/20/50/735942050.db2.gz ZUJOSQLPZJKBGK-UHFFFAOYSA-N 1 1 355.192 2.685 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000755027997 736227851 /nfs/dbraw/zinc/22/78/51/736227851.db2.gz HYSLBJUFHLJWIG-UHFFFAOYSA-N 1 1 368.191 2.684 20 5 FFBDMO O=C(C[NH+]1CCC2(CCOC2)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000761057831 736691353 /nfs/dbraw/zinc/69/13/53/736691353.db2.gz GXFUSHQRUIKELB-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000908083881 736714678 /nfs/dbraw/zinc/71/46/78/736714678.db2.gz ANFDUFYCDAAMER-UHFFFAOYSA-N 1 1 352.753 2.850 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2Br)C[C@@H]1C ZINC000766557951 737241941 /nfs/dbraw/zinc/24/19/41/737241941.db2.gz WYPLRSMUTRQNOJ-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO CSc1ccc(C(=O)NC(C)(C)CC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000912955411 737363460 /nfs/dbraw/zinc/36/34/60/737363460.db2.gz WEKRPNXSBJRWPH-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCS[C@@H]4COCC[C@H]43)c2)cc1 ZINC000767782345 737367634 /nfs/dbraw/zinc/36/76/34/737367634.db2.gz ITQKTLFWFMFDHM-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCS[C@@H]4COCC[C@H]43)c2)cc1 ZINC000767782345 737367639 /nfs/dbraw/zinc/36/76/39/737367639.db2.gz ITQKTLFWFMFDHM-IAGOWNOFSA-N 1 1 360.439 2.622 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cc(Br)ncc1[N+](=O)[O-] ZINC000769838140 737572443 /nfs/dbraw/zinc/57/24/43/737572443.db2.gz GSOKFJOBBLGXME-SNVBAGLBSA-N 1 1 372.219 2.784 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939785 737585314 /nfs/dbraw/zinc/58/53/14/737585314.db2.gz AUFWLFFEEXTKDO-CZUORRHYSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000769939785 737585316 /nfs/dbraw/zinc/58/53/16/737585316.db2.gz AUFWLFFEEXTKDO-CZUORRHYSA-N 1 1 364.833 2.927 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774639560 738008154 /nfs/dbraw/zinc/00/81/54/738008154.db2.gz LVKWPAHTVXCFTA-LRDDRELGSA-N 1 1 363.849 2.972 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)CC[C@@H]21 ZINC000774640379 738008867 /nfs/dbraw/zinc/00/88/67/738008867.db2.gz RXUYTFNSPRDOGN-LRDDRELGSA-N 1 1 363.849 2.972 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000775323176 738084622 /nfs/dbraw/zinc/08/46/22/738084622.db2.gz OKLHNLNXENEXPU-UHFFFAOYSA-N 1 1 370.837 2.559 20 5 FFBDMO Cn1cc(Br)cc1C[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776587570 738211783 /nfs/dbraw/zinc/21/17/83/738211783.db2.gz WRYKHQBXYXCDAN-HNNXBMFYSA-N 1 1 368.231 2.861 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778247736 738366518 /nfs/dbraw/zinc/36/65/18/738366518.db2.gz OCHOVOWCBJAOKI-STQMWFEESA-N 1 1 355.385 2.923 20 5 FFBDMO CC(C)([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)C(=O)N1CCCC1 ZINC000930300321 739084191 /nfs/dbraw/zinc/08/41/91/739084191.db2.gz IWUAJUYXLZMLRL-UHFFFAOYSA-N 1 1 370.247 2.848 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000930318033 739086404 /nfs/dbraw/zinc/08/64/04/739086404.db2.gz ZPSUHYLPKYMRNA-HIFRSBDPSA-N 1 1 364.471 2.913 20 5 FFBDMO C[C@H](CO)[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788466196 739247613 /nfs/dbraw/zinc/24/76/13/739247613.db2.gz GRPIKIHOEXFZBD-LLVKDONJSA-N 1 1 355.822 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2CC[C@H](C3OCCO3)C2)c1 ZINC000931999663 739369572 /nfs/dbraw/zinc/36/95/72/739369572.db2.gz YOFZAIRPRPFIGU-JTQLQIEISA-N 1 1 357.204 2.552 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790721493 739488131 /nfs/dbraw/zinc/48/81/31/739488131.db2.gz VAJIAGUZSLVSCY-NSHDSACASA-N 1 1 357.813 2.730 20 5 FFBDMO Cc1csc(C[C@H]2CC[N@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000933132320 739574053 /nfs/dbraw/zinc/57/40/53/739574053.db2.gz COUIOROJBNPKPF-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1csc(C[C@H]2CC[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000933132320 739574056 /nfs/dbraw/zinc/57/40/56/739574056.db2.gz COUIOROJBNPKPF-CYBMUJFWSA-N 1 1 360.439 2.863 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@@H]1C ZINC000933371284 739611532 /nfs/dbraw/zinc/61/15/32/739611532.db2.gz SKBDCAAALVHGIP-VHSXEESVSA-N 1 1 372.828 2.914 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934777897 739839679 /nfs/dbraw/zinc/83/96/79/739839679.db2.gz XLAJVHVAFHYGIE-PXAZEXFGSA-N 1 1 365.455 2.617 20 5 FFBDMO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ncc(Br)cn1 ZINC000814655836 741853980 /nfs/dbraw/zinc/85/39/80/741853980.db2.gz YHCOCIRMSVKHDZ-TVQRCGJNSA-N 1 1 367.203 2.532 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000815145703 741906923 /nfs/dbraw/zinc/90/69/23/741906923.db2.gz CDIIHXXUYJFURU-KRWDZBQOSA-N 1 1 366.849 2.604 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000824651145 743122079 /nfs/dbraw/zinc/12/20/79/743122079.db2.gz BMOYRPJPUCFHHN-ZDUSSCGKSA-N 1 1 351.422 2.903 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])CC[C@@H]21 ZINC000828509656 745077777 /nfs/dbraw/zinc/07/77/77/745077777.db2.gz FMOATODEBMSSTM-WFASDCNBSA-N 1 1 351.834 2.733 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)CC1 ZINC000835075768 745945764 /nfs/dbraw/zinc/94/57/64/745945764.db2.gz AJRYGUMBJBSPDI-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO O=C(OCC[NH+]1CCSCC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000835215034 745972643 /nfs/dbraw/zinc/97/26/43/745972643.db2.gz WYSGLKCTEVQWHJ-UHFFFAOYSA-N 1 1 364.345 2.819 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000837188420 746388887 /nfs/dbraw/zinc/38/88/87/746388887.db2.gz FEVOIVXNFRUUOD-LBPRGKRZSA-N 1 1 357.813 2.871 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839504437 746842364 /nfs/dbraw/zinc/84/23/64/746842364.db2.gz ZKTXPLXKIMKWIR-KGLIPLIRSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@@H](CO)[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC1CCC1 ZINC000839590497 746865076 /nfs/dbraw/zinc/86/50/76/746865076.db2.gz WJMJRJMXJSBBTO-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC1CCC1 ZINC000839590495 746865231 /nfs/dbraw/zinc/86/52/31/746865231.db2.gz WJMJRJMXJSBBTO-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000840155429 747021765 /nfs/dbraw/zinc/02/17/65/747021765.db2.gz XWMMCLNUZJYJFN-CYBMUJFWSA-N 1 1 351.838 2.970 20 5 FFBDMO COCC(C)(C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367048 747580695 /nfs/dbraw/zinc/58/06/95/747580695.db2.gz SAPWUTOTKZOSLA-INIZCTEOSA-N 1 1 350.415 2.775 20 5 FFBDMO COCC(C)(C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367048 747580700 /nfs/dbraw/zinc/58/07/00/747580700.db2.gz SAPWUTOTKZOSLA-INIZCTEOSA-N 1 1 350.415 2.775 20 5 FFBDMO CCCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000843990976 747946560 /nfs/dbraw/zinc/94/65/60/747946560.db2.gz ZQFCNMZEDJQDRS-GFCCVEGCSA-N 1 1 357.813 2.873 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C2(CCC2)CO1 ZINC000844422645 748026622 /nfs/dbraw/zinc/02/66/22/748026622.db2.gz RDEZEZRLHUCFKU-GFCCVEGCSA-N 1 1 351.378 2.706 20 5 FFBDMO Cc1c(C(=O)NCCC[N@H+](C)CC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000844655539 748066545 /nfs/dbraw/zinc/06/65/45/748066545.db2.gz KVEBOTXYGVROPK-UHFFFAOYSA-N 1 1 352.391 2.519 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000844903120 748132512 /nfs/dbraw/zinc/13/25/12/748132512.db2.gz SRMUBSFWYXBIAS-JJRVBVJISA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000846914173 748573860 /nfs/dbraw/zinc/57/38/60/748573860.db2.gz YEMRTFNXXMCTQH-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCC[C@H]1CC[N@@H+](C)C1 ZINC000847823268 748790098 /nfs/dbraw/zinc/79/00/98/748790098.db2.gz KIAPLDUGCLXZBK-CYBMUJFWSA-N 1 1 368.455 2.832 20 5 FFBDMO CC[C@H](CSC)[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483499 748938052 /nfs/dbraw/zinc/93/80/52/748938052.db2.gz IIOYSEWZTACRQG-GDBMZVCRSA-N 1 1 351.472 2.942 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000851864786 749709914 /nfs/dbraw/zinc/70/99/14/749709914.db2.gz KFRCJVSNRLBBPI-CMPLNLGQSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000851864786 749709917 /nfs/dbraw/zinc/70/99/17/749709917.db2.gz KFRCJVSNRLBBPI-CMPLNLGQSA-N 1 1 354.407 2.626 20 5 FFBDMO CCOP(=O)(OCC)[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000851869765 749712209 /nfs/dbraw/zinc/71/22/09/749712209.db2.gz QEJDXQPHHXPMQZ-OAHLLOKOSA-N 1 1 358.331 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC([N@H+]4CCCOCC4)CC3)sc2c1 ZINC000853688543 750136789 /nfs/dbraw/zinc/13/67/89/750136789.db2.gz QBUAXPZBAALUMZ-UHFFFAOYSA-N 1 1 362.455 2.896 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-] ZINC000853747441 750151581 /nfs/dbraw/zinc/15/15/81/750151581.db2.gz RANMOSXGJPQIBS-LBPRGKRZSA-N 1 1 352.391 2.588 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001116021084 1032068172 /nfs/dbraw/zinc/06/81/72/1032068172.db2.gz DVHQUJRJOCXELA-LSDHHAIUSA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134885650 960091726 /nfs/dbraw/zinc/09/17/26/960091726.db2.gz WMJVYVJVXGRZTG-RDJZCZTQSA-N 1 1 369.421 2.753 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc2c(=O)c3ccccc3[nH]c12 ZINC000683548136 960954857 /nfs/dbraw/zinc/95/48/57/960954857.db2.gz QGXFGXVOVWNSLE-HNNXBMFYSA-N 1 1 361.445 2.895 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(=O)OCCn2cc([N+](=O)[O-])cn2)cc1)C(C)C ZINC000748122222 961658121 /nfs/dbraw/zinc/65/81/21/961658121.db2.gz WYLWFBOFPVRYQD-UHFFFAOYSA-N 1 1 360.414 2.879 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@H]([C@H]2CCCO2)C1 ZINC000933189406 963691754 /nfs/dbraw/zinc/69/17/54/963691754.db2.gz ZORYBQCMVDNQAQ-BPQIPLTHSA-N 1 1 362.426 2.836 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@H]([C@H]2CCCO2)C1 ZINC000933189406 963691762 /nfs/dbraw/zinc/69/17/62/963691762.db2.gz ZORYBQCMVDNQAQ-BPQIPLTHSA-N 1 1 362.426 2.836 20 5 FFBDMO Cn1c2ccccc2c(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1=O ZINC000894476031 965403260 /nfs/dbraw/zinc/40/32/60/965403260.db2.gz MEZMGCIJHJOBJK-ZDUSSCGKSA-N 1 1 358.442 2.979 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000051373747 965663098 /nfs/dbraw/zinc/66/30/98/965663098.db2.gz BPWWFDJZXOPVMT-UHFFFAOYSA-N 1 1 356.382 2.868 20 5 FFBDMO COc1c(O)ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000892235106 966349349 /nfs/dbraw/zinc/34/93/49/966349349.db2.gz KURCJILEVCUBLG-CJNGLKHVSA-N 1 1 361.442 2.758 20 5 FFBDMO CCc1ccccc1C[NH+]1CCC(C)(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001270879902 967474314 /nfs/dbraw/zinc/47/43/14/967474314.db2.gz STDAWRMEYQXSAK-QZTJIDSGSA-N 1 1 359.470 2.633 20 5 FFBDMO COCC[N@@H+](CCC(=O)OC(C)(C)C)CCc1ccc([N+](=O)[O-])cc1 ZINC001176833593 1013784121 /nfs/dbraw/zinc/78/41/21/1013784121.db2.gz YJBQVGBCBULURJ-UHFFFAOYSA-N 1 1 352.431 2.818 20 5 FFBDMO COc1c(O)ccc(CNC[C@@H](Cc2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000892451170 968845384 /nfs/dbraw/zinc/84/53/84/968845384.db2.gz PQQSEWHZDCFIAD-MRXNPFEDSA-N 1 1 359.426 2.572 20 5 FFBDMO COCCOc1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000179534502 968969882 /nfs/dbraw/zinc/96/98/82/968969882.db2.gz FPOAWBKEMYSNIB-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO C[NH+](C)[C@H](C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000062331424 969125422 /nfs/dbraw/zinc/12/54/22/969125422.db2.gz ILDPAPOJYYIHLS-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000874846336 1013916084 /nfs/dbraw/zinc/91/60/84/1013916084.db2.gz IRBPBBSGYZUSKX-QZTJIDSGSA-N 1 1 358.442 2.504 20 5 FFBDMO Cc1cc(N2CCC[C@@H](OC(=O)c3cccc([N+](=O)[O-])c3)C2)nc(C)[nH+]1 ZINC000066731267 970102629 /nfs/dbraw/zinc/10/26/29/970102629.db2.gz UPGDGDANUKBCHP-MRXNPFEDSA-N 1 1 356.382 2.827 20 5 FFBDMO COCc1ncc2c(n1)CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C2 ZINC000895414268 970596816 /nfs/dbraw/zinc/59/68/16/970596816.db2.gz CCAKGYAOWWKKDW-ZSOIEALJSA-N 1 1 354.410 2.993 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1 ZINC000875745071 1014070602 /nfs/dbraw/zinc/07/06/02/1014070602.db2.gz HRXTUZHZPANRSR-IRXDYDNUSA-N 1 1 371.441 2.565 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000825842158 1014110631 /nfs/dbraw/zinc/11/06/31/1014110631.db2.gz ZJDYMPHCSFILGF-HZPDHXFCSA-N 1 1 361.442 2.621 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000981137548 976263452 /nfs/dbraw/zinc/26/34/52/976263452.db2.gz WHBXWRZPZKFLBF-RTBURBONSA-N 1 1 357.454 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000981137548 976263455 /nfs/dbraw/zinc/26/34/55/976263455.db2.gz WHBXWRZPZKFLBF-RTBURBONSA-N 1 1 357.454 2.654 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc(C3CCC3)cc2)CC1 ZINC000981137548 976263461 /nfs/dbraw/zinc/26/34/61/976263461.db2.gz WHBXWRZPZKFLBF-RTBURBONSA-N 1 1 357.454 2.654 20 5 FFBDMO Cc1ccc(CCC[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC000981765148 976763674 /nfs/dbraw/zinc/76/36/74/976763674.db2.gz RETCEJVZTSPDET-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccc(CCC[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765148 976763681 /nfs/dbraw/zinc/76/36/81/976763681.db2.gz RETCEJVZTSPDET-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO Cc1ccc(CCC[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765148 976763687 /nfs/dbraw/zinc/76/36/87/976763687.db2.gz RETCEJVZTSPDET-RTBURBONSA-N 1 1 371.481 2.517 20 5 FFBDMO CC/C=C/CC[NH2+]C[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1 ZINC001105423347 979414716 /nfs/dbraw/zinc/41/47/16/979414716.db2.gz OYGBXXMYLCHMKS-NRDRPROZSA-N 1 1 371.481 2.814 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964431 980154320 /nfs/dbraw/zinc/15/43/20/980154320.db2.gz HZFSKGSWCAJXDV-IEBWSBKVSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964431 980154322 /nfs/dbraw/zinc/15/43/22/980154322.db2.gz HZFSKGSWCAJXDV-IEBWSBKVSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964431 980154324 /nfs/dbraw/zinc/15/43/24/980154324.db2.gz HZFSKGSWCAJXDV-IEBWSBKVSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906356521 980637545 /nfs/dbraw/zinc/63/75/45/980637545.db2.gz XYGUTYBUEXYZTH-UHFFFAOYSA-N 1 1 350.806 2.892 20 5 FFBDMO C[C@H]1CC2(CC([NH2+][C@@H](c3nccn3C)c3ccc([N+](=O)[O-])cc3)C2)CO1 ZINC000897780625 982512764 /nfs/dbraw/zinc/51/27/64/982512764.db2.gz XYLFCOVGYHIWGR-CQLILNKWSA-N 1 1 356.426 2.965 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]21 ZINC000878198464 1014910294 /nfs/dbraw/zinc/91/02/94/1014910294.db2.gz WWELDKVQOINJIB-HIFRSBDPSA-N 1 1 357.414 2.561 20 5 FFBDMO C[NH+](C)C1(C)CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000913389870 984251637 /nfs/dbraw/zinc/25/16/37/984251637.db2.gz HSTHTBHHSQIQOE-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1 ZINC000157923276 984704350 /nfs/dbraw/zinc/70/43/50/984704350.db2.gz FAAFPBCWOMPSSE-PMACEKPBSA-N 1 1 356.422 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1 ZINC000157923276 984704358 /nfs/dbraw/zinc/70/43/58/984704358.db2.gz FAAFPBCWOMPSSE-PMACEKPBSA-N 1 1 356.422 2.962 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000172355152 985517971 /nfs/dbraw/zinc/51/79/71/985517971.db2.gz BOGJNUKADOLJSJ-OAHLLOKOSA-N 1 1 354.410 2.571 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)nc1 ZINC000172358450 985518494 /nfs/dbraw/zinc/51/84/94/985518494.db2.gz UKFYBHPESQTGTG-CYBMUJFWSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)nc1 ZINC000172358450 985518500 /nfs/dbraw/zinc/51/85/00/985518500.db2.gz UKFYBHPESQTGTG-CYBMUJFWSA-N 1 1 361.333 2.724 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173467140 985830569 /nfs/dbraw/zinc/83/05/69/985830569.db2.gz YENPSOLWHMOLIO-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000173467140 985830584 /nfs/dbraw/zinc/83/05/84/985830584.db2.gz YENPSOLWHMOLIO-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO COC(=O)[C@H](C)Oc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000921688033 986655876 /nfs/dbraw/zinc/65/58/76/986655876.db2.gz QMSZPZJOTJZRQB-ZDUSSCGKSA-N 1 1 374.393 2.834 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000761598889 987541169 /nfs/dbraw/zinc/54/11/69/987541169.db2.gz KRRCNVWEJALBPA-ZDUSSCGKSA-N 1 1 365.393 2.904 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)cc1[N+](=O)[O-] ZINC000879142905 1015382250 /nfs/dbraw/zinc/38/22/50/1015382250.db2.gz FKFTWQRGUBLGSS-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)cc1[N+](=O)[O-] ZINC000879142905 1015382262 /nfs/dbraw/zinc/38/22/62/1015382262.db2.gz FKFTWQRGUBLGSS-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO C/C(=C/C(=O)NCCC[N@H+]1CCCO[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000762612349 988512970 /nfs/dbraw/zinc/51/29/70/988512970.db2.gz KSQLXDAWSVRMPA-UGEDRFTOSA-N 1 1 361.442 2.615 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000915512410 988771592 /nfs/dbraw/zinc/77/15/92/988771592.db2.gz RROYPVFDIJPFPX-HNNXBMFYSA-N 1 1 358.398 2.812 20 5 FFBDMO C[N@H+](Cc1cnn(-c2ccccc2)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153713643 988900346 /nfs/dbraw/zinc/90/03/46/988900346.db2.gz RCWMSYIEIRUMHP-IBGZPJMESA-N 1 1 352.394 2.946 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243641 1015435541 /nfs/dbraw/zinc/43/55/41/1015435541.db2.gz KKXLPCJTLYYPIA-MJGOQNOKSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243641 1015435546 /nfs/dbraw/zinc/43/55/46/1015435546.db2.gz KKXLPCJTLYYPIA-MJGOQNOKSA-N 1 1 355.394 2.731 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000702628439 990010454 /nfs/dbraw/zinc/01/04/54/990010454.db2.gz LSRAFPLWVSKGCM-GOSISDBHSA-N 1 1 372.381 2.552 20 5 FFBDMO CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000154328943 990175625 /nfs/dbraw/zinc/17/56/25/990175625.db2.gz WLHIISUKAAYEHW-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000154328943 990175628 /nfs/dbraw/zinc/17/56/28/990175628.db2.gz WLHIISUKAAYEHW-RTBURBONSA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1cccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c1 ZINC001034815649 990274579 /nfs/dbraw/zinc/27/45/79/990274579.db2.gz AFSBDWBXKRGLLQ-RTBURBONSA-N 1 1 353.422 2.566 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000195418487 990923856 /nfs/dbraw/zinc/92/38/56/990923856.db2.gz JMXHKDDSRSGITL-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]Cc1ccccc1F)Cc1ccccc1 ZINC001484399436 991562708 /nfs/dbraw/zinc/56/27/08/991562708.db2.gz JEJBGBLSUGDXCG-IEBWSBKVSA-N 1 1 371.412 2.609 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008558 1015731561 /nfs/dbraw/zinc/73/15/61/1015731561.db2.gz FOYNLBVNAIGZKF-CJNGLKHVSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008558 1015731564 /nfs/dbraw/zinc/73/15/64/1015731564.db2.gz FOYNLBVNAIGZKF-CJNGLKHVSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008560 1015731717 /nfs/dbraw/zinc/73/17/17/1015731717.db2.gz FOYNLBVNAIGZKF-CZUORRHYSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)n1 ZINC000880008560 1015731720 /nfs/dbraw/zinc/73/17/20/1015731720.db2.gz FOYNLBVNAIGZKF-CZUORRHYSA-N 1 1 372.450 2.955 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001116097548 1032125084 /nfs/dbraw/zinc/12/50/84/1032125084.db2.gz XPEXGTPQMPBTER-MRXNPFEDSA-N 1 1 354.410 2.944 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000810619216 994842049 /nfs/dbraw/zinc/84/20/49/994842049.db2.gz YZWSPMJZWNUIRS-NSHDSACASA-N 1 1 362.342 2.572 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810615242 994853801 /nfs/dbraw/zinc/85/38/01/994853801.db2.gz IHJYZOYVVBBMBX-LBPRGKRZSA-N 1 1 355.354 2.531 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)ccn1 ZINC000880610951 1015898535 /nfs/dbraw/zinc/89/85/35/1015898535.db2.gz FIWMWSKTUQLCLI-UHFFFAOYSA-N 1 1 355.398 2.642 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000810845663 994951217 /nfs/dbraw/zinc/95/12/17/994951217.db2.gz FQLOMWSYEHRTMH-ZIAGYGMSSA-N 1 1 356.382 2.564 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(N(C)CC(F)F)CC2)c1 ZINC000811465192 995154120 /nfs/dbraw/zinc/15/41/20/995154120.db2.gz SVWBIAQFIUZMPX-UHFFFAOYSA-N 1 1 371.384 2.543 20 5 FFBDMO Cc1cnn([C@H]2CC[N@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)c1 ZINC000811800116 995257447 /nfs/dbraw/zinc/25/74/47/995257447.db2.gz KFAWENPSTXGYCN-SFHVURJKSA-N 1 1 352.398 2.868 20 5 FFBDMO Cc1cnn([C@H]2CC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)c1 ZINC000811800116 995257454 /nfs/dbraw/zinc/25/74/54/995257454.db2.gz KFAWENPSTXGYCN-SFHVURJKSA-N 1 1 352.398 2.868 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812847383 995550777 /nfs/dbraw/zinc/55/07/77/995550777.db2.gz ATDZCURPJMQKSE-KUHUBIRLSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812847383 995550784 /nfs/dbraw/zinc/55/07/84/995550784.db2.gz ATDZCURPJMQKSE-KUHUBIRLSA-N 1 1 357.410 2.977 20 5 FFBDMO COc1cccc(CC(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813170432 995632374 /nfs/dbraw/zinc/63/23/74/995632374.db2.gz OJMBJJFDJOIZBW-IBGZPJMESA-N 1 1 370.405 2.964 20 5 FFBDMO COc1cccc(CC(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000813170432 995632377 /nfs/dbraw/zinc/63/23/77/995632377.db2.gz OJMBJJFDJOIZBW-IBGZPJMESA-N 1 1 370.405 2.964 20 5 FFBDMO O=C(/C=C/C1CCOCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173449 995634990 /nfs/dbraw/zinc/63/49/90/995634990.db2.gz BTCNYFYNWOIFFM-WRFKIARRSA-N 1 1 360.410 2.695 20 5 FFBDMO O=C(/C=C/C1CCOCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173449 995634996 /nfs/dbraw/zinc/63/49/96/995634996.db2.gz BTCNYFYNWOIFFM-WRFKIARRSA-N 1 1 360.410 2.695 20 5 FFBDMO O=C(/C=C\C1CCOCC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173451 995635053 /nfs/dbraw/zinc/63/50/53/995635053.db2.gz BTCNYFYNWOIFFM-XDXAGZTOSA-N 1 1 360.410 2.695 20 5 FFBDMO O=C(/C=C\C1CCOCC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173451 995635058 /nfs/dbraw/zinc/63/50/58/995635058.db2.gz BTCNYFYNWOIFFM-XDXAGZTOSA-N 1 1 360.410 2.695 20 5 FFBDMO C[C@H](CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000826747866 1016058696 /nfs/dbraw/zinc/05/86/96/1016058696.db2.gz YRUXAFBNFUSDOK-BEFAXECRSA-N 1 1 371.437 2.655 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(N)=O ZINC000824608146 997010354 /nfs/dbraw/zinc/01/03/54/997010354.db2.gz BITVRKKFIOLLMW-LBPRGKRZSA-N 1 1 364.402 2.617 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1)C(N)=O ZINC000824608146 997010367 /nfs/dbraw/zinc/01/03/67/997010367.db2.gz BITVRKKFIOLLMW-LBPRGKRZSA-N 1 1 364.402 2.617 20 5 FFBDMO Cc1c(C(=O)NCCC[N@H+](C)CC(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000844653096 998047755 /nfs/dbraw/zinc/04/77/55/998047755.db2.gz DTYRMTOXYJRQQE-UHFFFAOYSA-N 1 1 366.418 2.828 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H](Cc2ccccc2)C1 ZINC000844739938 998109173 /nfs/dbraw/zinc/10/91/73/998109173.db2.gz FFHMUPMILNQIMZ-IBGZPJMESA-N 1 1 365.437 2.761 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000845735770 998643027 /nfs/dbraw/zinc/64/30/27/998643027.db2.gz OPAKTNOENKTFKX-HNNXBMFYSA-N 1 1 358.398 2.810 20 5 FFBDMO C[C@@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741033369 999701808 /nfs/dbraw/zinc/70/18/08/999701808.db2.gz QQODHQLKVIDNBD-UONOGXRCSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741022166 999703662 /nfs/dbraw/zinc/70/36/62/999703662.db2.gz QKPLKQSGJOBHKD-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741022166 999703663 /nfs/dbraw/zinc/70/36/63/999703663.db2.gz QKPLKQSGJOBHKD-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO COc1ccc([C@@H]2[C@@H](COC(=O)c3ccc([N+](=O)[O-])n3C)CC[N@H+]2C)cc1 ZINC000741120414 999709508 /nfs/dbraw/zinc/70/95/08/999709508.db2.gz GDBLFSODIDKNKH-RDTXWAMCSA-N 1 1 373.409 2.792 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000742242108 999766123 /nfs/dbraw/zinc/76/61/23/999766123.db2.gz SDRSDQZGHJHEDT-OAHLLOKOSA-N 1 1 360.458 2.799 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000742423211 999773640 /nfs/dbraw/zinc/77/36/40/999773640.db2.gz IMLVCSMEWYQUTK-KRWDZBQOSA-N 1 1 368.437 2.665 20 5 FFBDMO CC(C)C[C@@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000744437107 999856568 /nfs/dbraw/zinc/85/65/68/999856568.db2.gz GUBSHIPGRUNEQI-LIRRHRJNSA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCCC[N@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011396 1000015710 /nfs/dbraw/zinc/01/57/10/1000015710.db2.gz KDAJAMMPHBZCJR-LSDHHAIUSA-N 1 1 353.463 2.907 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000804330773 1000059254 /nfs/dbraw/zinc/05/92/54/1000059254.db2.gz CKXQLSNMUAKOCY-UHFFFAOYSA-N 1 1 372.381 2.947 20 5 FFBDMO C[N@@H+](CCOC(=O)c1cc(F)cc([N+](=O)[O-])c1N)Cc1ccc(F)cc1 ZINC000769086787 1000432669 /nfs/dbraw/zinc/43/26/69/1000432669.db2.gz JVSPECXIILKASR-UHFFFAOYSA-N 1 1 365.336 2.744 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC001146308776 1000654773 /nfs/dbraw/zinc/65/47/73/1000654773.db2.gz YQLCGKPIUKXODR-AWEZNQCLSA-N 1 1 372.425 2.512 20 5 FFBDMO O=C1OCC[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000770393185 1000767360 /nfs/dbraw/zinc/76/73/60/1000767360.db2.gz ROLYAEXMJRZGSC-OAHLLOKOSA-N 1 1 357.366 2.881 20 5 FFBDMO O=C1OCC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CCN12 ZINC000770393185 1000767363 /nfs/dbraw/zinc/76/73/63/1000767363.db2.gz ROLYAEXMJRZGSC-OAHLLOKOSA-N 1 1 357.366 2.881 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ncccn1 ZINC001147420118 1000893413 /nfs/dbraw/zinc/89/34/13/1000893413.db2.gz KZRHQIUCTZOCTJ-UHFFFAOYSA-N 1 1 359.389 2.733 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)s1 ZINC000771223086 1001055078 /nfs/dbraw/zinc/05/50/78/1001055078.db2.gz CCMVEOMNQWCRLV-QGZVFWFLSA-N 1 1 372.406 2.800 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000787577713 1001699638 /nfs/dbraw/zinc/69/96/38/1001699638.db2.gz CZZRYHRGXZMLIP-RMKNXTFCSA-N 1 1 361.442 2.567 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000788116902 1001756437 /nfs/dbraw/zinc/75/64/37/1001756437.db2.gz LBHBSNCTCDNLNI-HZPDHXFCSA-N 1 1 359.426 2.979 20 5 FFBDMO Cc1ccc(C)c(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001276200963 1016526959 /nfs/dbraw/zinc/52/69/59/1016526959.db2.gz XLDVETGEIVNUCU-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791395351 1002689282 /nfs/dbraw/zinc/68/92/82/1002689282.db2.gz RQTYWCKWLFZGDE-SJKOYZFVSA-N 1 1 372.400 2.566 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+](C)Cc2nnc3ccccn32)c([N+](=O)[O-])c1 ZINC001170336160 1003118573 /nfs/dbraw/zinc/11/85/73/1003118573.db2.gz VAONSZJKQPXWJB-CYBMUJFWSA-N 1 1 355.398 2.709 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@@H+](C)Cc2nnc3ccccn32)c([N+](=O)[O-])c1 ZINC001170336160 1003118580 /nfs/dbraw/zinc/11/85/80/1003118580.db2.gz VAONSZJKQPXWJB-CYBMUJFWSA-N 1 1 355.398 2.709 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](Oc3ncccn3)C2)c([N+](=O)[O-])c1 ZINC001170354849 1003123016 /nfs/dbraw/zinc/12/30/16/1003123016.db2.gz QGXXZYUAXYJQSO-RHSMWYFYSA-N 1 1 372.425 2.868 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@H](Oc3nccc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001170356060 1003123060 /nfs/dbraw/zinc/12/30/60/1003123060.db2.gz VIMLCEKHFNDGGJ-YOEHRIQHSA-N 1 1 372.425 2.786 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC001186800328 1003414674 /nfs/dbraw/zinc/41/46/74/1003414674.db2.gz OVXITGYOCCSGGG-GFCCVEGCSA-N 1 1 361.489 2.508 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000805774449 1004127233 /nfs/dbraw/zinc/12/72/33/1004127233.db2.gz KYJKJMCDRDDACA-INIZCTEOSA-N 1 1 365.430 2.964 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000805776594 1004129060 /nfs/dbraw/zinc/12/90/60/1004129060.db2.gz RQTHKJPJWGSHCI-INIZCTEOSA-N 1 1 365.430 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@H]3COC[C@@]3(c3ccccc3)C2)cc1 ZINC001197683045 1004320826 /nfs/dbraw/zinc/32/08/26/1004320826.db2.gz RTPVPQGQDUJYQJ-YSIASYRMSA-N 1 1 354.406 2.528 20 5 FFBDMO Cn1c[nH+]c2c1ccc1c2CCCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198676145 1004707319 /nfs/dbraw/zinc/70/73/19/1004707319.db2.gz IOBQIGQEXUFUJU-SFHVURJKSA-N 1 1 352.394 2.968 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000747464545 1004781469 /nfs/dbraw/zinc/78/14/69/1004781469.db2.gz AJCJSLZTCLEJON-IBGZPJMESA-N 1 1 355.442 2.737 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000747464547 1004781635 /nfs/dbraw/zinc/78/16/35/1004781635.db2.gz AJCJSLZTCLEJON-LJQANCHMSA-N 1 1 355.442 2.737 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001050243742 1016929788 /nfs/dbraw/zinc/92/97/88/1016929788.db2.gz FOQMCEBJDJSOOT-RTBURBONSA-N 1 1 371.481 2.980 20 5 FFBDMO C[N@@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001050243742 1016929808 /nfs/dbraw/zinc/92/98/08/1016929808.db2.gz FOQMCEBJDJSOOT-RTBURBONSA-N 1 1 371.481 2.980 20 5 FFBDMO C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001050243742 1016929824 /nfs/dbraw/zinc/92/98/24/1016929824.db2.gz FOQMCEBJDJSOOT-RTBURBONSA-N 1 1 371.481 2.980 20 5 FFBDMO COc1ccc(C[NH2+][C@H](CC(N)=O)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC001201735737 1005267375 /nfs/dbraw/zinc/26/73/75/1005267375.db2.gz WLGBVEPGLPJLAR-CQSZACIVSA-N 1 1 363.801 2.963 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000776574166 1005953236 /nfs/dbraw/zinc/95/32/36/1005953236.db2.gz DPWFYMLVCMFYSK-SJORKVTESA-N 1 1 358.394 2.790 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nnc4ccccn43)C2)cc1 ZINC000776584281 1005954951 /nfs/dbraw/zinc/95/49/51/1005954951.db2.gz KAZOSAJAJKXDFE-WBVHZDCISA-N 1 1 367.409 2.551 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000852496925 1006054547 /nfs/dbraw/zinc/05/45/47/1006054547.db2.gz SKSKMGHBXRSDAI-MHORFTMASA-N 1 1 362.426 2.682 20 5 FFBDMO CCOC1CC2(C1)CC[N@H+](Cn1cc([N+](=O)[O-])c(-c3ccccn3)n1)C2 ZINC000853512394 1006421067 /nfs/dbraw/zinc/42/10/67/1006421067.db2.gz DSTODNSLCRMXEE-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO CCOC1CC2(C1)CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c3ccccn3)n1)C2 ZINC000853512394 1006421071 /nfs/dbraw/zinc/42/10/71/1006421071.db2.gz DSTODNSLCRMXEE-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCN(C(C)C)CC1 ZINC000817239395 1007492402 /nfs/dbraw/zinc/49/24/02/1007492402.db2.gz RJDACWQTYCRMDO-UHFFFAOYSA-N 1 1 363.458 2.785 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000856354739 1007784511 /nfs/dbraw/zinc/78/45/11/1007784511.db2.gz KOCMPWLHJZJMFX-OAHLLOKOSA-N 1 1 373.384 2.503 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C ZINC001190869193 1007819845 /nfs/dbraw/zinc/81/98/45/1007819845.db2.gz TZVOZGUMRVKFRQ-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000820009896 1008265229 /nfs/dbraw/zinc/26/52/29/1008265229.db2.gz XCEKTIVFFQFZQW-CRAIPNDOSA-N 1 1 366.421 2.934 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1cccn1 ZINC000821172196 1008427058 /nfs/dbraw/zinc/42/70/58/1008427058.db2.gz YZJUQPXHICBIBI-PBHICJAKSA-N 1 1 358.398 2.560 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1cccn1 ZINC000821172196 1008427061 /nfs/dbraw/zinc/42/70/61/1008427061.db2.gz YZJUQPXHICBIBI-PBHICJAKSA-N 1 1 358.398 2.560 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@](O)(c2ccccc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000859588998 1008580930 /nfs/dbraw/zinc/58/09/30/1008580930.db2.gz ZFUTYBDSTXVADX-HXUWFJFHSA-N 1 1 369.421 2.907 20 5 FFBDMO O=C(COC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000859669788 1008612535 /nfs/dbraw/zinc/61/25/35/1008612535.db2.gz JBEADWQHVMTHFY-MRXNPFEDSA-N 1 1 364.373 2.867 20 5 FFBDMO O=C(COC(=O)[C@H]1CCC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000859669788 1008612542 /nfs/dbraw/zinc/61/25/42/1008612542.db2.gz JBEADWQHVMTHFY-MRXNPFEDSA-N 1 1 364.373 2.867 20 5 FFBDMO COc1cccc([C@H](O)C2CC[NH+](Cc3onc(C)c3[N+](=O)[O-])CC2)c1 ZINC000860134657 1008850887 /nfs/dbraw/zinc/85/08/87/1008850887.db2.gz YEXXZWZMMGSTBB-GOSISDBHSA-N 1 1 361.398 2.845 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cc(F)ccc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458407 1008995654 /nfs/dbraw/zinc/99/56/54/1008995654.db2.gz GAYZALILTULUPC-GDBMZVCRSA-N 1 1 371.840 2.911 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@](C)(O)c1ccccc1 ZINC000823584205 1009120382 /nfs/dbraw/zinc/12/03/82/1009120382.db2.gz CDXQQXSAXNOWIR-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@](C)(O)c1ccccc1 ZINC000823584205 1009120393 /nfs/dbraw/zinc/12/03/93/1009120393.db2.gz CDXQQXSAXNOWIR-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000823956525 1009277443 /nfs/dbraw/zinc/27/74/43/1009277443.db2.gz SKSUWUJSSLDTLM-DOTOQJQBSA-N 1 1 355.398 2.744 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N2CCCCC2)c1 ZINC001179341821 1009322319 /nfs/dbraw/zinc/32/23/19/1009322319.db2.gz HHMTUZYYNLBGTM-UHFFFAOYSA-N 1 1 359.361 2.954 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866638 1009789013 /nfs/dbraw/zinc/78/90/13/1009789013.db2.gz MBNHMAVEZHPEGF-CQSZACIVSA-N 1 1 357.370 2.627 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000890081708 1010261820 /nfs/dbraw/zinc/26/18/20/1010261820.db2.gz LZZXOPGALVDRAE-UHFFFAOYSA-N 1 1 374.485 2.659 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000715599260 1010353687 /nfs/dbraw/zinc/35/36/87/1010353687.db2.gz UIHIVPIMZOPOAC-CYBMUJFWSA-N 1 1 361.348 2.877 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc(F)c([N+](=O)[O-])cc1F ZINC000715599260 1010353697 /nfs/dbraw/zinc/35/36/97/1010353697.db2.gz UIHIVPIMZOPOAC-CYBMUJFWSA-N 1 1 361.348 2.877 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000121097154 1011007349 /nfs/dbraw/zinc/00/73/49/1011007349.db2.gz OHGFMLOIEBNRRS-UHFFFAOYSA-N 1 1 373.457 2.839 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@H](O)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000866638047 1011028966 /nfs/dbraw/zinc/02/89/66/1011028966.db2.gz CTWOKGNYJVICBP-ROUUACIJSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@@H](C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870087304 1012116779 /nfs/dbraw/zinc/11/67/79/1012116779.db2.gz BYCRXBQKUHZVTG-FZKQIMNGSA-N 1 1 355.394 2.577 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2cn(C)nc21 ZINC001172909495 1012122404 /nfs/dbraw/zinc/12/24/04/1012122404.db2.gz SYTFYLLFFUVNOX-ZWKOTPCHSA-N 1 1 370.453 2.822 20 5 FFBDMO CC(C)C(=O)N[C@@H]1[C@H]2C[N@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@H]21 ZINC001172909751 1012122592 /nfs/dbraw/zinc/12/25/92/1012122592.db2.gz IPAJTTQOKGFJIJ-YSHGAJCASA-N 1 1 357.454 2.545 20 5 FFBDMO CCO[C@@H]1C[C@H]2C[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CCN2C1 ZINC001172910204 1012122638 /nfs/dbraw/zinc/12/26/38/1012122638.db2.gz KXGNFKLXTPHRFX-YSIASYRMSA-N 1 1 359.470 2.637 20 5 FFBDMO CCO[C@@H]1C[C@H]2CN([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[N@@H+]2C1 ZINC001172910204 1012122644 /nfs/dbraw/zinc/12/26/44/1012122644.db2.gz KXGNFKLXTPHRFX-YSIASYRMSA-N 1 1 359.470 2.637 20 5 FFBDMO CCO[C@@H]1C[C@H]2CN([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[N@H+]2C1 ZINC001172910204 1012122651 /nfs/dbraw/zinc/12/26/51/1012122651.db2.gz KXGNFKLXTPHRFX-YSIASYRMSA-N 1 1 359.470 2.637 20 5 FFBDMO COC[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2cn(C)nc21 ZINC001172909487 1012123489 /nfs/dbraw/zinc/12/34/89/1012123489.db2.gz SYTFYLLFFUVNOX-MSOLQXFVSA-N 1 1 370.453 2.822 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCCO1 ZINC001173009442 1012180006 /nfs/dbraw/zinc/18/00/06/1012180006.db2.gz CICGFZDOPSPXRX-GFCCVEGCSA-N 1 1 355.385 2.953 20 5 FFBDMO C[C@@H]1COCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010632 1012181898 /nfs/dbraw/zinc/18/18/98/1012181898.db2.gz WNVLQRYIVXKJCK-LBPRGKRZSA-N 1 1 355.385 2.810 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870138402 1012183551 /nfs/dbraw/zinc/18/35/51/1012183551.db2.gz FALFTKLXCHUZOY-SFHVURJKSA-N 1 1 355.394 2.699 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCOC[C@@H]3C3CC3)CC2)c(F)c1 ZINC001173019514 1012192155 /nfs/dbraw/zinc/19/21/55/1012192155.db2.gz LUYYHLMNMVZHJX-QGZVFWFLSA-N 1 1 367.396 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@H](n3ccnn3)C2)c1F ZINC001173191164 1012330899 /nfs/dbraw/zinc/33/08/99/1012330899.db2.gz AVCYMOQDUJCPSB-CHWSQXEVSA-N 1 1 363.393 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CCC(C[NH+](C)C)CC2)c1F ZINC001173189652 1012331025 /nfs/dbraw/zinc/33/10/25/1012331025.db2.gz LLPCHNBNMDIWJU-ZDUSSCGKSA-N 1 1 353.438 2.947 20 5 FFBDMO CCOC(=O)c1cc2n(n1)CCC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173220799 1012352567 /nfs/dbraw/zinc/35/25/67/1012352567.db2.gz CPRWAWXBWCFAOY-AWEZNQCLSA-N 1 1 372.425 2.805 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN(Cc2ccccc2)[C@@H](CO)C1 ZINC001173224443 1012358510 /nfs/dbraw/zinc/35/85/10/1012358510.db2.gz FWOVRMCFNQYBJR-LAUBAEHRSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001173224443 1012358536 /nfs/dbraw/zinc/35/85/36/1012358536.db2.gz FWOVRMCFNQYBJR-LAUBAEHRSA-N 1 1 369.465 2.705 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](Cc2ccccc2)[C@@H](CO)C1 ZINC001173224443 1012358546 /nfs/dbraw/zinc/35/85/46/1012358546.db2.gz FWOVRMCFNQYBJR-LAUBAEHRSA-N 1 1 369.465 2.705 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173227425 1012360720 /nfs/dbraw/zinc/36/07/20/1012360720.db2.gz OGWJQOHYLNGZKW-NVXWUHKLSA-N 1 1 358.442 2.891 20 5 FFBDMO CCCCC[N@@H+](C)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173695530 1012902368 /nfs/dbraw/zinc/90/23/68/1012902368.db2.gz FVBFWRRSSKIECQ-UHFFFAOYSA-N 1 1 369.487 2.870 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000927056895 1018340525 /nfs/dbraw/zinc/34/05/25/1018340525.db2.gz NJTSOOUBDRCKMI-MXASKKJJSA-N 1 1 372.425 2.690 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCCN(C=O)CC3)o2)c([N+](=O)[O-])c1 ZINC000827876838 1018850384 /nfs/dbraw/zinc/85/03/84/1018850384.db2.gz FNDIOACYWBNTRU-UHFFFAOYSA-N 1 1 359.382 2.528 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000777735245 1019207736 /nfs/dbraw/zinc/20/77/36/1019207736.db2.gz XSGVUJYFWDBUIX-BFUOFWGJSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000777735245 1019207744 /nfs/dbraw/zinc/20/77/44/1019207744.db2.gz XSGVUJYFWDBUIX-BFUOFWGJSA-N 1 1 373.384 2.654 20 5 FFBDMO CN(C)c1ccc(-c2nnc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC001217714652 1032846672 /nfs/dbraw/zinc/84/66/72/1032846672.db2.gz KBZGABJAOHNGNO-MRXNPFEDSA-N 1 1 353.382 2.953 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000930314221 1019975114 /nfs/dbraw/zinc/97/51/14/1019975114.db2.gz DEZUYMDPJFHIQE-OAHLLOKOSA-N 1 1 362.430 2.586 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCO[C@@H]1CCOC1)[C@H]1CC[C@H](O)CC1 ZINC000930809886 1020197824 /nfs/dbraw/zinc/19/78/24/1020197824.db2.gz OVRKFGNHZFNJQD-KZNAEPCWSA-N 1 1 364.442 2.506 20 5 FFBDMO C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C(=O)OC(C)(C)C ZINC000828917137 1032903636 /nfs/dbraw/zinc/90/36/36/1032903636.db2.gz DOOLIINGPWUFHC-KBRIMQKVSA-N 1 1 364.442 2.928 20 5 FFBDMO C[C@]1([C@H]2CCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)COC(=O)N1 ZINC000932016177 1020667069 /nfs/dbraw/zinc/66/70/69/1020667069.db2.gz JJYNESCJPRKCDK-KBXCAEBGSA-N 1 1 363.414 2.574 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H]([C@]3(C)COC(=O)N3)C2)ccc1[N+](=O)[O-] ZINC000932018127 1020668321 /nfs/dbraw/zinc/66/83/21/1020668321.db2.gz ACKAJDCFKUINGD-KDOFPFPSSA-N 1 1 363.414 2.704 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]([C@]2(C)COC(=O)N2)C1 ZINC000932027431 1020673688 /nfs/dbraw/zinc/67/36/88/1020673688.db2.gz YJUYQKNGZWJLKY-KSSFIOAISA-N 1 1 363.414 2.704 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932134195 1020714531 /nfs/dbraw/zinc/71/45/31/1020714531.db2.gz HZFXSYJGUIJUFA-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932136891 1020716358 /nfs/dbraw/zinc/71/63/58/1020716358.db2.gz LOACDOBSFOVLLT-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932136891 1020716364 /nfs/dbraw/zinc/71/63/64/1020716364.db2.gz LOACDOBSFOVLLT-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1c(F)cc([N+](=O)[O-])cc1F ZINC000803374911 1020788701 /nfs/dbraw/zinc/78/87/01/1020788701.db2.gz QAVGPCHWPCWSLM-INIZCTEOSA-N 1 1 372.368 2.709 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)C[C@H]1CC(C)C ZINC000933246517 1020982645 /nfs/dbraw/zinc/98/26/45/1020982645.db2.gz CFUFZWPPDNMAGX-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)C[C@H]1CC(C)C ZINC000933246517 1020982650 /nfs/dbraw/zinc/98/26/50/1020982650.db2.gz CFUFZWPPDNMAGX-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)C[C@H]1CC(C)C ZINC000933246517 1020982655 /nfs/dbraw/zinc/98/26/55/1020982655.db2.gz CFUFZWPPDNMAGX-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC001116507924 1021253362 /nfs/dbraw/zinc/25/33/62/1021253362.db2.gz VNJWGHWSWNBSAU-HNNXBMFYSA-N 1 1 366.849 2.670 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]12CC[C@H]1CC[N@@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660782 1021327573 /nfs/dbraw/zinc/32/75/73/1021327573.db2.gz ZTQSGDQRSNJCGQ-KSSFIOAISA-N 1 1 362.430 2.869 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@]12CC[C@H]1CC[N@H+]2Cc1cccnc1[N+](=O)[O-] ZINC000934660782 1021327590 /nfs/dbraw/zinc/32/75/90/1021327590.db2.gz ZTQSGDQRSNJCGQ-KSSFIOAISA-N 1 1 362.430 2.869 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000750095459 1021337910 /nfs/dbraw/zinc/33/79/10/1021337910.db2.gz YUKCXNWHXKVDQT-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC000934836970 1021421797 /nfs/dbraw/zinc/42/17/97/1021421797.db2.gz GUIPBEFTCXMJCB-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807071 1021428596 /nfs/dbraw/zinc/42/85/96/1021428596.db2.gz QIZRGKQCFBKYCE-NVXWUHKLSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001116807071 1021428604 /nfs/dbraw/zinc/42/86/04/1021428604.db2.gz QIZRGKQCFBKYCE-NVXWUHKLSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1C ZINC001137745835 1033002406 /nfs/dbraw/zinc/00/24/06/1033002406.db2.gz KXPQMGOTCNEKEY-UHFFFAOYSA-N 1 1 363.458 2.642 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)C(C)(C)CN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC001118844995 1022433939 /nfs/dbraw/zinc/43/39/39/1022433939.db2.gz QFRKEXPPKYNLLR-UHFFFAOYSA-N 1 1 371.441 2.833 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000750732950 1022443932 /nfs/dbraw/zinc/44/39/32/1022443932.db2.gz ZDRRDONNBJZMQA-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000778942693 1022555269 /nfs/dbraw/zinc/55/52/69/1022555269.db2.gz PPHBSGMHLJCXJR-AWEZNQCLSA-N 1 1 365.430 2.950 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000754360882 1023459980 /nfs/dbraw/zinc/45/99/80/1023459980.db2.gz OMGZBCHTFGOQGY-AWHXWDPHSA-N 1 1 373.453 2.758 20 5 FFBDMO C[C@H](OC(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000755891981 1023647310 /nfs/dbraw/zinc/64/73/10/1023647310.db2.gz YYSQSKLHASXCTN-RDJZCZTQSA-N 1 1 372.425 2.635 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000837158357 1025623625 /nfs/dbraw/zinc/62/36/25/1025623625.db2.gz BSQCQWNYQWHATP-INIZCTEOSA-N 1 1 372.400 2.587 20 5 FFBDMO C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[N@H+]2CCC[C@H]2C2CCC2)C1=O ZINC000246014327 1025695489 /nfs/dbraw/zinc/69/54/89/1025695489.db2.gz LHSOAHUWIQPKPZ-QFBILLFUSA-N 1 1 372.425 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@@H]3O)n2)cc1 ZINC000840117674 1026965340 /nfs/dbraw/zinc/96/53/40/1026965340.db2.gz WCVCOESDWYUQCK-KURKYZTESA-N 1 1 371.441 2.826 20 5 FFBDMO CC(C)[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(=O)N1CCCC1 ZINC001159140803 1027280697 /nfs/dbraw/zinc/28/06/97/1027280697.db2.gz XQVJJJIUSHYIEI-JEJOPICUSA-N 1 1 361.446 2.581 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC001159187695 1027299619 /nfs/dbraw/zinc/29/96/19/1027299619.db2.gz CCYCYSMUCQMXGL-KAVBBEAFSA-N 1 1 363.417 2.855 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000248055080 1027375684 /nfs/dbraw/zinc/37/56/84/1027375684.db2.gz OFPGUDORLRVHRG-QAPCUYQASA-N 1 1 354.410 2.661 20 5 FFBDMO Cc1cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)s1 ZINC001160090428 1027586867 /nfs/dbraw/zinc/58/68/67/1027586867.db2.gz FURGTLQRLWXALP-IAGOWNOFSA-N 1 1 363.483 2.669 20 5 FFBDMO Cc1cc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001160090428 1027586877 /nfs/dbraw/zinc/58/68/77/1027586877.db2.gz FURGTLQRLWXALP-IAGOWNOFSA-N 1 1 363.483 2.669 20 5 FFBDMO Cc1cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001160090428 1027586889 /nfs/dbraw/zinc/58/68/89/1027586889.db2.gz FURGTLQRLWXALP-IAGOWNOFSA-N 1 1 363.483 2.669 20 5 FFBDMO Cc1nn(C[N@H+]2CC=C(c3ccnn3C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795659521 1027604659 /nfs/dbraw/zinc/60/46/59/1027604659.db2.gz ZCPOYSKFSMMCOB-UHFFFAOYSA-N 1 1 352.398 2.733 20 5 FFBDMO Cc1nn(C[N@@H+]2CC=C(c3ccnn3C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795659521 1027604666 /nfs/dbraw/zinc/60/46/66/1027604666.db2.gz ZCPOYSKFSMMCOB-UHFFFAOYSA-N 1 1 352.398 2.733 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795718178 1027965202 /nfs/dbraw/zinc/96/52/02/1027965202.db2.gz LDCSBMJLKCCMAX-HNNXBMFYSA-N 1 1 372.347 2.990 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000795718178 1027965217 /nfs/dbraw/zinc/96/52/17/1027965217.db2.gz LDCSBMJLKCCMAX-HNNXBMFYSA-N 1 1 372.347 2.990 20 5 FFBDMO Nc1ccc[nH+]c1N1CCN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC1 ZINC001154782471 1028448563 /nfs/dbraw/zinc/44/85/63/1028448563.db2.gz PHJRLDKVJHUWEP-UHFFFAOYSA-N 1 1 369.212 2.600 20 5 FFBDMO C[N@H+]1CCC[C@](C)(Nc2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])C1 ZINC001162336423 1028507388 /nfs/dbraw/zinc/50/73/88/1028507388.db2.gz BCENBYPLFOMNOD-NSHDSACASA-N 1 1 353.732 2.953 20 5 FFBDMO Cc1ccc2c(c1)[C@@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(=O)N2 ZINC001155111034 1028584159 /nfs/dbraw/zinc/58/41/59/1028584159.db2.gz OAGQONQXILGZAT-DKRLNXSXSA-N 1 1 353.382 2.936 20 5 FFBDMO CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1ncnc2cccc([N+](=O)[O-])c21 ZINC001162882187 1028692367 /nfs/dbraw/zinc/69/23/67/1028692367.db2.gz ZNODBLLIHWOJBW-OAHLLOKOSA-N 1 1 359.430 2.697 20 5 FFBDMO CCOc1nc(N[C@H](C[NH+]2CCOCC2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC001162880912 1028693046 /nfs/dbraw/zinc/69/30/46/1028693046.db2.gz NRCXZFSIUJVOKI-CQSZACIVSA-N 1 1 352.435 2.547 20 5 FFBDMO COCc1cccc([C@H](CO)Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)c1 ZINC001162913487 1028708738 /nfs/dbraw/zinc/70/87/38/1028708738.db2.gz UHBHFDDVYIWRBR-OZSKJFCKSA-N 1 1 372.425 2.814 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000780764284 1028798628 /nfs/dbraw/zinc/79/86/28/1028798628.db2.gz JLBRHAZZYOKAOU-UYAOXDASSA-N 1 1 366.421 2.915 20 5 FFBDMO COC(=O)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1ccc(O)cc1 ZINC001163503985 1028951723 /nfs/dbraw/zinc/95/17/23/1028951723.db2.gz LYZHKHPPWWZDHE-GOSISDBHSA-N 1 1 371.393 2.615 20 5 FFBDMO COC(=O)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1ccc(O)cc1 ZINC001163503985 1028951732 /nfs/dbraw/zinc/95/17/32/1028951732.db2.gz LYZHKHPPWWZDHE-GOSISDBHSA-N 1 1 371.393 2.615 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C(C)(C)C ZINC001163930820 1029120991 /nfs/dbraw/zinc/12/09/91/1029120991.db2.gz WYCJPTMTXFZVCY-QGZVFWFLSA-N 1 1 371.441 2.787 20 5 FFBDMO Cc1c[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)cc1[N+](=O)[O-] ZINC001164485325 1029292183 /nfs/dbraw/zinc/29/21/83/1029292183.db2.gz IJLQOCDLZVBTQD-OKZBNKHCSA-N 1 1 368.437 2.859 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001165083548 1029370828 /nfs/dbraw/zinc/37/08/28/1029370828.db2.gz GXWKUOUYSBUNLE-RHSMWYFYSA-N 1 1 369.381 2.609 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nc(C(F)(F)F)nc1NCC[NH+]1CCSCC1 ZINC001157045489 1029449747 /nfs/dbraw/zinc/44/97/47/1029449747.db2.gz IUMPQGAGOYXJJL-UHFFFAOYSA-N 1 1 371.772 2.518 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](n2ccnc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782488634 1029717533 /nfs/dbraw/zinc/71/75/33/1029717533.db2.gz GHHIDWRZMDQSAJ-CQSZACIVSA-N 1 1 361.377 2.596 20 5 FFBDMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782509781 1029725830 /nfs/dbraw/zinc/72/58/30/1029725830.db2.gz QVRDQORDRXMNDS-KBPBESRZSA-N 1 1 366.437 2.867 20 5 FFBDMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1C ZINC000782509781 1029725835 /nfs/dbraw/zinc/72/58/35/1029725835.db2.gz QVRDQORDRXMNDS-KBPBESRZSA-N 1 1 366.437 2.867 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001142221482 1030180860 /nfs/dbraw/zinc/18/08/60/1030180860.db2.gz FGGBLTJMDFYMNU-KBPBESRZSA-N 1 1 371.441 2.835 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001142303914 1030288814 /nfs/dbraw/zinc/28/88/14/1030288814.db2.gz WQFDCPSJKCYXSA-CMPLNLGQSA-N 1 1 363.805 2.537 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000784034541 1030430564 /nfs/dbraw/zinc/43/05/64/1030430564.db2.gz LCUWVXCXQLCSPI-ZDUSSCGKSA-N 1 1 360.414 2.689 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000784031124 1030431278 /nfs/dbraw/zinc/43/12/78/1030431278.db2.gz JWIXJHQIAGMSJX-LIRRHRJNSA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000784513616 1030657526 /nfs/dbraw/zinc/65/75/26/1030657526.db2.gz DDZYBDXMQZMUAH-MRXNPFEDSA-N 1 1 374.485 2.611 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]3[C@H]3CCCOC3)n2)c1 ZINC000842616423 1030825915 /nfs/dbraw/zinc/82/59/15/1030825915.db2.gz ORMKIKGISRKJBW-DOTOQJQBSA-N 1 1 357.414 2.702 20 5 FFBDMO C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000798527097 1031444466 /nfs/dbraw/zinc/44/44/66/1031444466.db2.gz NIIJXOSUPOVRSP-LJQANCHMSA-N 1 1 354.410 2.632 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C[C@@]2(C)C1 ZINC001149671872 1031565750 /nfs/dbraw/zinc/56/57/50/1031565750.db2.gz OLQYZCXXTARLHK-CALCHBBNSA-N 1 1 351.834 2.591 20 5 FFBDMO C[C@@H](OCc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001224108831 1033719720 /nfs/dbraw/zinc/71/97/20/1033719720.db2.gz LCLQVOJREHMSQE-QAPCUYQASA-N 1 1 357.410 2.796 20 5 FFBDMO C[C@@H](OCc1ccc([N+](=O)[O-])nc1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001224108831 1033719735 /nfs/dbraw/zinc/71/97/35/1033719735.db2.gz LCLQVOJREHMSQE-QAPCUYQASA-N 1 1 357.410 2.796 20 5 FFBDMO O=[N+]([O-])c1ccc(COC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cn1 ZINC001224114243 1033724483 /nfs/dbraw/zinc/72/44/83/1033724483.db2.gz MSFWKTUINKCGTC-GOSISDBHSA-N 1 1 357.410 2.798 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccnc(C[NH+](C)C)c1)c1ccccc1[N+](=O)[O-] ZINC001219714972 1033784459 /nfs/dbraw/zinc/78/44/59/1033784459.db2.gz FOSRBENWYHTPMT-ZDUSSCGKSA-N 1 1 357.414 2.977 20 5 FFBDMO CC1([NH+]2CCCCC2)CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000832247942 1034670463 /nfs/dbraw/zinc/67/04/63/1034670463.db2.gz ADGNXNLOICDPLA-UHFFFAOYSA-N 1 1 371.441 2.952 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@@H+]2C[C@H](Oc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001227479730 1035572256 /nfs/dbraw/zinc/57/22/56/1035572256.db2.gz JJSAGCXWKICGFL-UONOGXRCSA-N 1 1 363.414 2.667 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@H](Oc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001227479730 1035572275 /nfs/dbraw/zinc/57/22/75/1035572275.db2.gz JJSAGCXWKICGFL-UONOGXRCSA-N 1 1 363.414 2.667 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(OC2CCN(c3cc[nH+]cc3)CC2)cc1O ZINC001228813620 1036340431 /nfs/dbraw/zinc/34/04/31/1036340431.db2.gz DQEJBYWNQMAWTG-UHFFFAOYSA-N 1 1 373.365 2.530 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]1[N@H+]2C ZINC001229964091 1037005705 /nfs/dbraw/zinc/00/57/05/1037005705.db2.gz NZUSUTKVJPZSGE-SPGJAERMSA-N 1 1 354.790 2.794 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cnc4ccc(=O)n5c6ccccc6c3c45)[C@H]1CC(=O)C2 ZINC001234710502 1037151207 /nfs/dbraw/zinc/15/12/07/1037151207.db2.gz JHXGDWKIBCQBHQ-RZAIGCCYSA-N 1 1 373.412 2.622 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2c(C)cc(Br)cc2[N+](=O)[O-])C1 ZINC001230934722 1037411020 /nfs/dbraw/zinc/41/10/20/1037411020.db2.gz NKLCUIRUMQXOPE-GFCCVEGCSA-N 1 1 359.220 2.765 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H](CO)CC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256092910 1038377722 /nfs/dbraw/zinc/37/77/22/1038377722.db2.gz AYVRLHZUKFRARH-LSDHHAIUSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H]4CCO[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256094207 1038380347 /nfs/dbraw/zinc/38/03/47/1038380347.db2.gz VMMSXOVBARVZGL-KUHUBIRLSA-N 1 1 361.442 2.683 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCn4cccc4C3)CC2)ccc1[N+](=O)[O-] ZINC001256099576 1038383912 /nfs/dbraw/zinc/38/39/12/1038383912.db2.gz RSGZGLNFHSGJGU-UHFFFAOYSA-N 1 1 356.426 2.890 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c(C)c1[N+](=O)[O-] ZINC001208543346 1038400165 /nfs/dbraw/zinc/40/01/65/1038400165.db2.gz AIWSKTWJQVUSRU-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1-c1nc2ccc(N3CC[NH+](C)CC3)cc2[nH]1 ZINC001251473430 1039148368 /nfs/dbraw/zinc/14/83/68/1039148368.db2.gz BHBOLWAXHOYZQD-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001246879257 1039515660 /nfs/dbraw/zinc/51/56/60/1039515660.db2.gz NVMNJJJHBNLINN-BSIFCXSSSA-N 1 1 351.450 2.999 20 5 FFBDMO COc1cc(OC)cc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC001247666178 1039875285 /nfs/dbraw/zinc/87/52/85/1039875285.db2.gz MCFBDZVUWUCXCN-HNNXBMFYSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCC[C@](O)(CF)CC3)CC2)cc1 ZINC001254473973 1040738545 /nfs/dbraw/zinc/73/85/45/1040738545.db2.gz KKHRWABCWPJHDS-GOSISDBHSA-N 1 1 351.422 2.750 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH+]3CC(Oc4cccnc4)C3)CC2)cc1 ZINC001254478566 1040745390 /nfs/dbraw/zinc/74/53/90/1040745390.db2.gz GUDXBCYFVUZSTN-UHFFFAOYSA-N 1 1 354.410 2.722 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncc(Br)cn1 ZINC001254539436 1040788581 /nfs/dbraw/zinc/78/85/81/1040788581.db2.gz HPXLFGGSXMPAEO-JTQLQIEISA-N 1 1 351.204 2.868 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(CCc2ccccn2)CC1 ZINC001254563600 1040802659 /nfs/dbraw/zinc/80/26/59/1040802659.db2.gz ZJAAUQVBPAEOJA-KRWDZBQOSA-N 1 1 354.454 2.781 20 5 FFBDMO CN1c2ccccc2[C@]2(CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1=O ZINC001254594670 1040821814 /nfs/dbraw/zinc/82/18/14/1040821814.db2.gz HADLFLYZPCGMGA-LAUBAEHRSA-N 1 1 363.417 2.682 20 5 FFBDMO O=C(c1ccco1)N1CC[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254593813 1040822828 /nfs/dbraw/zinc/82/28/28/1040822828.db2.gz BXHITUKTUOBVOP-JCGIZDLHSA-N 1 1 367.405 2.502 20 5 FFBDMO CC(C)(C)OC(=O)N[C@]12C[C@H]1C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595731 1040826062 /nfs/dbraw/zinc/82/60/62/1040826062.db2.gz YYPMLIMJXRAQGF-GMBSWORKSA-N 1 1 359.426 2.661 20 5 FFBDMO COc1ccccc1CN1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254598583 1040830437 /nfs/dbraw/zinc/83/04/37/1040830437.db2.gz IANDOLOZODDKKH-HXUWFJFHSA-N 1 1 367.449 2.888 20 5 FFBDMO Cc1cnc(O[C@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605327 1040834223 /nfs/dbraw/zinc/83/42/23/1040834223.db2.gz BERONEIKSAGBBT-ROUUACIJSA-N 1 1 354.410 2.704 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccccc2)CC[N@@H+]1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254606164 1040834818 /nfs/dbraw/zinc/83/48/18/1040834818.db2.gz FNDBIWPIECUXNX-QRWLVFNGSA-N 1 1 365.433 2.909 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccccc2)CC[N@H+]1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254606164 1040834825 /nfs/dbraw/zinc/83/48/25/1040834825.db2.gz FNDBIWPIECUXNX-QRWLVFNGSA-N 1 1 365.433 2.909 20 5 FFBDMO COc1ccc(-c2nc3ccc(N4CC[NH+](C)CC4)cc3[nH]2)c([N+](=O)[O-])c1 ZINC001250838272 1041396470 /nfs/dbraw/zinc/39/64/70/1041396470.db2.gz XSXQFJDGJJKVPR-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001262826549 1041881079 /nfs/dbraw/zinc/88/10/79/1041881079.db2.gz MCTONCAHEVUKKL-XDTLVQLUSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC001309742320 1043504700 /nfs/dbraw/zinc/50/47/00/1043504700.db2.gz NDFMODMDYMMLFL-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO CCOc1cc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OCC ZINC001309999362 1043621504 /nfs/dbraw/zinc/62/15/04/1043621504.db2.gz BIEXEXYXHKCTRY-VXGBXAGGSA-N 1 1 366.418 2.606 20 5 FFBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC001310077181 1043633380 /nfs/dbraw/zinc/63/33/80/1043633380.db2.gz KOLHVSPJSCXDBM-GXTWGEPZSA-N 1 1 370.862 2.950 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001310506870 1043698980 /nfs/dbraw/zinc/69/89/80/1043698980.db2.gz IPTRAANRPGZYDQ-SNVBAGLBSA-N 1 1 371.235 2.963 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC1 ZINC001539290602 1070607497 /nfs/dbraw/zinc/60/74/97/1070607497.db2.gz QTZKPDBSNKYSGC-INIZCTEOSA-N 1 1 371.441 2.720 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001319041987 1045000412 /nfs/dbraw/zinc/00/04/12/1045000412.db2.gz RXEHFDMHEASDDK-OAHLLOKOSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001319041987 1045000427 /nfs/dbraw/zinc/00/04/27/1045000427.db2.gz RXEHFDMHEASDDK-OAHLLOKOSA-N 1 1 363.414 2.649 20 5 FFBDMO C[C@H](C[NH+]1CCOCC1)N(C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001320992614 1045508616 /nfs/dbraw/zinc/50/86/16/1045508616.db2.gz JZYRTLTURCUESN-GFCCVEGCSA-N 1 1 372.263 2.510 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC001322035852 1045927289 /nfs/dbraw/zinc/92/72/89/1045927289.db2.gz XUPIXPQZDRZYPK-MRXNPFEDSA-N 1 1 364.398 2.769 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC001322035852 1045927297 /nfs/dbraw/zinc/92/72/97/1045927297.db2.gz XUPIXPQZDRZYPK-MRXNPFEDSA-N 1 1 364.398 2.769 20 5 FFBDMO Cc1c(CC(=O)N2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)cccc1[N+](=O)[O-] ZINC001540114530 1070767354 /nfs/dbraw/zinc/76/73/54/1070767354.db2.gz ZIJISCXZHFCAQI-BGYRXZFFSA-N 1 1 357.454 2.780 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1 ZINC001540298463 1070827720 /nfs/dbraw/zinc/82/77/20/1070827720.db2.gz PBULITFCSFYDHG-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC001331278949 1049547569 /nfs/dbraw/zinc/54/75/69/1049547569.db2.gz BBGVRPVLDXMJAR-JTQLQIEISA-N 1 1 374.210 2.711 20 5 FFBDMO C[N@H+]1C[C@@]23CN(c4ncnc5cccc([N+](=O)[O-])c54)C[C@]2(C1)CCCC3 ZINC001339921454 1050337332 /nfs/dbraw/zinc/33/73/32/1050337332.db2.gz PAKXVAPUTOTRMN-KDURUIRLSA-N 1 1 353.426 2.850 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1NC)CCC(F)(F)F ZINC001343655794 1052359199 /nfs/dbraw/zinc/35/91/99/1052359199.db2.gz HNPOUKROSWJPOH-UHFFFAOYSA-N 1 1 362.352 2.641 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC001307947797 1052370606 /nfs/dbraw/zinc/37/06/06/1052370606.db2.gz WCGGEBUTJPSFFV-MRXNPFEDSA-N 1 1 355.398 2.859 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ncccn1 ZINC001307947797 1052370609 /nfs/dbraw/zinc/37/06/09/1052370609.db2.gz WCGGEBUTJPSFFV-MRXNPFEDSA-N 1 1 355.398 2.859 20 5 FFBDMO CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](CO)c1ccccc1 ZINC001308029517 1052387665 /nfs/dbraw/zinc/38/76/65/1052387665.db2.gz NLFCUBQISUZJKX-IBGZPJMESA-N 1 1 369.421 2.539 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](CO)c1ccccc1 ZINC001308029517 1052387670 /nfs/dbraw/zinc/38/76/70/1052387670.db2.gz NLFCUBQISUZJKX-IBGZPJMESA-N 1 1 369.421 2.539 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC001308067296 1052398476 /nfs/dbraw/zinc/39/84/76/1052398476.db2.gz AOWLJYGAVQQNRH-SGMGOOAPSA-N 1 1 366.849 2.744 20 5 FFBDMO CCc1ccc2c(c1)CC[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC001308170965 1052425328 /nfs/dbraw/zinc/42/53/28/1052425328.db2.gz PULAEWXNDSQTOH-GOSISDBHSA-N 1 1 356.422 2.955 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001344498440 1052802400 /nfs/dbraw/zinc/80/24/00/1052802400.db2.gz ZHAMGHPNCCWPER-CYBMUJFWSA-N 1 1 362.430 2.942 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC001334901696 1053142507 /nfs/dbraw/zinc/14/25/07/1053142507.db2.gz GMYCDCLMWYCLOB-QGZVFWFLSA-N 1 1 369.421 2.685 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC001335983398 1053686887 /nfs/dbraw/zinc/68/68/87/1053686887.db2.gz BEHVFQOVSGCGNC-OAHLLOKOSA-N 1 1 359.357 2.529 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c2ncc([N+](=O)[O-])cc12 ZINC001347244904 1053753530 /nfs/dbraw/zinc/75/35/30/1053753530.db2.gz WPHNJLNRLUZLGG-RHSMWYFYSA-N 1 1 359.430 2.887 20 5 FFBDMO Cc1cc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc(C)[nH+]1 ZINC001337307891 1054639927 /nfs/dbraw/zinc/63/99/27/1054639927.db2.gz JBJSZAZTHMWZMA-UHFFFAOYSA-N 1 1 351.366 2.681 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1 ZINC001338188707 1055303928 /nfs/dbraw/zinc/30/39/28/1055303928.db2.gz IPCVLYLJKQNLRH-UHFFFAOYSA-N 1 1 371.397 2.669 20 5 FFBDMO Cc1ccc(C[N@H+]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC2)cc1 ZINC001338751134 1055783056 /nfs/dbraw/zinc/78/30/56/1055783056.db2.gz XBCCZOIOWVIWFZ-UHFFFAOYSA-N 1 1 368.437 2.834 20 5 FFBDMO Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc2ccccc2c1[N+](=O)[O-] ZINC001544237540 1071616890 /nfs/dbraw/zinc/61/68/90/1071616890.db2.gz JLCYKGFSRZCSPM-HOTGVXAUSA-N 1 1 354.410 2.687 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001450608526 1059033626 /nfs/dbraw/zinc/03/36/26/1059033626.db2.gz NBHQHYOYGHQXRC-OAHLLOKOSA-N 1 1 373.457 2.690 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001454283362 1059484404 /nfs/dbraw/zinc/48/44/04/1059484404.db2.gz CTRLKNUSCHUJKY-CALCHBBNSA-N 1 1 369.824 2.730 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001454633557 1059590093 /nfs/dbraw/zinc/59/00/93/1059590093.db2.gz KFDDQRVMLJCEMH-GDBMZVCRSA-N 1 1 368.437 2.675 20 5 FFBDMO CC(C)N(CCN(C)Cc1ccc(Cl)cc1F)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001507787293 1059718203 /nfs/dbraw/zinc/71/82/03/1059718203.db2.gz JOBZMWIOPVQFOA-GDBMZVCRSA-N 1 1 371.840 2.813 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H]3CCC[N@H+]3Cc3ccccc32)n1 ZINC001354985766 1059735199 /nfs/dbraw/zinc/73/51/99/1059735199.db2.gz ZXTCKRGVBYHZKN-HNNXBMFYSA-N 1 1 352.394 2.923 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000848350285 1059835130 /nfs/dbraw/zinc/83/51/30/1059835130.db2.gz PKPHJIKXXXAMEX-IEBWSBKVSA-N 1 1 372.469 2.942 20 5 FFBDMO O=C1O[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1C1CC1 ZINC000848576625 1060305178 /nfs/dbraw/zinc/30/51/78/1060305178.db2.gz ACMVPBLDLISQFQ-OAHLLOKOSA-N 1 1 374.422 2.791 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001458644231 1060641038 /nfs/dbraw/zinc/64/10/38/1060641038.db2.gz IUMCQXQQRBVKGS-CQSZACIVSA-N 1 1 358.442 2.613 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC001459543659 1060772882 /nfs/dbraw/zinc/77/28/82/1060772882.db2.gz RXUUGOJXOPGLDT-QGZVFWFLSA-N 1 1 369.421 2.868 20 5 FFBDMO COc1ccc(C[C@H]2CC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001459656063 1060788092 /nfs/dbraw/zinc/78/80/92/1060788092.db2.gz OTECNLBVYGBCKH-SJORKVTESA-N 1 1 372.421 2.660 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001460722981 1061077890 /nfs/dbraw/zinc/07/78/90/1061077890.db2.gz ZOLWKYXMSWTSAJ-AWEZNQCLSA-N 1 1 363.414 2.589 20 5 FFBDMO COc1cc2c(cc1OC)[C@@H](C1CC1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC001460755524 1061089756 /nfs/dbraw/zinc/08/97/56/1061089756.db2.gz ARIUKINNWSFUMP-LJQANCHMSA-N 1 1 372.425 2.818 20 5 FFBDMO O=C1[C@H]([N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460925360 1061152632 /nfs/dbraw/zinc/15/26/32/1061152632.db2.gz SUKCCOSTYJWICJ-GPMSIDNRSA-N 1 1 373.453 2.839 20 5 FFBDMO COC(=O)c1cc(C2C[NH+](CC(C)=Cc3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC001462640363 1061704367 /nfs/dbraw/zinc/70/43/67/1061704367.db2.gz BZLNNDXUKYPIHQ-WUXMJOGZSA-N 1 1 356.382 2.607 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])Nc1c[nH+]ccc1-n1cccn1 ZINC001360115307 1061898990 /nfs/dbraw/zinc/89/89/90/1061898990.db2.gz SIDMYVQTVJXIDZ-UHFFFAOYSA-N 1 1 355.329 2.886 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC001478377657 1061991098 /nfs/dbraw/zinc/99/10/98/1061991098.db2.gz MIYKYLAHPZCWFK-QGZVFWFLSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC001478377657 1061991111 /nfs/dbraw/zinc/99/11/11/1061991111.db2.gz MIYKYLAHPZCWFK-QGZVFWFLSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC001529851141 1062414416 /nfs/dbraw/zinc/41/44/16/1062414416.db2.gz GUEXYNGKSKMZMY-MRXNPFEDSA-N 1 1 354.410 2.693 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1N)c1ccccc1Cl ZINC001440374224 1063298945 /nfs/dbraw/zinc/29/89/45/1063298945.db2.gz LDYTWADFIVQXST-INIZCTEOSA-N 1 1 362.817 2.863 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[N@H+]1CCCC[C@@H]1C ZINC001441491705 1063446559 /nfs/dbraw/zinc/44/65/59/1063446559.db2.gz HACSXYXWKJUTBJ-UWVGGRQHSA-N 1 1 372.828 2.962 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(C[NH+]2CCCC2)on1)c1ccccc1[N+](=O)[O-] ZINC001472149443 1064955412 /nfs/dbraw/zinc/95/54/12/1064955412.db2.gz QNJIBKDGGWRDBT-ZDUSSCGKSA-N 1 1 358.398 2.712 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@](O)(C3CC3)C2)o1 ZINC001473426785 1065260715 /nfs/dbraw/zinc/26/07/15/1065260715.db2.gz JRZBNSRIRDBXKU-MRXNPFEDSA-N 1 1 364.789 2.645 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@](O)(C3CC3)C2)o1 ZINC001473426785 1065260722 /nfs/dbraw/zinc/26/07/22/1065260722.db2.gz JRZBNSRIRDBXKU-MRXNPFEDSA-N 1 1 364.789 2.645 20 5 FFBDMO CC(C)(C)OC(=O)NC/C=C\C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001474492852 1065534623 /nfs/dbraw/zinc/53/46/23/1065534623.db2.gz DTDORXNOPFQSQV-PLNGDYQASA-N 1 1 362.386 2.907 20 5 FFBDMO O=[N+]([O-])c1cccc(CN2CCC3(C2)CC[NH2+]CC3)c1Br ZINC001580875743 1078881641 /nfs/dbraw/zinc/88/16/41/1078881641.db2.gz PPIGJLHMCYKPKU-UHFFFAOYSA-N 1 1 354.248 2.933 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC001584213308 1079323518 /nfs/dbraw/zinc/32/35/18/1079323518.db2.gz QHXAVNSUJQHEIW-BEFAXECRSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC001584213308 1079323521 /nfs/dbraw/zinc/32/35/21/1079323521.db2.gz QHXAVNSUJQHEIW-BEFAXECRSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC001559255625 1076140338 /nfs/dbraw/zinc/14/03/38/1076140338.db2.gz YBYQXLDZMSUXFL-GOEBONIOSA-N 1 1 368.437 2.874 20 5 FFBDMO CC(C)[C@@H]1CCCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559541393 1076170659 /nfs/dbraw/zinc/17/06/59/1076170659.db2.gz PAZZKRAQDLOSPL-IBGZPJMESA-N 1 1 374.485 2.754 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cc([N+](=O)[O-])ccc3Br)CC[C@H]21 ZINC001560077423 1076222332 /nfs/dbraw/zinc/22/23/32/1076222332.db2.gz KRUCUCPVRVOOQV-XHDPSFHLSA-N 1 1 354.248 2.883 20 5 FFBDMO COc1c(O)ccc(C[N@H+](C)CCOc2ccc(F)cc2)c1[N+](=O)[O-] ZINC001560721164 1076294354 /nfs/dbraw/zinc/29/43/54/1076294354.db2.gz YOLXTWJMUYNSHJ-UHFFFAOYSA-N 1 1 350.346 2.959 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)CCOc2ccc(F)cc2)c1[N+](=O)[O-] ZINC001560721164 1076294359 /nfs/dbraw/zinc/29/43/59/1076294359.db2.gz YOLXTWJMUYNSHJ-UHFFFAOYSA-N 1 1 350.346 2.959 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1 ZINC001569514689 1077149870 /nfs/dbraw/zinc/14/98/70/1077149870.db2.gz QLIFLJOXEURDGL-HNNXBMFYSA-N 1 1 373.384 2.861 20 5 FFBDMO O=C(NCC1([NH2+]CCCc2ccccc2Cl)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001570103893 1077182823 /nfs/dbraw/zinc/18/28/23/1077182823.db2.gz LYUSFNRUTFQDID-GDBMZVCRSA-N 1 1 365.861 2.566 20 5 FFBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001590043543 1080969710 /nfs/dbraw/zinc/96/97/10/1080969710.db2.gz OTQAGNNWJNGXFB-PXAZEXFGSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590052745 1080980957 /nfs/dbraw/zinc/98/09/57/1080980957.db2.gz TXBFOOOEOPNKBE-YVEFUNNKSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC001590260598 1081128727 /nfs/dbraw/zinc/12/87/27/1081128727.db2.gz QBTRVLAWZPFVOQ-UWVGGRQHSA-N 1 1 351.436 2.511 20 5 FFBDMO C[C@@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC001590260598 1081128729 /nfs/dbraw/zinc/12/87/29/1081128729.db2.gz QBTRVLAWZPFVOQ-UWVGGRQHSA-N 1 1 351.436 2.511 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000092764863 250000348 /nfs/dbraw/zinc/00/03/48/250000348.db2.gz XVJLCLIOVCNVDK-MRXNPFEDSA-N 1 1 372.421 2.997 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000092764863 250000353 /nfs/dbraw/zinc/00/03/53/250000353.db2.gz XVJLCLIOVCNVDK-MRXNPFEDSA-N 1 1 372.421 2.997 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000093742184 250044261 /nfs/dbraw/zinc/04/42/61/250044261.db2.gz LSRJPHJNDSSDIB-CQSZACIVSA-N 1 1 351.447 2.776 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)CC[N@@H+](C)C1CC1 ZINC000186763333 251259323 /nfs/dbraw/zinc/25/93/23/251259323.db2.gz LTUNYKSGBATYBU-LLVKDONJSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@@H](O)COCCOC(C)C ZINC000272283971 252000187 /nfs/dbraw/zinc/00/01/87/252000187.db2.gz FUQFVNRXNGFUSA-NVXWUHKLSA-N 1 1 354.447 2.699 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@@H+](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475876 252047056 /nfs/dbraw/zinc/04/70/56/252047056.db2.gz BEZDINIIJMEIEW-GOSISDBHSA-N 1 1 357.458 2.882 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000272671404 252098451 /nfs/dbraw/zinc/09/84/51/252098451.db2.gz TXMRMUWAYZAQBB-WFASDCNBSA-N 1 1 367.833 2.570 20 5 FFBDMO COc1cc(C[NH2+]CC2(N(C)C)CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000276046206 256068492 /nfs/dbraw/zinc/06/84/92/256068492.db2.gz TXWWYOFJZRJNFI-UHFFFAOYSA-N 1 1 373.400 2.821 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000276484012 256103844 /nfs/dbraw/zinc/10/38/44/256103844.db2.gz GKJLWXVMANCVKM-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)[C@@H]2C1 ZINC000277262018 256177959 /nfs/dbraw/zinc/17/79/59/256177959.db2.gz LMAHMWCHWYPUNE-GXFFZTMASA-N 1 1 368.231 2.524 20 5 FFBDMO CCCn1ccnc1CCC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000277171039 256168097 /nfs/dbraw/zinc/16/80/97/256168097.db2.gz KRJUZOBQSXITAD-UHFFFAOYSA-N 1 1 373.457 2.729 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000277381730 256191908 /nfs/dbraw/zinc/19/19/08/256191908.db2.gz WJJUKNHJBWLWDU-CABZTGNLSA-N 1 1 368.231 2.570 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000278770815 256346703 /nfs/dbraw/zinc/34/67/03/256346703.db2.gz WMHIDPWXJUOWTC-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000278817058 256350970 /nfs/dbraw/zinc/35/09/70/256350970.db2.gz IDABUGLCHCWKMX-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279068067 256378010 /nfs/dbraw/zinc/37/80/10/256378010.db2.gz AFDVCQPSQOVAFL-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000279068067 256378011 /nfs/dbraw/zinc/37/80/11/256378011.db2.gz AFDVCQPSQOVAFL-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000286914219 257061575 /nfs/dbraw/zinc/06/15/75/257061575.db2.gz AYDBEYUYEYABLQ-INIZCTEOSA-N 1 1 360.414 2.675 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000287431538 257089053 /nfs/dbraw/zinc/08/90/53/257089053.db2.gz OQCREJUXNRXBKU-INIZCTEOSA-N 1 1 362.474 2.899 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000288026826 257140447 /nfs/dbraw/zinc/14/04/47/257140447.db2.gz CLPZUEVTTSAPOG-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO CCC[C@@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000288832051 257230983 /nfs/dbraw/zinc/23/09/83/257230983.db2.gz NZRKAFRJZHCAOP-MRXNPFEDSA-N 1 1 355.822 2.671 20 5 FFBDMO CCC[C@@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000288832051 257230984 /nfs/dbraw/zinc/23/09/84/257230984.db2.gz NZRKAFRJZHCAOP-MRXNPFEDSA-N 1 1 355.822 2.671 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000288473335 257192766 /nfs/dbraw/zinc/19/27/66/257192766.db2.gz QOODKOUZPWECSB-LJQANCHMSA-N 1 1 354.410 2.661 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccncc2OC[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000288499177 257196935 /nfs/dbraw/zinc/19/69/35/257196935.db2.gz RTTCMHFDWLZOGP-OAHLLOKOSA-N 1 1 373.409 2.704 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC(C)(C)C1 ZINC000289672326 257293199 /nfs/dbraw/zinc/29/31/99/257293199.db2.gz GAHKTYBHZUEHLE-CQSZACIVSA-N 1 1 365.430 2.821 20 5 FFBDMO Cc1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc(N2CCCC2)[nH+]1 ZINC000290292115 257324140 /nfs/dbraw/zinc/32/41/40/257324140.db2.gz FIXXZYSQSXRVCI-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO Cc1cc(CNC(=O)Cc2ccccc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290407381 257330323 /nfs/dbraw/zinc/33/03/23/257330323.db2.gz QLOJAZCUUIQNLS-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000294597867 257594473 /nfs/dbraw/zinc/59/44/73/257594473.db2.gz ZAWSFVKEQYGNKU-AWEZNQCLSA-N 1 1 373.384 2.747 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(NCCc3cn4c([nH+]3)CCCC4)cc2N1 ZINC000301137198 258028004 /nfs/dbraw/zinc/02/80/04/258028004.db2.gz BPQVPDHDGJGJLF-UHFFFAOYSA-N 1 1 355.398 2.667 20 5 FFBDMO CCc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000302144426 258091010 /nfs/dbraw/zinc/09/10/10/258091010.db2.gz GXEXDLJHIKUDKD-INIZCTEOSA-N 1 1 357.458 2.992 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301630893 258060112 /nfs/dbraw/zinc/06/01/12/258060112.db2.gz BLMONRGBNUKFBH-CYBMUJFWSA-N 1 1 362.430 2.992 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000330587740 258166202 /nfs/dbraw/zinc/16/62/02/258166202.db2.gz UATMFTKVUHIFKJ-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)(C)[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000332044273 258211428 /nfs/dbraw/zinc/21/14/28/258211428.db2.gz LKBCAWQONJYVDC-INIZCTEOSA-N 1 1 363.414 2.640 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000332465402 258231449 /nfs/dbraw/zinc/23/14/49/258231449.db2.gz ISJOMPUJCRECGY-OCCSQVGLSA-N 1 1 366.849 2.745 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373100471 512171552 /nfs/dbraw/zinc/17/15/52/512171552.db2.gz RYONZTFONJYHKN-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000375157673 512187615 /nfs/dbraw/zinc/18/76/15/512187615.db2.gz GMNNRWBARAKSMD-AEFFLSMTSA-N 1 1 361.398 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H](c1ccsc1)[NH+](C)C ZINC000042158800 506604419 /nfs/dbraw/zinc/60/44/19/506604419.db2.gz FHGWLVBRHNAIPR-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000066920180 506693799 /nfs/dbraw/zinc/69/37/99/506693799.db2.gz OILDRRMLQTWFIJ-BSXFFOKHSA-N 1 1 363.458 2.906 20 5 FFBDMO Cc1ccc(NC(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043147968 506709078 /nfs/dbraw/zinc/70/90/78/506709078.db2.gz LPBKKJLWPOMPHX-OKILXGFUSA-N 1 1 350.419 2.524 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000043147938 506709276 /nfs/dbraw/zinc/70/92/76/506709276.db2.gz RFRCUMZHBDFSLO-MRXNPFEDSA-N 1 1 364.446 2.772 20 5 FFBDMO Cc1cc(C(=O)N2CC[NH+](CCc3cccs3)CC2)ccc1[N+](=O)[O-] ZINC000055643894 506811324 /nfs/dbraw/zinc/81/13/24/506811324.db2.gz FZHKNHHKDGNBKW-UHFFFAOYSA-N 1 1 359.451 2.965 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000067538475 506915410 /nfs/dbraw/zinc/91/54/10/506915410.db2.gz HEQNBGTWOXACIM-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000045343132 506950940 /nfs/dbraw/zinc/95/09/40/506950940.db2.gz ZMFKJSJHICBPOC-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1 ZINC000045624580 506993918 /nfs/dbraw/zinc/99/39/18/506993918.db2.gz OEKBLRJKEYXDPX-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000045623021 506994212 /nfs/dbraw/zinc/99/42/12/506994212.db2.gz CMGKPFBSNGMCCD-OAHLLOKOSA-N 1 1 368.437 2.841 20 5 FFBDMO CC1CC[NH+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000067796769 507013199 /nfs/dbraw/zinc/01/31/99/507013199.db2.gz WRNSRYCKRHMVEX-UHFFFAOYSA-N 1 1 359.430 2.713 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[N@H+]1CCC[C@H](C)C1 ZINC000068353297 507198557 /nfs/dbraw/zinc/19/85/57/507198557.db2.gz LUXNZRHNOVOPBV-QWHCGFSZSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000057222551 507211736 /nfs/dbraw/zinc/21/17/36/507211736.db2.gz CBKQRVBWZIYIBN-UHFFFAOYSA-N 1 1 363.337 2.613 20 5 FFBDMO C[C@H](NC(=O)NCC[NH+]1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000068406623 507219704 /nfs/dbraw/zinc/21/97/04/507219704.db2.gz DBTFIWHCUYKMOX-AWEZNQCLSA-N 1 1 354.410 2.971 20 5 FFBDMO COc1cccc(C[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000026176544 507564084 /nfs/dbraw/zinc/56/40/84/507564084.db2.gz CNFRPNIVOIKDBE-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1cccc(C[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1 ZINC000026176544 507564091 /nfs/dbraw/zinc/56/40/91/507564091.db2.gz CNFRPNIVOIKDBE-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(CC[NH+](C)C)c1ccccc1 ZINC000072054804 507741309 /nfs/dbraw/zinc/74/13/09/507741309.db2.gz DPQCXIPSUCREKC-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(OC)c1 ZINC000051421407 507769956 /nfs/dbraw/zinc/76/99/56/507769956.db2.gz UUPHQHBIJWXJAX-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)Nc1cccc(OC)c1 ZINC000051421407 507769958 /nfs/dbraw/zinc/76/99/58/507769958.db2.gz UUPHQHBIJWXJAX-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO Cc1cccc2nc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn21 ZINC000072665206 507839961 /nfs/dbraw/zinc/83/99/61/507839961.db2.gz HNGIKMDQBQSNLK-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1cccc2nc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn21 ZINC000072665206 507839962 /nfs/dbraw/zinc/83/99/62/507839962.db2.gz HNGIKMDQBQSNLK-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO CCOc1ccccc1OCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664949 507840384 /nfs/dbraw/zinc/84/03/84/507840384.db2.gz GAISNWYUGXCJFQ-OAHLLOKOSA-N 1 1 372.425 2.954 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000072770540 507851856 /nfs/dbraw/zinc/85/18/56/507851856.db2.gz CLIYKDPSLHOAPA-TXEJJXNPSA-N 1 1 353.444 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H]3CN3CCOCC3)co2)cc1 ZINC000089906136 507881367 /nfs/dbraw/zinc/88/13/67/507881367.db2.gz KGCKSSFSGNEORW-GOSISDBHSA-N 1 1 372.425 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3CN3CCOCC3)co2)cc1 ZINC000089906136 507881368 /nfs/dbraw/zinc/88/13/68/507881368.db2.gz KGCKSSFSGNEORW-GOSISDBHSA-N 1 1 372.425 2.546 20 5 FFBDMO O=C(C[N@H+](CCCO)[C@@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000074313072 508010494 /nfs/dbraw/zinc/01/04/94/508010494.db2.gz JXSGASKAFSZKNM-GOSISDBHSA-N 1 1 369.421 2.905 20 5 FFBDMO O=C1NC[C@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000091864162 508020605 /nfs/dbraw/zinc/02/06/05/508020605.db2.gz SKBNPUVKJCYSPF-AWEZNQCLSA-N 1 1 358.423 2.533 20 5 FFBDMO O=C1NC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000091864162 508020607 /nfs/dbraw/zinc/02/06/07/508020607.db2.gz SKBNPUVKJCYSPF-AWEZNQCLSA-N 1 1 358.423 2.533 20 5 FFBDMO C[C@@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000110351209 508022246 /nfs/dbraw/zinc/02/22/46/508022246.db2.gz MJXVKFZMZHOJCA-HNNXBMFYSA-N 1 1 357.410 2.610 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000092588328 508085057 /nfs/dbraw/zinc/08/50/57/508085057.db2.gz ACAHRSCUYBNXSL-AWEZNQCLSA-N 1 1 360.439 2.948 20 5 FFBDMO CCN1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000092607658 508086569 /nfs/dbraw/zinc/08/65/69/508086569.db2.gz LENOUPJCBJKNHT-UHFFFAOYSA-N 1 1 358.389 2.636 20 5 FFBDMO CCCn1nc(C)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000093534246 508148470 /nfs/dbraw/zinc/14/84/70/508148470.db2.gz MQWKCWYQDQYRMH-OAHLLOKOSA-N 1 1 358.446 2.900 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(N4CCCC4)nc3)C2)nc1 ZINC000093534388 508148476 /nfs/dbraw/zinc/14/84/76/508148476.db2.gz DBEAXHSHVDWARC-MRXNPFEDSA-N 1 1 368.441 2.671 20 5 FFBDMO CCOC(=O)C1(O)CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093596022 508149811 /nfs/dbraw/zinc/14/98/11/508149811.db2.gz DJRAEPRUBMIJDU-UHFFFAOYSA-N 1 1 374.393 2.745 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000081570376 508191735 /nfs/dbraw/zinc/19/17/35/508191735.db2.gz ACQZRTRJXQKVBG-CYBMUJFWSA-N 1 1 368.865 2.850 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H](C[N@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000081631988 508199598 /nfs/dbraw/zinc/19/95/98/508199598.db2.gz PJMRTFCQDHBBQA-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000081631988 508199601 /nfs/dbraw/zinc/19/96/01/508199601.db2.gz PJMRTFCQDHBBQA-KRWDZBQOSA-N 1 1 374.485 2.896 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076486607 508212867 /nfs/dbraw/zinc/21/28/67/508212867.db2.gz VSCBCKWICVFMOP-GDBMZVCRSA-N 1 1 371.441 2.583 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000076492413 508213429 /nfs/dbraw/zinc/21/34/29/508213429.db2.gz OHJAWPTUODUMSX-CZUORRHYSA-N 1 1 351.472 2.876 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3cn4ccccc4n3)CC2)cc1 ZINC000076796390 508254488 /nfs/dbraw/zinc/25/44/88/508254488.db2.gz CAQKOMYTUKJXKH-UHFFFAOYSA-N 1 1 365.437 2.603 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000101957285 508261560 /nfs/dbraw/zinc/26/15/60/508261560.db2.gz RGOZQUGFRKVXDB-UHFFFAOYSA-N 1 1 360.439 2.932 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1c(C)noc1C ZINC000113950764 508287854 /nfs/dbraw/zinc/28/78/54/508287854.db2.gz UZYSJEVWRNWIPI-ONGXEEELSA-N 1 1 362.386 2.886 20 5 FFBDMO CCC(=O)N[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104680566 508340840 /nfs/dbraw/zinc/34/08/40/508340840.db2.gz SPSVRTGYOYKSLR-HNNXBMFYSA-N 1 1 372.425 2.783 20 5 FFBDMO CC[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000104949350 508354520 /nfs/dbraw/zinc/35/45/20/508354520.db2.gz XRERUWQCMMXBSI-MRXNPFEDSA-N 1 1 374.393 2.585 20 5 FFBDMO CCOC(=O)c1ccnc(NCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000077905337 508390753 /nfs/dbraw/zinc/39/07/53/508390753.db2.gz JCRDHGYYPOPUDB-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000115436220 508394303 /nfs/dbraw/zinc/39/43/03/508394303.db2.gz ANFQMBWCORARBO-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC([N@@H+](C)CCCO)CC1 ZINC000115545786 508407182 /nfs/dbraw/zinc/40/71/82/508407182.db2.gz WADDQXQXIIDUDF-UHFFFAOYSA-N 1 1 365.474 2.661 20 5 FFBDMO C[NH+]1CCN(C(=O)Cc2cccc(NCc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000152455677 508450235 /nfs/dbraw/zinc/45/02/35/508450235.db2.gz DUOPCUHGVDFNTA-UHFFFAOYSA-N 1 1 368.437 2.523 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000116280174 508494080 /nfs/dbraw/zinc/49/40/80/508494080.db2.gz FJNXTCWAGPZEBN-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000116280174 508494081 /nfs/dbraw/zinc/49/40/81/508494081.db2.gz FJNXTCWAGPZEBN-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000116280174 508494082 /nfs/dbraw/zinc/49/40/82/508494082.db2.gz FJNXTCWAGPZEBN-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO Cn1cnnc1[C@@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000157088959 508521437 /nfs/dbraw/zinc/52/14/37/508521437.db2.gz VXGCNXSVSMBGQN-HNNXBMFYSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1cnnc1[C@@H]1CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000157088959 508521441 /nfs/dbraw/zinc/52/14/41/508521441.db2.gz VXGCNXSVSMBGQN-HNNXBMFYSA-N 1 1 368.397 2.758 20 5 FFBDMO CCC(=O)N1CC[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000134513221 508541276 /nfs/dbraw/zinc/54/12/76/508541276.db2.gz MEQTXKLBPKMGMN-CYBMUJFWSA-N 1 1 360.439 2.819 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153208298 508558822 /nfs/dbraw/zinc/55/88/22/508558822.db2.gz KHTHPCCCORLNJW-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCc1nccs1 ZINC000157441518 508567158 /nfs/dbraw/zinc/56/71/58/508567158.db2.gz ADVNJQDFQOSZKR-UHFFFAOYSA-N 1 1 364.427 2.563 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153357293 508575759 /nfs/dbraw/zinc/57/57/59/508575759.db2.gz QHYJHEWHLGACIJ-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153357293 508575760 /nfs/dbraw/zinc/57/57/60/508575760.db2.gz QHYJHEWHLGACIJ-KRWDZBQOSA-N 1 1 372.421 2.539 20 5 FFBDMO CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H]1CCC[N@@H+](C)C1 ZINC000153509740 508590366 /nfs/dbraw/zinc/59/03/66/508590366.db2.gz DDFVZOFMSMWDJI-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@@H](C)C1 ZINC000153517305 508591423 /nfs/dbraw/zinc/59/14/23/508591423.db2.gz YIGWJUILVHYUKZ-KGLIPLIRSA-N 1 1 358.442 2.855 20 5 FFBDMO C[NH+]1CCC(N2CCC(Nc3ncc(Cl)cc3[N+](=O)[O-])CC2)CC1 ZINC000153652351 508617189 /nfs/dbraw/zinc/61/71/89/508617189.db2.gz TUSLIFPWNGQVLY-UHFFFAOYSA-N 1 1 353.854 2.614 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000135688032 508640999 /nfs/dbraw/zinc/64/09/99/508640999.db2.gz LEWHGMASPLCTIF-UHFFFAOYSA-N 1 1 355.398 2.720 20 5 FFBDMO CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCC[N@@H+](C)C1 ZINC000153769647 508645172 /nfs/dbraw/zinc/64/51/72/508645172.db2.gz SWCIJRVGOKGHDG-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)Nc2c[nH+]ccc2-n2cc(C)cn2)c1 ZINC000158069411 508653016 /nfs/dbraw/zinc/65/30/16/508653016.db2.gz AUQSTEKCPCOGMM-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1)[N@H+]1CCC[C@H](C)C1 ZINC000135997029 508663910 /nfs/dbraw/zinc/66/39/10/508663910.db2.gz WCTKIDTYRPHQQP-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1OC ZINC000123351186 508673636 /nfs/dbraw/zinc/67/36/36/508673636.db2.gz UQPCNJFDTCBWLH-CHWSQXEVSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cccc(NCCNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)[nH+]1 ZINC000136157888 508675560 /nfs/dbraw/zinc/67/55/60/508675560.db2.gz KETLUENZFIXRHF-UHFFFAOYSA-N 1 1 353.382 2.550 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123418921 508684275 /nfs/dbraw/zinc/68/42/75/508684275.db2.gz ZECRQZLQAFJAKE-ZBFHGGJFSA-N 1 1 360.458 2.750 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000118866842 508688583 /nfs/dbraw/zinc/68/85/83/508688583.db2.gz UQSCORGZDRERIG-CQSZACIVSA-N 1 1 358.398 2.564 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000136986031 508730352 /nfs/dbraw/zinc/73/03/52/508730352.db2.gz MISDRGJQTNXAOT-HOCLYGCPSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000136986031 508730354 /nfs/dbraw/zinc/73/03/54/508730354.db2.gz MISDRGJQTNXAOT-HOCLYGCPSA-N 1 1 365.430 2.617 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000123898110 508754637 /nfs/dbraw/zinc/75/46/37/508754637.db2.gz WUGIBFBYAQTXEI-JOYOIKCWSA-N 1 1 368.231 2.712 20 5 FFBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000138369701 508772384 /nfs/dbraw/zinc/77/23/84/508772384.db2.gz NTDOLWXNKPETLH-AWEZNQCLSA-N 1 1 369.421 2.753 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154416163 508780527 /nfs/dbraw/zinc/78/05/27/508780527.db2.gz NISWKKSYBJNGKH-HOTGVXAUSA-N 1 1 365.430 2.569 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154416163 508780532 /nfs/dbraw/zinc/78/05/32/508780532.db2.gz NISWKKSYBJNGKH-HOTGVXAUSA-N 1 1 365.430 2.569 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000143211327 508829635 /nfs/dbraw/zinc/82/96/35/508829635.db2.gz JEJQOKVVHPLTQG-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000154679205 508832846 /nfs/dbraw/zinc/83/28/46/508832846.db2.gz VDNWKFIJNFBPKQ-UHFFFAOYSA-N 1 1 357.410 2.706 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCOCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000154679205 508832848 /nfs/dbraw/zinc/83/28/48/508832848.db2.gz VDNWKFIJNFBPKQ-UHFFFAOYSA-N 1 1 357.410 2.706 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H](C)O)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000130737829 508838774 /nfs/dbraw/zinc/83/87/74/508838774.db2.gz XMEUUXZJKJJXCK-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000130753058 508841285 /nfs/dbraw/zinc/84/12/85/508841285.db2.gz SKDUESOTXWXHLK-MRXNPFEDSA-N 1 1 357.414 2.735 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000130753058 508841288 /nfs/dbraw/zinc/84/12/88/508841288.db2.gz SKDUESOTXWXHLK-MRXNPFEDSA-N 1 1 357.414 2.735 20 5 FFBDMO CCC[C@H]1CN(c2cc(OC)c([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000120149336 508938836 /nfs/dbraw/zinc/93/88/36/508938836.db2.gz FEJIOHIDKRZIPV-ZDUSSCGKSA-N 1 1 355.410 2.680 20 5 FFBDMO COC(=O)c1oc([C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC000125224577 508951549 /nfs/dbraw/zinc/95/15/49/508951549.db2.gz BYAIICYGMHFCGC-STQMWFEESA-N 1 1 374.397 2.925 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1CCOC ZINC000120262001 508960794 /nfs/dbraw/zinc/96/07/94/508960794.db2.gz ZLCKVFXEPXIQAV-OAHLLOKOSA-N 1 1 364.446 2.786 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000155264419 508961516 /nfs/dbraw/zinc/96/15/16/508961516.db2.gz QBFKPTDPSLBJGI-HNNXBMFYSA-N 1 1 355.394 2.692 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000155311472 508973962 /nfs/dbraw/zinc/97/39/62/508973962.db2.gz PMBDRUPDLYWVCY-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000155311472 508973965 /nfs/dbraw/zinc/97/39/65/508973965.db2.gz PMBDRUPDLYWVCY-AOOOYVTPSA-N 1 1 370.247 2.830 20 5 FFBDMO CC(=O)Nc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000160431048 508985999 /nfs/dbraw/zinc/98/59/99/508985999.db2.gz NURFGGPEAXMGHX-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1 ZINC000125541719 508997138 /nfs/dbraw/zinc/99/71/38/508997138.db2.gz GURUJLDDOZSQFH-RHSMWYFYSA-N 1 1 361.442 2.873 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125574262 509001224 /nfs/dbraw/zinc/00/12/24/509001224.db2.gz IASBJYOYKRJEOA-MAUKXSAKSA-N 1 1 358.442 2.753 20 5 FFBDMO CN1CCC([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000155505872 509015568 /nfs/dbraw/zinc/01/55/68/509015568.db2.gz KGNAJVROJUBYDH-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CN1CCC([N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000155505872 509015571 /nfs/dbraw/zinc/01/55/71/509015571.db2.gz KGNAJVROJUBYDH-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000120616953 509032235 /nfs/dbraw/zinc/03/22/35/509032235.db2.gz UHSLSOFOSUEXEH-SECBINFHSA-N 1 1 356.220 2.570 20 5 FFBDMO Cc1c(CC(=O)NCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000160963511 509054368 /nfs/dbraw/zinc/05/43/68/509054368.db2.gz HJAHIDFOIYMZJT-UHFFFAOYSA-N 1 1 353.422 2.620 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])cnc2C)[nH+]1 ZINC000369496049 512437857 /nfs/dbraw/zinc/43/78/57/512437857.db2.gz HWQBJDDQTCISQN-AWEZNQCLSA-N 1 1 355.398 2.718 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000121007027 509108347 /nfs/dbraw/zinc/10/83/47/509108347.db2.gz AQQSGDRHZLQPAI-MFKMUULPSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cc(S(=O)(=O)Nc2ccc(-c3ncc[nH]3)cc2)ccc1[N+](=O)[O-] ZINC000121389988 509171348 /nfs/dbraw/zinc/17/13/48/509171348.db2.gz JOPCOEXPPJLUGI-UHFFFAOYSA-N 1 1 374.378 2.794 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@]3(O)CCCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000247957710 509199513 /nfs/dbraw/zinc/19/95/13/509199513.db2.gz FTHQDDXZLQILOV-KSSFIOAISA-N 1 1 350.415 2.609 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000185489100 509202552 /nfs/dbraw/zinc/20/25/52/509202552.db2.gz MQERTBADZRWEQA-GFCCVEGCSA-N 1 1 358.427 2.582 20 5 FFBDMO Cc1nn(C)c(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000263880815 509204222 /nfs/dbraw/zinc/20/42/22/509204222.db2.gz OTCDLDHSHJNOOI-UHFFFAOYSA-N 1 1 357.458 2.985 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000162384968 509214079 /nfs/dbraw/zinc/21/40/79/509214079.db2.gz NDNFWGFRLLAYQQ-LBPRGKRZSA-N 1 1 356.220 2.571 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000182396046 509215959 /nfs/dbraw/zinc/21/59/59/509215959.db2.gz XDELZXFGFIITNO-ZDUSSCGKSA-N 1 1 362.386 2.888 20 5 FFBDMO CNS(=O)(=O)c1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000266834963 509218459 /nfs/dbraw/zinc/21/84/59/509218459.db2.gz FIKLNUUZERGXDH-STQMWFEESA-N 1 1 363.439 2.915 20 5 FFBDMO CC[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000182450122 509243834 /nfs/dbraw/zinc/24/38/34/509243834.db2.gz BXBBBGAWJMGZNX-OAHLLOKOSA-N 1 1 367.427 2.714 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC000162578716 509256803 /nfs/dbraw/zinc/25/68/03/509256803.db2.gz APGYGTKJTKZKCF-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000172843008 509267275 /nfs/dbraw/zinc/26/72/75/509267275.db2.gz MQXRSTMSANVOCH-ZDUSSCGKSA-N 1 1 365.430 2.558 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]2CCCC[C@H]12 ZINC000182509025 509277272 /nfs/dbraw/zinc/27/72/72/509277272.db2.gz DNILVSZDFQBVSC-BZPMIXESSA-N 1 1 361.398 2.773 20 5 FFBDMO COc1cccc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000185644318 509282169 /nfs/dbraw/zinc/28/21/69/509282169.db2.gz LQSIKEJQBMTIQD-HZPDHXFCSA-N 1 1 357.410 2.651 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000248457199 509329744 /nfs/dbraw/zinc/32/97/44/509329744.db2.gz MEMCCIZYMURHED-FHLIZLRMSA-N 1 1 364.442 2.614 20 5 FFBDMO C[C@@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185879957 509403123 /nfs/dbraw/zinc/40/31/23/509403123.db2.gz QKTJFRLFXVORCM-INIZCTEOSA-N 1 1 372.469 2.970 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000248635393 509403799 /nfs/dbraw/zinc/40/37/99/509403799.db2.gz KHGUZKPBQCCCEC-HBFSDRIKSA-N 1 1 374.529 2.922 20 5 FFBDMO C[C@]1(C(N)=O)CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185904620 509417909 /nfs/dbraw/zinc/41/79/09/509417909.db2.gz PZVJEJFOPAPJHE-GOSISDBHSA-N 1 1 358.398 2.522 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000267276377 509422903 /nfs/dbraw/zinc/42/29/03/509422903.db2.gz UHCRAJVONBJKLG-HUUCEWRRSA-N 1 1 360.458 2.904 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000264266495 509423303 /nfs/dbraw/zinc/42/33/03/509423303.db2.gz GFPLTOYMMXFMGG-HNNXBMFYSA-N 1 1 364.446 2.523 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000248747205 509466647 /nfs/dbraw/zinc/46/66/47/509466647.db2.gz FRNYQYVOZAYHED-PEGIJTEDSA-N 1 1 360.357 2.939 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000248747205 509466651 /nfs/dbraw/zinc/46/66/51/509466651.db2.gz FRNYQYVOZAYHED-PEGIJTEDSA-N 1 1 360.357 2.939 20 5 FFBDMO CCC[N@@H+]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236807588 509507041 /nfs/dbraw/zinc/50/70/41/509507041.db2.gz CYFKHYCLJLOUJM-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000236807588 509507046 /nfs/dbraw/zinc/50/70/46/509507046.db2.gz CYFKHYCLJLOUJM-HNNXBMFYSA-N 1 1 357.458 2.817 20 5 FFBDMO C[C@@H](NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315896 509527045 /nfs/dbraw/zinc/52/70/45/509527045.db2.gz ONUBAVLLWQOWCN-FOIQADDNSA-N 1 1 355.438 2.665 20 5 FFBDMO C[C@@H](NC[C@@H](O)C[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173315896 509527053 /nfs/dbraw/zinc/52/70/53/509527053.db2.gz ONUBAVLLWQOWCN-FOIQADDNSA-N 1 1 355.438 2.665 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000192556571 509553345 /nfs/dbraw/zinc/55/33/45/509553345.db2.gz IDEWMDWXSPEMKQ-HZPDHXFCSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)oc1C ZINC000264718754 509664889 /nfs/dbraw/zinc/66/48/89/509664889.db2.gz OPDOPJDLERLNTA-UHFFFAOYSA-N 1 1 372.425 2.842 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176850985 509725214 /nfs/dbraw/zinc/72/52/14/509725214.db2.gz RIKKJQFQADYVOD-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO Cc1nc(C[NH+]2CCC(C(=O)NCc3ccccc3[N+](=O)[O-])CC2)cs1 ZINC000170694557 509727823 /nfs/dbraw/zinc/72/78/23/509727823.db2.gz BIQCJOCUEZCVLB-UHFFFAOYSA-N 1 1 374.466 2.888 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000268040709 509729627 /nfs/dbraw/zinc/72/96/27/509729627.db2.gz XYWBBGDLFRDMIF-GXSJLCMTSA-N 1 1 357.332 2.969 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000268120186 509767515 /nfs/dbraw/zinc/76/75/15/509767515.db2.gz KREZYWINYIDATD-CABCVRRESA-N 1 1 352.822 2.674 20 5 FFBDMO COc1ccc(OCCN2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173782392 509774351 /nfs/dbraw/zinc/77/43/51/509774351.db2.gz RWMQAJNOFRDOMV-UHFFFAOYSA-N 1 1 363.458 2.933 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000268186526 509803274 /nfs/dbraw/zinc/80/32/74/509803274.db2.gz WCQPBZVYHTYZJF-WCQYABFASA-N 1 1 354.838 2.872 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000264985394 509810088 /nfs/dbraw/zinc/81/00/88/509810088.db2.gz VLNOGQRGMUTFJQ-CQSZACIVSA-N 1 1 362.455 2.529 20 5 FFBDMO COCC[N@H+]1CC[C@@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000264985394 509810092 /nfs/dbraw/zinc/81/00/92/509810092.db2.gz VLNOGQRGMUTFJQ-CQSZACIVSA-N 1 1 362.455 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC000177054357 509841878 /nfs/dbraw/zinc/84/18/78/509841878.db2.gz SWRWURPZLPUICP-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H](O)COCc1ccccc1 ZINC000177070468 509853588 /nfs/dbraw/zinc/85/35/88/509853588.db2.gz GUOPJHHOKCCLKB-MRXNPFEDSA-N 1 1 371.393 2.746 20 5 FFBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H](O)COCc1ccccc1 ZINC000177070468 509853593 /nfs/dbraw/zinc/85/35/93/509853593.db2.gz GUOPJHHOKCCLKB-MRXNPFEDSA-N 1 1 371.393 2.746 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])cnc2N)cc1 ZINC000180582594 509996917 /nfs/dbraw/zinc/99/69/17/509996917.db2.gz KOKGHMRJITZKNB-NSHDSACASA-N 1 1 366.381 2.557 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000190257599 510030791 /nfs/dbraw/zinc/03/07/91/510030791.db2.gz QMZWJLKNXVHYIP-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000190257599 510030795 /nfs/dbraw/zinc/03/07/95/510030795.db2.gz QMZWJLKNXVHYIP-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180664440 510042952 /nfs/dbraw/zinc/04/29/52/510042952.db2.gz IAWRVHUJXGOLJR-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268682209 510069122 /nfs/dbraw/zinc/06/91/22/510069122.db2.gz GPLYSJFQHQXKNN-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000261962528 510131086 /nfs/dbraw/zinc/13/10/86/510131086.db2.gz MOVKPACPNMIMMY-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC[C@H](C)C1 ZINC000190483165 510158165 /nfs/dbraw/zinc/15/81/65/510158165.db2.gz QMOUVVFHWSDZFE-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194000672 510169190 /nfs/dbraw/zinc/16/91/90/510169190.db2.gz HMUZJVNRKHJTDO-KRWDZBQOSA-N 1 1 368.437 2.916 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](C[C@H]1CCCO1)[C@H]1CCSC1 ZINC000245995773 510242204 /nfs/dbraw/zinc/24/22/04/510242204.db2.gz XNJRZFVBNBUUJQ-LSDHHAIUSA-N 1 1 352.456 2.960 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc(C)cs1 ZINC000184382790 510295584 /nfs/dbraw/zinc/29/55/84/510295584.db2.gz FCURIBHTHBEJKB-AWEZNQCLSA-N 1 1 360.439 2.990 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269365562 510364370 /nfs/dbraw/zinc/36/43/70/510364370.db2.gz VKFZTWSXKWUKKC-UGSOOPFHSA-N 1 1 358.442 2.752 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000184585766 510401332 /nfs/dbraw/zinc/40/13/32/510401332.db2.gz OMQOQSDCYICBAO-UHFFFAOYSA-N 1 1 354.838 2.922 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)[N@@H+]1CCc2ccccc2C1 ZINC000171865183 510418343 /nfs/dbraw/zinc/41/83/43/510418343.db2.gz IDAMTTFZQQYSDG-AWEZNQCLSA-N 1 1 369.421 2.666 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000171865183 510418348 /nfs/dbraw/zinc/41/83/48/510418348.db2.gz IDAMTTFZQQYSDG-AWEZNQCLSA-N 1 1 369.421 2.666 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N2CCCC2)CC1 ZINC000175021508 510441560 /nfs/dbraw/zinc/44/15/60/510441560.db2.gz UEKNXBGMRFVCQP-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000269527312 510446985 /nfs/dbraw/zinc/44/69/85/510446985.db2.gz ZJNIHSVTCBDYOL-UHFFFAOYSA-N 1 1 356.304 2.939 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000175097368 510481933 /nfs/dbraw/zinc/48/19/33/510481933.db2.gz ANPJLPBPHRFKOQ-OAHLLOKOSA-N 1 1 361.442 2.732 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000194743675 510506826 /nfs/dbraw/zinc/50/68/26/510506826.db2.gz SJMPABXXHKAJSH-HNNXBMFYSA-N 1 1 371.441 2.522 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269678975 510510865 /nfs/dbraw/zinc/51/08/65/510510865.db2.gz XQQHLUYDKSXORD-QGZVFWFLSA-N 1 1 374.393 2.506 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184785578 510514930 /nfs/dbraw/zinc/51/49/30/510514930.db2.gz PKQKWHLJUPVTQW-LLVKDONJSA-N 1 1 365.821 2.889 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)[C@@H](C)C1 ZINC000246494921 510519182 /nfs/dbraw/zinc/51/91/82/510519182.db2.gz XMICXBFCERNSMY-BBRMVZONSA-N 1 1 369.487 2.562 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000172153985 510573066 /nfs/dbraw/zinc/57/30/66/510573066.db2.gz LARCQZWETCNAAC-OAHLLOKOSA-N 1 1 364.446 2.667 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000246702122 510625139 /nfs/dbraw/zinc/62/51/39/510625139.db2.gz JPGQVJPDOLUNSU-CZUORRHYSA-N 1 1 350.806 2.643 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC[C@@H]1C[C@H](C)O ZINC000246707171 510627611 /nfs/dbraw/zinc/62/76/11/510627611.db2.gz NGVQRVTYZJITOK-QJPTWQEYSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCC[C@@H]1C[C@H](C)O ZINC000246707171 510627613 /nfs/dbraw/zinc/62/76/13/510627613.db2.gz NGVQRVTYZJITOK-QJPTWQEYSA-N 1 1 355.822 2.811 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000246891065 510730824 /nfs/dbraw/zinc/73/08/24/510730824.db2.gz UMNYCBWUIJQIEU-GUYCJALGSA-N 1 1 367.421 2.601 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccncc2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000191638779 510764876 /nfs/dbraw/zinc/76/48/76/510764876.db2.gz NKLVOLPRBZHVCN-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccncc2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000191650362 510773042 /nfs/dbraw/zinc/77/30/42/510773042.db2.gz QCUWQLJDSJLABL-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000182146698 510780368 /nfs/dbraw/zinc/78/03/68/510780368.db2.gz VMXLGUQQEITABK-GHMZBOCLSA-N 1 1 357.357 2.751 20 5 FFBDMO O=C1[C@H](N2CCC[N@H+](C3CCCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000172584996 510805608 /nfs/dbraw/zinc/80/56/08/510805608.db2.gz ZJYVPODRMYJLIX-LJQANCHMSA-N 1 1 372.469 2.650 20 5 FFBDMO CC[N@H+](Cc1ccc(OC)cc1)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182215000 510816959 /nfs/dbraw/zinc/81/69/59/510816959.db2.gz ZEGQJCDPXCJBQH-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000182219133 510819833 /nfs/dbraw/zinc/81/98/33/510819833.db2.gz OBLXXASTNBMIGX-SFHVURJKSA-N 1 1 371.437 2.547 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000360383913 510902835 /nfs/dbraw/zinc/90/28/35/510902835.db2.gz DRRUPHNWYCQNNO-INIZCTEOSA-N 1 1 354.410 2.801 20 5 FFBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(N)=O)c1ccccn1 ZINC000297428729 510942644 /nfs/dbraw/zinc/94/26/44/510942644.db2.gz VDPXSLBLIFRBOX-BLLLJJGKSA-N 1 1 360.439 2.677 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000360775428 510946474 /nfs/dbraw/zinc/94/64/74/510946474.db2.gz GNSDTJYWFUZJJO-KRWDZBQOSA-N 1 1 368.437 2.940 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000270731430 510966577 /nfs/dbraw/zinc/96/65/77/510966577.db2.gz UNFPBUAIXUHXID-ZDUSSCGKSA-N 1 1 369.487 2.793 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@@H]21 ZINC000270936391 511030050 /nfs/dbraw/zinc/03/00/50/511030050.db2.gz IVNNYMPJXLZVTE-JQWIXIFHSA-N 1 1 355.236 2.673 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@@H]21 ZINC000270936393 511030381 /nfs/dbraw/zinc/03/03/81/511030381.db2.gz IVNNYMPJXLZVTE-PWSUYJOCSA-N 1 1 355.236 2.673 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000271203406 511118236 /nfs/dbraw/zinc/11/82/36/511118236.db2.gz VJCSKLIOGSJCCE-NSHDSACASA-N 1 1 364.320 2.765 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000271203406 511118241 /nfs/dbraw/zinc/11/82/41/511118241.db2.gz VJCSKLIOGSJCCE-NSHDSACASA-N 1 1 364.320 2.765 20 5 FFBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H](O)CNC(=O)OC(C)(C)C ZINC000294664588 511135508 /nfs/dbraw/zinc/13/55/08/511135508.db2.gz ACJILWIDHXOXTR-CYBMUJFWSA-N 1 1 373.837 2.566 20 5 FFBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H](O)CNC(=O)OC(C)(C)C ZINC000294664588 511135511 /nfs/dbraw/zinc/13/55/11/511135511.db2.gz ACJILWIDHXOXTR-CYBMUJFWSA-N 1 1 373.837 2.566 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000294716833 511152919 /nfs/dbraw/zinc/15/29/19/511152919.db2.gz UTQNQXRTURRYCX-MRXNPFEDSA-N 1 1 369.425 2.685 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](CO)c1ccccc1 ZINC000298045074 511155795 /nfs/dbraw/zinc/15/57/95/511155795.db2.gz HEJVMRZYQBOYAW-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1cc(C[N@H+](C)CCc2cnccn2)c([N+](=O)[O-])cc1OC(F)F ZINC000271360683 511176903 /nfs/dbraw/zinc/17/69/03/511176903.db2.gz PSYFEUUPDRJQQF-UHFFFAOYSA-N 1 1 368.340 2.669 20 5 FFBDMO COc1cc(C[N@@H+](C)CCc2cnccn2)c([N+](=O)[O-])cc1OC(F)F ZINC000271360683 511176911 /nfs/dbraw/zinc/17/69/11/511176911.db2.gz PSYFEUUPDRJQQF-UHFFFAOYSA-N 1 1 368.340 2.669 20 5 FFBDMO CS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000291481452 511214283 /nfs/dbraw/zinc/21/42/83/511214283.db2.gz FWQNVRAUYTVGAT-UHFFFAOYSA-N 1 1 367.254 2.959 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000283178283 511266548 /nfs/dbraw/zinc/26/65/48/511266548.db2.gz PXUBDDZVFOOWER-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO C[C@@H]1CN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000291616622 511269283 /nfs/dbraw/zinc/26/92/83/511269283.db2.gz AJXJMKCIKOYVFY-AWEZNQCLSA-N 1 1 372.469 2.798 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000365217644 511321557 /nfs/dbraw/zinc/32/15/57/511321557.db2.gz GBSFTDBGQFZHIR-UHFFFAOYSA-N 1 1 356.382 2.564 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291908837 511386736 /nfs/dbraw/zinc/38/67/36/511386736.db2.gz RQJZYRDWGOFRBF-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](CO)(c2ccccc2)C1 ZINC000291908837 511386742 /nfs/dbraw/zinc/38/67/42/511386742.db2.gz RQJZYRDWGOFRBF-FOIQADDNSA-N 1 1 369.421 2.558 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccn(-c4ccccc4)n3)CC2)n1 ZINC000365507169 511493195 /nfs/dbraw/zinc/49/31/95/511493195.db2.gz GUUZLYSRHYGUIS-UHFFFAOYSA-N 1 1 352.398 2.814 20 5 FFBDMO O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1cc2ccccc2c2cccnc12 ZINC000363377100 511512930 /nfs/dbraw/zinc/51/29/30/511512930.db2.gz WRKNZRAVCLNKJA-IRXDYDNUSA-N 1 1 361.445 2.981 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000295847795 511534073 /nfs/dbraw/zinc/53/40/73/511534073.db2.gz AVGZWVWPKFWNLV-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@]2(CCOC2)O1 ZINC000280623852 511537389 /nfs/dbraw/zinc/53/73/89/511537389.db2.gz WVELQSDHLRNDIV-KUHUBIRLSA-N 1 1 373.409 2.672 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C2)C1 ZINC000292311927 511547659 /nfs/dbraw/zinc/54/76/59/511547659.db2.gz SKVVPGMCDNOORA-OAHLLOKOSA-N 1 1 357.332 2.781 20 5 FFBDMO COCC[N@@H+]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000299221373 511555748 /nfs/dbraw/zinc/55/57/48/511555748.db2.gz NHURFQULAOCWAE-UHFFFAOYSA-N 1 1 363.439 2.604 20 5 FFBDMO COCC[N@H+]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 ZINC000299221373 511555753 /nfs/dbraw/zinc/55/57/53/511555753.db2.gz NHURFQULAOCWAE-UHFFFAOYSA-N 1 1 363.439 2.604 20 5 FFBDMO CC[C@H](O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000299420210 511629755 /nfs/dbraw/zinc/62/97/55/511629755.db2.gz WUMPFVJDRMAMTC-CVEARBPZSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2 ZINC000365794477 511656814 /nfs/dbraw/zinc/65/68/14/511656814.db2.gz JKOBTSOBYCBXQA-SFHVURJKSA-N 1 1 368.349 2.599 20 5 FFBDMO Cc1[nH+]ccn1CCCSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C ZINC000273976318 511678567 /nfs/dbraw/zinc/67/85/67/511678567.db2.gz YHBLZDOFEGKUSC-UHFFFAOYSA-N 1 1 359.411 2.529 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](OCc2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000281043396 511699172 /nfs/dbraw/zinc/69/91/72/511699172.db2.gz QEYIEJWWPNPIKL-MRXNPFEDSA-N 1 1 370.409 2.610 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)[C@H]2C1 ZINC000284521963 511757163 /nfs/dbraw/zinc/75/71/63/511757163.db2.gz FPXOQCPTWFDTIP-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO COc1ccc(C[NH2+]Cc2cc(C)nc(N3CCCC3)n2)cc1[N+](=O)[O-] ZINC000292885890 511758697 /nfs/dbraw/zinc/75/86/97/511758697.db2.gz YJEKRQGDBAWWKT-UHFFFAOYSA-N 1 1 357.414 2.592 20 5 FFBDMO CNc1ccc(-c2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350389709 511799203 /nfs/dbraw/zinc/79/92/03/511799203.db2.gz MDCYXRGYSAKSPY-RHSMWYFYSA-N 1 1 359.386 2.612 20 5 FFBDMO COc1c(-c2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cccc1[N+](=O)[O-] ZINC000350402006 511802327 /nfs/dbraw/zinc/80/23/27/511802327.db2.gz RRQDZJNPNZZUDP-DYVFJYSZSA-N 1 1 360.370 2.579 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000366141312 511864482 /nfs/dbraw/zinc/86/44/82/511864482.db2.gz BHVPSNVEHBNFQX-WBMJQRKESA-N 1 1 360.439 2.864 20 5 FFBDMO Cn1nccc1[C@H]1[C@H](CNc2c3c(ccc2[N+](=O)[O-])NCC3)CCC[N@H+]1C ZINC000284919709 511928689 /nfs/dbraw/zinc/92/86/89/511928689.db2.gz PMFSQPMHCSZWME-ORAYPTAESA-N 1 1 370.457 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](C[C@H]4CCCCO4)CC3)nc2c1 ZINC000274824556 511954368 /nfs/dbraw/zinc/95/43/68/511954368.db2.gz KQJHGHPFOOBCLE-OAHLLOKOSA-N 1 1 359.430 2.552 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000297042673 511997795 /nfs/dbraw/zinc/99/77/95/511997795.db2.gz XINYSGHIUFKYOF-CYBMUJFWSA-N 1 1 362.430 2.942 20 5 FFBDMO Cc1c(NC(=O)NC[C@@H]2CC[N@H+](C)C2)cc(Br)cc1[N+](=O)[O-] ZINC000297099878 512019456 /nfs/dbraw/zinc/01/94/56/512019456.db2.gz MDYSWWYFOJPHBM-JTQLQIEISA-N 1 1 371.235 2.739 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1 ZINC000366605895 512101008 /nfs/dbraw/zinc/10/10/08/512101008.db2.gz DTLYXLFDOQBFTQ-CQSZACIVSA-N 1 1 373.413 2.665 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1 ZINC000366605895 512101011 /nfs/dbraw/zinc/10/10/11/512101011.db2.gz DTLYXLFDOQBFTQ-CQSZACIVSA-N 1 1 373.413 2.665 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC3(CCC[N@H+]3C)CC2)cccc1[N+](=O)[O-] ZINC000371689984 512528662 /nfs/dbraw/zinc/52/86/62/512528662.db2.gz UQUQRPYTICISQF-OAHLLOKOSA-N 1 1 360.458 2.790 20 5 FFBDMO C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000372014420 512678962 /nfs/dbraw/zinc/67/89/62/512678962.db2.gz YCBGZJWMYHDXRX-HNNXBMFYSA-N 1 1 354.410 2.726 20 5 FFBDMO COC[C@@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376370618 512788638 /nfs/dbraw/zinc/78/86/38/512788638.db2.gz RJSLPWOVFINBLA-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](CO)CC(C)(C)C ZINC000411788692 512812117 /nfs/dbraw/zinc/81/21/17/512812117.db2.gz GZYVMUKJVFDYBO-CQSZACIVSA-N 1 1 367.446 2.661 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000374410677 512820644 /nfs/dbraw/zinc/82/06/44/512820644.db2.gz IJTMQHOQSSECKJ-UPJWGTAASA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000374410677 512820648 /nfs/dbraw/zinc/82/06/48/512820648.db2.gz IJTMQHOQSSECKJ-UPJWGTAASA-N 1 1 367.833 2.934 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3c2cnn3CCO)c(Cl)c1 ZINC000368181772 512834462 /nfs/dbraw/zinc/83/44/62/512834462.db2.gz SOEQUSVGTKWNRF-OAHLLOKOSA-N 1 1 350.806 2.604 20 5 FFBDMO CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383248760 512880473 /nfs/dbraw/zinc/88/04/73/512880473.db2.gz AHYPWXZDTOJNNW-HNNXBMFYSA-N 1 1 372.400 2.663 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccnn3-c3ccc(F)cc3)CC2)n1 ZINC000368444669 512951882 /nfs/dbraw/zinc/95/18/82/512951882.db2.gz ZZIQHEJLBOMHFG-UHFFFAOYSA-N 1 1 370.388 2.953 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000368446080 512952394 /nfs/dbraw/zinc/95/23/94/512952394.db2.gz SPJJJDWQQMRIQQ-ZWKOTPCHSA-N 1 1 369.469 2.815 20 5 FFBDMO CC(=O)c1cc(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000368542256 512993009 /nfs/dbraw/zinc/99/30/09/512993009.db2.gz CKACEVGSRKPSSH-QZTJIDSGSA-N 1 1 369.421 2.845 20 5 FFBDMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374881057 513052652 /nfs/dbraw/zinc/05/26/52/513052652.db2.gz VYDIYBQKKOSPFG-GOEBONIOSA-N 1 1 354.410 2.630 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000433695933 513129592 /nfs/dbraw/zinc/12/95/92/513129592.db2.gz ZQABFBNXWURVLL-ZDUSSCGKSA-N 1 1 371.441 2.618 20 5 FFBDMO Cc1cc(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000428666158 513157753 /nfs/dbraw/zinc/15/77/53/513157753.db2.gz GKTGDBHBXUSROZ-MRXNPFEDSA-N 1 1 358.467 2.750 20 5 FFBDMO Cc1nc(NC[C@@H]2CSCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000428672348 513160206 /nfs/dbraw/zinc/16/02/06/513160206.db2.gz XPYMLELGBRQATJ-MRXNPFEDSA-N 1 1 358.467 2.750 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450473248 513210892 /nfs/dbraw/zinc/21/08/92/513210892.db2.gz HCESENCPFFJIIK-CYBMUJFWSA-N 1 1 362.455 2.611 20 5 FFBDMO Cn1ccnc1[C@@H](NC1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000421367507 513237919 /nfs/dbraw/zinc/23/79/19/513237919.db2.gz DXWQLNRCLLABAJ-HTWSVDAQSA-N 1 1 357.458 2.880 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2CCCO)c(Br)c1 ZINC000450589179 513264320 /nfs/dbraw/zinc/26/43/20/513264320.db2.gz CEXOBVOPOAKBKQ-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1CCCC[N@@H+]1CCO ZINC000450621486 513276255 /nfs/dbraw/zinc/27/62/55/513276255.db2.gz XFDFUPWJPNPLGP-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000421568239 513311143 /nfs/dbraw/zinc/31/11/43/513311143.db2.gz ZUFHYNHPMLJQJF-OAHLLOKOSA-N 1 1 361.442 2.537 20 5 FFBDMO COC(=O)c1cccc(OCC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000446737123 513326808 /nfs/dbraw/zinc/32/68/08/513326808.db2.gz YTVLSHRLSGJVLB-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc(OCC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000446737123 513326815 /nfs/dbraw/zinc/32/68/15/513326815.db2.gz YTVLSHRLSGJVLB-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000421708131 513381495 /nfs/dbraw/zinc/38/14/95/513381495.db2.gz ZFRPSHPTCFBISW-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1sc(Br)cc1[N+](=O)[O-] ZINC000421711319 513382382 /nfs/dbraw/zinc/38/23/82/513382382.db2.gz OJWHZOZYBYRMBQ-MRVPVSSYSA-N 1 1 362.249 2.585 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CCN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434695833 513396495 /nfs/dbraw/zinc/39/64/95/513396495.db2.gz VFRHYJLWOPJTPK-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO CCOc1cc(CN(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434695833 513396508 /nfs/dbraw/zinc/39/65/08/513396508.db2.gz VFRHYJLWOPJTPK-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO CCOc1cc(CN(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434695833 513396516 /nfs/dbraw/zinc/39/65/16/513396516.db2.gz VFRHYJLWOPJTPK-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413085452 513434863 /nfs/dbraw/zinc/43/48/63/513434863.db2.gz WEPYSDADGGXABC-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@]4(CNC(=O)C4)C3)o2)c([N+](=O)[O-])c1 ZINC000435048430 513498094 /nfs/dbraw/zinc/49/80/94/513498094.db2.gz AMLSOBYTJFPOSE-IBGZPJMESA-N 1 1 371.393 2.575 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194870 513509941 /nfs/dbraw/zinc/50/99/41/513509941.db2.gz JTKFSDLXOZZRIG-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441194870 513509949 /nfs/dbraw/zinc/50/99/49/513509949.db2.gz JTKFSDLXOZZRIG-STQMWFEESA-N 1 1 367.833 2.935 20 5 FFBDMO COCC[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000425483966 513591614 /nfs/dbraw/zinc/59/16/14/513591614.db2.gz RTDOCIUMFQVQQF-CYBMUJFWSA-N 1 1 359.220 2.595 20 5 FFBDMO COCC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCOC1 ZINC000425483966 513591619 /nfs/dbraw/zinc/59/16/19/513591619.db2.gz RTDOCIUMFQVQQF-CYBMUJFWSA-N 1 1 359.220 2.595 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H](O)COCc1ccccc1 ZINC000430239858 513595918 /nfs/dbraw/zinc/59/59/18/513595918.db2.gz MXXSPGFIPOKHON-SFHVURJKSA-N 1 1 360.410 2.613 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H](O)COCc1ccccc1 ZINC000430239858 513595926 /nfs/dbraw/zinc/59/59/26/513595926.db2.gz MXXSPGFIPOKHON-SFHVURJKSA-N 1 1 360.410 2.613 20 5 FFBDMO Cn1cc(C[N@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccc(Cl)cc2)cn1 ZINC000430258051 513602528 /nfs/dbraw/zinc/60/25/28/513602528.db2.gz BBACIYZBUNFQQO-UHFFFAOYSA-N 1 1 374.832 2.881 20 5 FFBDMO Cn1cc(C[N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccc(Cl)cc2)cn1 ZINC000430258051 513602536 /nfs/dbraw/zinc/60/25/36/513602536.db2.gz BBACIYZBUNFQQO-UHFFFAOYSA-N 1 1 374.832 2.881 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000451265899 513636787 /nfs/dbraw/zinc/63/67/87/513636787.db2.gz ONYKDNKIMGUMGV-MOPGFXCFSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c1 ZINC000451265899 513636789 /nfs/dbraw/zinc/63/67/89/513636789.db2.gz ONYKDNKIMGUMGV-MOPGFXCFSA-N 1 1 360.385 2.774 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000418993581 513710081 /nfs/dbraw/zinc/71/00/81/513710081.db2.gz HCHVNPXWVHKTED-UONOGXRCSA-N 1 1 374.416 2.687 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@H]3O)n2)c1 ZINC000451420464 513739752 /nfs/dbraw/zinc/73/97/52/513739752.db2.gz PAHHYBSWNYBGRH-BZUAXINKSA-N 1 1 358.398 2.770 20 5 FFBDMO Nc1c(F)c(NC[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000436198605 513791182 /nfs/dbraw/zinc/79/11/82/513791182.db2.gz PKAINJREYUZGEM-CQSZACIVSA-N 1 1 360.389 2.629 20 5 FFBDMO Nc1c(F)c(NC[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000436198605 513791188 /nfs/dbraw/zinc/79/11/88/513791188.db2.gz PKAINJREYUZGEM-CQSZACIVSA-N 1 1 360.389 2.629 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436272812 513814511 /nfs/dbraw/zinc/81/45/11/513814511.db2.gz IDMSGVPFYXLDIV-LLVKDONJSA-N 1 1 362.352 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@@H]3CCCS(=O)(=O)C3)C2)cc1 ZINC000451551215 513827473 /nfs/dbraw/zinc/82/74/73/513827473.db2.gz TWGUDNAGOYWUIQ-HOCLYGCPSA-N 1 1 352.456 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@@H](O)COCC(F)(F)F)C2)cc1 ZINC000451554151 513830540 /nfs/dbraw/zinc/83/05/40/513830540.db2.gz ZKCUFNCSFVKVHZ-DZGCQCFKSA-N 1 1 362.348 2.714 20 5 FFBDMO C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000448697171 513850725 /nfs/dbraw/zinc/85/07/25/513850725.db2.gz LFKBBLCFFQQHBF-HUUCEWRRSA-N 1 1 361.442 2.937 20 5 FFBDMO O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000436426240 513851657 /nfs/dbraw/zinc/85/16/57/513851657.db2.gz BIMBCKGJDDAMOA-CYBMUJFWSA-N 1 1 365.408 2.741 20 5 FFBDMO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1nnc(C2CC2)s1 ZINC000414325611 514048516 /nfs/dbraw/zinc/04/85/16/514048516.db2.gz MLMXKPFEUASLIO-JTQLQIEISA-N 1 1 361.427 2.831 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000427018798 514092410 /nfs/dbraw/zinc/09/24/10/514092410.db2.gz CWSZJGHFBXHKNP-SJLPKXTDSA-N 1 1 355.394 2.779 20 5 FFBDMO C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000432138359 514104760 /nfs/dbraw/zinc/10/47/60/514104760.db2.gz LBZFVSZTYOSWPT-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CCN1C1CC[NH+](C)CC1 ZINC000432138359 514104763 /nfs/dbraw/zinc/10/47/63/514104763.db2.gz LBZFVSZTYOSWPT-OAHLLOKOSA-N 1 1 369.469 2.748 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000452005159 514129756 /nfs/dbraw/zinc/12/97/56/514129756.db2.gz LQKWGCLBVUYQAA-SJORKVTESA-N 1 1 370.405 2.862 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1NC)CCC(F)(F)F ZINC000427258336 514165309 /nfs/dbraw/zinc/16/53/09/514165309.db2.gz SKFKZOXOKVQZRY-UHFFFAOYSA-N 1 1 362.352 2.641 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000414563246 514182716 /nfs/dbraw/zinc/18/27/16/514182716.db2.gz VVMLGXHCRAQVRJ-IBGZPJMESA-N 1 1 372.425 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCC[N@H+]3CCCO)o2)cc1 ZINC000449390471 514191056 /nfs/dbraw/zinc/19/10/56/514191056.db2.gz WFDPOEKBVPIVRO-KRWDZBQOSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCC[N@@H+]3CCCO)o2)cc1 ZINC000449390471 514191057 /nfs/dbraw/zinc/19/10/57/514191057.db2.gz WFDPOEKBVPIVRO-KRWDZBQOSA-N 1 1 359.426 2.791 20 5 FFBDMO CO[C@@H]1C[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000449572559 514259078 /nfs/dbraw/zinc/25/90/78/514259078.db2.gz NUWAIIMWFOHNOB-RTBURBONSA-N 1 1 357.410 2.554 20 5 FFBDMO CO[C@@H]1C[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C[C@H]1O ZINC000449572559 514259084 /nfs/dbraw/zinc/25/90/84/514259084.db2.gz NUWAIIMWFOHNOB-RTBURBONSA-N 1 1 357.410 2.554 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000420944449 514392820 /nfs/dbraw/zinc/39/28/20/514392820.db2.gz QVAOGTRLRVIJRA-QWRGUYRKSA-N 1 1 360.357 2.655 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCC1 ZINC000445036375 514393299 /nfs/dbraw/zinc/39/32/99/514393299.db2.gz UFXQUTAGAFXBSD-UHFFFAOYSA-N 1 1 374.445 2.535 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000449982410 514452057 /nfs/dbraw/zinc/45/20/57/514452057.db2.gz SZQPWQXHAHIOHM-ZDUSSCGKSA-N 1 1 365.405 2.737 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C)C[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462009 514480452 /nfs/dbraw/zinc/48/04/52/514480452.db2.gz PNVASOYCUOYZHE-SJKOYZFVSA-N 1 1 373.409 2.949 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C)C[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462009 514480458 /nfs/dbraw/zinc/48/04/58/514480458.db2.gz PNVASOYCUOYZHE-SJKOYZFVSA-N 1 1 373.409 2.949 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000421101376 514483931 /nfs/dbraw/zinc/48/39/31/514483931.db2.gz VUWRVKUQEUSOKA-NSHDSACASA-N 1 1 358.345 2.754 20 5 FFBDMO CC[C@@H](C)[C@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079622 514490367 /nfs/dbraw/zinc/49/03/67/514490367.db2.gz UVZPLHGMJJZMRQ-RHSMWYFYSA-N 1 1 372.473 2.769 20 5 FFBDMO CC[C@@H](C)[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000439079622 514490373 /nfs/dbraw/zinc/49/03/73/514490373.db2.gz UVZPLHGMJJZMRQ-RHSMWYFYSA-N 1 1 372.473 2.769 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000475173453 514578431 /nfs/dbraw/zinc/57/84/31/514578431.db2.gz MZAQCMXKJLUJOX-LLVKDONJSA-N 1 1 368.397 2.622 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000466222072 514581786 /nfs/dbraw/zinc/58/17/86/514581786.db2.gz GBOPXCMKXKDAAD-CABCVRRESA-N 1 1 352.822 2.674 20 5 FFBDMO CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475315402 514616007 /nfs/dbraw/zinc/61/60/07/514616007.db2.gz XBYYLFOAOAOFBX-LJQANCHMSA-N 1 1 353.422 2.870 20 5 FFBDMO Cc1ccc(CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000453403230 514620139 /nfs/dbraw/zinc/62/01/39/514620139.db2.gz AVBQRGBPBOAEAQ-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C[C@@H](C)C1 ZINC000453428742 514631211 /nfs/dbraw/zinc/63/12/11/514631211.db2.gz QMHSUGIWXHGTDG-VBQJREDUSA-N 1 1 370.457 2.557 20 5 FFBDMO Cc1ccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1C ZINC000489004881 514670250 /nfs/dbraw/zinc/67/02/50/514670250.db2.gz CMVQBEHZXBPJFD-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@](C)(OC)CC2)cc1[N+](=O)[O-] ZINC000475559685 514714599 /nfs/dbraw/zinc/71/45/99/514714599.db2.gz FHARAVZLUXNTMO-SFHVURJKSA-N 1 1 366.414 2.538 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000508344528 514748517 /nfs/dbraw/zinc/74/85/17/514748517.db2.gz QWLLNOZHKWMIGO-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)c1 ZINC000475728401 514781413 /nfs/dbraw/zinc/78/14/13/514781413.db2.gz AKZHSCHQBDNUOW-HXUWFJFHSA-N 1 1 369.469 2.779 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@]3(CCCOC3)C2)c([N+](=O)[O-])c1 ZINC000475746816 514792090 /nfs/dbraw/zinc/79/20/90/514792090.db2.gz HIUNZXXWIGUCET-GOSISDBHSA-N 1 1 350.415 2.875 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000489327875 514799459 /nfs/dbraw/zinc/79/94/59/514799459.db2.gz MIAMWWBSVMOMTD-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1scnc1C ZINC000489445920 514848981 /nfs/dbraw/zinc/84/89/81/514848981.db2.gz FOXMKOINMZCCJX-UHFFFAOYSA-N 1 1 351.428 2.887 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@@H](C)C1 ZINC000480202536 514878250 /nfs/dbraw/zinc/87/82/50/514878250.db2.gz YKWMZEATXDKHEY-UONOGXRCSA-N 1 1 351.447 2.663 20 5 FFBDMO CCc1ccc(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000471672824 514976754 /nfs/dbraw/zinc/97/67/54/514976754.db2.gz YYDWNBUDJOJJKR-KRWDZBQOSA-N 1 1 363.458 2.634 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480515376 514983386 /nfs/dbraw/zinc/98/33/86/514983386.db2.gz XLXNQZUIIIBDJW-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO CCCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000509098891 515021584 /nfs/dbraw/zinc/02/15/84/515021584.db2.gz VVOVQHOLSYIAQU-MRXNPFEDSA-N 1 1 371.441 2.835 20 5 FFBDMO C[C@@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485418657 515033104 /nfs/dbraw/zinc/03/31/04/515033104.db2.gz VBQGAGFYWLMKDH-AWEZNQCLSA-N 1 1 374.416 2.953 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000490005918 515066335 /nfs/dbraw/zinc/06/63/35/515066335.db2.gz DCMXNVKRHGLMBW-GOSISDBHSA-N 1 1 357.410 2.913 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2ccnc(N(C)C)n2)CC1 ZINC000490035497 515077872 /nfs/dbraw/zinc/07/78/72/515077872.db2.gz CSDDXUVKHXMCKN-HNNXBMFYSA-N 1 1 370.457 2.642 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462491878 515082958 /nfs/dbraw/zinc/08/29/58/515082958.db2.gz SQHTYXHIMIPMHF-WMLDXEAASA-N 1 1 368.437 2.885 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000467709058 515087585 /nfs/dbraw/zinc/08/75/85/515087585.db2.gz PCGGWMPECNXEMH-COPLHBTASA-N 1 1 367.833 2.614 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)O1 ZINC000509294654 515113492 /nfs/dbraw/zinc/11/34/92/515113492.db2.gz PXACTGVPQDSBPH-MCIONIFRSA-N 1 1 369.412 2.947 20 5 FFBDMO CC[NH+]1CCN(c2ccc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000467840733 515143161 /nfs/dbraw/zinc/14/31/61/515143161.db2.gz WOLKFYHFNDLPMO-MRXNPFEDSA-N 1 1 369.469 2.983 20 5 FFBDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000467840733 515143170 /nfs/dbraw/zinc/14/31/70/515143170.db2.gz WOLKFYHFNDLPMO-MRXNPFEDSA-N 1 1 369.469 2.983 20 5 FFBDMO C[C@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849779 515146644 /nfs/dbraw/zinc/14/66/44/515146644.db2.gz IRKZSXCAQWFDJD-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849779 515146647 /nfs/dbraw/zinc/14/66/47/515146647.db2.gz IRKZSXCAQWFDJD-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO CN(C)c1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc[nH+]1 ZINC000481031108 515180814 /nfs/dbraw/zinc/18/08/14/515180814.db2.gz AAPCEXJBXSIKAK-UHFFFAOYSA-N 1 1 356.791 2.510 20 5 FFBDMO C[C@@H]1[C@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCC[N@H+]1C ZINC000462701951 515198432 /nfs/dbraw/zinc/19/84/32/515198432.db2.gz PEYSKMCVWKYGFH-GDBMZVCRSA-N 1 1 356.426 2.885 20 5 FFBDMO O=C(Nc1cccc(C[NH+]2CCC(O)CC2)c1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000476916341 515248501 /nfs/dbraw/zinc/24/85/01/515248501.db2.gz QZQZBTSMEOQZBZ-UHFFFAOYSA-N 1 1 371.393 2.509 20 5 FFBDMO CCc1cc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000462885085 515281797 /nfs/dbraw/zinc/28/17/97/515281797.db2.gz TWJLISKVLYLTLJ-BBRMVZONSA-N 1 1 355.442 2.931 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000481388076 515310798 /nfs/dbraw/zinc/31/07/98/515310798.db2.gz CNZRFEKFJSZRIW-LSDHHAIUSA-N 1 1 369.487 2.705 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-] ZINC000468480488 515379269 /nfs/dbraw/zinc/37/92/69/515379269.db2.gz UPAMTZUADXTMFZ-OAHLLOKOSA-N 1 1 351.472 2.924 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC[C@@H](O)C[NH+]1CCCC1 ZINC000504896548 515404741 /nfs/dbraw/zinc/40/47/41/515404741.db2.gz YMRWMTRLLPOJOR-HUUCEWRRSA-N 1 1 353.488 2.512 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCC1 ZINC000504896548 515404750 /nfs/dbraw/zinc/40/47/50/515404750.db2.gz YMRWMTRLLPOJOR-HUUCEWRRSA-N 1 1 353.488 2.512 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000505512241 515565341 /nfs/dbraw/zinc/56/53/41/515565341.db2.gz CBLABCKSSKQDKD-IBGZPJMESA-N 1 1 369.421 2.709 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000457029947 515595102 /nfs/dbraw/zinc/59/51/02/515595102.db2.gz RFQMSJZXGOUACX-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000493442881 515633689 /nfs/dbraw/zinc/63/36/89/515633689.db2.gz PTAYUSBRBXGFGD-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000473511915 515641144 /nfs/dbraw/zinc/64/11/44/515641144.db2.gz FIEMQEHKPBPKPQ-MRXNPFEDSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)CCn1ccc([N+](=O)[O-])n1 ZINC000478000732 515664748 /nfs/dbraw/zinc/66/47/48/515664748.db2.gz JBPQXULHEHTURM-UHFFFAOYSA-N 1 1 372.404 2.885 20 5 FFBDMO CNC(=O)C1C[NH+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000459607961 515689094 /nfs/dbraw/zinc/68/90/94/515689094.db2.gz JKGBJJBPPWIXBW-UHFFFAOYSA-N 1 1 354.410 2.541 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000510906293 515710813 /nfs/dbraw/zinc/71/08/13/515710813.db2.gz XZKAZLMQDAPRRG-ZDUSSCGKSA-N 1 1 359.348 2.875 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCc2ccccc2C1 ZINC000511125483 515793692 /nfs/dbraw/zinc/79/36/92/515793692.db2.gz NGUCLARJFYHRET-UHFFFAOYSA-N 1 1 353.422 2.654 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)N1CCc2ccccc2C1 ZINC000511125483 515793699 /nfs/dbraw/zinc/79/36/99/515793699.db2.gz NGUCLARJFYHRET-UHFFFAOYSA-N 1 1 353.422 2.654 20 5 FFBDMO Cc1cccc(OCCNC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511141367 515802383 /nfs/dbraw/zinc/80/23/83/515802383.db2.gz LJQYQZZNEQMTHN-UHFFFAOYSA-N 1 1 371.437 2.573 20 5 FFBDMO Cc1cccc(OCCNC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511141367 515802392 /nfs/dbraw/zinc/80/23/92/515802392.db2.gz LJQYQZZNEQMTHN-UHFFFAOYSA-N 1 1 371.437 2.573 20 5 FFBDMO CCN(CCn1ccc([N+](=O)[O-])n1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000478437699 515822907 /nfs/dbraw/zinc/82/29/07/515822907.db2.gz QCGNYTPNZABYCL-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000478437699 515822916 /nfs/dbraw/zinc/82/29/16/515822916.db2.gz QCGNYTPNZABYCL-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000478437699 515822926 /nfs/dbraw/zinc/82/29/26/515822926.db2.gz QCGNYTPNZABYCL-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CCC1(CC)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCS1 ZINC000464581336 515883410 /nfs/dbraw/zinc/88/34/10/515883410.db2.gz ODWVUNFRCKLIGN-CQSZACIVSA-N 1 1 354.472 2.942 20 5 FFBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](CC(N)=O)c1ccccc1 ZINC000483109826 515931307 /nfs/dbraw/zinc/93/13/07/515931307.db2.gz AJTYTTRPMJPVHA-MRXNPFEDSA-N 1 1 353.382 2.520 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](CC(N)=O)c1ccccc1 ZINC000483109826 515931320 /nfs/dbraw/zinc/93/13/20/515931320.db2.gz AJTYTTRPMJPVHA-MRXNPFEDSA-N 1 1 353.382 2.520 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000511531532 515936629 /nfs/dbraw/zinc/93/66/29/515936629.db2.gz ZCBCDKMMHDRFFJ-HOTGVXAUSA-N 1 1 362.474 2.899 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000494810916 515971086 /nfs/dbraw/zinc/97/10/86/515971086.db2.gz UKJDOLNVAGAXSI-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NCC[N@@H+]3CC=CCC3)cc2[N+](=O)[O-])C1 ZINC000506766016 515979038 /nfs/dbraw/zinc/97/90/38/515979038.db2.gz IEZWZCIQUVVHPQ-INIZCTEOSA-N 1 1 372.469 2.823 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]2COCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853996 515989445 /nfs/dbraw/zinc/98/94/45/515989445.db2.gz PEPATMYMOLUVQB-SMDDNHRTSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2COCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853996 515989453 /nfs/dbraw/zinc/98/94/53/515989453.db2.gz PEPATMYMOLUVQB-SMDDNHRTSA-N 1 1 353.806 2.688 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1Cc1[nH+]ccn1Cc1ccccc1 ZINC000465011884 516042945 /nfs/dbraw/zinc/04/29/45/516042945.db2.gz MTLSQNHGCYDNLG-UHFFFAOYSA-N 1 1 350.334 2.796 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474431922 516043533 /nfs/dbraw/zinc/04/35/33/516043533.db2.gz JCXYYVZIKDHZOT-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@H]1C ZINC000487959908 516052302 /nfs/dbraw/zinc/05/23/02/516052302.db2.gz SJHNMFFPFCZGFS-RHSMWYFYSA-N 1 1 361.442 2.621 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131023 516133519 /nfs/dbraw/zinc/13/35/19/516133519.db2.gz FNZUCTSQALXPNM-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131023 516133527 /nfs/dbraw/zinc/13/35/27/516133527.db2.gz FNZUCTSQALXPNM-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000470131023 516133537 /nfs/dbraw/zinc/13/35/37/516133537.db2.gz FNZUCTSQALXPNM-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1CCOC ZINC000501605858 516169514 /nfs/dbraw/zinc/16/95/14/516169514.db2.gz WHIQCRWGLNZPDC-AWEZNQCLSA-N 1 1 374.441 2.649 20 5 FFBDMO C[N@@H+](CCNC(=O)NCCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000465759847 516250198 /nfs/dbraw/zinc/25/01/98/516250198.db2.gz QXZOEVXHTPAXFX-UHFFFAOYSA-N 1 1 356.426 2.569 20 5 FFBDMO CCC[C@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CC[N@H+]1CCOC ZINC000557609307 516333742 /nfs/dbraw/zinc/33/37/42/516333742.db2.gz DKYDPYPPCBYOIX-LBPRGKRZSA-N 1 1 365.459 2.537 20 5 FFBDMO O=c1[nH]c(N2CC[NH+](Cc3ccsc3)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC000561099030 516378067 /nfs/dbraw/zinc/37/80/67/516378067.db2.gz KYWNJGQPYMOOHM-UHFFFAOYSA-N 1 1 371.422 2.627 20 5 FFBDMO Cc1cc(N2C[C@@H]([NH+]3CCOCC3)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000557696342 516388156 /nfs/dbraw/zinc/38/81/56/516388156.db2.gz CLHCLOIWEPIRIO-CABCVRRESA-N 1 1 356.426 2.751 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523135675 516394969 /nfs/dbraw/zinc/39/49/69/516394969.db2.gz UXDPLOMDONOULU-HNNXBMFYSA-N 1 1 369.849 2.816 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000535659938 516439367 /nfs/dbraw/zinc/43/93/67/516439367.db2.gz QRGJTCBJISGUTH-HOCLYGCPSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000535659938 516439374 /nfs/dbraw/zinc/43/93/74/516439374.db2.gz QRGJTCBJISGUTH-HOCLYGCPSA-N 1 1 362.817 2.762 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)CC2)c1 ZINC000535676721 516446689 /nfs/dbraw/zinc/44/66/89/516446689.db2.gz QGUHRMWYEMJRSO-UHFFFAOYSA-N 1 1 365.393 2.742 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000540475105 516570374 /nfs/dbraw/zinc/57/03/74/516570374.db2.gz DTGHIBCAKRHPBN-QGZVFWFLSA-N 1 1 361.373 2.674 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2nccn2C)C1 ZINC000536068648 516617141 /nfs/dbraw/zinc/61/71/41/516617141.db2.gz JUBXDXLFSWZBIR-JSGCOSHPSA-N 1 1 368.397 2.929 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000551388682 516687770 /nfs/dbraw/zinc/68/77/70/516687770.db2.gz LLRITPNCSPHXRM-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000551388682 516687778 /nfs/dbraw/zinc/68/77/78/516687778.db2.gz LLRITPNCSPHXRM-SFHVURJKSA-N 1 1 354.410 2.985 20 5 FFBDMO CCc1ccc([C@@H](NC[C@@H]2C[N@@H+](C)CCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544360841 516722250 /nfs/dbraw/zinc/72/22/50/516722250.db2.gz SDLPLYGWONDUJW-XLIONFOSSA-N 1 1 372.469 2.675 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccccc1O)c1ccc([N+](=O)[O-])cc1 ZINC000513703412 516724270 /nfs/dbraw/zinc/72/42/70/516724270.db2.gz VKUSYZSNQHYRJF-GOSISDBHSA-N 1 1 352.394 2.956 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC000544393103 516740291 /nfs/dbraw/zinc/74/02/91/516740291.db2.gz TWCDRXYRCCUTIC-CQSZACIVSA-N 1 1 364.409 2.816 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441008 516759832 /nfs/dbraw/zinc/75/98/32/516759832.db2.gz UYRCYIHUWTWMDY-ZQIUZPCESA-N 1 1 363.458 2.959 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C(C)(C)C)[C@@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441008 516759838 /nfs/dbraw/zinc/75/98/38/516759838.db2.gz UYRCYIHUWTWMDY-ZQIUZPCESA-N 1 1 363.458 2.959 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000532169371 516838135 /nfs/dbraw/zinc/83/81/35/516838135.db2.gz NMNPOYBYQWVWLS-WBVHZDCISA-N 1 1 362.430 2.668 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000541097890 516873773 /nfs/dbraw/zinc/87/37/73/516873773.db2.gz FISWLYNZQHJTPW-HNNXBMFYSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000541097890 516873783 /nfs/dbraw/zinc/87/37/83/516873783.db2.gz FISWLYNZQHJTPW-HNNXBMFYSA-N 1 1 356.382 2.912 20 5 FFBDMO CC[NH+](CC)CCN(Cc1ccccc1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-] ZINC000519097325 516882345 /nfs/dbraw/zinc/88/23/45/516882345.db2.gz DOGBMKHLIZAISY-UHFFFAOYSA-N 1 1 359.430 2.611 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000514639498 516975116 /nfs/dbraw/zinc/97/51/16/516975116.db2.gz CYRLTQBLGGDBAC-OAHLLOKOSA-N 1 1 350.463 2.899 20 5 FFBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000532484374 516999545 /nfs/dbraw/zinc/99/95/45/516999545.db2.gz SBZJHYPKCMVXKL-QGZVFWFLSA-N 1 1 369.421 2.909 20 5 FFBDMO COCCN(C)c1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000559071990 517067824 /nfs/dbraw/zinc/06/78/24/517067824.db2.gz NDXJMQNHKMAHLL-UHFFFAOYSA-N 1 1 358.442 2.747 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000525544406 517071419 /nfs/dbraw/zinc/07/14/19/517071419.db2.gz BZUZIZVFVOFGNC-DYEKYZERSA-N 1 1 369.849 2.957 20 5 FFBDMO Cc1c(Br)c(NCC[N@H+]2CCCC[C@@H]2C)ncc1[N+](=O)[O-] ZINC000541576234 517121674 /nfs/dbraw/zinc/12/16/74/517121674.db2.gz CXDLECDYTRZAGR-JTQLQIEISA-N 1 1 357.252 2.769 20 5 FFBDMO Cc1c(Br)c(NCC[N@@H+]2CCCC[C@@H]2C)ncc1[N+](=O)[O-] ZINC000541576234 517121681 /nfs/dbraw/zinc/12/16/81/517121681.db2.gz CXDLECDYTRZAGR-JTQLQIEISA-N 1 1 357.252 2.769 20 5 FFBDMO C[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@H+]1CCc2ccccc2C1 ZINC000541577657 517122293 /nfs/dbraw/zinc/12/22/93/517122293.db2.gz FFOJMGUPJLXQGY-AWEZNQCLSA-N 1 1 363.421 2.819 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C ZINC000555928401 517187853 /nfs/dbraw/zinc/18/78/53/517187853.db2.gz OWEGTGRQSGEUNU-WDEREUQCSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C ZINC000555928401 517187857 /nfs/dbraw/zinc/18/78/57/517187857.db2.gz OWEGTGRQSGEUNU-WDEREUQCSA-N 1 1 370.247 2.830 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000542030230 517347101 /nfs/dbraw/zinc/34/71/01/517347101.db2.gz RGKFLFWBTVVKQR-QWHCGFSZSA-N 1 1 350.419 2.988 20 5 FFBDMO COC(=O)CCC1CC[NH+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533344836 517416147 /nfs/dbraw/zinc/41/61/47/517416147.db2.gz RUBVYMGMYVDUCW-UHFFFAOYSA-N 1 1 363.414 2.507 20 5 FFBDMO CCC[N@H+]1CC[C@H](CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000562854491 517459541 /nfs/dbraw/zinc/45/95/41/517459541.db2.gz XMJQGQQZBUFSPJ-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO CC[N@@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000542505844 517599264 /nfs/dbraw/zinc/59/92/64/517599264.db2.gz NNUBIKUOTFOAPO-LLVKDONJSA-N 1 1 357.252 2.769 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000542505844 517599268 /nfs/dbraw/zinc/59/92/68/517599268.db2.gz NNUBIKUOTFOAPO-LLVKDONJSA-N 1 1 357.252 2.769 20 5 FFBDMO Cc1c(Br)c(NC[C@@H]2CC[N@H+](CC(C)C)C2)ncc1[N+](=O)[O-] ZINC000542505579 517599426 /nfs/dbraw/zinc/59/94/26/517599426.db2.gz ILPVLQZCHDTMRB-LBPRGKRZSA-N 1 1 371.279 2.872 20 5 FFBDMO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)[N@@H+](C)Cc1ccccc1 ZINC000553390400 517686143 /nfs/dbraw/zinc/68/61/43/517686143.db2.gz YSMFAGNJTAJWDD-ZDUSSCGKSA-N 1 1 367.409 2.598 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000542744745 517714742 /nfs/dbraw/zinc/71/47/42/517714742.db2.gz IETPOWHUPMYGRC-ZFWWWQNUSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCC[C@@H](C)C1 ZINC000521533253 517765447 /nfs/dbraw/zinc/76/54/47/517765447.db2.gz SHXOTTZEGUEUEF-HUUCEWRRSA-N 1 1 358.442 2.786 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000538953268 517862012 /nfs/dbraw/zinc/86/20/12/517862012.db2.gz LLPOWUZHYXZLGN-GHMZBOCLSA-N 1 1 359.373 2.729 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000517087425 518019552 /nfs/dbraw/zinc/01/95/52/518019552.db2.gz QETXPKMIUFXJHA-HOCLYGCPSA-N 1 1 360.458 2.655 20 5 FFBDMO CN1CC[N@H+](C)C[C@@H]1c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000547205037 518022388 /nfs/dbraw/zinc/02/23/88/518022388.db2.gz IGYUFEQFJZIUPS-OAHLLOKOSA-N 1 1 359.430 2.861 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000547205037 518022397 /nfs/dbraw/zinc/02/23/97/518022397.db2.gz IGYUFEQFJZIUPS-OAHLLOKOSA-N 1 1 359.430 2.861 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000534996137 518111730 /nfs/dbraw/zinc/11/17/30/518111730.db2.gz NIWCIGLYFHWJRY-UHFFFAOYSA-N 1 1 374.441 2.507 20 5 FFBDMO Cc1nn(CCC(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000522474508 518115072 /nfs/dbraw/zinc/11/50/72/518115072.db2.gz YQBYWRDWFBFJRP-AWEZNQCLSA-N 1 1 365.478 2.569 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000522651378 518140747 /nfs/dbraw/zinc/14/07/47/518140747.db2.gz NTVBZYMPKQIEBO-KBPBESRZSA-N 1 1 367.833 2.760 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000543574255 518142032 /nfs/dbraw/zinc/14/20/32/518142032.db2.gz PVZSAQIEHWSKRA-LPHOPBHVSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000543574255 518142034 /nfs/dbraw/zinc/14/20/34/518142034.db2.gz PVZSAQIEHWSKRA-LPHOPBHVSA-N 1 1 364.442 2.616 20 5 FFBDMO O=C1C[C@]2(CN1)CCC[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000539821194 518168320 /nfs/dbraw/zinc/16/83/20/518168320.db2.gz MXMMNNVEKKKTTH-IBGZPJMESA-N 1 1 355.394 2.957 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569674769 518231972 /nfs/dbraw/zinc/23/19/72/518231972.db2.gz WGHVZNHPQUFWPF-LBPRGKRZSA-N 1 1 353.394 2.689 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC(C)(C)[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000566884675 518246756 /nfs/dbraw/zinc/24/67/56/518246756.db2.gz QNOLNTSZRCZQRF-IAGOWNOFSA-N 1 1 350.415 2.872 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)c3cc([N+](=O)[O-])c[nH]3)C2)s1 ZINC000584372675 518307894 /nfs/dbraw/zinc/30/78/94/518307894.db2.gz GIEQXMFBDUEKGH-ZDUSSCGKSA-N 1 1 362.455 2.887 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000572820127 518375802 /nfs/dbraw/zinc/37/58/02/518375802.db2.gz PJGDCDUFZFQHAK-UHFFFAOYSA-N 1 1 370.453 2.884 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000564361318 518418166 /nfs/dbraw/zinc/41/81/66/518418166.db2.gz CMZNPHLRBOMLNY-CYBMUJFWSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000564361318 518418171 /nfs/dbraw/zinc/41/81/71/518418171.db2.gz CMZNPHLRBOMLNY-CYBMUJFWSA-N 1 1 360.439 2.885 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000567541546 518575154 /nfs/dbraw/zinc/57/51/54/518575154.db2.gz FDDPGRFOINMXNQ-DOTOQJQBSA-N 1 1 360.385 2.963 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1NCc1c[nH+]c2n1CCCC2 ZINC000570749914 518760045 /nfs/dbraw/zinc/76/00/45/518760045.db2.gz YJHOJHVWZFMLOD-UHFFFAOYSA-N 1 1 371.441 2.572 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3c([N+](=O)[O-])ncn3C)C2)s1 ZINC000565051390 518762821 /nfs/dbraw/zinc/76/28/21/518762821.db2.gz MVBRMWYSMVGFLL-CQSZACIVSA-N 1 1 363.487 2.652 20 5 FFBDMO C[C@]1(NC(=O)Cc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000565063701 518770031 /nfs/dbraw/zinc/77/00/31/518770031.db2.gz DXECCKJDSVIROV-FQEVSTJZSA-N 1 1 353.422 2.918 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@@H](C)CO)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000582873298 518962288 /nfs/dbraw/zinc/96/22/88/518962288.db2.gz PTPPGJKAKMLMCL-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000571438215 519096171 /nfs/dbraw/zinc/09/61/71/519096171.db2.gz ZRVWJGSQOOBAOT-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO C[C@@H](Cc1cnc[nH]1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000565786049 519132232 /nfs/dbraw/zinc/13/22/32/519132232.db2.gz ZKELKHONACLVLI-VIFPVBQESA-N 1 1 356.304 2.832 20 5 FFBDMO Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140277 519160276 /nfs/dbraw/zinc/16/02/76/519160276.db2.gz ODLNOKVGPNXAAQ-HUUCEWRRSA-N 1 1 359.348 2.831 20 5 FFBDMO CN1CCC([N@H+]2CC[C@@H](Nc3nccc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000590690073 519318108 /nfs/dbraw/zinc/31/81/08/519318108.db2.gz MXOXQRMBHCKCEE-CQSZACIVSA-N 1 1 355.442 2.723 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@@H]3CCC[N@H+]3Cc3ccccc32)c1 ZINC000577952361 519339081 /nfs/dbraw/zinc/33/90/81/519339081.db2.gz GGZCGLGGKFQWBI-INIZCTEOSA-N 1 1 373.434 2.768 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCCOC(C)C ZINC000569175560 519413975 /nfs/dbraw/zinc/41/39/75/519413975.db2.gz PKWKGRLQBQKIFU-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CCOC[C@@H]2CC2CCC2)c([N+](=O)[O-])c1 ZINC000583825714 519453521 /nfs/dbraw/zinc/45/35/21/519453521.db2.gz AFLUFMAPYVJFQY-HNNXBMFYSA-N 1 1 350.415 2.873 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOC[C@@H]2CC2CCC2)c([N+](=O)[O-])c1 ZINC000583825714 519453525 /nfs/dbraw/zinc/45/35/25/519453525.db2.gz AFLUFMAPYVJFQY-HNNXBMFYSA-N 1 1 350.415 2.873 20 5 FFBDMO CC(C)(C)c1csc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1 ZINC000583866714 519474214 /nfs/dbraw/zinc/47/42/14/519474214.db2.gz DZXUHGAXOOJQGN-CYBMUJFWSA-N 1 1 365.455 2.878 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000581021820 519481688 /nfs/dbraw/zinc/48/16/88/519481688.db2.gz AJWNUFCJPHWNQS-ZDUSSCGKSA-N 1 1 352.437 2.837 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000591347903 519603300 /nfs/dbraw/zinc/60/33/00/519603300.db2.gz WYOJGXCJTLWMIC-LJQANCHMSA-N 1 1 360.502 2.978 20 5 FFBDMO Cc1ccc(CNc2c(C(N)=O)cccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000591461400 519628962 /nfs/dbraw/zinc/62/89/62/519628962.db2.gz BJBDMQGTNRJBLV-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO CCOc1cc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000616179495 519934500 /nfs/dbraw/zinc/93/45/00/519934500.db2.gz DXRJXBCVRVOSCM-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000591529059 519939342 /nfs/dbraw/zinc/93/93/42/519939342.db2.gz NVVOVFQJYJIUOC-MRXNPFEDSA-N 1 1 361.442 2.539 20 5 FFBDMO C[NH+]1CCC2(CCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)CC1 ZINC000602876614 519942347 /nfs/dbraw/zinc/94/23/47/519942347.db2.gz HHXQICZXFPOYIN-UHFFFAOYSA-N 1 1 357.414 2.563 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594418465 519954525 /nfs/dbraw/zinc/95/45/25/519954525.db2.gz JFHOKYFIEFUCNC-ZWKOTPCHSA-N 1 1 360.458 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594420533 519955534 /nfs/dbraw/zinc/95/55/34/519955534.db2.gz WGCQUQRGERUJIA-CVEARBPZSA-N 1 1 361.442 2.805 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000599972442 519979714 /nfs/dbraw/zinc/97/97/14/519979714.db2.gz XPNGIMSYCFIIOY-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612529001 520005084 /nfs/dbraw/zinc/00/50/84/520005084.db2.gz YKFHWQRAIJKLBZ-QWRGUYRKSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C(CCOc1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1 ZINC000600071930 520030050 /nfs/dbraw/zinc/03/00/50/520030050.db2.gz HQTGQJPFGPTONH-UHFFFAOYSA-N 1 1 373.812 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594604056 520048023 /nfs/dbraw/zinc/04/80/23/520048023.db2.gz XRPKZDRUBPUBKI-HKUYNNGSSA-N 1 1 374.485 2.856 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc[nH]c2=O)c([N+](=O)[O-])cc1OCC(F)F ZINC000600207999 520125042 /nfs/dbraw/zinc/12/50/42/520125042.db2.gz HXDRMBODGBUDFM-UHFFFAOYSA-N 1 1 369.324 2.638 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608836184 520141021 /nfs/dbraw/zinc/14/10/21/520141021.db2.gz NDFQMCOSAKMQIW-WMZOPIPTSA-N 1 1 355.442 2.712 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC3(CCC([NH+](C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000597704306 520186946 /nfs/dbraw/zinc/18/69/46/520186946.db2.gz RUHJGUMRAWIZGX-UHFFFAOYSA-N 1 1 363.462 2.607 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])c3cccnc13)C2 ZINC000597709747 520190233 /nfs/dbraw/zinc/19/02/33/520190233.db2.gz BBISPXPMSDFJKP-IBGZPJMESA-N 1 1 354.410 2.701 20 5 FFBDMO C[C@H](C[NH+]1CCCCC1)NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000594914043 520216221 /nfs/dbraw/zinc/21/62/21/520216221.db2.gz BRDULOMZQRRHRO-OAHLLOKOSA-N 1 1 357.458 2.959 20 5 FFBDMO Cc1ccc(C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592145811 520224318 /nfs/dbraw/zinc/22/43/18/520224318.db2.gz CAICIYLPTXNIPJ-GOSISDBHSA-N 1 1 371.437 2.950 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2cccc([N+](=O)[O-])c2)C1 ZINC000594995026 520247381 /nfs/dbraw/zinc/24/73/81/520247381.db2.gz NBKVUGYDWYGVDZ-FQEVSTJZSA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNCc2cccc([N+](=O)[O-])c2)C1 ZINC000594995026 520247390 /nfs/dbraw/zinc/24/73/90/520247390.db2.gz NBKVUGYDWYGVDZ-FQEVSTJZSA-N 1 1 354.454 2.501 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597859166 520286951 /nfs/dbraw/zinc/28/69/51/520286951.db2.gz AJECOXGMBSPKCX-ZDUSSCGKSA-N 1 1 356.426 2.993 20 5 FFBDMO CCOc1ccc([C@@H](C)NC2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000595106579 520297234 /nfs/dbraw/zinc/29/72/34/520297234.db2.gz VKZIXAQCNATUIO-PBHICJAKSA-N 1 1 363.458 2.897 20 5 FFBDMO CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1 ZINC000597944993 520344049 /nfs/dbraw/zinc/34/40/49/520344049.db2.gz FZINUEJGPXUIFP-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000603844640 520374444 /nfs/dbraw/zinc/37/44/44/520374444.db2.gz WFKGBVQTTWDKGO-LJQANCHMSA-N 1 1 371.437 2.547 20 5 FFBDMO CC[N@@H+](CCNc1ncnc2ccc([N+](=O)[O-])cc21)CCC(F)(F)F ZINC000617210271 520380698 /nfs/dbraw/zinc/38/06/98/520380698.db2.gz FUXWQCZCILFRLR-UHFFFAOYSA-N 1 1 357.336 2.646 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598040182 520389226 /nfs/dbraw/zinc/38/92/26/520389226.db2.gz DKBRTWDPAMMACX-INIZCTEOSA-N 1 1 360.458 2.751 20 5 FFBDMO NC(=O)C1(c2ccccc2)CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609672859 520402411 /nfs/dbraw/zinc/40/24/11/520402411.db2.gz UELUCHIBJRUISY-UHFFFAOYSA-N 1 1 357.385 2.753 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493519 520416817 /nfs/dbraw/zinc/41/68/17/520416817.db2.gz UBORCMQXIKAKSB-CVEARBPZSA-N 1 1 360.458 2.553 20 5 FFBDMO CCN(C[C@H]1CC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1)CC(F)(F)F ZINC000595343832 520419867 /nfs/dbraw/zinc/41/98/67/520419867.db2.gz FENHXNWSBIKJFE-LLVKDONJSA-N 1 1 350.341 2.597 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1)CC(F)(F)F ZINC000595343832 520419872 /nfs/dbraw/zinc/41/98/72/520419872.db2.gz FENHXNWSBIKJFE-LLVKDONJSA-N 1 1 350.341 2.597 20 5 FFBDMO CCn1c2cc(F)ccc2[nH+]c1NCc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000613286594 520428820 /nfs/dbraw/zinc/42/88/20/520428820.db2.gz UCZXAFJCKNXMNW-UHFFFAOYSA-N 1 1 372.356 2.909 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000613295147 520433074 /nfs/dbraw/zinc/43/30/74/520433074.db2.gz SCCAKPVFZPNSEC-OAHLLOKOSA-N 1 1 362.430 2.540 20 5 FFBDMO C[C@@H]1C[NH+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)c2)C[C@@H](C)O1 ZINC000609992947 520498060 /nfs/dbraw/zinc/49/80/60/520498060.db2.gz HKQMYPVGQSJTLQ-CHWSQXEVSA-N 1 1 358.398 2.784 20 5 FFBDMO COCC[C@H]1CCCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000613503379 520533880 /nfs/dbraw/zinc/53/38/80/520533880.db2.gz QZYJAJBHOCHWDB-CRAIPNDOSA-N 1 1 361.442 2.839 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000592793092 520581695 /nfs/dbraw/zinc/58/16/95/520581695.db2.gz IWRXVIQWPLHFBE-ZDUSSCGKSA-N 1 1 358.398 2.595 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000592881786 520631400 /nfs/dbraw/zinc/63/14/00/520631400.db2.gz NKTZHEGEDYJUAX-APWZRJJASA-N 1 1 353.422 2.978 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000610392182 520663250 /nfs/dbraw/zinc/66/32/50/520663250.db2.gz ALPZMZZSBXXEMV-DOTOQJQBSA-N 1 1 369.425 2.513 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@@H](C)O)C2CCCCC2)c1 ZINC000593012430 520684286 /nfs/dbraw/zinc/68/42/86/520684286.db2.gz XDKKXIWRCUAKIA-CYBMUJFWSA-N 1 1 350.415 2.897 20 5 FFBDMO COc1ccc2c(c1)CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000595758745 520703532 /nfs/dbraw/zinc/70/35/32/520703532.db2.gz FNAJPRCPPBMNIO-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593088502 520735317 /nfs/dbraw/zinc/73/53/17/520735317.db2.gz FMMJHHBRNWWRLQ-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593088502 520735322 /nfs/dbraw/zinc/73/53/22/520735322.db2.gz FMMJHHBRNWWRLQ-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](Cc2ccccc2)C1 ZINC000593088502 520735327 /nfs/dbraw/zinc/73/53/27/520735327.db2.gz FMMJHHBRNWWRLQ-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[NH+]([C@@H]2CCCOC2)CC1 ZINC000610559992 520739343 /nfs/dbraw/zinc/73/93/43/520739343.db2.gz INFRXXRLBIYGDQ-CYBMUJFWSA-N 1 1 359.348 2.915 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[NH2+]Cc3c(C)cccc32)c([N+](=O)[O-])s1 ZINC000601341983 520749113 /nfs/dbraw/zinc/74/91/13/520749113.db2.gz NMXLJOAPPCGMLI-UHFFFAOYSA-N 1 1 367.452 2.572 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000598632025 520752772 /nfs/dbraw/zinc/75/27/72/520752772.db2.gz YKKHAIDODUESLB-ZBFHGGJFSA-N 1 1 370.409 2.534 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000593144391 520778338 /nfs/dbraw/zinc/77/83/38/520778338.db2.gz BYYIWPXUMURWKI-INIZCTEOSA-N 1 1 371.412 2.915 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914404 520820102 /nfs/dbraw/zinc/82/01/02/520820102.db2.gz HFXHEEOVHNWWTC-APPDUMDISA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cccc1[N+](=O)[O-] ZINC000595914404 520820109 /nfs/dbraw/zinc/82/01/09/520820109.db2.gz HFXHEEOVHNWWTC-APPDUMDISA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC000595920973 520825574 /nfs/dbraw/zinc/82/55/74/520825574.db2.gz VYQNTPONUOBEER-SJCJKPOMSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC000595920973 520825583 /nfs/dbraw/zinc/82/55/83/520825583.db2.gz VYQNTPONUOBEER-SJCJKPOMSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593322408 520910010 /nfs/dbraw/zinc/91/00/10/520910010.db2.gz MMIRYDZXTDHMFG-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593322408 520910016 /nfs/dbraw/zinc/91/00/16/520910016.db2.gz MMIRYDZXTDHMFG-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[N@H+](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000596110401 520917803 /nfs/dbraw/zinc/91/78/03/520917803.db2.gz NDYMPUIOWKSKQM-UHFFFAOYSA-N 1 1 355.822 2.955 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@@H]1CCN1C1CCCCC1)OCCO2 ZINC000598991747 520963686 /nfs/dbraw/zinc/96/36/86/520963686.db2.gz FMCMZUJPLLAUMA-INIZCTEOSA-N 1 1 361.442 2.863 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1 ZINC000596217319 520977122 /nfs/dbraw/zinc/97/71/22/520977122.db2.gz CKYXDZNQFUFIEH-GFCCVEGCSA-N 1 1 360.439 2.638 20 5 FFBDMO C[N@H+]1CCN(CCNc2c(Br)cccc2[N+](=O)[O-])CC1(C)C ZINC000596223605 520979041 /nfs/dbraw/zinc/97/90/41/520979041.db2.gz SSQBNARAFXTMRE-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596269633 521003115 /nfs/dbraw/zinc/00/31/15/521003115.db2.gz WEOFBPNLHVPPDN-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593454864 521004073 /nfs/dbraw/zinc/00/40/73/521004073.db2.gz NNEWNIJUYXKQJK-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000596307318 521018835 /nfs/dbraw/zinc/01/88/35/521018835.db2.gz KNPFHTINFNPPOT-GFCCVEGCSA-N 1 1 350.419 2.699 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000596307319 521018961 /nfs/dbraw/zinc/01/89/61/521018961.db2.gz KNPFHTINFNPPOT-LBPRGKRZSA-N 1 1 350.419 2.699 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350403 521112991 /nfs/dbraw/zinc/11/29/91/521112991.db2.gz LACVHEBUQMJPKX-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350403 521112996 /nfs/dbraw/zinc/11/29/96/521112996.db2.gz LACVHEBUQMJPKX-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1C(F)(F)F ZINC000596541604 521124149 /nfs/dbraw/zinc/12/41/49/521124149.db2.gz ZVNJWJYOZMJBRG-CYBMUJFWSA-N 1 1 359.348 2.649 20 5 FFBDMO Cc1ccc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)c(N2CCCC2)[nH+]1 ZINC000618585868 521136714 /nfs/dbraw/zinc/13/67/14/521136714.db2.gz MVMIKMQUBQYDNG-UHFFFAOYSA-N 1 1 352.398 2.809 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](CC3CC3)C2)s1 ZINC000596570022 521136944 /nfs/dbraw/zinc/13/69/44/521136944.db2.gz GZPXJADVBREMRI-GFCCVEGCSA-N 1 1 373.500 2.594 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](CC3CC3)C2)s1 ZINC000596570022 521136946 /nfs/dbraw/zinc/13/69/46/521136946.db2.gz GZPXJADVBREMRI-GFCCVEGCSA-N 1 1 373.500 2.594 20 5 FFBDMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000593673458 521143877 /nfs/dbraw/zinc/14/38/77/521143877.db2.gz YLAPGLRXXDBHAC-ZWKOTPCHSA-N 1 1 371.437 2.944 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611577217 521230974 /nfs/dbraw/zinc/23/09/74/521230974.db2.gz GRMWMMWMSVPYRU-GFCCVEGCSA-N 1 1 373.356 2.636 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000602291269 521263166 /nfs/dbraw/zinc/26/31/66/521263166.db2.gz KMMMPWIRIWFLBW-QAPCUYQASA-N 1 1 357.454 2.959 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599656833 521368982 /nfs/dbraw/zinc/36/89/82/521368982.db2.gz VPIMUCNSSPTQRZ-NFAWXSAZSA-N 1 1 366.389 2.906 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000599656833 521368986 /nfs/dbraw/zinc/36/89/86/521368986.db2.gz VPIMUCNSSPTQRZ-NFAWXSAZSA-N 1 1 366.389 2.906 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599656828 521369572 /nfs/dbraw/zinc/36/95/72/521369572.db2.gz VPIMUCNSSPTQRZ-GUTXKFCHSA-N 1 1 366.389 2.906 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000599656828 521369576 /nfs/dbraw/zinc/36/95/76/521369576.db2.gz VPIMUCNSSPTQRZ-GUTXKFCHSA-N 1 1 366.389 2.906 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000594199244 521464271 /nfs/dbraw/zinc/46/42/71/521464271.db2.gz IHWVGXQXVXBBLG-NVXWUHKLSA-N 1 1 358.442 2.916 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594204004 521469406 /nfs/dbraw/zinc/46/94/06/521469406.db2.gz WJHNFRMIFVCGLA-AEFFLSMTSA-N 1 1 356.426 2.683 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCc2cccc(Br)c2)c([N+](=O)[O-])n1 ZINC000602676978 521475533 /nfs/dbraw/zinc/47/55/33/521475533.db2.gz OSDZAXKFPDFQAX-UHFFFAOYSA-N 1 1 353.220 2.765 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597103916 521509646 /nfs/dbraw/zinc/50/96/46/521509646.db2.gz MROIWHATBBWLBX-NEPJUHHUSA-N 1 1 367.837 2.921 20 5 FFBDMO Cn1cc(C[NH2+][C@H]2CCOc3c(Br)cccc32)c([N+](=O)[O-])n1 ZINC000602825897 521555498 /nfs/dbraw/zinc/55/54/98/521555498.db2.gz LJABBTKQQSKPGF-LBPRGKRZSA-N 1 1 367.203 2.704 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(CN3CC[NH+]([C@H]4CCOC4)CC3)cs2)c1 ZINC000597203837 521572579 /nfs/dbraw/zinc/57/25/79/521572579.db2.gz YELOMAYIHPJLAS-KRWDZBQOSA-N 1 1 374.466 2.625 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000616055627 521612815 /nfs/dbraw/zinc/61/28/15/521612815.db2.gz FFDJJPHWHSHTTF-INIZCTEOSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1Cl ZINC000619867326 521911038 /nfs/dbraw/zinc/91/10/38/521911038.db2.gz STWARNIKGUIBBY-UHFFFAOYSA-N 1 1 353.762 2.518 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1Cl ZINC000619867326 521911045 /nfs/dbraw/zinc/91/10/45/521911045.db2.gz STWARNIKGUIBBY-UHFFFAOYSA-N 1 1 353.762 2.518 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625856 719086952 /nfs/dbraw/zinc/08/69/52/719086952.db2.gz HESZIOCQDDWPKB-HKUYNNGSSA-N 1 1 368.437 2.637 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CCN(c3cccc([N+](=O)[O-])n3)C[C@@H]2C[C@H]1Cn1cccn1 ZINC001164832954 720519526 /nfs/dbraw/zinc/51/95/26/720519526.db2.gz CCNMASFKISGJEX-YESZJQIVSA-N 1 1 370.457 2.564 20 5 FFBDMO Cc1cnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC001164859711 720925434 /nfs/dbraw/zinc/92/54/34/720925434.db2.gz PKUGKAJBLRBWQS-AWEZNQCLSA-N 1 1 358.446 2.916 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000745428354 735420418 /nfs/dbraw/zinc/42/04/18/735420418.db2.gz SSTXZNJUFFRQIB-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000745428354 735420420 /nfs/dbraw/zinc/42/04/20/735420420.db2.gz SSTXZNJUFFRQIB-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000066139809 728166792 /nfs/dbraw/zinc/16/67/92/728166792.db2.gz GFAYXVLANPXFLG-JTQLQIEISA-N 1 1 352.391 2.580 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNS(=O)(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000119634686 728597561 /nfs/dbraw/zinc/59/75/61/728597561.db2.gz FPSCKDSKDXQCKI-UHFFFAOYSA-N 1 1 369.468 2.587 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCCC[C@H](SC)C2)c([N+](=O)[O-])c1 ZINC000134610993 728731459 /nfs/dbraw/zinc/73/14/59/728731459.db2.gz PDNZNTFNKJFCIO-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCC[C@H](SC)C2)c([N+](=O)[O-])c1 ZINC000134610993 728731460 /nfs/dbraw/zinc/73/14/60/728731460.db2.gz PDNZNTFNKJFCIO-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000856282144 730321087 /nfs/dbraw/zinc/32/10/87/730321087.db2.gz QBJQSZWBOMICTP-UHFFFAOYSA-N 1 1 352.391 2.662 20 5 FFBDMO Cc1cc(C)c(CS(=O)(=O)CCOc2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC000864438935 730845621 /nfs/dbraw/zinc/84/56/21/730845621.db2.gz CJXOLYSCYVPZNI-UHFFFAOYSA-N 1 1 364.423 2.909 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(S(C)(=O)=O)s1 ZINC000873113026 731876038 /nfs/dbraw/zinc/87/60/38/731876038.db2.gz NJOPPKYHGGBORB-UHFFFAOYSA-N 1 1 354.453 2.966 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000877608631 732397736 /nfs/dbraw/zinc/39/77/36/732397736.db2.gz XSWINDXCVVUBAF-HNNXBMFYSA-N 1 1 359.348 2.712 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN2CC[NH+](C3CC3)CC2)o1 ZINC000878001272 732465483 /nfs/dbraw/zinc/46/54/83/732465483.db2.gz VNCPHIZOLPAJDN-UHFFFAOYSA-N 1 1 363.805 2.578 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879962151 732810337 /nfs/dbraw/zinc/81/03/37/732810337.db2.gz MJOOOUCBUDSFCJ-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000879962151 732810343 /nfs/dbraw/zinc/81/03/43/732810343.db2.gz MJOOOUCBUDSFCJ-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000880435215 732907421 /nfs/dbraw/zinc/90/74/21/732907421.db2.gz KGUYBUYTQIPRKJ-JSGCOSHPSA-N 1 1 359.220 2.593 20 5 FFBDMO CS(=O)(=O)[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883374747 733376494 /nfs/dbraw/zinc/37/64/94/733376494.db2.gz NVADNOPKBVXZAT-SZMVWBNQSA-N 1 1 360.435 2.849 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@H](O)c1cccc(Br)c1 ZINC000886247606 733765760 /nfs/dbraw/zinc/76/57/60/733765760.db2.gz VVEWWNYKXPSCEA-AWEZNQCLSA-N 1 1 366.215 2.918 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@H](O)c1cccc(Br)c1 ZINC000886247606 733765764 /nfs/dbraw/zinc/76/57/64/733765764.db2.gz VVEWWNYKXPSCEA-AWEZNQCLSA-N 1 1 366.215 2.918 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886562230 733802419 /nfs/dbraw/zinc/80/24/19/733802419.db2.gz TWXXFFHRRWHRHU-MXWKQRLJSA-N 1 1 355.847 2.870 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H]2CSC[C@@H]2C1 ZINC000886562230 733802422 /nfs/dbraw/zinc/80/24/22/733802422.db2.gz TWXXFFHRRWHRHU-MXWKQRLJSA-N 1 1 355.847 2.870 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ncc(Br)s2)cc1 ZINC000714930816 734370773 /nfs/dbraw/zinc/37/07/73/734370773.db2.gz QHKAJKBWQFLWRR-JTQLQIEISA-N 1 1 358.217 2.637 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000893601817 734725195 /nfs/dbraw/zinc/72/51/95/734725195.db2.gz JLIOJJYXIARYQW-HUUCEWRRSA-N 1 1 352.822 2.626 20 5 FFBDMO Cc1ccc(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1Br ZINC000895246309 734980681 /nfs/dbraw/zinc/98/06/81/734980681.db2.gz MWCVBCVQPKMANI-YPMHNXCESA-N 1 1 371.279 2.712 20 5 FFBDMO CC[N@H+]1CCN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000754389006 736154965 /nfs/dbraw/zinc/15/49/65/736154965.db2.gz XOPULNIVZMGOGF-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] ZINC000754510021 736166885 /nfs/dbraw/zinc/16/68/85/736166885.db2.gz MPMAZHDFROXKCR-MRXNPFEDSA-N 1 1 354.378 2.570 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757729256 736423096 /nfs/dbraw/zinc/42/30/96/736423096.db2.gz LGXORFYFHCAQOI-BONVTDFDSA-N 1 1 352.822 2.530 20 5 FFBDMO O=C(c1cc(Cl)c(F)c([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000907795539 736668490 /nfs/dbraw/zinc/66/84/90/736668490.db2.gz YNAKFWSRQCSOGV-RYUDHWBXSA-N 1 1 359.760 2.646 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)c([N+](=O)[O-])c1 ZINC000763377425 736933211 /nfs/dbraw/zinc/93/32/11/736933211.db2.gz YBJCPMZOOKAITQ-HIFRSBDPSA-N 1 1 350.375 2.558 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911472274 737202721 /nfs/dbraw/zinc/20/27/21/737202721.db2.gz HARUNCNACCBSBK-JTQLQIEISA-N 1 1 352.341 2.899 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000768837172 737464381 /nfs/dbraw/zinc/46/43/81/737464381.db2.gz YUJMGWAUTYWPGN-LBPRGKRZSA-N 1 1 361.489 2.589 20 5 FFBDMO O=C1OC[C@@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000769482610 737534569 /nfs/dbraw/zinc/53/45/69/737534569.db2.gz DGYIKACZAMILOY-LBPRGKRZSA-N 1 1 359.407 2.960 20 5 FFBDMO O=C1OC[C@@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CCN12 ZINC000769482610 737534570 /nfs/dbraw/zinc/53/45/70/737534570.db2.gz DGYIKACZAMILOY-LBPRGKRZSA-N 1 1 359.407 2.960 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001885 737589241 /nfs/dbraw/zinc/58/92/41/737589241.db2.gz MQTAYPIYWVVYJP-WMZOPIPTSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@@]1(C(=O)OCC)CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001885 737589242 /nfs/dbraw/zinc/58/92/42/737589242.db2.gz MQTAYPIYWVVYJP-WMZOPIPTSA-N 1 1 350.415 2.826 20 5 FFBDMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000770687327 737653144 /nfs/dbraw/zinc/65/31/44/737653144.db2.gz IPKFQXRMKFNQKW-OTYXRUKQSA-N 1 1 369.830 2.960 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000771938835 737767958 /nfs/dbraw/zinc/76/79/58/737767958.db2.gz QOSZKEBCGFQMEW-SNVBAGLBSA-N 1 1 353.762 2.764 20 5 FFBDMO CCN1CCC[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1=O ZINC000922638315 738178069 /nfs/dbraw/zinc/17/80/69/738178069.db2.gz AFOFIIQPIGCIOF-HNNXBMFYSA-N 1 1 360.439 2.819 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[NH3+])[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000923501769 738292948 /nfs/dbraw/zinc/29/29/48/738292948.db2.gz VHNXNQQJDDPSSP-QWRGUYRKSA-N 1 1 359.373 2.622 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)[C@@H]2C1 ZINC000930767459 739159873 /nfs/dbraw/zinc/15/98/73/739159873.db2.gz GOKOQHWBMVSXDQ-NOZJJQNGSA-N 1 1 358.320 2.781 20 5 FFBDMO COc1c(C)[nH]cc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1=O ZINC000931324215 739245577 /nfs/dbraw/zinc/24/55/77/739245577.db2.gz CBRAOGSMWWDZON-UHFFFAOYSA-N 1 1 351.790 2.886 20 5 FFBDMO COc1c(C)[nH]cc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1=O ZINC000931324215 739245582 /nfs/dbraw/zinc/24/55/82/739245582.db2.gz CBRAOGSMWWDZON-UHFFFAOYSA-N 1 1 351.790 2.886 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3)[C@H]2C1 ZINC000931335579 739247357 /nfs/dbraw/zinc/24/73/57/739247357.db2.gz XYGKAMFIFBCQKM-RNCFNFMXSA-N 1 1 369.219 2.525 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000790269597 739431170 /nfs/dbraw/zinc/43/11/70/739431170.db2.gz BTSTVIGNUDKCGJ-XHDPSFHLSA-N 1 1 367.833 2.955 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790544583 739468311 /nfs/dbraw/zinc/46/83/11/739468311.db2.gz ZTXWIKSHBUTVBQ-LLVKDONJSA-N 1 1 357.813 2.778 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791349910 739551402 /nfs/dbraw/zinc/55/14/02/739551402.db2.gz DSBOCLCEJRNPPM-UHFFFAOYSA-N 1 1 352.410 2.653 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000933440247 739626239 /nfs/dbraw/zinc/62/62/39/739626239.db2.gz CJVOLHRQAMPQPS-BDAKNGLRSA-N 1 1 358.801 2.524 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H](c3nccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000933715746 739678206 /nfs/dbraw/zinc/67/82/06/739678206.db2.gz NHRNHTMBMIORPA-VIFPVBQESA-N 1 1 357.292 2.690 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H](c3nccc(C(F)(F)F)n3)C2)c1[N+](=O)[O-] ZINC000933715746 739678207 /nfs/dbraw/zinc/67/82/07/739678207.db2.gz NHRNHTMBMIORPA-VIFPVBQESA-N 1 1 357.292 2.690 20 5 FFBDMO COC(=O)c1nn(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1Cl ZINC000795645631 740047805 /nfs/dbraw/zinc/04/78/05/740047805.db2.gz UQDCDORZRQMOJB-UHFFFAOYSA-N 1 1 366.805 2.672 20 5 FFBDMO COC(=O)c1nn(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1Cl ZINC000795645631 740047810 /nfs/dbraw/zinc/04/78/10/740047810.db2.gz UQDCDORZRQMOJB-UHFFFAOYSA-N 1 1 366.805 2.672 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1COC(=O)N(C)C ZINC000796558274 740154143 /nfs/dbraw/zinc/15/41/43/740154143.db2.gz XFKBCUKIASOHPE-HNNXBMFYSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1COC(=O)N(C)C ZINC000796558274 740154146 /nfs/dbraw/zinc/15/41/46/740154146.db2.gz XFKBCUKIASOHPE-HNNXBMFYSA-N 1 1 351.403 2.656 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000811447892 741523224 /nfs/dbraw/zinc/52/32/24/741523224.db2.gz PGCQKNBNJPJOCU-QGZVFWFLSA-N 1 1 354.378 2.729 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000811478310 741527409 /nfs/dbraw/zinc/52/74/09/741527409.db2.gz FYXKGPCHZQTVMT-OLZOCXBDSA-N 1 1 360.241 2.854 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000816682237 742053072 /nfs/dbraw/zinc/05/30/72/742053072.db2.gz SDXMFDNNPAUETJ-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2cc(Cl)c(F)cc2[N+](=O)[O-])CC1 ZINC000820625045 742529430 /nfs/dbraw/zinc/52/94/30/742529430.db2.gz YHNNRYGARAYOJM-UHFFFAOYSA-N 1 1 372.828 2.790 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)CC1 ZINC000822426276 742732136 /nfs/dbraw/zinc/73/21/36/742732136.db2.gz AHVDVVCADROLBM-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3Br)[C@@H]2C1 ZINC000822438851 742733929 /nfs/dbraw/zinc/73/39/29/742733929.db2.gz XGJYANRIMLLKKL-GXFFZTMASA-N 1 1 368.231 2.524 20 5 FFBDMO CC1(C)CC(C[NH2+]C[C@H]2CC[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1 ZINC001048607807 743414580 /nfs/dbraw/zinc/41/45/80/743414580.db2.gz LTVQOKPQQSWYGH-MUIFIZLQSA-N 1 1 351.491 2.600 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC000827328401 743556172 /nfs/dbraw/zinc/55/61/72/743556172.db2.gz FBFVVMRUPXHCRM-SCRDCRAPSA-N 1 1 367.833 2.568 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000830896419 745447795 /nfs/dbraw/zinc/44/77/95/745447795.db2.gz DVMOFXQZDNWAPO-DLBZAZTESA-N 1 1 350.802 2.947 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000834595332 745864573 /nfs/dbraw/zinc/86/45/73/745864573.db2.gz XICGOTWODWZJOB-KGLIPLIRSA-N 1 1 373.787 2.575 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](CCC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000840186418 747032772 /nfs/dbraw/zinc/03/27/72/747032772.db2.gz ZJEYDAUPSFNDGH-AWEZNQCLSA-N 1 1 352.435 2.891 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](CCC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000840186418 747032778 /nfs/dbraw/zinc/03/27/78/747032778.db2.gz ZJEYDAUPSFNDGH-AWEZNQCLSA-N 1 1 352.435 2.891 20 5 FFBDMO Cc1cc(C[NH+](C)C)ccc1NS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000840953484 747241325 /nfs/dbraw/zinc/24/13/25/747241325.db2.gz SFPHDXJMVNAXGU-UHFFFAOYSA-N 1 1 355.441 2.827 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000843981557 747944918 /nfs/dbraw/zinc/94/49/18/747944918.db2.gz IVZNKNIMSWBXBN-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C(C)(C)C1 ZINC000844948483 748143185 /nfs/dbraw/zinc/14/31/85/748143185.db2.gz AICCLYVPQRVAGO-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C(C)(C)C1 ZINC000844948483 748143192 /nfs/dbraw/zinc/14/31/92/748143192.db2.gz AICCLYVPQRVAGO-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO Cc1noc(C[NH2+][C@H](CNC(=O)OC(C)(C)C)C(C)(C)C)c1[N+](=O)[O-] ZINC000852011037 749750946 /nfs/dbraw/zinc/75/09/46/749750946.db2.gz ZDCZMBUQKBORFS-GFCCVEGCSA-N 1 1 356.423 2.920 20 5 FFBDMO C[C@]1(C2CC2)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000852322571 749834314 /nfs/dbraw/zinc/83/43/14/749834314.db2.gz MUIOXQAWTXMFKA-QGZVFWFLSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CCO ZINC000852455086 749863699 /nfs/dbraw/zinc/86/36/99/749863699.db2.gz DMQMQMAVTHEEAA-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1CCO ZINC000852455086 749863704 /nfs/dbraw/zinc/86/37/04/749863704.db2.gz DMQMQMAVTHEEAA-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000854569204 750330677 /nfs/dbraw/zinc/33/06/77/750330677.db2.gz IPCKVGOVNAYYPH-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1F ZINC000854676807 750350339 /nfs/dbraw/zinc/35/03/39/750350339.db2.gz CWUXYIBVBFKLBT-SNVBAGLBSA-N 1 1 353.369 2.738 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266639 971206224 /nfs/dbraw/zinc/20/62/24/971206224.db2.gz SDWBLSUVVNNLHX-RDJZCZTQSA-N 1 1 357.410 2.844 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266639 971206228 /nfs/dbraw/zinc/20/62/28/971206228.db2.gz SDWBLSUVVNNLHX-RDJZCZTQSA-N 1 1 357.410 2.844 20 5 FFBDMO COc1nc(SC)nc(NCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC001167751655 971706876 /nfs/dbraw/zinc/70/68/76/971706876.db2.gz NATYYNDMBGEQEU-NSHDSACASA-N 1 1 355.464 2.792 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(N[C@@H]3CC[N@@H+](Cc4ccccc4)C3)cc2N1 ZINC000312812355 972007035 /nfs/dbraw/zinc/00/70/35/972007035.db2.gz RRMQAFKVCJJYTI-CQSZACIVSA-N 1 1 368.393 2.612 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001175301366 1013429220 /nfs/dbraw/zinc/42/92/20/1013429220.db2.gz RPSHWXXZYOLJNO-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@@]1(C)C[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001175301366 1013429227 /nfs/dbraw/zinc/42/92/27/1013429227.db2.gz RPSHWXXZYOLJNO-BONVTDFDSA-N 1 1 371.231 2.988 20 5 FFBDMO COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC2 ZINC001175965347 1013597277 /nfs/dbraw/zinc/59/72/77/1013597277.db2.gz DTTDQLTZQSRIBG-WBVHZDCISA-N 1 1 352.362 2.660 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000892437712 968744670 /nfs/dbraw/zinc/74/46/70/968744670.db2.gz AVKYTFQMKWWZQT-INIZCTEOSA-N 1 1 357.410 2.673 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000892437712 968744672 /nfs/dbraw/zinc/74/46/72/968744672.db2.gz AVKYTFQMKWWZQT-INIZCTEOSA-N 1 1 357.410 2.673 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1C[N@@H+](C)CCN1C ZINC000895247765 968761787 /nfs/dbraw/zinc/76/17/87/968761787.db2.gz WFFKBKSARSTFMK-WMLDXEAASA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1CN(C)CC[N@@H+]1C ZINC000895247765 968761792 /nfs/dbraw/zinc/76/17/92/968761792.db2.gz WFFKBKSARSTFMK-WMLDXEAASA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@H]1CN(C)CC[N@H+]1C ZINC000895247765 968761803 /nfs/dbraw/zinc/76/18/03/968761803.db2.gz WFFKBKSARSTFMK-WMLDXEAASA-N 1 1 355.442 2.703 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103457489 970398432 /nfs/dbraw/zinc/39/84/32/970398432.db2.gz DYUMLKFEODDUTQ-HNNXBMFYSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103457489 970398438 /nfs/dbraw/zinc/39/84/38/970398438.db2.gz DYUMLKFEODDUTQ-HNNXBMFYSA-N 1 1 358.398 2.691 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000893038147 970522200 /nfs/dbraw/zinc/52/22/00/970522200.db2.gz VNRJVYOWVJSQLS-UHFFFAOYSA-N 1 1 355.442 2.821 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313084854 972622601 /nfs/dbraw/zinc/62/26/01/972622601.db2.gz XHVWLXQZHIKJFD-HOCLYGCPSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000899199343 977009286 /nfs/dbraw/zinc/00/92/86/977009286.db2.gz HDNQCHXQMVLBMW-HZPDHXFCSA-N 1 1 354.410 2.639 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H]([C@H](O)c2nccn2C)C1 ZINC000876809105 1014401600 /nfs/dbraw/zinc/40/16/00/1014401600.db2.gz CQMKDISFWGMRKT-QAPCUYQASA-N 1 1 358.442 2.891 20 5 FFBDMO C[C@H]1CN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000893958852 977615936 /nfs/dbraw/zinc/61/59/36/977615936.db2.gz DYFVSINLNGYQMU-CQSZACIVSA-N 1 1 370.453 2.757 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000877526647 1014613493 /nfs/dbraw/zinc/61/34/93/1014613493.db2.gz UOLHPLHYOZJNSK-GOSISDBHSA-N 1 1 360.502 2.812 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000877526647 1014613502 /nfs/dbraw/zinc/61/35/02/1014613502.db2.gz UOLHPLHYOZJNSK-GOSISDBHSA-N 1 1 360.502 2.812 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC000908304828 981412883 /nfs/dbraw/zinc/41/28/83/981412883.db2.gz ZSAOCZLJAFVXBO-CYBMUJFWSA-N 1 1 365.430 2.606 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000877818574 1014739772 /nfs/dbraw/zinc/73/97/72/1014739772.db2.gz KVKLQWVJWMHESA-CYBMUJFWSA-N 1 1 364.398 2.547 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)cc1OC ZINC000910294471 981903139 /nfs/dbraw/zinc/90/31/39/981903139.db2.gz UNYWPYJQFYVAFB-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000878163345 1014893011 /nfs/dbraw/zinc/89/30/11/1014893011.db2.gz QJLAMHGXSSYYLS-KBPBESRZSA-N 1 1 359.430 2.949 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000764920208 984812053 /nfs/dbraw/zinc/81/20/53/984812053.db2.gz MYTUPQCCGQASSJ-ZDUSSCGKSA-N 1 1 356.386 2.781 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000764920208 984812075 /nfs/dbraw/zinc/81/20/75/984812075.db2.gz MYTUPQCCGQASSJ-ZDUSSCGKSA-N 1 1 356.386 2.781 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000764934090 984837808 /nfs/dbraw/zinc/83/78/08/984837808.db2.gz IXNUSRGQTSOASU-INIZCTEOSA-N 1 1 358.442 2.916 20 5 FFBDMO COc1cccc(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000913685805 986830160 /nfs/dbraw/zinc/83/01/60/986830160.db2.gz GUVBCMNRLHISRB-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1cccc(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC000913685805 986830171 /nfs/dbraw/zinc/83/01/71/986830171.db2.gz GUVBCMNRLHISRB-HOTGVXAUSA-N 1 1 367.405 2.702 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC000879057627 1015343529 /nfs/dbraw/zinc/34/35/29/1015343529.db2.gz RCRCHXKVLDIGFP-INIZCTEOSA-N 1 1 357.414 2.525 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCc3c(CC(N)=O)cccc3C2)ccc1[N+](=O)[O-] ZINC000879233201 1015425430 /nfs/dbraw/zinc/42/54/30/1015425430.db2.gz RFKBMPKTHJDIMI-UHFFFAOYSA-N 1 1 369.421 2.580 20 5 FFBDMO CCOc1cc(C[N@H+]2CCc3c(CC(N)=O)cccc3C2)ccc1[N+](=O)[O-] ZINC000879233201 1015425436 /nfs/dbraw/zinc/42/54/36/1015425436.db2.gz RFKBMPKTHJDIMI-UHFFFAOYSA-N 1 1 369.421 2.580 20 5 FFBDMO CC(C)c1ccccc1C[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005380151 989743479 /nfs/dbraw/zinc/74/34/79/989743479.db2.gz CEZSDVBVBODLHD-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO Cc1ccccc1CCC[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001005380609 989744968 /nfs/dbraw/zinc/74/49/68/989744968.db2.gz FOAOEVVYDRXZNV-RTBURBONSA-N 1 1 359.470 2.516 20 5 FFBDMO COC(=O)c1cc(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)no1 ZINC000879428014 1015527198 /nfs/dbraw/zinc/52/71/98/1015527198.db2.gz NKQHXZVWZUGEAS-UHFFFAOYSA-N 1 1 363.345 2.888 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)c([N+](=O)[O-])c1 ZINC000826109213 1015548425 /nfs/dbraw/zinc/54/84/25/1015548425.db2.gz UXAHECDOXRPZNB-LJQANCHMSA-N 1 1 361.442 2.623 20 5 FFBDMO CCc1ccccc1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001034816343 990275909 /nfs/dbraw/zinc/27/59/09/990275909.db2.gz NUFQXYQJESYUGX-WOJBJXKFSA-N 1 1 367.449 2.820 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cc1C ZINC001034816484 990276008 /nfs/dbraw/zinc/27/60/08/990276008.db2.gz PQBRJUBTRSLXFI-WOJBJXKFSA-N 1 1 367.449 2.875 20 5 FFBDMO CCc1ccccc1C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2 ZINC001035186959 990410257 /nfs/dbraw/zinc/41/02/57/990410257.db2.gz NMHNVHKZCYCCNP-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1ccccc1C[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035186959 990410259 /nfs/dbraw/zinc/41/02/59/990410259.db2.gz NMHNVHKZCYCCNP-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO CCc1ccccc1C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001035186959 990410262 /nfs/dbraw/zinc/41/02/62/990410262.db2.gz NMHNVHKZCYCCNP-RTBURBONSA-N 1 1 371.481 2.729 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000705677113 990489578 /nfs/dbraw/zinc/48/95/78/990489578.db2.gz BKDCZBIJWDZKRR-IYBDPMFKSA-N 1 1 369.396 2.938 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000923314608 991057752 /nfs/dbraw/zinc/05/77/52/991057752.db2.gz KGBCDGBHEDUTNX-UONOGXRCSA-N 1 1 354.410 2.639 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000180153788 991439153 /nfs/dbraw/zinc/43/91/53/991439153.db2.gz OFPGUDORLRVHRG-MAUKXSAKSA-N 1 1 354.410 2.661 20 5 FFBDMO CC(C)Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)cc1 ZINC001484633789 991711728 /nfs/dbraw/zinc/71/17/28/991711728.db2.gz AWPSNKHSZBKWQA-QZTJIDSGSA-N 1 1 359.470 2.679 20 5 FFBDMO Cc1cncc([C@H]2CCC[N@H+]2C[C@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000879750342 1015664968 /nfs/dbraw/zinc/66/49/68/1015664968.db2.gz TUJGKQFAKNHLFA-DLBZAZTESA-N 1 1 357.410 2.875 20 5 FFBDMO COc1cc(CN2CC[C@@H]3[C@H]2CCC[N@H+]3C)c([N+](=O)[O-])cc1OC(F)F ZINC000880133368 1015763945 /nfs/dbraw/zinc/76/39/45/1015763945.db2.gz SXMQCEWTGSBQJW-CHWSQXEVSA-N 1 1 371.384 2.873 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808790631 994265863 /nfs/dbraw/zinc/26/58/63/994265863.db2.gz UYVGTYKGKBCSIE-RCBQFDQVSA-N 1 1 365.430 2.616 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1 ZINC000811485939 995156039 /nfs/dbraw/zinc/15/60/39/995156039.db2.gz GIHXJDFHKCESND-IBGZPJMESA-N 1 1 374.368 2.614 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1 ZINC000811485939 995156042 /nfs/dbraw/zinc/15/60/42/995156042.db2.gz GIHXJDFHKCESND-IBGZPJMESA-N 1 1 374.368 2.614 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000811502048 995169507 /nfs/dbraw/zinc/16/95/07/995169507.db2.gz HOQZGWCJWQYQPN-UHFFFAOYSA-N 1 1 373.365 2.964 20 5 FFBDMO Cc1cc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)c(N)c([N+](=O)[O-])c1 ZINC000811622422 995195333 /nfs/dbraw/zinc/19/53/33/995195333.db2.gz KUVFXFOKMUSKQR-UHFFFAOYSA-N 1 1 369.425 2.719 20 5 FFBDMO CCOc1cc(NC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000888833178 1015958775 /nfs/dbraw/zinc/95/87/75/1015958775.db2.gz XXKCOZICDDGXQF-HIFRSBDPSA-N 1 1 362.430 2.942 20 5 FFBDMO CC(C)Cn1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173604 995633721 /nfs/dbraw/zinc/63/37/21/995633721.db2.gz FIZUYYXJTYWJNJ-SFHVURJKSA-N 1 1 372.425 2.879 20 5 FFBDMO CC(C)Cn1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cn1 ZINC000813173604 995633722 /nfs/dbraw/zinc/63/37/22/995633722.db2.gz FIZUYYXJTYWJNJ-SFHVURJKSA-N 1 1 372.425 2.879 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000826709229 1015984266 /nfs/dbraw/zinc/98/42/66/1015984266.db2.gz JPPFVFQCGOZOKJ-LJQANCHMSA-N 1 1 364.405 2.922 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000826709229 1015984270 /nfs/dbraw/zinc/98/42/70/1015984270.db2.gz JPPFVFQCGOZOKJ-LJQANCHMSA-N 1 1 364.405 2.922 20 5 FFBDMO Cc1ccc(C[N@H+]2Cc3ccc(CNC(=O)[C@@H]4C[C@H]4[N+](=O)[O-])cc3C2)cc1 ZINC001054264362 1015994927 /nfs/dbraw/zinc/99/49/27/1015994927.db2.gz BMOHYLBKSTWIRV-WOJBJXKFSA-N 1 1 365.433 2.792 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCC1CCCC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264399 1015995801 /nfs/dbraw/zinc/99/58/01/1015995801.db2.gz CZIKNHVECIOSRN-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CCC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264399 1015995808 /nfs/dbraw/zinc/99/58/08/1015995808.db2.gz CZIKNHVECIOSRN-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264399 1015995811 /nfs/dbraw/zinc/99/58/11/1015995811.db2.gz CZIKNHVECIOSRN-RTBURBONSA-N 1 1 357.454 2.864 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000824827936 997117959 /nfs/dbraw/zinc/11/79/59/997117959.db2.gz JUAUQOQEVCDOIO-KBPBESRZSA-N 1 1 371.359 2.746 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC1 ZINC000732567777 998705028 /nfs/dbraw/zinc/70/50/28/998705028.db2.gz BGNOEAXSRVZCSX-UHFFFAOYSA-N 1 1 360.458 2.798 20 5 FFBDMO C[N@H+]1CC[C@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)C1 ZINC000823755230 999074657 /nfs/dbraw/zinc/07/46/57/999074657.db2.gz MLELOTUWOTXSJN-SSDOTTSWSA-N 1 1 350.177 2.722 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741017039 999702791 /nfs/dbraw/zinc/70/27/91/999702791.db2.gz LTXKLUMLVIPVRP-UPJWGTAASA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741022664 999703588 /nfs/dbraw/zinc/70/35/88/999703588.db2.gz WAGRMAYQOFCJTC-XUXIUFHCSA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)[NH+]1CCCCCC1 ZINC000741029476 999705035 /nfs/dbraw/zinc/70/50/35/999705035.db2.gz PVBVXIMMYLDHIG-ZDUSSCGKSA-N 1 1 364.398 2.769 20 5 FFBDMO CC(C)C1CC[NH+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000742170157 999760943 /nfs/dbraw/zinc/76/09/43/999760943.db2.gz XPUQBVCTQSDASB-IBGZPJMESA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCCC[N@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011390 1000015723 /nfs/dbraw/zinc/01/57/23/1000015723.db2.gz KDAJAMMPHBZCJR-CABCVRRESA-N 1 1 353.463 2.907 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019189 1000017595 /nfs/dbraw/zinc/01/75/95/1000017595.db2.gz FJIHNJWRMDVLAJ-BSWVEEBUSA-N 1 1 361.442 2.528 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)CN1c1ccc(F)cc1 ZINC001169021542 1000017603 /nfs/dbraw/zinc/01/76/03/1000017603.db2.gz OWOZMSOXPPDABE-BJZITVGISA-N 1 1 361.417 2.700 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]12 ZINC001169052554 1000019020 /nfs/dbraw/zinc/01/90/20/1000019020.db2.gz HFSXODWPLMEOLV-DGXTUMSLSA-N 1 1 353.463 2.667 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC001147337674 1000874086 /nfs/dbraw/zinc/87/40/86/1000874086.db2.gz UVICYQXIKDMKSX-INIZCTEOSA-N 1 1 362.474 2.942 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000788116901 1001756527 /nfs/dbraw/zinc/75/65/27/1001756527.db2.gz LBHBSNCTCDNLNI-HOTGVXAUSA-N 1 1 359.426 2.979 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000774530096 1001999538 /nfs/dbraw/zinc/99/95/38/1001999538.db2.gz ZAXATCVVNDFCFV-LBPRGKRZSA-N 1 1 355.398 2.594 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000791630437 1002767055 /nfs/dbraw/zinc/76/70/55/1002767055.db2.gz UDKXCQVDSKGXNO-UHFFFAOYSA-N 1 1 374.441 2.649 20 5 FFBDMO COCc1noc2c1C[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341896 1003129990 /nfs/dbraw/zinc/12/99/90/1003129990.db2.gz UCZGLLZTEGQKBT-GFCCVEGCSA-N 1 1 361.398 2.727 20 5 FFBDMO COCc1noc2c1C[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341896 1003129994 /nfs/dbraw/zinc/12/99/94/1003129994.db2.gz UCZGLLZTEGQKBT-GFCCVEGCSA-N 1 1 361.398 2.727 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2C[C@@H]3COC[C@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170351018 1003135336 /nfs/dbraw/zinc/13/53/36/1003135336.db2.gz DGKDJKJBHOKBIN-FPMFFAJLSA-N 1 1 356.369 2.748 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000792875753 1003216649 /nfs/dbraw/zinc/21/66/49/1003216649.db2.gz JLSWVUUFNMBUIQ-LBPRGKRZSA-N 1 1 368.353 2.935 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Cn3c(C)ncc3[N+](=O)[O-])cc2)c1C ZINC001129457789 1003654054 /nfs/dbraw/zinc/65/40/54/1003654054.db2.gz KLLTYZOJJUALAJ-UHFFFAOYSA-N 1 1 354.370 2.541 20 5 FFBDMO Cc1cccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])c(F)c2)c1 ZINC001001522594 1016829753 /nfs/dbraw/zinc/82/97/53/1016829753.db2.gz GCGLTUGMLNKEFW-IEBWSBKVSA-N 1 1 371.412 2.705 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2cnccn2)C1 ZINC001198166180 1004519056 /nfs/dbraw/zinc/51/90/56/1004519056.db2.gz XYPCSSZZRBZJFU-CQSZACIVSA-N 1 1 355.398 2.511 20 5 FFBDMO COC(=O)C[C@](C)([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cccnc1 ZINC001198890374 1004774166 /nfs/dbraw/zinc/77/41/66/1004774166.db2.gz FBBDDKYKNSAVAB-SFHVURJKSA-N 1 1 359.382 2.567 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776275099 1005342456 /nfs/dbraw/zinc/34/24/56/1005342456.db2.gz JGYXEPTUYHKUGR-ZWKOTPCHSA-N 1 1 352.394 2.741 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000106867617 1005364935 /nfs/dbraw/zinc/36/49/35/1005364935.db2.gz VAALQZODRMTPQY-AWEZNQCLSA-N 1 1 365.430 2.963 20 5 FFBDMO O=[N+]([O-])c1cccnc1N[C@H]1CC[C@H](N2CC[NH+](CC3CC3)CC2)CC1 ZINC001170720216 1006104023 /nfs/dbraw/zinc/10/40/23/1006104023.db2.gz LUGVYMUKEIJKRX-QAQDUYKDSA-N 1 1 359.474 2.741 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000110998310 1006249791 /nfs/dbraw/zinc/24/97/91/1006249791.db2.gz ZZBALOBNTHOAHP-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO COc1cc(N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c([N+](=O)[O-])cc1C ZINC000853296606 1006360946 /nfs/dbraw/zinc/36/09/46/1006360946.db2.gz OEYHTXDHSXCKLU-INIZCTEOSA-N 1 1 362.474 2.518 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)nc1-c1ccccn1 ZINC000853505728 1006418572 /nfs/dbraw/zinc/41/85/72/1006418572.db2.gz AGBQENWIUCDGEQ-INIZCTEOSA-N 1 1 364.409 2.770 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)nc1-c1ccccn1 ZINC000853505728 1006418577 /nfs/dbraw/zinc/41/85/77/1006418577.db2.gz AGBQENWIUCDGEQ-INIZCTEOSA-N 1 1 364.409 2.770 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(C(=O)OC)c(C)n1C ZINC000883344848 1006761139 /nfs/dbraw/zinc/76/11/39/1006761139.db2.gz KJYWVUOPPCSFCX-UHFFFAOYSA-N 1 1 361.398 2.717 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1CC1CC1 ZINC000883403046 1006779562 /nfs/dbraw/zinc/77/95/62/1006779562.db2.gz IVBNPVZCPBFPKW-AWEZNQCLSA-N 1 1 372.450 2.819 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)CC1 ZINC000816952850 1007274545 /nfs/dbraw/zinc/27/45/45/1007274545.db2.gz SVZIEHXBSJQYPX-BEFAXECRSA-N 1 1 372.469 2.607 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001137204356 1007304256 /nfs/dbraw/zinc/30/42/56/1007304256.db2.gz DALGMRAQLFJWGT-OKILXGFUSA-N 1 1 367.421 2.662 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc([N+](=O)[O-])c(F)c1 ZINC000817182976 1007462558 /nfs/dbraw/zinc/46/25/58/1007462558.db2.gz MYXATNJJBWFXQU-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)n1 ZINC001135832477 1007465612 /nfs/dbraw/zinc/46/56/12/1007465612.db2.gz RMNFSLZPLZCBBX-UHFFFAOYSA-N 1 1 354.410 2.646 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)n1 ZINC000858019975 1008278770 /nfs/dbraw/zinc/27/87/70/1008278770.db2.gz NMUMUGVSBFNZOD-MRXNPFEDSA-N 1 1 357.414 2.607 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000820101330 1008286723 /nfs/dbraw/zinc/28/67/23/1008286723.db2.gz YCISHHPGMSNEBB-YRWFTTLQSA-N 1 1 369.396 2.523 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000859209152 1008487626 /nfs/dbraw/zinc/48/76/26/1008487626.db2.gz XIQKJBLTNWYNCX-HNNXBMFYSA-N 1 1 357.410 2.589 20 5 FFBDMO COc1cc(OC)cc(N2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886040220 1008522438 /nfs/dbraw/zinc/52/24/38/1008522438.db2.gz UTURBJNHHYNJJW-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO COc1cc(OC)cc(N2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886040220 1008522447 /nfs/dbraw/zinc/52/24/47/1008522447.db2.gz UTURBJNHHYNJJW-UHFFFAOYSA-N 1 1 372.425 2.719 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1C(=O)OC(C)(C)C ZINC000859611386 1008587451 /nfs/dbraw/zinc/58/74/51/1008587451.db2.gz CVIQYZPVHPUPLL-XOKHGSTOSA-N 1 1 364.442 2.928 20 5 FFBDMO O=C(COC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000859669787 1008612058 /nfs/dbraw/zinc/61/20/58/1008612058.db2.gz JBEADWQHVMTHFY-INIZCTEOSA-N 1 1 364.373 2.867 20 5 FFBDMO O=C(COC(=O)[C@@H]1CCC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1F ZINC000859669787 1008612069 /nfs/dbraw/zinc/61/20/69/1008612069.db2.gz JBEADWQHVMTHFY-INIZCTEOSA-N 1 1 364.373 2.867 20 5 FFBDMO C[C@H]1C[C@@H]1c1noc(CC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)n1 ZINC000886267431 1008616428 /nfs/dbraw/zinc/61/64/28/1008616428.db2.gz MRHBDMRNAODJTJ-WFASDCNBSA-N 1 1 357.414 2.951 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@](C)(O)c1ccccc1 ZINC000822516802 1008664648 /nfs/dbraw/zinc/66/46/48/1008664648.db2.gz QFFIKQSKETZGMB-LJQANCHMSA-N 1 1 358.394 2.706 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000859929241 1008726322 /nfs/dbraw/zinc/72/63/22/1008726322.db2.gz ARZBKRLRUZCSCW-OKZBNKHCSA-N 1 1 351.406 2.929 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@H]1CC1(O)CCCCC1 ZINC000887035088 1008989241 /nfs/dbraw/zinc/98/92/41/1008989241.db2.gz GGIUQFXPBQPWNZ-INIZCTEOSA-N 1 1 363.458 2.696 20 5 FFBDMO Cc1ccc(NCCNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC001178602820 1009052527 /nfs/dbraw/zinc/05/25/27/1009052527.db2.gz DVUANGHGKSKVNC-UHFFFAOYSA-N 1 1 357.414 2.719 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)c2ccccc2C1 ZINC001136716102 1009052805 /nfs/dbraw/zinc/05/28/05/1009052805.db2.gz MHLFHBYPLYOPCY-UHFFFAOYSA-N 1 1 360.801 2.923 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)c2ccccc2C1 ZINC001136716102 1009052807 /nfs/dbraw/zinc/05/28/07/1009052807.db2.gz MHLFHBYPLYOPCY-UHFFFAOYSA-N 1 1 360.801 2.923 20 5 FFBDMO O=C(OCCC[N+](=O)[O-])[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1c1ccncc1 ZINC000860922424 1009199559 /nfs/dbraw/zinc/19/95/59/1009199559.db2.gz QTOLPEXZDNWUJS-RBUKOAKNSA-N 1 1 369.421 2.507 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823939078 1009287523 /nfs/dbraw/zinc/28/75/23/1009287523.db2.gz QUEZEVZAQKGBCF-GUYCJALGSA-N 1 1 369.425 2.962 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cc2ccccc2[nH]c1=O)c1cccc([N+](=O)[O-])c1 ZINC001179352327 1009314596 /nfs/dbraw/zinc/31/45/96/1009314596.db2.gz ASFBGZMEYJGVEI-LJQANCHMSA-N 1 1 353.378 2.846 20 5 FFBDMO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c2c(c1)COCO2 ZINC000134930948 1009504374 /nfs/dbraw/zinc/50/43/74/1009504374.db2.gz RWUUKLLOYOKVMT-KUHUBIRLSA-N 1 1 373.453 2.910 20 5 FFBDMO NC(=O)c1ccc(C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000794768910 1010581286 /nfs/dbraw/zinc/58/12/86/1010581286.db2.gz WUMQLMKRLGJHAA-SFHVURJKSA-N 1 1 373.384 2.531 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)c(F)c1 ZINC000794768910 1010581294 /nfs/dbraw/zinc/58/12/94/1010581294.db2.gz WUMQLMKRLGJHAA-SFHVURJKSA-N 1 1 373.384 2.531 20 5 FFBDMO C[C@@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000864809493 1010585973 /nfs/dbraw/zinc/58/59/73/1010585973.db2.gz VUUXZKZYXRSXOK-AWEZNQCLSA-N 1 1 371.412 2.839 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865625645 1010829346 /nfs/dbraw/zinc/82/93/46/1010829346.db2.gz TVQBQBXFUZKJII-ACJLOTCBSA-N 1 1 367.409 2.827 20 5 FFBDMO O=C1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1C1CCCC1 ZINC001172914895 1012096575 /nfs/dbraw/zinc/09/65/75/1012096575.db2.gz KVMCITKKIVZIDH-QGZVFWFLSA-N 1 1 357.454 2.929 20 5 FFBDMO O=C1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1C1CCCC1 ZINC001172914895 1012096587 /nfs/dbraw/zinc/09/65/87/1012096587.db2.gz KVMCITKKIVZIDH-QGZVFWFLSA-N 1 1 357.454 2.929 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@@H+]3Cc4cncnc4C3)CC2)c(F)c1 ZINC001173010116 1012178516 /nfs/dbraw/zinc/17/85/16/1012178516.db2.gz MPBLFCDFTWVYHK-UHFFFAOYSA-N 1 1 361.352 2.648 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3Cc4cncnc4C3)CC2)c(F)c1 ZINC001173010116 1012178523 /nfs/dbraw/zinc/17/85/23/1012178523.db2.gz MPBLFCDFTWVYHK-UHFFFAOYSA-N 1 1 361.352 2.648 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@@H]4COC[C@@H]4C3)CC2)c(F)c1 ZINC001173009801 1012179553 /nfs/dbraw/zinc/17/95/53/1012179553.db2.gz HKJAFMBNYOVVKQ-OLZOCXBDSA-N 1 1 367.396 2.810 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCCC[C@H](O)C3)CC2)c(F)c1 ZINC001173010777 1012182095 /nfs/dbraw/zinc/18/20/95/1012182095.db2.gz YTCXSAVODSUPIW-AWEZNQCLSA-N 1 1 355.385 2.689 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870140713 1012189796 /nfs/dbraw/zinc/18/97/96/1012189796.db2.gz KRFIFYAUOHCAGH-KRWDZBQOSA-N 1 1 359.357 2.529 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001173223181 1012354098 /nfs/dbraw/zinc/35/40/98/1012354098.db2.gz AHAQCCZJQJEPNJ-GPWPYBQESA-N 1 1 369.421 2.900 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001173223181 1012354120 /nfs/dbraw/zinc/35/41/20/1012354120.db2.gz AHAQCCZJQJEPNJ-GPWPYBQESA-N 1 1 369.421 2.900 20 5 FFBDMO CCOCc1nnn2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173229507 1012363657 /nfs/dbraw/zinc/36/36/57/1012363657.db2.gz XCYQBRYPZPYGPS-AWEZNQCLSA-N 1 1 359.430 2.560 20 5 FFBDMO Cc1cc(C)c(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001045436122 1019965451 /nfs/dbraw/zinc/96/54/51/1019965451.db2.gz IQQSHIDPZPFSIH-SJLPKXTDSA-N 1 1 359.470 2.748 20 5 FFBDMO O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)CC1 ZINC000930587818 1020094042 /nfs/dbraw/zinc/09/40/42/1020094042.db2.gz DPIXBHSCMJUNLH-YOWGUQMCSA-N 1 1 365.380 2.644 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048607671 1020352155 /nfs/dbraw/zinc/35/21/55/1020352155.db2.gz GEPWSDSKLQJJBX-MOIQIXESSA-N 1 1 363.433 2.503 20 5 FFBDMO CCOc1cc(C[N@H+](C)Cc2c[nH]c(C)c(OC)c2=O)ccc1[N+](=O)[O-] ZINC000931327420 1020423927 /nfs/dbraw/zinc/42/39/27/1020423927.db2.gz XFWQAPQIQCAVEL-UHFFFAOYSA-N 1 1 361.398 2.631 20 5 FFBDMO CCOc1cc(C[N@@H+](C)Cc2c[nH]c(C)c(OC)c2=O)ccc1[N+](=O)[O-] ZINC000931327420 1020423931 /nfs/dbraw/zinc/42/39/31/1020423931.db2.gz XFWQAPQIQCAVEL-UHFFFAOYSA-N 1 1 361.398 2.631 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)c1 ZINC000931490945 1020488557 /nfs/dbraw/zinc/48/85/57/1020488557.db2.gz IJMKQIHAHCUBEE-UFYCRDLUSA-N 1 1 353.422 2.587 20 5 FFBDMO CN(C)CC[C@H]([NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381661 1020815119 /nfs/dbraw/zinc/81/51/19/1020815119.db2.gz YJILUSYDGYZVSW-BZSNNMDCSA-N 1 1 372.473 2.953 20 5 FFBDMO Cc1nn(C[N@H+](C)CCOc2ccc(F)cc2)c2ncc([N+](=O)[O-])cc12 ZINC000749937010 1021146413 /nfs/dbraw/zinc/14/64/13/1021146413.db2.gz KICPOSCRSFUPNV-UHFFFAOYSA-N 1 1 359.361 2.755 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCOc2ccc(F)cc2)c2ncc([N+](=O)[O-])cc12 ZINC000749937010 1021146415 /nfs/dbraw/zinc/14/64/15/1021146415.db2.gz KICPOSCRSFUPNV-UHFFFAOYSA-N 1 1 359.361 2.755 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c1 ZINC000934268180 1021182877 /nfs/dbraw/zinc/18/28/77/1021182877.db2.gz HUPNVVBJILCONI-JKSUJKDBSA-N 1 1 373.375 2.645 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccnc1[N+](=O)[O-])C2 ZINC000934611779 1021296263 /nfs/dbraw/zinc/29/62/63/1021296263.db2.gz ZPRNYXVSJBTCCU-QEJZJMRPSA-N 1 1 362.430 2.867 20 5 FFBDMO C[C@@H](C(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001116684003 1021352379 /nfs/dbraw/zinc/35/23/79/1021352379.db2.gz FFNZNVAZPZNNJU-BBWFWOEESA-N 1 1 374.485 2.500 20 5 FFBDMO C[C@H](C(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC001116684005 1021354970 /nfs/dbraw/zinc/35/49/70/1021354970.db2.gz FFNZNVAZPZNNJU-IXDOHACOSA-N 1 1 374.485 2.500 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583758 1022135435 /nfs/dbraw/zinc/13/54/35/1022135435.db2.gz PILOHPWVRJAGJD-BXUZGUMPSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583758 1022135444 /nfs/dbraw/zinc/13/54/44/1022135444.db2.gz PILOHPWVRJAGJD-BXUZGUMPSA-N 1 1 367.450 2.601 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001017543454 1022244918 /nfs/dbraw/zinc/24/49/18/1022244918.db2.gz CODSISDYMSDNMC-UKBAYJJMSA-N 1 1 357.454 2.650 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001017543454 1022244926 /nfs/dbraw/zinc/24/49/26/1022244926.db2.gz CODSISDYMSDNMC-UKBAYJJMSA-N 1 1 357.454 2.650 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001017543454 1022244935 /nfs/dbraw/zinc/24/49/35/1022244935.db2.gz CODSISDYMSDNMC-UKBAYJJMSA-N 1 1 357.454 2.650 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1[N+](=O)[O-] ZINC000778951274 1022573765 /nfs/dbraw/zinc/57/37/65/1022573765.db2.gz JLQIPOJZIYRLLA-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1[N+](=O)[O-] ZINC000778951274 1022573776 /nfs/dbraw/zinc/57/37/76/1022573776.db2.gz JLQIPOJZIYRLLA-ZDUSSCGKSA-N 1 1 373.369 2.593 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC([N@H+](Cc2ccccc2)CC2CC2)CC1 ZINC001039485937 1022762836 /nfs/dbraw/zinc/76/28/36/1022762836.db2.gz VBXAACXKQMQBFM-RTBURBONSA-N 1 1 357.454 2.555 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@@H+](Cc2ccccc2)CC2CC2)CC1 ZINC001039485937 1022762841 /nfs/dbraw/zinc/76/28/41/1022762841.db2.gz VBXAACXKQMQBFM-RTBURBONSA-N 1 1 357.454 2.555 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([N@H+](Cc2ccccc2)CC2CC2)CC1 ZINC001039485937 1022762852 /nfs/dbraw/zinc/76/28/52/1022762852.db2.gz VBXAACXKQMQBFM-RTBURBONSA-N 1 1 357.454 2.555 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@@H]2CCCC3(CCC3)O2)CC1 ZINC001119686669 1022936004 /nfs/dbraw/zinc/93/60/04/1022936004.db2.gz SGXIAWGVSOZKDV-SFHVURJKSA-N 1 1 373.453 2.844 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829349961 1033112097 /nfs/dbraw/zinc/11/20/97/1033112097.db2.gz LCHXEZUDPWEBLE-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829349961 1033112100 /nfs/dbraw/zinc/11/21/00/1033112100.db2.gz LCHXEZUDPWEBLE-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@@H](O)c2cnn(C)c2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000753663863 1023365664 /nfs/dbraw/zinc/36/56/64/1023365664.db2.gz NLVIGUQHSQQILT-MJGOQNOKSA-N 1 1 370.409 2.896 20 5 FFBDMO O=C(OC[C@H]1CCC[N@@H+]1Cc1ccco1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779229723 1023402518 /nfs/dbraw/zinc/40/25/18/1023402518.db2.gz IDXXCTKCYABAQV-CYBMUJFWSA-N 1 1 374.349 2.738 20 5 FFBDMO O=C(OC[C@H]1CCC[N@H+]1Cc1ccco1)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000779229723 1023402523 /nfs/dbraw/zinc/40/25/23/1023402523.db2.gz IDXXCTKCYABAQV-CYBMUJFWSA-N 1 1 374.349 2.738 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000758333646 1024050590 /nfs/dbraw/zinc/05/05/90/1024050590.db2.gz IBKWGNVHDYLNJH-KSSFIOAISA-N 1 1 372.469 2.798 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000758336080 1024053237 /nfs/dbraw/zinc/05/32/37/1024053237.db2.gz BIVXSGJVHFHHDF-UHFFFAOYSA-N 1 1 370.344 2.945 20 5 FFBDMO CC(C)(C[NH2+]CC1CCCC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540775 1024885212 /nfs/dbraw/zinc/88/52/12/1024885212.db2.gz SYXREENUUVYEHO-IAGOWNOFSA-N 1 1 351.491 2.696 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246378464 1026081713 /nfs/dbraw/zinc/08/17/13/1026081713.db2.gz ZHDFYIVZRVYCAM-DNVCBOLYSA-N 1 1 372.421 2.940 20 5 FFBDMO O=C(CCC[NH+]1CCN(c2cc([N+](=O)[O-])ccn2)CC1)c1ccc(F)cc1 ZINC001158809368 1027141926 /nfs/dbraw/zinc/14/19/26/1027141926.db2.gz VFRJFWKXFYRSQV-UHFFFAOYSA-N 1 1 372.400 2.914 20 5 FFBDMO Cc1ccc2c(c1)[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(=O)N2 ZINC001155111035 1028583920 /nfs/dbraw/zinc/58/39/20/1028583920.db2.gz OAGQONQXILGZAT-LXXRFIIISA-N 1 1 353.382 2.936 20 5 FFBDMO O=[N+]([O-])c1cncc(Cl)c1NCC1(C[NH+]2CCOCC2)CCCCC1 ZINC001162732105 1028636724 /nfs/dbraw/zinc/63/67/24/1028636724.db2.gz MAALWWOIIDALOW-UHFFFAOYSA-N 1 1 368.865 2.760 20 5 FFBDMO CC(C)[C@@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000780497727 1028714397 /nfs/dbraw/zinc/71/43/97/1028714397.db2.gz MMSDLJTWPBEKNA-AUUYWEPGSA-N 1 1 374.441 2.687 20 5 FFBDMO CO[C@@H](C[NH+]1CCN(c2ncc([N+](=O)[O-])cc2F)CC1)c1ccccc1 ZINC001155714227 1028865321 /nfs/dbraw/zinc/86/53/21/1028865321.db2.gz DDOXWXXZEQANOF-KRWDZBQOSA-N 1 1 360.389 2.639 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1cc(N)c([N+](=O)[O-])cn1 ZINC001156341881 1029155680 /nfs/dbraw/zinc/15/56/80/1029155680.db2.gz PXKGATLLTAGDDP-KSSFIOAISA-N 1 1 355.442 2.919 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cc([N+](=O)[O-])c3cc[nH]c3n2)CC1 ZINC001165110604 1029400031 /nfs/dbraw/zinc/40/00/31/1029400031.db2.gz TZKUPKXAGYXJME-CQSZACIVSA-N 1 1 359.430 2.551 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1ccc([N+](=O)[O-])c(N)n1 ZINC001165180456 1029435650 /nfs/dbraw/zinc/43/56/50/1029435650.db2.gz AXOVQHZQXBIURK-WMLDXEAASA-N 1 1 355.442 2.919 20 5 FFBDMO C[N@@H+](Cc1ccc(F)cc1)C1CCN(c2cc(N)c([N+](=O)[O-])cn2)CC1 ZINC001157075087 1029458337 /nfs/dbraw/zinc/45/83/37/1029458337.db2.gz WKQJEWOZSBTVIT-UHFFFAOYSA-N 1 1 359.405 2.812 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@H](c3cccnc3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842629282 1030853020 /nfs/dbraw/zinc/85/30/20/1030853020.db2.gz TYXIOSSJSLHCNQ-INIZCTEOSA-N 1 1 367.409 2.679 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@H](c3cccnc3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842629282 1030853041 /nfs/dbraw/zinc/85/30/41/1030853041.db2.gz TYXIOSSJSLHCNQ-INIZCTEOSA-N 1 1 367.409 2.679 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1Cn1cnc(-c3cccc([N+](=O)[O-])c3)n1)CCOCC2 ZINC000842639140 1030868352 /nfs/dbraw/zinc/86/83/52/1030868352.db2.gz OWZLTWZVMOEOAK-AWEZNQCLSA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796706218 1030886808 /nfs/dbraw/zinc/88/68/08/1030886808.db2.gz IZUDGJOBPMQLCJ-IAGOWNOFSA-N 1 1 365.430 2.617 20 5 FFBDMO COC(=O)CC[N@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C[C@@H]1CCCO1 ZINC001204350274 1031244751 /nfs/dbraw/zinc/24/47/51/1031244751.db2.gz YVIKOYUWHHWBNR-HNNXBMFYSA-N 1 1 350.415 2.756 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CN2CCOC2=O)C1 ZINC000830100914 1033461579 /nfs/dbraw/zinc/46/15/79/1033461579.db2.gz IRKZQSNQFJHLBM-AWEZNQCLSA-N 1 1 363.414 2.656 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001220409122 1034156358 /nfs/dbraw/zinc/15/63/58/1034156358.db2.gz ABQPNTYMEOMVGF-KBPBESRZSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2F)c(N2CCCC2)[nH+]1 ZINC000831930229 1034418686 /nfs/dbraw/zinc/41/86/86/1034418686.db2.gz BOYHQXJAPQRUDM-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)cc1 ZINC000832054955 1034522946 /nfs/dbraw/zinc/52/29/46/1034522946.db2.gz ZAFVAEOXYNSIEM-BPQIPLTHSA-N 1 1 362.426 2.636 20 5 FFBDMO COC(=O)c1cc(Br)cc([N+](=O)[O-])c1O[C@H]1CCC[N@@H+](C)C1 ZINC001226358794 1034649779 /nfs/dbraw/zinc/64/97/79/1034649779.db2.gz VMOGCJZFTXSCQD-JTQLQIEISA-N 1 1 373.203 2.617 20 5 FFBDMO C[C@@H](c1ccccn1)[N@@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111659 1034938354 /nfs/dbraw/zinc/93/83/54/1034938354.db2.gz PUWPBLMGGHSKQI-GXTWGEPZSA-N 1 1 373.369 2.897 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001227111659 1034938361 /nfs/dbraw/zinc/93/83/61/1034938361.db2.gz PUWPBLMGGHSKQI-GXTWGEPZSA-N 1 1 373.369 2.897 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ccc(Br)nc1[N+](=O)[O-] ZINC001227260266 1035490905 /nfs/dbraw/zinc/49/09/05/1035490905.db2.gz PVKOFFSGWBTMTE-IWIIMEHWSA-N 1 1 356.220 2.861 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@H](C)[C@H]2C[N@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685330 1036255271 /nfs/dbraw/zinc/25/52/71/1036255271.db2.gz GDLIYDQQSTUJQT-RHSMWYFYSA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@H](C)[C@H]2C[N@@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685330 1036255285 /nfs/dbraw/zinc/25/52/85/1036255285.db2.gz GDLIYDQQSTUJQT-RHSMWYFYSA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@@H+](Cc3ccc(Cl)cc3)C2)c([N+](=O)[O-])c(=O)[n-]1 ZINC001229377876 1036640966 /nfs/dbraw/zinc/64/09/66/1036640966.db2.gz GGMIMGQTXBRYGL-CYBMUJFWSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@H+](Cc3ccc(Cl)cc3)C2)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229377876 1036640972 /nfs/dbraw/zinc/64/09/72/1036640972.db2.gz GGMIMGQTXBRYGL-CYBMUJFWSA-N 1 1 364.789 2.706 20 5 FFBDMO Cc1nc2c(c(O[C@@H](C[N+](=O)[O-])C3CC3)n1)C[N@H+](Cc1ccccc1)CC2 ZINC001229846066 1036928886 /nfs/dbraw/zinc/92/88/86/1036928886.db2.gz KMSXINVYKPIQBZ-IBGZPJMESA-N 1 1 368.437 2.777 20 5 FFBDMO Cc1nc2c(c(O[C@@H](C[N+](=O)[O-])C3CC3)n1)C[N@@H+](Cc1ccccc1)CC2 ZINC001229846066 1036928907 /nfs/dbraw/zinc/92/89/07/1036928907.db2.gz KMSXINVYKPIQBZ-IBGZPJMESA-N 1 1 368.437 2.777 20 5 FFBDMO C[C@@H](C[NH+]1CCOCC1)Oc1cnc2ccc(=O)n3c4ccccc4c1c23 ZINC001234710840 1037151246 /nfs/dbraw/zinc/15/12/46/1037151246.db2.gz MYXNYDABTUIFLO-AWEZNQCLSA-N 1 1 363.417 2.538 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001537097843 1070120346 /nfs/dbraw/zinc/12/03/46/1070120346.db2.gz YLVWWSJLCRAZCN-NVXWUHKLSA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(N2CCC([NH2+]CC[C@@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC001256087527 1038372052 /nfs/dbraw/zinc/37/20/52/1038372052.db2.gz DSOBNOHCFKHSPM-INIZCTEOSA-N 1 1 362.474 2.646 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3c(F)ccc([N+](=O)[O-])c3F)o2)C[C@H](C)O1 ZINC001258136389 1039213608 /nfs/dbraw/zinc/21/36/08/1039213608.db2.gz AWJJVSUPTUEKQD-AOOOYVTPSA-N 1 1 368.340 2.575 20 5 FFBDMO COc1cc(N2CCC(N[C@H](C[NH3+])c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001246505544 1039375017 /nfs/dbraw/zinc/37/50/17/1039375017.db2.gz DGOVKJQDGOUCBN-GOSISDBHSA-N 1 1 370.453 2.862 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@H+](C)CCO1 ZINC001210683680 1039668311 /nfs/dbraw/zinc/66/83/11/1039668311.db2.gz YFJSMLFZAPECRX-YVEFUNNKSA-N 1 1 358.398 2.589 20 5 FFBDMO C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@@H+](C)CCO1 ZINC001210683680 1039668323 /nfs/dbraw/zinc/66/83/23/1039668323.db2.gz YFJSMLFZAPECRX-YVEFUNNKSA-N 1 1 358.398 2.589 20 5 FFBDMO CC(=O)c1ccc(C[C@H]([NH3+])c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)cc1 ZINC001249349010 1040694482 /nfs/dbraw/zinc/69/44/82/1040694482.db2.gz GLZGTRFOVXXHBH-ZDUSSCGKSA-N 1 1 371.328 2.624 20 5 FFBDMO Cc1noc([C@@H]2CC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)n1 ZINC001254480389 1040747481 /nfs/dbraw/zinc/74/74/81/1040747481.db2.gz FFQPQWCSHHUVDN-CQSZACIVSA-N 1 1 357.414 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](Oc4cnccn4)C3)CC2)cc1 ZINC001254482065 1040749379 /nfs/dbraw/zinc/74/93/79/1040749379.db2.gz HQOUESHRHCIKGQ-GOSISDBHSA-N 1 1 369.425 2.507 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001254561842 1040799059 /nfs/dbraw/zinc/79/90/59/1040799059.db2.gz MOMVKTSYSWFXAS-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001254561842 1040799076 /nfs/dbraw/zinc/79/90/76/1040799076.db2.gz MOMVKTSYSWFXAS-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO Cc1noc([C@@H]2C[C@@H]3CC[N@H+]([C@@H]4Cc5ccc([N+](=O)[O-])cc5C4)C[C@H]3O2)n1 ZINC001254593345 1040822055 /nfs/dbraw/zinc/82/20/55/1040822055.db2.gz LFLMSARBWCJEAI-HNONPPJISA-N 1 1 370.409 2.606 20 5 FFBDMO CC(C)C(=O)N1CC[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC[C@@H]21 ZINC001254596125 1040824247 /nfs/dbraw/zinc/82/42/47/1040824247.db2.gz OWCVHDZHTZBVLR-MNEFBYGVSA-N 1 1 357.454 2.641 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2CN1c1ccccc1 ZINC001254595887 1040825134 /nfs/dbraw/zinc/82/51/34/1040825134.db2.gz OCUQKRLPUHWKSF-DBVUQKKJSA-N 1 1 363.417 2.657 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCc3ncnc(C4CC4)c3CC1)C2 ZINC001254596866 1040827451 /nfs/dbraw/zinc/82/74/51/1040827451.db2.gz SFHWGBMRXCSQRN-QGZVFWFLSA-N 1 1 350.422 2.830 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(CCc3cccs3)CC1)C2 ZINC001254601204 1040832630 /nfs/dbraw/zinc/83/26/30/1040832630.db2.gz VSZUGJQZDYQEOS-GOSISDBHSA-N 1 1 357.479 2.984 20 5 FFBDMO O=C(c1ccco1)N1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254604030 1040833012 /nfs/dbraw/zinc/83/30/12/1040833012.db2.gz STKCTPBBEDHEHR-QGZVFWFLSA-N 1 1 355.394 2.503 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NCCn2cc[nH+]c2C(C)C)c1[N+](=O)[O-] ZINC001309878691 1043568593 /nfs/dbraw/zinc/56/85/93/1043568593.db2.gz MQAQLBPDYJUCMF-UHFFFAOYSA-N 1 1 366.443 2.510 20 5 FFBDMO CCN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1C[C@H]1CC[N@@H+](CC)C1 ZINC001313888347 1044436177 /nfs/dbraw/zinc/43/61/77/1044436177.db2.gz HCBSZLBBZSMDTM-AWEZNQCLSA-N 1 1 358.446 2.651 20 5 FFBDMO CN(CC(C)(C)C[NH2+]Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001282294611 1045482980 /nfs/dbraw/zinc/48/29/80/1045482980.db2.gz CRSUVDIZGWMZKP-HZPDHXFCSA-N 1 1 359.426 2.672 20 5 FFBDMO Cc1ccc(C[N@@H+]2CCCN(C(=O)c3cc([N+](=O)[O-])cn3C)CC2)cc1 ZINC001322698234 1046186426 /nfs/dbraw/zinc/18/64/26/1046186426.db2.gz JGIUOYGLUJRSOD-UHFFFAOYSA-N 1 1 356.426 2.590 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002988 1046302266 /nfs/dbraw/zinc/30/22/66/1046302266.db2.gz IDOBFSIUZPKMAH-MAUKXSAKSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002988 1046302278 /nfs/dbraw/zinc/30/22/78/1046302278.db2.gz IDOBFSIUZPKMAH-MAUKXSAKSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002989 1046302666 /nfs/dbraw/zinc/30/26/66/1046302666.db2.gz IDOBFSIUZPKMAH-QAPCUYQASA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001323002989 1046302678 /nfs/dbraw/zinc/30/26/78/1046302678.db2.gz IDOBFSIUZPKMAH-QAPCUYQASA-N 1 1 373.384 2.918 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC001331329573 1047867767 /nfs/dbraw/zinc/86/77/67/1047867767.db2.gz JMHKTJCOOVIVFX-IUODEOHRSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)COCCO3)c(Br)c1 ZINC001331848391 1048140560 /nfs/dbraw/zinc/14/05/60/1048140560.db2.gz ZMBPPAKNSDSANL-UHFFFAOYSA-N 1 1 371.231 2.739 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001332911452 1048617720 /nfs/dbraw/zinc/61/77/20/1048617720.db2.gz JDZPKTIYFWELES-OLZOCXBDSA-N 1 1 351.834 2.924 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001329254209 1048637237 /nfs/dbraw/zinc/63/72/37/1048637237.db2.gz UIHJZJMOJCOVFB-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001329254209 1048637244 /nfs/dbraw/zinc/63/72/44/1048637244.db2.gz UIHJZJMOJCOVFB-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H]1c1ccc(F)cc1 ZINC001333709471 1049068792 /nfs/dbraw/zinc/06/87/92/1049068792.db2.gz MLIOSXFIIGTDBY-NVXWUHKLSA-N 1 1 358.373 2.690 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC001340030032 1050440796 /nfs/dbraw/zinc/44/07/96/1050440796.db2.gz PSDXFMCOEZWWJA-KSSFIOAISA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC001340030032 1050440800 /nfs/dbraw/zinc/44/08/00/1050440800.db2.gz PSDXFMCOEZWWJA-KSSFIOAISA-N 1 1 354.410 2.832 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C)[nH+]c1N1CCCC1 ZINC001342062759 1050659897 /nfs/dbraw/zinc/65/98/97/1050659897.db2.gz ABCTUCNYXVMRIL-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(c2nnc([C@@H](C)[N+](=O)[O-])n2Cc2ccccc2)C[C@@H]1C ZINC001342144903 1050739576 /nfs/dbraw/zinc/73/95/76/1050739576.db2.gz OVQZCUWABBTDJB-HRCADAONSA-N 1 1 372.473 2.583 20 5 FFBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC001542350615 1071216272 /nfs/dbraw/zinc/21/62/72/1071216272.db2.gz MMPAAKDWXJCRHK-CYBMUJFWSA-N 1 1 367.833 2.575 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)[nH+]1 ZINC001303893008 1051466946 /nfs/dbraw/zinc/46/69/46/1051466946.db2.gz XNPCUKQCBBYJBX-UHFFFAOYSA-N 1 1 357.395 2.988 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC001304041467 1051511378 /nfs/dbraw/zinc/51/13/78/1051511378.db2.gz NFIGREHJGDXRIP-KRWDZBQOSA-N 1 1 360.458 2.655 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC001307117641 1052253775 /nfs/dbraw/zinc/25/37/75/1052253775.db2.gz ZOBXAEFVDVFABP-UHFFFAOYSA-N 1 1 369.347 2.668 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001307819564 1052353513 /nfs/dbraw/zinc/35/35/13/1052353513.db2.gz WDDXLPUUKKFWKN-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001307819564 1052353516 /nfs/dbraw/zinc/35/35/16/1052353516.db2.gz WDDXLPUUKKFWKN-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)C[C@@H]1C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC001308081244 1052402153 /nfs/dbraw/zinc/40/21/53/1052402153.db2.gz GKQNSYPAMKQLMR-YRGRVCCFSA-N 1 1 374.397 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@H]2CC2CCOCC2)cc1 ZINC001308137894 1052415499 /nfs/dbraw/zinc/41/54/99/1052415499.db2.gz WDHVZTRMDFKTOK-GOSISDBHSA-N 1 1 364.442 2.881 20 5 FFBDMO COC(=O)COc1ccc(CNc2ccc3[nH]c[nH+]c3c2)cc1[N+](=O)[O-] ZINC001308399262 1052453801 /nfs/dbraw/zinc/45/38/01/1052453801.db2.gz SQQBOVHQWWDKAQ-UHFFFAOYSA-N 1 1 356.338 2.635 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CCC[C@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308910839 1052518028 /nfs/dbraw/zinc/51/80/28/1052518028.db2.gz UXCZYNUQRSAFHI-ZDUSSCGKSA-N 1 1 366.414 2.863 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@H](C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC001308910839 1052518030 /nfs/dbraw/zinc/51/80/30/1052518030.db2.gz UXCZYNUQRSAFHI-ZDUSSCGKSA-N 1 1 366.414 2.863 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC001347395697 1053934583 /nfs/dbraw/zinc/93/45/83/1053934583.db2.gz ONIJIVNRGVTCHX-HNNXBMFYSA-N 1 1 356.426 2.553 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC001347395697 1053934587 /nfs/dbraw/zinc/93/45/87/1053934587.db2.gz ONIJIVNRGVTCHX-HNNXBMFYSA-N 1 1 356.426 2.553 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@@H]2C1 ZINC001337835849 1055048618 /nfs/dbraw/zinc/04/86/18/1055048618.db2.gz XZJJFULYVSVQCC-BHYNMZESSA-N 1 1 357.332 2.684 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)CC1 ZINC001338072134 1055208660 /nfs/dbraw/zinc/20/86/60/1055208660.db2.gz BTUVQZZDEWXIBA-UHFFFAOYSA-N 1 1 373.442 2.569 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC001352451506 1055487700 /nfs/dbraw/zinc/48/77/00/1055487700.db2.gz CFFWZQBIJCIVIJ-CHWSQXEVSA-N 1 1 364.475 2.580 20 5 FFBDMO C[C@@H](Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12)[C@H](C)[NH+]1CCOCC1 ZINC001350456336 1055782871 /nfs/dbraw/zinc/78/28/71/1055782871.db2.gz JUOUSPAEYQFFGL-MNOVXSKESA-N 1 1 365.821 2.713 20 5 FFBDMO C[C@H](Nc1ncnc2c(Cl)cc([N+](=O)[O-])cc12)[C@H](C)[NH+]1CCOCC1 ZINC001350456338 1055783138 /nfs/dbraw/zinc/78/31/38/1055783138.db2.gz JUOUSPAEYQFFGL-QWRGUYRKSA-N 1 1 365.821 2.713 20 5 FFBDMO Cn1c([C@@H]2CCC[N@@H+](C)C2)nnc1N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001350843905 1055965914 /nfs/dbraw/zinc/96/59/14/1055965914.db2.gz YHPTWPGYBBGTFI-OAHLLOKOSA-N 1 1 370.457 2.702 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001358288593 1056234744 /nfs/dbraw/zinc/23/47/44/1056234744.db2.gz UMWSZDYIPIEZHX-OAHLLOKOSA-N 1 1 355.394 2.780 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC[N@H+](C)C[C@H]1c1cnn(C)c1 ZINC000849597326 1056937997 /nfs/dbraw/zinc/93/79/97/1056937997.db2.gz SFOVPIGLQNCLQH-CVEARBPZSA-N 1 1 371.441 2.619 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@@H+](C)CCN1C ZINC001517886775 1058189873 /nfs/dbraw/zinc/18/98/73/1058189873.db2.gz BEPPJRRCCDGVEF-FZKQIMNGSA-N 1 1 371.441 2.504 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1Cn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001502281604 1058805101 /nfs/dbraw/zinc/80/51/01/1058805101.db2.gz KDOURYFIHRZLNT-GOSISDBHSA-N 1 1 370.457 2.542 20 5 FFBDMO Cc1c(C(=O)N2CC[N@H+](C)C(C)(C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC001454270130 1059479621 /nfs/dbraw/zinc/47/96/21/1059479621.db2.gz VXLNBWVXCKTSTA-UHFFFAOYSA-N 1 1 364.402 2.676 20 5 FFBDMO CCOC(=O)CC[N@H+](Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1 ZINC000848474651 1060095490 /nfs/dbraw/zinc/09/54/90/1060095490.db2.gz FWIJVSZXYOZUST-UHFFFAOYSA-N 1 1 358.398 2.833 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1 ZINC000848474651 1060095511 /nfs/dbraw/zinc/09/55/11/1060095511.db2.gz FWIJVSZXYOZUST-UHFFFAOYSA-N 1 1 358.398 2.833 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848478205 1060100233 /nfs/dbraw/zinc/10/02/33/1060100233.db2.gz HZLGMKPALQLLIW-INIZCTEOSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848478205 1060100245 /nfs/dbraw/zinc/10/02/45/1060100245.db2.gz HZLGMKPALQLLIW-INIZCTEOSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000848485384 1060126520 /nfs/dbraw/zinc/12/65/20/1060126520.db2.gz ZEPPZTISUKZNTK-HKUYNNGSSA-N 1 1 373.453 2.617 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC[C@@H](OC4CCC4)C3)n2)cc1 ZINC000848496837 1060167918 /nfs/dbraw/zinc/16/79/18/1060167918.db2.gz FLEMNKVFEDKNDL-QGZVFWFLSA-N 1 1 357.414 2.844 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H](OC4CCC4)C3)n2)cc1 ZINC000848496837 1060167925 /nfs/dbraw/zinc/16/79/25/1060167925.db2.gz FLEMNKVFEDKNDL-QGZVFWFLSA-N 1 1 357.414 2.844 20 5 FFBDMO CC[N@@H+](C)[C@H]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001457411565 1060371273 /nfs/dbraw/zinc/37/12/73/1060371273.db2.gz IHAZFCGMKGRZAA-ZDUSSCGKSA-N 1 1 355.822 2.570 20 5 FFBDMO CC[N@@H+](CCn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1 ZINC001547578168 1071972521 /nfs/dbraw/zinc/97/25/21/1071972521.db2.gz BZPADXXQGLNPAZ-UHFFFAOYSA-N 1 1 370.457 2.542 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001460828196 1061119344 /nfs/dbraw/zinc/11/93/44/1061119344.db2.gz GSKSYIYOKOBFNY-CQSZACIVSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1cccc(CN2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)c1Br ZINC001460902262 1061143743 /nfs/dbraw/zinc/14/37/43/1061143743.db2.gz QQQFRRPDYLZFGO-RYUDHWBXSA-N 1 1 358.211 2.585 20 5 FFBDMO O=[N+]([O-])c1cccc(CN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)c1Br ZINC001460902262 1061143752 /nfs/dbraw/zinc/14/37/52/1061143752.db2.gz QQQFRRPDYLZFGO-RYUDHWBXSA-N 1 1 358.211 2.585 20 5 FFBDMO O=C(CC[N@H+]1CCCC[C@@]12CCOC2)Nc1cc([N+](=O)[O-])ccc1F ZINC001460957899 1061164457 /nfs/dbraw/zinc/16/44/57/1061164457.db2.gz AQLYAKGVLMEHMO-KRWDZBQOSA-N 1 1 351.378 2.708 20 5 FFBDMO Cc1cc(NC(=O)NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001477213260 1061628444 /nfs/dbraw/zinc/62/84/44/1061628444.db2.gz ZZZUHDAKMVZCGM-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc(NC(=O)NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001477213260 1061628449 /nfs/dbraw/zinc/62/84/49/1061628449.db2.gz ZZZUHDAKMVZCGM-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001528151323 1061775972 /nfs/dbraw/zinc/77/59/72/1061775972.db2.gz AQFKBSTXNSIMIA-BPQIPLTHSA-N 1 1 360.458 2.855 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC001463220338 1062000336 /nfs/dbraw/zinc/00/03/36/1062000336.db2.gz CJJYELZTXFTOEU-ZDUSSCGKSA-N 1 1 370.247 2.500 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001463269456 1062023326 /nfs/dbraw/zinc/02/33/26/1062023326.db2.gz DZZCVMSASMLNFP-GUTXKFCHSA-N 1 1 369.487 2.548 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)Cc2cccc(F)c2[N+](=O)[O-])cn1 ZINC001464219291 1062489576 /nfs/dbraw/zinc/48/95/76/1062489576.db2.gz UWCNMOGLMYUEGV-UHFFFAOYSA-N 1 1 355.329 2.804 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)n1 ZINC001531317858 1062743707 /nfs/dbraw/zinc/74/37/07/1062743707.db2.gz WDYPZWWZFRULRA-CALCHBBNSA-N 1 1 366.421 2.502 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@@H]2C1 ZINC001467070995 1063629263 /nfs/dbraw/zinc/62/92/63/1063629263.db2.gz ZURZCCPDJRVEFR-PEYYIBSZSA-N 1 1 355.398 2.605 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001467570742 1063787495 /nfs/dbraw/zinc/78/74/95/1063787495.db2.gz QOIJWKFXPVXJDU-KGLIPLIRSA-N 1 1 359.430 2.839 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC001470779873 1064448819 /nfs/dbraw/zinc/44/88/19/1064448819.db2.gz JWCBVQSDJMIVMU-PBHICJAKSA-N 1 1 356.426 2.574 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC001471092647 1064555161 /nfs/dbraw/zinc/55/51/61/1064555161.db2.gz ZNHUYAVWROOZJJ-UHFFFAOYSA-N 1 1 355.369 2.692 20 5 FFBDMO Cc1ccc(NCCNC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[nH+]c1 ZINC001472010447 1064889956 /nfs/dbraw/zinc/88/99/56/1064889956.db2.gz DHBZYEREQYCFTP-UHFFFAOYSA-N 1 1 358.398 2.604 20 5 FFBDMO C[C@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C1CCCC1 ZINC001473798676 1065367506 /nfs/dbraw/zinc/36/75/06/1065367506.db2.gz VNMVBOCOEQPSBI-HNNXBMFYSA-N 1 1 360.458 2.506 20 5 FFBDMO C[C@H]1CN(c2cc[nH+]cc2)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001473809317 1065373352 /nfs/dbraw/zinc/37/33/52/1065373352.db2.gz NKLWZUCCRGKRRU-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO C[C@@H]([NH3+])c1nc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC001576177464 1078202122 /nfs/dbraw/zinc/20/21/22/1078202122.db2.gz UAVXYZTZNKPSPQ-MRVPVSSYSA-N 1 1 354.819 2.697 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC001474833838 1065620756 /nfs/dbraw/zinc/62/07/56/1065620756.db2.gz BNEJYJWYZVYDDX-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[N@H+]1C[C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001558525073 1076024808 /nfs/dbraw/zinc/02/48/08/1076024808.db2.gz GHTGNKLQQFKIGY-HNNXBMFYSA-N 1 1 367.471 2.785 20 5 FFBDMO CN(CCn1ccc([N+](=O)[O-])n1)C[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC001560090816 1076225402 /nfs/dbraw/zinc/22/54/02/1076225402.db2.gz MOUBJGVCXDEQMX-GOSISDBHSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)C[C@H]1CCCCN1Cc1ccccc1 ZINC001560090816 1076225404 /nfs/dbraw/zinc/22/54/04/1076225404.db2.gz MOUBJGVCXDEQMX-GOSISDBHSA-N 1 1 357.458 2.778 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@H]1CCCCN1Cc1ccccc1 ZINC001560090816 1076225407 /nfs/dbraw/zinc/22/54/07/1076225407.db2.gz MOUBJGVCXDEQMX-GOSISDBHSA-N 1 1 357.458 2.778 20 5 FFBDMO CC[N@@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC001560638778 1076287105 /nfs/dbraw/zinc/28/71/05/1076287105.db2.gz MRFMONTUULZDPC-AWEZNQCLSA-N 1 1 374.393 2.971 20 5 FFBDMO CC[N@H+](Cc1ccc(O)c(OC)c1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC001560638778 1076287107 /nfs/dbraw/zinc/28/71/07/1076287107.db2.gz MRFMONTUULZDPC-AWEZNQCLSA-N 1 1 374.393 2.971 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C2CCOCC2)n1 ZINC001560825321 1076303092 /nfs/dbraw/zinc/30/30/92/1076303092.db2.gz JBTNCXSWYJCDPM-UHFFFAOYSA-N 1 1 358.442 2.897 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC001568903677 1077117625 /nfs/dbraw/zinc/11/76/25/1077117625.db2.gz DIVFHBAJDOYNSU-UHFFFAOYSA-N 1 1 368.437 2.740 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC12CCCCC2 ZINC001569328619 1077139606 /nfs/dbraw/zinc/13/96/06/1077139606.db2.gz RKJXJJVOCXGQKJ-UHFFFAOYSA-N 1 1 362.386 2.594 20 5 FFBDMO CCOc1cc(NC(=O)c2ccn(-c3cc[nH+]cc3)n2)ccc1[N+](=O)[O-] ZINC001585927014 1079515209 /nfs/dbraw/zinc/51/52/09/1079515209.db2.gz QVAGKXHRWYWHBH-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO C[C@H](Cc1cccs1)[N@@H+](C)Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001589902498 1080851920 /nfs/dbraw/zinc/85/19/20/1080851920.db2.gz GLOABVVTFJAUTK-LLVKDONJSA-N 1 1 358.427 2.899 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(-c2nn[nH]n2)c1 ZINC001589969607 1080911018 /nfs/dbraw/zinc/91/10/18/1080911018.db2.gz GXDKPLUFZGISMM-SNVBAGLBSA-N 1 1 369.341 2.534 20 5 FFBDMO C[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000409637443 512113750 /nfs/dbraw/zinc/11/37/50/512113750.db2.gz HKBGBUZANYLXHH-HNNXBMFYSA-N 1 1 368.437 2.570 20 5 FFBDMO C[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000409637443 512113755 /nfs/dbraw/zinc/11/37/55/512113755.db2.gz HKBGBUZANYLXHH-HNNXBMFYSA-N 1 1 368.437 2.570 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cc1[N+](=O)[O-] ZINC000103466711 250151319 /nfs/dbraw/zinc/15/13/19/250151319.db2.gz WYEMHWLDLYYJPL-AWEZNQCLSA-N 1 1 357.414 2.521 20 5 FFBDMO CC[N@H+]1CCCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000104951405 250191725 /nfs/dbraw/zinc/19/17/25/250191725.db2.gz KKVCGYDFTHAOSD-UHFFFAOYSA-N 1 1 359.373 2.732 20 5 FFBDMO Cn1cc(CNCC[N@@H+](C)C2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000105497434 250214238 /nfs/dbraw/zinc/21/42/38/250214238.db2.gz PDLHCBYPLCGVOI-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO CN(CC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000105497434 250214240 /nfs/dbraw/zinc/21/42/40/250214240.db2.gz PDLHCBYPLCGVOI-UHFFFAOYSA-N 1 1 357.458 2.959 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[NH+](CCOC(C)C)CC1 ZINC000120036410 250538596 /nfs/dbraw/zinc/53/85/96/250538596.db2.gz UIKLPIOQMQONHS-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])c1 ZINC000173562696 251208233 /nfs/dbraw/zinc/20/82/33/251208233.db2.gz WSUIVFRVDDHVLO-CYBMUJFWSA-N 1 1 362.386 2.553 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186822040 251270786 /nfs/dbraw/zinc/27/07/86/251270786.db2.gz VTUXEYGUZITVAG-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCSC2(CCOCC2)C1 ZINC000186822040 251270789 /nfs/dbraw/zinc/27/07/89/251270789.db2.gz VTUXEYGUZITVAG-CYBMUJFWSA-N 1 1 365.455 2.520 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](N2CCCCC2)C1 ZINC000264602702 251321486 /nfs/dbraw/zinc/32/14/86/251321486.db2.gz NUFYBAPOCBCDPJ-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](N2CCCCC2)C1 ZINC000264602702 251321488 /nfs/dbraw/zinc/32/14/88/251321488.db2.gz NUFYBAPOCBCDPJ-KRWDZBQOSA-N 1 1 360.458 2.792 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000267393899 251343904 /nfs/dbraw/zinc/34/39/04/251343904.db2.gz DQQGAAWRIWKCNK-GFCCVEGCSA-N 1 1 364.398 2.625 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000267393899 251343908 /nfs/dbraw/zinc/34/39/08/251343908.db2.gz DQQGAAWRIWKCNK-GFCCVEGCSA-N 1 1 364.398 2.625 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270801228 251632204 /nfs/dbraw/zinc/63/22/04/251632204.db2.gz MACWWXIRTDQYHH-MSOLQXFVSA-N 1 1 358.442 2.896 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000272637982 252087596 /nfs/dbraw/zinc/08/75/96/252087596.db2.gz XXZFFXKZMQFLEP-SJLPKXTDSA-N 1 1 360.458 2.653 20 5 FFBDMO C[C@H](NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1)C1=CC[N@@H+](C)CC1 ZINC000272954833 252174319 /nfs/dbraw/zinc/17/43/19/252174319.db2.gz MZCLSNAQFXWKIW-AWEZNQCLSA-N 1 1 358.442 2.919 20 5 FFBDMO COCC[C@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1ccco1 ZINC000273237467 252261779 /nfs/dbraw/zinc/26/17/79/252261779.db2.gz GYQIDHUERQIKLS-AWEZNQCLSA-N 1 1 363.370 2.502 20 5 FFBDMO CCc1ccc([C@@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000273423847 252304014 /nfs/dbraw/zinc/30/40/14/252304014.db2.gz JTLPQUMMJFFXMA-GFCCVEGCSA-N 1 1 352.412 2.875 20 5 FFBDMO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354375 256092519 /nfs/dbraw/zinc/09/25/19/256092519.db2.gz UXUBZKUKVUXJBM-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354375 256092520 /nfs/dbraw/zinc/09/25/20/256092520.db2.gz UXUBZKUKVUXJBM-STQMWFEESA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000277439609 256198273 /nfs/dbraw/zinc/19/82/73/256198273.db2.gz LEWWFRHGLORLHK-HNNXBMFYSA-N 1 1 364.446 2.834 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000277615575 256217931 /nfs/dbraw/zinc/21/79/31/256217931.db2.gz QJNXZEXHPGOQDY-KBPBESRZSA-N 1 1 361.442 2.986 20 5 FFBDMO COc1cc(C(=O)N2CCC(Oc3cc[nH+]cc3C)CC2)ccc1[N+](=O)[O-] ZINC000278128632 256279530 /nfs/dbraw/zinc/27/95/30/256279530.db2.gz RHDVYZRQYDQZNK-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO CCOc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278108 257029098 /nfs/dbraw/zinc/02/90/98/257029098.db2.gz BQJNSIFOAPUCIZ-CHWSQXEVSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)ccc1[N+](=O)[O-] ZINC000286278108 257029099 /nfs/dbraw/zinc/02/90/99/257029099.db2.gz BQJNSIFOAPUCIZ-CHWSQXEVSA-N 1 1 362.348 2.986 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000286464132 257038555 /nfs/dbraw/zinc/03/85/55/257038555.db2.gz KOGDAEPTCDDXNP-XBRIKIQZSA-N 1 1 359.426 2.587 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCC(F)(F)CC1 ZINC000287033263 257068087 /nfs/dbraw/zinc/06/80/87/257068087.db2.gz SIPRRGHEBQFFCP-UHFFFAOYSA-N 1 1 353.369 2.994 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000289361359 257276642 /nfs/dbraw/zinc/27/66/42/257276642.db2.gz IUZROJNCUNGLLD-LBPRGKRZSA-N 1 1 362.817 2.974 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)CO)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000289379032 257277862 /nfs/dbraw/zinc/27/78/62/257277862.db2.gz CDAFRQKZCITAFZ-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289267227 257270635 /nfs/dbraw/zinc/27/06/35/257270635.db2.gz DPLLVJQHAWRFNC-KRWDZBQOSA-N 1 1 355.394 2.519 20 5 FFBDMO O=C(C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])NCC(F)(F)F ZINC000290888775 257362744 /nfs/dbraw/zinc/36/27/44/257362744.db2.gz MTPVPKUGVSPWGQ-UHFFFAOYSA-N 1 1 360.119 2.670 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)n1 ZINC000302071617 258086082 /nfs/dbraw/zinc/08/60/82/258086082.db2.gz YQSNDXUQMVIWTK-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO Cc1cc(NC[C@@H](O)C[NH+]2CCC(C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302185621 258093804 /nfs/dbraw/zinc/09/38/04/258093804.db2.gz PGMMYRSDXRAROO-MRXNPFEDSA-N 1 1 358.442 2.956 20 5 FFBDMO CN(C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000302414519 258101083 /nfs/dbraw/zinc/10/10/83/258101083.db2.gz HMDQPHGQXKZRBI-LJQANCHMSA-N 1 1 359.401 2.807 20 5 FFBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000302807281 258111538 /nfs/dbraw/zinc/11/15/38/258111538.db2.gz XPHATIFDRDJEAU-ZDUSSCGKSA-N 1 1 370.388 2.660 20 5 FFBDMO Cc1nn(C)c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)c1[N+](=O)[O-] ZINC000312058466 258115446 /nfs/dbraw/zinc/11/54/46/258115446.db2.gz GSQSCKPGJXWNCR-IAGOWNOFSA-N 1 1 355.442 2.595 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2ncc([N+](=O)[O-])cc2Br)C[C@H](C)O1 ZINC000301546421 258055240 /nfs/dbraw/zinc/05/52/40/258055240.db2.gz POWBXXJKTDVMHO-PHIMTYICSA-N 1 1 373.251 2.664 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2Br)C1 ZINC000301579610 258057343 /nfs/dbraw/zinc/05/73/43/258057343.db2.gz ZZLWLVBFGWIDQW-LBPRGKRZSA-N 1 1 373.251 2.521 20 5 FFBDMO C[C@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1Cc1ccccc1 ZINC000301967027 258078925 /nfs/dbraw/zinc/07/89/25/258078925.db2.gz KZJZEXOPBYHILA-HNNXBMFYSA-N 1 1 366.425 2.738 20 5 FFBDMO C[C@H]1C[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1Cc1ccccc1 ZINC000301975104 258079769 /nfs/dbraw/zinc/07/97/69/258079769.db2.gz VRNZXIZBMRZTPX-ZFWWWQNUSA-N 1 1 352.398 2.712 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000330554593 258165479 /nfs/dbraw/zinc/16/54/79/258165479.db2.gz GIDZHFJTJWHNGW-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330585611 258166117 /nfs/dbraw/zinc/16/61/17/258166117.db2.gz LJAPIOUJKGVGSN-GHMZBOCLSA-N 1 1 359.373 2.729 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000330918335 258173571 /nfs/dbraw/zinc/17/35/71/258173571.db2.gz MZROBBOGGSGYMI-SFHVURJKSA-N 1 1 361.442 2.839 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270754 258181015 /nfs/dbraw/zinc/18/10/15/258181015.db2.gz AROXMDPIOYREAL-JTNHKYCSSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270754 258181016 /nfs/dbraw/zinc/18/10/16/258181016.db2.gz AROXMDPIOYREAL-JTNHKYCSSA-N 1 1 355.822 2.668 20 5 FFBDMO O=C(Cc1ccccc1)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000052780626 506249900 /nfs/dbraw/zinc/24/99/00/506249900.db2.gz ZXYGBZJQKNKJMG-UHFFFAOYSA-N 1 1 353.422 2.524 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCC[C@H](C)C1 ZINC000053160503 506324032 /nfs/dbraw/zinc/32/40/32/506324032.db2.gz JAHANGZZVCXIMP-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000053698819 506433794 /nfs/dbraw/zinc/43/37/94/506433794.db2.gz SVROPQDVIKZSNF-CQSZACIVSA-N 1 1 369.487 2.525 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000041319102 506505874 /nfs/dbraw/zinc/50/58/74/506505874.db2.gz CRSIKXFACQZWIC-UHFFFAOYSA-N 1 1 362.474 2.658 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000066834006 506656942 /nfs/dbraw/zinc/65/69/42/506656942.db2.gz SBVFGBCLZYGEEF-JTQLQIEISA-N 1 1 374.340 2.590 20 5 FFBDMO COC(=O)[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000066834006 506656945 /nfs/dbraw/zinc/65/69/45/506656945.db2.gz SBVFGBCLZYGEEF-JTQLQIEISA-N 1 1 374.340 2.590 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043147310 506708881 /nfs/dbraw/zinc/70/88/81/506708881.db2.gz RCHCGGHGEPEBAE-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043147310 506708886 /nfs/dbraw/zinc/70/88/86/506708886.db2.gz RCHCGGHGEPEBAE-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000043342986 506734954 /nfs/dbraw/zinc/73/49/54/506734954.db2.gz MWDVDGIAWXVIPT-ZDUSSCGKSA-N 1 1 370.837 2.727 20 5 FFBDMO CN1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)Cc2ccccc21 ZINC000067380569 506852900 /nfs/dbraw/zinc/85/29/00/506852900.db2.gz BAHPUHPOJNKGMD-LJQANCHMSA-N 1 1 366.421 2.652 20 5 FFBDMO CN1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)Cc2ccccc21 ZINC000067380569 506852905 /nfs/dbraw/zinc/85/29/05/506852905.db2.gz BAHPUHPOJNKGMD-LJQANCHMSA-N 1 1 366.421 2.652 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067794550 507011495 /nfs/dbraw/zinc/01/14/95/507011495.db2.gz BQCZJLFPCJYPPR-GOSISDBHSA-N 1 1 369.421 2.661 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067794550 507011501 /nfs/dbraw/zinc/01/15/01/507011501.db2.gz BQCZJLFPCJYPPR-GOSISDBHSA-N 1 1 369.421 2.661 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000045948325 507050848 /nfs/dbraw/zinc/05/08/48/507050848.db2.gz OSDWFBGASOZICW-OLZOCXBDSA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@@H](CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000068195859 507144229 /nfs/dbraw/zinc/14/42/29/507144229.db2.gz VDDVPDOWMFPUOC-QWRGUYRKSA-N 1 1 355.822 2.614 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000018769859 507151357 /nfs/dbraw/zinc/15/13/57/507151357.db2.gz BZXUMWVMTNVHQU-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](CCOc2ccc(Cl)cc2)CC1 ZINC000018899074 507151939 /nfs/dbraw/zinc/15/19/39/507151939.db2.gz MCSPXAXAHGJLRV-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000068433612 507230583 /nfs/dbraw/zinc/23/05/83/507230583.db2.gz YXLKROGOCMQYOV-CYBMUJFWSA-N 1 1 355.398 2.507 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822306 507268331 /nfs/dbraw/zinc/26/83/31/507268331.db2.gz VZQZUJHQTLYBMQ-INIZCTEOSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000047145528 507272821 /nfs/dbraw/zinc/27/28/21/507272821.db2.gz HUFIMNVYTOMTLD-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000069008913 507380546 /nfs/dbraw/zinc/38/05/46/507380546.db2.gz UGDSAINCVHMBLW-CQSZACIVSA-N 1 1 359.430 2.744 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000069143289 507420184 /nfs/dbraw/zinc/42/01/84/507420184.db2.gz IATKUDAOPCSLDR-MRXNPFEDSA-N 1 1 374.485 2.659 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000059850242 507504788 /nfs/dbraw/zinc/50/47/88/507504788.db2.gz ZGWIQHGHSIMCLL-SFHVURJKSA-N 1 1 353.422 2.918 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000048397391 507517531 /nfs/dbraw/zinc/51/75/31/507517531.db2.gz DKUACNYGDJLVOY-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1cn2cc(Cl)ccc2[nH+]1 ZINC000061111861 507597926 /nfs/dbraw/zinc/59/79/26/507597926.db2.gz MYHAWMFHBZCWNQ-UHFFFAOYSA-N 1 1 355.741 2.654 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccco1 ZINC000049944325 507643825 /nfs/dbraw/zinc/64/38/25/507643825.db2.gz JZMGEYSYWUPOOJ-QGZVFWFLSA-N 1 1 372.425 2.821 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000063490262 507739030 /nfs/dbraw/zinc/73/90/30/507739030.db2.gz BPUOKUSJDITXCG-HNNXBMFYSA-N 1 1 360.458 2.655 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051341658 507762766 /nfs/dbraw/zinc/76/27/66/507762766.db2.gz GXZDJNUYWLJJJQ-AWEZNQCLSA-N 1 1 360.439 2.932 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000052192630 507802114 /nfs/dbraw/zinc/80/21/14/507802114.db2.gz UIXAVLOIGWCZDA-UHFFFAOYSA-N 1 1 371.441 2.766 20 5 FFBDMO COc1c(C)cnc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000072665140 507840111 /nfs/dbraw/zinc/84/01/11/507840111.db2.gz VHNAQAXHBKRSFY-AWEZNQCLSA-N 1 1 357.414 2.697 20 5 FFBDMO COc1c(C)c[nH+]c(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1C ZINC000072665140 507840115 /nfs/dbraw/zinc/84/01/15/507840115.db2.gz VHNAQAXHBKRSFY-AWEZNQCLSA-N 1 1 357.414 2.697 20 5 FFBDMO CN(C(=O)C[N@H+](C)[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000072772682 507851460 /nfs/dbraw/zinc/85/14/60/507851460.db2.gz QNRSYICVJHEMIT-GOSISDBHSA-N 1 1 357.410 2.613 20 5 FFBDMO CN(C(=O)C[N@@H+](C)[C@H](CCO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000072772682 507851462 /nfs/dbraw/zinc/85/14/62/507851462.db2.gz QNRSYICVJHEMIT-GOSISDBHSA-N 1 1 357.410 2.613 20 5 FFBDMO CCSCC[C@H](C)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000072900775 507871230 /nfs/dbraw/zinc/87/12/30/507871230.db2.gz BHCQSCLGMFUMOF-ZDUSSCGKSA-N 1 1 351.472 2.947 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000072976710 507879326 /nfs/dbraw/zinc/87/93/26/507879326.db2.gz AUMLHAJMZWKLSE-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2 ZINC000073994748 507975303 /nfs/dbraw/zinc/97/53/03/507975303.db2.gz VEYBLLVOBSLLCF-GOEBONIOSA-N 1 1 358.442 2.504 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079771252 507999897 /nfs/dbraw/zinc/99/98/97/507999897.db2.gz MMOIPWPUZUVUJQ-LLVKDONJSA-N 1 1 356.220 2.571 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C ZINC000110264323 508017092 /nfs/dbraw/zinc/01/70/92/508017092.db2.gz RTDSUUKWUZJMAZ-MRXNPFEDSA-N 1 1 369.487 2.836 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000091960396 508027375 /nfs/dbraw/zinc/02/73/75/508027375.db2.gz AJYAHHVFNQUKTA-BBRMVZONSA-N 1 1 360.414 2.892 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000091960396 508027378 /nfs/dbraw/zinc/02/73/78/508027378.db2.gz AJYAHHVFNQUKTA-BBRMVZONSA-N 1 1 360.414 2.892 20 5 FFBDMO CN(Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[N@@H+](C)C1 ZINC000092253379 508054776 /nfs/dbraw/zinc/05/47/76/508054776.db2.gz YIYDRPRMEWKNCA-OAHLLOKOSA-N 1 1 357.458 2.769 20 5 FFBDMO Cn1cc(C[N@H+](C)C[C@@H]2CCCN(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092253379 508054786 /nfs/dbraw/zinc/05/47/86/508054786.db2.gz YIYDRPRMEWKNCA-OAHLLOKOSA-N 1 1 357.458 2.769 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@@H]2CCCN(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092253379 508054788 /nfs/dbraw/zinc/05/47/88/508054788.db2.gz YIYDRPRMEWKNCA-OAHLLOKOSA-N 1 1 357.458 2.769 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000110992509 508064002 /nfs/dbraw/zinc/06/40/02/508064002.db2.gz PMGBJZIJPOYQAR-GFCCVEGCSA-N 1 1 367.471 2.930 20 5 FFBDMO C[N@@H+]1[C@@H]2CCC[C@H]1CC(NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C2 ZINC000080718547 508097911 /nfs/dbraw/zinc/09/79/11/508097911.db2.gz GEKPSCLTSHRBCZ-MQVJKMGUSA-N 1 1 372.469 2.940 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc4c3OCCCO4)C2)nc1 ZINC000093534232 508147348 /nfs/dbraw/zinc/14/73/48/508147348.db2.gz UCPVCLRMEOYINE-OAHLLOKOSA-N 1 1 370.409 2.838 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])c(CC)nn3C)CC2)cc1 ZINC000094133156 508170189 /nfs/dbraw/zinc/17/01/89/508170189.db2.gz NQTMHYGVUIMMAY-UHFFFAOYSA-N 1 1 373.457 2.612 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000081634880 508200009 /nfs/dbraw/zinc/20/00/09/508200009.db2.gz RCPXTMKWCQEBEZ-INIZCTEOSA-N 1 1 360.458 2.505 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Nc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000102845575 508287485 /nfs/dbraw/zinc/28/74/85/508287485.db2.gz BPFXFKHIUAXSER-KRWDZBQOSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Nc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000102845575 508287486 /nfs/dbraw/zinc/28/74/86/508287486.db2.gz BPFXFKHIUAXSER-KRWDZBQOSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](Nc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000102845573 508287840 /nfs/dbraw/zinc/28/78/40/508287840.db2.gz BPFXFKHIUAXSER-QGZVFWFLSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](Nc2ccccc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000102845573 508287843 /nfs/dbraw/zinc/28/78/43/508287843.db2.gz BPFXFKHIUAXSER-QGZVFWFLSA-N 1 1 366.421 2.670 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187150 508298330 /nfs/dbraw/zinc/29/83/30/508298330.db2.gz CVHYOQCKZKKPMY-ZFWWWQNUSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187150 508298331 /nfs/dbraw/zinc/29/83/31/508298331.db2.gz CVHYOQCKZKKPMY-ZFWWWQNUSA-N 1 1 355.822 2.812 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H]2[C@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460667 508317219 /nfs/dbraw/zinc/31/72/19/508317219.db2.gz CUJHIZRBXHTJSG-NVXWUHKLSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@@H]2[C@H](O)CC)c([N+](=O)[O-])c1 ZINC000114460667 508317221 /nfs/dbraw/zinc/31/72/21/508317221.db2.gz CUJHIZRBXHTJSG-NVXWUHKLSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c2c(c1)COCO2 ZINC000114467303 508318269 /nfs/dbraw/zinc/31/82/69/508318269.db2.gz OKRMKYGMTGRQCO-IBGZPJMESA-N 1 1 370.405 2.943 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+](CCO)[C@H]2CCc3ccccc32)c2c(c1)COCO2 ZINC000114467303 508318272 /nfs/dbraw/zinc/31/82/72/508318272.db2.gz OKRMKYGMTGRQCO-IBGZPJMESA-N 1 1 370.405 2.943 20 5 FFBDMO C[N@H+]1CCCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000375553234 512391193 /nfs/dbraw/zinc/39/11/93/512391193.db2.gz NTMBLEYZLDRCFM-UHFFFAOYSA-N 1 1 357.208 2.527 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCc2ccccc21 ZINC000088605645 508378225 /nfs/dbraw/zinc/37/82/25/508378225.db2.gz DEKXCWWDGBRWBX-UHFFFAOYSA-N 1 1 351.406 2.932 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000121778971 508416992 /nfs/dbraw/zinc/41/69/92/508416992.db2.gz KNXKELPOKAIJDE-MRXNPFEDSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000121838577 508429232 /nfs/dbraw/zinc/42/92/32/508429232.db2.gz OTYMKNFDBOBNEU-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO COc1cc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000133818632 508454485 /nfs/dbraw/zinc/45/44/85/508454485.db2.gz BNRQEJGBLCKLTH-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3ccccc3[C@H]2CO)cccc1[N+](=O)[O-] ZINC000133846343 508457875 /nfs/dbraw/zinc/45/78/75/508457875.db2.gz NLXNNHQJMYFSJJ-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO O=C(NCc1ccccc1C[NH+]1CCCCCC1)c1n[nH]cc1[N+](=O)[O-] ZINC000157084408 508520555 /nfs/dbraw/zinc/52/05/55/508520555.db2.gz VCYDSJZFCMJKKJ-UHFFFAOYSA-N 1 1 357.414 2.624 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153774869 508645757 /nfs/dbraw/zinc/64/57/57/508645757.db2.gz TWUUVTZSDWJKBG-KYJSFNMBSA-N 1 1 363.458 2.645 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2OCCC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000128960833 508664821 /nfs/dbraw/zinc/66/48/21/508664821.db2.gz OWVLWDARAPYHQQ-MLGOLLRUSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1ccnc1 ZINC000136090519 508669218 /nfs/dbraw/zinc/66/92/18/508669218.db2.gz JXYLTASMCOKQSE-GUYCJALGSA-N 1 1 358.398 2.741 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1n1ccnc1 ZINC000136090519 508669219 /nfs/dbraw/zinc/66/92/19/508669219.db2.gz JXYLTASMCOKQSE-GUYCJALGSA-N 1 1 358.398 2.741 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCC(CO)CC1 ZINC000129271778 508706180 /nfs/dbraw/zinc/70/61/80/508706180.db2.gz ZSNFIYYZEOYHKO-UHFFFAOYSA-N 1 1 353.394 2.545 20 5 FFBDMO CC[N@@H+](CCO)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000158680654 508738427 /nfs/dbraw/zinc/73/84/27/508738427.db2.gz PZWIJPUOCVEBBT-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)C[N@H+]1C1CC1 ZINC000154241950 508743884 /nfs/dbraw/zinc/74/38/84/508743884.db2.gz IUVIJSUCHKKNRE-DZGCQCFKSA-N 1 1 358.442 2.894 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000124068731 508779164 /nfs/dbraw/zinc/77/91/64/508779164.db2.gz ABLFHMQMMMCBHJ-CJNGLKHVSA-N 1 1 371.441 2.550 20 5 FFBDMO Cc1c(C[N@@H+](C)CCN2C(=O)c3ccccc3C2=O)cccc1[N+](=O)[O-] ZINC000159063667 508788293 /nfs/dbraw/zinc/78/82/93/508788293.db2.gz YFKRXCDXGGPIHO-UHFFFAOYSA-N 1 1 353.378 2.631 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@@H]1CCC[N@@H+](C)C1 ZINC000159103495 508792936 /nfs/dbraw/zinc/79/29/36/508792936.db2.gz SFITXCZQJQCYBZ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H]([NH2+]C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCC1)c1ccccc1 ZINC000154505984 508797868 /nfs/dbraw/zinc/79/78/68/508797868.db2.gz MIFIOHUHFZMEML-ZDUSSCGKSA-N 1 1 357.414 2.711 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000119588304 508823877 /nfs/dbraw/zinc/82/38/77/508823877.db2.gz BWGZVRNRUNFATM-YOEHRIQHSA-N 1 1 369.421 2.854 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000119726411 508851817 /nfs/dbraw/zinc/85/18/17/508851817.db2.gz CMMQWLQEFBCYBI-AWEZNQCLSA-N 1 1 360.458 2.877 20 5 FFBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159731284 508881417 /nfs/dbraw/zinc/88/14/17/508881417.db2.gz RYLFLCDLDVSQKT-QGZVFWFLSA-N 1 1 373.409 2.611 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000150779591 508892196 /nfs/dbraw/zinc/89/21/96/508892196.db2.gz RVDGTXLWEPXHKK-ZDUSSCGKSA-N 1 1 351.422 2.903 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC000159871196 508903983 /nfs/dbraw/zinc/90/39/83/508903983.db2.gz FEHFGWSFOGTRTO-LJQANCHMSA-N 1 1 371.437 2.519 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC(=O)OC(C)(C)C ZINC000150898618 508917501 /nfs/dbraw/zinc/91/75/01/508917501.db2.gz KOXNNBIJMWFHJG-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](OCC(C)C)C2)c([N+](=O)[O-])c1 ZINC000120075626 508922610 /nfs/dbraw/zinc/92/26/10/508922610.db2.gz PBXCENYUNPKSMB-OAHLLOKOSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150925254 508923892 /nfs/dbraw/zinc/92/38/92/508923892.db2.gz WUIZCDYRMLWHAJ-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCC(=O)OC(C)(C)C ZINC000150925254 508923893 /nfs/dbraw/zinc/92/38/93/508923893.db2.gz WUIZCDYRMLWHAJ-LBPRGKRZSA-N 1 1 351.403 2.585 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1 ZINC000120183681 508945875 /nfs/dbraw/zinc/94/58/75/508945875.db2.gz ZLDTYAQPNUYWQE-OAHLLOKOSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 ZINC000120211499 508950874 /nfs/dbraw/zinc/95/08/74/508950874.db2.gz HDMYRXRQCOKPLU-UHFFFAOYSA-N 1 1 371.441 2.862 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000125256937 508956256 /nfs/dbraw/zinc/95/62/56/508956256.db2.gz FKVCWPLYQLQRDL-VQIMIIECSA-N 1 1 372.469 2.796 20 5 FFBDMO Cc1ccc(NCCCNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)[nH+]c1 ZINC000120368107 508982269 /nfs/dbraw/zinc/98/22/69/508982269.db2.gz XBSQXTZHEWEZCJ-UHFFFAOYSA-N 1 1 369.425 2.868 20 5 FFBDMO COCCOc1ccccc1C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000160432721 508985882 /nfs/dbraw/zinc/98/58/82/508985882.db2.gz GJIADFSZLUNWJT-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000121100302 509127858 /nfs/dbraw/zinc/12/78/58/509127858.db2.gz YNNUAJVMQMYHGI-UHFFFAOYSA-N 1 1 356.220 2.571 20 5 FFBDMO CCOc1ccc(NC(=O)CN2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000266777366 509188850 /nfs/dbraw/zinc/18/88/50/509188850.db2.gz UKDGHQHNXPMRGZ-UHFFFAOYSA-N 1 1 373.413 2.535 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000191831152 509200857 /nfs/dbraw/zinc/20/08/57/509200857.db2.gz QPNIVJNVDXWCPE-HUBLWGQQSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000191831152 509200862 /nfs/dbraw/zinc/20/08/62/509200862.db2.gz QPNIVJNVDXWCPE-HUBLWGQQSA-N 1 1 374.397 2.837 20 5 FFBDMO Cc1ccc(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000172749534 509210835 /nfs/dbraw/zinc/21/08/35/509210835.db2.gz MFXHJSZCUXIRCE-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO Cc1cc(NC(=O)NC[C@@H](CC(C)C)[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000195662114 509217306 /nfs/dbraw/zinc/21/73/06/509217306.db2.gz PLCBAGCFVYOEJN-MRXNPFEDSA-N 1 1 364.446 2.772 20 5 FFBDMO Cc1cc(C(=O)N[C@H](C)C2([NH+]3CCOCC3)CCCC2)cc([N+](=O)[O-])c1 ZINC000175923803 509219262 /nfs/dbraw/zinc/21/92/62/509219262.db2.gz QNRHZPRZHCCIRB-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000248279766 509267953 /nfs/dbraw/zinc/26/79/53/509267953.db2.gz URQFUOCXNHXYGA-BPQIPLTHSA-N 1 1 364.442 2.614 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248463597 509333443 /nfs/dbraw/zinc/33/34/43/509333443.db2.gz QRMLLJIYZBAMSG-GDBMZVCRSA-N 1 1 360.414 2.512 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000182657057 509354047 /nfs/dbraw/zinc/35/40/47/509354047.db2.gz OCWWPFLZWSOYFX-NSHDSACASA-N 1 1 357.863 2.798 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000179324410 509377098 /nfs/dbraw/zinc/37/70/98/509377098.db2.gz PPNUMLKENNHZSK-UHFFFAOYSA-N 1 1 369.487 2.867 20 5 FFBDMO Cc1ccc(CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@H]2CCCO2)cc1 ZINC000176271210 509413294 /nfs/dbraw/zinc/41/32/94/509413294.db2.gz WTMXWEBSEFZNSW-GOSISDBHSA-N 1 1 358.442 2.823 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)n1 ZINC000248656745 509422404 /nfs/dbraw/zinc/42/24/04/509422404.db2.gz DWSGROIMUOAKEV-HUUCEWRRSA-N 1 1 363.462 2.538 20 5 FFBDMO CN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000182870532 509468240 /nfs/dbraw/zinc/46/82/40/509468240.db2.gz LXMBCYISDPMVJI-LBPRGKRZSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1c2ccccc2-c2ccccc21 ZINC000176434614 509508531 /nfs/dbraw/zinc/50/85/31/509508531.db2.gz SMVFLHOWCSLRMI-OAHLLOKOSA-N 1 1 364.405 2.854 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000248901868 509535324 /nfs/dbraw/zinc/53/53/24/509535324.db2.gz UNMXMMYRDXQWRK-DNVCBOLYSA-N 1 1 368.437 2.915 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000189428432 509571248 /nfs/dbraw/zinc/57/12/48/509571248.db2.gz ITEMIXAXBQLOTI-LJQANCHMSA-N 1 1 371.441 2.665 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCSC[C@@H](C)C1 ZINC000249083979 509595982 /nfs/dbraw/zinc/59/59/82/509595982.db2.gz SAIYHWDWRQGPRL-NWDGAFQWSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000249083979 509595990 /nfs/dbraw/zinc/59/59/90/509595990.db2.gz SAIYHWDWRQGPRL-NWDGAFQWSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc(OCC[N@@H+](C[C@H](C)O)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000173667875 509709463 /nfs/dbraw/zinc/70/94/63/509709463.db2.gz DUKXOQFWXZVUCJ-AWEZNQCLSA-N 1 1 352.431 2.998 20 5 FFBDMO CNC(=O)c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192958421 509714705 /nfs/dbraw/zinc/71/47/05/509714705.db2.gz ABOFEYSWFLETRX-MRXNPFEDSA-N 1 1 368.437 2.888 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180139795 509773327 /nfs/dbraw/zinc/77/33/27/509773327.db2.gz AXLFVZDXEIDHHF-KXBFYZLASA-N 1 1 355.394 2.535 20 5 FFBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)CCN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000186582745 509784259 /nfs/dbraw/zinc/78/42/59/509784259.db2.gz GTDPFUTXZYAOTC-HZPDHXFCSA-N 1 1 364.490 2.670 20 5 FFBDMO NC(=O)[C@@H](c1ccccc1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000173799449 509785383 /nfs/dbraw/zinc/78/53/83/509785383.db2.gz RCCFPISMTRVHJK-GOSISDBHSA-N 1 1 355.394 2.665 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[NH+](C3CCC3)CC2)cc1SC ZINC000265003465 509818075 /nfs/dbraw/zinc/81/80/75/509818075.db2.gz SXGYGRXUDMYQRB-UHFFFAOYSA-N 1 1 365.455 2.636 20 5 FFBDMO COc1cc(C[N@@H+](CC(C)(C)O)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000189991844 509870866 /nfs/dbraw/zinc/87/08/66/509870866.db2.gz KLCSPNNXSVKERX-UHFFFAOYSA-N 1 1 360.357 2.940 20 5 FFBDMO O=C(C[NH2+]C1(c2nccs2)CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000177169619 509915922 /nfs/dbraw/zinc/91/59/22/509915922.db2.gz VRJLSXVNSNXFJX-UHFFFAOYSA-N 1 1 372.450 3.000 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000245439944 509936902 /nfs/dbraw/zinc/93/69/02/509936902.db2.gz UAPKAZZVTKUAJJ-SWLSCSKDSA-N 1 1 368.865 2.849 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000180571851 509992226 /nfs/dbraw/zinc/99/22/26/509992226.db2.gz IIQOVIONKJONOW-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000174344538 510069148 /nfs/dbraw/zinc/06/91/48/510069148.db2.gz JPBTZHVVUBAOGU-HZPDHXFCSA-N 1 1 363.461 2.915 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000174344538 510069157 /nfs/dbraw/zinc/06/91/57/510069157.db2.gz JPBTZHVVUBAOGU-HZPDHXFCSA-N 1 1 363.461 2.915 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000245687233 510086228 /nfs/dbraw/zinc/08/62/28/510086228.db2.gz AJYAHHVFNQUKTA-CZUORRHYSA-N 1 1 360.414 2.892 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000245687233 510086233 /nfs/dbraw/zinc/08/62/33/510086233.db2.gz AJYAHHVFNQUKTA-CZUORRHYSA-N 1 1 360.414 2.892 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000261933981 510121448 /nfs/dbraw/zinc/12/14/48/510121448.db2.gz JVYVFXKJUHUFQC-INIZCTEOSA-N 1 1 360.801 2.738 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000184099122 510129489 /nfs/dbraw/zinc/12/94/89/510129489.db2.gz QTKYJXPBSJCIGC-CQSZACIVSA-N 1 1 366.805 2.943 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184224289 510203764 /nfs/dbraw/zinc/20/37/64/510203764.db2.gz RBDGOGNEZSQWGO-UHFFFAOYSA-N 1 1 367.421 2.871 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000171624084 510259731 /nfs/dbraw/zinc/25/97/31/510259731.db2.gz IUFXJQMITGXZMN-CYBMUJFWSA-N 1 1 357.414 2.521 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000265988688 510343440 /nfs/dbraw/zinc/34/34/40/510343440.db2.gz MEVOYOHEZCVRPE-UHFFFAOYSA-N 1 1 363.458 2.536 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000266009077 510356154 /nfs/dbraw/zinc/35/61/54/510356154.db2.gz RZTUZWHSDQDPKR-XHDPSFHLSA-N 1 1 364.402 2.614 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCc1ccncc1 ZINC000181446626 510412587 /nfs/dbraw/zinc/41/25/87/510412587.db2.gz IOGKKZAQLPCYCQ-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000184620850 510421811 /nfs/dbraw/zinc/42/18/11/510421811.db2.gz LQRPUEUYLDOCMF-CQSZACIVSA-N 1 1 354.838 2.922 20 5 FFBDMO CCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](CC)C2)c1[N+](=O)[O-] ZINC000171873166 510423570 /nfs/dbraw/zinc/42/35/70/510423570.db2.gz PPZJULSRLGODQD-LBPRGKRZSA-N 1 1 351.451 2.511 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCc1ccncc1 ZINC000181494472 510437936 /nfs/dbraw/zinc/43/79/36/510437936.db2.gz QEGMWUSLVLZBQZ-UHFFFAOYSA-N 1 1 358.398 2.502 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000181637546 510514931 /nfs/dbraw/zinc/51/49/31/510514931.db2.gz KMYNKVWDHHODII-ZIAGYGMSSA-N 1 1 361.442 2.986 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)C2 ZINC000175202498 510528864 /nfs/dbraw/zinc/52/88/64/510528864.db2.gz QYWPXYXPGNQJMG-FUHWJXTLSA-N 1 1 360.458 2.796 20 5 FFBDMO O=C(CC[N@H+](CCO)Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000181681067 510536952 /nfs/dbraw/zinc/53/69/52/510536952.db2.gz KAKMEYXNBYTKEW-UHFFFAOYSA-N 1 1 361.373 2.557 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000178305483 510538446 /nfs/dbraw/zinc/53/84/46/510538446.db2.gz KKONSIGWXLQXNU-UHFFFAOYSA-N 1 1 361.442 2.588 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1cccnc1 ZINC000191235306 510560368 /nfs/dbraw/zinc/56/03/68/510560368.db2.gz SJCGAQQJCHFMOM-UHFFFAOYSA-N 1 1 372.425 2.775 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1C ZINC000181746129 510571626 /nfs/dbraw/zinc/57/16/26/510571626.db2.gz JXVVNJZWVUODJO-MRXNPFEDSA-N 1 1 360.410 2.784 20 5 FFBDMO Cc1cc(S(=O)(=O)N2CC[NH+](C3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000178394204 510580081 /nfs/dbraw/zinc/58/00/81/510580081.db2.gz BYZOSNLJWSXFLL-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1ccc([C@@H](C)[NH2+]CC(=O)N2CC(=O)Nc3ccccc32)cc1[N+](=O)[O-] ZINC000181838455 510619775 /nfs/dbraw/zinc/61/97/75/510619775.db2.gz QMAWELPWTLUKHS-CYBMUJFWSA-N 1 1 368.393 2.539 20 5 FFBDMO CCS[C@@H]1CCCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000181871787 510634484 /nfs/dbraw/zinc/63/44/84/510634484.db2.gz ILYHZCRRLAXEQV-LSDHHAIUSA-N 1 1 354.472 2.942 20 5 FFBDMO Cc1ccc(C[N@H+](CCO)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000181968297 510683687 /nfs/dbraw/zinc/68/36/87/510683687.db2.gz KZUJINMHVNQIMR-UHFFFAOYSA-N 1 1 358.394 2.764 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000181968297 510683692 /nfs/dbraw/zinc/68/36/92/510683692.db2.gz KZUJINMHVNQIMR-UHFFFAOYSA-N 1 1 358.394 2.764 20 5 FFBDMO CN(Cc1c(F)cccc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188277587 510685578 /nfs/dbraw/zinc/68/55/78/510685578.db2.gz BMGVGYLKQCISIC-HXUWFJFHSA-N 1 1 373.428 2.803 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000246880017 510724803 /nfs/dbraw/zinc/72/48/03/510724803.db2.gz FVOMDHJWBZCQQZ-CVEARBPZSA-N 1 1 358.442 2.868 20 5 FFBDMO CN(CC[NH+]1CCN(c2ccccc2)CC1)C(=O)c1csc([N+](=O)[O-])c1 ZINC000172457702 510736003 /nfs/dbraw/zinc/73/60/03/510736003.db2.gz QNINUKPTRFPVBY-UHFFFAOYSA-N 1 1 374.466 2.551 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000182146753 510780568 /nfs/dbraw/zinc/78/05/68/510780568.db2.gz VMXLGUQQEITABK-QWRGUYRKSA-N 1 1 357.357 2.751 20 5 FFBDMO O=C(c1ccccc1)c1ccc(NCC[N@@H+]2CCCOCC2)c([N+](=O)[O-])c1 ZINC000188499883 510798508 /nfs/dbraw/zinc/79/85/08/510798508.db2.gz KQCFPJZAXPUWMY-UHFFFAOYSA-N 1 1 369.421 2.960 20 5 FFBDMO O=C(c1ccccc1)c1ccc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1 ZINC000188499883 510798509 /nfs/dbraw/zinc/79/85/09/510798509.db2.gz KQCFPJZAXPUWMY-UHFFFAOYSA-N 1 1 369.421 2.960 20 5 FFBDMO Cc1cc(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000270883630 511015589 /nfs/dbraw/zinc/01/55/89/511015589.db2.gz KKBPUFKKBBBMAQ-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282547525 511021422 /nfs/dbraw/zinc/02/14/22/511021422.db2.gz WSSXKMMUWFLPPD-CQSZACIVSA-N 1 1 359.430 2.874 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282547525 511021425 /nfs/dbraw/zinc/02/14/25/511021425.db2.gz WSSXKMMUWFLPPD-CQSZACIVSA-N 1 1 359.430 2.874 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279313145 511041755 /nfs/dbraw/zinc/04/17/55/511041755.db2.gz OPCMKOMCYNLNJT-XPTSAGLGSA-N 1 1 355.797 2.529 20 5 FFBDMO COCC1(O)CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000271163720 511104800 /nfs/dbraw/zinc/10/48/00/511104800.db2.gz FBMQWANCMYYVDP-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@H]4CCc5[nH+]ccn5C4)n3)c2c1 ZINC000364892217 511137237 /nfs/dbraw/zinc/13/72/37/511137237.db2.gz FRYXCSKHUYGFQF-NSHDSACASA-N 1 1 364.365 2.976 20 5 FFBDMO CC(C)(C)[NH+]1CCC(Nc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000271297570 511154296 /nfs/dbraw/zinc/15/42/96/511154296.db2.gz QGBVCDNQJAQROJ-UHFFFAOYSA-N 1 1 361.489 2.735 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])s1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279704918 511183365 /nfs/dbraw/zinc/18/33/65/511183365.db2.gz PGEVDWFXRQXGDY-GASCZTMLSA-N 1 1 357.435 2.860 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N[C@H](C)CCN1CC[NH+](C)CC1 ZINC000294836998 511194764 /nfs/dbraw/zinc/19/47/64/511194764.db2.gz AZMHLXFMAQOKKI-CQSZACIVSA-N 1 1 373.457 2.590 20 5 FFBDMO COc1ccccc1CNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271616969 511263518 /nfs/dbraw/zinc/26/35/18/511263518.db2.gz LXLDUYXFPDOPGR-KBPBESRZSA-N 1 1 357.410 2.959 20 5 FFBDMO C[C@H]([NH2+]Cc1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271698045 511292146 /nfs/dbraw/zinc/29/21/46/511292146.db2.gz GRBXDGLDRYHPLF-ZDUSSCGKSA-N 1 1 363.439 2.696 20 5 FFBDMO C[C@H]([NH2+]CC(=O)Nc1ccc(C(=O)N(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000271779050 511321203 /nfs/dbraw/zinc/32/12/03/511321203.db2.gz RWRNFJKZFJPPIG-ZDUSSCGKSA-N 1 1 370.409 2.586 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000298667491 511368735 /nfs/dbraw/zinc/36/87/35/511368735.db2.gz YHBKQLQPQKGCEC-RDJZCZTQSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](Cc2cnn(C)c2)C1 ZINC000363135516 511375215 /nfs/dbraw/zinc/37/52/15/511375215.db2.gz VTAFPKCPRBAHJN-HNNXBMFYSA-N 1 1 371.441 2.530 20 5 FFBDMO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295387622 511386481 /nfs/dbraw/zinc/38/64/81/511386481.db2.gz RECPLVVOMDHWME-UGSOOPFHSA-N 1 1 369.425 2.684 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283511152 511395331 /nfs/dbraw/zinc/39/53/31/511395331.db2.gz PTWIGPQMXZFAEK-GFCCVEGCSA-N 1 1 352.410 2.701 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])cc1F ZINC000295417381 511398081 /nfs/dbraw/zinc/39/80/81/511398081.db2.gz DSEFHSLKLZPAKZ-QAPCUYQASA-N 1 1 373.384 2.918 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](CC(N)=O)c1ccccc1 ZINC000280293263 511410160 /nfs/dbraw/zinc/41/01/60/511410160.db2.gz FGOFPEBHJCGEST-QGZVFWFLSA-N 1 1 371.393 2.510 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](CC(N)=O)c1ccccc1 ZINC000280293263 511410162 /nfs/dbraw/zinc/41/01/62/511410162.db2.gz FGOFPEBHJCGEST-QGZVFWFLSA-N 1 1 371.393 2.510 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCOC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000292086662 511459134 /nfs/dbraw/zinc/45/91/34/511459134.db2.gz GIKQVNJZHRFDEC-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO COC(=O)CC1([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCCC1 ZINC000280449940 511469948 /nfs/dbraw/zinc/46/99/48/511469948.db2.gz NPKFPJYYNBTDHS-UHFFFAOYSA-N 1 1 360.370 2.610 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)n1 ZINC000272243973 511476733 /nfs/dbraw/zinc/47/67/33/511476733.db2.gz NZEIRLMSQXOOJH-OAHLLOKOSA-N 1 1 373.461 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)n2)cc1 ZINC000292173255 511493677 /nfs/dbraw/zinc/49/36/77/511493677.db2.gz PUJGKEIMCAWWJI-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)n2)cc1 ZINC000292173255 511493682 /nfs/dbraw/zinc/49/36/82/511493682.db2.gz PUJGKEIMCAWWJI-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)C2)C1 ZINC000296005603 511585981 /nfs/dbraw/zinc/58/59/81/511585981.db2.gz VXWIJLZTJWJEJA-IBGZPJMESA-N 1 1 369.425 2.543 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)C2)C1 ZINC000296005603 511585989 /nfs/dbraw/zinc/58/59/89/511585989.db2.gz VXWIJLZTJWJEJA-IBGZPJMESA-N 1 1 369.425 2.543 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1c[nH+]c2c1C[C@H](C)[C@H](C)C2 ZINC000296049959 511602845 /nfs/dbraw/zinc/60/28/45/511602845.db2.gz UBMOCWSCONHSMU-NEPJUHHUSA-N 1 1 358.398 2.809 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1)c1ccccc1 ZINC000281180440 511749034 /nfs/dbraw/zinc/74/90/34/511749034.db2.gz QUBBSDCGTJHGGV-QFBILLFUSA-N 1 1 369.421 2.613 20 5 FFBDMO COc1cccc(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)c1[N+](=O)[O-] ZINC000350346477 511785639 /nfs/dbraw/zinc/78/56/39/511785639.db2.gz ARINAHLAGUCPHW-SUMWQHHRSA-N 1 1 360.370 2.579 20 5 FFBDMO COC[C@@H]1CCCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000363829657 511793479 /nfs/dbraw/zinc/79/34/79/511793479.db2.gz WRYMKIACDNJEHK-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000363937945 511862230 /nfs/dbraw/zinc/86/22/30/511862230.db2.gz MBFDZUJDXOUODW-JKSUJKDBSA-N 1 1 372.469 2.942 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3cc(=O)oc4ccc5ccccc5c34)C[C@@H]21 ZINC000284797599 511873898 /nfs/dbraw/zinc/87/38/98/511873898.db2.gz OITJSTREGISUNN-OALUTQOASA-N 1 1 364.445 2.851 20 5 FFBDMO Cc1cc(F)c(NC(=O)N(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296756764 511884058 /nfs/dbraw/zinc/88/40/58/511884058.db2.gz OEJWEKDCFVUOKR-BETUJISGSA-N 1 1 368.409 2.615 20 5 FFBDMO Cc1cc(F)c(NC(=O)N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296756764 511884061 /nfs/dbraw/zinc/88/40/61/511884061.db2.gz OEJWEKDCFVUOKR-BETUJISGSA-N 1 1 368.409 2.615 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[N@H+](C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000296801137 511903491 /nfs/dbraw/zinc/90/34/91/511903491.db2.gz UECRVMFMPWIILU-UKRRQHHQSA-N 1 1 360.458 2.646 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000274949633 511996694 /nfs/dbraw/zinc/99/66/94/511996694.db2.gz SDDNPIRBQAGSCM-IEBWSBKVSA-N 1 1 366.421 2.611 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000293525669 511997798 /nfs/dbraw/zinc/99/77/98/511997798.db2.gz WKOLZZZJTVAOJU-GRYCIOLGSA-N 1 1 354.838 2.600 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000411057056 512453754 /nfs/dbraw/zinc/45/37/54/512453754.db2.gz JKTBNSZKYCACHF-GFCCVEGCSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000411057056 512453757 /nfs/dbraw/zinc/45/37/57/512453757.db2.gz JKTBNSZKYCACHF-GFCCVEGCSA-N 1 1 370.247 2.914 20 5 FFBDMO CCOc1cc(C(=O)N2CC[N@H+](CC)C[C@H]2CC)c([N+](=O)[O-])cc1OC ZINC000411063097 512455847 /nfs/dbraw/zinc/45/58/47/512455847.db2.gz SHCZEXDPYRGXKW-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO CCOc1cc(C(=O)N2CC[N@@H+](CC)C[C@H]2CC)c([N+](=O)[O-])cc1OC ZINC000411063097 512455851 /nfs/dbraw/zinc/45/58/51/512455851.db2.gz SHCZEXDPYRGXKW-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO Cn1nccc1[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000375766284 512495139 /nfs/dbraw/zinc/49/51/39/512495139.db2.gz ULOQGYJFJFKHSK-CYBMUJFWSA-N 1 1 358.398 2.574 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1 ZINC000373942515 512584082 /nfs/dbraw/zinc/58/40/82/512584082.db2.gz HBGFQVZRSKPCQY-HOTGVXAUSA-N 1 1 361.442 2.615 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(c3cn[nH]c3)CC2)c([N+](=O)[O-])c1 ZINC000373992434 512609973 /nfs/dbraw/zinc/60/99/73/512609973.db2.gz LSXMTSLVJSVLFY-GFCCVEGCSA-N 1 1 373.413 2.533 20 5 FFBDMO Cc1nc2ccccc2n1C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC000370040243 512738638 /nfs/dbraw/zinc/73/86/38/512738638.db2.gz IWTUPNSTFPEKFZ-UHFFFAOYSA-N 1 1 354.414 2.824 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000368071225 512789530 /nfs/dbraw/zinc/78/95/30/512789530.db2.gz TVGZBLYBHYOHIK-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO CC(C)[C@]1(CO)CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000368071225 512789534 /nfs/dbraw/zinc/78/95/34/512789534.db2.gz TVGZBLYBHYOHIK-MRXNPFEDSA-N 1 1 355.822 2.527 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])c1 ZINC000372272178 512791153 /nfs/dbraw/zinc/79/11/53/512791153.db2.gz GDLQHJOTEKFODF-HXUWFJFHSA-N 1 1 367.405 2.715 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000411988809 512903518 /nfs/dbraw/zinc/90/35/18/512903518.db2.gz WIXXGFJTYITESR-JKSUJKDBSA-N 1 1 359.813 2.949 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000368446079 512952322 /nfs/dbraw/zinc/95/23/22/512952322.db2.gz SPJJJDWQQMRIQQ-ROUUACIJSA-N 1 1 369.469 2.815 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408001220 512981453 /nfs/dbraw/zinc/98/14/53/512981453.db2.gz OAIWXKNJHFIJJJ-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000412193638 512992636 /nfs/dbraw/zinc/99/26/36/512992636.db2.gz MMRLKUNHDYGKBI-ZWKOTPCHSA-N 1 1 366.421 2.751 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H]4CC[N@@H+](C)[C@@H]4C3)cc2[N+](=O)[O-])C1 ZINC000408461376 513070913 /nfs/dbraw/zinc/07/09/13/513070913.db2.gz AEHREJFHPHIYNI-SIXWZSSISA-N 1 1 372.469 2.607 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007861 513250055 /nfs/dbraw/zinc/25/00/55/513250055.db2.gz WLHRVSOBMCJBBC-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@@H]1N1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007861 513250060 /nfs/dbraw/zinc/25/00/60/513250060.db2.gz WLHRVSOBMCJBBC-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@@H]1N1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007861 513250064 /nfs/dbraw/zinc/25/00/64/513250064.db2.gz WLHRVSOBMCJBBC-RKVPGOIHSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429040833 513264762 /nfs/dbraw/zinc/26/47/62/513264762.db2.gz NGGQSHMYLVKPGJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429040833 513264772 /nfs/dbraw/zinc/26/47/72/513264772.db2.gz NGGQSHMYLVKPGJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429040833 513264778 /nfs/dbraw/zinc/26/47/78/513264778.db2.gz NGGQSHMYLVKPGJ-URLQWDBASA-N 1 1 374.485 2.894 20 5 FFBDMO COC(=O)c1cc(NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc(C)c1[N+](=O)[O-] ZINC000440714260 513391084 /nfs/dbraw/zinc/39/10/84/513391084.db2.gz DMWXUSCORUHTFX-OKILXGFUSA-N 1 1 365.430 2.601 20 5 FFBDMO CC(C)[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[NH+]1CCOCC1 ZINC000413046291 513405670 /nfs/dbraw/zinc/40/56/70/513405670.db2.gz RYHUSRFZXNHFOC-ZDUSSCGKSA-N 1 1 362.352 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@]2([NH+]3CCOCC3)CCSC2)c2cccnc21 ZINC000413063613 513418235 /nfs/dbraw/zinc/41/82/35/513418235.db2.gz AVGKHOQQDFZMHV-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CNC(=O)C4)C3)o2)c([N+](=O)[O-])c1 ZINC000435048431 513498200 /nfs/dbraw/zinc/49/82/00/513498200.db2.gz AMLSOBYTJFPOSE-LJQANCHMSA-N 1 1 371.393 2.575 20 5 FFBDMO C[NH2+]CC1CCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])CC1 ZINC000435391630 513574069 /nfs/dbraw/zinc/57/40/69/513574069.db2.gz XNZBWOUCVRQMDQ-UHFFFAOYSA-N 1 1 373.400 2.679 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCn2cc[nH+]c2C1 ZINC000447810701 513576307 /nfs/dbraw/zinc/57/63/07/513576307.db2.gz AIFICMIYOLTYHD-SECBINFHSA-N 1 1 350.762 2.658 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1 ZINC000430211262 513588868 /nfs/dbraw/zinc/58/88/68/513588868.db2.gz XHOPTXFDWRHADD-RLFYNMQTSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1CN1C[C@H](C)O[C@@H](C)C1 ZINC000430211262 513588871 /nfs/dbraw/zinc/58/88/71/513588871.db2.gz XHOPTXFDWRHADD-RLFYNMQTSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@H]1CCC(=O)N1 ZINC000425485955 513592693 /nfs/dbraw/zinc/59/26/93/513592693.db2.gz XCIOOUXWYNEEQH-CYBMUJFWSA-N 1 1 370.247 2.846 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000447911009 513621917 /nfs/dbraw/zinc/62/19/17/513621917.db2.gz GXHTXROMRYCVLA-OAHLLOKOSA-N 1 1 350.419 2.845 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC000448005174 513655898 /nfs/dbraw/zinc/65/58/98/513655898.db2.gz SXKRKRIOGVJNDU-OAHLLOKOSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451340596 513685839 /nfs/dbraw/zinc/68/58/39/513685839.db2.gz JVXPUFXOVAKAGL-KKBFJZEXSA-N 1 1 361.442 2.937 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000451430622 513748069 /nfs/dbraw/zinc/74/80/69/513748069.db2.gz YCBHJHSWOBHVIA-QGTPRVQTSA-N 1 1 361.442 2.857 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](C2CC2)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436307773 513821970 /nfs/dbraw/zinc/82/19/70/513821970.db2.gz LHHBJUKLFRIFRT-LBPRGKRZSA-N 1 1 365.408 2.787 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436307773 513821976 /nfs/dbraw/zinc/82/19/76/513821976.db2.gz LHHBJUKLFRIFRT-LBPRGKRZSA-N 1 1 365.408 2.787 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCC[C@H](C)C1 ZINC000448706585 513857378 /nfs/dbraw/zinc/85/73/78/513857378.db2.gz ZIGMNKISNLXKOM-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426313657 513899614 /nfs/dbraw/zinc/89/96/14/513899614.db2.gz XJEOSCSUCGROSW-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000426313657 513899620 /nfs/dbraw/zinc/89/96/20/513899620.db2.gz XJEOSCSUCGROSW-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO CC(C)CN(CC[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000448908298 513963556 /nfs/dbraw/zinc/96/35/56/513963556.db2.gz FZJVWCXFKVVKNP-UHFFFAOYSA-N 1 1 359.430 2.645 20 5 FFBDMO C[C@@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000420585763 514192938 /nfs/dbraw/zinc/19/29/38/514192938.db2.gz MYTHOSYRSTWVIT-NSHDSACASA-N 1 1 360.439 2.614 20 5 FFBDMO C[C@@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000420586004 514193516 /nfs/dbraw/zinc/19/35/16/514193516.db2.gz NPLKXKDOERPWDM-ZDUSSCGKSA-N 1 1 354.410 2.552 20 5 FFBDMO C[C@@H]1C[C@H](Nc2c(C(N)=O)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000420602226 514197617 /nfs/dbraw/zinc/19/76/17/514197617.db2.gz OLQWAHCQYMZJKM-HIFRSBDPSA-N 1 1 354.410 2.769 20 5 FFBDMO CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000437873589 514257309 /nfs/dbraw/zinc/25/73/09/514257309.db2.gz IRVZBNKTYQKBLG-CQSZACIVSA-N 1 1 363.462 2.797 20 5 FFBDMO C[C@@H]1C[C@@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn21 ZINC000449575625 514260426 /nfs/dbraw/zinc/26/04/26/514260426.db2.gz YKFRZCHVHMFVQJ-MLGOLLRUSA-N 1 1 352.398 2.987 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCN3CCc4ccccc43)C2)nc1 ZINC000428386149 514463524 /nfs/dbraw/zinc/46/35/24/514463524.db2.gz WQJKEKUMVKUYCO-INIZCTEOSA-N 1 1 353.426 2.539 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000450018037 514466687 /nfs/dbraw/zinc/46/66/87/514466687.db2.gz QMVBILGPAQNNEZ-CYBMUJFWSA-N 1 1 365.405 2.546 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000439484837 514563183 /nfs/dbraw/zinc/56/31/83/514563183.db2.gz FTFLJRHNYIJMST-KSSFIOAISA-N 1 1 350.415 2.948 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475309826 514612391 /nfs/dbraw/zinc/61/23/91/514612391.db2.gz YQYDBOQVIQHODO-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475322270 514619936 /nfs/dbraw/zinc/61/99/36/514619936.db2.gz OKQSCELPLGVWNC-GOSISDBHSA-N 1 1 369.421 2.707 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000458209739 514631032 /nfs/dbraw/zinc/63/10/32/514631032.db2.gz KRCOJIAGIUUPBJ-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470976958 514704246 /nfs/dbraw/zinc/70/42/46/514704246.db2.gz MIZFRBOZLUOBJE-HOCLYGCPSA-N 1 1 360.458 2.586 20 5 FFBDMO COCC[C@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000502653626 514728943 /nfs/dbraw/zinc/72/89/43/514728943.db2.gz MNXCNBVTVKXZLG-JKSUJKDBSA-N 1 1 359.382 2.661 20 5 FFBDMO Cc1cc(NCC[N@@H+]2CCC[C@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489173399 514737409 /nfs/dbraw/zinc/73/74/09/514737409.db2.gz GKRWWRXAHHBGMH-AWEZNQCLSA-N 1 1 355.442 2.926 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000502713452 514749269 /nfs/dbraw/zinc/74/92/69/514749269.db2.gz XGBKJYDFFWKEPE-CQSZACIVSA-N 1 1 355.460 2.528 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231148 514761172 /nfs/dbraw/zinc/76/11/72/514761172.db2.gz IPQZPDOHUQGPPA-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231148 514761179 /nfs/dbraw/zinc/76/11/79/514761179.db2.gz IPQZPDOHUQGPPA-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO COc1cc(CN2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000489231148 514761184 /nfs/dbraw/zinc/76/11/84/514761184.db2.gz IPQZPDOHUQGPPA-UXLLHSPISA-N 1 1 363.458 2.677 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2scnc2C)cc1[N+](=O)[O-] ZINC000475701907 514767835 /nfs/dbraw/zinc/76/78/35/514767835.db2.gz MLAGBGVWLRVGOG-UHFFFAOYSA-N 1 1 365.411 2.544 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2scnc2C)cc1[N+](=O)[O-] ZINC000475701907 514767841 /nfs/dbraw/zinc/76/78/41/514767841.db2.gz MLAGBGVWLRVGOG-UHFFFAOYSA-N 1 1 365.411 2.544 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)C[C@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000471205028 514796315 /nfs/dbraw/zinc/79/63/15/514796315.db2.gz RENYPZYGFDGGJN-AWEZNQCLSA-N 1 1 373.400 2.977 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CC[C@H](C)C1 ZINC000484852102 514815454 /nfs/dbraw/zinc/81/54/54/514815454.db2.gz BBFYMDWTSMAWLC-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(CNC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)cccc1[N+](=O)[O-] ZINC000480062025 514828361 /nfs/dbraw/zinc/82/83/61/514828361.db2.gz REEPEORQARBMBH-UHFFFAOYSA-N 1 1 371.441 2.801 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000484929729 514847237 /nfs/dbraw/zinc/84/72/37/514847237.db2.gz XZZUPTUKEOZWMH-CZUORRHYSA-N 1 1 359.430 2.949 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000484929725 514847943 /nfs/dbraw/zinc/84/79/43/514847943.db2.gz XZZUPTUKEOZWMH-CJNGLKHVSA-N 1 1 359.430 2.949 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H]1CC=CCC1 ZINC000485142080 514933880 /nfs/dbraw/zinc/93/38/80/514933880.db2.gz METYKNLEEYISIE-MRXNPFEDSA-N 1 1 373.453 2.789 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000480581396 515007791 /nfs/dbraw/zinc/00/77/91/515007791.db2.gz BPVSHUCPLSRDOM-DLBZAZTESA-N 1 1 369.421 2.739 20 5 FFBDMO COCC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485410994 515029749 /nfs/dbraw/zinc/02/97/49/515029749.db2.gz USJCTZAVMFRWDZ-UHFFFAOYSA-N 1 1 362.405 2.598 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000467550445 515045266 /nfs/dbraw/zinc/04/52/66/515045266.db2.gz KKANYAXBAPSRSZ-QBUQCISBSA-N 1 1 362.426 2.900 20 5 FFBDMO CCN1CCN(c2ccc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000480731676 515062184 /nfs/dbraw/zinc/06/21/84/515062184.db2.gz QPOCWKCKKNNETQ-MRXNPFEDSA-N 1 1 369.469 2.983 20 5 FFBDMO C[C@H](CC[NH+](C)C)NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000462486882 515078215 /nfs/dbraw/zinc/07/82/15/515078215.db2.gz BMNYELPAILKPJL-MRVPVSSYSA-N 1 1 370.258 2.520 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000467710925 515088952 /nfs/dbraw/zinc/08/89/52/515088952.db2.gz OUFNTROXSZXOKS-OTYXRUKQSA-N 1 1 368.231 2.570 20 5 FFBDMO COc1ccc(C(=O)CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000509359883 515140192 /nfs/dbraw/zinc/14/01/92/515140192.db2.gz UEZJKXZRFXZRAE-OAHLLOKOSA-N 1 1 370.409 2.758 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000456382415 515143922 /nfs/dbraw/zinc/14/39/22/515143922.db2.gz OULFOKUAMUDTCN-GFCCVEGCSA-N 1 1 357.357 2.753 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000456391591 515150157 /nfs/dbraw/zinc/15/01/57/515150157.db2.gz WQQSJZKGLNCTEK-ZDUSSCGKSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000456391591 515150162 /nfs/dbraw/zinc/15/01/62/515150162.db2.gz WQQSJZKGLNCTEK-ZDUSSCGKSA-N 1 1 370.247 2.914 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H]1CCCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000485956479 515273811 /nfs/dbraw/zinc/27/38/11/515273811.db2.gz KTOAZMBMSQDMIL-HNNXBMFYSA-N 1 1 354.370 2.819 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000509649673 515273746 /nfs/dbraw/zinc/27/37/46/515273746.db2.gz FZSZOZABIQPBNM-LLVKDONJSA-N 1 1 368.231 2.632 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419502 515316203 /nfs/dbraw/zinc/31/62/03/515316203.db2.gz GDCFYXNUQKWXCG-LSDHHAIUSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419502 515316209 /nfs/dbraw/zinc/31/62/09/515316209.db2.gz GDCFYXNUQKWXCG-LSDHHAIUSA-N 1 1 356.426 2.668 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000481714296 515436494 /nfs/dbraw/zinc/43/64/94/515436494.db2.gz NQZGTSPIJBFFKK-IRXDYDNUSA-N 1 1 369.421 2.821 20 5 FFBDMO CC[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)[N@H+]1CCc2ccccc2C1 ZINC000468729510 515490529 /nfs/dbraw/zinc/49/05/29/515490529.db2.gz PGLKMYOQGGDMEO-MRXNPFEDSA-N 1 1 368.437 2.744 20 5 FFBDMO C[C@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473155602 515517651 /nfs/dbraw/zinc/51/76/51/515517651.db2.gz AZMPEDLFUVRISX-LKFCYVNXSA-N 1 1 369.830 2.960 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871922 515570975 /nfs/dbraw/zinc/57/09/75/515570975.db2.gz JYTYAIRHGOPEFE-GJZGRUSLSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871922 515570984 /nfs/dbraw/zinc/57/09/84/515570984.db2.gz JYTYAIRHGOPEFE-GJZGRUSLSA-N 1 1 366.414 2.536 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000457063574 515617702 /nfs/dbraw/zinc/61/77/02/515617702.db2.gz WHATYRYRNNCMET-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C1CC1 ZINC000457174850 515705582 /nfs/dbraw/zinc/70/55/82/515705582.db2.gz WYFGPVOHGZEPCO-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000494036223 515716932 /nfs/dbraw/zinc/71/69/32/515716932.db2.gz DEZNCQOWQQNQJD-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO CO[C@@H]1C[C@@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000459730611 515775783 /nfs/dbraw/zinc/77/57/83/515775783.db2.gz DYHFFCNYEURXOC-ZACQAIPSSA-N 1 1 356.426 2.965 20 5 FFBDMO CO[C@@H]1C[C@@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000459730608 515776691 /nfs/dbraw/zinc/77/66/91/515776691.db2.gz DYHFFCNYEURXOC-BRWVUGGUSA-N 1 1 356.426 2.965 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[C@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000459734835 515778436 /nfs/dbraw/zinc/77/84/36/515778436.db2.gz OPIITLSDFBKUCH-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[C@@H]1CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000459734836 515778467 /nfs/dbraw/zinc/77/84/67/515778467.db2.gz OPIITLSDFBKUCH-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO CO[C@@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C12CCC2 ZINC000459780957 515801059 /nfs/dbraw/zinc/80/10/59/515801059.db2.gz MCRGSLCHNPLBSM-BBWFWOEESA-N 1 1 356.426 2.965 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459802941 515816087 /nfs/dbraw/zinc/81/60/87/515816087.db2.gz NFGCFRJBYHZJIS-JEBQAFNWSA-N 1 1 361.442 2.795 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459807571 515819763 /nfs/dbraw/zinc/81/97/63/515819763.db2.gz RENCNBLVZBADBZ-DHSIGJKJSA-N 1 1 361.442 2.795 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459807571 515819769 /nfs/dbraw/zinc/81/97/69/515819769.db2.gz RENCNBLVZBADBZ-DHSIGJKJSA-N 1 1 361.442 2.795 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459806284 515820380 /nfs/dbraw/zinc/82/03/80/515820380.db2.gz MOBZCBMLKMKMDR-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@H](C)C(=O)OC(C)(C)C ZINC000459806284 515820390 /nfs/dbraw/zinc/82/03/90/515820390.db2.gz MOBZCBMLKMKMDR-ZDUSSCGKSA-N 1 1 365.430 2.751 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+]1Cc1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506475735 515892687 /nfs/dbraw/zinc/89/26/87/515892687.db2.gz YSLDHNOSCXBGMM-MRXNPFEDSA-N 1 1 355.394 2.695 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506475735 515892694 /nfs/dbraw/zinc/89/26/94/515892694.db2.gz YSLDHNOSCXBGMM-MRXNPFEDSA-N 1 1 355.394 2.695 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1 ZINC000483168860 515965186 /nfs/dbraw/zinc/96/51/86/515965186.db2.gz NHVPDLSXSDLTAS-AEFFLSMTSA-N 1 1 350.415 2.634 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000487819715 515990669 /nfs/dbraw/zinc/99/06/69/515990669.db2.gz QCAGYOWAQVDGCG-BXUZGUMPSA-N 1 1 366.849 2.715 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494899839 516003276 /nfs/dbraw/zinc/00/32/76/516003276.db2.gz FFBVJZKZMXRGBP-UHFFFAOYSA-N 1 1 362.352 2.753 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487897468 516024063 /nfs/dbraw/zinc/02/40/63/516024063.db2.gz NVSMDAMZQMEJLL-UHFFFAOYSA-N 1 1 356.854 2.822 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCC[C@@H]1C ZINC000487998524 516073026 /nfs/dbraw/zinc/07/30/26/516073026.db2.gz IGARPZFQQOKSCD-XJKSGUPXSA-N 1 1 365.430 2.679 20 5 FFBDMO CC(C)[C@@H]1CN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000488083089 516111109 /nfs/dbraw/zinc/11/11/09/516111109.db2.gz YVZUBHVWHNWPAX-LRDDRELGSA-N 1 1 368.865 2.847 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000488087552 516112906 /nfs/dbraw/zinc/11/29/06/516112906.db2.gz WUEJIHGHSWHNLO-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccc1 ZINC000488390884 516213536 /nfs/dbraw/zinc/21/35/36/516213536.db2.gz NCKFLHNXHSGLLO-ZFWWWQNUSA-N 1 1 359.430 2.813 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000488613301 516275286 /nfs/dbraw/zinc/27/52/86/516275286.db2.gz ZXPNGSMYEKABGX-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000460969075 516294233 /nfs/dbraw/zinc/29/42/33/516294233.db2.gz LPTFNYXCSCQXBG-UHFFFAOYSA-N 1 1 359.451 2.586 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[C@H]1C ZINC000497558323 516326446 /nfs/dbraw/zinc/32/64/46/516326446.db2.gz NZNYULTUHCWNQF-HUUCEWRRSA-N 1 1 360.458 2.750 20 5 FFBDMO O=C([C@H]1CCC[N@@H+](Cc2cccnc2)C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523134583 516395000 /nfs/dbraw/zinc/39/50/00/516395000.db2.gz QLVQMODVZNSQIA-INIZCTEOSA-N 1 1 366.421 2.791 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000517884965 516480185 /nfs/dbraw/zinc/48/01/85/516480185.db2.gz ZRNGAXIURLVQHX-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000540365958 516529621 /nfs/dbraw/zinc/52/96/21/516529621.db2.gz LIXONKUUXSQKGS-LBPRGKRZSA-N 1 1 373.409 2.952 20 5 FFBDMO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1c(F)cncc1F ZINC000513267540 516549335 /nfs/dbraw/zinc/54/93/35/516549335.db2.gz QPUNMTRKVIEEGU-JTQLQIEISA-N 1 1 350.325 2.947 20 5 FFBDMO C[N@@H+](CCN1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1)Cc1ccccc1 ZINC000513446028 516626690 /nfs/dbraw/zinc/62/66/90/516626690.db2.gz BMCZZCYYBUXEOX-UHFFFAOYSA-N 1 1 368.481 2.844 20 5 FFBDMO CCc1ccc([C@H](NC[C@H]2C[N@@H+](C)CCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544360839 516723158 /nfs/dbraw/zinc/72/31/58/516723158.db2.gz SDLPLYGWONDUJW-FXAWDEMLSA-N 1 1 372.469 2.675 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000540885548 516754202 /nfs/dbraw/zinc/75/42/02/516754202.db2.gz FNJBCMIPICDMGF-UHFFFAOYSA-N 1 1 354.410 2.861 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000558479373 516767376 /nfs/dbraw/zinc/76/73/76/516767376.db2.gz APGPHQDZUHGLEZ-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551796414 516874155 /nfs/dbraw/zinc/87/41/55/516874155.db2.gz ZPDRAHVXSVXHJI-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000551796414 516874163 /nfs/dbraw/zinc/87/41/63/516874163.db2.gz ZPDRAHVXSVXHJI-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000525105568 516917094 /nfs/dbraw/zinc/91/70/94/516917094.db2.gz IYQRQKQRTFHKTD-MDZLAQPJSA-N 1 1 355.822 2.614 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCCCc1ccccc1 ZINC000558739737 516921797 /nfs/dbraw/zinc/92/17/97/516921797.db2.gz TXOZJUMLBKWMQE-UHFFFAOYSA-N 1 1 355.438 2.818 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCCCc1ccccc1 ZINC000558739737 516921804 /nfs/dbraw/zinc/92/18/04/516921804.db2.gz TXOZJUMLBKWMQE-UHFFFAOYSA-N 1 1 355.438 2.818 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC000541314436 516982725 /nfs/dbraw/zinc/98/27/25/516982725.db2.gz FNWUOFVLXCSKGH-OKILXGFUSA-N 1 1 364.446 2.666 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCOCC1 ZINC000514705277 517014711 /nfs/dbraw/zinc/01/47/11/517014711.db2.gz LIDRJDQECZYSSH-QGZVFWFLSA-N 1 1 364.446 2.853 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1C[N@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454598 517045200 /nfs/dbraw/zinc/04/52/00/517045200.db2.gz JREOXJYWGZABQM-BEFAXECRSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454598 517045209 /nfs/dbraw/zinc/04/52/09/517045209.db2.gz JREOXJYWGZABQM-BEFAXECRSA-N 1 1 369.421 2.673 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000532900624 517193656 /nfs/dbraw/zinc/19/36/56/517193656.db2.gz JKDNAZAJLHQXNX-NSHDSACASA-N 1 1 370.247 2.817 20 5 FFBDMO C[C@H](CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000520264883 517324940 /nfs/dbraw/zinc/32/49/40/517324940.db2.gz BPVXPQAVXJYHPG-HUUCEWRRSA-N 1 1 364.446 2.536 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000537810959 517355124 /nfs/dbraw/zinc/35/51/24/517355124.db2.gz MMKVRHYBZGJQMQ-QWRGUYRKSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000537810959 517355134 /nfs/dbraw/zinc/35/51/34/517355134.db2.gz MMKVRHYBZGJQMQ-QWRGUYRKSA-N 1 1 370.247 2.830 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000537825510 517363580 /nfs/dbraw/zinc/36/35/80/517363580.db2.gz USPXUNHUTAEPOP-VXGBXAGGSA-N 1 1 355.822 2.568 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C[C@@H](C)OC)C(C)C ZINC000533295908 517392015 /nfs/dbraw/zinc/39/20/15/517392015.db2.gz NIADGSIRFWKSDX-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO COCC[N@@H+]1CC[C@@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000520755801 517499338 /nfs/dbraw/zinc/49/93/38/517499338.db2.gz ADWPQIAMPXXJCU-QGZVFWFLSA-N 1 1 369.421 2.958 20 5 FFBDMO COCC[N@H+]1CC[C@@H](Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC000520755801 517499343 /nfs/dbraw/zinc/49/93/43/517499343.db2.gz ADWPQIAMPXXJCU-QGZVFWFLSA-N 1 1 369.421 2.958 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000520760070 517502784 /nfs/dbraw/zinc/50/27/84/517502784.db2.gz KSYTXNIOIUORNK-GASCZTMLSA-N 1 1 371.441 2.773 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000533548345 517519899 /nfs/dbraw/zinc/51/98/99/517519899.db2.gz HXEHCHZNWUYKEL-CQSZACIVSA-N 1 1 351.472 2.769 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2CC(O)C2)cc1OC ZINC000546095203 517541160 /nfs/dbraw/zinc/54/11/60/517541160.db2.gz WIKGWICGXOCRDD-LRVUVFPRSA-N 1 1 352.431 2.983 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2CC(O)C2)cc1OC ZINC000546095203 517541166 /nfs/dbraw/zinc/54/11/66/517541166.db2.gz WIKGWICGXOCRDD-LRVUVFPRSA-N 1 1 352.431 2.983 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553458 517615481 /nfs/dbraw/zinc/61/54/81/517615481.db2.gz BDTFBUOTBGYNOP-YOEHRIQHSA-N 1 1 351.447 2.527 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2cc(O)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000549553458 517615493 /nfs/dbraw/zinc/61/54/93/517615493.db2.gz BDTFBUOTBGYNOP-YOEHRIQHSA-N 1 1 351.447 2.527 20 5 FFBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000521290156 517682714 /nfs/dbraw/zinc/68/27/14/517682714.db2.gz WYLSTOGFSTTXOC-NVXWUHKLSA-N 1 1 368.437 2.956 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)s1 ZINC000553482552 517738242 /nfs/dbraw/zinc/73/82/42/517738242.db2.gz GTEKNXXCCHYLSZ-CHWSQXEVSA-N 1 1 363.443 2.655 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H]2NC(=O)C2(C)C)CC1 ZINC000563363937 517849804 /nfs/dbraw/zinc/84/98/04/517849804.db2.gz NLWJDAYTDDEESB-KRWDZBQOSA-N 1 1 361.442 2.730 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1OCC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000534398847 517879910 /nfs/dbraw/zinc/87/99/10/517879910.db2.gz MTVMUIYVUFMPKP-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[NH+](Cc4ccsc4)CC3)nc2c1 ZINC000560620385 517936065 /nfs/dbraw/zinc/93/60/65/517936065.db2.gz DNOYXNNWQCNUJF-UHFFFAOYSA-N 1 1 357.439 2.850 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H]1Cc1ccccc1 ZINC000563556600 517982607 /nfs/dbraw/zinc/98/26/07/517982607.db2.gz BDFBUJMLROVPNU-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)C[C@@H]1Cc1ccccc1 ZINC000563556600 517982619 /nfs/dbraw/zinc/98/26/19/517982619.db2.gz BDFBUJMLROVPNU-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000522195068 518028433 /nfs/dbraw/zinc/02/84/33/518028433.db2.gz QHRYYAZPEVCTMS-AWEZNQCLSA-N 1 1 359.430 2.856 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000522195068 518028443 /nfs/dbraw/zinc/02/84/43/518028443.db2.gz QHRYYAZPEVCTMS-AWEZNQCLSA-N 1 1 359.430 2.856 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000522195068 518028449 /nfs/dbraw/zinc/02/84/49/518028449.db2.gz QHRYYAZPEVCTMS-AWEZNQCLSA-N 1 1 359.430 2.856 20 5 FFBDMO CC(C)(NC(=O)c1cc(C[NH+]2CCCC2)on1)c1ccccc1[N+](=O)[O-] ZINC000554074091 518050227 /nfs/dbraw/zinc/05/02/27/518050227.db2.gz VJNBMYZMONUJFC-UHFFFAOYSA-N 1 1 358.398 2.844 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@@H](C)C1 ZINC000557525768 518053386 /nfs/dbraw/zinc/05/33/86/518053386.db2.gz NFLLILMJUYBBHU-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@@H](C)C1 ZINC000557525768 518053399 /nfs/dbraw/zinc/05/33/99/518053399.db2.gz NFLLILMJUYBBHU-INIZCTEOSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@H](C)C1 ZINC000557525769 518054122 /nfs/dbraw/zinc/05/41/22/518054122.db2.gz NFLLILMJUYBBHU-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@H](C)C1 ZINC000557525769 518054128 /nfs/dbraw/zinc/05/41/28/518054128.db2.gz NFLLILMJUYBBHU-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000534996025 518111957 /nfs/dbraw/zinc/11/19/57/518111957.db2.gz JYIQSPWLHBDZSX-MRXNPFEDSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000534996025 518111964 /nfs/dbraw/zinc/11/19/64/518111964.db2.gz JYIQSPWLHBDZSX-MRXNPFEDSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+](CCCN1C(=O)c2ccccc2C1=O)CCc1cccc([N+](=O)[O-])c1 ZINC000517330521 518120371 /nfs/dbraw/zinc/12/03/71/518120371.db2.gz MFGZODTXTPJROC-UHFFFAOYSA-N 1 1 367.405 2.755 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000531062788 518122701 /nfs/dbraw/zinc/12/27/01/518122701.db2.gz IBDLHLXCWCBLCY-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO COc1cc(CNCC[N@H+]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000539813153 518166453 /nfs/dbraw/zinc/16/64/53/518166453.db2.gz DKXGSDDIPBSIHL-GFCCVEGCSA-N 1 1 373.400 2.679 20 5 FFBDMO COc1cc(C[NH2+]CCN2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000539813153 518166458 /nfs/dbraw/zinc/16/64/58/518166458.db2.gz DKXGSDDIPBSIHL-GFCCVEGCSA-N 1 1 373.400 2.679 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000535307918 518174036 /nfs/dbraw/zinc/17/40/36/518174036.db2.gz LBVAVFWAFQUSLP-CYBMUJFWSA-N 1 1 357.414 2.504 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000564003674 518265625 /nfs/dbraw/zinc/26/56/25/518265625.db2.gz UFEAVOLNFZVPMV-RDJZCZTQSA-N 1 1 369.421 2.753 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]21 ZINC000581479438 518306155 /nfs/dbraw/zinc/30/61/55/518306155.db2.gz ADLHUQMYTHZCRW-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000575910315 518340358 /nfs/dbraw/zinc/34/03/58/518340358.db2.gz QTOCFGDPKKUOJC-ZDUSSCGKSA-N 1 1 357.476 2.610 20 5 FFBDMO C[C@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000570591086 518682324 /nfs/dbraw/zinc/68/23/24/518682324.db2.gz DQVRRWMYTQQORM-HZPDHXFCSA-N 1 1 362.474 2.899 20 5 FFBDMO Cc1c(Cl)cccc1N1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000574025643 518951200 /nfs/dbraw/zinc/95/12/00/518951200.db2.gz MYCQSAWAPMSVMV-UHFFFAOYSA-N 1 1 363.849 2.965 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000582859445 518958101 /nfs/dbraw/zinc/95/81/01/518958101.db2.gz LPHKWEDSXWVGKW-GFCCVEGCSA-N 1 1 359.348 2.914 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000589303413 518977201 /nfs/dbraw/zinc/97/72/01/518977201.db2.gz LRJYQMDTJYVIAT-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000589303413 518977206 /nfs/dbraw/zinc/97/72/06/518977206.db2.gz LRJYQMDTJYVIAT-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCN(C)c2ccccc2)c1 ZINC000589498168 519018302 /nfs/dbraw/zinc/01/83/02/519018302.db2.gz OSSQGYFASSOLJQ-UHFFFAOYSA-N 1 1 357.410 2.950 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCN(C)c2ccccc2)c1 ZINC000589498168 519018308 /nfs/dbraw/zinc/01/83/08/519018308.db2.gz OSSQGYFASSOLJQ-UHFFFAOYSA-N 1 1 357.410 2.950 20 5 FFBDMO COc1ccc(-c2ccc(CN3CC[C@@H]4C[N@@H+](C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052742 519138468 /nfs/dbraw/zinc/13/84/68/519138468.db2.gz KENXLDSQUBEHBK-FZKQIMNGSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4CN(C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052742 519138470 /nfs/dbraw/zinc/13/84/70/519138470.db2.gz KENXLDSQUBEHBK-FZKQIMNGSA-N 1 1 357.410 2.999 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H]4CN(C)C[C@H]43)o2)c([N+](=O)[O-])c1 ZINC000590052742 519138475 /nfs/dbraw/zinc/13/84/75/519138475.db2.gz KENXLDSQUBEHBK-FZKQIMNGSA-N 1 1 357.410 2.999 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000568663994 519154504 /nfs/dbraw/zinc/15/45/04/519154504.db2.gz JPVSIIUWPWZNPC-YLJYHZDGSA-N 1 1 367.449 2.591 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000568663994 519154514 /nfs/dbraw/zinc/15/45/14/519154514.db2.gz JPVSIIUWPWZNPC-YLJYHZDGSA-N 1 1 367.449 2.591 20 5 FFBDMO COc1cncc(/C=C\CC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 ZINC000583319473 519187765 /nfs/dbraw/zinc/18/77/65/519187765.db2.gz RFCKSSCKRZNCKO-DJWKRKHSSA-N 1 1 369.425 2.619 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000590386531 519212320 /nfs/dbraw/zinc/21/23/20/519212320.db2.gz ATDZRQUJBNKZMG-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nccc(C(F)F)n1 ZINC000571781978 519273923 /nfs/dbraw/zinc/27/39/23/519273923.db2.gz MHXLHANUODWLET-JTQLQIEISA-N 1 1 365.340 2.829 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2ccccn2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000590600735 519283135 /nfs/dbraw/zinc/28/31/35/519283135.db2.gz LXIKRSYGOGDRNY-INIZCTEOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2ccccn2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000590600735 519283141 /nfs/dbraw/zinc/28/31/41/519283141.db2.gz LXIKRSYGOGDRNY-INIZCTEOSA-N 1 1 366.421 2.759 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000580891102 519411908 /nfs/dbraw/zinc/41/19/08/519411908.db2.gz RVRHIITUFWVOPS-OAHLLOKOSA-N 1 1 369.487 2.652 20 5 FFBDMO COc1cc(CN2CCC(CC[NH3+])CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000566316895 519429583 /nfs/dbraw/zinc/42/95/83/519429583.db2.gz SHRSHMDOVBYEFI-UHFFFAOYSA-N 1 1 359.373 2.766 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000583929658 519504699 /nfs/dbraw/zinc/50/46/99/519504699.db2.gz VJQYFQIQPFGRBT-LBPRGKRZSA-N 1 1 354.765 2.917 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000572229094 519506821 /nfs/dbraw/zinc/50/68/21/519506821.db2.gz BBFCYMRXLMHBBL-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000572229094 519506826 /nfs/dbraw/zinc/50/68/26/519506826.db2.gz BBFCYMRXLMHBBL-HXUWFJFHSA-N 1 1 367.449 2.913 20 5 FFBDMO CCN(C[C@H]1CCC[N@H+]1CC)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569374934 519519494 /nfs/dbraw/zinc/51/94/94/519519494.db2.gz YXGKZZYTEVOMOA-MRXNPFEDSA-N 1 1 358.442 2.951 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CN(c2ccccc2)CCO1 ZINC000584061113 519571303 /nfs/dbraw/zinc/57/13/03/519571303.db2.gz AXZVEDLVPAYKKR-LJQANCHMSA-N 1 1 355.438 2.975 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000591459181 519629207 /nfs/dbraw/zinc/62/92/07/519629207.db2.gz PVSSDUMALAALIF-UHFFFAOYSA-N 1 1 368.437 2.714 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000591529056 519939647 /nfs/dbraw/zinc/93/96/47/519939647.db2.gz NVVOVFQJYJIUOC-INIZCTEOSA-N 1 1 361.442 2.539 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C(C)(C)C ZINC000602874770 519941579 /nfs/dbraw/zinc/94/15/79/519941579.db2.gz UABWTCUHCJXNSR-OAHLLOKOSA-N 1 1 368.865 2.849 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-] ZINC000594484097 519992631 /nfs/dbraw/zinc/99/26/31/519992631.db2.gz SAJZTWDXWISUML-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594551509 520023127 /nfs/dbraw/zinc/02/31/27/520023127.db2.gz FLTBQCAUUYHFLJ-ZVZYQTTQSA-N 1 1 360.458 2.837 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-] ZINC000594551509 520023132 /nfs/dbraw/zinc/02/31/32/520023132.db2.gz FLTBQCAUUYHFLJ-ZVZYQTTQSA-N 1 1 360.458 2.837 20 5 FFBDMO COc1cc(CN2CCC([C@@H]3CCC[NH2+]C3)CC2)c([N+](=O)[O-])cc1OC ZINC000594735194 520123531 /nfs/dbraw/zinc/12/35/31/520123531.db2.gz HNMMGMCEOIJCOY-OAHLLOKOSA-N 1 1 363.458 2.824 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600228467 520140893 /nfs/dbraw/zinc/14/08/93/520140893.db2.gz AYOSVGPIIUHGBZ-ZDUSSCGKSA-N 1 1 367.396 2.939 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000600298487 520189023 /nfs/dbraw/zinc/18/90/23/520189023.db2.gz KTJRMBIDNKBFCL-QGZVFWFLSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000600298487 520189030 /nfs/dbraw/zinc/18/90/30/520189030.db2.gz KTJRMBIDNKBFCL-QGZVFWFLSA-N 1 1 369.421 2.537 20 5 FFBDMO O=C(NC1CC1)[C@@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000592141851 520217457 /nfs/dbraw/zinc/21/74/57/520217457.db2.gz PMXYPSXPSHPKFM-FQEVSTJZSA-N 1 1 365.433 2.843 20 5 FFBDMO O=C(NC1CC1)[C@@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000592141851 520217467 /nfs/dbraw/zinc/21/74/67/520217467.db2.gz PMXYPSXPSHPKFM-FQEVSTJZSA-N 1 1 365.433 2.843 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCc2c1cnn2CCO ZINC000595019006 520259439 /nfs/dbraw/zinc/25/94/39/520259439.db2.gz VLSDPHLJNQUJQV-LRDDRELGSA-N 1 1 360.414 2.520 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000595048850 520270032 /nfs/dbraw/zinc/27/00/32/520270032.db2.gz RQAZIEOAYOASLM-CABCVRRESA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000597861702 520289306 /nfs/dbraw/zinc/28/93/06/520289306.db2.gz VRCWMCMZMRWYPT-AWEZNQCLSA-N 1 1 361.442 2.794 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000609357609 520294803 /nfs/dbraw/zinc/29/48/03/520294803.db2.gz OVQHRLLIASNIHG-HZPDHXFCSA-N 1 1 374.485 2.903 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000609441584 520313024 /nfs/dbraw/zinc/31/30/24/520313024.db2.gz KAQIJQPMZMSAPE-QGZVFWFLSA-N 1 1 367.421 2.601 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000597925878 520326341 /nfs/dbraw/zinc/32/63/41/520326341.db2.gz XPVVBJRJTDAJIZ-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO O=C(NCC(F)(F)F)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595289103 520387095 /nfs/dbraw/zinc/38/70/95/520387095.db2.gz OEGAXQBOHUQTEZ-UHFFFAOYSA-N 1 1 363.311 2.624 20 5 FFBDMO CC(=O)N1CCCCC[C@H]1C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595316075 520403474 /nfs/dbraw/zinc/40/34/74/520403474.db2.gz YTQMIUCVFBFOIM-INIZCTEOSA-N 1 1 364.446 2.894 20 5 FFBDMO CCN(C[C@@H]1CC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1)CC(F)(F)F ZINC000595343833 520419838 /nfs/dbraw/zinc/41/98/38/520419838.db2.gz FENHXNWSBIKJFE-NSHDSACASA-N 1 1 350.341 2.597 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1)CC(F)(F)F ZINC000595343833 520419845 /nfs/dbraw/zinc/41/98/45/520419845.db2.gz FENHXNWSBIKJFE-NSHDSACASA-N 1 1 350.341 2.597 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000604044724 520437413 /nfs/dbraw/zinc/43/74/13/520437413.db2.gz LDHCQMAAYUEBLJ-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000604044728 520437519 /nfs/dbraw/zinc/43/75/19/520437519.db2.gz LDHCQMAAYUEBLJ-OAHLLOKOSA-N 1 1 371.441 2.775 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000592525606 520440321 /nfs/dbraw/zinc/44/03/21/520440321.db2.gz AUBDQKHSCBLPBM-LJEUOOAZSA-N 1 1 371.359 2.999 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(S(N)(=O)=O)c1 ZINC000595414732 520454924 /nfs/dbraw/zinc/45/49/24/520454924.db2.gz LBYFIBBVRRJFJW-OAHLLOKOSA-N 1 1 367.402 2.622 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439690 520471949 /nfs/dbraw/zinc/47/19/49/520471949.db2.gz KCMCNHWRIFMGTP-WMLDXEAASA-N 1 1 353.438 2.961 20 5 FFBDMO COc1cccc([C@H]2[C@@H]([NH2+]Cc3onc(C)c3[N+](=O)[O-])CCN2C2CC2)c1 ZINC000595475921 520495417 /nfs/dbraw/zinc/49/54/17/520495417.db2.gz KHWVSAUAHBYGFZ-LPHOPBHVSA-N 1 1 372.425 2.967 20 5 FFBDMO Cn1cc([C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000595491658 520506318 /nfs/dbraw/zinc/50/63/18/520506318.db2.gz DBJRJMHMVCRPGX-MRXNPFEDSA-N 1 1 364.833 2.975 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000617450700 520506389 /nfs/dbraw/zinc/50/63/89/520506389.db2.gz IHLHDVBYOYWSGL-INIZCTEOSA-N 1 1 363.461 2.755 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C[C@@H]1C ZINC000610135389 520554055 /nfs/dbraw/zinc/55/40/55/520554055.db2.gz RADXFTVMNWARDZ-DZGCQCFKSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1c(CNC(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000595587589 520572673 /nfs/dbraw/zinc/57/26/73/520572673.db2.gz ISLGWUJXOXTERN-INIZCTEOSA-N 1 1 360.458 2.824 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000610208561 520580627 /nfs/dbraw/zinc/58/06/27/520580627.db2.gz DQOOPSABZHCSHF-DGCLKSJQSA-N 1 1 355.822 2.616 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1 ZINC000595659119 520629048 /nfs/dbraw/zinc/62/90/48/520629048.db2.gz KQCFHVMINLSNRS-UHFFFAOYSA-N 1 1 370.240 2.920 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3ccnc(C)n3)C2)c([N+](=O)[O-])c1 ZINC000610368052 520654748 /nfs/dbraw/zinc/65/47/48/520654748.db2.gz OSJABBMKTSQISV-HNNXBMFYSA-N 1 1 372.425 2.960 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598508046 520666980 /nfs/dbraw/zinc/66/69/80/520666980.db2.gz BURAJHWHSDWOLL-KRWDZBQOSA-N 1 1 357.385 2.667 20 5 FFBDMO CC(=O)N1C[C@@H]2CCC[C@H](Nc3cc[nH+]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1 ZINC000601166780 520669364 /nfs/dbraw/zinc/66/93/64/520669364.db2.gz SEEDZUWDRQNZRM-XCRHUMRWSA-N 1 1 354.410 2.624 20 5 FFBDMO C[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+](C2CCC2)C1 ZINC000601167845 520670259 /nfs/dbraw/zinc/67/02/59/520670259.db2.gz GPPQLOCTCSSQOV-JTQLQIEISA-N 1 1 361.368 2.658 20 5 FFBDMO O=C(C[NH+]1CCC2(CC2(F)F)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000593072609 520724027 /nfs/dbraw/zinc/72/40/27/520724027.db2.gz JJTAILAAWKFJLF-UHFFFAOYSA-N 1 1 351.353 2.605 20 5 FFBDMO COC(=O)c1ccnc(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000598591714 520732552 /nfs/dbraw/zinc/73/25/52/520732552.db2.gz AJHQYLBQJIMHGE-GFCCVEGCSA-N 1 1 350.419 2.699 20 5 FFBDMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2(CCC2)CO1 ZINC000593092363 520740618 /nfs/dbraw/zinc/74/06/18/520740618.db2.gz NKBDOUARLGUWOO-CYBMUJFWSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2(CCC2)CO1 ZINC000593092363 520740621 /nfs/dbraw/zinc/74/06/21/520740621.db2.gz NKBDOUARLGUWOO-CYBMUJFWSA-N 1 1 361.398 2.536 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000601355135 520751872 /nfs/dbraw/zinc/75/18/72/520751872.db2.gz KNLQFJJKOPTKFR-QWHCGFSZSA-N 1 1 373.450 2.536 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CN2CCCC2=O)C1 ZINC000595832387 520755701 /nfs/dbraw/zinc/75/57/01/520755701.db2.gz PENWOYVMBAXMJG-HNNXBMFYSA-N 1 1 361.442 2.826 20 5 FFBDMO O=C(Nc1ccc(C[NH+]2CCC(O)CC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000614009723 520762579 /nfs/dbraw/zinc/76/25/79/520762579.db2.gz AOOYQNCRQWRMKI-UHFFFAOYSA-N 1 1 371.393 2.509 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000610798638 520848902 /nfs/dbraw/zinc/84/89/02/520848902.db2.gz IBNHHVDMGCKPBP-SFHVURJKSA-N 1 1 360.502 2.532 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)C1(c3ccc([N+](=O)[O-])cc3)CCC1)C2 ZINC000601614583 520866553 /nfs/dbraw/zinc/86/65/53/520866553.db2.gz XIOOIUNLWAMPQR-LJQANCHMSA-N 1 1 357.454 2.961 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(CNc3cc[nH]c(=O)c3[N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000596077743 520897864 /nfs/dbraw/zinc/89/78/64/520897864.db2.gz ATZYRZKUIJRMLI-OKILXGFUSA-N 1 1 372.425 2.917 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596088647 520906742 /nfs/dbraw/zinc/90/67/42/520906742.db2.gz MUMLGSQUTRKNOV-CZUORRHYSA-N 1 1 354.410 2.941 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593331258 520914385 /nfs/dbraw/zinc/91/43/85/520914385.db2.gz QQXZJVGZQQZTPH-LJQANCHMSA-N 1 1 368.437 2.663 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593331258 520914392 /nfs/dbraw/zinc/91/43/92/520914392.db2.gz QQXZJVGZQQZTPH-LJQANCHMSA-N 1 1 368.437 2.663 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl ZINC000596110597 520918625 /nfs/dbraw/zinc/91/86/25/520918625.db2.gz QLMTZGZPKKUPEW-LLVKDONJSA-N 1 1 371.821 2.558 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[NH+](C2CCC2)CC1 ZINC000610960396 520921203 /nfs/dbraw/zinc/92/12/03/520921203.db2.gz VBMSBZGYAHIHAG-UHFFFAOYSA-N 1 1 357.332 2.924 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000596137766 520935136 /nfs/dbraw/zinc/93/51/36/520935136.db2.gz WIOKWAQVWVFWCU-GHMZBOCLSA-N 1 1 355.822 2.954 20 5 FFBDMO NC(=O)c1cc(N2CCC(c3[nH+]cc4n3CCCC4)CC2)ccc1[N+](=O)[O-] ZINC000596214928 520974976 /nfs/dbraw/zinc/97/49/76/520974976.db2.gz NFMQRKHXZAJUJV-UHFFFAOYSA-N 1 1 369.425 2.611 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088123 520979367 /nfs/dbraw/zinc/97/93/67/520979367.db2.gz DHTZKLOWXVMMDT-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088123 520979378 /nfs/dbraw/zinc/97/93/78/520979378.db2.gz DHTZKLOWXVMMDT-RYUDHWBXSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599025094 520987271 /nfs/dbraw/zinc/98/72/71/520987271.db2.gz ZOJVUKFJLORPPG-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000618307235 520990534 /nfs/dbraw/zinc/99/05/34/520990534.db2.gz UULUCAJLTQVQRR-LJQANCHMSA-N 1 1 363.377 2.567 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 ZINC000618307235 520990542 /nfs/dbraw/zinc/99/05/42/520990542.db2.gz UULUCAJLTQVQRR-LJQANCHMSA-N 1 1 363.377 2.567 20 5 FFBDMO Cc1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c1 ZINC000593495820 521032137 /nfs/dbraw/zinc/03/21/37/521032137.db2.gz JWBDBRXAJQZSQV-RBUKOAKNSA-N 1 1 368.437 2.778 20 5 FFBDMO Cn1cc(CN[C@H]2CC[NH2+]CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000601970002 521048601 /nfs/dbraw/zinc/04/86/01/521048601.db2.gz IJTJWTUDHHWFSM-INIZCTEOSA-N 1 1 357.458 2.863 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000599140439 521051501 /nfs/dbraw/zinc/05/15/01/521051501.db2.gz SKWKESUXKHSPKS-OAHLLOKOSA-N 1 1 367.409 2.588 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)nc1 ZINC000596526633 521116700 /nfs/dbraw/zinc/11/67/00/521116700.db2.gz RUAIGINEZDAVCR-INIZCTEOSA-N 1 1 353.426 2.521 20 5 FFBDMO C[C@H](NC(=O)NCC[NH+]1Cc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000611372772 521124894 /nfs/dbraw/zinc/12/48/94/521124894.db2.gz MUQMLRWGWUBTSN-AWEZNQCLSA-N 1 1 354.410 2.971 20 5 FFBDMO Cc1cc(N2CCO[C@H](CCC[NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000596565980 521133646 /nfs/dbraw/zinc/13/36/46/521133646.db2.gz JQVGTXDJTMGMLG-MRXNPFEDSA-N 1 1 358.442 2.998 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](NC[C@@H]2CCC[N@@H+]2CCCO)C(F)(F)F)cc1 ZINC000593713126 521169817 /nfs/dbraw/zinc/16/98/17/521169817.db2.gz UXAFWIIPHFVWOZ-GJZGRUSLSA-N 1 1 361.364 2.635 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCc1ccc(CO)cc1)c1cccc([N+](=O)[O-])c1 ZINC000611560836 521219614 /nfs/dbraw/zinc/21/96/14/521219614.db2.gz LEFUNPIYIDUIJK-IBGZPJMESA-N 1 1 366.421 2.742 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000611614714 521248804 /nfs/dbraw/zinc/24/88/04/521248804.db2.gz CLMDHNWBGLIFOZ-NEPJUHHUSA-N 1 1 355.341 2.553 20 5 FFBDMO CCOCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCc2ccccc21 ZINC000599624387 521341028 /nfs/dbraw/zinc/34/10/28/521341028.db2.gz DJLZDMJXDPWWMT-IBGZPJMESA-N 1 1 371.437 2.783 20 5 FFBDMO O=C1NCCN1[C@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602449177 521350973 /nfs/dbraw/zinc/35/09/73/521350973.db2.gz ORNAHNVHYYMFHS-ZDUSSCGKSA-N 1 1 372.347 2.603 20 5 FFBDMO O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602449177 521350981 /nfs/dbraw/zinc/35/09/81/521350981.db2.gz ORNAHNVHYYMFHS-ZDUSSCGKSA-N 1 1 372.347 2.603 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3c(O)cccc3C2)cccc1[N+](=O)[O-] ZINC000599648216 521358152 /nfs/dbraw/zinc/35/81/52/521358152.db2.gz VRLFVDIPBXMKLJ-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO O=[N+]([O-])c1sc(C[NH2+][C@H](CO)CC(F)(F)F)cc1Br ZINC000602578825 521422030 /nfs/dbraw/zinc/42/20/30/521422030.db2.gz HINJSRVTESGNJA-YFKPBYRVSA-N 1 1 363.155 2.822 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC000599715533 521424933 /nfs/dbraw/zinc/42/49/33/521424933.db2.gz ZMSFHHVMWNWBIE-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@H]1C ZINC000599715533 521424941 /nfs/dbraw/zinc/42/49/41/521424941.db2.gz ZMSFHHVMWNWBIE-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000594197197 521462817 /nfs/dbraw/zinc/46/28/17/521462817.db2.gz AXHSBNSJFXCAKB-IAGOWNOFSA-N 1 1 372.469 2.942 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000594197201 521463174 /nfs/dbraw/zinc/46/31/74/521463174.db2.gz AXHSBNSJFXCAKB-SJORKVTESA-N 1 1 372.469 2.942 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594200365 521466934 /nfs/dbraw/zinc/46/69/34/521466934.db2.gz LADIVLITZKLPOF-AEFFLSMTSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000602709660 521489993 /nfs/dbraw/zinc/48/99/93/521489993.db2.gz OSAPATYYPRAZQH-CQSZACIVSA-N 1 1 359.348 2.520 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@H](OCc3ccccn3)C1)OCCO2 ZINC000602713420 521491873 /nfs/dbraw/zinc/49/18/73/521491873.db2.gz AEFVBMQUUWKMFB-INIZCTEOSA-N 1 1 371.393 2.552 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H](OCc3ccccn3)C1)OCCO2 ZINC000602713420 521491878 /nfs/dbraw/zinc/49/18/78/521491878.db2.gz AEFVBMQUUWKMFB-INIZCTEOSA-N 1 1 371.393 2.552 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000599830644 521499925 /nfs/dbraw/zinc/49/99/25/521499925.db2.gz WDVWCRSWKHRAPH-ZDUSSCGKSA-N 1 1 355.398 2.749 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccncc12)C1=CC[N@@H+](C)CC1 ZINC000599832638 521500976 /nfs/dbraw/zinc/50/09/76/521500976.db2.gz GYBWFFLOKSAAQI-GFCCVEGCSA-N 1 1 355.398 2.915 20 5 FFBDMO COc1ccccc1C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000602763456 521520188 /nfs/dbraw/zinc/52/01/88/521520188.db2.gz ONLQCZTYMZEGIZ-QGZVFWFLSA-N 1 1 374.441 2.790 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O ZINC000602825109 521554952 /nfs/dbraw/zinc/55/49/52/521554952.db2.gz JPMFTPOWCIFNDX-QMCVQRASSA-N 1 1 350.463 2.751 20 5 FFBDMO COc1c(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)cccc1[N+](=O)[O-] ZINC000619442229 521570000 /nfs/dbraw/zinc/57/00/00/521570000.db2.gz HTQVVJVZDHLRCL-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@@H]2N1 ZINC000597204845 521572450 /nfs/dbraw/zinc/57/24/50/521572450.db2.gz GGAOTVBBYQQQIC-YOEHRIQHSA-N 1 1 355.394 2.955 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@H]2N1 ZINC000597207816 521575008 /nfs/dbraw/zinc/57/50/08/521575008.db2.gz VTRRKYDXDPBJHP-RHSMWYFYSA-N 1 1 355.394 2.955 20 5 FFBDMO O=C1CCCN1C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597228344 521585861 /nfs/dbraw/zinc/58/58/61/521585861.db2.gz LOKBZBGYUMTVST-GFCCVEGCSA-N 1 1 369.368 2.641 20 5 FFBDMO O=C1CCCN1C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597228344 521585869 /nfs/dbraw/zinc/58/58/69/521585869.db2.gz LOKBZBGYUMTVST-GFCCVEGCSA-N 1 1 369.368 2.641 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000619864429 521908842 /nfs/dbraw/zinc/90/88/42/521908842.db2.gz OZJKWYBURAEOJN-VQIMIIECSA-N 1 1 374.441 2.625 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[NH+]1CCN(C)CC1 ZINC000485416562 561318573 /nfs/dbraw/zinc/31/85/73/561318573.db2.gz KWRFAKPGUCXGGM-AWEZNQCLSA-N 1 1 373.432 2.844 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000023802541 727848698 /nfs/dbraw/zinc/84/86/98/727848698.db2.gz AVRSEKXXAPJNGN-YVMONPNESA-N 1 1 358.423 2.503 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000023802541 727848702 /nfs/dbraw/zinc/84/87/02/727848702.db2.gz AVRSEKXXAPJNGN-YVMONPNESA-N 1 1 358.423 2.503 20 5 FFBDMO COc1ccc(C[N@@H+](C)[C@H](C)CNC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC000171956427 729016962 /nfs/dbraw/zinc/01/69/62/729016962.db2.gz KDPTXGNDQMIFEQ-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](CN3CCOCC3)C2)c1 ZINC000172180350 729021011 /nfs/dbraw/zinc/02/10/11/729021011.db2.gz GTUADNNRBVHZDR-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](CN3CCOCC3)C2)c1 ZINC000172180350 729021013 /nfs/dbraw/zinc/02/10/13/729021013.db2.gz GTUADNNRBVHZDR-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000173395922 729046367 /nfs/dbraw/zinc/04/63/67/729046367.db2.gz XKFWXMQHJBWYBM-LBPRGKRZSA-N 1 1 367.427 2.814 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000173395922 729046372 /nfs/dbraw/zinc/04/63/72/729046372.db2.gz XKFWXMQHJBWYBM-LBPRGKRZSA-N 1 1 367.427 2.814 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1 ZINC000182189515 729271360 /nfs/dbraw/zinc/27/13/60/729271360.db2.gz NFIRKDNXYAMKIZ-NSHDSACASA-N 1 1 352.387 2.988 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000857263338 730388118 /nfs/dbraw/zinc/38/81/18/730388118.db2.gz XCGBXUMIYMKJTF-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000857283408 730389160 /nfs/dbraw/zinc/38/91/60/730389160.db2.gz TVMYNBRPIHZBKF-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000925167364 738484763 /nfs/dbraw/zinc/48/47/63/738484763.db2.gz BVYCFPQPSSROPY-DAXOMENPSA-N 1 1 364.471 2.535 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000865904343 731009755 /nfs/dbraw/zinc/00/97/55/731009755.db2.gz QTIMCFHSKCARFU-GFCCVEGCSA-N 1 1 350.806 2.715 20 5 FFBDMO COCCCN1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866255382 731044096 /nfs/dbraw/zinc/04/40/96/731044096.db2.gz RRLGPBLEYHGJKA-AWEZNQCLSA-N 1 1 353.438 2.755 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000869286065 731382966 /nfs/dbraw/zinc/38/29/66/731382966.db2.gz ZWQKOPXMBSDSFV-GFCCVEGCSA-N 1 1 370.247 2.500 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000780768251 738575130 /nfs/dbraw/zinc/57/51/30/738575130.db2.gz QJPKWDDLHWLWGH-GJZGRUSLSA-N 1 1 364.496 2.856 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000877021423 732313555 /nfs/dbraw/zinc/31/35/55/732313555.db2.gz BFZAZCJXPZDUKH-ZIAGYGMSSA-N 1 1 359.348 2.566 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435027 732907583 /nfs/dbraw/zinc/90/75/83/732907583.db2.gz IDYISIWMSAMWBA-WCQYABFASA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435027 732907586 /nfs/dbraw/zinc/90/75/86/732907586.db2.gz IDYISIWMSAMWBA-WCQYABFASA-N 1 1 359.220 2.593 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC3(CC2)COCCO3)c1Br ZINC000880548061 732923102 /nfs/dbraw/zinc/92/31/02/732923102.db2.gz IOBBUNBAIJLACN-UHFFFAOYSA-N 1 1 371.231 2.739 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3Br)CC[C@@H]21 ZINC000881439509 733055185 /nfs/dbraw/zinc/05/51/85/733055185.db2.gz NZSXYYKHPOCFGC-PWSUYJOCSA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])C[C@]2(C)C1 ZINC000887925430 733993711 /nfs/dbraw/zinc/99/37/11/733993711.db2.gz JDUBUIWFMVOQJB-PSLIRLAXSA-N 1 1 358.225 2.925 20 5 FFBDMO CSc1ccc(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928104548 738825536 /nfs/dbraw/zinc/82/55/36/738825536.db2.gz VZUWCALUWWYBQW-GXTWGEPZSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928104548 738825538 /nfs/dbraw/zinc/82/55/38/738825538.db2.gz VZUWCALUWWYBQW-GXTWGEPZSA-N 1 1 367.496 2.626 20 5 FFBDMO CC(C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+]1CCOCC1 ZINC000729630448 734587337 /nfs/dbraw/zinc/58/73/37/734587337.db2.gz MYDHVKPHVOATIZ-AWEZNQCLSA-N 1 1 350.444 2.973 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000783920093 738849071 /nfs/dbraw/zinc/84/90/71/738849071.db2.gz ZBRLDRPWGNUMKK-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO CC(C)[C@@H]([NH2+]C1CCOCC1)C(=O)OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000783923302 738849190 /nfs/dbraw/zinc/84/91/90/738849190.db2.gz IVIBMORPXGZHMO-MRXNPFEDSA-N 1 1 354.378 2.570 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000894484068 734866874 /nfs/dbraw/zinc/86/68/74/734866874.db2.gz BJDGXHNMVWFLDO-KBPBESRZSA-N 1 1 350.415 2.948 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000735491015 734948031 /nfs/dbraw/zinc/94/80/31/734948031.db2.gz ZZJIATBZBNXKPU-CHWSQXEVSA-N 1 1 369.849 2.611 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)COC(=O)N1 ZINC000896394750 735152288 /nfs/dbraw/zinc/15/22/88/735152288.db2.gz FSJLNRIASNBVPG-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2COc2ccc(Cl)cc2)n1 ZINC000747958919 735605170 /nfs/dbraw/zinc/60/51/70/735605170.db2.gz GESRBHBGKZEXEL-AWEZNQCLSA-N 1 1 350.806 2.988 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2C(=O)OC)C1 ZINC000757703784 736420839 /nfs/dbraw/zinc/42/08/39/736420839.db2.gz JLMSULOHSUNEON-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC000906876383 736554752 /nfs/dbraw/zinc/55/47/52/736554752.db2.gz TYLGUKZXSLEJLT-GFCCVEGCSA-N 1 1 366.849 2.634 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761044897 736690029 /nfs/dbraw/zinc/69/00/29/736690029.db2.gz IZYLGWCUOBABNL-JTQLQIEISA-N 1 1 361.320 2.816 20 5 FFBDMO COCCOc1ncccc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522379 736742763 /nfs/dbraw/zinc/74/27/63/736742763.db2.gz OTEOWPQUYPLXEC-UHFFFAOYSA-N 1 1 351.790 2.958 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000762973050 736888763 /nfs/dbraw/zinc/88/87/63/736888763.db2.gz AQRVBOWKMDXLQI-UHFFFAOYSA-N 1 1 361.383 2.742 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000766253169 737212604 /nfs/dbraw/zinc/21/26/04/737212604.db2.gz JATYXDAGLZYRPN-RYUDHWBXSA-N 1 1 354.838 2.601 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000773917931 737945227 /nfs/dbraw/zinc/94/52/27/737945227.db2.gz AXWLQBFNNVEIHR-AEFFLSMTSA-N 1 1 350.415 2.539 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000921806122 738047649 /nfs/dbraw/zinc/04/76/49/738047649.db2.gz IYJPYGBXHDGTAL-BJJXKVORSA-N 1 1 364.471 2.535 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000923283284 738266137 /nfs/dbraw/zinc/26/61/37/738266137.db2.gz UHNUSVIIAVMYJV-NWDGAFQWSA-N 1 1 357.332 2.922 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CCn3cc[nH+]c3C2)cc1Cl ZINC000777801636 738321339 /nfs/dbraw/zinc/32/13/39/738321339.db2.gz JCEHCKPHWXFNQK-VIFPVBQESA-N 1 1 350.762 2.658 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC000929522533 738994913 /nfs/dbraw/zinc/99/49/13/738994913.db2.gz YQTOSAAXTXYPGC-NSHDSACASA-N 1 1 356.220 2.587 20 5 FFBDMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Br ZINC000929522533 738994915 /nfs/dbraw/zinc/99/49/15/738994915.db2.gz YQTOSAAXTXYPGC-NSHDSACASA-N 1 1 356.220 2.587 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000787962821 739191800 /nfs/dbraw/zinc/19/18/00/739191800.db2.gz RHHYVHIFPRAKPH-QMTHXVAHSA-N 1 1 371.821 2.705 20 5 FFBDMO Cc1csc(C[C@@H]2CC[N@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000933132324 739574700 /nfs/dbraw/zinc/57/47/00/739574700.db2.gz COUIOROJBNPKPF-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1csc(C[C@@H]2CC[N@@H+](CC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000933132324 739574702 /nfs/dbraw/zinc/57/47/02/739574702.db2.gz COUIOROJBNPKPF-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934773126 739838007 /nfs/dbraw/zinc/83/80/07/739838007.db2.gz FBZMWMHGHIRBOJ-QFSBIZTOSA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934773126 739838011 /nfs/dbraw/zinc/83/80/11/739838011.db2.gz FBZMWMHGHIRBOJ-QFSBIZTOSA-N 1 1 365.455 2.615 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000794258499 739868352 /nfs/dbraw/zinc/86/83/52/739868352.db2.gz QMVGJLUYUGFNSZ-LBPRGKRZSA-N 1 1 354.426 2.650 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000935685965 739994192 /nfs/dbraw/zinc/99/41/92/739994192.db2.gz JAVLKFWGYMUVKP-HOCLYGCPSA-N 1 1 369.824 2.826 20 5 FFBDMO CSc1ccc(C(=O)OC[C@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802138525 740677934 /nfs/dbraw/zinc/67/79/34/740677934.db2.gz JIODRDHLORZVFB-CYBMUJFWSA-N 1 1 354.428 2.583 20 5 FFBDMO CSc1ccc(C(=O)OC[C@H]2C[N@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802138525 740677935 /nfs/dbraw/zinc/67/79/35/740677935.db2.gz JIODRDHLORZVFB-CYBMUJFWSA-N 1 1 354.428 2.583 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000810844736 741455215 /nfs/dbraw/zinc/45/52/15/741455215.db2.gz QOVDCCJGOABDMI-NWDGAFQWSA-N 1 1 356.325 2.980 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](O)C12CCCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000814667910 741855452 /nfs/dbraw/zinc/85/54/52/741855452.db2.gz UHVOCVTWOPQSJG-CQSZACIVSA-N 1 1 353.806 2.566 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000816845378 742066095 /nfs/dbraw/zinc/06/60/95/742066095.db2.gz LWJBSUAEMDUTID-LBPRGKRZSA-N 1 1 362.817 2.974 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@@H](CCO)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000817297473 742120305 /nfs/dbraw/zinc/12/03/05/742120305.db2.gz REPBZZNGEBJIEN-CYBMUJFWSA-N 1 1 353.394 2.547 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(Cl)c([N+](=O)[O-])cc1NC(C)=O ZINC000826757844 743436621 /nfs/dbraw/zinc/43/66/21/743436621.db2.gz HBVXPDKZPHTJEO-UHFFFAOYSA-N 1 1 370.837 2.668 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)NC(C)(C)CC[NH+]1CCOCC1 ZINC000826959591 743479022 /nfs/dbraw/zinc/47/90/22/743479022.db2.gz CXSZLWCQOQJANE-UHFFFAOYSA-N 1 1 367.471 2.547 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000827321131 743554674 /nfs/dbraw/zinc/55/46/74/743554674.db2.gz UNAYYXCVPCNWAK-OCCSQVGLSA-N 1 1 367.833 2.570 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000830674415 745403465 /nfs/dbraw/zinc/40/34/65/745403465.db2.gz NELHRCOHXLHSNY-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000830674415 745403468 /nfs/dbraw/zinc/40/34/68/745403468.db2.gz NELHRCOHXLHSNY-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000830678749 745404748 /nfs/dbraw/zinc/40/47/48/745404748.db2.gz OGMALJPYHAWRLJ-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000830678749 745404750 /nfs/dbraw/zinc/40/47/50/745404750.db2.gz OGMALJPYHAWRLJ-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CC(C)[N@@H+](C)CCNS(=O)(=O)c1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC000831191442 745496810 /nfs/dbraw/zinc/49/68/10/745496810.db2.gz UROXIURKEOBMAO-UHFFFAOYSA-N 1 1 370.258 2.520 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H](CCCO)C1 ZINC000832784315 745754887 /nfs/dbraw/zinc/75/48/87/745754887.db2.gz YSZYNHSUOFWDHF-NEPJUHHUSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H](CCCO)C1 ZINC000832784315 745754892 /nfs/dbraw/zinc/75/48/92/745754892.db2.gz YSZYNHSUOFWDHF-NEPJUHHUSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1Cl ZINC000834598241 745864945 /nfs/dbraw/zinc/86/49/45/745864945.db2.gz JVVHCJBCQZOZID-KGLIPLIRSA-N 1 1 355.797 2.815 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC000838906712 746734203 /nfs/dbraw/zinc/73/42/03/746734203.db2.gz PPRQWWKCQSZPGF-OKILXGFUSA-N 1 1 366.439 2.727 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839417191 746825627 /nfs/dbraw/zinc/82/56/27/746825627.db2.gz ZWNSDXMNVROOQD-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839417191 746825635 /nfs/dbraw/zinc/82/56/35/746825635.db2.gz ZWNSDXMNVROOQD-LLVKDONJSA-N 1 1 370.247 2.914 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839470529 746833714 /nfs/dbraw/zinc/83/37/14/746833714.db2.gz PNZIQWBZOJRLCX-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839470529 746833718 /nfs/dbraw/zinc/83/37/18/746833718.db2.gz PNZIQWBZOJRLCX-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000839502978 746841826 /nfs/dbraw/zinc/84/18/26/746841826.db2.gz IPAACYYQYLAQAY-DGCLKSJQSA-N 1 1 354.838 2.601 20 5 FFBDMO NC(=[NH+]OCc1cccc([N+](=O)[O-])c1Br)C1CCOCC1 ZINC000842029781 747504740 /nfs/dbraw/zinc/50/47/40/747504740.db2.gz LAIBUOVPCBKSLB-UHFFFAOYSA-N 1 1 358.192 2.782 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000844381918 748018275 /nfs/dbraw/zinc/01/82/75/748018275.db2.gz ONMAOOBEZVDQRH-CQSZACIVSA-N 1 1 353.394 2.952 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC[C@H]([NH+]4CCOCC4)CC3)sc2c1 ZINC000848793795 749007718 /nfs/dbraw/zinc/00/77/18/749007718.db2.gz MTUAYIGCLHIHFJ-ZDUSSCGKSA-N 1 1 362.455 2.896 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)cc1Cl ZINC000848929858 749037478 /nfs/dbraw/zinc/03/74/78/749037478.db2.gz KKHKDVACUMRDQK-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)cc1Cl ZINC000848929858 749037482 /nfs/dbraw/zinc/03/74/82/749037482.db2.gz KKHKDVACUMRDQK-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H]([C@@H]2CCCO2)C1 ZINC000933189409 963692222 /nfs/dbraw/zinc/69/22/22/963692222.db2.gz ZORYBQCMVDNQAQ-NXHRZFHOSA-N 1 1 362.426 2.836 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@@H]([C@@H]2CCCO2)C1 ZINC000933189409 963692227 /nfs/dbraw/zinc/69/22/27/963692227.db2.gz ZORYBQCMVDNQAQ-NXHRZFHOSA-N 1 1 362.426 2.836 20 5 FFBDMO Cc1cc(F)ccc1C[NH2+]CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001269858828 964372662 /nfs/dbraw/zinc/37/26/62/964372662.db2.gz GLPXBBFYQBQTCZ-QZTJIDSGSA-N 1 1 363.433 2.518 20 5 FFBDMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001266835196 964534104 /nfs/dbraw/zinc/53/41/04/964534104.db2.gz SEFIDFDPSXKYLF-UHFFFAOYSA-N 1 1 363.377 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCOCC3)cc2)c2nonc21 ZINC000018061613 965245307 /nfs/dbraw/zinc/24/53/07/965245307.db2.gz ZULBXXCHEFIHFF-UHFFFAOYSA-N 1 1 369.381 2.575 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000825698725 1013666811 /nfs/dbraw/zinc/66/68/11/1013666811.db2.gz SFZNTSLNUQBYEN-CQSZACIVSA-N 1 1 358.398 2.808 20 5 FFBDMO CCOC(=O)Cc1ccc(NCCNc2cccc(C)[nH+]2)c([N+](=O)[O-])c1 ZINC000825748412 1013879045 /nfs/dbraw/zinc/87/90/45/1013879045.db2.gz ZSXASUXZKWAYJS-UHFFFAOYSA-N 1 1 358.398 2.928 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001267590853 969689670 /nfs/dbraw/zinc/68/96/70/969689670.db2.gz LGSSUGDVDBNSHU-FZKQIMNGSA-N 1 1 354.410 2.549 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1)c1ccccc1[N+](=O)[O-] ZINC000897060940 973204868 /nfs/dbraw/zinc/20/48/68/973204868.db2.gz DOSMQOGNWVHTEB-BFYDXBDKSA-N 1 1 360.458 2.824 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCC(CN(C3CC3)C3COC3)CC2)cc1 ZINC001205960051 1032085294 /nfs/dbraw/zinc/08/52/94/1032085294.db2.gz JBPQPHFKQLKKLQ-UHFFFAOYSA-N 1 1 359.470 2.713 20 5 FFBDMO C[C@@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876468015 1014279745 /nfs/dbraw/zinc/27/97/45/1014279745.db2.gz BCITYVLUSRUNCJ-COXVUDFISA-N 1 1 372.425 2.668 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000981137560 976264152 /nfs/dbraw/zinc/26/41/52/976264152.db2.gz XBAWYDTYAQENQB-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2cccc3ccccc32)CC1 ZINC000981137560 976264166 /nfs/dbraw/zinc/26/41/66/976264166.db2.gz XBAWYDTYAQENQB-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000981137560 976264174 /nfs/dbraw/zinc/26/41/74/976264174.db2.gz XBAWYDTYAQENQB-RTBURBONSA-N 1 1 353.422 2.539 20 5 FFBDMO Cc1ncccc1OC[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000842173535 976709679 /nfs/dbraw/zinc/70/96/79/976709679.db2.gz RHNAKTPPVQLFDX-ZWKOTPCHSA-N 1 1 357.410 2.875 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)cc1 ZINC000981765212 976763880 /nfs/dbraw/zinc/76/38/80/976763880.db2.gz VIGKPVCRHFTXMV-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765212 976763891 /nfs/dbraw/zinc/76/38/91/976763891.db2.gz VIGKPVCRHFTXMV-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC000981765212 976763901 /nfs/dbraw/zinc/76/39/01/976763901.db2.gz VIGKPVCRHFTXMV-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CCOC(=O)Cc1ccc(N2CCC3(CCC[N@H+]3C)CC2)c([N+](=O)[O-])c1 ZINC000825895827 1014356715 /nfs/dbraw/zinc/35/67/15/1014356715.db2.gz RDRPNMFIHMSPSR-UHFFFAOYSA-N 1 1 361.442 2.765 20 5 FFBDMO CC1CC[NH+](CCNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236847259 977139432 /nfs/dbraw/zinc/13/94/32/977139432.db2.gz OXIPNZZYXRFLFS-UHFFFAOYSA-N 1 1 357.458 2.817 20 5 FFBDMO O=c1oc2ccc(C[NH+]3CCN(c4cccc([N+](=O)[O-])c4)CC3)cc2o1 ZINC000893967262 977617145 /nfs/dbraw/zinc/61/71/45/977617145.db2.gz YURZQWXFKRIWMP-UHFFFAOYSA-N 1 1 355.350 2.616 20 5 FFBDMO Cc1c(C)c(C)c(C[NH2+]C/C=C\CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1C ZINC001268543291 977956726 /nfs/dbraw/zinc/95/67/26/977956726.db2.gz VMBGGHPIHKXEJQ-LJJUJYJISA-N 1 1 359.470 2.656 20 5 FFBDMO C[N@H+](Cc1ccc2cc[nH]c2c1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964396 980154386 /nfs/dbraw/zinc/15/43/86/980154386.db2.gz FWGSRQWVJWVAHS-IEBWSBKVSA-N 1 1 370.453 2.504 20 5 FFBDMO C[N@@H+](Cc1ccc2cc[nH]c2c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964396 980154389 /nfs/dbraw/zinc/15/43/89/980154389.db2.gz FWGSRQWVJWVAHS-IEBWSBKVSA-N 1 1 370.453 2.504 20 5 FFBDMO C[N@H+](Cc1ccc2cc[nH]c2c1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964396 980154391 /nfs/dbraw/zinc/15/43/91/980154391.db2.gz FWGSRQWVJWVAHS-IEBWSBKVSA-N 1 1 370.453 2.504 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001029964502 980155186 /nfs/dbraw/zinc/15/51/86/980155186.db2.gz MLPSTFKHRZVZIV-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964502 980155188 /nfs/dbraw/zinc/15/51/88/980155188.db2.gz MLPSTFKHRZVZIV-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964502 980155190 /nfs/dbraw/zinc/15/51/90/980155190.db2.gz MLPSTFKHRZVZIV-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cn1cc(C[NH+]2CCC([C@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])n1 ZINC000877583099 1014634631 /nfs/dbraw/zinc/63/46/31/1014634631.db2.gz DITXRXPZPVMPAE-INIZCTEOSA-N 1 1 366.368 2.552 20 5 FFBDMO C[N@@H+](C[C@H]1CC=CCC1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000784014740 980491373 /nfs/dbraw/zinc/49/13/73/980491373.db2.gz NSZWZVNQDJVIBY-AWEZNQCLSA-N 1 1 358.398 2.609 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878136095 1014876821 /nfs/dbraw/zinc/87/68/21/1014876821.db2.gz RRVZGIQPBLWMHF-CQSZACIVSA-N 1 1 359.430 2.951 20 5 FFBDMO CC(C)[NH+]1CC(Nc2c3ccc(Br)cc3ncc2[N+](=O)[O-])C1 ZINC001168315434 982833762 /nfs/dbraw/zinc/83/37/62/982833762.db2.gz ONLHYYBVVITWFC-UHFFFAOYSA-N 1 1 365.231 2.832 20 5 FFBDMO C[C@@H](C[NH+](C)C)[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000912814264 984126176 /nfs/dbraw/zinc/12/61/76/984126176.db2.gz UURMYGPZWQICSI-BLLLJJGKSA-N 1 1 359.430 2.664 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764866801 984766217 /nfs/dbraw/zinc/76/62/17/984766217.db2.gz VZOIBVGEVZULPR-UHFFFAOYSA-N 1 1 371.441 2.545 20 5 FFBDMO Cc1nn(C[NH+]2CCC(C(=O)N(C)C(C)C)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000764883161 984780655 /nfs/dbraw/zinc/78/06/55/984780655.db2.gz BIWRNXWHNBCFKQ-UHFFFAOYSA-N 1 1 373.457 2.789 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)nc1-c1ccccc1 ZINC000761210203 984905189 /nfs/dbraw/zinc/90/51/89/984905189.db2.gz ILOGBWQOGRVBOV-JKSUJKDBSA-N 1 1 354.410 2.932 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000170647423 985103451 /nfs/dbraw/zinc/10/34/51/985103451.db2.gz UEVIDMVBAWUPGA-AWEZNQCLSA-N 1 1 365.430 2.950 20 5 FFBDMO C/C(=C\C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000785437974 985320823 /nfs/dbraw/zinc/32/08/23/985320823.db2.gz ACWOCUIEIIFOKC-QJPKHSJYSA-N 1 1 373.453 2.710 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1nnc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000878662590 1015156731 /nfs/dbraw/zinc/15/67/31/1015156731.db2.gz RJBAXZUKWAZRIX-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc(C)ccc2[N+](=O)[O-])cn1 ZINC000173165443 985758728 /nfs/dbraw/zinc/75/87/28/985758728.db2.gz PYVOMQRNQQSZRM-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C[C@H]1c1ccc(O)cc1 ZINC000451097629 987356357 /nfs/dbraw/zinc/35/63/57/987356357.db2.gz QGGMISCDOPBAGO-ZWKOTPCHSA-N 1 1 370.405 2.997 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000761602206 987542088 /nfs/dbraw/zinc/54/20/88/987542088.db2.gz ZFRVGNBNCKDNHA-CYBMUJFWSA-N 1 1 365.393 2.904 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCOCC2)c2ccccc2)c2nonc21 ZINC000914863192 988001374 /nfs/dbraw/zinc/00/13/74/988001374.db2.gz NFXKDYRMMPVGFK-HNNXBMFYSA-N 1 1 369.381 2.616 20 5 FFBDMO C[N@@H+](CCCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000915284423 988377320 /nfs/dbraw/zinc/37/73/20/988377320.db2.gz XGHNTOSEBSGINR-UHFFFAOYSA-N 1 1 373.457 2.715 20 5 FFBDMO Cc1noc(C)c1CO[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000762638102 988544287 /nfs/dbraw/zinc/54/42/87/988544287.db2.gz AIQXIRNYLWIISA-WMZOPIPTSA-N 1 1 361.398 2.524 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000879214709 1015413627 /nfs/dbraw/zinc/41/36/27/1015413627.db2.gz VCXTWWCKLCRKKI-OAHLLOKOSA-N 1 1 369.425 2.631 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC2(CC1)CC[NH+](C)CC2 ZINC000879249489 1015439073 /nfs/dbraw/zinc/43/90/73/1015439073.db2.gz RRMNSVJBHWCGQX-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000194342481 989217206 /nfs/dbraw/zinc/21/72/06/989217206.db2.gz RFCDJIQGHGQMRU-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000194342481 989217218 /nfs/dbraw/zinc/21/72/18/989217218.db2.gz RFCDJIQGHGQMRU-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154748725 990418905 /nfs/dbraw/zinc/41/89/05/990418905.db2.gz DQXABESBQRJQCK-OAHLLOKOSA-N 1 1 362.430 2.543 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154748725 990418907 /nfs/dbraw/zinc/41/89/07/990418907.db2.gz DQXABESBQRJQCK-OAHLLOKOSA-N 1 1 362.430 2.543 20 5 FFBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000154878232 990556767 /nfs/dbraw/zinc/55/67/67/990556767.db2.gz YZXWYMAICBDBPG-AWEZNQCLSA-N 1 1 360.414 2.957 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000920451838 990850939 /nfs/dbraw/zinc/85/09/39/990850939.db2.gz URKZVMZHKPAPTQ-OAHLLOKOSA-N 1 1 373.457 2.715 20 5 FFBDMO C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(OCC(=O)[O-])c([N+](=O)[O-])c1)C(C)(C)C ZINC001598215506 990877977 /nfs/dbraw/zinc/87/79/77/990877977.db2.gz ZGQVMCRPFAYPQM-MRXNPFEDSA-N 1 1 367.446 2.514 20 5 FFBDMO Cn1cc(CNCC[NH+]2CCCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237915298 991393146 /nfs/dbraw/zinc/39/31/46/991393146.db2.gz BXMCXYPTCLTXDD-UHFFFAOYSA-N 1 1 357.458 2.961 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCC2CCCCC2)CC1 ZINC001484135684 991406905 /nfs/dbraw/zinc/40/69/05/991406905.db2.gz DZVDKTDSVANSHF-IAGOWNOFSA-N 1 1 351.491 2.840 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000068964560 991554066 /nfs/dbraw/zinc/55/40/66/991554066.db2.gz PBCIAAFSNOMPBT-HUUCEWRRSA-N 1 1 373.457 2.919 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000880518462 1015862184 /nfs/dbraw/zinc/86/21/84/1015862184.db2.gz JQZACTMNCIPDBJ-DPGVMXDBSA-N 1 1 356.426 2.772 20 5 FFBDMO CCOc1cc(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000810846305 994953254 /nfs/dbraw/zinc/95/32/54/994953254.db2.gz IROBERZTOZKVKJ-OLZOCXBDSA-N 1 1 364.398 2.786 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CCC1CC1)Cc1cccc(Cl)c1 ZINC001133395907 995497623 /nfs/dbraw/zinc/49/76/23/995497623.db2.gz HTDPWRYOGDQQGK-IAGOWNOFSA-N 1 1 365.861 2.724 20 5 FFBDMO COc1ccccc1CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171235 995633798 /nfs/dbraw/zinc/63/37/98/995633798.db2.gz RAGPABDYQWZARV-SFHVURJKSA-N 1 1 370.405 2.964 20 5 FFBDMO COc1ccccc1CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171235 995633801 /nfs/dbraw/zinc/63/38/01/995633801.db2.gz RAGPABDYQWZARV-SFHVURJKSA-N 1 1 370.405 2.964 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000826709226 1015984078 /nfs/dbraw/zinc/98/40/78/1015984078.db2.gz JPPFVFQCGOZOKJ-IBGZPJMESA-N 1 1 364.405 2.922 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000826709226 1015984084 /nfs/dbraw/zinc/98/40/84/1015984084.db2.gz JPPFVFQCGOZOKJ-IBGZPJMESA-N 1 1 364.405 2.922 20 5 FFBDMO CC1(C)CC(C[N@H+]2Cc3ccc(CNC(=O)[C@@H]4C[C@H]4[N+](=O)[O-])cc3C2)C1 ZINC001054264968 1015996296 /nfs/dbraw/zinc/99/62/96/1015996296.db2.gz XTHMCDTXLRHQFL-QZTJIDSGSA-N 1 1 357.454 2.720 20 5 FFBDMO CC1(C)CC(C[N@@H+]2Cc3ccc(CNC(=O)[C@@H]4CC4[N+](=O)[O-])cc3C2)C1 ZINC001054264968 1015996302 /nfs/dbraw/zinc/99/63/02/1015996302.db2.gz XTHMCDTXLRHQFL-QZTJIDSGSA-N 1 1 357.454 2.720 20 5 FFBDMO CC1(C)CC(C[N@H+]2Cc3ccc(CNC(=O)[C@@H]4CC4[N+](=O)[O-])cc3C2)C1 ZINC001054264968 1015996308 /nfs/dbraw/zinc/99/63/08/1015996308.db2.gz XTHMCDTXLRHQFL-QZTJIDSGSA-N 1 1 357.454 2.720 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741023032 999704245 /nfs/dbraw/zinc/70/42/45/999704245.db2.gz YBNYSOLAQGSEPO-XUXIUFHCSA-N 1 1 363.414 2.726 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086082834 999754559 /nfs/dbraw/zinc/75/45/59/999754559.db2.gz FKCXPHOYIUDLLU-ZWQIFLOQSA-N 1 1 357.454 2.604 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000742419037 999773112 /nfs/dbraw/zinc/77/31/12/999773112.db2.gz PEFZUCPCUCJGLA-CQSZACIVSA-N 1 1 366.418 2.614 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000745943341 999938236 /nfs/dbraw/zinc/93/82/36/999938236.db2.gz BKAQEOJSPKZDSW-HNNXBMFYSA-N 1 1 365.430 2.915 20 5 FFBDMO C[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C[C@@H]1CNC(=O)OC(C)(C)C ZINC001169006444 1000015008 /nfs/dbraw/zinc/01/50/08/1000015008.db2.gz IHVGHETWZLSZTQ-FXUDXRNXSA-N 1 1 355.479 2.915 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]12CCC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011023 1000015243 /nfs/dbraw/zinc/01/52/43/1000015243.db2.gz HJVQLCGPXUFKPK-DAYGRLMNSA-N 1 1 353.463 2.907 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCc3ncnc(-c4ccccc4)c3CC2)C1 ZINC001169024875 1000018309 /nfs/dbraw/zinc/01/83/09/1000018309.db2.gz RWTBWFNMDFWFFV-RDJZCZTQSA-N 1 1 352.438 2.990 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC001147162866 1000837017 /nfs/dbraw/zinc/83/70/17/1000837017.db2.gz DGHGLIWHNNMARG-CYBMUJFWSA-N 1 1 353.850 2.981 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](Oc3ncccc3F)C2)cc1 ZINC000785841256 1001492262 /nfs/dbraw/zinc/49/22/62/1001492262.db2.gz QTPRTXSGJQCJGO-NVXWUHKLSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](Oc3ncccc3F)C2)cc1 ZINC000785841256 1001492263 /nfs/dbraw/zinc/49/22/63/1001492263.db2.gz QTPRTXSGJQCJGO-NVXWUHKLSA-N 1 1 361.373 2.706 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1OC ZINC000788113775 1001763647 /nfs/dbraw/zinc/76/36/47/1001763647.db2.gz BWRPFHAQPZZLTL-STQMWFEESA-N 1 1 364.398 2.786 20 5 FFBDMO Cc1ccc2c(=O)c3cccc(CC(=O)N4CC([NH+](C)C)C4)c3oc2c1C ZINC001182505786 1001937905 /nfs/dbraw/zinc/93/79/05/1001937905.db2.gz HIRYDNNWRHRSFV-UHFFFAOYSA-N 1 1 364.445 2.878 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000791325892 1002654553 /nfs/dbraw/zinc/65/45/53/1002654553.db2.gz VHFVHHIOLSNFCN-CQSZACIVSA-N 1 1 372.400 2.711 20 5 FFBDMO CC(C)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(=O)N1CCCC1 ZINC001170159467 1002780729 /nfs/dbraw/zinc/78/07/29/1002780729.db2.gz ZBCMKZKEQDSFEA-SFHVURJKSA-N 1 1 360.458 2.642 20 5 FFBDMO CC(C)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(=O)N1CCCC1 ZINC001170159467 1002780743 /nfs/dbraw/zinc/78/07/43/1002780743.db2.gz ZBCMKZKEQDSFEA-SFHVURJKSA-N 1 1 360.458 2.642 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@@H]21 ZINC001185701245 1003026579 /nfs/dbraw/zinc/02/65/79/1003026579.db2.gz FTCIVELAEORKBH-LRDDRELGSA-N 1 1 371.397 2.972 20 5 FFBDMO Cn1cc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc([N+](=O)[O-])c1=O ZINC001170330543 1003116266 /nfs/dbraw/zinc/11/62/66/1003116266.db2.gz ANQAATBAGYYVKA-XGWQRUHWSA-N 1 1 368.437 2.901 20 5 FFBDMO COc1ccc(C[C@H](C)N2CC3(C2)CC[N@@H+](CC2CC2)C3)c([N+](=O)[O-])c1 ZINC001170339802 1003128511 /nfs/dbraw/zinc/12/85/11/1003128511.db2.gz JOMYZBLQGYCANG-HNNXBMFYSA-N 1 1 359.470 2.952 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC001170344398 1003132201 /nfs/dbraw/zinc/13/22/01/1003132201.db2.gz BSEBDHPKITZXRI-INIZCTEOSA-N 1 1 370.453 2.747 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](Oc3cnccn3)C2)c([N+](=O)[O-])c1 ZINC001170351239 1003136912 /nfs/dbraw/zinc/13/69/12/1003136912.db2.gz BQLDCTXCJDZQON-PBHICJAKSA-N 1 1 372.425 2.868 20 5 FFBDMO CN(CCOCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC001196225900 1003710807 /nfs/dbraw/zinc/71/08/07/1003710807.db2.gz ALTNNYCBKLRLMC-UHFFFAOYSA-N 1 1 367.446 2.910 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1C ZINC001191896783 1003993882 /nfs/dbraw/zinc/99/38/82/1003993882.db2.gz SPBXFBYRGGMJNH-HOTGVXAUSA-N 1 1 367.471 2.507 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1cccnc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC001193282655 1004436039 /nfs/dbraw/zinc/43/60/39/1004436039.db2.gz MPTUMHULONGCLA-UHFFFAOYSA-N 1 1 373.409 2.954 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1cccnc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC001193282655 1004436042 /nfs/dbraw/zinc/43/60/42/1004436042.db2.gz MPTUMHULONGCLA-UHFFFAOYSA-N 1 1 373.409 2.954 20 5 FFBDMO O=C(C[N@H+]1CCCc2ccccc2CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001194400308 1004722061 /nfs/dbraw/zinc/72/20/61/1004722061.db2.gz GRXNTICFDWZWLR-UHFFFAOYSA-N 1 1 365.433 2.975 20 5 FFBDMO CC1(C)OCC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194436771 1004736101 /nfs/dbraw/zinc/73/61/01/1004736101.db2.gz YSFZEPCULYKPQL-GFCCVEGCSA-N 1 1 352.778 2.955 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NCc1ccccc1C[N@H+]1CC[C@H](O)C1 ZINC000808014205 1004738534 /nfs/dbraw/zinc/73/85/34/1004738534.db2.gz GIOHPHQYWUMUPY-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](CO)c1ccc(Br)cc1 ZINC001194734332 1004796922 /nfs/dbraw/zinc/79/69/22/1004796922.db2.gz SJIPBNHWEFJNIF-ZDUSSCGKSA-N 1 1 352.188 2.576 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000101955734 1004963208 /nfs/dbraw/zinc/96/32/08/1004963208.db2.gz HHASTNHLWYOQDC-UHFFFAOYSA-N 1 1 362.474 2.901 20 5 FFBDMO C[N@H+](Cc1ccc(C(=O)NC2CC2)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278938 1005345348 /nfs/dbraw/zinc/34/53/48/1005345348.db2.gz VFSVQELXXUFVSB-LJQANCHMSA-N 1 1 369.421 2.652 20 5 FFBDMO Cc1cc(N2CCN(c3[nH+]ccn3C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000776293442 1005352043 /nfs/dbraw/zinc/35/20/43/1005352043.db2.gz YWVWAOLIWHBGSY-UHFFFAOYSA-N 1 1 352.398 2.512 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580731 1005961086 /nfs/dbraw/zinc/96/10/86/1005961086.db2.gz ZHVKUBLQBCEJRC-QGPMSJSTSA-N 1 1 363.458 2.645 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852298944 1005966003 /nfs/dbraw/zinc/96/60/03/1005966003.db2.gz IVIACUXNDNSLMR-LLVKDONJSA-N 1 1 369.381 2.576 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852298944 1005966011 /nfs/dbraw/zinc/96/60/11/1005966011.db2.gz IVIACUXNDNSLMR-LLVKDONJSA-N 1 1 369.381 2.576 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+](C2CCC2)C1 ZINC000813630766 1006005495 /nfs/dbraw/zinc/00/54/95/1006005495.db2.gz QMLWQPYCKJGMQU-CQSZACIVSA-N 1 1 372.469 2.798 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000813828103 1006046843 /nfs/dbraw/zinc/04/68/43/1006046843.db2.gz ZOUUWSJRDVILMR-YOEHRIQHSA-N 1 1 368.437 2.878 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000852514276 1006062120 /nfs/dbraw/zinc/06/21/20/1006062120.db2.gz DWGUQWLZYQUOCP-NHCUHLMSSA-N 1 1 369.465 2.877 20 5 FFBDMO COC(=O)c1ccnc(N2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000882810592 1006512937 /nfs/dbraw/zinc/51/29/37/1006512937.db2.gz XHESGOWWUGPFDM-AWEZNQCLSA-N 1 1 370.409 2.660 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000853746407 1006523644 /nfs/dbraw/zinc/52/36/44/1006523644.db2.gz IIFXUBRIPRECCJ-SNVBAGLBSA-N 1 1 366.374 2.574 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1 ZINC000776765610 1007036960 /nfs/dbraw/zinc/03/69/60/1007036960.db2.gz HALMXGIJXLVZBG-SFHVURJKSA-N 1 1 356.357 2.635 20 5 FFBDMO C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000817288914 1007509287 /nfs/dbraw/zinc/50/92/87/1007509287.db2.gz OWMMJTVIQKUWMJ-UNEWFSDZSA-N 1 1 364.442 2.928 20 5 FFBDMO C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000817288626 1007510336 /nfs/dbraw/zinc/51/03/36/1007510336.db2.gz JUFLLAHKEMXUEE-UNEWFSDZSA-N 1 1 364.442 2.928 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000856476575 1007845357 /nfs/dbraw/zinc/84/53/57/1007845357.db2.gz ZWITVMRHHXXPKL-HNNXBMFYSA-N 1 1 360.458 2.513 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856537129 1007876989 /nfs/dbraw/zinc/87/69/89/1007876989.db2.gz OAPIPVVBGMPURZ-DOPJRALCSA-N 1 1 354.410 2.506 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856537129 1007876997 /nfs/dbraw/zinc/87/69/97/1007876997.db2.gz OAPIPVVBGMPURZ-DOPJRALCSA-N 1 1 354.410 2.506 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000819902535 1008247883 /nfs/dbraw/zinc/24/78/83/1008247883.db2.gz FOHGPCYJMJWSHJ-KRWDZBQOSA-N 1 1 373.409 2.741 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000819902535 1008247885 /nfs/dbraw/zinc/24/78/85/1008247885.db2.gz FOHGPCYJMJWSHJ-KRWDZBQOSA-N 1 1 373.409 2.741 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1F ZINC000859293192 1008498296 /nfs/dbraw/zinc/49/82/96/1008498296.db2.gz UPXPIPJOEFVTLN-LJQANCHMSA-N 1 1 360.385 2.888 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1F ZINC000859293192 1008498297 /nfs/dbraw/zinc/49/82/97/1008498297.db2.gz UPXPIPJOEFVTLN-LJQANCHMSA-N 1 1 360.385 2.888 20 5 FFBDMO CC(C)c1cccc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])n1 ZINC001178458459 1008994547 /nfs/dbraw/zinc/99/45/47/1008994547.db2.gz HYMAWQQTKNCZBP-SJLPKXTDSA-N 1 1 362.474 2.636 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000823927012 1009284730 /nfs/dbraw/zinc/28/47/30/1009284730.db2.gz KNZUZBVDEZUYOX-AWEZNQCLSA-N 1 1 369.425 2.915 20 5 FFBDMO C[C@H]1CN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000823927012 1009284741 /nfs/dbraw/zinc/28/47/41/1009284741.db2.gz KNZUZBVDEZUYOX-AWEZNQCLSA-N 1 1 369.425 2.915 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CCC([NH+]2CCOCC2)CC1 ZINC000862213738 1009748066 /nfs/dbraw/zinc/74/80/66/1009748066.db2.gz VODQKXSLWZJSIB-UHFFFAOYSA-N 1 1 369.421 2.685 20 5 FFBDMO CC[N@H+](CCNC(=O)OC(C)(C)C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000863294989 1010162691 /nfs/dbraw/zinc/16/26/91/1010162691.db2.gz QMSQWNUJTAUDTK-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000863294989 1010162701 /nfs/dbraw/zinc/16/27/01/1010162701.db2.gz QMSQWNUJTAUDTK-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000868309207 1011239888 /nfs/dbraw/zinc/23/98/88/1011239888.db2.gz GWNGTNSAJGSUQM-WMZOPIPTSA-N 1 1 360.458 2.653 20 5 FFBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172911668 1012125551 /nfs/dbraw/zinc/12/55/51/1012125551.db2.gz UUKMKJCXNPSPBS-SJLPKXTDSA-N 1 1 374.437 2.686 20 5 FFBDMO O=C1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1F ZINC001173010820 1012181529 /nfs/dbraw/zinc/18/15/29/1012181529.db2.gz ZVRKKZUTXLJSCD-ZDUSSCGKSA-N 1 1 371.359 2.845 20 5 FFBDMO O=C1CC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1F ZINC001173010820 1012181535 /nfs/dbraw/zinc/18/15/35/1012181535.db2.gz ZVRKKZUTXLJSCD-ZDUSSCGKSA-N 1 1 371.359 2.845 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])[C@H]1C ZINC001173195871 1012338635 /nfs/dbraw/zinc/33/86/35/1012338635.db2.gz JUEOHMNMIDBDAF-RWMBFGLXSA-N 1 1 368.405 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2C[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C2)c1F ZINC001173196576 1012341690 /nfs/dbraw/zinc/34/16/90/1012341690.db2.gz NSRSFARAJAPTBY-KKYDWHDCSA-N 1 1 350.390 2.783 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2c1cnn2C ZINC001173220682 1012352388 /nfs/dbraw/zinc/35/23/88/1012352388.db2.gz BUVZUAGKQMYRQU-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cnn(C)c21 ZINC001173224348 1012357697 /nfs/dbraw/zinc/35/76/97/1012357697.db2.gz JOYUKZMMMCRNJK-YOEHRIQHSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 ZINC001173228832 1012364976 /nfs/dbraw/zinc/36/49/76/1012364976.db2.gz ZDNQKYSFLQGVIP-QOKNQOGYSA-N 1 1 366.421 2.516 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2cccnc2)C1 ZINC001173238504 1012384795 /nfs/dbraw/zinc/38/47/95/1012384795.db2.gz UFPWXCKJPPUMOU-MAUKXSAKSA-N 1 1 368.437 2.815 20 5 FFBDMO CCCC[N@@H+](CC)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173697628 1012901549 /nfs/dbraw/zinc/90/15/49/1012901549.db2.gz UBVJQHMGWYVRRT-UHFFFAOYSA-N 1 1 369.487 2.870 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001275748158 1012955726 /nfs/dbraw/zinc/95/57/26/1012955726.db2.gz IBKMLGQIQHCHBM-CQSZACIVSA-N 1 1 356.426 2.885 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000748349975 1017120286 /nfs/dbraw/zinc/12/02/86/1017120286.db2.gz MEJDPQAIMQAECL-HNNXBMFYSA-N 1 1 360.458 2.607 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])CC1 ZINC000748349975 1017120294 /nfs/dbraw/zinc/12/02/94/1017120294.db2.gz MEJDPQAIMQAECL-HNNXBMFYSA-N 1 1 360.458 2.607 20 5 FFBDMO CC(C)(C)CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001051291132 1017271610 /nfs/dbraw/zinc/27/16/10/1017271610.db2.gz LLKOJSMRKORMMT-QZTJIDSGSA-N 1 1 359.470 2.762 20 5 FFBDMO CC(C)(C)CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291132 1017271619 /nfs/dbraw/zinc/27/16/19/1017271619.db2.gz LLKOJSMRKORMMT-QZTJIDSGSA-N 1 1 359.470 2.762 20 5 FFBDMO CC(C)(C)CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001051291132 1017271633 /nfs/dbraw/zinc/27/16/33/1017271633.db2.gz LLKOJSMRKORMMT-QZTJIDSGSA-N 1 1 359.470 2.762 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000748844524 1017702962 /nfs/dbraw/zinc/70/29/62/1017702962.db2.gz RNIXDWOWKWHWMM-CYBMUJFWSA-N 1 1 364.402 2.580 20 5 FFBDMO c1c(-c2nc(-c3ccc4ccc5cccnc5c4n3)no2)nc2n1CC[NH2+]C2 ZINC001217522107 1032769680 /nfs/dbraw/zinc/76/96/80/1032769680.db2.gz QNBKWPPQKAXPSQ-UHFFFAOYSA-N 1 1 369.388 2.800 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@](CO)(c4ccccc4)C3)nc2c1 ZINC000801579822 1019138979 /nfs/dbraw/zinc/13/89/79/1019138979.db2.gz YHWGQWPUTOICLT-FQEVSTJZSA-N 1 1 366.421 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@](CO)(c4ccccc4)C3)nc2c1 ZINC000801579822 1019138985 /nfs/dbraw/zinc/13/89/85/1019138985.db2.gz YHWGQWPUTOICLT-FQEVSTJZSA-N 1 1 366.421 2.997 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000802018649 1019632645 /nfs/dbraw/zinc/63/26/45/1019632645.db2.gz RHXAOWKLWCPEEJ-ZIFCJYIRSA-N 1 1 354.410 2.682 20 5 FFBDMO Cn1nccc1C1=C[C@H]2CC[C@@H](C1)[N@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000802018646 1019633041 /nfs/dbraw/zinc/63/30/41/1019633041.db2.gz RHXAOWKLWCPEEJ-AOIWGVFYSA-N 1 1 354.410 2.682 20 5 FFBDMO CC(C)C(=O)NC1CC[NH+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CC1 ZINC000777955682 1020318037 /nfs/dbraw/zinc/31/80/37/1020318037.db2.gz XHCPSRTZSUKBJE-UHFFFAOYSA-N 1 1 371.441 2.652 20 5 FFBDMO CC[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CCCCC1 ZINC000726582968 1020488897 /nfs/dbraw/zinc/48/88/97/1020488897.db2.gz LFZMCRWBGJNOJF-UHFFFAOYSA-N 1 1 360.414 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1c1ccnn1C ZINC000932266318 1020759490 /nfs/dbraw/zinc/75/94/90/1020759490.db2.gz PZCIKFNGGNGNSS-KRWDZBQOSA-N 1 1 357.414 2.802 20 5 FFBDMO CN(C)CC[C@H]([NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccnc1 ZINC000903381663 1020815910 /nfs/dbraw/zinc/81/59/10/1020815910.db2.gz YJILUSYDGYZVSW-OKZBNKHCSA-N 1 1 372.473 2.953 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](C2CCOCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000933081778 1020954928 /nfs/dbraw/zinc/95/49/28/1020954928.db2.gz OLSKJVJHBFDCIE-KRWDZBQOSA-N 1 1 373.453 2.623 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H]1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000933777466 1021089008 /nfs/dbraw/zinc/08/90/08/1021089008.db2.gz SLWPNXRJGAMXTR-GOSISDBHSA-N 1 1 361.442 2.837 20 5 FFBDMO Cc1nn(C[N@H+]2CCCN(c3ccccc3)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000749944063 1021153983 /nfs/dbraw/zinc/15/39/83/1021153983.db2.gz KBJJSOSYYNXKMO-UHFFFAOYSA-N 1 1 366.425 2.818 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2Cc3ncccc3N3CCC[C@H]3C2)cc1 ZINC000934491660 1021259552 /nfs/dbraw/zinc/25/95/52/1021259552.db2.gz ZGBPUXYECMXUNW-QFBILLFUSA-N 1 1 354.410 2.508 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000935001237 1021516861 /nfs/dbraw/zinc/51/68/61/1021516861.db2.gz YWSWIDSUHMEVLT-UHFFFAOYSA-N 1 1 357.414 2.710 20 5 FFBDMO CCOC(=O)c1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)[nH]n1 ZINC001118268239 1022150480 /nfs/dbraw/zinc/15/04/80/1022150480.db2.gz UGUADFPJYZTLQW-UHFFFAOYSA-N 1 1 372.303 2.803 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000750569260 1022186309 /nfs/dbraw/zinc/18/63/09/1022186309.db2.gz ZNCZTBKQDPGUKB-CQSZACIVSA-N 1 1 362.474 2.901 20 5 FFBDMO CN(Cc1ccc(C[NH+](C)C)cc1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000750586839 1022209578 /nfs/dbraw/zinc/20/95/78/1022209578.db2.gz IJEQIQQRAPXOER-UHFFFAOYSA-N 1 1 367.409 2.805 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000155241451 1022230766 /nfs/dbraw/zinc/23/07/66/1022230766.db2.gz JQZPADGHZCPBKF-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808498 1022396850 /nfs/dbraw/zinc/39/68/50/1022396850.db2.gz DRDBXFBGOZIZDH-PBHICJAKSA-N 1 1 365.405 2.730 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1C(=O)O[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808498 1022396863 /nfs/dbraw/zinc/39/68/63/1022396863.db2.gz DRDBXFBGOZIZDH-PBHICJAKSA-N 1 1 365.405 2.730 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC(F)(F)CC1 ZINC001039583328 1022768072 /nfs/dbraw/zinc/76/80/72/1022768072.db2.gz MPRKCZQONBFARW-QKPAOTATSA-N 1 1 371.428 2.542 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CCC(F)(F)CC1 ZINC001039583328 1022768084 /nfs/dbraw/zinc/76/80/84/1022768084.db2.gz MPRKCZQONBFARW-QKPAOTATSA-N 1 1 371.428 2.542 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC(F)(F)CC1 ZINC001039583328 1022768095 /nfs/dbraw/zinc/76/80/95/1022768095.db2.gz MPRKCZQONBFARW-QKPAOTATSA-N 1 1 371.428 2.542 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc(F)ccc1[N+](=O)[O-] ZINC000751358998 1022808428 /nfs/dbraw/zinc/80/84/28/1022808428.db2.gz OGCYPHMALHQXDK-UHFFFAOYSA-N 1 1 355.329 2.553 20 5 FFBDMO C/C(=C\C(=O)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000751690049 1022911511 /nfs/dbraw/zinc/91/15/11/1022911511.db2.gz YEDWAWLCUWRYNG-IDCODDLRSA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC001218296359 1033091231 /nfs/dbraw/zinc/09/12/31/1033091231.db2.gz JWZKBOJINZSXOB-LIRRHRJNSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@H](Oc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC001218296359 1033091236 /nfs/dbraw/zinc/09/12/36/1033091236.db2.gz JWZKBOJINZSXOB-LIRRHRJNSA-N 1 1 357.410 2.845 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1Cc1ccccc1 ZINC000188328644 1023056570 /nfs/dbraw/zinc/05/65/70/1023056570.db2.gz AJKOXLSZBHKRKE-UKRRQHHQSA-N 1 1 354.410 2.570 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)[C@@H]2C1 ZINC001123302014 1023731432 /nfs/dbraw/zinc/73/14/32/1023731432.db2.gz VGULQNHDBBOSEU-WCQGTBRESA-N 1 1 370.356 2.658 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c1 ZINC000246202586 1025871688 /nfs/dbraw/zinc/87/16/88/1025871688.db2.gz BEFQZYZZWWFTNH-VQTJNVASSA-N 1 1 356.422 2.962 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839635016 1026769152 /nfs/dbraw/zinc/76/91/52/1026769152.db2.gz FMAWLLVNTAXMMV-YJBOKZPZSA-N 1 1 373.384 2.870 20 5 FFBDMO CC1(C)CN(C(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000839781734 1026824758 /nfs/dbraw/zinc/82/47/58/1026824758.db2.gz ZFPCKVGIPJZGJJ-QRVBRYPASA-N 1 1 371.481 2.801 20 5 FFBDMO O=C1[C@@H]2CCC[C@@H]2CN1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000840014468 1026912026 /nfs/dbraw/zinc/91/20/26/1026912026.db2.gz IFWLOOMINMDDQY-RDTXWAMCSA-N 1 1 359.426 2.654 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000840184319 1027003115 /nfs/dbraw/zinc/00/31/15/1027003115.db2.gz NOYGVUFXGCCAJW-GOSISDBHSA-N 1 1 358.398 2.691 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCCOc2ccc3c(c2)OCO3)ncc1[N+](=O)[O-] ZINC001158946447 1027201042 /nfs/dbraw/zinc/20/10/42/1027201042.db2.gz SQQPYXXAFYYLSJ-FNORWQNLSA-N 1 1 372.381 2.742 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](C/C=C\c2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160096964 1027588313 /nfs/dbraw/zinc/58/83/13/1027588313.db2.gz CQHZEFXPEPAUSU-ZSKSOVMSSA-N 1 1 355.438 2.503 20 5 FFBDMO O=C(NCCC1=CC[N@H+](C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160096964 1027588322 /nfs/dbraw/zinc/58/83/22/1027588322.db2.gz CQHZEFXPEPAUSU-ZSKSOVMSSA-N 1 1 355.438 2.503 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](C/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160096964 1027588326 /nfs/dbraw/zinc/58/83/26/1027588326.db2.gz CQHZEFXPEPAUSU-ZSKSOVMSSA-N 1 1 355.438 2.503 20 5 FFBDMO [NH3+][C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCN2CC[C@@H]2C1 ZINC001161423673 1028165026 /nfs/dbraw/zinc/16/50/26/1028165026.db2.gz JDXKGHLVZXSWIQ-GCJKJVERSA-N 1 1 359.473 2.779 20 5 FFBDMO C[NH+]1CCN(c2c3ccc(Br)cc3ncc2[N+](=O)[O-])CC1 ZINC001161970700 1028378898 /nfs/dbraw/zinc/37/88/98/1028378898.db2.gz NQALRFLHYKNHJJ-UHFFFAOYSA-N 1 1 351.204 2.657 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)c1nnc2ccccn21 ZINC001162185149 1028462877 /nfs/dbraw/zinc/46/28/77/1028462877.db2.gz BFHINNCTELTOCW-LBPRGKRZSA-N 1 1 352.398 2.799 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)c1nnc2ccccn21 ZINC001162185149 1028462889 /nfs/dbraw/zinc/46/28/89/1028462889.db2.gz BFHINNCTELTOCW-LBPRGKRZSA-N 1 1 352.398 2.799 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796110072 1028474134 /nfs/dbraw/zinc/47/41/34/1028474134.db2.gz AGNRUDXOESBWOQ-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796110072 1028474148 /nfs/dbraw/zinc/47/41/48/1028474148.db2.gz AGNRUDXOESBWOQ-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO CC[N@H+](Cc1ccc(C)cc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713033 1028581956 /nfs/dbraw/zinc/58/19/56/1028581956.db2.gz HXKJOJKDLCQJLM-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@@H+](Cc1ccc(C)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713033 1028581968 /nfs/dbraw/zinc/58/19/68/1028581968.db2.gz HXKJOJKDLCQJLM-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO CC[N@H+](Cc1ccc(C)cc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713033 1028581979 /nfs/dbraw/zinc/58/19/79/1028581979.db2.gz HXKJOJKDLCQJLM-RTBURBONSA-N 1 1 359.470 2.721 20 5 FFBDMO COCc1cccc([C@@H](CO)Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)c1 ZINC001162913486 1028709531 /nfs/dbraw/zinc/70/95/31/1028709531.db2.gz UHBHFDDVYIWRBR-IWAYRVGRSA-N 1 1 372.425 2.814 20 5 FFBDMO COc1cc(N2CC[NH+](C/C=C/c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC001163844802 1029088660 /nfs/dbraw/zinc/08/86/60/1029088660.db2.gz CSVNZKDHBHMJNE-VMPITWQZSA-N 1 1 354.410 2.834 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001163930661 1029118834 /nfs/dbraw/zinc/11/88/34/1029118834.db2.gz VINBHPCGSQBHGR-MRXNPFEDSA-N 1 1 366.437 2.602 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001163930661 1029118841 /nfs/dbraw/zinc/11/88/41/1029118841.db2.gz VINBHPCGSQBHGR-MRXNPFEDSA-N 1 1 366.437 2.602 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1F ZINC001164486911 1029296314 /nfs/dbraw/zinc/29/63/14/1029296314.db2.gz SLRVCGFQLLCNQW-OWCLPIDISA-N 1 1 372.400 2.690 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1 ZINC001165089413 1029380324 /nfs/dbraw/zinc/38/03/24/1029380324.db2.gz UNOIPYHBRCXXLH-GDBMZVCRSA-N 1 1 374.828 2.592 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1ncc([N+](=O)[O-])cc1N ZINC001165181864 1029436680 /nfs/dbraw/zinc/43/66/80/1029436680.db2.gz RTNNQCSVBOIDRF-KDOFPFPSSA-N 1 1 355.442 2.919 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)[C@@H]2CCCC[C@@H]21 ZINC000782277748 1029637951 /nfs/dbraw/zinc/63/79/51/1029637951.db2.gz RUVBNDZSKGNWKI-KBRIMQKVSA-N 1 1 372.425 2.831 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1O ZINC000782531057 1029734754 /nfs/dbraw/zinc/73/47/54/1029734754.db2.gz LGLXVEGCKHWEER-CZUORRHYSA-N 1 1 367.421 2.791 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](OCC2CC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782549835 1029742573 /nfs/dbraw/zinc/74/25/73/1029742573.db2.gz KBWHONAWLZDVMI-OAHLLOKOSA-N 1 1 365.405 2.954 20 5 FFBDMO Nc1ccc(C(=O)O[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000783442860 1030100821 /nfs/dbraw/zinc/10/08/21/1030100821.db2.gz AGYNIVNPOIUUKF-MRXNPFEDSA-N 1 1 355.394 2.998 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000783997196 1030401741 /nfs/dbraw/zinc/40/17/41/1030401741.db2.gz AUDXHEMTHCCGCL-HNNXBMFYSA-N 1 1 374.441 2.728 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@@H]3CCOC3)CC2)nc1-c1ccncc1 ZINC000784006542 1030410095 /nfs/dbraw/zinc/41/00/95/1030410095.db2.gz YVPFBIXAVDYDFX-MRXNPFEDSA-N 1 1 357.414 2.559 20 5 FFBDMO C/C(=C/C(=O)OC[C@@H]1C[N@@H+](CC(C)C)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000784870963 1030854693 /nfs/dbraw/zinc/85/46/93/1030854693.db2.gz JUGTWXMKMUZMFO-BXBOZWQASA-N 1 1 362.426 2.898 20 5 FFBDMO C[C@@H]1CC2(C[N@H+]1Cn1cc([N+](=O)[O-])c(-c3ccncc3)n1)CCOCC2 ZINC000842637989 1030867053 /nfs/dbraw/zinc/86/70/53/1030867053.db2.gz HMGUKYRTJKOTEZ-CQSZACIVSA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)Cn1nccc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842802384 1030964201 /nfs/dbraw/zinc/96/42/01/1030964201.db2.gz XKORFACDGPONGY-KRWDZBQOSA-N 1 1 372.425 2.879 20 5 FFBDMO CC(C)Cn1nccc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842802384 1030964220 /nfs/dbraw/zinc/96/42/20/1030964220.db2.gz XKORFACDGPONGY-KRWDZBQOSA-N 1 1 372.425 2.879 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC001149656458 1031563104 /nfs/dbraw/zinc/56/31/04/1031563104.db2.gz WCOJVGJCEXQGHH-HIFRSBDPSA-N 1 1 351.834 2.733 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]21 ZINC001149656460 1031563607 /nfs/dbraw/zinc/56/36/07/1031563607.db2.gz WCOJVGJCEXQGHH-UKRRQHHQSA-N 1 1 351.834 2.733 20 5 FFBDMO O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001149930623 1031622403 /nfs/dbraw/zinc/62/24/03/1031622403.db2.gz DOTBPUAIZDHWKY-MRXNPFEDSA-N 1 1 366.377 2.568 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c1 ZINC001115530557 1031787725 /nfs/dbraw/zinc/78/77/25/1031787725.db2.gz DGNQXNAQLGZSOQ-NVXWUHKLSA-N 1 1 363.433 2.708 20 5 FFBDMO CC(C)(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276901469 1033500691 /nfs/dbraw/zinc/50/06/91/1033500691.db2.gz OJTJXKYTLXPXHU-RGCFKVTRSA-N 1 1 351.491 2.648 20 5 FFBDMO CC(C)(C)CCC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276901469 1033500696 /nfs/dbraw/zinc/50/06/96/1033500696.db2.gz OJTJXKYTLXPXHU-RGCFKVTRSA-N 1 1 351.491 2.648 20 5 FFBDMO CC(C)(C)CCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276901469 1033500700 /nfs/dbraw/zinc/50/07/00/1033500700.db2.gz OJTJXKYTLXPXHU-RGCFKVTRSA-N 1 1 351.491 2.648 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NC[C@@H]1C[C@H](F)C[NH2+]1 ZINC001219635497 1033723003 /nfs/dbraw/zinc/72/30/03/1033723003.db2.gz JKCZSVACKJEEOU-FIKGOQFSSA-N 1 1 365.452 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](OC[C@H]1C[N@H+](Cc3ccccc3)CCO1)C2 ZINC001224955243 1034070559 /nfs/dbraw/zinc/07/05/59/1034070559.db2.gz FCNBIQMFSKQQMG-LEWJYISDSA-N 1 1 368.433 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](OC[C@H]1C[N@@H+](Cc3ccccc3)CCO1)C2 ZINC001224955243 1034070575 /nfs/dbraw/zinc/07/05/75/1034070575.db2.gz FCNBIQMFSKQQMG-LEWJYISDSA-N 1 1 368.433 2.980 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000831698865 1034219476 /nfs/dbraw/zinc/21/94/76/1034219476.db2.gz BTGIAKXNIANHSB-MSOLQXFVSA-N 1 1 361.442 2.542 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001225616455 1034335902 /nfs/dbraw/zinc/33/59/02/1034335902.db2.gz QJWOLBACDCZQLT-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001225712899 1034378315 /nfs/dbraw/zinc/37/83/15/1034378315.db2.gz LMIRIIPJGGDIKA-CAVOSLQRSA-N 1 1 354.790 2.794 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1 ZINC000832054884 1034523233 /nfs/dbraw/zinc/52/32/33/1034523233.db2.gz XBYXUTSNGXKQLK-NJAFHUGGSA-N 1 1 362.426 2.636 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2c(C(=O)OC)cc(Br)cc2[N+](=O)[O-])C1 ZINC001226358059 1034649666 /nfs/dbraw/zinc/64/96/66/1034649666.db2.gz OJWDNCJUIXGAAJ-SNVBAGLBSA-N 1 1 373.203 2.617 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CCCO1 ZINC001232229016 1035507411 /nfs/dbraw/zinc/50/74/11/1035507411.db2.gz XJLDTPBJLSRDAM-QGZVFWFLSA-N 1 1 351.406 2.547 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2cc(OC)cc3oc4c(O)ccc(O)c4c(=O)c23)C1 ZINC001227647228 1035656022 /nfs/dbraw/zinc/65/60/22/1035656022.db2.gz XDPVWVLPQLBFKO-NSHDSACASA-N 1 1 371.389 2.839 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3cncc([N+](=O)[O-])c3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001227990342 1035853030 /nfs/dbraw/zinc/85/30/30/1035853030.db2.gz KMUGWQAMEAZHFV-GDIGMMSISA-N 1 1 353.378 2.743 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc4cccc([N+](=O)[O-])c4n3)C[C@H]1[N@H+]2C ZINC001233837146 1036783205 /nfs/dbraw/zinc/78/32/05/1036783205.db2.gz VLUFEFMPUFEJJO-XJNFMUPTSA-N 1 1 371.393 2.689 20 5 FFBDMO O=[N+]([O-])c1cc([N+](=O)[O-])c(O[C@@H]2CCc3[nH+]ccn3C2)c2ncccc12 ZINC001233906838 1036819499 /nfs/dbraw/zinc/81/94/99/1036819499.db2.gz ZJJGNCVBNLNBPQ-SNVBAGLBSA-N 1 1 355.310 2.642 20 5 FFBDMO Cc1nc(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])cc1Br ZINC001231120849 1037480400 /nfs/dbraw/zinc/48/04/00/1037480400.db2.gz XTPDKMRMJKZVSS-SECBINFHSA-N 1 1 353.176 2.651 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3C[C@@H]4C(=O)CCC[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256103822 1038389572 /nfs/dbraw/zinc/38/95/72/1038389572.db2.gz PKJCJSUDIHNNRO-PBHICJAKSA-N 1 1 373.453 2.873 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1Cc1nnc(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258091888 1039166124 /nfs/dbraw/zinc/16/61/24/1039166124.db2.gz OUGRJQBQEGRETK-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1Cc1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1 ZINC001258091888 1039166129 /nfs/dbraw/zinc/16/61/29/1039166129.db2.gz OUGRJQBQEGRETK-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO C[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@]1(C)CCCNC1 ZINC001246917009 1039532332 /nfs/dbraw/zinc/53/23/32/1039532332.db2.gz YLCKEPKDLLJLLA-SFHVURJKSA-N 1 1 368.428 2.916 20 5 FFBDMO C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@]1(C)CCCNC1 ZINC001246917009 1039532346 /nfs/dbraw/zinc/53/23/46/1039532346.db2.gz YLCKEPKDLLJLLA-SFHVURJKSA-N 1 1 368.428 2.916 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559747 1040796957 /nfs/dbraw/zinc/79/69/57/1040796957.db2.gz ZULJBBJRRIWHEG-CVEARBPZSA-N 1 1 358.442 2.891 20 5 FFBDMO CCOC[C@@H]1Cn2nccc2C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559747 1040796969 /nfs/dbraw/zinc/79/69/69/1040796969.db2.gz ZULJBBJRRIWHEG-CVEARBPZSA-N 1 1 358.442 2.891 20 5 FFBDMO COc1cccnc1N1CC[NH+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001254564385 1040801308 /nfs/dbraw/zinc/80/13/08/1040801308.db2.gz KZNXRNGYTRFPMM-HNNXBMFYSA-N 1 1 356.426 2.752 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593983 1040821351 /nfs/dbraw/zinc/82/13/51/1040821351.db2.gz OTMBFGDDTXMBHI-IKGGRYGDSA-N 1 1 359.426 2.756 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001254593983 1040821354 /nfs/dbraw/zinc/82/13/54/1040821354.db2.gz OTMBFGDDTXMBHI-IKGGRYGDSA-N 1 1 359.426 2.756 20 5 FFBDMO COc1cccnc1O[C@@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611009 1040840128 /nfs/dbraw/zinc/84/01/28/1040840128.db2.gz NVCCHTVFNWVVKD-IAGOWNOFSA-N 1 1 355.394 2.619 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CC/C=C/c2ccccc2)CC1 ZINC001318886463 1044923877 /nfs/dbraw/zinc/92/38/77/1044923877.db2.gz RNYRUKWZQBJQPZ-HNJWQCIISA-N 1 1 371.481 2.973 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001319351237 1045119021 /nfs/dbraw/zinc/11/90/21/1045119021.db2.gz FYNXTZBHONFSCI-CZUORRHYSA-N 1 1 365.861 2.832 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC001539537480 1070654744 /nfs/dbraw/zinc/65/47/44/1070654744.db2.gz LVDPHIAXXZQLES-UHFFFAOYSA-N 1 1 370.247 2.819 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)c1ccn(-c2cc[nH+]cc2)n1 ZINC001321630650 1045735943 /nfs/dbraw/zinc/73/59/43/1045735943.db2.gz IUTKCYAAVJWFAG-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(NC(=O)C[NH+](C)C)cc1 ZINC001539703481 1070683866 /nfs/dbraw/zinc/68/38/66/1070683866.db2.gz JVJVVKSWWVJBLI-UHFFFAOYSA-N 1 1 370.409 2.964 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001328186921 1048216310 /nfs/dbraw/zinc/21/63/10/1048216310.db2.gz VQDPJYAFXWPNNW-DOTOQJQBSA-N 1 1 373.388 2.883 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001328436693 1048303705 /nfs/dbraw/zinc/30/37/05/1048303705.db2.gz KJMVXGXHWHJHML-IBGZPJMESA-N 1 1 366.421 2.895 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC001332627213 1048480505 /nfs/dbraw/zinc/48/05/05/1048480505.db2.gz FGHDQGNHJOWWMG-UHFFFAOYSA-N 1 1 371.441 2.626 20 5 FFBDMO Cc1nn(Cc2ccc(-c3nnc(C[NH+](C)C)o3)cc2)c(C)c1[N+](=O)[O-] ZINC001329075216 1048570855 /nfs/dbraw/zinc/57/08/55/1048570855.db2.gz QJTQDZYAEQACOT-UHFFFAOYSA-N 1 1 356.386 2.568 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001542185923 1071184062 /nfs/dbraw/zinc/18/40/62/1071184062.db2.gz GYZPPVRCXBLOHJ-CQSZACIVSA-N 1 1 354.410 2.728 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC001344875645 1052091843 /nfs/dbraw/zinc/09/18/43/1052091843.db2.gz MUWIVLIFMUONSA-CQSZACIVSA-N 1 1 350.419 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2CC[N@H+]2C2CCOCC2)c1 ZINC001344928318 1052138646 /nfs/dbraw/zinc/13/86/46/1052138646.db2.gz CZFKRLQMCNMYDI-CYBMUJFWSA-N 1 1 366.439 2.727 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001306977922 1052229956 /nfs/dbraw/zinc/22/99/56/1052229956.db2.gz CKTWPMJMEJVYKF-CQSZACIVSA-N 1 1 358.442 2.757 20 5 FFBDMO CCC[N@H+]1CC[C@@H](Cn2c(-c3cccc([N+](=O)[O-])c3)nnc2N(C)OC)C1 ZINC001307035998 1052242452 /nfs/dbraw/zinc/24/24/52/1052242452.db2.gz WDMQNXSFRZJTAO-CQSZACIVSA-N 1 1 374.445 2.583 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)ncc1[N+](=O)[O-] ZINC001307233920 1052273912 /nfs/dbraw/zinc/27/39/12/1052273912.db2.gz JYEJXKOQCVHRQU-HBNTYKKESA-N 1 1 355.236 2.813 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(Cc3cccc(F)c3)CC2)cc1 ZINC001307646733 1052330365 /nfs/dbraw/zinc/33/03/65/1052330365.db2.gz LABWSFVOIYNGAE-UHFFFAOYSA-N 1 1 359.401 2.931 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC001307874977 1052359020 /nfs/dbraw/zinc/35/90/20/1052359020.db2.gz GGLHPUKMKUXKFK-BXKDBHETSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C[C@H]1C ZINC001307874977 1052359024 /nfs/dbraw/zinc/35/90/24/1052359024.db2.gz GGLHPUKMKUXKFK-BXKDBHETSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)c1ccc2c(c1)CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001308044914 1052390962 /nfs/dbraw/zinc/39/09/62/1052390962.db2.gz ORIVRWGQGLHPEK-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO CC1(C)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1c1ccccc1 ZINC001308113284 1052410670 /nfs/dbraw/zinc/41/06/70/1052410670.db2.gz MIFOILXVHXNLHG-MSOLQXFVSA-N 1 1 358.442 2.668 20 5 FFBDMO CCc1ccc(S(=O)(=O)NCC[N@@H+]2CCCC[C@@H]2CC)cc1[N+](=O)[O-] ZINC001309175601 1052567765 /nfs/dbraw/zinc/56/77/65/1052567765.db2.gz VFWFFWNMAKUADF-HNNXBMFYSA-N 1 1 369.487 2.700 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001348454809 1054707294 /nfs/dbraw/zinc/70/72/94/1054707294.db2.gz JJGZPEDCTQYEMI-GASCZTMLSA-N 1 1 373.379 2.659 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)CCc4cccc([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001337558032 1054845149 /nfs/dbraw/zinc/84/51/49/1054845149.db2.gz FTOLQCNHTOBDRN-BGYRXZFFSA-N 1 1 357.454 2.862 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@H]2C1 ZINC001337834527 1055047103 /nfs/dbraw/zinc/04/71/03/1055047103.db2.gz PPBQMVYJPSBEAS-QWRKXWFKSA-N 1 1 358.225 2.972 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000847253516 1055320871 /nfs/dbraw/zinc/32/08/71/1055320871.db2.gz GUJLENLJUISXIK-UONOGXRCSA-N 1 1 362.386 2.558 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C[C@H](C)C1 ZINC001356351821 1055468023 /nfs/dbraw/zinc/46/80/23/1055468023.db2.gz NFAVJXSMPDLNMD-JKSUJKDBSA-N 1 1 372.473 2.594 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001543997505 1071579898 /nfs/dbraw/zinc/57/98/98/1071579898.db2.gz MPJSZVMPIXSIDJ-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)C1CCCCC1 ZINC001544038728 1071584311 /nfs/dbraw/zinc/58/43/11/1071584311.db2.gz ASPJHMWQWXKDOR-UHFFFAOYSA-N 1 1 372.828 2.964 20 5 FFBDMO CN1C[C@@H](C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC001353351258 1056324243 /nfs/dbraw/zinc/32/42/43/1056324243.db2.gz ICHWYMSAFBDRDB-HOJAQTOUSA-N 1 1 355.438 2.563 20 5 FFBDMO C[NH+](C)CC(C)(C)C1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC001339444969 1056459664 /nfs/dbraw/zinc/45/96/64/1056459664.db2.gz ZYQNRVWWMDJJNO-UHFFFAOYSA-N 1 1 373.457 2.911 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000849483721 1056869503 /nfs/dbraw/zinc/86/95/03/1056869503.db2.gz IVHVJYKGVKESEK-HZPDHXFCSA-N 1 1 371.441 2.619 20 5 FFBDMO C[N@@H+]1C[C@@H](O)C[C@@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874971 1058252759 /nfs/dbraw/zinc/25/27/59/1058252759.db2.gz QMLXMYFLTHJZLS-KXBFYZLASA-N 1 1 371.393 2.781 20 5 FFBDMO C[N@H+]1C[C@@H](O)C[C@@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874971 1058252778 /nfs/dbraw/zinc/25/27/78/1058252778.db2.gz QMLXMYFLTHJZLS-KXBFYZLASA-N 1 1 371.393 2.781 20 5 FFBDMO O=C(Nc1cccc2c1C[N@H+](C1CC1)C2)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001447229761 1058610653 /nfs/dbraw/zinc/61/06/53/1058610653.db2.gz MYQXPCRQZZHVCF-GOSISDBHSA-N 1 1 353.378 2.745 20 5 FFBDMO C[C@@H](c1nnc(N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)n1C)[N+](=O)[O-] ZINC001519598449 1058867575 /nfs/dbraw/zinc/86/75/75/1058867575.db2.gz VZGUHLDTHGVPGK-JONQDZQNSA-N 1 1 372.473 2.641 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC001452844614 1059305696 /nfs/dbraw/zinc/30/56/96/1059305696.db2.gz PMNJSZPVOQIJIR-KRWDZBQOSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC001452844614 1059305716 /nfs/dbraw/zinc/30/57/16/1059305716.db2.gz PMNJSZPVOQIJIR-KRWDZBQOSA-N 1 1 371.412 2.662 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001455618574 1059837450 /nfs/dbraw/zinc/83/74/50/1059837450.db2.gz BCVHAZIUSPKXGG-UHFFFAOYSA-N 1 1 371.422 2.907 20 5 FFBDMO CC(C)[N@@H+](CCO)CC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC001515985973 1059920386 /nfs/dbraw/zinc/92/03/86/1059920386.db2.gz AQBMBWQGPJMFEF-UHFFFAOYSA-N 1 1 356.854 2.562 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001355171868 1059957849 /nfs/dbraw/zinc/95/78/49/1059957849.db2.gz PQAVPINKEJSZLQ-ZWKOPEQDSA-N 1 1 357.332 2.684 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[nH+]c1 ZINC001456131337 1060019143 /nfs/dbraw/zinc/01/91/43/1060019143.db2.gz YNFUTVQMACZGFY-UHFFFAOYSA-N 1 1 369.425 2.740 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000848478483 1060110071 /nfs/dbraw/zinc/11/00/71/1060110071.db2.gz NYMVISCJJPZYKL-NVXWUHKLSA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000848478483 1060110080 /nfs/dbraw/zinc/11/00/80/1060110080.db2.gz NYMVISCJJPZYKL-NVXWUHKLSA-N 1 1 355.394 2.951 20 5 FFBDMO CN(C)C(=O)CC1CC[NH+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)CC1 ZINC000848484212 1060123514 /nfs/dbraw/zinc/12/35/14/1060123514.db2.gz YENYYPCLHWULSG-UHFFFAOYSA-N 1 1 371.441 2.606 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C12CCC2 ZINC000848489261 1060141811 /nfs/dbraw/zinc/14/18/11/1060141811.db2.gz RQIRPALYOGGQPJ-OKZBNKHCSA-N 1 1 373.453 2.758 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)[C@H]2C1 ZINC001521372845 1060561767 /nfs/dbraw/zinc/56/17/67/1060561767.db2.gz JYEXLZVYNAYHNC-JCGIZDLHSA-N 1 1 358.442 2.609 20 5 FFBDMO CCC[N@H+]1CC[C@H](Nc2cc(CC)nc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC001458503182 1060607715 /nfs/dbraw/zinc/60/77/15/1060607715.db2.gz DFMDAZAFZWIJNO-INIZCTEOSA-N 1 1 355.442 2.932 20 5 FFBDMO Cc1cc(C)c(CN2C(=O)N[C@@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c(C)[nH+]1 ZINC001458908085 1060678938 /nfs/dbraw/zinc/67/89/38/1060678938.db2.gz CXXRCONSCYJUNJ-IBGZPJMESA-N 1 1 368.393 2.882 20 5 FFBDMO C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(N2CCCOC2=O)cc1 ZINC001460173740 1060913582 /nfs/dbraw/zinc/91/35/82/1060913582.db2.gz VAEDOUVXKFLEQE-GFCCVEGCSA-N 1 1 359.386 2.526 20 5 FFBDMO C[C@@H]1[C@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227607 1060925317 /nfs/dbraw/zinc/92/53/17/1060925317.db2.gz RJIFMRAXXULWKV-MNOVXSKESA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@@H]1[C@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227607 1060925330 /nfs/dbraw/zinc/92/53/30/1060925330.db2.gz RJIFMRAXXULWKV-MNOVXSKESA-N 1 1 366.805 2.891 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCC[C@H](C3CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460834759 1061120809 /nfs/dbraw/zinc/12/08/09/1061120809.db2.gz NNBYRLLFUFTTAV-LPHOPBHVSA-N 1 1 373.453 2.839 20 5 FFBDMO CN(C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1 ZINC001476363985 1061398115 /nfs/dbraw/zinc/39/81/15/1061398115.db2.gz YDMVXKIXEOJPTN-LLVKDONJSA-N 1 1 371.235 2.915 20 5 FFBDMO CC(C)c1ccc(C[NH2+]CC(=O)N(C)OCC(F)(F)F)cc1[N+](=O)[O-] ZINC001461810038 1061412703 /nfs/dbraw/zinc/41/27/03/1061412703.db2.gz CTNJDATUBMYCRU-UHFFFAOYSA-N 1 1 363.336 2.760 20 5 FFBDMO O=C(NCCC[NH+](Cc1ccccc1)Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001361204643 1062118185 /nfs/dbraw/zinc/11/81/85/1062118185.db2.gz CVGCXRZLHCIWOG-WOJBJXKFSA-N 1 1 367.449 2.860 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@@H]2CNc2cccc(C)[nH+]2)n1 ZINC001465072843 1062966428 /nfs/dbraw/zinc/96/64/28/1062966428.db2.gz LEGIFKPPAAGAEL-CQSZACIVSA-N 1 1 355.398 2.718 20 5 FFBDMO O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001467548696 1063777713 /nfs/dbraw/zinc/77/77/13/1063777713.db2.gz UNSJGDYHXKYREI-ZIAGYGMSSA-N 1 1 370.409 2.733 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC001467858405 1063868407 /nfs/dbraw/zinc/86/84/07/1063868407.db2.gz CDLLJUIYYWCRJP-QGZVFWFLSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC001467858405 1063868412 /nfs/dbraw/zinc/86/84/12/1063868412.db2.gz CDLLJUIYYWCRJP-QGZVFWFLSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC12CCCCC2 ZINC001468225082 1063946915 /nfs/dbraw/zinc/94/69/15/1063946915.db2.gz HSBMBLHJRFWZQW-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC12CCCCC2 ZINC001468225082 1063946928 /nfs/dbraw/zinc/94/69/28/1063946928.db2.gz HSBMBLHJRFWZQW-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC12CCCCC2 ZINC001468225082 1063946938 /nfs/dbraw/zinc/94/69/38/1063946938.db2.gz HSBMBLHJRFWZQW-UHFFFAOYSA-N 1 1 357.414 2.562 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC001470779878 1064449047 /nfs/dbraw/zinc/44/90/47/1064449047.db2.gz JWCBVQSDJMIVMU-WMLDXEAASA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001471981336 1064878560 /nfs/dbraw/zinc/87/85/60/1064878560.db2.gz QMJYAGTVCJDBCH-UHFFFAOYSA-N 1 1 353.176 2.627 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCCNc2ccc(C)c[nH+]2)cc1OC ZINC001472010411 1064889805 /nfs/dbraw/zinc/88/98/05/1064889805.db2.gz DACGTUAQULKIPM-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO CCc1[nH+]ccn1CCNc1ncc([N+](=O)[O-])c(C)c1Br ZINC001472876400 1065164844 /nfs/dbraw/zinc/16/48/44/1065164844.db2.gz QJHMOBGKLCRVIN-UHFFFAOYSA-N 1 1 354.208 2.932 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-] ZINC001472878163 1065166013 /nfs/dbraw/zinc/16/60/13/1065166013.db2.gz JQUXPCIPLHOEPH-CYBMUJFWSA-N 1 1 362.430 2.538 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH+]2CCC(CO)CC2)o1 ZINC001473105695 1065201157 /nfs/dbraw/zinc/20/11/57/1065201157.db2.gz DDPIJJGDDLCAMI-UHFFFAOYSA-N 1 1 352.778 2.503 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNc2cc(-c3nn[nH]n3)sc2[N+](=O)[O-])C1 ZINC001575970196 1078182653 /nfs/dbraw/zinc/18/26/53/1078182653.db2.gz NSTUCRVNRORBNT-PHIMTYICSA-N 1 1 365.463 2.616 20 5 FFBDMO O=C(C[N@H+]1CCCc2ccccc2CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001473478228 1065271032 /nfs/dbraw/zinc/27/10/32/1065271032.db2.gz NEARJASXONXUGL-UHFFFAOYSA-N 1 1 365.433 2.975 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@H]1CCCCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC001473708455 1065326657 /nfs/dbraw/zinc/32/66/57/1065326657.db2.gz CIJHAPCNIRBNPV-CQSZACIVSA-N 1 1 367.450 2.561 20 5 FFBDMO C[C@]([NH3+])(C(=O)Nc1cccc(-c2cc[nH]n2)c1)c1cccc([N+](=O)[O-])c1 ZINC001576086567 1078194563 /nfs/dbraw/zinc/19/45/63/1078194563.db2.gz VPWBUANTQALWAS-GOSISDBHSA-N 1 1 351.366 2.798 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)cc1 ZINC001473874161 1065400424 /nfs/dbraw/zinc/40/04/24/1065400424.db2.gz YEZGZGXQCYQXLK-YLJYHZDGSA-N 1 1 356.422 2.899 20 5 FFBDMO CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CCN(C(=O)OC(C)(C)C)CC1 ZINC001473886116 1065406369 /nfs/dbraw/zinc/40/63/69/1065406369.db2.gz SQWQKXJPQVDGPY-UHFFFAOYSA-N 1 1 367.450 2.550 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCS(=O)(=O)CC3CC3)o2)cc1 ZINC001474045539 1065445311 /nfs/dbraw/zinc/44/53/11/1065445311.db2.gz CMFFTAXGUUXRIL-UHFFFAOYSA-N 1 1 364.423 2.769 20 5 FFBDMO NC(=O)c1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC001474065508 1065448548 /nfs/dbraw/zinc/44/85/48/1065448548.db2.gz QFHBMYGJRMBDEP-UHFFFAOYSA-N 1 1 352.350 2.639 20 5 FFBDMO COc1cc(C[NH2+][C@@H]2CCN(C(C)=O)c3ccccc32)c([N+](=O)[O-])cc1O ZINC001474073975 1065451874 /nfs/dbraw/zinc/45/18/74/1065451874.db2.gz UXHLBZZONMKKAS-OAHLLOKOSA-N 1 1 371.393 2.897 20 5 FFBDMO CCc1ccc2c(c1)CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001578263762 1078457553 /nfs/dbraw/zinc/45/75/53/1078457553.db2.gz WQYLNCVLXLPFGK-FQEVSTJZSA-N 1 1 353.422 2.916 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nn[nH]n2)c1NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001582803923 1079109788 /nfs/dbraw/zinc/10/97/88/1079109788.db2.gz CRGZZUNGMMLCCN-CYBMUJFWSA-N 1 1 357.418 2.594 20 5 FFBDMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC001557033954 1075801330 /nfs/dbraw/zinc/80/13/30/1075801330.db2.gz LHUNCLDDGNMXFI-MRXNPFEDSA-N 1 1 359.813 2.964 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)c1 ZINC001557763215 1075886111 /nfs/dbraw/zinc/88/61/11/1075886111.db2.gz UYBXOZRCAGSKRC-CQSZACIVSA-N 1 1 372.400 2.629 20 5 FFBDMO C[C@]12CN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@H]1C[N@@H+](Cc1ccccc1)C2 ZINC001558242337 1075966196 /nfs/dbraw/zinc/96/61/96/1075966196.db2.gz BIHHOTICQNIOBT-BEFAXECRSA-N 1 1 355.394 2.782 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001558999095 1076112584 /nfs/dbraw/zinc/11/25/84/1076112584.db2.gz ZGIQVJDSGKPIPN-SNVBAGLBSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC001558999095 1076112586 /nfs/dbraw/zinc/11/25/86/1076112586.db2.gz ZGIQVJDSGKPIPN-SNVBAGLBSA-N 1 1 368.231 2.666 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N[C@@H]3CCC[N@H+]4CCSC[C@H]34)c2c1 ZINC001559277867 1076145049 /nfs/dbraw/zinc/14/50/49/1076145049.db2.gz FTONSZGELDINQS-NVXWUHKLSA-N 1 1 374.466 2.565 20 5 FFBDMO C[C@@H](O)C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC001559953128 1076206696 /nfs/dbraw/zinc/20/66/96/1076206696.db2.gz IFUDMXHXKJSILD-SECBINFHSA-N 1 1 352.778 2.643 20 5 FFBDMO C[C@@H](O)C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC001559953128 1076206699 /nfs/dbraw/zinc/20/66/99/1076206699.db2.gz IFUDMXHXKJSILD-SECBINFHSA-N 1 1 352.778 2.643 20 5 FFBDMO COC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001559984887 1076210068 /nfs/dbraw/zinc/21/00/68/1076210068.db2.gz WPNJUASEEOXVOR-UHFFFAOYSA-N 1 1 363.414 2.731 20 5 FFBDMO Cc1ccc(NC(=O)C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC001560065919 1076221230 /nfs/dbraw/zinc/22/12/30/1076221230.db2.gz BXQGIUFIKHOMDS-IBGZPJMESA-N 1 1 357.410 2.647 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC001560872320 1076305708 /nfs/dbraw/zinc/30/57/08/1076305708.db2.gz IQJKMNUDCQBZMM-UHFFFAOYSA-N 1 1 371.397 2.837 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC001562587731 1076505776 /nfs/dbraw/zinc/50/57/76/1076505776.db2.gz OLTNJMNUHYZPIQ-UHFFFAOYSA-N 1 1 371.441 2.752 20 5 FFBDMO O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccc([N+](=O)[O-])cc1F ZINC001569503375 1077149917 /nfs/dbraw/zinc/14/99/17/1077149917.db2.gz MEUPJPQUBSVFCC-VQFNDLOPSA-N 1 1 355.369 2.594 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C[C@H]1C(C)(C)C ZINC001570910286 1077242293 /nfs/dbraw/zinc/24/22/93/1077242293.db2.gz BYYVFYSDOUNYQD-SFHVURJKSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1 ZINC001587222895 1079757202 /nfs/dbraw/zinc/75/72/02/1079757202.db2.gz FTSAYNOWTXJXLE-UHFFFAOYSA-N 1 1 351.406 2.861 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@H](O)c2nccn2C)C1 ZINC000131949880 251031431 /nfs/dbraw/zinc/03/14/31/251031431.db2.gz SJOKRMKIXGNPJR-KDOFPFPSSA-N 1 1 374.441 2.673 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000132097020 251045758 /nfs/dbraw/zinc/04/57/58/251045758.db2.gz MAMZGKLOWLGENO-LLVKDONJSA-N 1 1 364.320 2.765 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000132097020 251045759 /nfs/dbraw/zinc/04/57/59/251045759.db2.gz MAMZGKLOWLGENO-LLVKDONJSA-N 1 1 364.320 2.765 20 5 FFBDMO Cc1n[nH]cc1CCC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272496165 252053229 /nfs/dbraw/zinc/05/32/29/252053229.db2.gz FYYNCSUIZKLNFO-KRWDZBQOSA-N 1 1 354.414 2.672 20 5 FFBDMO COC(=O)c1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)[nH]1 ZINC000272722791 252114461 /nfs/dbraw/zinc/11/44/61/252114461.db2.gz FSJVWPQJCQOMRS-UHFFFAOYSA-N 1 1 359.382 2.753 20 5 FFBDMO COc1cc(NCc2ccccc2C[N@H+]2CC[C@@H](O)C2)ccc1[N+](=O)[O-] ZINC000273225661 252256280 /nfs/dbraw/zinc/25/62/80/252256280.db2.gz RBFYQLURNCLYMU-QGZVFWFLSA-N 1 1 357.410 2.782 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000273340148 252284250 /nfs/dbraw/zinc/28/42/50/252284250.db2.gz ACJSFMDWHQVELX-BETUJISGSA-N 1 1 368.409 2.745 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000366649109 512123035 /nfs/dbraw/zinc/12/30/35/512123035.db2.gz CGNREDMQFOLABG-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO COCCCCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000274109514 255834904 /nfs/dbraw/zinc/83/49/04/255834904.db2.gz TZXBENOEYMEPOP-UHFFFAOYSA-N 1 1 361.446 2.800 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000276360934 256092781 /nfs/dbraw/zinc/09/27/81/256092781.db2.gz AIVYBNGNTLRALK-HNNXBMFYSA-N 1 1 364.446 2.570 20 5 FFBDMO CCC[N@@H+](C)[C@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000285767823 257003708 /nfs/dbraw/zinc/00/37/08/257003708.db2.gz AASSRKZJTBVYLQ-CYBMUJFWSA-N 1 1 365.821 2.784 20 5 FFBDMO CCC[N@@H+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000285767823 257003710 /nfs/dbraw/zinc/00/37/10/257003710.db2.gz AASSRKZJTBVYLQ-CYBMUJFWSA-N 1 1 365.821 2.784 20 5 FFBDMO Cc1noc(C)c1C(C)(C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000285780138 257004397 /nfs/dbraw/zinc/00/43/97/257004397.db2.gz UBYBSEDUDDMKBY-UHFFFAOYSA-N 1 1 358.398 2.614 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000277930274 256256988 /nfs/dbraw/zinc/25/69/88/256256988.db2.gz YPEDYWPKNUHIMH-QGZVFWFLSA-N 1 1 353.394 2.690 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1N1CC[NH+](C2CC2)CC1 ZINC000278367717 256304388 /nfs/dbraw/zinc/30/43/88/256304388.db2.gz DIIXPHMWGXFOIP-UHFFFAOYSA-N 1 1 366.290 2.928 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000278430110 256311740 /nfs/dbraw/zinc/31/17/40/256311740.db2.gz CYGFRFPWNGESIH-CJNGLKHVSA-N 1 1 371.441 2.521 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000278475319 256316701 /nfs/dbraw/zinc/31/67/01/256316701.db2.gz IUZYFLQDXUXRLO-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO Nc1ccc(NC2CC[NH+](CC(=O)Nc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000283659585 256893860 /nfs/dbraw/zinc/89/38/60/256893860.db2.gz VYJORXBPPZKTGN-UHFFFAOYSA-N 1 1 369.425 2.692 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+][C@]2(CO)CCCc3ccccc32)c([N+](=O)[O-])c1 ZINC000284905447 256958004 /nfs/dbraw/zinc/95/80/04/256958004.db2.gz VAJIGTGLRAHVMB-SFHVURJKSA-N 1 1 357.366 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCSCC[C@@H]1C ZINC000286124286 257021307 /nfs/dbraw/zinc/02/13/07/257021307.db2.gz MJPTYWXFMSPGIZ-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000286545355 257042347 /nfs/dbraw/zinc/04/23/47/257042347.db2.gz OJFDDEJIYMADJC-XFJQVIQYSA-N 1 1 359.426 2.587 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000287826529 257118368 /nfs/dbraw/zinc/11/83/68/257118368.db2.gz PYPNKAZRDVMLCO-QGZVFWFLSA-N 1 1 373.409 2.668 20 5 FFBDMO CN1CC[NH+](CC2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000289391891 257278771 /nfs/dbraw/zinc/27/87/71/257278771.db2.gz FBZYADGERUKQEV-GQCTYLIASA-N 1 1 358.486 2.567 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCCO1 ZINC000289618957 257290368 /nfs/dbraw/zinc/29/03/68/257290368.db2.gz JSDMLVTVJMZBHQ-LBPRGKRZSA-N 1 1 370.837 2.871 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289707238 257294747 /nfs/dbraw/zinc/29/47/47/257294747.db2.gz CBNIGHRQBPPQOM-LSDHHAIUSA-N 1 1 357.414 2.682 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289707238 257294748 /nfs/dbraw/zinc/29/47/48/257294748.db2.gz CBNIGHRQBPPQOM-LSDHHAIUSA-N 1 1 357.414 2.682 20 5 FFBDMO C[C@@H]1[C@H](N2CCOCC2)CC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289722234 257295446 /nfs/dbraw/zinc/29/54/46/257295446.db2.gz IORBRXNLIWGCOT-RDTXWAMCSA-N 1 1 372.425 2.545 20 5 FFBDMO C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000289722234 257295447 /nfs/dbraw/zinc/29/54/47/257295447.db2.gz IORBRXNLIWGCOT-RDTXWAMCSA-N 1 1 372.425 2.545 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)[C@H](C)C1 ZINC000289875173 257304002 /nfs/dbraw/zinc/30/40/02/257304002.db2.gz NYSWEUUKDGENEO-CJNGLKHVSA-N 1 1 358.446 2.557 20 5 FFBDMO COc1ncccc1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000290201686 257319971 /nfs/dbraw/zinc/31/99/71/257319971.db2.gz PCHNVJMBESMVGD-KRWDZBQOSA-N 1 1 367.409 2.654 20 5 FFBDMO Cc1ccc(C[N@H+]2CCC[C@@H](CNC(=O)C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000291002283 257372334 /nfs/dbraw/zinc/37/23/34/257372334.db2.gz AXTSXOWPYCYTLZ-ZDUSSCGKSA-N 1 1 359.348 2.794 20 5 FFBDMO Cc1csc2nc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])cc(=O)n12 ZINC000292096296 257458993 /nfs/dbraw/zinc/45/89/93/257458993.db2.gz HGSNASKQGLPWIF-UHFFFAOYSA-N 1 1 358.423 2.998 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000302177208 258092715 /nfs/dbraw/zinc/09/27/15/258092715.db2.gz OVEAETJKHVPBBF-IFXJQAMLSA-N 1 1 368.437 2.887 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000330836934 258171740 /nfs/dbraw/zinc/17/17/40/258171740.db2.gz TWHIDYZCBKOKAP-PWSUYJOCSA-N 1 1 357.863 2.939 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000332088245 258213663 /nfs/dbraw/zinc/21/36/63/258213663.db2.gz JWPLJCBOSSBOOI-JKSUJKDBSA-N 1 1 361.442 2.757 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000408090919 512997175 /nfs/dbraw/zinc/99/71/75/512997175.db2.gz VXBOJXNXKQQLSK-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000408090919 512997186 /nfs/dbraw/zinc/99/71/86/512997186.db2.gz VXBOJXNXKQQLSK-ZJUUUORDSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000064857606 506236614 /nfs/dbraw/zinc/23/66/14/506236614.db2.gz RCRMYMIPRFFEBW-FPMFFAJLSA-N 1 1 367.833 2.759 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000375209494 512212502 /nfs/dbraw/zinc/21/25/02/512212502.db2.gz FXZVIVXIMFUXBS-KRWDZBQOSA-N 1 1 354.410 2.726 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000377347242 512226195 /nfs/dbraw/zinc/22/61/95/512226195.db2.gz QVJKBELFWPQPOR-CXAGYDPISA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000066377695 506500603 /nfs/dbraw/zinc/50/06/03/506500603.db2.gz JXEBVYCAEYMYPY-JZXOWHBKSA-N 1 1 363.458 2.547 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000066474333 506530435 /nfs/dbraw/zinc/53/04/35/506530435.db2.gz SKXQGIPMWDDVTL-HZPDHXFCSA-N 1 1 363.458 2.990 20 5 FFBDMO Cc1c(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cccc1[N+](=O)[O-] ZINC000041664548 506540797 /nfs/dbraw/zinc/54/07/97/506540797.db2.gz KSISKKDLUBZJOA-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1noc(C2CC[NH+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)CC2)n1 ZINC000054679110 506603252 /nfs/dbraw/zinc/60/32/52/506603252.db2.gz IPLUQQRRGZPZPU-UHFFFAOYSA-N 1 1 360.370 2.532 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043149515 506708928 /nfs/dbraw/zinc/70/89/28/506708928.db2.gz PLUROWDBGPXVNL-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043149515 506708933 /nfs/dbraw/zinc/70/89/33/506708933.db2.gz PLUROWDBGPXVNL-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1ccc([C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[NH+](C)C)cc1 ZINC000067267894 506810183 /nfs/dbraw/zinc/81/01/83/506810183.db2.gz YEBSMIBSVDLASX-KRWDZBQOSA-N 1 1 367.409 2.812 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c1 ZINC000067547282 506920474 /nfs/dbraw/zinc/92/04/74/506920474.db2.gz FNXVGMWESHSAIL-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H](c2ccsc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000045809718 507024823 /nfs/dbraw/zinc/02/48/23/507024823.db2.gz HVEGYNIAQCDYLH-OAHLLOKOSA-N 1 1 369.468 2.546 20 5 FFBDMO COc1ccc(CC(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000067911302 507050407 /nfs/dbraw/zinc/05/04/07/507050407.db2.gz SXOBXCXVFMKYLA-AWEZNQCLSA-N 1 1 363.458 2.773 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000067961860 507069230 /nfs/dbraw/zinc/06/92/30/507069230.db2.gz CKBWWDRXSJJLLF-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO CCOC(=O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000067961860 507069236 /nfs/dbraw/zinc/06/92/36/507069236.db2.gz CKBWWDRXSJJLLF-MRXNPFEDSA-N 1 1 363.414 2.649 20 5 FFBDMO Cc1c(NC(=O)CN2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000016445823 507090280 /nfs/dbraw/zinc/09/02/80/507090280.db2.gz WGRSSPBCPFQPSX-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822303 507268172 /nfs/dbraw/zinc/26/81/72/507268172.db2.gz QSTXFQWUSPPZNZ-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000047145531 507271692 /nfs/dbraw/zinc/27/16/92/507271692.db2.gz HUFIMNVYTOMTLD-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO O=C(NCc1cccc(C[NH+]2CCOCC2)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000047322862 507308604 /nfs/dbraw/zinc/30/86/04/507308604.db2.gz YTHAHAAUDLHTCL-UHFFFAOYSA-N 1 1 370.409 2.749 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000371328811 512332859 /nfs/dbraw/zinc/33/28/59/512332859.db2.gz ZGRFKVMFUPHXBK-CVEARBPZSA-N 1 1 356.426 2.854 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000069036120 507385467 /nfs/dbraw/zinc/38/54/67/507385467.db2.gz CJJCACFLQBULCC-HNNXBMFYSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1C[NH+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)O1 ZINC000048361436 507507804 /nfs/dbraw/zinc/50/78/04/507507804.db2.gz HVUUHXCJMVUAHQ-ZIAGYGMSSA-N 1 1 373.409 2.727 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000064735609 507807635 /nfs/dbraw/zinc/80/76/35/507807635.db2.gz AXRUUGOBIWWYFS-HLLBOEOZSA-N 1 1 361.442 2.837 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000072725438 507848180 /nfs/dbraw/zinc/84/81/80/507848180.db2.gz XMXZCGOLBDNOOT-AWEZNQCLSA-N 1 1 368.865 2.993 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000108305860 507886043 /nfs/dbraw/zinc/88/60/43/507886043.db2.gz IRJKUBKZTNWJIQ-SMDDNHRTSA-N 1 1 367.833 2.616 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c([N+](=O)[O-])c1 ZINC000090004205 507900089 /nfs/dbraw/zinc/90/00/89/507900089.db2.gz NZCVAFPRVALXHZ-HNNXBMFYSA-N 1 1 374.441 2.670 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[NH+]1CCN(C)CC1 ZINC000090089316 507907947 /nfs/dbraw/zinc/90/79/47/507907947.db2.gz LSUBOSLTBCFONF-OAHLLOKOSA-N 1 1 355.442 2.705 20 5 FFBDMO Nc1c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(F)cc1[N+](=O)[O-] ZINC000108625012 507909619 /nfs/dbraw/zinc/90/96/19/507909619.db2.gz ZLZWZHPAGJDRGJ-OAHLLOKOSA-N 1 1 372.400 2.711 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3c(C)cccc3[N+](=O)[O-])CC2)CC1 ZINC000108847165 507921859 /nfs/dbraw/zinc/92/18/59/507921859.db2.gz SEJMIRHCOSSQKH-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(n4ccnc4)CC3)o2)cc1 ZINC000109794077 507987241 /nfs/dbraw/zinc/98/72/41/507987241.db2.gz ZOJYFMNESTUHPF-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO COCC[N@@H+](CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000093006014 508114037 /nfs/dbraw/zinc/11/40/37/508114037.db2.gz QUDHKAPHYGRGQI-UHFFFAOYSA-N 1 1 364.373 2.967 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000093282271 508134215 /nfs/dbraw/zinc/13/42/15/508134215.db2.gz OMMPRFUOBKGCEE-AWEZNQCLSA-N 1 1 350.415 2.885 20 5 FFBDMO COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000093298381 508135900 /nfs/dbraw/zinc/13/59/00/508135900.db2.gz DGCWZMXSFSRZDW-AWEZNQCLSA-N 1 1 350.415 2.885 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000081095402 508136550 /nfs/dbraw/zinc/13/65/50/508136550.db2.gz ZMQCLQMABAHUAS-CZUORRHYSA-N 1 1 359.430 2.807 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000076481269 508212095 /nfs/dbraw/zinc/21/20/95/508212095.db2.gz YHKBHFBNURRJNA-CXAGYDPISA-N 1 1 360.458 2.971 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000112978955 508236669 /nfs/dbraw/zinc/23/66/69/508236669.db2.gz ANFQVJZRNRGSLY-IBGZPJMESA-N 1 1 372.421 2.952 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088606073 508378918 /nfs/dbraw/zinc/37/89/18/508378918.db2.gz BGTSCZJBOZEYNN-GOSISDBHSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088606073 508378920 /nfs/dbraw/zinc/37/89/20/508378920.db2.gz BGTSCZJBOZEYNN-GOSISDBHSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1 ZINC000133600089 508422837 /nfs/dbraw/zinc/42/28/37/508422837.db2.gz NUKJZUSNAXNDJH-MLGOLLRUSA-N 1 1 365.405 2.831 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000133779928 508448377 /nfs/dbraw/zinc/44/83/77/508448377.db2.gz MZMQTUPOBVSRRH-BXKDBHETSA-N 1 1 357.332 2.969 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668492 508490382 /nfs/dbraw/zinc/49/03/82/508490382.db2.gz NGVQRVTYZJITOK-WOPDTQHZSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000152668492 508490384 /nfs/dbraw/zinc/49/03/84/508490384.db2.gz NGVQRVTYZJITOK-WOPDTQHZSA-N 1 1 355.822 2.811 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCO)CCOCC(F)(F)F ZINC000116280737 508495042 /nfs/dbraw/zinc/49/50/42/508495042.db2.gz MWTYNIUALCJPSS-UHFFFAOYSA-N 1 1 356.728 2.621 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCO)CCOCC(F)(F)F ZINC000116280737 508495043 /nfs/dbraw/zinc/49/50/43/508495043.db2.gz MWTYNIUALCJPSS-UHFFFAOYSA-N 1 1 356.728 2.621 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122382552 508526262 /nfs/dbraw/zinc/52/62/62/508526262.db2.gz CUHVJKYPDHMZGU-INIZCTEOSA-N 1 1 358.442 2.753 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)COCc1ccccc1F)C2 ZINC000153400637 508578983 /nfs/dbraw/zinc/57/89/83/508578983.db2.gz LWPBKFKRPOKUGK-MRXNPFEDSA-N 1 1 360.385 2.670 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)COCc1ccccc1F)C2 ZINC000153400637 508578987 /nfs/dbraw/zinc/57/89/87/508578987.db2.gz LWPBKFKRPOKUGK-MRXNPFEDSA-N 1 1 360.385 2.670 20 5 FFBDMO O=c1c2ccccc2ncn1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135230424 508591759 /nfs/dbraw/zinc/59/17/59/508591759.db2.gz PMSARXGHJKMANI-UHFFFAOYSA-N 1 1 364.405 2.969 20 5 FFBDMO O=c1c2ccccc2ncn1CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135230424 508591764 /nfs/dbraw/zinc/59/17/64/508591764.db2.gz PMSARXGHJKMANI-UHFFFAOYSA-N 1 1 364.405 2.969 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157855712 508622591 /nfs/dbraw/zinc/62/25/91/508622591.db2.gz DZSAOFRDXZVBED-NSHDSACASA-N 1 1 364.427 2.561 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157855712 508622593 /nfs/dbraw/zinc/62/25/93/508622593.db2.gz DZSAOFRDXZVBED-NSHDSACASA-N 1 1 364.427 2.561 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cc(Br)ccc1F ZINC000157883130 508626645 /nfs/dbraw/zinc/62/66/45/508626645.db2.gz ZRAUZLKZMIXMCU-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cc(Br)ccc1F ZINC000157883130 508626649 /nfs/dbraw/zinc/62/66/49/508626649.db2.gz ZRAUZLKZMIXMCU-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H]2CCCc3c2cnn3C)c([N+](=O)[O-])c1 ZINC000135593984 508629517 /nfs/dbraw/zinc/62/95/17/508629517.db2.gz YYWACIFTAPMQDG-OAHLLOKOSA-N 1 1 360.414 2.725 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000123387384 508678784 /nfs/dbraw/zinc/67/87/84/508678784.db2.gz VMCLFZJDHJGXEK-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123419124 508684037 /nfs/dbraw/zinc/68/40/37/508684037.db2.gz ZECRQZLQAFJAKE-HOCLYGCPSA-N 1 1 360.458 2.750 20 5 FFBDMO CN(C(=O)[C@@H](c1ccccc1)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000158306872 508686295 /nfs/dbraw/zinc/68/62/95/508686295.db2.gz OYYXXUMCZYXSFZ-LJQANCHMSA-N 1 1 368.437 2.546 20 5 FFBDMO CCO[C@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002467 508696271 /nfs/dbraw/zinc/69/62/71/508696271.db2.gz MCSVMBMEFQLVLZ-ROUUACIJSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002467 508696272 /nfs/dbraw/zinc/69/62/72/508696272.db2.gz MCSVMBMEFQLVLZ-ROUUACIJSA-N 1 1 373.453 2.763 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158596104 508726624 /nfs/dbraw/zinc/72/66/24/508726624.db2.gz JHXHZGVBCWSGJM-KRWDZBQOSA-N 1 1 362.474 2.949 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+](CCO)Cc3cccnc3)o2)c1 ZINC000129650391 508750623 /nfs/dbraw/zinc/75/06/23/508750623.db2.gz BYKVWFCXLYNLSS-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)(C)CN1CCOCC1 ZINC000123874851 508751561 /nfs/dbraw/zinc/75/15/61/508751561.db2.gz LJQNJCDHFPSESP-UHFFFAOYSA-N 1 1 362.430 2.526 20 5 FFBDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CCCC1 ZINC000159219174 508809840 /nfs/dbraw/zinc/80/98/40/508809840.db2.gz FMWMKKMPOOILER-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000124322104 508814996 /nfs/dbraw/zinc/81/49/96/508814996.db2.gz LFHSQGZGOXFUBT-DOTOQJQBSA-N 1 1 358.442 2.753 20 5 FFBDMO CN(C)C(=O)c1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)[nH]1 ZINC000130726898 508837197 /nfs/dbraw/zinc/83/71/97/508837197.db2.gz LNUCNCPHBXYCJD-UHFFFAOYSA-N 1 1 372.425 2.668 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CCC(=O)OC(C)(C)C ZINC000150830076 508902842 /nfs/dbraw/zinc/90/28/42/508902842.db2.gz PZTBMZPPDVOSFV-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000125101279 508931149 /nfs/dbraw/zinc/93/11/49/508931149.db2.gz WZZZUYFJGPKUKJ-UHFFFAOYSA-N 1 1 356.213 2.962 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000160367762 508976678 /nfs/dbraw/zinc/97/66/78/508976678.db2.gz VDGBPRIOWPZZNA-LJQANCHMSA-N 1 1 353.422 2.961 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000160367762 508976680 /nfs/dbraw/zinc/97/66/80/508976680.db2.gz VDGBPRIOWPZZNA-LJQANCHMSA-N 1 1 353.422 2.961 20 5 FFBDMO COc1ccc(CN2CC[NH+]([C@@H](C)c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000120505050 509009747 /nfs/dbraw/zinc/00/97/47/509009747.db2.gz UWODXYPOENFCRK-HNNXBMFYSA-N 1 1 356.426 2.877 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@@H+](C)C1CC1 ZINC000132320176 509014549 /nfs/dbraw/zinc/01/45/49/509014549.db2.gz XMZNIQXGMGRPNN-LBPRGKRZSA-N 1 1 367.471 2.546 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000151627834 509055456 /nfs/dbraw/zinc/05/54/56/509055456.db2.gz HDZZCZGKLGPFOO-CYBMUJFWSA-N 1 1 370.247 2.500 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000172712613 509191058 /nfs/dbraw/zinc/19/10/58/509191058.db2.gz HTYONFXBKWVSCB-UHFFFAOYSA-N 1 1 353.422 2.524 20 5 FFBDMO Cc1c(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000172755286 509214530 /nfs/dbraw/zinc/21/45/30/509214530.db2.gz UDKRQIYYCBPWOA-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO C[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000172761868 509219461 /nfs/dbraw/zinc/21/94/61/509219461.db2.gz IUHFWEIRDDDGSW-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1 ZINC000248068519 509229032 /nfs/dbraw/zinc/22/90/32/509229032.db2.gz QALPSCAZVBXVPE-FUHWJXTLSA-N 1 1 355.394 2.779 20 5 FFBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1(O)CCOCC1 ZINC000188839498 509287422 /nfs/dbraw/zinc/28/74/22/509287422.db2.gz CQVPCMCMOICDDA-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO C[C@H]1CN(C)c2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248474789 509335983 /nfs/dbraw/zinc/33/59/83/509335983.db2.gz XJHJMEHATADSRF-DOTOQJQBSA-N 1 1 371.437 2.675 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000248473138 509336311 /nfs/dbraw/zinc/33/63/11/509336311.db2.gz WRDMEHURAVYZBO-UNEWFSDZSA-N 1 1 352.456 2.695 20 5 FFBDMO CCCS(=O)(=O)NC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182658391 509355574 /nfs/dbraw/zinc/35/55/74/509355574.db2.gz IDRBLIFMPUALRD-AWEZNQCLSA-N 1 1 369.487 2.758 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[N@H+]1C1CC1 ZINC000185837997 509378755 /nfs/dbraw/zinc/37/87/55/509378755.db2.gz JNIJYKWZJMJAOO-ZYHUDNBSSA-N 1 1 352.822 2.673 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCS[C@@H](C)CC2)c([N+](=O)[O-])c1 ZINC000192176020 509390161 /nfs/dbraw/zinc/39/01/61/509390161.db2.gz OFEQTCRIXCNVLJ-LBPRGKRZSA-N 1 1 353.444 2.759 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCS[C@H](C)CC1 ZINC000192192798 509396625 /nfs/dbraw/zinc/39/66/25/509396625.db2.gz OFBNQNZIIXQEMT-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO Cc1ccc(C(=O)N[C@H](C)C2([NH+]3CCOCC3)CCCC2)cc1[N+](=O)[O-] ZINC000173181676 509442838 /nfs/dbraw/zinc/44/28/38/509442838.db2.gz GMNNAQGQLKVZJB-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000248716307 509449268 /nfs/dbraw/zinc/44/92/68/509449268.db2.gz BWGZVRNRUNFATM-WMLDXEAASA-N 1 1 369.421 2.854 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)[C@H](C)C1 ZINC000173259545 509485086 /nfs/dbraw/zinc/48/50/86/509485086.db2.gz XMICXBFCERNSMY-CJNGLKHVSA-N 1 1 369.487 2.562 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000248880613 509526212 /nfs/dbraw/zinc/52/62/12/509526212.db2.gz RPWNZFGHIWXNIO-RDTXWAMCSA-N 1 1 369.421 2.854 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000248907188 509540172 /nfs/dbraw/zinc/54/01/72/509540172.db2.gz UYOOUKDRAJTEKV-HNAYVOBHSA-N 1 1 369.421 2.610 20 5 FFBDMO CNC(=O)C1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000179821171 509637335 /nfs/dbraw/zinc/63/73/35/509637335.db2.gz LPZZXORXFIGMRH-UHFFFAOYSA-N 1 1 360.439 2.676 20 5 FFBDMO Cc1sc(C(=O)NCCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000176691715 509644925 /nfs/dbraw/zinc/64/49/25/509644925.db2.gz OHWXDTTTXFHECE-TXEJJXNPSA-N 1 1 355.460 2.584 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000183210694 509659168 /nfs/dbraw/zinc/65/91/68/509659168.db2.gz BVAFZRNWQJWYKF-QWRGUYRKSA-N 1 1 357.863 2.891 20 5 FFBDMO Cn1nc2c(cc1=O)C[N@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CC2 ZINC000180014004 509710013 /nfs/dbraw/zinc/71/00/13/509710013.db2.gz AAMVBYGDHNMRQR-UHFFFAOYSA-N 1 1 366.377 2.507 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192959747 509716386 /nfs/dbraw/zinc/71/63/86/509716386.db2.gz MVLZUFSIMIZSQI-HNNXBMFYSA-N 1 1 370.409 2.710 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183375767 509747061 /nfs/dbraw/zinc/74/70/61/509747061.db2.gz OJUUWBOWTRDEFE-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](Oc2cccc(F)c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183375767 509747066 /nfs/dbraw/zinc/74/70/66/509747066.db2.gz OJUUWBOWTRDEFE-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000183388286 509756028 /nfs/dbraw/zinc/75/60/28/509756028.db2.gz NLUMZXNKLPSUEL-UHFFFAOYSA-N 1 1 353.378 2.631 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249822345 509768852 /nfs/dbraw/zinc/76/88/52/509768852.db2.gz OILDRRMLQTWFIJ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000249822345 509768853 /nfs/dbraw/zinc/76/88/53/509768853.db2.gz OILDRRMLQTWFIJ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO C[C@H]1CN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1CC(C)(C)O ZINC000189884874 509809026 /nfs/dbraw/zinc/80/90/26/509809026.db2.gz RSHDFRWAJUWUHD-AWEZNQCLSA-N 1 1 374.441 2.527 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173845942 509812161 /nfs/dbraw/zinc/81/21/61/509812161.db2.gz FOLIDJFQCNANDU-ZBFHGGJFSA-N 1 1 367.471 2.539 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000173889121 509835884 /nfs/dbraw/zinc/83/58/84/509835884.db2.gz HYILHIGSWBSHNE-GFCCVEGCSA-N 1 1 373.400 2.978 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000268353952 509884243 /nfs/dbraw/zinc/88/42/43/509884243.db2.gz NSFPJDJLXILXSR-INIZCTEOSA-N 1 1 374.340 2.590 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000268353952 509884250 /nfs/dbraw/zinc/88/42/50/509884250.db2.gz NSFPJDJLXILXSR-INIZCTEOSA-N 1 1 374.340 2.590 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000177138842 509895122 /nfs/dbraw/zinc/89/51/22/509895122.db2.gz DWXKROFEJHXYPI-ZYHUDNBSSA-N 1 1 370.356 2.897 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019695 509906621 /nfs/dbraw/zinc/90/66/21/509906621.db2.gz ACQRXGPNAJCHMI-CRAIPNDOSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019695 509906625 /nfs/dbraw/zinc/90/66/25/509906625.db2.gz ACQRXGPNAJCHMI-CRAIPNDOSA-N 1 1 365.430 2.677 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000245408744 509911023 /nfs/dbraw/zinc/91/10/23/509911023.db2.gz ISMQWZOOEWKVPE-CABCVRRESA-N 1 1 371.224 2.688 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432935 509928999 /nfs/dbraw/zinc/92/89/99/509928999.db2.gz OYJZDIHMMSOEPM-BLLLJJGKSA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000245438038 509932789 /nfs/dbraw/zinc/93/27/89/509932789.db2.gz RYRGAODWMDIWLJ-XJKSGUPXSA-N 1 1 359.430 2.807 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1 ZINC000193529157 509951312 /nfs/dbraw/zinc/95/13/12/509951312.db2.gz JKXKBQSKOUNXET-KRWDZBQOSA-N 1 1 356.426 2.880 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180531206 509969548 /nfs/dbraw/zinc/96/95/48/509969548.db2.gz CHIPZPVINPFHAW-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000245581229 510019530 /nfs/dbraw/zinc/01/95/30/510019530.db2.gz JHAHLRBDEBUFDO-CLCXKQKWSA-N 1 1 357.410 2.607 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000245581229 510019540 /nfs/dbraw/zinc/01/95/40/510019540.db2.gz JHAHLRBDEBUFDO-CLCXKQKWSA-N 1 1 357.410 2.607 20 5 FFBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000245581235 510020707 /nfs/dbraw/zinc/02/07/07/510020707.db2.gz JHAHLRBDEBUFDO-SPYBWZPUSA-N 1 1 357.410 2.607 20 5 FFBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000245581235 510020713 /nfs/dbraw/zinc/02/07/13/510020713.db2.gz JHAHLRBDEBUFDO-SPYBWZPUSA-N 1 1 357.410 2.607 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000261680679 510025477 /nfs/dbraw/zinc/02/54/77/510025477.db2.gz BWHNYHRRSDAUIN-QGZVFWFLSA-N 1 1 374.828 2.833 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000245631612 510049883 /nfs/dbraw/zinc/04/98/83/510049883.db2.gz IBMBRSMXNJWZTA-QZTJIDSGSA-N 1 1 354.410 2.839 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000177425874 510050743 /nfs/dbraw/zinc/05/07/43/510050743.db2.gz JXKKXJSJZSHVDP-PIGZYNQJSA-N 1 1 360.370 2.591 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CN(C)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000190310364 510055171 /nfs/dbraw/zinc/05/51/71/510055171.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000190310364 510055175 /nfs/dbraw/zinc/05/51/75/510055175.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000190310364 510055180 /nfs/dbraw/zinc/05/51/80/510055180.db2.gz UAVBDTDWEAHHRR-OAQYLSRUSA-N 1 1 369.465 2.972 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C1 ZINC000174542552 510169397 /nfs/dbraw/zinc/16/93/97/510169397.db2.gz YUBUIWWWBSQZTB-ZDUSSCGKSA-N 1 1 364.402 2.534 20 5 FFBDMO COc1ccc(CN(CC[NH+]2CCOCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000177649401 510179062 /nfs/dbraw/zinc/17/90/62/510179062.db2.gz UJVBBFWTXFMFKF-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO Cc1nn(C)c(C(=O)N[C@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000187322041 510193013 /nfs/dbraw/zinc/19/30/13/510193013.db2.gz PVTCVMMPFWPCPE-MRXNPFEDSA-N 1 1 373.457 2.523 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184231890 510206597 /nfs/dbraw/zinc/20/65/97/510206597.db2.gz DUFISIOIMLJFPG-LLVKDONJSA-N 1 1 354.378 2.906 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1F ZINC000184231890 510206607 /nfs/dbraw/zinc/20/66/07/510206607.db2.gz DUFISIOIMLJFPG-LLVKDONJSA-N 1 1 354.378 2.906 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c([N+](=O)[O-])cc1F ZINC000184233300 510208783 /nfs/dbraw/zinc/20/87/83/510208783.db2.gz KBJKCBZGVVEIHW-OAHLLOKOSA-N 1 1 368.405 2.903 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246143253 510317094 /nfs/dbraw/zinc/31/70/94/510317094.db2.gz FAEOAIPVZCWCHB-JSGCOSHPSA-N 1 1 366.849 2.745 20 5 FFBDMO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269284744 510324366 /nfs/dbraw/zinc/32/43/66/510324366.db2.gz NBMZCIVBYCGQNZ-MRXNPFEDSA-N 1 1 369.421 2.895 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000269284744 510324374 /nfs/dbraw/zinc/32/43/74/510324374.db2.gz NBMZCIVBYCGQNZ-MRXNPFEDSA-N 1 1 369.421 2.895 20 5 FFBDMO C[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CCN1Cc1ccccc1 ZINC000174870556 510356629 /nfs/dbraw/zinc/35/66/29/510356629.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000174870556 510356632 /nfs/dbraw/zinc/35/66/32/510356632.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000174870556 510356633 /nfs/dbraw/zinc/35/66/33/510356633.db2.gz PNJOUZXSNYLMQL-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404114 510391724 /nfs/dbraw/zinc/39/17/24/510391724.db2.gz RYTZDVKFBDRKQO-JQWIXIFHSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000181404114 510391732 /nfs/dbraw/zinc/39/17/32/510391732.db2.gz RYTZDVKFBDRKQO-JQWIXIFHSA-N 1 1 360.357 2.940 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266241816 510479147 /nfs/dbraw/zinc/47/91/47/510479147.db2.gz HGYNXSJUIYXFFZ-STQMWFEESA-N 1 1 357.332 2.970 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](CO)c1ccccc1 ZINC000269603271 510480038 /nfs/dbraw/zinc/48/00/38/510480038.db2.gz PZHPPRQTHFRHCJ-QGZVFWFLSA-N 1 1 373.409 2.597 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCC1 ZINC000181596158 510492546 /nfs/dbraw/zinc/49/25/46/510492546.db2.gz ZYXSNVOLSPIUQT-UHFFFAOYSA-N 1 1 357.357 2.800 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])CC1 ZINC000194730654 510499928 /nfs/dbraw/zinc/49/99/28/510499928.db2.gz ZEQGYVRVXQTSMD-INIZCTEOSA-N 1 1 360.458 2.655 20 5 FFBDMO COc1cc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000181673218 510533085 /nfs/dbraw/zinc/53/30/85/510533085.db2.gz AAGRVIRNFKFMGS-ZFWWWQNUSA-N 1 1 361.442 2.986 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000246546190 510548090 /nfs/dbraw/zinc/54/80/90/510548090.db2.gz AVESPDCOWVNIJK-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1 ZINC000246546190 510548091 /nfs/dbraw/zinc/54/80/91/510548091.db2.gz AVESPDCOWVNIJK-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246617116 510586516 /nfs/dbraw/zinc/58/65/16/510586516.db2.gz DXPAQWSPXZTRNV-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246617116 510586523 /nfs/dbraw/zinc/58/65/23/510586523.db2.gz DXPAQWSPXZTRNV-MAUKXSAKSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@@H]1C ZINC000191401916 510642919 /nfs/dbraw/zinc/64/29/19/510642919.db2.gz FXXCQSXBELKSSU-AWEZNQCLSA-N 1 1 364.446 2.521 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000181908832 510653338 /nfs/dbraw/zinc/65/33/38/510653338.db2.gz CBWLAQRPRGMQBV-ROUUACIJSA-N 1 1 356.422 2.899 20 5 FFBDMO CCS[C@H]1CC[C@@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931943 510666068 /nfs/dbraw/zinc/66/60/68/510666068.db2.gz PFQSUCAYYYMJLK-CABCVRRESA-N 1 1 372.512 2.975 20 5 FFBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931943 510666072 /nfs/dbraw/zinc/66/60/72/510666072.db2.gz PFQSUCAYYYMJLK-CABCVRRESA-N 1 1 372.512 2.975 20 5 FFBDMO CCOC(=O)c1ccnc(N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000172365822 510693190 /nfs/dbraw/zinc/69/31/90/510693190.db2.gz KJWXCLHPDKHMNF-UHFFFAOYSA-N 1 1 364.446 2.867 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000191649687 510772098 /nfs/dbraw/zinc/77/20/98/510772098.db2.gz LFEXALHLCURRTL-MRXNPFEDSA-N 1 1 371.441 2.548 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)O1 ZINC000195313593 510779865 /nfs/dbraw/zinc/77/98/65/510779865.db2.gz MYYJJBBUFLGORR-GASCZTMLSA-N 1 1 374.441 2.791 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)O1 ZINC000195313593 510779870 /nfs/dbraw/zinc/77/98/70/510779870.db2.gz MYYJJBBUFLGORR-GASCZTMLSA-N 1 1 374.441 2.791 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH2+]CCS(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000195422663 510820585 /nfs/dbraw/zinc/82/05/85/510820585.db2.gz PNMTZUPDOSWDTL-UHFFFAOYSA-N 1 1 354.815 2.812 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000247643339 510867641 /nfs/dbraw/zinc/86/76/41/510867641.db2.gz OQFHSYQTYHQBBW-RHSMWYFYSA-N 1 1 357.414 2.703 20 5 FFBDMO Cc1cccn2c(=O)cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)nc12 ZINC000282461907 510988700 /nfs/dbraw/zinc/98/87/00/510988700.db2.gz MYKILUGQDMFSLO-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1 ZINC000282535295 511017201 /nfs/dbraw/zinc/01/72/01/511017201.db2.gz VJWQYJLUPSMZAE-SFNKJDCFSA-N 1 1 356.426 2.563 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@H]21 ZINC000270936389 511030019 /nfs/dbraw/zinc/03/00/19/511030019.db2.gz IVNNYMPJXLZVTE-CMPLNLGQSA-N 1 1 355.236 2.673 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2 ZINC000291406175 511184366 /nfs/dbraw/zinc/18/43/66/511184366.db2.gz XMFHKGLXNOHZBJ-OAHLLOKOSA-N 1 1 354.410 2.853 20 5 FFBDMO Cc1cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc(N2CCCC2)[nH+]1 ZINC000291511092 511226461 /nfs/dbraw/zinc/22/64/61/511226461.db2.gz WPPVWGBUFOFIJS-UHFFFAOYSA-N 1 1 354.410 2.757 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818979 511228278 /nfs/dbraw/zinc/22/82/78/511228278.db2.gz QKAWNMMZTCDQOG-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818979 511228282 /nfs/dbraw/zinc/22/82/82/511228282.db2.gz QKAWNMMZTCDQOG-DGCLKSJQSA-N 1 1 355.822 2.812 20 5 FFBDMO COC(=O)c1c(C)[nH]c(C(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000298363000 511258876 /nfs/dbraw/zinc/25/88/76/511258876.db2.gz NCLXIVDRQACBDQ-NSHDSACASA-N 1 1 359.382 2.860 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)N1CC(=O)Nc2ccccc21 ZINC000271621225 511266274 /nfs/dbraw/zinc/26/62/74/511266274.db2.gz MXLWBQTUZGZITA-QWHCGFSZSA-N 1 1 368.393 2.619 20 5 FFBDMO CNC(=O)c1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271639828 511271529 /nfs/dbraw/zinc/27/15/29/511271529.db2.gz RDUPMKHPCCFSGD-STQMWFEESA-N 1 1 370.409 2.632 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000295101741 511282698 /nfs/dbraw/zinc/28/26/98/511282698.db2.gz KLNMESFNNVAIFN-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000295237871 511332334 /nfs/dbraw/zinc/33/23/34/511332334.db2.gz ZXCGTEABBPGYAX-TVQRCGJNSA-N 1 1 357.332 2.826 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCC2=CC[N@@H+](C)CC2)CC1 ZINC000271920168 511371217 /nfs/dbraw/zinc/37/12/17/511371217.db2.gz KGKAQEBCMJLZDO-UHFFFAOYSA-N 1 1 372.469 2.823 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](CC(N)=O)c1ccccc1 ZINC000280293261 511409303 /nfs/dbraw/zinc/40/93/03/511409303.db2.gz FGOFPEBHJCGEST-KRWDZBQOSA-N 1 1 371.393 2.510 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](CC(N)=O)c1ccccc1 ZINC000280293261 511409310 /nfs/dbraw/zinc/40/93/10/511409310.db2.gz FGOFPEBHJCGEST-KRWDZBQOSA-N 1 1 371.393 2.510 20 5 FFBDMO C[C@@H]1OCC[C@]12C[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)CCO2 ZINC000280334822 511425522 /nfs/dbraw/zinc/42/55/22/511425522.db2.gz HMOSARWONYKYLZ-LIRRHRJNSA-N 1 1 373.409 2.672 20 5 FFBDMO C[N@@H+]1CC[C@]2(CCN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133246 511478674 /nfs/dbraw/zinc/47/86/74/511478674.db2.gz LLBYWPTWHQNPIO-IBGZPJMESA-N 1 1 356.426 2.820 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133246 511478681 /nfs/dbraw/zinc/47/86/81/511478681.db2.gz LLBYWPTWHQNPIO-IBGZPJMESA-N 1 1 356.426 2.820 20 5 FFBDMO CN1CC[C@]2(CC[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133246 511478688 /nfs/dbraw/zinc/47/86/88/511478688.db2.gz LLBYWPTWHQNPIO-IBGZPJMESA-N 1 1 356.426 2.820 20 5 FFBDMO CN1CC[C@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000292133246 511478695 /nfs/dbraw/zinc/47/86/95/511478695.db2.gz LLBYWPTWHQNPIO-IBGZPJMESA-N 1 1 356.426 2.820 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@H](O)COCCOC(C)C ZINC000272283975 511489994 /nfs/dbraw/zinc/48/99/94/511489994.db2.gz FUQFVNRXNGFUSA-WBVHZDCISA-N 1 1 354.447 2.699 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)ccc1[N+](=O)[O-] ZINC000295761773 511507688 /nfs/dbraw/zinc/50/76/88/511507688.db2.gz XYBBLMVAGXRWKY-JKSUJKDBSA-N 1 1 369.421 2.775 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299195014 511547383 /nfs/dbraw/zinc/54/73/83/511547383.db2.gz MLHMHMCTCVKFCJ-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299195014 511547385 /nfs/dbraw/zinc/54/73/85/511547385.db2.gz MLHMHMCTCVKFCJ-HLLBOEOZSA-N 1 1 361.442 2.617 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H](CSC)C2)c([N+](=O)[O-])c1 ZINC000292537802 511634355 /nfs/dbraw/zinc/63/43/55/511634355.db2.gz XMBBITRZESBAEX-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H](CSC)C2)c([N+](=O)[O-])c1 ZINC000292537802 511634363 /nfs/dbraw/zinc/63/43/63/511634363.db2.gz XMBBITRZESBAEX-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)c([N+](=O)[O-])cc1OC ZINC000365818824 511667435 /nfs/dbraw/zinc/66/74/35/511667435.db2.gz HGVLLZSYIQRJHD-CYBMUJFWSA-N 1 1 360.414 2.725 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c([N+](=O)[O-])c1 ZINC000292846697 511743068 /nfs/dbraw/zinc/74/30/68/511743068.db2.gz QXVHQQSURHINPK-IBGZPJMESA-N 1 1 360.458 2.655 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC3(CCOCC3)[C@H]2C)c([N+](=O)[O-])c1 ZINC000363792671 511770501 /nfs/dbraw/zinc/77/05/01/511770501.db2.gz GBQFNQCPIRNLIB-CQSZACIVSA-N 1 1 350.415 2.873 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000274326641 511795134 /nfs/dbraw/zinc/79/51/34/511795134.db2.gz YUTFYRKOGVUFPL-UKRRQHHQSA-N 1 1 371.441 2.692 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000325456609 511847924 /nfs/dbraw/zinc/84/79/24/511847924.db2.gz ZDBPFDSWYXTMPI-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CCCO1 ZINC000325456609 511847930 /nfs/dbraw/zinc/84/79/30/511847930.db2.gz ZDBPFDSWYXTMPI-CQSZACIVSA-N 1 1 356.806 2.792 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886363 511913423 /nfs/dbraw/zinc/91/34/23/511913423.db2.gz TZFNTOPNDAFDDW-UKRRQHHQSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886363 511913428 /nfs/dbraw/zinc/91/34/28/511913428.db2.gz TZFNTOPNDAFDDW-UKRRQHHQSA-N 1 1 353.806 2.830 20 5 FFBDMO CN(C)C(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000293336023 511927449 /nfs/dbraw/zinc/92/74/49/511927449.db2.gz CXFOJFNWZZYZGR-UHFFFAOYSA-N 1 1 359.348 2.914 20 5 FFBDMO C[NH+]1CCN([C@H](c2nc(-c3ccc([N+](=O)[O-])o3)no2)c2ccccc2)CC1 ZINC000351154485 511968613 /nfs/dbraw/zinc/96/86/13/511968613.db2.gz ZVFRHLWQDJDEEB-INIZCTEOSA-N 1 1 369.381 2.575 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000275075343 512033749 /nfs/dbraw/zinc/03/37/49/512033749.db2.gz BQLCDVXXTFDBQS-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000275075343 512033755 /nfs/dbraw/zinc/03/37/55/512033755.db2.gz BQLCDVXXTFDBQS-SECBINFHSA-N 1 1 365.739 2.749 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)c1 ZINC000375688649 512456274 /nfs/dbraw/zinc/45/62/74/512456274.db2.gz BQELWMLEEBCMCD-HNNXBMFYSA-N 1 1 350.806 2.917 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000371557829 512464484 /nfs/dbraw/zinc/46/44/84/512464484.db2.gz IABAZUIKIXMAPT-OAHLLOKOSA-N 1 1 371.441 2.522 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@H+](CC(=O)Nc4ccc(Cl)cc4[N+](=O)[O-])[C@H]1[C@H]3C2 ZINC000375745830 512483105 /nfs/dbraw/zinc/48/31/05/512483105.db2.gz RISWVLBNUKPAGD-YOCWQBDXSA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CC(=O)Nc4ccc(Cl)cc4[N+](=O)[O-])[C@H]1[C@H]3C2 ZINC000375745830 512483107 /nfs/dbraw/zinc/48/31/07/512483107.db2.gz RISWVLBNUKPAGD-YOCWQBDXSA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000375787621 512506721 /nfs/dbraw/zinc/50/67/21/512506721.db2.gz HHHZSISWFJBKNM-SAYFZHNOSA-N 1 1 356.382 2.500 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4nc(-c5cccc([N+](=O)[O-])c5)no4)[C@H]1[C@H]3C2 ZINC000375787622 512506734 /nfs/dbraw/zinc/50/67/34/512506734.db2.gz HHHZSISWFJBKNM-UOYADTOYSA-N 1 1 356.382 2.500 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000371702596 512535424 /nfs/dbraw/zinc/53/54/24/512535424.db2.gz FQGACNRXFBCRIS-QGZVFWFLSA-N 1 1 366.893 2.849 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000374028433 512630327 /nfs/dbraw/zinc/63/03/27/512630327.db2.gz QBJFLZCZPWXGDR-RVKKMQEKSA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](C)O2 ZINC000374028433 512630329 /nfs/dbraw/zinc/63/03/29/512630329.db2.gz QBJFLZCZPWXGDR-RVKKMQEKSA-N 1 1 350.415 2.632 20 5 FFBDMO Cn1cc(CN2CCC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000378349299 512710061 /nfs/dbraw/zinc/71/00/61/512710061.db2.gz JHJSEEJXNHGQKO-GOSISDBHSA-N 1 1 355.442 2.665 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[NH2+]2)cc1 ZINC000374358200 512788882 /nfs/dbraw/zinc/78/88/82/512788882.db2.gz BLBMHBNMLRETHB-GOSISDBHSA-N 1 1 354.410 2.526 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)[nH+]1 ZINC000370156657 512793801 /nfs/dbraw/zinc/79/38/01/512793801.db2.gz RTKMDLAEBQXRQH-ZDUSSCGKSA-N 1 1 355.398 2.597 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC[C@H]1C1CC1 ZINC000411782859 512809328 /nfs/dbraw/zinc/80/93/28/512809328.db2.gz FHBALWBYHGXTDX-HNNXBMFYSA-N 1 1 365.455 2.759 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCSC2(CCC2)CC1 ZINC000411872304 512852423 /nfs/dbraw/zinc/85/24/23/512852423.db2.gz UYXFNMGVOPGWQL-CQSZACIVSA-N 1 1 352.456 2.696 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCSC2(CCC2)CC1 ZINC000411872303 512852923 /nfs/dbraw/zinc/85/29/23/512852923.db2.gz UYXFNMGVOPGWQL-AWEZNQCLSA-N 1 1 352.456 2.696 20 5 FFBDMO CNc1ccc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000380467296 512873217 /nfs/dbraw/zinc/87/32/17/512873217.db2.gz QGUCLXUUMAPSQZ-KRWDZBQOSA-N 1 1 368.437 2.983 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000412007406 512910335 /nfs/dbraw/zinc/91/03/35/512910335.db2.gz DLORYHYYJXJGLY-LJQANCHMSA-N 1 1 369.421 2.610 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446347 512939035 /nfs/dbraw/zinc/93/90/35/512939035.db2.gz CODWTJWTHWFVOP-RDTXWAMCSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000370446347 512939040 /nfs/dbraw/zinc/93/90/40/512939040.db2.gz CODWTJWTHWFVOP-RDTXWAMCSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000397976613 512952135 /nfs/dbraw/zinc/95/21/35/512952135.db2.gz KWJZIHPNMNUTDR-CJNGLKHVSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@H]1C[C@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[N@H+]1Cc1ccccc1 ZINC000397984492 512952350 /nfs/dbraw/zinc/95/23/50/512952350.db2.gz NSYJWHNOGIFWFJ-ZFWWWQNUSA-N 1 1 351.410 2.968 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[nH+]1 ZINC000412132719 512973007 /nfs/dbraw/zinc/97/30/07/512973007.db2.gz YASARLMOVMEMCK-UHFFFAOYSA-N 1 1 358.398 2.927 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CCC[N@@H+](C)CC3)cc2[N+](=O)[O-])C1 ZINC000407997434 512981877 /nfs/dbraw/zinc/98/18/77/512981877.db2.gz VXSLGMSXHCWDEI-HNNXBMFYSA-N 1 1 360.458 2.609 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC(n3c[nH+]cc3C)CC2)c1 ZINC000374810114 513014674 /nfs/dbraw/zinc/01/46/74/513014674.db2.gz JXCVKPVZAADNNC-UHFFFAOYSA-N 1 1 358.398 2.976 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC[C@@H]1C ZINC000439887531 513203298 /nfs/dbraw/zinc/20/32/98/513203298.db2.gz HQOCFSZLDJEHFA-ZDUSSCGKSA-N 1 1 350.419 2.989 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000439887530 513203838 /nfs/dbraw/zinc/20/38/38/513203838.db2.gz HQOCFSZLDJEHFA-CYBMUJFWSA-N 1 1 350.419 2.989 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@H]1C ZINC000450500782 513223087 /nfs/dbraw/zinc/22/30/87/513223087.db2.gz OEASKYBKAHKMOK-CHWSQXEVSA-N 1 1 357.414 2.540 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]([C@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429001789 513248009 /nfs/dbraw/zinc/24/80/09/513248009.db2.gz WZHFBRAJVKXBPV-ADAWSYLGSA-N 1 1 360.458 2.584 20 5 FFBDMO CC(C)([NH2+]CC(=O)NC[C@@H]1Cc2ccccc2O1)c1ccccc1[N+](=O)[O-] ZINC000429246569 513315451 /nfs/dbraw/zinc/31/54/51/513315451.db2.gz OJZAXCOWTZHOST-HNNXBMFYSA-N 1 1 369.421 2.539 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[C@H](C)[N@@H+]1CCO ZINC000450789340 513342804 /nfs/dbraw/zinc/34/28/04/513342804.db2.gz FMPXCPPLXDLICI-OKILXGFUSA-N 1 1 351.447 2.663 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC[C@H](S(C)(=O)=O)C1 ZINC000446850459 513350207 /nfs/dbraw/zinc/35/02/07/513350207.db2.gz ZNWVMMIWJOFLPM-QXSWTLKVSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC[C@H](S(C)(=O)=O)C1 ZINC000446850459 513350210 /nfs/dbraw/zinc/35/02/10/513350210.db2.gz ZNWVMMIWJOFLPM-QXSWTLKVSA-N 1 1 352.456 2.897 20 5 FFBDMO C[N@H+]1CCN(CCNc2ccc([N+](=O)[O-])cc2Br)CC1(C)C ZINC000440650979 513371412 /nfs/dbraw/zinc/37/14/12/513371412.db2.gz OKNVVKPNHPJIAW-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c1 ZINC000434772759 513425448 /nfs/dbraw/zinc/42/54/48/513425448.db2.gz BNVOGDCVUIUIGY-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1 ZINC000434772759 513425453 /nfs/dbraw/zinc/42/54/53/513425453.db2.gz BNVOGDCVUIUIGY-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)n2)cc1 ZINC000441198863 513510553 /nfs/dbraw/zinc/51/05/53/513510553.db2.gz CKNMIHOWRKERCW-GJZGRUSLSA-N 1 1 358.398 2.893 20 5 FFBDMO CCC(C)(C)CC[NH+]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000441228519 513517310 /nfs/dbraw/zinc/51/73/10/513517310.db2.gz IYUXEAJTCLTQHY-UHFFFAOYSA-N 1 1 369.487 2.727 20 5 FFBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441276561 513525911 /nfs/dbraw/zinc/52/59/11/513525911.db2.gz KLSHLTGQLWKRBZ-NHYWBVRUSA-N 1 1 372.347 2.864 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441278287 513528585 /nfs/dbraw/zinc/52/85/85/513528585.db2.gz PHUJRZARBXGRFP-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc(N2CCC(Nc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)[nH+]1 ZINC000447686432 513543782 /nfs/dbraw/zinc/54/37/82/513543782.db2.gz FKYWRALIKNVWJY-UHFFFAOYSA-N 1 1 352.398 2.677 20 5 FFBDMO COc1ccccc1[C@@H]([NH3+])C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000430114116 513556550 /nfs/dbraw/zinc/55/65/50/513556550.db2.gz PQYSLDFCJKPWEF-GOSISDBHSA-N 1 1 357.410 2.742 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1NCC1([NH+]2CCOCC2)CCOCC1 ZINC000413402214 513639105 /nfs/dbraw/zinc/63/91/05/513639105.db2.gz JMHZORUTICUEQW-UHFFFAOYSA-N 1 1 355.822 2.542 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@@H]1[C@@H]1CCCOC1 ZINC000451295498 513659204 /nfs/dbraw/zinc/65/92/04/513659204.db2.gz DNSUSYFKQVRWJG-ZTFGCOKTSA-N 1 1 364.442 2.744 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000451347705 513693546 /nfs/dbraw/zinc/69/35/46/513693546.db2.gz UPPXXMMJHIFWJK-KSZLIROESA-N 1 1 361.442 2.573 20 5 FFBDMO C[C@@]12C[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368996 513705482 /nfs/dbraw/zinc/70/54/82/513705482.db2.gz MWBIIQUWVYFOMS-WNJKXWAASA-N 1 1 353.422 2.628 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccnn3-c3ccccc3)C2)nc1 ZINC000448339651 513738433 /nfs/dbraw/zinc/73/84/33/513738433.db2.gz PWCZCBAFWZAHRP-OAHLLOKOSA-N 1 1 364.409 2.862 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccnn3-c3ccccc3)C2)nc1 ZINC000448339651 513738442 /nfs/dbraw/zinc/73/84/42/513738442.db2.gz PWCZCBAFWZAHRP-OAHLLOKOSA-N 1 1 364.409 2.862 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451432887 513748738 /nfs/dbraw/zinc/74/87/38/513748738.db2.gz ZZFWPUNNXRUBIU-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCOCC4CCC4)CC3)nc2c1 ZINC000419255194 513757856 /nfs/dbraw/zinc/75/78/56/513757856.db2.gz YDQUBIRMNZZESY-UHFFFAOYSA-N 1 1 373.457 2.800 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436307772 513822160 /nfs/dbraw/zinc/82/21/60/513822160.db2.gz LHHBJUKLFRIFRT-GFCCVEGCSA-N 1 1 365.408 2.787 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436307772 513822166 /nfs/dbraw/zinc/82/21/66/513822166.db2.gz LHHBJUKLFRIFRT-GFCCVEGCSA-N 1 1 365.408 2.787 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691975 513914514 /nfs/dbraw/zinc/91/45/14/513914514.db2.gz DCUVABYYXGIRAU-MBNYWOFBSA-N 1 1 367.833 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@H](O)CC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451691975 513914521 /nfs/dbraw/zinc/91/45/21/513914521.db2.gz DCUVABYYXGIRAU-MBNYWOFBSA-N 1 1 367.833 2.670 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448984991 514007921 /nfs/dbraw/zinc/00/79/21/514007921.db2.gz VKHNQVXHFSAYDY-MRXNPFEDSA-N 1 1 371.441 2.775 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000427018799 514092541 /nfs/dbraw/zinc/09/25/41/514092541.db2.gz CWSZJGHFBXHKNP-WMZOPIPTSA-N 1 1 355.394 2.779 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C[C@H]1c1ccccc1 ZINC000451995129 514120941 /nfs/dbraw/zinc/12/09/41/514120941.db2.gz MYZKLHVLLYCHNQ-ROUUACIJSA-N 1 1 370.405 2.992 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000427369807 514195672 /nfs/dbraw/zinc/19/56/72/514195672.db2.gz KVOPLQJVLPTLGJ-HUUCEWRRSA-N 1 1 371.441 2.546 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000427369807 514195678 /nfs/dbraw/zinc/19/56/78/514195678.db2.gz KVOPLQJVLPTLGJ-HUUCEWRRSA-N 1 1 371.441 2.546 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000449550065 514250853 /nfs/dbraw/zinc/25/08/53/514250853.db2.gz BXERSONCJLPBDB-UMVBOHGHSA-N 1 1 350.415 2.595 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449558872 514254715 /nfs/dbraw/zinc/25/47/15/514254715.db2.gz XEJBXNAGRUUYSY-GPMSIDNRSA-N 1 1 370.453 2.978 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000444628312 514278236 /nfs/dbraw/zinc/27/82/36/514278236.db2.gz HXMMKXVDQZLOJJ-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO C[C@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000417315664 514289867 /nfs/dbraw/zinc/28/98/67/514289867.db2.gz SQQYJHKYNACWGX-OXQOHEQNSA-N 1 1 360.502 2.835 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000427920236 514345922 /nfs/dbraw/zinc/34/59/22/514345922.db2.gz AUVQPJRTCVWQCP-AWEZNQCLSA-N 1 1 372.425 2.512 20 5 FFBDMO C[C@@]1(Cc2ccc(F)cc2)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000420921463 514377069 /nfs/dbraw/zinc/37/70/69/514377069.db2.gz CUROLWXDRHLUIB-IBGZPJMESA-N 1 1 359.401 2.993 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000420949384 514396951 /nfs/dbraw/zinc/39/69/51/514396951.db2.gz VLRCYHXPXMLUKI-NWDGAFQWSA-N 1 1 374.384 2.698 20 5 FFBDMO NC(=O)c1cccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439161714 514502757 /nfs/dbraw/zinc/50/27/57/514502757.db2.gz YALBEKXZZAUSIV-MRXNPFEDSA-N 1 1 368.437 2.670 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000458166557 514594767 /nfs/dbraw/zinc/59/47/67/514594767.db2.gz CHOFEZSYDNDZAW-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475309637 514611813 /nfs/dbraw/zinc/61/18/13/514611813.db2.gz XKCCESPKPMVFCN-MRXNPFEDSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ccc(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)nc1 ZINC000453403236 514620308 /nfs/dbraw/zinc/62/03/08/514620308.db2.gz AVBQRGBPBOAEAQ-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470822256 514627462 /nfs/dbraw/zinc/62/74/62/514627462.db2.gz QHMKBXQOYMJJDN-HFTRVMKXSA-N 1 1 373.432 2.990 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000475580795 514721738 /nfs/dbraw/zinc/72/17/38/514721738.db2.gz LQTLCCUHLZQLLO-HNNXBMFYSA-N 1 1 359.382 2.812 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000475580795 514721748 /nfs/dbraw/zinc/72/17/48/514721748.db2.gz LQTLCCUHLZQLLO-HNNXBMFYSA-N 1 1 359.382 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc(CCN(CC[NH+]2CCOCC2)c2ccccc2)cc1 ZINC000471172436 514782766 /nfs/dbraw/zinc/78/27/66/514782766.db2.gz GQVOHGNBCCBILH-UHFFFAOYSA-N 1 1 355.438 2.976 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CC[C@@H](C)C1 ZINC000484852103 514815375 /nfs/dbraw/zinc/81/53/75/514815375.db2.gz BBFYMDWTSMAWLC-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000471388580 514862599 /nfs/dbraw/zinc/86/25/99/514862599.db2.gz PTVXGPSRHZCOIG-KDURUIRLSA-N 1 1 365.433 2.728 20 5 FFBDMO COCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCO[C@H]1C ZINC000489481868 514863481 /nfs/dbraw/zinc/86/34/81/514863481.db2.gz NSCXLJHHLAMEBF-GUYCJALGSA-N 1 1 361.398 2.876 20 5 FFBDMO COCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCO[C@H]1C ZINC000489481868 514863493 /nfs/dbraw/zinc/86/34/93/514863493.db2.gz NSCXLJHHLAMEBF-GUYCJALGSA-N 1 1 361.398 2.876 20 5 FFBDMO COCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCO[C@@H]1C ZINC000489481864 514863807 /nfs/dbraw/zinc/86/38/07/514863807.db2.gz NSCXLJHHLAMEBF-CXAGYDPISA-N 1 1 361.398 2.876 20 5 FFBDMO COCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCO[C@@H]1C ZINC000489481864 514863820 /nfs/dbraw/zinc/86/38/20/514863820.db2.gz NSCXLJHHLAMEBF-CXAGYDPISA-N 1 1 361.398 2.876 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000498471481 514917040 /nfs/dbraw/zinc/91/70/40/514917040.db2.gz PLBFKZTZBYTUJA-CYBMUJFWSA-N 1 1 368.865 2.774 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000462190959 514932869 /nfs/dbraw/zinc/93/28/69/514932869.db2.gz RNCWPDHHSNVFGO-UGSOOPFHSA-N 1 1 357.385 2.984 20 5 FFBDMO O=C1C[C@@H]([N@H+]2CCC3(C2)CCCCC3)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000462273191 514968420 /nfs/dbraw/zinc/96/84/20/514968420.db2.gz BIAQARYZKNXMBG-MRXNPFEDSA-N 1 1 357.410 2.883 20 5 FFBDMO CCCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000509098889 515021499 /nfs/dbraw/zinc/02/14/99/515021499.db2.gz VVOVQHOLSYIAQU-INIZCTEOSA-N 1 1 371.441 2.835 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000498740263 515048713 /nfs/dbraw/zinc/04/87/13/515048713.db2.gz WXHLWHJWPBBRID-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1C ZINC000480926161 515137307 /nfs/dbraw/zinc/13/73/07/515137307.db2.gz KNHXXMMNIVDQFS-ZIAGYGMSSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@H](NC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849780 515146757 /nfs/dbraw/zinc/14/67/57/515146757.db2.gz IRKZSXCAQWFDJD-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849780 515146761 /nfs/dbraw/zinc/14/67/61/515146761.db2.gz IRKZSXCAQWFDJD-OXJNMPFZSA-N 1 1 355.438 2.882 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000490294975 515168020 /nfs/dbraw/zinc/16/80/20/515168020.db2.gz YMDXKARYVRANNR-HNNXBMFYSA-N 1 1 369.849 2.816 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000490646533 515273568 /nfs/dbraw/zinc/27/35/68/515273568.db2.gz HCGKUFYHYOOMNC-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653475 515274284 /nfs/dbraw/zinc/27/42/84/515274284.db2.gz ANIWQEDARCDFSL-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000509653475 515274294 /nfs/dbraw/zinc/27/42/94/515274294.db2.gz ANIWQEDARCDFSL-NWDGAFQWSA-N 1 1 360.439 2.883 20 5 FFBDMO CNc1c(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000462907187 515294186 /nfs/dbraw/zinc/29/41/86/515294186.db2.gz QRMDZKONKPFYTA-UHFFFAOYSA-N 1 1 368.437 2.637 20 5 FFBDMO CNc1nc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000454272318 515356990 /nfs/dbraw/zinc/35/69/90/515356990.db2.gz GLALGOUKLCDMSJ-OAHLLOKOSA-N 1 1 373.413 2.582 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000468479138 515378314 /nfs/dbraw/zinc/37/83/14/515378314.db2.gz MCOOTAHFRXMNQK-HNNXBMFYSA-N 1 1 351.472 2.924 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C(C)C)N1CCN(C)CC1 ZINC000468654877 515455585 /nfs/dbraw/zinc/45/55/85/515455585.db2.gz CZBMEOGXZMIRKS-KEWOFRHOSA-N 1 1 360.502 2.860 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](Cc4ccncc4F)CC3)nc2c1 ZINC000459407241 515531087 /nfs/dbraw/zinc/53/10/87/515531087.db2.gz VKDJIPFTUKURJO-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](Cc4ccncc4F)CC3)nc2c1 ZINC000459407241 515531094 /nfs/dbraw/zinc/53/10/94/515531094.db2.gz VKDJIPFTUKURJO-UHFFFAOYSA-N 1 1 370.388 2.718 20 5 FFBDMO O=C(NCC[N@H+]1CC=CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000477652895 515543416 /nfs/dbraw/zinc/54/34/16/515543416.db2.gz QJYNPTSOLKAIKP-UHFFFAOYSA-N 1 1 365.408 2.812 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000477652895 515543424 /nfs/dbraw/zinc/54/34/24/515543424.db2.gz QJYNPTSOLKAIKP-UHFFFAOYSA-N 1 1 365.408 2.812 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C[C@H]1C ZINC000493891582 515678856 /nfs/dbraw/zinc/67/88/56/515678856.db2.gz OEJLICDPQHHOSB-CABCVRRESA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000494061267 515723795 /nfs/dbraw/zinc/72/37/95/515723795.db2.gz VKMFQDBXLXJQJW-WBVHZDCISA-N 1 1 368.437 2.786 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511072355 515767703 /nfs/dbraw/zinc/76/77/03/515767703.db2.gz FNXKZFNXUNQHRL-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO COc1ccccc1CN(C)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511072355 515767710 /nfs/dbraw/zinc/76/77/10/515767710.db2.gz FNXKZFNXUNQHRL-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO C[C@@H](C(=O)NCCc1cccs1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511090206 515774397 /nfs/dbraw/zinc/77/43/97/515774397.db2.gz IGOOSRCIOADSJA-AWEZNQCLSA-N 1 1 361.467 2.878 20 5 FFBDMO C[C@@H](C(=O)NCCc1cccs1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511090206 515774407 /nfs/dbraw/zinc/77/44/07/515774407.db2.gz IGOOSRCIOADSJA-AWEZNQCLSA-N 1 1 361.467 2.878 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC1(c2ccccc2)CC1 ZINC000511096849 515778434 /nfs/dbraw/zinc/77/84/34/515778434.db2.gz RFARUEBHWKVDRO-UHFFFAOYSA-N 1 1 367.449 2.917 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC1(c2ccccc2)CC1 ZINC000511096849 515778441 /nfs/dbraw/zinc/77/84/41/515778441.db2.gz RFARUEBHWKVDRO-UHFFFAOYSA-N 1 1 367.449 2.917 20 5 FFBDMO CCCC[C@H](C(=O)Nc1cc(C)on1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122168 515792699 /nfs/dbraw/zinc/79/26/99/515792699.db2.gz HUSZJLYMFBDNCP-QGZVFWFLSA-N 1 1 374.441 2.985 20 5 FFBDMO CCCC[C@H](C(=O)Nc1cc(C)on1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511122168 515792709 /nfs/dbraw/zinc/79/27/09/515792709.db2.gz HUSZJLYMFBDNCP-QGZVFWFLSA-N 1 1 374.441 2.985 20 5 FFBDMO C[C@H](C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000459806272 515818211 /nfs/dbraw/zinc/81/82/11/515818211.db2.gz MNEVEHJZFUDDPH-CYBMUJFWSA-N 1 1 365.430 2.833 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000459810813 515823259 /nfs/dbraw/zinc/82/32/59/515823259.db2.gz QIRBHUZKOFZWDV-ZDUSSCGKSA-N 1 1 365.430 2.833 20 5 FFBDMO CNc1nc(C(=O)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000454958052 515857594 /nfs/dbraw/zinc/85/75/94/515857594.db2.gz VHHNTFBPTUDSBS-UKRRQHHQSA-N 1 1 369.425 2.597 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+](CCCOc2ccccc2)C2CCOCC2)n1 ZINC000464595372 515887160 /nfs/dbraw/zinc/88/71/60/515887160.db2.gz ILJNFDPMQUFRJZ-UHFFFAOYSA-N 1 1 374.441 2.741 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704758 515932282 /nfs/dbraw/zinc/93/22/82/515932282.db2.gz TTYXLELRFKXRNM-ZWKOTPCHSA-N 1 1 359.426 2.591 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@H](OCC3CC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000494704758 515932291 /nfs/dbraw/zinc/93/22/91/515932291.db2.gz TTYXLELRFKXRNM-ZWKOTPCHSA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NCC[N@@H+]3CC=CCC3)cc2[N+](=O)[O-])C1 ZINC000506766017 515978866 /nfs/dbraw/zinc/97/88/66/515978866.db2.gz IEZWZCIQUVVHPQ-MRXNPFEDSA-N 1 1 372.469 2.823 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506784229 515984581 /nfs/dbraw/zinc/98/45/81/515984581.db2.gz ZWRGRDQKIPBHOB-INIZCTEOSA-N 1 1 355.394 2.695 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506784229 515984590 /nfs/dbraw/zinc/98/45/90/515984590.db2.gz ZWRGRDQKIPBHOB-INIZCTEOSA-N 1 1 355.394 2.695 20 5 FFBDMO O=c1c2ccccc2n(Cc2[nH+]ccn2CC(F)(F)F)cc1[N+](=O)[O-] ZINC000487870418 516013405 /nfs/dbraw/zinc/01/34/05/516013405.db2.gz MFKFGBMMDBUPLO-UHFFFAOYSA-N 1 1 352.272 2.717 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000501228235 516022854 /nfs/dbraw/zinc/02/28/54/516022854.db2.gz MRCQQNKSHFJBPX-DOTOQJQBSA-N 1 1 369.421 2.925 20 5 FFBDMO Cc1cnc(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000495063590 516054051 /nfs/dbraw/zinc/05/40/51/516054051.db2.gz XKZGSBKJIAFUDU-UHFFFAOYSA-N 1 1 362.455 2.951 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000501504939 516129651 /nfs/dbraw/zinc/12/96/51/516129651.db2.gz OSDWFBGASOZICW-CHWSQXEVSA-N 1 1 350.419 2.988 20 5 FFBDMO C[C@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000501540229 516146690 /nfs/dbraw/zinc/14/66/90/516146690.db2.gz YVLAJYWKCWZAKZ-HUUCEWRRSA-N 1 1 363.462 2.569 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000470156394 516151223 /nfs/dbraw/zinc/15/12/23/516151223.db2.gz OCHBPYOYMJQIIJ-SKDZVZGDSA-N 1 1 355.394 2.941 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000470173989 516162768 /nfs/dbraw/zinc/16/27/68/516162768.db2.gz HDPZVCXALZHADS-ZDUSSCGKSA-N 1 1 369.368 2.943 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616490 516173468 /nfs/dbraw/zinc/17/34/68/516173468.db2.gz FVAXIFBEHRYFEA-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000501616490 516173472 /nfs/dbraw/zinc/17/34/72/516173472.db2.gz FVAXIFBEHRYFEA-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000465535183 516184479 /nfs/dbraw/zinc/18/44/79/516184479.db2.gz WRRZKJAJFQUVNC-IYBDPMFKSA-N 1 1 362.474 2.805 20 5 FFBDMO CCOC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000488741186 516298038 /nfs/dbraw/zinc/29/80/38/516298038.db2.gz BLZCGOZKVSEBHT-SUNYJGFJSA-N 1 1 361.442 2.938 20 5 FFBDMO Cc1ccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1F ZINC000488770581 516304406 /nfs/dbraw/zinc/30/44/06/516304406.db2.gz TXGMGPDIOBWWSC-UHFFFAOYSA-N 1 1 361.377 2.514 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000497481285 516323585 /nfs/dbraw/zinc/32/35/85/516323585.db2.gz HGUHMNYWDKXFDC-AWEZNQCLSA-N 1 1 354.838 2.574 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc(Br)c1C)C1CC1 ZINC000550689920 516384358 /nfs/dbraw/zinc/38/43/58/516384358.db2.gz FQDQWCRAYBCSPE-UHFFFAOYSA-N 1 1 370.247 2.880 20 5 FFBDMO CC(=O)NC1CCC([N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000544111544 516588762 /nfs/dbraw/zinc/58/87/62/516588762.db2.gz UTZWHFKORPBEDU-UHFFFAOYSA-N 1 1 373.413 2.524 20 5 FFBDMO CC(=O)NCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccsc1 ZINC000554830131 516656392 /nfs/dbraw/zinc/65/63/92/516656392.db2.gz SMXOOQKFDZDQCZ-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO CC(=O)NCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccsc1 ZINC000554830131 516656402 /nfs/dbraw/zinc/65/64/02/516656402.db2.gz SMXOOQKFDZDQCZ-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCN(CCO)CC1 ZINC000513567228 516673715 /nfs/dbraw/zinc/67/37/15/516673715.db2.gz DUSJDMVEQHEGFF-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC[NH+](CCO)CC1 ZINC000513567228 516673721 /nfs/dbraw/zinc/67/37/21/516673721.db2.gz DUSJDMVEQHEGFF-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000536262823 516700209 /nfs/dbraw/zinc/70/02/09/516700209.db2.gz JGHNCNIQONLFBD-OXQOHEQNSA-N 1 1 369.421 2.708 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@@H](C)C1 ZINC000561760651 516754248 /nfs/dbraw/zinc/75/42/48/516754248.db2.gz IGDWIAYLRLJGFQ-GDZNZVCISA-N 1 1 356.426 2.878 20 5 FFBDMO NC(=O)c1ccc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000561927938 516833873 /nfs/dbraw/zinc/83/38/73/516833873.db2.gz IEZGISBGMKLHOH-HNNXBMFYSA-N 1 1 363.801 2.560 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000536589591 516838881 /nfs/dbraw/zinc/83/88/81/516838881.db2.gz OIRJMLBZYLHFQD-UHFFFAOYSA-N 1 1 363.462 2.601 20 5 FFBDMO CC[N@H+](CCC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000536589591 516838886 /nfs/dbraw/zinc/83/88/86/516838886.db2.gz OIRJMLBZYLHFQD-UHFFFAOYSA-N 1 1 363.462 2.601 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000536589591 516838894 /nfs/dbraw/zinc/83/88/94/516838894.db2.gz OIRJMLBZYLHFQD-UHFFFAOYSA-N 1 1 363.462 2.601 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000541035867 516840629 /nfs/dbraw/zinc/84/06/29/516840629.db2.gz GOKPNXKBKJJDBF-AAEUAGOBSA-N 1 1 371.384 2.999 20 5 FFBDMO CCOCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000555343321 516890894 /nfs/dbraw/zinc/89/08/94/516890894.db2.gz ZXOWGHUVZWSTJB-UHFFFAOYSA-N 1 1 361.364 2.768 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000525053988 516903899 /nfs/dbraw/zinc/90/38/99/516903899.db2.gz TUMQXMIUMCTRDE-TZMCWYRMSA-N 1 1 365.430 2.557 20 5 FFBDMO O=[N+]([O-])c1c(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)nc2sccn21 ZINC000548334525 516907757 /nfs/dbraw/zinc/90/77/57/516907757.db2.gz SGANQMXYVUYFER-NSHDSACASA-N 1 1 358.427 2.831 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCNC(=O)[C@H]1Cc1ccccc1 ZINC000519198472 516921444 /nfs/dbraw/zinc/92/14/44/516921444.db2.gz HVGMJNHTATULCH-LJQANCHMSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H]1C ZINC000525396028 517028748 /nfs/dbraw/zinc/02/87/48/517028748.db2.gz KRAKLPRVNUDROD-KBXCAEBGSA-N 1 1 371.441 2.725 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000525397448 517029490 /nfs/dbraw/zinc/02/94/90/517029490.db2.gz PFNBQKNMEGYWTK-STQMWFEESA-N 1 1 372.425 2.793 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000514752255 517039218 /nfs/dbraw/zinc/03/92/18/517039218.db2.gz QGEJOVSOYGFIOQ-CZUORRHYSA-N 1 1 370.409 2.851 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H](OCc3c(C)noc3C)C2)cc1[N+](=O)[O-] ZINC000545172645 517085525 /nfs/dbraw/zinc/08/55/25/517085525.db2.gz NYJVTECAXJVTFY-OAHLLOKOSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](OCc3c(C)noc3C)C2)cc1[N+](=O)[O-] ZINC000545172645 517085539 /nfs/dbraw/zinc/08/55/39/517085539.db2.gz NYJVTECAXJVTFY-OAHLLOKOSA-N 1 1 361.398 2.999 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@@H+](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552249643 517162592 /nfs/dbraw/zinc/16/25/92/517162592.db2.gz GUCOCHMWSQSCCZ-GOSISDBHSA-N 1 1 357.458 2.882 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000548751547 517188821 /nfs/dbraw/zinc/18/88/21/517188821.db2.gz HRATVAVKIOCZMN-GOSISDBHSA-N 1 1 368.437 2.561 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@@H+]1Cc1ccccc1 ZINC000545403472 517221304 /nfs/dbraw/zinc/22/13/04/517221304.db2.gz CKBCMMZACBCNKA-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000545403472 517221317 /nfs/dbraw/zinc/22/13/17/517221317.db2.gz CKBCMMZACBCNKA-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])n1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000545476804 517257989 /nfs/dbraw/zinc/25/79/89/517257989.db2.gz KBAIEZXIVJDHIP-MRXNPFEDSA-N 1 1 356.426 2.670 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000533049456 517268033 /nfs/dbraw/zinc/26/80/33/517268033.db2.gz DCLINPNBAFVIDH-UHFFFAOYSA-N 1 1 365.336 2.822 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cc(F)cc(F)c1 ZINC000533049456 517268037 /nfs/dbraw/zinc/26/80/37/517268037.db2.gz DCLINPNBAFVIDH-UHFFFAOYSA-N 1 1 365.336 2.822 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000545830099 517384423 /nfs/dbraw/zinc/38/44/23/517384423.db2.gz QRKSQHVLJBCRKS-STQMWFEESA-N 1 1 351.422 2.953 20 5 FFBDMO CC[N@H+](Cc1ccc2c(c1)OCO2)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000520452927 517398590 /nfs/dbraw/zinc/39/85/90/517398590.db2.gz LPKZQRLVHNPPDT-OAHLLOKOSA-N 1 1 374.393 2.585 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000533447573 517469143 /nfs/dbraw/zinc/46/91/43/517469143.db2.gz JQMWOFNZELFBSN-TZMCWYRMSA-N 1 1 368.865 2.991 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000562893399 517481611 /nfs/dbraw/zinc/48/16/11/517481611.db2.gz ZWKNZQONLCFWNP-UHFFFAOYSA-N 1 1 373.319 2.943 20 5 FFBDMO O=C(NC[C@H]([NH2+]Cc1ccccc1)c1ccco1)c1cc([N+](=O)[O-])c[nH]1 ZINC000516033430 517543445 /nfs/dbraw/zinc/54/34/45/517543445.db2.gz XDNFLBKHHXGZRX-INIZCTEOSA-N 1 1 354.366 2.777 20 5 FFBDMO Cn1cnc2cc(C[NH+]3CCN(c4ccccc4[N+](=O)[O-])CC3)ccc21 ZINC000538307728 517555265 /nfs/dbraw/zinc/55/52/65/517555265.db2.gz DTEBSWDZOKFFOH-UHFFFAOYSA-N 1 1 351.410 2.804 20 5 FFBDMO O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000546266956 517623208 /nfs/dbraw/zinc/62/32/08/517623208.db2.gz QBXSYDMPJNELAX-CQSZACIVSA-N 1 1 370.409 2.891 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@]3(C2)CCC[N@H+](C)C3)ncc1[N+](=O)[O-] ZINC000549576842 517625605 /nfs/dbraw/zinc/62/56/05/517625605.db2.gz DCFHCFRBFQCFQP-HNNXBMFYSA-N 1 1 369.263 2.983 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(c2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000553334785 517650935 /nfs/dbraw/zinc/65/09/35/517650935.db2.gz DDMZKFYSCVZRQJ-UHFFFAOYSA-N 1 1 355.423 2.920 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556882792 517726415 /nfs/dbraw/zinc/72/64/15/517726415.db2.gz DTCLEMLNEIPBHS-HNNXBMFYSA-N 1 1 374.441 2.969 20 5 FFBDMO CCN(C(=O)c1[nH]nc(C)c1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477126 517748680 /nfs/dbraw/zinc/74/86/80/517748680.db2.gz SDHYWDXZIUJTIZ-GOEBONIOSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477126 517748688 /nfs/dbraw/zinc/74/86/88/517748688.db2.gz SDHYWDXZIUJTIZ-GOEBONIOSA-N 1 1 371.441 2.924 20 5 FFBDMO CCN(C(=O)c1n[nH]c(C)c1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000521477126 517748696 /nfs/dbraw/zinc/74/86/96/517748696.db2.gz SDHYWDXZIUJTIZ-GOEBONIOSA-N 1 1 371.441 2.924 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)c1ccc([N+](=O)[O-])cc1F ZINC000557024157 517809942 /nfs/dbraw/zinc/80/99/42/517809942.db2.gz QOOAHVUIHKBLIL-OAHLLOKOSA-N 1 1 359.357 2.553 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553768746 517893341 /nfs/dbraw/zinc/89/33/41/517893341.db2.gz SZTYJEMKCCNRTC-WOSRLPQWSA-N 1 1 361.442 2.714 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1 ZINC000553812830 517917678 /nfs/dbraw/zinc/91/76/78/517917678.db2.gz AKTOAQGFNKMENA-HZPDHXFCSA-N 1 1 363.458 2.909 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543136557 517927104 /nfs/dbraw/zinc/92/71/04/517927104.db2.gz HNVZZXQKYIOJIL-KKVAFCGZSA-N 1 1 372.421 2.659 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000550433216 518053970 /nfs/dbraw/zinc/05/39/70/518053970.db2.gz FQAFWZCGKCCHCR-SFHVURJKSA-N 1 1 360.414 2.875 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000550433216 518053975 /nfs/dbraw/zinc/05/39/75/518053975.db2.gz FQAFWZCGKCCHCR-SFHVURJKSA-N 1 1 360.414 2.875 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@@H](C3CCCCC3)C2)c1 ZINC000543585132 518145968 /nfs/dbraw/zinc/14/59/68/518145968.db2.gz IEMWIDHXNWXJLH-PKOBYXMFSA-N 1 1 364.442 2.616 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@@H](C3CCCCC3)C2)c1 ZINC000543585132 518145976 /nfs/dbraw/zinc/14/59/76/518145976.db2.gz IEMWIDHXNWXJLH-PKOBYXMFSA-N 1 1 364.442 2.616 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000535274855 518172355 /nfs/dbraw/zinc/17/23/55/518172355.db2.gz DCTCEBGVHNKHJY-INIZCTEOSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000535274855 518172357 /nfs/dbraw/zinc/17/23/57/518172357.db2.gz DCTCEBGVHNKHJY-INIZCTEOSA-N 1 1 350.378 2.993 20 5 FFBDMO COc1cccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)c1[N+](=O)[O-] ZINC000569980578 518386348 /nfs/dbraw/zinc/38/63/48/518386348.db2.gz GNZCTGIFPUYMSQ-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO C[N@H+]1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCCCC2 ZINC000584538668 518388563 /nfs/dbraw/zinc/38/85/63/518388563.db2.gz XJCUOWROEDXMIN-GOSISDBHSA-N 1 1 372.469 2.650 20 5 FFBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)C[C@@H]21 ZINC000584710852 518441190 /nfs/dbraw/zinc/44/11/90/518441190.db2.gz KKIRLDYOSJRPIG-IRXDYDNUSA-N 1 1 354.410 2.566 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000570233626 518508015 /nfs/dbraw/zinc/50/80/15/518508015.db2.gz WMGGJOYAOUQXOA-ROUUACIJSA-N 1 1 357.458 2.882 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000576311166 518529677 /nfs/dbraw/zinc/52/96/77/518529677.db2.gz UXNGGODZYUERSZ-KRWDZBQOSA-N 1 1 361.442 2.891 20 5 FFBDMO O=C(c1ccccc1)N1CC[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000582015251 518547910 /nfs/dbraw/zinc/54/79/10/518547910.db2.gz FQTQEVUGPRZGTA-OAHLLOKOSA-N 1 1 366.421 2.510 20 5 FFBDMO O=C(c1ccccc1)N1CC[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C1 ZINC000582015251 518547917 /nfs/dbraw/zinc/54/79/17/518547917.db2.gz FQTQEVUGPRZGTA-OAHLLOKOSA-N 1 1 366.421 2.510 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]21 ZINC000585767620 518591099 /nfs/dbraw/zinc/59/10/99/518591099.db2.gz RBFJXEREKWLYBA-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO CN(C)c1ccccc1C[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000579283897 518606740 /nfs/dbraw/zinc/60/67/40/518606740.db2.gz XKYFRVFWYKSJAE-IBGZPJMESA-N 1 1 368.437 2.898 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000579283897 518606743 /nfs/dbraw/zinc/60/67/43/518606743.db2.gz XKYFRVFWYKSJAE-IBGZPJMESA-N 1 1 368.437 2.898 20 5 FFBDMO O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCCC[N@H+]1C1CCCC1 ZINC000586802541 518647186 /nfs/dbraw/zinc/64/71/86/518647186.db2.gz NUOKEEYHQDECJS-INIZCTEOSA-N 1 1 357.414 2.629 20 5 FFBDMO CO[C@]1(C)CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1 ZINC000579488743 518706684 /nfs/dbraw/zinc/70/66/84/518706684.db2.gz ARIFUHLARYPFDM-GOSISDBHSA-N 1 1 363.414 2.784 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N[C@@H](C)C[NH+]1CCN(c2ccccn2)CC1 ZINC000573623987 518757138 /nfs/dbraw/zinc/75/71/38/518757138.db2.gz HFOYOHBOVCQLNR-HNNXBMFYSA-N 1 1 371.441 2.621 20 5 FFBDMO COc1ccc(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000568011345 518830314 /nfs/dbraw/zinc/83/03/14/518830314.db2.gz KRGYYRBKQUGOSU-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)Nc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000588866103 518852363 /nfs/dbraw/zinc/85/23/63/518852363.db2.gz MDCZMRYOZOWBSC-INIZCTEOSA-N 1 1 364.490 2.959 20 5 FFBDMO CC[N@H+](C)[C@H](c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)c1ccccc1 ZINC000589149949 518930375 /nfs/dbraw/zinc/93/03/75/518930375.db2.gz GHFMGYPJRIKDNU-ZDUSSCGKSA-N 1 1 356.386 2.728 20 5 FFBDMO CC[N@@H+](C)[C@H](c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)c1ccccc1 ZINC000589149949 518930383 /nfs/dbraw/zinc/93/03/83/518930383.db2.gz GHFMGYPJRIKDNU-ZDUSSCGKSA-N 1 1 356.386 2.728 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC(C[N@H+](C)C(C)C)CC2)c1 ZINC000589497113 519018491 /nfs/dbraw/zinc/01/84/91/519018491.db2.gz BOKWDLXIPSCIQK-UHFFFAOYSA-N 1 1 363.458 2.934 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000589497113 519018498 /nfs/dbraw/zinc/01/84/98/519018498.db2.gz BOKWDLXIPSCIQK-UHFFFAOYSA-N 1 1 363.458 2.934 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@](CO)(c3ccccc3)C1)OCCO2 ZINC000589737664 519074188 /nfs/dbraw/zinc/07/41/88/519074188.db2.gz OTPCIJHSGJPTNB-HXUWFJFHSA-N 1 1 370.405 2.502 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000590390353 519211725 /nfs/dbraw/zinc/21/17/25/519211725.db2.gz YJELZTQGNQOZQT-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000583442119 519251648 /nfs/dbraw/zinc/25/16/48/519251648.db2.gz RVUWJFKGOLZYHJ-QGZVFWFLSA-N 1 1 358.373 2.562 20 5 FFBDMO COC(=O)Cc1ccc(NCC[NH+]2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000590687819 519315614 /nfs/dbraw/zinc/31/56/14/519315614.db2.gz ZUZVXENSNJHAMB-UHFFFAOYSA-N 1 1 355.394 2.738 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2cnn(C)c2)CC(C)C)c1 ZINC000590781510 519365791 /nfs/dbraw/zinc/36/57/91/519365791.db2.gz IEPQCJPVOKHAPS-UHFFFAOYSA-N 1 1 360.414 2.773 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2cnn(C)c2)CC(C)C)c1 ZINC000590781510 519365799 /nfs/dbraw/zinc/36/57/99/519365799.db2.gz IEPQCJPVOKHAPS-UHFFFAOYSA-N 1 1 360.414 2.773 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC(C)(C)OCC1(C)C ZINC000591014734 519476521 /nfs/dbraw/zinc/47/65/21/519476521.db2.gz ITIZZXUZISOPIN-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO CC1(C2CC2)CC[NH+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000584141579 519609105 /nfs/dbraw/zinc/60/91/05/519609105.db2.gz FMKFANCRRQGOBE-UHFFFAOYSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443826 519613867 /nfs/dbraw/zinc/61/38/67/519613867.db2.gz GIWQEUCZDUEEEP-SUMWQHHRSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443826 519613874 /nfs/dbraw/zinc/61/38/74/519613874.db2.gz GIWQEUCZDUEEEP-SUMWQHHRSA-N 1 1 371.441 2.781 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](O)[C@@H]1CCc1ccccc1 ZINC000602851525 519923842 /nfs/dbraw/zinc/92/38/42/519923842.db2.gz LOIRZUISEHHLNW-ROUUACIJSA-N 1 1 358.442 2.558 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C(C)(C)C ZINC000602873292 519939825 /nfs/dbraw/zinc/93/98/25/519939825.db2.gz IRTUKFUYIYAXQI-HNNXBMFYSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]([C@H]2CCCO2)C2(CO)CCC2)c(F)c1 ZINC000602891466 519952354 /nfs/dbraw/zinc/95/23/54/519952354.db2.gz NKVBUOQXFGWCRE-HZPDHXFCSA-N 1 1 356.369 2.673 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000612529003 520005789 /nfs/dbraw/zinc/00/57/89/520005789.db2.gz YKFHWQRAIJKLBZ-WDEREUQCSA-N 1 1 357.332 2.970 20 5 FFBDMO CC(C)(C)n1nnc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000594512569 520008311 /nfs/dbraw/zinc/00/83/11/520008311.db2.gz WFQPFENUWANJTO-HIFRSBDPSA-N 1 1 358.446 2.837 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000602997284 520013356 /nfs/dbraw/zinc/01/33/56/520013356.db2.gz HBIBDXLGRJJDST-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@@H+]3C[C@H](O)C[C@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588235 520037253 /nfs/dbraw/zinc/03/72/53/520037253.db2.gz VPBIBLVAIPSIOT-JKSUJKDBSA-N 1 1 374.462 2.982 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@H+]3C[C@H](O)C[C@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588235 520037260 /nfs/dbraw/zinc/03/72/60/520037260.db2.gz VPBIBLVAIPSIOT-JKSUJKDBSA-N 1 1 374.462 2.982 20 5 FFBDMO COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000600192541 520112281 /nfs/dbraw/zinc/11/22/81/520112281.db2.gz QNNDQVUOVRURLM-GOSISDBHSA-N 1 1 360.366 2.619 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000609029692 520181173 /nfs/dbraw/zinc/18/11/73/520181173.db2.gz WHMNOLJMWHJBMO-SFHVURJKSA-N 1 1 356.426 2.816 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000609233548 520240103 /nfs/dbraw/zinc/24/01/03/520240103.db2.gz GJBNUVJJLIMQHN-ICSRJNTNSA-N 1 1 372.421 2.798 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000595011476 520253974 /nfs/dbraw/zinc/25/39/74/520253974.db2.gz FLQUHBVVGUFUOS-CQSZACIVSA-N 1 1 357.410 2.913 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000600469787 520279959 /nfs/dbraw/zinc/27/99/59/520279959.db2.gz KFQSEJDOZJAHIA-INIZCTEOSA-N 1 1 369.425 2.527 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000609547519 520353720 /nfs/dbraw/zinc/35/37/20/520353720.db2.gz BEXNKDSBERBUTC-UHFFFAOYSA-N 1 1 372.425 2.843 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000595294909 520392455 /nfs/dbraw/zinc/39/24/55/520392455.db2.gz UPZMZDSDCGQORJ-CKEIUWERSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000595294909 520392462 /nfs/dbraw/zinc/39/24/62/520392462.db2.gz UPZMZDSDCGQORJ-CKEIUWERSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCC[C@@H](C)C1 ZINC000603895040 520393981 /nfs/dbraw/zinc/39/39/81/520393981.db2.gz JAHANGZZVCXIMP-HUUCEWRRSA-N 1 1 371.441 2.631 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000609664480 520399835 /nfs/dbraw/zinc/39/98/35/520399835.db2.gz JJOQGSMHQCKCTC-INIZCTEOSA-N 1 1 374.485 2.611 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H]([C@H]4CCC[NH2+]C4)C3)n2)c1 ZINC000592492564 520417119 /nfs/dbraw/zinc/41/71/19/520417119.db2.gz AOLFLJXJFGSSBK-HOTGVXAUSA-N 1 1 371.441 2.856 20 5 FFBDMO COC(=O)c1ccc(-c2cccc(C[NH+]3CCOCC3)c2)c([N+](=O)[O-])c1 ZINC000600786198 520469416 /nfs/dbraw/zinc/46/94/16/520469416.db2.gz OHYASAMLULUOIY-UHFFFAOYSA-N 1 1 356.378 2.881 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000598220050 520501165 /nfs/dbraw/zinc/50/11/65/520501165.db2.gz OMBHTAIGIYBMGZ-OAHLLOKOSA-N 1 1 361.442 2.669 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505526 520515472 /nfs/dbraw/zinc/51/54/72/520515472.db2.gz VOGAPSXVLLCXER-HNAYVOBHSA-N 1 1 360.458 2.648 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341600 520564654 /nfs/dbraw/zinc/56/46/54/520564654.db2.gz DLQOANIIEYDNCN-DGCLKSJQSA-N 1 1 355.822 2.616 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](CO)Cc1ccccc1 ZINC000595593888 520578473 /nfs/dbraw/zinc/57/84/73/520578473.db2.gz BHYHGUUJHFSEDC-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](CO)Cc1ccccc1 ZINC000595593888 520578486 /nfs/dbraw/zinc/57/84/86/520578486.db2.gz BHYHGUUJHFSEDC-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000592793090 520581977 /nfs/dbraw/zinc/58/19/77/520581977.db2.gz IWRXVIQWPLHFBE-CYBMUJFWSA-N 1 1 358.398 2.595 20 5 FFBDMO O=C(C[NH+]1CCC(c2ccco2)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595615946 520594959 /nfs/dbraw/zinc/59/49/59/520594959.db2.gz OEZXBPDZFBYSIT-UHFFFAOYSA-N 1 1 355.394 2.957 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCN(Cc4cscn4)CC3)c2c1 ZINC000601106666 520637506 /nfs/dbraw/zinc/63/75/06/520637506.db2.gz ULMHXGUYSOFROM-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595682565 520644482 /nfs/dbraw/zinc/64/44/82/520644482.db2.gz BHYVBTZAWCCFDP-GOSISDBHSA-N 1 1 373.409 2.544 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000601132596 520652310 /nfs/dbraw/zinc/65/23/10/520652310.db2.gz KHESSUQUQOAREJ-PWSUYJOCSA-N 1 1 373.379 2.800 20 5 FFBDMO Cn1c(=O)sc2cc(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)ccc21 ZINC000601148617 520658891 /nfs/dbraw/zinc/65/88/91/520658891.db2.gz FNWODCTXYNHHPA-GOSISDBHSA-N 1 1 373.434 2.506 20 5 FFBDMO COc1cc2c(c(C[NH2+][C@](C)(CO)c3cccc([N+](=O)[O-])c3)c1)O[C@@H](C)C2 ZINC000601149302 520662525 /nfs/dbraw/zinc/66/25/25/520662525.db2.gz KSEPKZUDXDZNBM-RNODOKPDSA-N 1 1 372.421 2.924 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCOC[C@@H]3[C@@H]3CCCC[C@@H]3O)c2c1 ZINC000601164258 520668677 /nfs/dbraw/zinc/66/86/77/520668677.db2.gz RFBXFYJKRIJVOT-KYNGSXCRSA-N 1 1 357.410 2.899 20 5 FFBDMO Cn1nccc1[C@H]1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601171171 520670604 /nfs/dbraw/zinc/67/06/04/520670604.db2.gz HGZGUWHGCYJHED-KZULUSFZSA-N 1 1 353.382 2.631 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000593015287 520685764 /nfs/dbraw/zinc/68/57/64/520685764.db2.gz QICCAKZMGRFUOI-SFHVURJKSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000593015287 520685770 /nfs/dbraw/zinc/68/57/70/520685770.db2.gz QICCAKZMGRFUOI-SFHVURJKSA-N 1 1 357.385 2.792 20 5 FFBDMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000593040944 520702250 /nfs/dbraw/zinc/70/22/50/520702250.db2.gz OSNCJEDWZSJLCQ-LJQANCHMSA-N 1 1 357.385 2.996 20 5 FFBDMO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000593040942 520702333 /nfs/dbraw/zinc/70/23/33/520702333.db2.gz OSNCJEDWZSJLCQ-IBGZPJMESA-N 1 1 357.385 2.996 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598560450 520705366 /nfs/dbraw/zinc/70/53/66/520705366.db2.gz MGMZWRDRQQIHGL-HNNXBMFYSA-N 1 1 370.453 2.857 20 5 FFBDMO CC[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](CC)CO1 ZINC000593059754 520714918 /nfs/dbraw/zinc/71/49/18/520714918.db2.gz TWSGEXDKMJPDQE-ZFWWWQNUSA-N 1 1 363.414 2.782 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000610523059 520727254 /nfs/dbraw/zinc/72/72/54/520727254.db2.gz DQGVXZYSYMSKJP-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC000593089822 520737731 /nfs/dbraw/zinc/73/77/31/520737731.db2.gz FNPKDMTXTORGOH-DOTOQJQBSA-N 1 1 356.422 2.996 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2C[C@@H]2C1)Nc1cc(N2CC[C@H]3C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000595810777 520740641 /nfs/dbraw/zinc/74/06/41/520740641.db2.gz NXWUHUAVTRGTNC-QXSJWSMHSA-N 1 1 370.453 2.721 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2C[C@@H]2C1)Nc1cc(N2CC[C@H]3C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000595810777 520740648 /nfs/dbraw/zinc/74/06/48/520740648.db2.gz NXWUHUAVTRGTNC-QXSJWSMHSA-N 1 1 370.453 2.721 20 5 FFBDMO COC(=O)c1ccnc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000598610157 520740823 /nfs/dbraw/zinc/74/08/23/520740823.db2.gz DZPRIRXFFFXPDS-CHWSQXEVSA-N 1 1 362.430 2.841 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595850786 520766931 /nfs/dbraw/zinc/76/69/31/520766931.db2.gz OTBPSBFKRAPRAD-HNNXBMFYSA-N 1 1 372.425 2.986 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595850786 520766941 /nfs/dbraw/zinc/76/69/41/520766941.db2.gz OTBPSBFKRAPRAD-HNNXBMFYSA-N 1 1 372.425 2.986 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[C@@H](C4CC[NH2+]CC4)C3)n2)cc1 ZINC000595900359 520805009 /nfs/dbraw/zinc/80/50/09/520805009.db2.gz DBUJNHSPUOYBEO-MRXNPFEDSA-N 1 1 371.441 2.856 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@@H](C4CC[NH2+]CC4)C3)n2)c1 ZINC000595901471 520808125 /nfs/dbraw/zinc/80/81/25/520808125.db2.gz WNVKTJHSDDDQFD-MRXNPFEDSA-N 1 1 371.441 2.856 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[C@H](C4CC[NH2+]CC4)C3)n2)c1 ZINC000595901470 520808247 /nfs/dbraw/zinc/80/82/47/520808247.db2.gz WNVKTJHSDDDQFD-INIZCTEOSA-N 1 1 371.441 2.856 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@@H](C)C[N@H+]1C ZINC000593187557 520810701 /nfs/dbraw/zinc/81/07/01/520810701.db2.gz LSZIVBFEAFPINF-XHSDSOJGSA-N 1 1 374.485 2.751 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000593316802 520905497 /nfs/dbraw/zinc/90/54/97/520905497.db2.gz XSTOSIDBOQRWFF-GMBSWORKSA-N 1 1 363.458 2.712 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000596097246 520908928 /nfs/dbraw/zinc/90/89/28/520908928.db2.gz DDAPGJJWZOTWPT-OKILXGFUSA-N 1 1 367.881 2.638 20 5 FFBDMO CC(C)c1ncc2c(n1)CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000598938288 520931200 /nfs/dbraw/zinc/93/12/00/520931200.db2.gz YKICSWHROBLNMH-UHFFFAOYSA-N 1 1 369.425 2.895 20 5 FFBDMO COc1cc(N2CC[NH+](C3CCOCC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596148246 520938681 /nfs/dbraw/zinc/93/86/81/520938681.db2.gz BAWRYACFGDWHKT-UHFFFAOYSA-N 1 1 355.822 2.558 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088387 520978723 /nfs/dbraw/zinc/97/87/23/520978723.db2.gz SQJUMBBDZHYDKW-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611088387 520978728 /nfs/dbraw/zinc/97/87/28/520978728.db2.gz SQJUMBBDZHYDKW-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000599024008 520987383 /nfs/dbraw/zinc/98/73/83/520987383.db2.gz FKDUUSYOMMXQPZ-CYBMUJFWSA-N 1 1 368.865 2.822 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC1CC([NH+]2CCOCC2)C1 ZINC000599095013 521029838 /nfs/dbraw/zinc/02/98/38/521029838.db2.gz OLFRJHCWWHVFPK-UHFFFAOYSA-N 1 1 356.220 2.632 20 5 FFBDMO Cc1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)c([N+](=O)[O-])c1 ZINC000593495818 521031730 /nfs/dbraw/zinc/03/17/30/521031730.db2.gz JWBDBRXAJQZSQV-OALUTQOASA-N 1 1 368.437 2.778 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599125885 521042834 /nfs/dbraw/zinc/04/28/34/521042834.db2.gz FBTONDSCWBNFHQ-AWEZNQCLSA-N 1 1 367.471 2.817 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@@H]2CC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599125885 521042843 /nfs/dbraw/zinc/04/28/43/521042843.db2.gz FBTONDSCWBNFHQ-AWEZNQCLSA-N 1 1 367.471 2.817 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+][C@H](CF)c1ccc(F)cc1 ZINC000601973581 521049203 /nfs/dbraw/zinc/04/92/03/521049203.db2.gz QGYFQBSIUAWRQS-HUUCEWRRSA-N 1 1 352.337 2.774 20 5 FFBDMO COc1cc(C[N@H+]2CCc3ccc(O)cc3CC2)c([N+](=O)[O-])cc1OC ZINC000611266576 521065374 /nfs/dbraw/zinc/06/53/74/521065374.db2.gz BXNXUPJHYQNJFX-UHFFFAOYSA-N 1 1 358.394 2.918 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000593658970 521136144 /nfs/dbraw/zinc/13/61/44/521136144.db2.gz JTJWZDWDXRRODB-OAHLLOKOSA-N 1 1 366.414 2.536 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000593686498 521158477 /nfs/dbraw/zinc/15/84/77/521158477.db2.gz FYBCEGHBOSGACI-GOSISDBHSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000593686498 521158486 /nfs/dbraw/zinc/15/84/86/521158486.db2.gz FYBCEGHBOSGACI-GOSISDBHSA-N 1 1 371.412 2.662 20 5 FFBDMO C[NH+](C)CCCOc1ccc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)cc1 ZINC000611559187 521219003 /nfs/dbraw/zinc/21/90/03/521219003.db2.gz FDSIFSVEFASBMK-UHFFFAOYSA-N 1 1 359.382 2.883 20 5 FFBDMO Cc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)c(N2CCCC2)[nH+]1 ZINC000611582293 521237157 /nfs/dbraw/zinc/23/71/57/521237157.db2.gz XFEOTGHOIPGBBH-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](C)[C@H](O)C2)cc1OC ZINC000611668761 521272410 /nfs/dbraw/zinc/27/24/10/521272410.db2.gz VGXCGRFESWXFMH-WOSRLPQWSA-N 1 1 352.431 2.841 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@@H](C)[C@H](O)C2)cc1OC ZINC000611668761 521272416 /nfs/dbraw/zinc/27/24/16/521272416.db2.gz VGXCGRFESWXFMH-WOSRLPQWSA-N 1 1 352.431 2.841 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(C)(N3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000599623795 521339418 /nfs/dbraw/zinc/33/94/18/521339418.db2.gz XIBNCCABDFGWTP-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO C/C=C\C[C@@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690292 521404402 /nfs/dbraw/zinc/40/44/02/521404402.db2.gz NCVDAMHDZIGTGG-XQJDBVBESA-N 1 1 361.398 2.940 20 5 FFBDMO C/C=C\C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690292 521404413 /nfs/dbraw/zinc/40/44/13/521404413.db2.gz NCVDAMHDZIGTGG-XQJDBVBESA-N 1 1 361.398 2.940 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108725 521408685 /nfs/dbraw/zinc/40/86/85/521408685.db2.gz FPZIIRVUXQAKSB-MELADBBJSA-N 1 1 364.446 2.776 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108725 521408686 /nfs/dbraw/zinc/40/86/86/521408686.db2.gz FPZIIRVUXQAKSB-MELADBBJSA-N 1 1 364.446 2.776 20 5 FFBDMO CC(C)N1CC[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C1=O ZINC000602555402 521410344 /nfs/dbraw/zinc/41/03/44/521410344.db2.gz PUOPSXQCFIMYCD-SNVBAGLBSA-N 1 1 362.249 2.518 20 5 FFBDMO O=C(N[C@@H]1CCC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1cc([N+](=O)[O-])c[nH]1 ZINC000612037584 521450434 /nfs/dbraw/zinc/45/04/34/521450434.db2.gz HMOZFFKUWDQFSD-CGTJXYLNSA-N 1 1 368.437 2.953 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000594198702 521464720 /nfs/dbraw/zinc/46/47/20/521464720.db2.gz VCPGVBPGRAHVAS-JKSUJKDBSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]2N1 ZINC000602711487 521491769 /nfs/dbraw/zinc/49/17/69/521491769.db2.gz ZUNYBYNPPIJPIX-GXFFZTMASA-N 1 1 357.332 2.714 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc(Cl)cc1[N+](=O)[O-] ZINC000597091968 521497854 /nfs/dbraw/zinc/49/78/54/521497854.db2.gz HULQDHKBQILLKA-DGCLKSJQSA-N 1 1 367.837 2.969 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@@H]2C1 ZINC000599832688 521501893 /nfs/dbraw/zinc/50/18/93/521501893.db2.gz IGUABJJKGAPLAH-YVEFUNNKSA-N 1 1 355.398 2.701 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594284313 521537200 /nfs/dbraw/zinc/53/72/00/521537200.db2.gz VQXCHRPTSIPMBW-SJLPKXTDSA-N 1 1 360.458 2.796 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)c1 ZINC000602810740 521547596 /nfs/dbraw/zinc/54/75/96/521547596.db2.gz IJXBOEHPEOWMGM-HNNXBMFYSA-N 1 1 354.414 2.553 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000602824389 521553764 /nfs/dbraw/zinc/55/37/64/521553764.db2.gz BNSBGVQIDNINCI-UHFFFAOYSA-N 1 1 365.384 2.590 20 5 FFBDMO Cn1cc(C[NH2+][C@@H](c2cncc(Br)c2)C2CC2)c([N+](=O)[O-])n1 ZINC000602828840 521556840 /nfs/dbraw/zinc/55/68/40/521556840.db2.gz VHEXWMDQNMJSRC-CYBMUJFWSA-N 1 1 366.219 2.727 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]2N1 ZINC000597204736 521573780 /nfs/dbraw/zinc/57/37/80/521573780.db2.gz FTIYXYURHZAXIG-XJKSGUPXSA-N 1 1 355.394 2.955 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000619785176 521872290 /nfs/dbraw/zinc/87/22/90/521872290.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785176 521872296 /nfs/dbraw/zinc/87/22/96/521872296.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000619785176 521872308 /nfs/dbraw/zinc/87/23/08/521872308.db2.gz KINPGUSMGVLRKO-HXUWFJFHSA-N 1 1 357.454 2.562 20 5 FFBDMO C[C@H](CCNc1ccc2ncc([N+](=O)[O-])n2n1)[N@@H+](C)Cc1ccccc1 ZINC000502353700 561616807 /nfs/dbraw/zinc/61/68/07/561616807.db2.gz QPMHQWNAXABSIR-CQSZACIVSA-N 1 1 354.414 2.960 20 5 FFBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(-c2nn[nH]n2)cc1 ZINC000824633979 608464331 /nfs/dbraw/zinc/46/43/31/608464331.db2.gz SJBWJVLIVDZSKP-SNVBAGLBSA-N 1 1 365.353 2.767 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)sc2C1 ZINC000021295250 670032636 /nfs/dbraw/zinc/03/26/36/670032636.db2.gz MNAIWQXHBKPONV-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)sc2C1 ZINC000021295250 670032639 /nfs/dbraw/zinc/03/26/39/670032639.db2.gz MNAIWQXHBKPONV-UHFFFAOYSA-N 1 1 362.411 2.690 20 5 FFBDMO COC[C@H]1C[N@@H+](CC2CC2)C[C@]12CCN(c1ncc([N+](=O)[O-])c(C)c1C)C2 ZINC001164811788 720126799 /nfs/dbraw/zinc/12/67/99/720126799.db2.gz NJYZLIAPHYSQRG-XLIONFOSSA-N 1 1 374.485 2.791 20 5 FFBDMO Cc1cnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)c([N+](=O)[O-])c1 ZINC001164859713 720924921 /nfs/dbraw/zinc/92/49/21/720924921.db2.gz PKUGKAJBLRBWQS-CQSZACIVSA-N 1 1 358.446 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164897255 721512021 /nfs/dbraw/zinc/51/20/21/721512021.db2.gz FNQHHVCHYADCEU-FUHWJXTLSA-N 1 1 372.400 2.779 20 5 FFBDMO CC(C)Oc1nc(N2CC[NH+](CCc3ccccn3)CC2)ccc1[N+](=O)[O-] ZINC001165054901 722018227 /nfs/dbraw/zinc/01/82/27/722018227.db2.gz IULDVPQFVVBVKB-UHFFFAOYSA-N 1 1 371.441 2.537 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000159144981 728901629 /nfs/dbraw/zinc/90/16/29/728901629.db2.gz ZQHUTIDDTCVHAQ-UWVGGRQHSA-N 1 1 356.220 2.570 20 5 FFBDMO CCOC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000113939765 728558400 /nfs/dbraw/zinc/55/84/00/728558400.db2.gz YCBBGHKORCPRSM-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000113939765 728558401 /nfs/dbraw/zinc/55/84/01/728558401.db2.gz YCBBGHKORCPRSM-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO C[C@@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000171954691 729016343 /nfs/dbraw/zinc/01/63/43/729016343.db2.gz LDGZSEPNSPZCPH-ZDUSSCGKSA-N 1 1 353.419 2.819 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000174821741 729080805 /nfs/dbraw/zinc/08/08/05/729080805.db2.gz LEGJZWBKIHWIOK-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000174821741 729080810 /nfs/dbraw/zinc/08/08/10/729080810.db2.gz LEGJZWBKIHWIOK-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000778949679 738423674 /nfs/dbraw/zinc/42/36/74/738423674.db2.gz RKHNKDPVORXXOY-GFCCVEGCSA-N 1 1 353.419 2.948 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000861340144 730600518 /nfs/dbraw/zinc/60/05/18/730600518.db2.gz FFZMUYULNXRSIX-JDFRZJQESA-N 1 1 368.455 2.728 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@]1(C)C[C@H](OC)C[N@H+]1C ZINC000861350679 730602841 /nfs/dbraw/zinc/60/28/41/730602841.db2.gz QNRDTFWQIFAFLU-GUYCJALGSA-N 1 1 368.455 2.973 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)CCN1c1ccccc1[N+](=O)[O-] ZINC000863294976 730764987 /nfs/dbraw/zinc/76/49/87/730764987.db2.gz QAQDMZDKXWHASE-KGLIPLIRSA-N 1 1 362.455 2.764 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)CCN1c1ccccc1[N+](=O)[O-] ZINC000863294976 730764990 /nfs/dbraw/zinc/76/49/90/730764990.db2.gz QAQDMZDKXWHASE-KGLIPLIRSA-N 1 1 362.455 2.764 20 5 FFBDMO C[C@H]([NH2+]Cc1c(Br)cnn1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866432159 731059845 /nfs/dbraw/zinc/05/98/45/731059845.db2.gz MJVMWOMECNUDPF-QMMMGPOBSA-N 1 1 354.208 2.524 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000874825259 732104117 /nfs/dbraw/zinc/10/41/17/732104117.db2.gz ITZLMAKJJMOMKW-KBPBESRZSA-N 1 1 357.332 2.922 20 5 FFBDMO CO[C@H]1CCC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878046455 732473839 /nfs/dbraw/zinc/47/38/39/732473839.db2.gz AGMAUBASJKPSLK-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO CO[C@H]1CCC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878046455 732473843 /nfs/dbraw/zinc/47/38/43/732473843.db2.gz AGMAUBASJKPSLK-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC3(CC2)COCCO3)ccc1Br ZINC000880546367 732922469 /nfs/dbraw/zinc/92/24/69/732922469.db2.gz MRENVUSTSMQSLH-UHFFFAOYSA-N 1 1 371.231 2.739 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3Br)CC[C@H]21 ZINC000881439510 733055164 /nfs/dbraw/zinc/05/51/64/733055164.db2.gz NZSXYYKHPOCFGC-ZYHUDNBSSA-N 1 1 368.231 2.524 20 5 FFBDMO CCC1([NH+]2CCC2)CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000884717925 733553878 /nfs/dbraw/zinc/55/38/78/733553878.db2.gz PIKNJNIZWTVJSI-UHFFFAOYSA-N 1 1 373.500 2.515 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885974952 733736424 /nfs/dbraw/zinc/73/64/24/733736424.db2.gz GKJZOSGPUUJXLI-ZDUSSCGKSA-N 1 1 350.419 2.727 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000885974952 733736425 /nfs/dbraw/zinc/73/64/25/733736425.db2.gz GKJZOSGPUUJXLI-ZDUSSCGKSA-N 1 1 350.419 2.727 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]1(C)CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886192418 733758271 /nfs/dbraw/zinc/75/82/71/733758271.db2.gz VGEQFRNUSAJKDS-KRWDZBQOSA-N 1 1 350.419 2.727 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@]1(C)CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886192418 733758274 /nfs/dbraw/zinc/75/82/74/733758274.db2.gz VGEQFRNUSAJKDS-KRWDZBQOSA-N 1 1 350.419 2.727 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000888834533 734103899 /nfs/dbraw/zinc/10/38/99/734103899.db2.gz KVGOKEPDGQTUND-ZDUSSCGKSA-N 1 1 350.419 2.845 20 5 FFBDMO CC[NH+](CC)CC1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])CC1 ZINC000891611911 734452085 /nfs/dbraw/zinc/45/20/85/734452085.db2.gz YDZFAJWKIIKGLO-UHFFFAOYSA-N 1 1 351.447 2.863 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)Cc2ccccc2)cc1Cl ZINC000783605370 738819037 /nfs/dbraw/zinc/81/90/37/738819037.db2.gz ZQSLEGNMYSKCKO-UHFFFAOYSA-N 1 1 368.842 2.953 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091428 738820505 /nfs/dbraw/zinc/82/05/05/738820505.db2.gz FAQDQJMOYAUUFX-KGLIPLIRSA-N 1 1 361.423 2.651 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091428 738820506 /nfs/dbraw/zinc/82/05/06/738820506.db2.gz FAQDQJMOYAUUFX-KGLIPLIRSA-N 1 1 361.423 2.651 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000732036482 734713298 /nfs/dbraw/zinc/71/32/98/734713298.db2.gz SNYSNNBURRBCSF-GFCCVEGCSA-N 1 1 368.231 2.666 20 5 FFBDMO COc1cc(C[NH2+]C[C@H]2CC(C)=NO2)c([N+](=O)[O-])cc1OCC(F)F ZINC000895307374 734989222 /nfs/dbraw/zinc/98/92/22/734989222.db2.gz QHQPSVIUBVQWBX-LLVKDONJSA-N 1 1 359.329 2.502 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO ZINC000897220408 735207853 /nfs/dbraw/zinc/20/78/53/735207853.db2.gz ASLDRYCVEADEEZ-STQMWFEESA-N 1 1 359.348 2.649 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=S)NC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000751916526 735934352 /nfs/dbraw/zinc/93/43/52/735934352.db2.gz BHDWIZRWTDJDHL-OAHLLOKOSA-N 1 1 350.488 2.778 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932772 735937017 /nfs/dbraw/zinc/93/70/17/735937017.db2.gz FQHSWAFJBJFSSY-ZWNOBZJWSA-N 1 1 361.240 2.647 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cn2cc(Br)c([N+](=O)[O-])n2)C1(C)C ZINC000751932772 735937020 /nfs/dbraw/zinc/93/70/20/735937020.db2.gz FQHSWAFJBJFSSY-ZWNOBZJWSA-N 1 1 361.240 2.647 20 5 FFBDMO CSCC1CC[NH+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000902392760 735941721 /nfs/dbraw/zinc/94/17/21/735941721.db2.gz LQJGLPBUDLXAOG-KRWDZBQOSA-N 1 1 363.483 2.943 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@@H+]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000753094503 736037109 /nfs/dbraw/zinc/03/71/09/736037109.db2.gz DLOFZYXKEXBNPK-SNVBAGLBSA-N 1 1 370.247 2.880 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000755025985 736227894 /nfs/dbraw/zinc/22/78/94/736227894.db2.gz PZBUTWBLJZKKAX-GXSJLCMTSA-N 1 1 371.235 2.962 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000906791353 736543902 /nfs/dbraw/zinc/54/39/02/736543902.db2.gz LCGAMOLJBKMBBK-GWCFXTLKSA-N 1 1 354.838 2.633 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906969758 736566642 /nfs/dbraw/zinc/56/66/42/736566642.db2.gz BETJTCRYMZUSDD-ZBEGNZNMSA-N 1 1 351.834 2.780 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)c2ccccc2)cc1Cl ZINC000761523072 736742713 /nfs/dbraw/zinc/74/27/13/736742713.db2.gz QSJBTONCLQHSJB-UHFFFAOYSA-N 1 1 354.815 2.812 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc([N+](=O)[O-])ccc1SCCO ZINC000763744491 736965268 /nfs/dbraw/zinc/96/52/68/736965268.db2.gz NBRDOXDCODZDRE-ZDUSSCGKSA-N 1 1 368.455 2.710 20 5 FFBDMO CC[N@@H+](C[C@H]1CCOC1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764197670 737000966 /nfs/dbraw/zinc/00/09/66/737000966.db2.gz PQEPPNYUUJSXAO-NWDGAFQWSA-N 1 1 355.822 2.934 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001883 737589227 /nfs/dbraw/zinc/58/92/27/737589227.db2.gz MQTAYPIYWVVYJP-SJLPKXTDSA-N 1 1 350.415 2.826 20 5 FFBDMO CCC[C@]1(C(=O)OCC)CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000770001883 737589231 /nfs/dbraw/zinc/58/92/31/737589231.db2.gz MQTAYPIYWVVYJP-SJLPKXTDSA-N 1 1 350.415 2.826 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)cc([N+](=O)[O-])c1F ZINC000771743888 737751144 /nfs/dbraw/zinc/75/11/44/737751144.db2.gz SQFDYOAZEWPOBY-UHFFFAOYSA-N 1 1 373.450 2.585 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000923262319 738263274 /nfs/dbraw/zinc/26/32/74/738263274.db2.gz UPFQYCXMILKXIM-WDEREUQCSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000785547482 738976114 /nfs/dbraw/zinc/97/61/14/738976114.db2.gz YVVDULVJDZARHN-BFQNTYOBSA-N 1 1 353.394 2.544 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932017557 739373368 /nfs/dbraw/zinc/37/33/68/739373368.db2.gz WGBWHVIHDHJGND-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO CN(C(=O)CCc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000932547519 739467741 /nfs/dbraw/zinc/46/77/41/739467741.db2.gz NAKLZJDWDMWEHF-CYBMUJFWSA-N 1 1 351.834 2.876 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790694258 739485383 /nfs/dbraw/zinc/48/53/83/739485383.db2.gz VWNAZDIRHSVXRT-GFCCVEGCSA-N 1 1 357.813 2.920 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)s1 ZINC000932665838 739487783 /nfs/dbraw/zinc/48/77/83/739487783.db2.gz SEKUHMDVPJMNMH-SNVBAGLBSA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)s1 ZINC000932665838 739487785 /nfs/dbraw/zinc/48/77/85/739487785.db2.gz SEKUHMDVPJMNMH-SNVBAGLBSA-N 1 1 365.386 2.967 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000933247630 739588504 /nfs/dbraw/zinc/58/85/04/739588504.db2.gz HKPIZSBISULGHU-CQSZACIVSA-N 1 1 368.865 2.849 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333399 739766813 /nfs/dbraw/zinc/76/68/13/739766813.db2.gz OTPZXAZKCSARKW-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934333399 739766817 /nfs/dbraw/zinc/76/68/17/739766817.db2.gz OTPZXAZKCSARKW-ZDUSSCGKSA-N 1 1 360.439 2.863 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934337315 739769096 /nfs/dbraw/zinc/76/90/96/739769096.db2.gz VVQBOZWHLDKCNF-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934337315 739769101 /nfs/dbraw/zinc/76/91/01/739769101.db2.gz VVQBOZWHLDKCNF-CHWSQXEVSA-N 1 1 360.439 2.943 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2COC(=O)N(C)C)ccc1[N+](=O)[O-] ZINC000796550138 740152612 /nfs/dbraw/zinc/15/26/12/740152612.db2.gz UIZSUDXWGCRXTK-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2COC(=O)N(C)C)ccc1[N+](=O)[O-] ZINC000796550138 740152615 /nfs/dbraw/zinc/15/26/15/740152615.db2.gz UIZSUDXWGCRXTK-CQSZACIVSA-N 1 1 351.403 2.656 20 5 FFBDMO CC(C)(C)CC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000957547717 740545308 /nfs/dbraw/zinc/54/53/08/740545308.db2.gz MMVIFEKSVMAINL-HZPDHXFCSA-N 1 1 351.491 2.792 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000809916620 741360414 /nfs/dbraw/zinc/36/04/14/741360414.db2.gz QDYCJERAROBCNH-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000811598768 741541561 /nfs/dbraw/zinc/54/15/61/741541561.db2.gz CCFLGXJAMHRYBF-LLVKDONJSA-N 1 1 352.391 2.662 20 5 FFBDMO CC[C@@H](C)[C@H](OC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173249 741684532 /nfs/dbraw/zinc/68/45/32/741684532.db2.gz ZKTPIUCQTKNSTO-COXVUDFISA-N 1 1 350.415 2.773 20 5 FFBDMO CC[C@@H](C)[C@H](OC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173249 741684533 /nfs/dbraw/zinc/68/45/33/741684533.db2.gz ZKTPIUCQTKNSTO-COXVUDFISA-N 1 1 350.415 2.773 20 5 FFBDMO COC1CC[NH+](C(C)(C)CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815578563 741946028 /nfs/dbraw/zinc/94/60/28/741946028.db2.gz QRIKMYABNYGNNK-ZDUSSCGKSA-N 1 1 350.463 2.717 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000817310747 742121923 /nfs/dbraw/zinc/12/19/23/742121923.db2.gz LEQWYHREQUMUFW-NSHDSACASA-N 1 1 371.235 2.915 20 5 FFBDMO Cc1cc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)cs1 ZINC001040700690 743023380 /nfs/dbraw/zinc/02/33/80/743023380.db2.gz PCXPHYQMDDGMNY-HZPDHXFCSA-N 1 1 363.483 2.536 20 5 FFBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)OC[C@H]1CCCC[N@H+]1C(C)C ZINC000837667298 746496004 /nfs/dbraw/zinc/49/60/04/746496004.db2.gz VDZKEOQDZIBPPT-GFCCVEGCSA-N 1 1 351.403 2.605 20 5 FFBDMO CCOc1cc(C[N@H+](C)CCNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000839136241 746785330 /nfs/dbraw/zinc/78/53/30/746785330.db2.gz KWPRDFLWEHXHTO-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CCOc1cc(C[N@@H+](C)CCNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000839136241 746785332 /nfs/dbraw/zinc/78/53/32/746785332.db2.gz KWPRDFLWEHXHTO-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CN(C)C(=O)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839455182 746831192 /nfs/dbraw/zinc/83/11/92/746831192.db2.gz FCRIUDABYLQXDN-UHFFFAOYSA-N 1 1 370.247 2.658 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839480826 746835821 /nfs/dbraw/zinc/83/58/21/746835821.db2.gz JXIYFUKLYMZDJI-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839480826 746835814 /nfs/dbraw/zinc/83/58/14/746835814.db2.gz JXIYFUKLYMZDJI-NSHDSACASA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839535973 746850102 /nfs/dbraw/zinc/85/01/02/746850102.db2.gz KHDYHNNXSNZWHY-UHFFFAOYSA-N 1 1 370.247 2.835 20 5 FFBDMO C[C@@H]1[C@H](C(=O)N[C@@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)CC[N@H+]1C ZINC000843907415 747925807 /nfs/dbraw/zinc/92/58/07/747925807.db2.gz ZCRZFXSZMLBVDZ-KKFJDGPESA-N 1 1 363.311 2.794 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000847256367 748663076 /nfs/dbraw/zinc/66/30/76/748663076.db2.gz PQAUIAJXFKYYSM-GJZGRUSLSA-N 1 1 353.369 2.820 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000852108582 749775676 /nfs/dbraw/zinc/77/56/76/749775676.db2.gz HWDPOVFDDCQFAR-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO Cc1noc(C[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1[N+](=O)[O-] ZINC000852149666 749785853 /nfs/dbraw/zinc/78/58/53/749785853.db2.gz LDRPMURBPZOUGZ-GFCCVEGCSA-N 1 1 354.407 2.769 20 5 FFBDMO C[C@@H](CO)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852424269 749856923 /nfs/dbraw/zinc/85/69/23/749856923.db2.gz ALMMOYBKNPETQS-LRDDRELGSA-N 1 1 353.394 2.545 20 5 FFBDMO C[NH+]1CCN(c2ccc(Nc3cc[nH]c(=O)c3[N+](=O)[O-])cc2Cl)CC1 ZINC000853245456 750037167 /nfs/dbraw/zinc/03/71/67/750037167.db2.gz VQYPVHZKHNWARG-UHFFFAOYSA-N 1 1 363.805 2.844 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@H](O)c3cccc(Cl)c3)C2)nc1 ZINC000072665081 845558078 /nfs/dbraw/zinc/55/80/78/845558078.db2.gz VNGRFLOADNRNHV-HOCLYGCPSA-N 1 1 362.817 2.863 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895843991 970992666 /nfs/dbraw/zinc/99/26/66/970992666.db2.gz KWTSVFZGLBPDMO-YJBOKZPZSA-N 1 1 356.426 2.996 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190503 1013079611 /nfs/dbraw/zinc/07/96/11/1013079611.db2.gz VKPXWBYETPIZFF-AUUYWEPGSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190503 1013079622 /nfs/dbraw/zinc/07/96/22/1013079622.db2.gz VKPXWBYETPIZFF-AUUYWEPGSA-N 1 1 359.401 2.978 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccc(C3CCC3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC000983655193 965681282 /nfs/dbraw/zinc/68/12/82/965681282.db2.gz QWABOIQNRDYUDX-UTRMSSBJSA-N 1 1 357.454 2.604 20 5 FFBDMO COc1c(O)ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000892235102 966349423 /nfs/dbraw/zinc/34/94/23/966349423.db2.gz KURCJILEVCUBLG-BBRMVZONSA-N 1 1 361.442 2.758 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176525149 1013721754 /nfs/dbraw/zinc/72/17/54/1013721754.db2.gz WKNIKHFQHGJJRX-GXTWGEPZSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176525149 1013721760 /nfs/dbraw/zinc/72/17/60/1013721760.db2.gz WKNIKHFQHGJJRX-GXTWGEPZSA-N 1 1 366.381 2.985 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@@H+]1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000102392955 968439066 /nfs/dbraw/zinc/43/90/66/968439066.db2.gz PJSYPLVOJJXGAN-ZDUSSCGKSA-N 1 1 372.360 2.818 20 5 FFBDMO O=[N+]([O-])c1ccnn1C[N@H+]1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 ZINC000102392955 968439075 /nfs/dbraw/zinc/43/90/75/968439075.db2.gz PJSYPLVOJJXGAN-ZDUSSCGKSA-N 1 1 372.360 2.818 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000311580638 970060736 /nfs/dbraw/zinc/06/07/36/970060736.db2.gz CPVXRIBCPNKFHJ-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311580638 970060746 /nfs/dbraw/zinc/06/07/46/970060746.db2.gz CPVXRIBCPNKFHJ-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311580638 970060754 /nfs/dbraw/zinc/06/07/54/970060754.db2.gz CPVXRIBCPNKFHJ-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO COCC[N@H+](Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O)C1CCCC1 ZINC000728706941 970508883 /nfs/dbraw/zinc/50/88/83/970508883.db2.gz JJMRYRCSNBPJRD-UHFFFAOYSA-N 1 1 374.441 2.704 20 5 FFBDMO COCC[N@@H+](Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O)C1CCCC1 ZINC000728706941 970508892 /nfs/dbraw/zinc/50/88/92/970508892.db2.gz JJMRYRCSNBPJRD-UHFFFAOYSA-N 1 1 374.441 2.704 20 5 FFBDMO C[N@@H+](Cc1cccc2ccccc21)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985426175 974054161 /nfs/dbraw/zinc/05/41/61/974054161.db2.gz MPHAAXKAQHWCSL-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO C[N@H+](Cc1cccc2ccccc21)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426175 974054169 /nfs/dbraw/zinc/05/41/69/974054169.db2.gz MPHAAXKAQHWCSL-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO C[N@@H+](Cc1cccc2ccccc21)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985426175 974054180 /nfs/dbraw/zinc/05/41/80/974054180.db2.gz MPHAAXKAQHWCSL-WOJBJXKFSA-N 1 1 367.449 2.928 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278954 977375687 /nfs/dbraw/zinc/37/56/87/977375687.db2.gz UWMHGNCZAAGZQQ-DWIQEWEKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278954 977375691 /nfs/dbraw/zinc/37/56/91/977375691.db2.gz UWMHGNCZAAGZQQ-DWIQEWEKSA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC000982278954 977375699 /nfs/dbraw/zinc/37/56/99/977375699.db2.gz UWMHGNCZAAGZQQ-DWIQEWEKSA-N 1 1 371.481 2.639 20 5 FFBDMO CCc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001029964770 980156314 /nfs/dbraw/zinc/15/63/14/980156314.db2.gz YNJXZGOCYFQJNC-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1ccc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001029964770 980156318 /nfs/dbraw/zinc/15/63/18/980156318.db2.gz YNJXZGOCYFQJNC-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CCc1ccc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001029964770 980156328 /nfs/dbraw/zinc/15/63/28/980156328.db2.gz YNJXZGOCYFQJNC-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO C[C@H]1CC2(CC([NH2+][C@H](c3nccn3C)c3ccc([N+](=O)[O-])cc3)C2)CO1 ZINC000897780624 982512846 /nfs/dbraw/zinc/51/28/46/982512846.db2.gz XYLFCOVGYHIWGR-BDTLPFKBSA-N 1 1 356.426 2.965 20 5 FFBDMO C/C(=C/C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000911839222 983904604 /nfs/dbraw/zinc/90/46/04/983904604.db2.gz AGWMWHOZBHZZAI-WMGCDEKXSA-N 1 1 373.453 2.614 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000796455739 1015004781 /nfs/dbraw/zinc/00/47/81/1015004781.db2.gz MXKYHNFFEVHYFT-LBPRGKRZSA-N 1 1 366.418 2.980 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)CC1 ZINC000151180358 984204049 /nfs/dbraw/zinc/20/40/49/984204049.db2.gz RSTUKNHIIALUGL-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2cccc3ccccc32)CC1 ZINC000996428885 984352999 /nfs/dbraw/zinc/35/29/99/984352999.db2.gz KPTUUWRBTFGWCW-RTBURBONSA-N 1 1 353.422 2.586 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001002787896 987477117 /nfs/dbraw/zinc/47/71/17/987477117.db2.gz KUPAYMXFXHQXKQ-RTBURBONSA-N 1 1 357.454 2.700 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000130290009 987629994 /nfs/dbraw/zinc/62/99/94/987629994.db2.gz JQKHBXNUNHHPBY-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO COC(=O)/C=C/c1ccc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])c1 ZINC000914572057 987791416 /nfs/dbraw/zinc/79/14/16/987791416.db2.gz NFTNKYGDGVCUEC-SOFGYWHQSA-N 1 1 370.409 2.968 20 5 FFBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1 ZINC000252480798 988116130 /nfs/dbraw/zinc/11/61/30/988116130.db2.gz FSMPWCOSJHILKC-SRCQZFHVSA-N 1 1 360.414 2.533 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243642 1015434553 /nfs/dbraw/zinc/43/45/53/1015434553.db2.gz KKXLPCJTLYYPIA-PKOBYXMFSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@H](O)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000879243642 1015434559 /nfs/dbraw/zinc/43/45/59/1015434559.db2.gz KKXLPCJTLYYPIA-PKOBYXMFSA-N 1 1 355.394 2.731 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC2(CC1)CC[NH+](C)CC2 ZINC000879249599 1015438847 /nfs/dbraw/zinc/43/88/47/1015438847.db2.gz VTRPQYSDRSTIQH-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO Cc1ccc(C)c(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c1 ZINC001034815722 990274598 /nfs/dbraw/zinc/27/45/98/990274598.db2.gz CHCQSWZJOOEFMH-WOJBJXKFSA-N 1 1 367.449 2.875 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cc1F ZINC001034815742 990275248 /nfs/dbraw/zinc/27/52/48/990275248.db2.gz DFXNMLFABNYETD-IEBWSBKVSA-N 1 1 371.412 2.705 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(=O)OCc1cccnc1[N+](=O)[O-] ZINC000923853439 990972712 /nfs/dbraw/zinc/97/27/12/990972712.db2.gz YDKRYZRHFPHGHH-WMLDXEAASA-N 1 1 355.394 2.801 20 5 FFBDMO Cc1cncc([C@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000879749199 1015665232 /nfs/dbraw/zinc/66/52/32/1015665232.db2.gz UIVJIZHADFMKGF-PKOBYXMFSA-N 1 1 357.410 2.875 20 5 FFBDMO CC(=O)Nc1ccc2c(c1)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880032066 1015738289 /nfs/dbraw/zinc/73/82/89/1015738289.db2.gz YIKNRRZIGDYMGS-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000072500987 993123220 /nfs/dbraw/zinc/12/32/20/993123220.db2.gz JTRLBKAOFYWLPU-MRXNPFEDSA-N 1 1 360.458 2.799 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495764 995572415 /nfs/dbraw/zinc/57/24/15/995572415.db2.gz XOOPITJFAOLCRZ-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001133495764 995572423 /nfs/dbraw/zinc/57/24/23/995572423.db2.gz XOOPITJFAOLCRZ-GXTWGEPZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)n2)cc1 ZINC000747832283 995596073 /nfs/dbraw/zinc/59/60/73/995596073.db2.gz PAFWYKOXLZZKJV-JKSUJKDBSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCc1ccccc1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001054264903 1015996047 /nfs/dbraw/zinc/99/60/47/1015996047.db2.gz VTYNJDINIOLUTE-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@@H+](CCc1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264903 1015996051 /nfs/dbraw/zinc/99/60/51/1015996051.db2.gz VTYNJDINIOLUTE-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO O=C(NCc1ccc2c(c1)C[N@H+](CCc1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001054264903 1015996057 /nfs/dbraw/zinc/99/60/57/1015996057.db2.gz VTYNJDINIOLUTE-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000823972907 996770176 /nfs/dbraw/zinc/77/01/76/996770176.db2.gz BEFQSXRBSWAFPD-MLGOLLRUSA-N 1 1 359.430 2.658 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000803728891 1016111691 /nfs/dbraw/zinc/11/16/91/1016111691.db2.gz DMYIDZCUXGVJAA-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC000803728891 1016111697 /nfs/dbraw/zinc/11/16/97/1016111697.db2.gz DMYIDZCUXGVJAA-INIZCTEOSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000803858045 1016247102 /nfs/dbraw/zinc/24/71/02/1016247102.db2.gz BVCSCVSDDLJCMT-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000732960996 998832577 /nfs/dbraw/zinc/83/25/77/998832577.db2.gz WUBOAJRPXXNMIB-UHFFFAOYSA-N 1 1 359.430 2.923 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1CCCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000741032425 999701719 /nfs/dbraw/zinc/70/17/19/999701719.db2.gz FNRSMSXTAOPDOC-KBPBESRZSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2CCC[C@H]21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000744407312 999855727 /nfs/dbraw/zinc/85/57/27/999855727.db2.gz SOYKJRGVVYGDIX-VQIMIIECSA-N 1 1 372.469 2.508 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2C1 ZINC001169035775 1000016714 /nfs/dbraw/zinc/01/67/14/1000016714.db2.gz LUDXHXDUPPEMQQ-KLHDSHLOSA-N 1 1 353.463 2.621 20 5 FFBDMO O=C1OC[C@@H]2[C@H]([N@H+](Cc3ccccc3)[C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CCCN12 ZINC001169038579 1000017052 /nfs/dbraw/zinc/01/70/52/1000017052.db2.gz ZTBKLFBDOODUJR-NCXUSEDFSA-N 1 1 373.453 2.917 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(CC3CC3)nc21 ZINC001169021691 1000017615 /nfs/dbraw/zinc/01/76/15/1000017615.db2.gz PKYVTVNDSHDRPA-RYQLBKOJSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)C1 ZINC001169026218 1000018230 /nfs/dbraw/zinc/01/82/30/1000018230.db2.gz VYDZSLOGBDCAFH-KCITZHQASA-N 1 1 361.442 2.529 20 5 FFBDMO CS(=O)(=O)c1cccc([C@@H]2CCC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)c1 ZINC001169046924 1000018438 /nfs/dbraw/zinc/01/84/38/1000018438.db2.gz OLCBYTPVVWIEOR-USXIJHARSA-N 1 1 366.483 2.715 20 5 FFBDMO O=C1Nc2ccccc2CN1[C@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1 ZINC001169051371 1000019050 /nfs/dbraw/zinc/01/90/50/1000019050.db2.gz DNPVAYOLAKCQJJ-UAGQMJEPSA-N 1 1 358.442 2.944 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001147148015 1000833244 /nfs/dbraw/zinc/83/32/44/1000833244.db2.gz XCDBKFNROXDPOE-VIFPVBQESA-N 1 1 372.828 2.820 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC001147337675 1000873529 /nfs/dbraw/zinc/87/35/29/1000873529.db2.gz UVICYQXIKDMKSX-MRXNPFEDSA-N 1 1 362.474 2.942 20 5 FFBDMO Cc1ccc(NCCCNC(=O)C[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001147337650 1000873539 /nfs/dbraw/zinc/87/35/39/1000873539.db2.gz UHKQAUJBBGLPBI-UHFFFAOYSA-N 1 1 350.463 2.799 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000771486824 1001123672 /nfs/dbraw/zinc/12/36/72/1001123672.db2.gz QARJWTWLJMHYJT-SFHVURJKSA-N 1 1 373.384 2.628 20 5 FFBDMO NC(=[NH2+])Nc1ccc(C(=O)Nc2cc3nc4ccccc4nc3cc2N)cc1 ZINC001148650430 1001180111 /nfs/dbraw/zinc/18/01/11/1001180111.db2.gz LSGYIRNIZZOESO-UHFFFAOYSA-N 1 1 371.404 2.923 20 5 FFBDMO Cc1cc(F)ccc1[C@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000746652950 1001670730 /nfs/dbraw/zinc/67/07/30/1001670730.db2.gz IRHRBZVDEOJMTE-LJQANCHMSA-N 1 1 359.401 2.898 20 5 FFBDMO COC(=O)C[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC001170352784 1003121819 /nfs/dbraw/zinc/12/18/19/1003121819.db2.gz QFTRNWOMYVQBPS-ZDUSSCGKSA-N 1 1 350.415 2.952 20 5 FFBDMO COC(=O)C[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC001170352784 1003121821 /nfs/dbraw/zinc/12/18/21/1003121821.db2.gz QFTRNWOMYVQBPS-ZDUSSCGKSA-N 1 1 350.415 2.952 20 5 FFBDMO CC(C)(C)OC(=O)NCC[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000805765708 1004138333 /nfs/dbraw/zinc/13/83/33/1004138333.db2.gz XYLOFYYHJHOZNZ-AWEZNQCLSA-N 1 1 367.450 2.561 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC001197647100 1004300601 /nfs/dbraw/zinc/30/06/01/1004300601.db2.gz NMWVDLQUHNUOIQ-LLVKDONJSA-N 1 1 363.443 2.934 20 5 FFBDMO CCOC(=O)C1=C(Nc2nc(-c3ccccc3)ccc2[N+](=O)[O-])CC[NH2+]C1 ZINC001170513918 1004452807 /nfs/dbraw/zinc/45/28/07/1004452807.db2.gz ICYQUZPAHOKRNL-UHFFFAOYSA-N 1 1 368.393 2.879 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2c2ccnn2C)c([N+](=O)[O-])c1 ZINC001198157738 1004515104 /nfs/dbraw/zinc/51/51/04/1004515104.db2.gz TVHOXGWGDFOCSP-INIZCTEOSA-N 1 1 373.413 2.503 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000808216318 1004777275 /nfs/dbraw/zinc/77/72/75/1004777275.db2.gz APIAIYPMBWIBHG-INIZCTEOSA-N 1 1 371.441 2.654 20 5 FFBDMO C[N@@H+](CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H]1C=CCCCCC1 ZINC001195488050 1004975671 /nfs/dbraw/zinc/97/56/71/1004975671.db2.gz NTNLNXIBMHFKCB-HNNXBMFYSA-N 1 1 367.471 2.694 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000776274230 1005340283 /nfs/dbraw/zinc/34/02/83/1005340283.db2.gz CGXSZUOOFXCHIE-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)cc1 ZINC000776279509 1005345747 /nfs/dbraw/zinc/34/57/47/1005345747.db2.gz XUVMBOVTWRNKKD-QKLQHJQFSA-N 1 1 353.422 2.696 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3nnc4ccccn43)C2)cc1 ZINC000776584279 1005954797 /nfs/dbraw/zinc/95/47/97/1005954797.db2.gz KAZOSAJAJKXDFE-NVXWUHKLSA-N 1 1 367.409 2.551 20 5 FFBDMO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000776585679 1005976465 /nfs/dbraw/zinc/97/64/65/1005976465.db2.gz ZEAUOYGFPNSRPY-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000776585679 1005976471 /nfs/dbraw/zinc/97/64/71/1005976471.db2.gz ZEAUOYGFPNSRPY-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c(N)c([N+](=O)[O-])c1 ZINC000813828102 1006047071 /nfs/dbraw/zinc/04/70/71/1006047071.db2.gz ZOUUWSJRDVILMR-WMLDXEAASA-N 1 1 368.437 2.878 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000852497650 1006056060 /nfs/dbraw/zinc/05/60/60/1006056060.db2.gz XHRRMYZCUHZKEY-MHORFTMASA-N 1 1 362.426 2.682 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000110991793 1006247028 /nfs/dbraw/zinc/24/70/28/1006247028.db2.gz UJGWOKUOEMPRBL-ZDUSSCGKSA-N 1 1 364.402 2.724 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000814482134 1006301198 /nfs/dbraw/zinc/30/11/98/1006301198.db2.gz LXZZAAQOQXXHEC-UHFFFAOYSA-N 1 1 364.377 2.942 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC([C@@H]3CCCO3)CC2)nc1-c1ccccn1 ZINC000853509021 1006420621 /nfs/dbraw/zinc/42/06/21/1006420621.db2.gz ULFYDOSXBDJINZ-KRWDZBQOSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000853793871 1006538915 /nfs/dbraw/zinc/53/89/15/1006538915.db2.gz BIKVTYROJIAMOV-MRXNPFEDSA-N 1 1 372.381 2.682 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(c3cccnc3[N+](=O)[O-])C2)ccn1 ZINC000856536412 1007875952 /nfs/dbraw/zinc/87/59/52/1007875952.db2.gz SQDZVGAHVYHXCF-KRWDZBQOSA-N 1 1 371.441 2.883 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856537130 1007877125 /nfs/dbraw/zinc/87/71/25/1007877125.db2.gz OAPIPVVBGMPURZ-JEBQAFNWSA-N 1 1 354.410 2.506 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 ZINC000856537130 1007877132 /nfs/dbraw/zinc/87/71/32/1007877132.db2.gz OAPIPVVBGMPURZ-JEBQAFNWSA-N 1 1 354.410 2.506 20 5 FFBDMO N[C@@H](CCC[NH3+])Nc1nc2ccsc2c(Oc2cccc([N+](=O)[O-])c2)n1 ZINC001170897704 1007897010 /nfs/dbraw/zinc/89/70/10/1007897010.db2.gz JEDRDRBLSWCRBA-CYBMUJFWSA-N 1 1 374.426 2.827 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)nc1 ZINC000858011896 1008277122 /nfs/dbraw/zinc/27/71/22/1008277122.db2.gz TVSTZOPMTCFMAO-OAHLLOKOSA-N 1 1 371.393 2.723 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)nc1 ZINC000858011896 1008277129 /nfs/dbraw/zinc/27/71/29/1008277129.db2.gz TVSTZOPMTCFMAO-OAHLLOKOSA-N 1 1 371.393 2.723 20 5 FFBDMO CC(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[NH+]1CCOCC1 ZINC000858241841 1008331839 /nfs/dbraw/zinc/33/18/39/1008331839.db2.gz HEFPGKIANUDWLW-IBGZPJMESA-N 1 1 371.437 2.835 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000822089199 1008519177 /nfs/dbraw/zinc/51/91/77/1008519177.db2.gz IUUYQVAXQCTWSQ-KRWDZBQOSA-N 1 1 357.385 2.840 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@](O)(c3ccccc3)C2)c2c(c1)COCO2 ZINC000859585454 1008575588 /nfs/dbraw/zinc/57/55/88/1008575588.db2.gz QNYGIMVKPPVLDO-HXUWFJFHSA-N 1 1 370.405 2.945 20 5 FFBDMO C[C@@H]1C[C@H]1c1noc(CC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)n1 ZINC000886267429 1008617340 /nfs/dbraw/zinc/61/73/40/1008617340.db2.gz MRHBDMRNAODJTJ-IUODEOHRSA-N 1 1 357.414 2.951 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@](C)(O)c1ccccc1 ZINC000822515783 1008664906 /nfs/dbraw/zinc/66/49/06/1008664906.db2.gz FVRJTBLUUXXEMB-LJQANCHMSA-N 1 1 358.394 2.801 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000859955037 1008744068 /nfs/dbraw/zinc/74/40/68/1008744068.db2.gz RQOMFMINLJHDBN-ZNMIVQPWSA-N 1 1 363.370 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000859955037 1008744082 /nfs/dbraw/zinc/74/40/82/1008744082.db2.gz RQOMFMINLJHDBN-ZNMIVQPWSA-N 1 1 363.370 2.667 20 5 FFBDMO Cc1ccc(F)c(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1 ZINC001178464497 1008998316 /nfs/dbraw/zinc/99/83/16/1008998316.db2.gz UGSNWZLBPSVYSR-NVXWUHKLSA-N 1 1 351.422 2.566 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)C[C@](C)(O)c2ccccc2)c([N+](=O)[O-])c1 ZINC000823591434 1009127952 /nfs/dbraw/zinc/12/79/52/1009127952.db2.gz LFNISOQJVCJNAT-IBGZPJMESA-N 1 1 360.410 2.822 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823600173 1009136749 /nfs/dbraw/zinc/13/67/49/1009136749.db2.gz YWFHAFFTZCPFKK-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823600173 1009136760 /nfs/dbraw/zinc/13/67/60/1009136760.db2.gz YWFHAFFTZCPFKK-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C/C(=C/C(=O)N1CCC([N@H+]2CCCOCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000861985020 1009647170 /nfs/dbraw/zinc/64/71/70/1009647170.db2.gz QQRCMXBTBCZAFH-NXVVXOECSA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000889164066 1009846073 /nfs/dbraw/zinc/84/60/73/1009846073.db2.gz XFSDFHNIPOHGDK-TZMCWYRMSA-N 1 1 356.426 2.885 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@](O)(c3ccccc3)C1)OCCO2 ZINC000862482866 1009853920 /nfs/dbraw/zinc/85/39/20/1009853920.db2.gz MILFWVZTQDTUGB-FQEVSTJZSA-N 1 1 370.405 2.850 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@H](O)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000866638049 1011028734 /nfs/dbraw/zinc/02/87/34/1011028734.db2.gz CTWOKGNYJVICBP-ZWKOTPCHSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@@H]1CC[C@H](C(N)=O)[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1Br ZINC001171598186 1011395750 /nfs/dbraw/zinc/39/57/50/1011395750.db2.gz CIHNGXZTLHVDGV-SCVCMEIPSA-N 1 1 370.247 2.832 20 5 FFBDMO COCCCN1CCC([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172901376 1012075569 /nfs/dbraw/zinc/07/55/69/1012075569.db2.gz MOENENSXTYDVIY-SFHVURJKSA-N 1 1 361.486 2.933 20 5 FFBDMO CCOC(=O)C1([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172895974 1012096255 /nfs/dbraw/zinc/09/62/55/1012096255.db2.gz KDUISTVVFVPYRK-MRXNPFEDSA-N 1 1 362.426 2.544 20 5 FFBDMO COC[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2cn(C)nc21 ZINC001172909490 1012122514 /nfs/dbraw/zinc/12/25/14/1012122514.db2.gz SYTFYLLFFUVNOX-QZTJIDSGSA-N 1 1 370.453 2.822 20 5 FFBDMO CC(C)C(=O)N[C@@H]1[C@H]2C[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@H]21 ZINC001172909749 1012122896 /nfs/dbraw/zinc/12/28/96/1012122896.db2.gz IPAJTTQOKGFJIJ-GDAAHCPNSA-N 1 1 357.454 2.545 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)N1C ZINC001173018472 1012189955 /nfs/dbraw/zinc/18/99/55/1012189955.db2.gz WESVRCTWLIYTIM-BETUJISGSA-N 1 1 368.428 2.866 20 5 FFBDMO C[C@@H]1CN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)[N@H+]1C ZINC001173018472 1012189960 /nfs/dbraw/zinc/18/99/60/1012189960.db2.gz WESVRCTWLIYTIM-BETUJISGSA-N 1 1 368.428 2.866 20 5 FFBDMO C[C@@H]1CN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)[N@@H+]1C ZINC001173018472 1012189964 /nfs/dbraw/zinc/18/99/64/1012189964.db2.gz WESVRCTWLIYTIM-BETUJISGSA-N 1 1 368.428 2.866 20 5 FFBDMO CCOC(=O)C1CC[NH+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173182848 1012326529 /nfs/dbraw/zinc/32/65/29/1012326529.db2.gz UVHUDEIZXFEAKJ-LBPRGKRZSA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)[C@H](C(C)C)[N@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191283 1012330721 /nfs/dbraw/zinc/33/07/21/1012330721.db2.gz BJWWXKFZLQVBHA-ZBEGNZNMSA-N 1 1 356.394 2.803 20 5 FFBDMO COC(=O)[C@H](C(C)C)[N@@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191283 1012330731 /nfs/dbraw/zinc/33/07/31/1012330731.db2.gz BJWWXKFZLQVBHA-ZBEGNZNMSA-N 1 1 356.394 2.803 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@@H]([N@@H+](C)C3CC3)C2)c1F ZINC001173192110 1012335460 /nfs/dbraw/zinc/33/54/60/1012335460.db2.gz IGMNMOLOKYITOV-GXTWGEPZSA-N 1 1 351.422 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@H]3CCCC(=O)[C@@H]3C2)c1F ZINC001173194672 1012339385 /nfs/dbraw/zinc/33/93/85/1012339385.db2.gz YBLREOFAKGAITN-OUCADQQQSA-N 1 1 350.390 2.975 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225346 1012357132 /nfs/dbraw/zinc/35/71/32/1012357132.db2.gz NMHFRTMBMHNRBC-HOCLYGCPSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225346 1012357146 /nfs/dbraw/zinc/35/71/46/1012357146.db2.gz NMHFRTMBMHNRBC-HOCLYGCPSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173227422 1012362040 /nfs/dbraw/zinc/36/20/40/1012362040.db2.gz OGWJQOHYLNGZKW-DOTOQJQBSA-N 1 1 358.442 2.891 20 5 FFBDMO COc1ccc2c(c1)CCCN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C2 ZINC000870881527 1012619686 /nfs/dbraw/zinc/61/96/86/1012619686.db2.gz XZZZNAVWBGMKTH-FQEVSTJZSA-N 1 1 369.421 2.752 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000097667647 1012931368 /nfs/dbraw/zinc/93/13/68/1012931368.db2.gz IVKNXPIPFKTGFL-RYUDHWBXSA-N 1 1 364.402 2.662 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@](CO)(c2ccccc2)C1 ZINC000801578485 1019133648 /nfs/dbraw/zinc/13/36/48/1019133648.db2.gz GXDUXKXILDJICP-HXUWFJFHSA-N 1 1 356.422 3.000 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801600575 1019160442 /nfs/dbraw/zinc/16/04/42/1019160442.db2.gz QWDBVZBCEHKHPI-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801600575 1019160449 /nfs/dbraw/zinc/16/04/49/1019160449.db2.gz QWDBVZBCEHKHPI-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000801822636 1019417627 /nfs/dbraw/zinc/41/76/27/1019417627.db2.gz SLYAIHDLBZKHMK-BETUJISGSA-N 1 1 366.437 2.804 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1Cc1ccccc1 ZINC000801921033 1019513264 /nfs/dbraw/zinc/51/32/64/1019513264.db2.gz WONIHUNTUVTPNN-GXTWGEPZSA-N 1 1 372.400 2.709 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccc3ccccc3c2)CC1 ZINC001045437414 1019964861 /nfs/dbraw/zinc/96/48/61/1019964861.db2.gz PYESRLZFOOLLBR-RTBURBONSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505651 1020062930 /nfs/dbraw/zinc/06/29/30/1020062930.db2.gz UWNFOACSADQXAZ-SJORKVTESA-N 1 1 371.462 2.934 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505651 1020062938 /nfs/dbraw/zinc/06/29/38/1020062938.db2.gz UWNFOACSADQXAZ-SJORKVTESA-N 1 1 371.462 2.934 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@@H](C4OCCO4)C3)c2)c1 ZINC000777957023 1020331041 /nfs/dbraw/zinc/33/10/41/1020331041.db2.gz OOPZJHVKAUBSDW-OAHLLOKOSA-N 1 1 358.398 2.501 20 5 FFBDMO C[N@H+](Cc1ccc(C(=O)NC2CC2)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749670795 1021018814 /nfs/dbraw/zinc/01/88/14/1021018814.db2.gz LNXPNXCULRMHFW-IBGZPJMESA-N 1 1 369.421 2.652 20 5 FFBDMO CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000750116628 1021379387 /nfs/dbraw/zinc/37/93/87/1021379387.db2.gz SLYPZRRFECAFDV-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000750116628 1021379403 /nfs/dbraw/zinc/37/94/03/1021379403.db2.gz SLYPZRRFECAFDV-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000750116628 1021379420 /nfs/dbraw/zinc/37/94/20/1021379420.db2.gz SLYPZRRFECAFDV-VQTJNVASSA-N 1 1 355.438 2.835 20 5 FFBDMO CCc1cc(C[NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])[nH]n1 ZINC000779077417 1022768477 /nfs/dbraw/zinc/76/84/77/1022768477.db2.gz GZPDXOQLUNLSPM-UHFFFAOYSA-N 1 1 370.356 2.823 20 5 FFBDMO O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000077958240 1023711676 /nfs/dbraw/zinc/71/16/76/1023711676.db2.gz WTIWCLHWYSTDBU-QGZVFWFLSA-N 1 1 372.425 2.637 20 5 FFBDMO Cc1cc(-c2nnc(N3CCC[N@H+](C(C)C)CC3)n2C)cc([N+](=O)[O-])c1 ZINC001121399095 1023750977 /nfs/dbraw/zinc/75/09/77/1023750977.db2.gz SNSMHZWZSYEKPG-UHFFFAOYSA-N 1 1 358.446 2.619 20 5 FFBDMO Cc1ccnc(C2CC[NH+](Cn3ncc4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000758261492 1024003364 /nfs/dbraw/zinc/00/33/64/1024003364.db2.gz CNGBSGRZHPBUPP-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](Cc2ccc(Cl)cc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097891 1027588910 /nfs/dbraw/zinc/58/89/10/1027588910.db2.gz OMGZGHUSKXXQND-IAGOWNOFSA-N 1 1 363.845 2.644 20 5 FFBDMO Cn1cc([C@@H](O)C[C@H]2CCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970077 1028372268 /nfs/dbraw/zinc/37/22/68/1028372268.db2.gz STBUNPQDMIGMGZ-PXAZEXFGSA-N 1 1 366.368 2.695 20 5 FFBDMO Cn1cc([C@@H](O)C[C@H]2CCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970077 1028372283 /nfs/dbraw/zinc/37/22/83/1028372283.db2.gz STBUNPQDMIGMGZ-PXAZEXFGSA-N 1 1 366.368 2.695 20 5 FFBDMO CN1C(=O)CCC12CCC(Nc1ccc([N+](=O)[O-])c3c1CC[N@H+](C)C3)CC2 ZINC001163597481 1028982755 /nfs/dbraw/zinc/98/27/55/1028982755.db2.gz WIACIXVOEBKJHF-UHFFFAOYSA-N 1 1 372.469 2.928 20 5 FFBDMO CN1C(=O)CCC12CCC(Nc1ccc([N+](=O)[O-])c3c1CC[N@@H+](C)C3)CC2 ZINC001163597481 1028982766 /nfs/dbraw/zinc/98/27/66/1028982766.db2.gz WIACIXVOEBKJHF-UHFFFAOYSA-N 1 1 372.469 2.928 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C2CCCCCC2)n1 ZINC001163942212 1029122771 /nfs/dbraw/zinc/12/27/71/1029122771.db2.gz OWHYJOQXVPKGMD-AWEZNQCLSA-N 1 1 362.430 2.985 20 5 FFBDMO COc1cc(C)nc(NCc2ccc(C[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC001156388588 1029174482 /nfs/dbraw/zinc/17/44/82/1029174482.db2.gz HANYMRHVVVOVEU-UHFFFAOYSA-N 1 1 372.425 2.751 20 5 FFBDMO CN(C)C1(CNc2ccc3cc(F)cc([N+](=O)[O-])c3n2)CC[NH+](C)CC1 ZINC001164211762 1029205357 /nfs/dbraw/zinc/20/53/57/1029205357.db2.gz SIHQIZNASVDRQU-UHFFFAOYSA-N 1 1 361.421 2.720 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494767 1029296786 /nfs/dbraw/zinc/29/67/86/1029296786.db2.gz RCVOLDLQVNLGPB-RTBURBONSA-N 1 1 371.481 2.995 20 5 FFBDMO CCCc1ccc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001164494610 1029297895 /nfs/dbraw/zinc/29/78/95/1029297895.db2.gz OQKLCZHYPPPURW-QZTJIDSGSA-N 1 1 359.470 2.680 20 5 FFBDMO CN(C)c1cc(NC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc[nH+]1 ZINC000781787894 1029403292 /nfs/dbraw/zinc/40/32/92/1029403292.db2.gz HOGSRPQRQJGTSX-UHFFFAOYSA-N 1 1 359.342 2.535 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(-n2ccc(C[NH2+]Cc3ccccc3)n2)n1 ZINC001157609925 1029629562 /nfs/dbraw/zinc/62/95/62/1029629562.db2.gz WVHGOXROBIOYTC-UHFFFAOYSA-N 1 1 358.789 2.822 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](C)CCN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001157772396 1029659891 /nfs/dbraw/zinc/65/98/91/1029659891.db2.gz FBCRDWHPGSSFJY-AWEZNQCLSA-N 1 1 370.840 2.730 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C)CCN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001157772396 1029659895 /nfs/dbraw/zinc/65/98/95/1029659895.db2.gz FBCRDWHPGSSFJY-AWEZNQCLSA-N 1 1 370.840 2.730 20 5 FFBDMO O=C(NCCC[NH2+]Cc1ccc(-c2ccccc2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001157775678 1029661544 /nfs/dbraw/zinc/66/15/44/1029661544.db2.gz WBFIIZORMGJGHC-RTBURBONSA-N 1 1 353.422 2.615 20 5 FFBDMO C[C@H]1C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@H]1c1ccccc1 ZINC000782860321 1029840064 /nfs/dbraw/zinc/84/00/64/1029840064.db2.gz FYPUMDGILVBQMZ-RDTXWAMCSA-N 1 1 369.425 2.605 20 5 FFBDMO COc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC001165202760 1029889393 /nfs/dbraw/zinc/88/93/93/1029889393.db2.gz OEJRAQUOLMZUNB-UONOGXRCSA-N 1 1 371.441 2.801 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1nc(Cl)c(Cl)cc1[N+](=O)[O-])CC2 ZINC001166031364 1030211384 /nfs/dbraw/zinc/21/13/84/1030211384.db2.gz CFWQOJJELQNFHA-UHFFFAOYSA-N 1 1 374.228 2.931 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001142303917 1030289485 /nfs/dbraw/zinc/28/94/85/1030289485.db2.gz WQFDCPSJKCYXSA-ZYHUDNBSSA-N 1 1 363.805 2.537 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC([C@H]4CCOC4)CC3)n2)cc1 ZINC000784008391 1030411472 /nfs/dbraw/zinc/41/14/72/1030411472.db2.gz ROUXWIVTRXJYCK-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO C[C@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC(C)(C)C1 ZINC000784008237 1030412266 /nfs/dbraw/zinc/41/22/66/1030412266.db2.gz MWXRFUBNROXTOO-CYBMUJFWSA-N 1 1 360.414 2.689 20 5 FFBDMO C[N@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C[C@H]1CC=CCC1 ZINC000784394515 1030600743 /nfs/dbraw/zinc/60/07/43/1030600743.db2.gz TXJOLXLOTXSFPA-KRWDZBQOSA-N 1 1 372.469 2.532 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1Cn1cnc(-c3ccc([N+](=O)[O-])cc3)n1)CCOCC2 ZINC000842640072 1030869519 /nfs/dbraw/zinc/86/95/19/1030869519.db2.gz ULDRCBYASZDQKW-AWEZNQCLSA-N 1 1 357.414 2.702 20 5 FFBDMO COc1cc(OCC(=O)OC[C@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000842834086 1030984939 /nfs/dbraw/zinc/98/49/39/1030984939.db2.gz REVHFGRAVBYROZ-AWEZNQCLSA-N 1 1 366.414 2.646 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000797517128 1031141108 /nfs/dbraw/zinc/14/11/08/1031141108.db2.gz CADGKMLXMWVDOJ-CYBMUJFWSA-N 1 1 365.430 2.950 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)C2)cc1 ZINC001219452465 1033649875 /nfs/dbraw/zinc/64/98/75/1033649875.db2.gz OXIGGLIXGPEQTI-INIZCTEOSA-N 1 1 369.425 2.881 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000830529803 1033659179 /nfs/dbraw/zinc/65/91/79/1033659179.db2.gz POCYDAPYLGDUPW-ZDUSSCGKSA-N 1 1 364.421 2.547 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)cc([N+](=O)[O-])c1 ZINC001220410739 1034156656 /nfs/dbraw/zinc/15/66/56/1034156656.db2.gz AYLXSIJHBYXHHV-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])ccc1O[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001226164039 1034553717 /nfs/dbraw/zinc/55/37/17/1034553717.db2.gz GFXBNOKTICKHIF-INIZCTEOSA-N 1 1 355.394 2.737 20 5 FFBDMO CC[N@@H+]1CC[C@@H](Oc2c(Br)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226268355 1034603300 /nfs/dbraw/zinc/60/33/00/1034603300.db2.gz QSJLYKNKOSBWGE-SNVBAGLBSA-N 1 1 373.203 2.617 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2c(Br)cc(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC001226268355 1034603305 /nfs/dbraw/zinc/60/33/05/1034603305.db2.gz QSJLYKNKOSBWGE-SNVBAGLBSA-N 1 1 373.203 2.617 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000832297047 1034709699 /nfs/dbraw/zinc/70/96/99/1034709699.db2.gz POFJLMHQVZDQRR-CYBMUJFWSA-N 1 1 364.402 2.722 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1OC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC001226764021 1034824767 /nfs/dbraw/zinc/82/47/67/1034824767.db2.gz DLDFHQVQNRHBNJ-SFHVURJKSA-N 1 1 357.410 2.968 20 5 FFBDMO COC(=O)CO[C@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232227707 1035505031 /nfs/dbraw/zinc/50/50/31/1035505031.db2.gz MEGREGVGZSBBNZ-KRWDZBQOSA-N 1 1 351.406 2.547 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc3c(c1)oc1cc(=O)ccc-1[n+]3[O-])C2 ZINC001227449080 1035558515 /nfs/dbraw/zinc/55/85/15/1035558515.db2.gz KSBCUYTZUOBMJM-VIKVFOODSA-N 1 1 352.390 2.535 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ccc(OC(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227603952 1035633759 /nfs/dbraw/zinc/63/37/59/1035633759.db2.gz NKCVIGCOLHGKOQ-UPLXVJCVSA-N 1 1 360.288 2.676 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ccc(OC(F)(F)F)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227603952 1035633765 /nfs/dbraw/zinc/63/37/65/1035633765.db2.gz NKCVIGCOLHGKOQ-UPLXVJCVSA-N 1 1 360.288 2.676 20 5 FFBDMO C[C@@H](c1ccccn1)[N@H+]1CCC[C@H](Oc2ncc([N+](=O)[O-])c3nc[nH]c32)C1 ZINC001227692270 1035675329 /nfs/dbraw/zinc/67/53/29/1035675329.db2.gz VQNJGUXVZNIZBF-STQMWFEESA-N 1 1 368.397 2.866 20 5 FFBDMO CC[N@@H+](CCCNC(=O)Nc1c(C)cncc1[N+](=O)[O-])C1CCCCC1 ZINC001203066756 1036177298 /nfs/dbraw/zinc/17/72/98/1036177298.db2.gz BOLXTZSTMLDARP-UHFFFAOYSA-N 1 1 363.462 2.886 20 5 FFBDMO C[N@H+]1CCC[C@H](Oc2cc([O-])cc3oc4c(O)ccc(O)c4c(=O)c23)CC1 ZINC001234122938 1036929492 /nfs/dbraw/zinc/92/94/92/1036929492.db2.gz CHAPHEWBGHVQPV-LBPRGKRZSA-N 1 1 371.389 2.926 20 5 FFBDMO C[N@@H+]1CCC[C@H](Oc2cc(O)cc3oc4c(O)ccc(O)c4c(=O)c23)CC1 ZINC001234122938 1036929506 /nfs/dbraw/zinc/92/95/06/1036929506.db2.gz CHAPHEWBGHVQPV-LBPRGKRZSA-N 1 1 371.389 2.926 20 5 FFBDMO COc1c(O)cc(O[C@H]2CCC[N@@H+](C)C2)c2c(=O)c3ccccc3n(C)c12 ZINC001234172817 1036957169 /nfs/dbraw/zinc/95/71/69/1036957169.db2.gz VILVTIFJADGQHC-ZDUSSCGKSA-N 1 1 368.433 2.879 20 5 FFBDMO COC(=O)c1cc(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c(F)cc1[N+](=O)[O-] ZINC001229937980 1036989776 /nfs/dbraw/zinc/98/97/76/1036989776.db2.gz FWPRILRYEAWHFU-CDMJZVDBSA-N 1 1 352.362 2.630 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2ccc(I)cc2[N+](=O)[O-])C1 ZINC001229939371 1036990878 /nfs/dbraw/zinc/99/08/78/1036990878.db2.gz BNPSHUBHWOSKDI-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@H]2CCC[N@H+](C(C)C)C2)c1 ZINC001234411410 1037026767 /nfs/dbraw/zinc/02/67/67/1037026767.db2.gz SLSKPWDKLNVWJQ-HNNXBMFYSA-N 1 1 350.415 2.952 20 5 FFBDMO C[NH+]1CCN(c2ncc(-c3cc4cccnc4c4ncccc34)cn2)CC1 ZINC001235919671 1037837057 /nfs/dbraw/zinc/83/70/57/1037837057.db2.gz VVMJKPGWNSXBFF-UHFFFAOYSA-N 1 1 356.433 2.992 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001537097842 1070119873 /nfs/dbraw/zinc/11/98/73/1070119873.db2.gz YLVWWSJLCRAZCN-DOTOQJQBSA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(N2CCC([NH2+]C3(c4ncccn4)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256089452 1038373514 /nfs/dbraw/zinc/37/35/14/1038373514.db2.gz UUDVOTPZNDESRM-UHFFFAOYSA-N 1 1 369.425 2.641 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H]4OCC[C@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100774 1038384811 /nfs/dbraw/zinc/38/48/11/1038384811.db2.gz OTBJXHXCQXEJRO-KBXCAEBGSA-N 1 1 361.442 2.683 20 5 FFBDMO Cc1cc(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c([N+](=O)[O-])cc1C ZINC001258153901 1039233971 /nfs/dbraw/zinc/23/39/71/1039233971.db2.gz RTLUZOBVDLIWLM-OKILXGFUSA-N 1 1 360.414 2.913 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@H]3CCCCNC3)CC2)c(F)c1 ZINC001246091828 1039241645 /nfs/dbraw/zinc/24/16/45/1039241645.db2.gz QPNVVFGGKUKFDQ-ZDUSSCGKSA-N 1 1 354.401 2.574 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC(N[C@H]3CCCC[NH2+]C3)CC2)c(F)c1 ZINC001246091828 1039241667 /nfs/dbraw/zinc/24/16/67/1039241667.db2.gz QPNVVFGGKUKFDQ-ZDUSSCGKSA-N 1 1 354.401 2.574 20 5 FFBDMO N[C@@]1(C(F)(F)F)CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246570370 1039402513 /nfs/dbraw/zinc/40/25/13/1039402513.db2.gz POZCQNXWQLIANF-HNNXBMFYSA-N 1 1 358.364 2.529 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001246879173 1039515476 /nfs/dbraw/zinc/51/54/76/1039515476.db2.gz MMEKKNMLUOQILX-BSIFCXSSSA-N 1 1 351.450 2.999 20 5 FFBDMO Cn1cncc1C[C@H]([NH3+])c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247295990 1039696685 /nfs/dbraw/zinc/69/66/85/1039696685.db2.gz LNEIKIRXDAKFLN-HNNXBMFYSA-N 1 1 371.404 2.809 20 5 FFBDMO Cn1c[nH+]cc1C[C@H](N)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247295990 1039696690 /nfs/dbraw/zinc/69/66/90/1039696690.db2.gz LNEIKIRXDAKFLN-HNNXBMFYSA-N 1 1 371.404 2.809 20 5 FFBDMO C[NH2+][C@@H](COCc1ccccc1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001248238740 1040187373 /nfs/dbraw/zinc/18/73/73/1040187373.db2.gz VEMKVMDYGWZPTR-ZDUSSCGKSA-N 1 1 373.344 2.656 20 5 FFBDMO CCOC(=O)[C@@]12C[C@@H]1CC[N@H+]2C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254474537 1040738744 /nfs/dbraw/zinc/73/87/44/1040738744.db2.gz RKIQYCOSYASVOW-IFXJQAMLSA-N 1 1 359.426 2.591 20 5 FFBDMO CCOC(=O)[C@]12C[C@H]1CC[N@H+]2C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254474538 1040740283 /nfs/dbraw/zinc/74/02/83/1040740283.db2.gz RKIQYCOSYASVOW-KUHUBIRLSA-N 1 1 359.426 2.591 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479891 1040745073 /nfs/dbraw/zinc/74/50/73/1040745073.db2.gz PFXNHPWZAAPREY-LSDHHAIUSA-N 1 1 361.442 2.695 20 5 FFBDMO COC(=O)[C@H]1C[C@H]2C[C@@H](C1)[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2 ZINC001254481665 1040747118 /nfs/dbraw/zinc/74/71/18/1040747118.db2.gz YDRXKBPOQRXLNV-DOXZYTNZSA-N 1 1 373.453 2.837 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CCN(c3ncccn3)C[C@H]2C1 ZINC001254561446 1040798479 /nfs/dbraw/zinc/79/84/79/1040798479.db2.gz KXRQLXJMGYKZHG-JQHSSLGASA-N 1 1 367.453 2.774 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561514 1040800893 /nfs/dbraw/zinc/80/08/93/1040800893.db2.gz LVDIJLGIFAJAQV-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561514 1040800909 /nfs/dbraw/zinc/80/09/09/1040800909.db2.gz LVDIJLGIFAJAQV-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C[C@@H]2COC ZINC001254563397 1040803613 /nfs/dbraw/zinc/80/36/13/1040803613.db2.gz ZTFBPUOIJFQFPR-GDBMZVCRSA-N 1 1 358.442 2.988 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C[C@@H]2COC ZINC001254563397 1040803626 /nfs/dbraw/zinc/80/36/26/1040803626.db2.gz ZTFBPUOIJFQFPR-GDBMZVCRSA-N 1 1 358.442 2.988 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2cccnc2)C1 ZINC001254569196 1040805248 /nfs/dbraw/zinc/80/52/48/1040805248.db2.gz IYGPQSJLQJXZAN-MAUKXSAKSA-N 1 1 368.437 2.815 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)C[NH+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254594732 1040821682 /nfs/dbraw/zinc/82/16/82/1040821682.db2.gz SPVCYTXPFAHBBR-MRXNPFEDSA-N 1 1 359.426 2.615 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@H]1Cc1cnn(C)c1 ZINC001254596951 1040826946 /nfs/dbraw/zinc/82/69/46/1040826946.db2.gz SWCQFRRVLKMEHO-AABGKKOBSA-N 1 1 370.453 2.518 20 5 FFBDMO COC(=O)c1cccc2c1CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254605251 1040835341 /nfs/dbraw/zinc/83/53/41/1040835341.db2.gz ARIZZCNTUPTTDF-QGZVFWFLSA-N 1 1 352.390 2.907 20 5 FFBDMO O=C(Nc1nccc2cc([N+](=O)[O-])ccc21)c1ccn(-c2cc[nH+]cc2)n1 ZINC001538620949 1070463871 /nfs/dbraw/zinc/46/38/71/1070463871.db2.gz SGVIUGSFIYSLPV-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO C[C@H](CNC(=O)NC[C@@H](c1ccco1)[NH+](C)C)c1ccccc1[N+](=O)[O-] ZINC001311346224 1043898980 /nfs/dbraw/zinc/89/89/80/1043898980.db2.gz ZBZRHDBHOBDOFC-CJNGLKHVSA-N 1 1 360.414 2.893 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001313376429 1044338622 /nfs/dbraw/zinc/33/86/22/1044338622.db2.gz PORJMMRTUKBVMV-FUHWJXTLSA-N 1 1 360.458 2.968 20 5 FFBDMO CC[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC1 ZINC001539290603 1070607446 /nfs/dbraw/zinc/60/74/46/1070607446.db2.gz QTZKPDBSNKYSGC-MRXNPFEDSA-N 1 1 371.441 2.720 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890844 1044926165 /nfs/dbraw/zinc/92/61/65/1044926165.db2.gz RVWYOFUEBNJFLN-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001318890844 1044926173 /nfs/dbraw/zinc/92/61/73/1044926173.db2.gz RVWYOFUEBNJFLN-BBRMVZONSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@H]3CCCC[C@@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001318012018 1045191585 /nfs/dbraw/zinc/19/15/85/1045191585.db2.gz AEBIYFKNEGHRDO-CPUCHLNUSA-N 1 1 357.410 2.739 20 5 FFBDMO O=C([C@H]1CCC[N@@H+]1Cc1ccccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001319556757 1045194541 /nfs/dbraw/zinc/19/45/41/1045194541.db2.gz CDZZQCMPMUJLGK-LJQANCHMSA-N 1 1 366.421 2.539 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1Cc1ccccn1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001319556757 1045194543 /nfs/dbraw/zinc/19/45/43/1045194543.db2.gz CDZZQCMPMUJLGK-LJQANCHMSA-N 1 1 366.421 2.539 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001320888732 1045489069 /nfs/dbraw/zinc/48/90/69/1045489069.db2.gz KONJCEUDEWETMK-RDJZCZTQSA-N 1 1 374.437 2.906 20 5 FFBDMO Cc1c([C@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cnn1C ZINC001320994699 1045509215 /nfs/dbraw/zinc/50/92/15/1045509215.db2.gz SUTVWJSSZMJTGV-VIFPVBQESA-N 1 1 351.794 2.579 20 5 FFBDMO CC(C)(CCC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1)[N+](=O)[O-] ZINC001288965565 1047542948 /nfs/dbraw/zinc/54/29/48/1047542948.db2.gz SAHNNGZSFUUUJZ-MSOLQXFVSA-N 1 1 359.470 2.802 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC001327616177 1047969376 /nfs/dbraw/zinc/96/93/76/1047969376.db2.gz LDXRVPZGHORAEE-QGZVFWFLSA-N 1 1 362.474 2.571 20 5 FFBDMO O=C(c1c(Br)cccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1 ZINC001331555094 1048002037 /nfs/dbraw/zinc/00/20/37/1048002037.db2.gz VCNXBYBXKDPAMC-NSHDSACASA-N 1 1 368.231 2.668 20 5 FFBDMO Cc1nn(CCO)c(C)c1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001327952293 1048106398 /nfs/dbraw/zinc/10/63/98/1048106398.db2.gz PEKIDXLMFYUACU-KRWDZBQOSA-N 1 1 358.442 2.780 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001290892613 1048485798 /nfs/dbraw/zinc/48/57/98/1048485798.db2.gz ZSOBMVKEFKDHSV-CYBMUJFWSA-N 1 1 356.426 2.792 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@@H+]1C ZINC001333100996 1048714149 /nfs/dbraw/zinc/71/41/49/1048714149.db2.gz QWZZMAWBGNIANZ-SSDOTTSWSA-N 1 1 350.177 2.817 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC001333100996 1048714162 /nfs/dbraw/zinc/71/41/62/1048714162.db2.gz QWZZMAWBGNIANZ-SSDOTTSWSA-N 1 1 350.177 2.817 20 5 FFBDMO COCn1ncc(C)c1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001333161161 1048738449 /nfs/dbraw/zinc/73/84/49/1048738449.db2.gz JBFLPFYDOJEDTG-UHFFFAOYSA-N 1 1 369.219 2.756 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001329985910 1048992792 /nfs/dbraw/zinc/99/27/92/1048992792.db2.gz QSPBKULENHWZAL-ZDUSSCGKSA-N 1 1 355.398 2.845 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001307154713 1049460697 /nfs/dbraw/zinc/46/06/97/1049460697.db2.gz ZTKJDGSSDKPDMP-MELADBBJSA-N 1 1 365.430 2.599 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001307154713 1049460702 /nfs/dbraw/zinc/46/07/02/1049460702.db2.gz ZTKJDGSSDKPDMP-MELADBBJSA-N 1 1 365.430 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)CC[C@H](O)c1ccccc1)CC2 ZINC001340616641 1050997846 /nfs/dbraw/zinc/99/78/46/1050997846.db2.gz SEXMGEFSDAYFEO-UXHICEINSA-N 1 1 356.422 2.828 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001340876879 1051209748 /nfs/dbraw/zinc/20/97/48/1051209748.db2.gz AXMBHAZAMUBKAE-WBVHZDCISA-N 1 1 372.473 2.737 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1C[C@H]2C[C@@]2(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC001340919765 1051248278 /nfs/dbraw/zinc/24/82/78/1051248278.db2.gz DZJZQPWCXGRALD-AHRSYUTCSA-N 1 1 351.406 2.569 20 5 FFBDMO CCN(c1nnc([C@H](C)[N+](=O)[O-])n1C)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001341358504 1051717450 /nfs/dbraw/zinc/71/74/50/1051717450.db2.gz HAPLULUUIGCPAP-HLLBOEOZSA-N 1 1 372.473 2.815 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](O)[C@@H]4CCCC[C@H]43)n2)cc1 ZINC001308025785 1052386147 /nfs/dbraw/zinc/38/61/47/1052386147.db2.gz RDBQAIUMVZKSNR-OAGGEKHMSA-N 1 1 358.398 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](O)[C@H]4CCCC[C@@H]43)n2)cc1 ZINC001308025784 1052386582 /nfs/dbraw/zinc/38/65/82/1052386582.db2.gz RDBQAIUMVZKSNR-JYJNAYRXSA-N 1 1 358.398 2.770 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2C[C@H]3[C@H]4C=C[C@H](C4)[C@@]3(C)C2)c([N+](=O)[O-])c1 ZINC001308119611 1052411384 /nfs/dbraw/zinc/41/13/84/1052411384.db2.gz RPOMRGYIYSJGTJ-QRDCCXFBSA-N 1 1 357.410 2.686 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC001309059993 1052547278 /nfs/dbraw/zinc/54/72/78/1052547278.db2.gz KGVTURDNGKIXRU-GJZGRUSLSA-N 1 1 369.487 2.753 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC001309059995 1052547526 /nfs/dbraw/zinc/54/75/26/1052547526.db2.gz KGVTURDNGKIXRU-LSDHHAIUSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CCCO1 ZINC001335188149 1053250244 /nfs/dbraw/zinc/25/02/44/1053250244.db2.gz NEXGPOHLISBHRW-HNNXBMFYSA-N 1 1 371.437 2.979 20 5 FFBDMO COc1ccc([C@@H](C[NH+](C)C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335414556 1053345571 /nfs/dbraw/zinc/34/55/71/1053345571.db2.gz YUXPQRAPGUFFDG-RTBURBONSA-N 1 1 359.426 2.529 20 5 FFBDMO O=[N+]([O-])c1cnc2c(Cl)cccc2c1N1CC[NH+]([C@@H]2CCOC2)CC1 ZINC001335520438 1053412754 /nfs/dbraw/zinc/41/27/54/1053412754.db2.gz PUPOOGFLGPUKST-GFCCVEGCSA-N 1 1 362.817 2.707 20 5 FFBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC001347239009 1053748272 /nfs/dbraw/zinc/74/82/72/1053748272.db2.gz TWKOMCRUXTUNNF-SUMWQHHRSA-N 1 1 351.378 2.561 20 5 FFBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@@H](CCF)C1 ZINC001347239009 1053748276 /nfs/dbraw/zinc/74/82/76/1053748276.db2.gz TWKOMCRUXTUNNF-SUMWQHHRSA-N 1 1 351.378 2.561 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC001336745966 1054187662 /nfs/dbraw/zinc/18/76/62/1054187662.db2.gz ULGJQDKBRGPKSW-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO Cc1cc(NC(=O)[C@@H]2CCC[N@@H+]2C(C)C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001349584727 1055352891 /nfs/dbraw/zinc/35/28/91/1055352891.db2.gz FEAZTQSDASEBCB-INIZCTEOSA-N 1 1 357.414 2.900 20 5 FFBDMO Nc1c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc2ccccc2c1[N+](=O)[O-] ZINC001350573099 1055841179 /nfs/dbraw/zinc/84/11/79/1055841179.db2.gz HRZITOGRTSERLI-AWEZNQCLSA-N 1 1 354.410 2.641 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)N2CCc3c2ccc([N+](=O)[O-])c3F)C1 ZINC001544010822 1071580840 /nfs/dbraw/zinc/58/08/40/1071580840.db2.gz HLVZSDSPBPMVKX-QGZVFWFLSA-N 1 1 353.369 2.836 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC001520129942 1059416937 /nfs/dbraw/zinc/41/69/37/1059416937.db2.gz XEIZKAUHCJOMQZ-STQMWFEESA-N 1 1 350.419 2.940 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H]1C(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001455679657 1059864245 /nfs/dbraw/zinc/86/42/45/1059864245.db2.gz TWCCIUMYNIMVLD-KRWDZBQOSA-N 1 1 373.457 2.640 20 5 FFBDMO CCC[N@H+]1CC[C@H](Cn2c(C)nnc2N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001547168157 1071928264 /nfs/dbraw/zinc/92/82/64/1071928264.db2.gz JHSIBPAXUKHJJZ-INIZCTEOSA-N 1 1 372.473 2.863 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848486343 1060128856 /nfs/dbraw/zinc/12/88/56/1060128856.db2.gz GNTMVKVQEKEXAO-INIZCTEOSA-N 1 1 371.441 2.654 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000848587246 1060317930 /nfs/dbraw/zinc/31/79/30/1060317930.db2.gz GVHNOIZTRMQDSH-CYBMUJFWSA-N 1 1 371.384 2.757 20 5 FFBDMO CC(C)Oc1nc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC001458594280 1060630433 /nfs/dbraw/zinc/63/04/33/1060630433.db2.gz MBFRLEAUJPTARW-TZMCWYRMSA-N 1 1 352.460 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@H]2C[C@@H](O)C23CCC3)o1 ZINC001460424377 1060988889 /nfs/dbraw/zinc/98/88/89/1060988889.db2.gz AFNDCRBKXPKBGC-QWHCGFSZSA-N 1 1 364.789 2.691 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC001460716838 1061074836 /nfs/dbraw/zinc/07/48/36/1061074836.db2.gz IHOHPPHUSHAZPD-LBPRGKRZSA-N 1 1 354.378 2.908 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC001460716838 1061074851 /nfs/dbraw/zinc/07/48/51/1061074851.db2.gz IHOHPPHUSHAZPD-LBPRGKRZSA-N 1 1 354.378 2.908 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC001526656349 1061205327 /nfs/dbraw/zinc/20/53/27/1061205327.db2.gz PZENGRXWGLQVCU-OALUTQOASA-N 1 1 353.422 2.947 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2nncnn2)cc1 ZINC001461615618 1061361696 /nfs/dbraw/zinc/36/16/96/1061361696.db2.gz RTLSMOPOIAASNX-UHFFFAOYSA-N 1 1 366.381 2.530 20 5 FFBDMO Nc1c(NC(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc(Cl)cc1[N+](=O)[O-] ZINC001476915806 1061509654 /nfs/dbraw/zinc/50/96/54/1061509654.db2.gz CFHWJWURBNQMOL-LBPRGKRZSA-N 1 1 367.837 2.969 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)c(C)cc1[N+](=O)[O-] ZINC001462737527 1061751934 /nfs/dbraw/zinc/75/19/34/1061751934.db2.gz CWBWFRCHAFAYOV-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+]1Cc1ccccc1 ZINC001466752562 1063545570 /nfs/dbraw/zinc/54/55/70/1063545570.db2.gz GTPDVZNWHWIQTD-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001466752562 1063545590 /nfs/dbraw/zinc/54/55/90/1063545590.db2.gz GTPDVZNWHWIQTD-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC001467858404 1063867566 /nfs/dbraw/zinc/86/75/66/1063867566.db2.gz CDLLJUIYYWCRJP-KRWDZBQOSA-N 1 1 371.412 2.662 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@@H]1Cc1ccccc1 ZINC001467858404 1063867575 /nfs/dbraw/zinc/86/75/75/1063867575.db2.gz CDLLJUIYYWCRJP-KRWDZBQOSA-N 1 1 371.412 2.662 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C(F)(F)F ZINC001473769320 1065352950 /nfs/dbraw/zinc/35/29/50/1065352950.db2.gz GJMCXUVTCOUVJD-ZIAGYGMSSA-N 1 1 360.332 2.811 20 5 FFBDMO COCC[N@H+](CCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1OC ZINC001473867965 1065398535 /nfs/dbraw/zinc/39/85/35/1065398535.db2.gz BXTGIPSTJMTQSF-UHFFFAOYSA-N 1 1 368.430 2.784 20 5 FFBDMO COCC[N@@H+](CCC(=O)OC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1OC ZINC001473867965 1065398539 /nfs/dbraw/zinc/39/85/39/1065398539.db2.gz BXTGIPSTJMTQSF-UHFFFAOYSA-N 1 1 368.430 2.784 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC001580494251 1078814884 /nfs/dbraw/zinc/81/48/84/1078814884.db2.gz RJCCYGUCKANUHB-YOCVDRLZSA-N 1 1 355.369 2.920 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC001585138746 1079430265 /nfs/dbraw/zinc/43/02/65/1079430265.db2.gz LCHVTOQFJRMAQZ-MRXNPFEDSA-N 1 1 371.441 2.583 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC001585138746 1079430269 /nfs/dbraw/zinc/43/02/69/1079430269.db2.gz LCHVTOQFJRMAQZ-MRXNPFEDSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001556098827 1075700276 /nfs/dbraw/zinc/70/02/76/1075700276.db2.gz ZLXFLOFEBDPKCL-KBXCAEBGSA-N 1 1 371.412 2.913 20 5 FFBDMO Cc1ccc(NCCNc2ncc(Br)cc2[N+](=O)[O-])[nH+]c1 ZINC001559286557 1076146218 /nfs/dbraw/zinc/14/62/18/1076146218.db2.gz FEFGPKCDUHTCAW-UHFFFAOYSA-N 1 1 352.192 2.980 20 5 FFBDMO COC(=O)c1cc(C(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)[nH]1 ZINC001559686460 1076182658 /nfs/dbraw/zinc/18/26/58/1076182658.db2.gz CRQDUDVSHATYOO-LLVKDONJSA-N 1 1 359.382 2.860 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC001560077494 1076222632 /nfs/dbraw/zinc/22/26/32/1076222632.db2.gz ODUGDNFBXCDJTP-SWLSCSKDSA-N 1 1 354.248 2.883 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187210 1076243399 /nfs/dbraw/zinc/24/33/99/1076243399.db2.gz BMBMDZUOYUVRQD-DGCLKSJQSA-N 1 1 360.370 2.591 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187210 1076243402 /nfs/dbraw/zinc/24/34/02/1076243402.db2.gz BMBMDZUOYUVRQD-DGCLKSJQSA-N 1 1 360.370 2.591 20 5 FFBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(-c2nn[nH]n2)cn1 ZINC001589701732 1080677408 /nfs/dbraw/zinc/67/74/08/1080677408.db2.gz XCZLBVSZWNOZLB-UHFFFAOYSA-N 1 1 353.386 2.581 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(-c2nn[nH]n2)cn1 ZINC001589701732 1080677411 /nfs/dbraw/zinc/67/74/11/1080677411.db2.gz XCZLBVSZWNOZLB-UHFFFAOYSA-N 1 1 353.386 2.581 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876318 1080825838 /nfs/dbraw/zinc/82/58/38/1080825838.db2.gz UUDLZRNMCHPRFI-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000115414906 210171034 /nfs/dbraw/zinc/17/10/34/210171034.db2.gz KNYLJHMRGBTAJE-RYUDHWBXSA-N 1 1 352.391 2.803 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000375011260 512118544 /nfs/dbraw/zinc/11/85/44/512118544.db2.gz FBYVFGUUSKILAC-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000375011260 512118550 /nfs/dbraw/zinc/11/85/50/512118550.db2.gz FBYVFGUUSKILAC-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccco1 ZINC000021903053 249329064 /nfs/dbraw/zinc/32/90/64/249329064.db2.gz SONUIFGABQUIRO-MRXNPFEDSA-N 1 1 358.398 2.795 20 5 FFBDMO C[C@H]1C[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000093643726 250039027 /nfs/dbraw/zinc/03/90/27/250039027.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@H]1C[C@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643726 250039031 /nfs/dbraw/zinc/03/90/31/250039031.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@H]1C[C@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643726 250039034 /nfs/dbraw/zinc/03/90/34/250039034.db2.gz HMVXHNNZSXELAV-KBXCAEBGSA-N 1 1 357.458 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCS(=O)(=O)C3)o2)c(Cl)c1 ZINC000102420188 250110335 /nfs/dbraw/zinc/11/03/35/250110335.db2.gz HQALAELTYHETCG-JTQLQIEISA-N 1 1 370.814 2.785 20 5 FFBDMO C[N@@H+](CCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCC1 ZINC000104572494 250180154 /nfs/dbraw/zinc/18/01/54/250180154.db2.gz MVAFSRSSFJKIEV-UHFFFAOYSA-N 1 1 374.485 2.802 20 5 FFBDMO CCOC(=O)N1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000104661433 250182023 /nfs/dbraw/zinc/18/20/23/250182023.db2.gz GZFRYSHHHBJHKC-UHFFFAOYSA-N 1 1 374.397 2.566 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@H]2CCCC[C@@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181099011 251241542 /nfs/dbraw/zinc/24/15/42/251241542.db2.gz GWYQKHAXGFFSRA-QAPCUYQASA-N 1 1 358.442 2.978 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O ZINC000272295073 252003980 /nfs/dbraw/zinc/00/39/80/252003980.db2.gz FXBUIOXZWIOAQM-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O ZINC000272295073 252003986 /nfs/dbraw/zinc/00/39/86/252003986.db2.gz FXBUIOXZWIOAQM-GJZGRUSLSA-N 1 1 360.414 2.874 20 5 FFBDMO CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272683595 252100088 /nfs/dbraw/zinc/10/00/88/252100088.db2.gz OIZBSVVKZOPNMY-INIZCTEOSA-N 1 1 355.394 2.647 20 5 FFBDMO CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272683595 252100092 /nfs/dbraw/zinc/10/00/92/252100092.db2.gz OIZBSVVKZOPNMY-INIZCTEOSA-N 1 1 355.394 2.647 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000272937941 252169302 /nfs/dbraw/zinc/16/93/02/252169302.db2.gz MTQLFQSWEFHICL-NSHDSACASA-N 1 1 370.377 2.998 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(CC(=O)N2CCCC2)CC1 ZINC000276141749 256076119 /nfs/dbraw/zinc/07/61/19/256076119.db2.gz OPCUUBLANGODRF-QGZVFWFLSA-N 1 1 374.485 2.594 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[N@H+](CC(=O)N2CCCC2)CC1 ZINC000276141749 256076121 /nfs/dbraw/zinc/07/61/21/256076121.db2.gz OPCUUBLANGODRF-QGZVFWFLSA-N 1 1 374.485 2.594 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1 ZINC000276141749 256076122 /nfs/dbraw/zinc/07/61/22/256076122.db2.gz OPCUUBLANGODRF-QGZVFWFLSA-N 1 1 374.485 2.594 20 5 FFBDMO C[C@@H]1CC[C@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)O1 ZINC000276472992 256103492 /nfs/dbraw/zinc/10/34/92/256103492.db2.gz ZDRALMGMUIXFTC-UKRRQHHQSA-N 1 1 359.430 2.551 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000277199419 256171705 /nfs/dbraw/zinc/17/17/05/256171705.db2.gz FKYUVUSDSZOFAY-DYVFJYSZSA-N 1 1 359.426 2.692 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCCC[N@H+]1CCC[C@@H]1CO ZINC000278732456 256342473 /nfs/dbraw/zinc/34/24/73/256342473.db2.gz RZFBBSYZUZZWCU-CQSZACIVSA-N 1 1 369.849 2.523 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000278305171 256297339 /nfs/dbraw/zinc/29/73/39/256297339.db2.gz WIDGVVJLRFMZQL-UHFFFAOYSA-N 1 1 351.359 2.668 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH2+]Cc2c(F)ccc(Br)c2F)c1 ZINC000282156320 256698711 /nfs/dbraw/zinc/69/87/11/256698711.db2.gz XINHDDMJRKDXTF-UHFFFAOYSA-N 1 1 361.146 2.622 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282547519 256754031 /nfs/dbraw/zinc/75/40/31/256754031.db2.gz WSSXKMMUWFLPPD-AWEZNQCLSA-N 1 1 359.430 2.874 20 5 FFBDMO CC(C)n1nccc1NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282547519 256754034 /nfs/dbraw/zinc/75/40/34/256754034.db2.gz WSSXKMMUWFLPPD-AWEZNQCLSA-N 1 1 359.430 2.874 20 5 FFBDMO CN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286117486 257021077 /nfs/dbraw/zinc/02/10/77/257021077.db2.gz GJSAHDFAGDCRNO-JWTNVVGKSA-N 1 1 360.458 2.871 20 5 FFBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000286565609 257043327 /nfs/dbraw/zinc/04/33/27/257043327.db2.gz UCLXCDGUALWCBM-CQSZACIVSA-N 1 1 373.413 2.526 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1 ZINC000288680378 257217818 /nfs/dbraw/zinc/21/78/18/257217818.db2.gz CRJXSCPJMDHXTE-UXHICEINSA-N 1 1 374.412 2.694 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC[N@H+]1CC(C)(C)O ZINC000289514830 257285149 /nfs/dbraw/zinc/28/51/49/257285149.db2.gz BXHDKFWNAYAEBP-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[C@@H]([NH+]2CCOCC2)[C@H]1C ZINC000290066915 257313924 /nfs/dbraw/zinc/31/39/24/257313924.db2.gz BZSBVHCFFKDVNM-GDBMZVCRSA-N 1 1 362.430 2.539 20 5 FFBDMO COc1cc(CN2CC[C@@H](C3CC[NH+](C)CC3)C2)c([N+](=O)[O-])cc1OC ZINC000290486797 257334685 /nfs/dbraw/zinc/33/46/85/257334685.db2.gz OIVXLQYONLKKFZ-OAHLLOKOSA-N 1 1 363.458 2.776 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@](CO)(c4ccccc4)C3)nc2c1 ZINC000291150205 257388073 /nfs/dbraw/zinc/38/80/73/257388073.db2.gz AGORILMIDXXXQI-IBGZPJMESA-N 1 1 353.378 2.872 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000296238021 257685799 /nfs/dbraw/zinc/68/57/99/257685799.db2.gz WXGJLJIRLCNSLY-CYBMUJFWSA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1cc(F)c(NC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000296901207 257765014 /nfs/dbraw/zinc/76/50/14/257765014.db2.gz XVSBIMODEPXZEK-ZDUSSCGKSA-N 1 1 368.409 2.665 20 5 FFBDMO CCN1CC[NH+](CCCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000301199985 258033451 /nfs/dbraw/zinc/03/34/51/258033451.db2.gz WBPNZRSADLXJHK-UHFFFAOYSA-N 1 1 371.279 2.797 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000302027093 258082962 /nfs/dbraw/zinc/08/29/62/258082962.db2.gz HDXAWDXUYXMICH-LSDHHAIUSA-N 1 1 358.446 2.728 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1N(C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000302481390 258103376 /nfs/dbraw/zinc/10/33/76/258103376.db2.gz WMKNQOGKNCMUMZ-FQEVSTJZSA-N 1 1 355.438 2.976 20 5 FFBDMO Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302476620 258103489 /nfs/dbraw/zinc/10/34/89/258103489.db2.gz FJAJJLSUBWGNLF-AWEZNQCLSA-N 1 1 358.442 2.733 20 5 FFBDMO C[C@H]1CCC[N@@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000302675351 258107765 /nfs/dbraw/zinc/10/77/65/258107765.db2.gz UBQLRKONEYZTJT-ZDUSSCGKSA-N 1 1 369.487 2.921 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000302675351 258107766 /nfs/dbraw/zinc/10/77/66/258107766.db2.gz UBQLRKONEYZTJT-ZDUSSCGKSA-N 1 1 369.487 2.921 20 5 FFBDMO CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1C[C@H](C)O ZINC000301428786 258049117 /nfs/dbraw/zinc/04/91/17/258049117.db2.gz FEGREVFYOMLCKL-RYUDHWBXSA-N 1 1 361.364 2.895 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301879705 258072516 /nfs/dbraw/zinc/07/25/16/258072516.db2.gz JUEMTXKGAHXTJY-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)CC2)s1 ZINC000301961805 258077967 /nfs/dbraw/zinc/07/79/67/258077967.db2.gz IESPPFKCTDOWTJ-UHFFFAOYSA-N 1 1 372.454 2.584 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000301996821 258080675 /nfs/dbraw/zinc/08/06/75/258080675.db2.gz OUXVRMUCWQCAEX-OAHLLOKOSA-N 1 1 366.425 2.738 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)[N@H+]1C ZINC000330783635 258170679 /nfs/dbraw/zinc/17/06/79/258170679.db2.gz INBBPKQKTGXISR-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)[N@@H+]1C ZINC000330783635 258170680 /nfs/dbraw/zinc/17/06/80/258170680.db2.gz INBBPKQKTGXISR-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO Cc1c(NC(=O)CCN2C[C@H]3CCCC[N@@H+]3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000332008719 258210048 /nfs/dbraw/zinc/21/00/48/258210048.db2.gz JSUQEZANNSMVID-GDBMZVCRSA-N 1 1 360.458 2.790 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389548 258228269 /nfs/dbraw/zinc/22/82/69/258228269.db2.gz LFWQEFSCEVWQIS-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332389548 258228270 /nfs/dbraw/zinc/22/82/70/258228270.db2.gz LFWQEFSCEVWQIS-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC[N@H+]1C ZINC000332656357 258239282 /nfs/dbraw/zinc/23/92/82/258239282.db2.gz JQUOXJYLIIKZTB-DGCLKSJQSA-N 1 1 360.439 2.931 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@H](C)O1 ZINC000331727541 258198196 /nfs/dbraw/zinc/19/81/96/258198196.db2.gz YOGNZKXCYQVWNT-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C[C@H](C)O1 ZINC000331727541 258198197 /nfs/dbraw/zinc/19/81/97/258198197.db2.gz YOGNZKXCYQVWNT-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO O=C1C[C@@H](c2ccccc2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1 ZINC000052835519 506259573 /nfs/dbraw/zinc/25/95/73/506259573.db2.gz QBWSKWBVKCWRND-SFHVURJKSA-N 1 1 355.394 2.537 20 5 FFBDMO C[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)[NH+]1CCN(c2ccccc2)CC1 ZINC000053016584 506296756 /nfs/dbraw/zinc/29/67/56/506296756.db2.gz DIVBLSLKQXQGFA-AWEZNQCLSA-N 1 1 374.466 2.597 20 5 FFBDMO Cc1cccc(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1C ZINC000373236467 512234961 /nfs/dbraw/zinc/23/49/61/512234961.db2.gz IRTKJXKVKCBQMV-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000375318790 512264910 /nfs/dbraw/zinc/26/49/10/512264910.db2.gz KFKHGZJFRYJHJD-IBGZPJMESA-N 1 1 364.361 2.832 20 5 FFBDMO CNC(=O)c1ccc(N2CCC[N@@H+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000053554479 506404140 /nfs/dbraw/zinc/40/41/40/506404140.db2.gz PBHBVYPUFMPPJA-UHFFFAOYSA-N 1 1 368.437 2.667 20 5 FFBDMO C[C@@H](CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1C ZINC000041488275 506526370 /nfs/dbraw/zinc/52/63/70/506526370.db2.gz GENIVHUUFMKSFQ-GJZGRUSLSA-N 1 1 363.462 2.569 20 5 FFBDMO CC(C)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCOCC1 ZINC000043342398 506735948 /nfs/dbraw/zinc/73/59/48/506735948.db2.gz GDOIODSTCMHBEH-OAHLLOKOSA-N 1 1 370.837 2.727 20 5 FFBDMO COc1ccc(CC[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000067308751 506824385 /nfs/dbraw/zinc/82/43/85/506824385.db2.gz UBBZNRVKVTXYTI-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(Cc3ccccn3)CC2)cc1 ZINC000055900150 506880298 /nfs/dbraw/zinc/88/02/98/506880298.db2.gz MLYQVKCLDRPXOW-UHFFFAOYSA-N 1 1 356.426 2.577 20 5 FFBDMO O=C(c1ccccc1)N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000055898499 506880726 /nfs/dbraw/zinc/88/07/26/506880726.db2.gz PDDNDLNZGTWKAK-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000067724020 506990809 /nfs/dbraw/zinc/99/08/09/506990809.db2.gz MYFUNDMXWDMTPD-OAHLLOKOSA-N 1 1 368.437 2.841 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068084906 507104733 /nfs/dbraw/zinc/10/47/33/507104733.db2.gz UKZCCYDXNMMXHO-CYBMUJFWSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068084906 507104737 /nfs/dbraw/zinc/10/47/37/507104737.db2.gz UKZCCYDXNMMXHO-CYBMUJFWSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068084906 507104746 /nfs/dbraw/zinc/10/47/46/507104746.db2.gz UKZCCYDXNMMXHO-CYBMUJFWSA-N 1 1 359.430 2.856 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC[C@@H](C)C1 ZINC000047147919 507272897 /nfs/dbraw/zinc/27/28/97/507272897.db2.gz QQEHUXYIZRTSEZ-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)NCCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000057830404 507338241 /nfs/dbraw/zinc/33/82/41/507338241.db2.gz IRQWEVKWFCUSEA-GOSISDBHSA-N 1 1 356.426 2.816 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000068935902 507364547 /nfs/dbraw/zinc/36/45/47/507364547.db2.gz BPUOKUSJDITXCG-OAHLLOKOSA-N 1 1 360.458 2.655 20 5 FFBDMO C[C@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000025632894 507517588 /nfs/dbraw/zinc/51/75/88/507517588.db2.gz IXJWELOMULQXOG-OAHLLOKOSA-N 1 1 369.421 2.537 20 5 FFBDMO Cc1cccc(OCC[N@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000025698302 507524734 /nfs/dbraw/zinc/52/47/34/507524734.db2.gz NKBRZMSPQYIRNM-KRWDZBQOSA-N 1 1 360.410 2.654 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1C ZINC000060497761 507553222 /nfs/dbraw/zinc/55/32/22/507553222.db2.gz LXZQHCMTPXFVRJ-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051049560 507728487 /nfs/dbraw/zinc/72/84/87/507728487.db2.gz NQLVPFXVEBTJCG-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000063738873 507767333 /nfs/dbraw/zinc/76/73/33/507767333.db2.gz IQSHYWCJVBPKIS-CYBMUJFWSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNc2nc3sccn3c2[N+](=O)[O-])cn1 ZINC000052510418 507811586 /nfs/dbraw/zinc/81/15/86/507811586.db2.gz JFCCMHWYOGAHAK-UHFFFAOYSA-N 1 1 355.383 2.805 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072977549 507880203 /nfs/dbraw/zinc/88/02/03/507880203.db2.gz UTPWFSWXVHGRIE-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072977549 507880205 /nfs/dbraw/zinc/88/02/05/507880205.db2.gz UTPWFSWXVHGRIE-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO Cn1cccc1[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000073101522 507893236 /nfs/dbraw/zinc/89/32/36/507893236.db2.gz RXFLBSLCOIOXOG-SFHVURJKSA-N 1 1 354.410 2.660 20 5 FFBDMO Cn1cccc1[C@@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000073101522 507893240 /nfs/dbraw/zinc/89/32/40/507893240.db2.gz RXFLBSLCOIOXOG-SFHVURJKSA-N 1 1 354.410 2.660 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000090003543 507899215 /nfs/dbraw/zinc/89/92/15/507899215.db2.gz MCQFXCCAJKFLAQ-ZDUSSCGKSA-N 1 1 355.398 2.924 20 5 FFBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000074319829 508012016 /nfs/dbraw/zinc/01/20/16/508012016.db2.gz LBSFTWVAUYFCOP-UHFFFAOYSA-N 1 1 362.474 2.638 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000074319829 508012018 /nfs/dbraw/zinc/01/20/18/508012018.db2.gz LBSFTWVAUYFCOP-UHFFFAOYSA-N 1 1 362.474 2.638 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H](Cn3ccnn3)C2)c1 ZINC000092070924 508039967 /nfs/dbraw/zinc/03/99/67/508039967.db2.gz BNVRZDMFMYZLCR-LBPRGKRZSA-N 1 1 367.356 2.700 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)c1 ZINC000092070924 508039970 /nfs/dbraw/zinc/03/99/70/508039970.db2.gz BNVRZDMFMYZLCR-LBPRGKRZSA-N 1 1 367.356 2.700 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000080125655 508041232 /nfs/dbraw/zinc/04/12/32/508041232.db2.gz AFXCPYKLNZYVMH-GFCCVEGCSA-N 1 1 357.332 2.828 20 5 FFBDMO C[N@H+](Cc1ccccc1-c1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075681659 508128338 /nfs/dbraw/zinc/12/83/38/508128338.db2.gz ZWTXBPHRKJKQNE-IBGZPJMESA-N 1 1 366.421 2.951 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000081128601 508140991 /nfs/dbraw/zinc/14/09/91/508140991.db2.gz AHDARXLHQWNPLE-QGZVFWFLSA-N 1 1 369.421 2.707 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000075953886 508146054 /nfs/dbraw/zinc/14/60/54/508146054.db2.gz AFUIPZWOOPQXQM-HNNXBMFYSA-N 1 1 352.431 2.867 20 5 FFBDMO COCCOc1cccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000093534296 508148542 /nfs/dbraw/zinc/14/85/42/508148542.db2.gz FTSKKCMREXCWEH-MRXNPFEDSA-N 1 1 372.425 2.701 20 5 FFBDMO CCOC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000112356807 508178386 /nfs/dbraw/zinc/17/83/86/508178386.db2.gz BSYLBXCRDAGEIL-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000112356807 508178389 /nfs/dbraw/zinc/17/83/89/508178389.db2.gz BSYLBXCRDAGEIL-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC[C@@H]2CCCO2)CC1 ZINC000083414657 508245350 /nfs/dbraw/zinc/24/53/50/508245350.db2.gz YLXLNOCUFDQKKO-KRWDZBQOSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114645218 508333774 /nfs/dbraw/zinc/33/37/74/508333774.db2.gz KWOFQEDWDDXJOW-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000156620899 508451342 /nfs/dbraw/zinc/45/13/42/508451342.db2.gz CDVJBGKBCXQYCM-BBRMVZONSA-N 1 1 371.441 2.521 20 5 FFBDMO CC[C@H](O)C[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000134489051 508539174 /nfs/dbraw/zinc/53/91/74/508539174.db2.gz TYGKUEBRRWTRRZ-IBGZPJMESA-N 1 1 371.437 2.831 20 5 FFBDMO CC[C@H](O)C[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000134489051 508539178 /nfs/dbraw/zinc/53/91/78/508539178.db2.gz TYGKUEBRRWTRRZ-IBGZPJMESA-N 1 1 371.437 2.831 20 5 FFBDMO CCC[C@H](NCCC[N@H+]1CCC[C@H](C(N)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000128085553 508544593 /nfs/dbraw/zinc/54/45/93/508544593.db2.gz QFLZIPXNGUPZHW-WMZOPIPTSA-N 1 1 362.474 2.613 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@H](c2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000122738042 508580441 /nfs/dbraw/zinc/58/04/41/508580441.db2.gz BCIBWJRPUATWCI-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCO[C@@H]2CCCC[C@@H]21 ZINC000117336572 508593779 /nfs/dbraw/zinc/59/37/79/508593779.db2.gz XIWMMXWTHROFSC-GOEBONIOSA-N 1 1 361.398 2.536 20 5 FFBDMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000157978200 508640808 /nfs/dbraw/zinc/64/08/08/508640808.db2.gz AOLZDXUJGLRTSH-KURKYZTESA-N 1 1 350.415 2.632 20 5 FFBDMO C[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000123199625 508651001 /nfs/dbraw/zinc/65/10/01/508651001.db2.gz UHUBGROLADNFKN-AAEUAGOBSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000123242126 508657007 /nfs/dbraw/zinc/65/70/07/508657007.db2.gz CHVSMVMLXTVHKX-MFKMUULPSA-N 1 1 364.402 2.675 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])cc1 ZINC000136007963 508665083 /nfs/dbraw/zinc/66/50/83/508665083.db2.gz RKBPKETVTAQYGJ-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1 ZINC000136007963 508665085 /nfs/dbraw/zinc/66/50/85/508665085.db2.gz RKBPKETVTAQYGJ-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1 ZINC000136007963 508665090 /nfs/dbraw/zinc/66/50/90/508665090.db2.gz RKBPKETVTAQYGJ-CYBMUJFWSA-N 1 1 357.414 2.622 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CN3CCOCC3)C2)ccc1Cl ZINC000153908557 508674367 /nfs/dbraw/zinc/67/43/67/508674367.db2.gz ICRICMLZWUMDDX-HNNXBMFYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](CN3CCOCC3)C2)ccc1Cl ZINC000153908557 508674371 /nfs/dbraw/zinc/67/43/71/508674371.db2.gz ICRICMLZWUMDDX-HNNXBMFYSA-N 1 1 353.850 2.792 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](Cc2ccc(CNC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)C1 ZINC000136245252 508681465 /nfs/dbraw/zinc/68/14/65/508681465.db2.gz NEPSVVIANQUMRX-KBPBESRZSA-N 1 1 371.441 2.726 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2n[nH]cc2[N+](=O)[O-])c1 ZINC000136548222 508700474 /nfs/dbraw/zinc/70/04/74/508700474.db2.gz LOZRQIKOXKSNBN-UHFFFAOYSA-N 1 1 354.370 2.938 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000123849103 508747662 /nfs/dbraw/zinc/74/76/62/508747662.db2.gz BQPBFFUWVFHFRU-HUUCEWRRSA-N 1 1 371.441 2.610 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000158829209 508756807 /nfs/dbraw/zinc/75/68/07/508756807.db2.gz GKRBNHZRSNAAIY-UHFFFAOYSA-N 1 1 372.450 2.739 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])sc2C1 ZINC000159008771 508780218 /nfs/dbraw/zinc/78/02/18/508780218.db2.gz CHDYSGNGFCGYPD-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])sc2C1 ZINC000159008771 508780220 /nfs/dbraw/zinc/78/02/20/508780220.db2.gz CHDYSGNGFCGYPD-UHFFFAOYSA-N 1 1 350.375 2.821 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000119457750 508799508 /nfs/dbraw/zinc/79/95/08/508799508.db2.gz AAFXELLXWBLVDK-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-] ZINC000119457884 508799572 /nfs/dbraw/zinc/79/95/72/508799572.db2.gz AAFXELLXWBLVDK-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1ccccc1[N+](=O)[O-] ZINC000119533078 508813957 /nfs/dbraw/zinc/81/39/57/508813957.db2.gz ZOSIHJPEXJGQDK-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000130758360 508842077 /nfs/dbraw/zinc/84/20/77/508842077.db2.gz DFPJCKKXRDWTIO-UHFFFAOYSA-N 1 1 357.414 2.836 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000159807634 508893612 /nfs/dbraw/zinc/89/36/12/508893612.db2.gz NZPIPUZTBNMKGB-SFHVURJKSA-N 1 1 359.426 2.533 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150835178 508903938 /nfs/dbraw/zinc/90/39/38/508903938.db2.gz KNXQTKSCPNXIJK-MRXNPFEDSA-N 1 1 360.458 2.650 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000120079609 508924130 /nfs/dbraw/zinc/92/41/30/508924130.db2.gz ZGWNKOIOHPAFKS-UGSOOPFHSA-N 1 1 354.410 2.549 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000125187559 508944278 /nfs/dbraw/zinc/94/42/78/508944278.db2.gz IITIMPKHXGUBEC-LBPRGKRZSA-N 1 1 353.382 2.714 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[NH+]2CCOCC2)cc1C(F)(F)F ZINC000160404407 508982238 /nfs/dbraw/zinc/98/22/38/508982238.db2.gz ASDNWBVFMSDSPO-CYBMUJFWSA-N 1 1 359.348 2.915 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)CC1 ZINC000120426922 508994273 /nfs/dbraw/zinc/99/42/73/508994273.db2.gz OTGVREZLIUSRLW-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1[C@H]1CNC(=O)C1 ZINC000125541951 508996878 /nfs/dbraw/zinc/99/68/78/508996878.db2.gz GURUJLDDOZSQFH-PBHICJAKSA-N 1 1 361.442 2.873 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000120509259 509011006 /nfs/dbraw/zinc/01/10/06/509011006.db2.gz CKUCIAZYQPYRRM-WBVHZDCISA-N 1 1 374.485 2.610 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)CCC2CCOCC2)c([N+](=O)[O-])c1 ZINC000120695839 509046997 /nfs/dbraw/zinc/04/69/97/509046997.db2.gz KWVDYVRWMAXNCJ-UHFFFAOYSA-N 1 1 365.430 2.681 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000155842562 509080312 /nfs/dbraw/zinc/08/03/12/509080312.db2.gz GJEJBNOHHNBZGN-CJNGLKHVSA-N 1 1 351.834 2.733 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC000266785911 509192591 /nfs/dbraw/zinc/19/25/91/509192591.db2.gz WBMOZTNVRAPIHV-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)CC1 ZINC000195508668 509202392 /nfs/dbraw/zinc/20/23/92/509202392.db2.gz IWJRQPKSKPYCJN-UHFFFAOYSA-N 1 1 361.471 2.801 20 5 FFBDMO C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000185493480 509205254 /nfs/dbraw/zinc/20/52/54/509205254.db2.gz HQVCUOVUSKXFRS-ACJLOTCBSA-N 1 1 353.382 2.560 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000248034359 509221244 /nfs/dbraw/zinc/22/12/44/509221244.db2.gz KWFZLMWZPVVDJY-FXAWDEMLSA-N 1 1 368.437 2.958 20 5 FFBDMO COc1ccc([C@H]2CC[N@@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000248444400 509323634 /nfs/dbraw/zinc/32/36/34/509323634.db2.gz FXGFONYBAOFZBN-DLBZAZTESA-N 1 1 372.421 2.833 20 5 FFBDMO Cc1[nH+]ccn1CCCCSc1nc2cc([N+](=O)[O-])ccc2c(=O)n1C ZINC000185730912 509328335 /nfs/dbraw/zinc/32/83/35/509328335.db2.gz QYENFWGSFOWEQN-UHFFFAOYSA-N 1 1 373.438 2.919 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000248463598 509333527 /nfs/dbraw/zinc/33/35/27/509333527.db2.gz QRMLLJIYZBAMSG-ZBFHGGJFSA-N 1 1 360.414 2.512 20 5 FFBDMO C[C@@H](CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000182620505 509336642 /nfs/dbraw/zinc/33/66/42/509336642.db2.gz XTLCNVATAJGISJ-JTQLQIEISA-N 1 1 357.863 2.939 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000227836733 509414542 /nfs/dbraw/zinc/41/45/42/509414542.db2.gz QLNPDCZVFROJDF-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC([C@H]3CCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000189163661 509444691 /nfs/dbraw/zinc/44/46/91/509444691.db2.gz RCJVGPMQKGMJJV-ZWKOTPCHSA-N 1 1 359.426 2.591 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000248759280 509473538 /nfs/dbraw/zinc/47/35/38/509473538.db2.gz JFQHYUSZLNYSCH-DOTOQJQBSA-N 1 1 355.394 2.779 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000186010031 509478266 /nfs/dbraw/zinc/47/82/66/509478266.db2.gz FFZCQQDADKSWEU-UHFFFAOYSA-N 1 1 365.821 2.985 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000192519811 509544060 /nfs/dbraw/zinc/54/40/60/509544060.db2.gz XZFKDHWHOYKQET-UHFFFAOYSA-N 1 1 359.430 2.738 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000267928962 509675293 /nfs/dbraw/zinc/67/52/93/509675293.db2.gz NJHRZVMMTWUYLT-VIFPVBQESA-N 1 1 374.210 2.568 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000267928960 509676016 /nfs/dbraw/zinc/67/60/16/509676016.db2.gz NJHRZVMMTWUYLT-SECBINFHSA-N 1 1 374.210 2.568 20 5 FFBDMO C[C@H]1CC[C@@](CO)([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657720 509687120 /nfs/dbraw/zinc/68/71/20/509687120.db2.gz ABYNXKHOKKJAJM-YVEFUNNKSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176798620 509696476 /nfs/dbraw/zinc/69/64/76/509696476.db2.gz KPKNCKCWVOJAES-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176798620 509696480 /nfs/dbraw/zinc/69/64/80/509696480.db2.gz KPKNCKCWVOJAES-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO CNC(=O)c1ccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000176992259 509804954 /nfs/dbraw/zinc/80/49/54/509804954.db2.gz OUNWFYWERYCYFE-UHFFFAOYSA-N 1 1 354.366 2.728 20 5 FFBDMO CNC(=O)c1ccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000176992259 509804956 /nfs/dbraw/zinc/80/49/56/509804956.db2.gz OUNWFYWERYCYFE-UHFFFAOYSA-N 1 1 354.366 2.728 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N(C)CC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])CC1 ZINC000186708563 509864842 /nfs/dbraw/zinc/86/48/42/509864842.db2.gz VYNIYVXSWXCGDF-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CCc1oc(C(=O)OC)cc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000177199433 509932190 /nfs/dbraw/zinc/93/21/90/509932190.db2.gz AVGQKVZBKUJJJH-CYBMUJFWSA-N 1 1 374.397 2.618 20 5 FFBDMO Cc1nnc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)[nH]1 ZINC000268528034 509990772 /nfs/dbraw/zinc/99/07/72/509990772.db2.gz YDIQDDGROWGDSB-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000268528034 509990777 /nfs/dbraw/zinc/99/07/77/509990777.db2.gz YDIQDDGROWGDSB-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000268528034 509990782 /nfs/dbraw/zinc/99/07/82/509990782.db2.gz YDIQDDGROWGDSB-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n[nH]1 ZINC000268528034 509990787 /nfs/dbraw/zinc/99/07/87/509990787.db2.gz YDIQDDGROWGDSB-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)n[nH]1 ZINC000268528034 509990791 /nfs/dbraw/zinc/99/07/91/509990791.db2.gz YDIQDDGROWGDSB-CQSZACIVSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000265361957 510013768 /nfs/dbraw/zinc/01/37/68/510013768.db2.gz ZWVONHXTWHOIRS-ZDUSSCGKSA-N 1 1 364.402 2.534 20 5 FFBDMO CC(C)n1cnnc1[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000180629868 510023829 /nfs/dbraw/zinc/02/38/29/510023829.db2.gz YFJXPMXVGQSYPC-WBVHZDCISA-N 1 1 359.430 2.680 20 5 FFBDMO C[C@@]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)(C(N)=O)c1cccc(Cl)c1 ZINC000177414138 510045126 /nfs/dbraw/zinc/04/51/26/510045126.db2.gz ZGFVNTYJAWBWIZ-KRWDZBQOSA-N 1 1 363.801 2.617 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000261933984 510121679 /nfs/dbraw/zinc/12/16/79/510121679.db2.gz JVYVFXKJUHUFQC-MRXNPFEDSA-N 1 1 360.801 2.738 20 5 FFBDMO COc1ccccc1[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000265631346 510146748 /nfs/dbraw/zinc/14/67/48/510146748.db2.gz DTFQBMSTOLGKIX-NVXWUHKLSA-N 1 1 372.421 2.833 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000262101511 510177548 /nfs/dbraw/zinc/17/75/48/510177548.db2.gz ZJIRPDGWPXOUER-KRWDZBQOSA-N 1 1 359.813 2.964 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000187352863 510214015 /nfs/dbraw/zinc/21/40/15/510214015.db2.gz AEUUACQLFDKWGT-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000187352863 510214020 /nfs/dbraw/zinc/21/40/20/510214020.db2.gz AEUUACQLFDKWGT-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[N@@H+](Cc1cccc(Cl)c1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174655948 510234834 /nfs/dbraw/zinc/23/48/34/510234834.db2.gz GJVYVDXAGJGNQN-LBPRGKRZSA-N 1 1 359.213 2.591 20 5 FFBDMO C[N@H+](Cc1cccc(Cl)c1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174655948 510234839 /nfs/dbraw/zinc/23/48/39/510234839.db2.gz GJVYVDXAGJGNQN-LBPRGKRZSA-N 1 1 359.213 2.591 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000177780667 510248719 /nfs/dbraw/zinc/24/87/19/510248719.db2.gz COBBKUKUAIGFMY-HIFRSBDPSA-N 1 1 351.834 2.876 20 5 FFBDMO CC1(C)CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000181046807 510255582 /nfs/dbraw/zinc/25/55/82/510255582.db2.gz DFESTRNTGDIHJV-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC1(C)CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000181046807 510255588 /nfs/dbraw/zinc/25/55/88/510255588.db2.gz DFESTRNTGDIHJV-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000184341600 510273761 /nfs/dbraw/zinc/27/37/61/510273761.db2.gz YNAPVQGWELYPER-ZDUSSCGKSA-N 1 1 374.466 2.881 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246239035 510383633 /nfs/dbraw/zinc/38/36/33/510383633.db2.gz RKUJBHQCFCHVGZ-GJZGRUSLSA-N 1 1 369.487 2.562 20 5 FFBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000171920527 510452154 /nfs/dbraw/zinc/45/21/54/510452154.db2.gz GQMOIIADDAALNZ-CQSZACIVSA-N 1 1 359.348 2.968 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000172019252 510502576 /nfs/dbraw/zinc/50/25/76/510502576.db2.gz YQMHKFWUDHYGAH-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000172019252 510502578 /nfs/dbraw/zinc/50/25/78/510502578.db2.gz YQMHKFWUDHYGAH-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000181643019 510518685 /nfs/dbraw/zinc/51/86/85/510518685.db2.gz KIRWGOWTMCOJNK-INIZCTEOSA-N 1 1 360.435 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000181643019 510518691 /nfs/dbraw/zinc/51/86/91/510518691.db2.gz KIRWGOWTMCOJNK-INIZCTEOSA-N 1 1 360.435 2.858 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)[C@@H](C)C1 ZINC000246494931 510521393 /nfs/dbraw/zinc/52/13/93/510521393.db2.gz XMICXBFCERNSMY-XJKSGUPXSA-N 1 1 369.487 2.562 20 5 FFBDMO O=C(CCN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503807 510525336 /nfs/dbraw/zinc/52/53/36/510525336.db2.gz HWCVXQRWTPCDGW-KXBFYZLASA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503807 510525350 /nfs/dbraw/zinc/52/53/50/510525350.db2.gz HWCVXQRWTPCDGW-KXBFYZLASA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2[C@@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000246503807 510525353 /nfs/dbraw/zinc/52/53/53/510525353.db2.gz HWCVXQRWTPCDGW-KXBFYZLASA-N 1 1 372.469 2.872 20 5 FFBDMO CCc1n[nH]c(C(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000175384470 510620195 /nfs/dbraw/zinc/62/01/95/510620195.db2.gz GBQXMASUQZCCLL-CYBMUJFWSA-N 1 1 359.430 2.521 20 5 FFBDMO COc1cc(C(=O)NCCCNc2ccc(C)c[nH+]2)cc([N+](=O)[O-])c1OC ZINC000266501259 510624676 /nfs/dbraw/zinc/62/46/76/510624676.db2.gz VPVZGFLTCQVTMU-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000188212504 510651483 /nfs/dbraw/zinc/65/14/83/510651483.db2.gz YKUFYTGHFCDMSL-QGZVFWFLSA-N 1 1 368.437 2.914 20 5 FFBDMO COC[C@@H](Cc1ccccc1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191497542 510689392 /nfs/dbraw/zinc/68/93/92/510689392.db2.gz KIZDCFPROURHRS-LJQANCHMSA-N 1 1 371.437 2.747 20 5 FFBDMO COC[C@@H](Cc1ccccc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191497542 510689398 /nfs/dbraw/zinc/68/93/98/510689398.db2.gz KIZDCFPROURHRS-LJQANCHMSA-N 1 1 371.437 2.747 20 5 FFBDMO C[C@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178653511 510705813 /nfs/dbraw/zinc/70/58/13/510705813.db2.gz IWBMWWFDYQFFKM-HNNXBMFYSA-N 1 1 370.453 2.737 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000175751888 510771129 /nfs/dbraw/zinc/77/11/29/510771129.db2.gz GNIJFYBKDLMKHC-LLVKDONJSA-N 1 1 368.397 2.865 20 5 FFBDMO CCOc1ccccc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182216715 510818477 /nfs/dbraw/zinc/81/84/77/510818477.db2.gz QJYGMLPKHCXFOV-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000247376571 510859133 /nfs/dbraw/zinc/85/91/33/510859133.db2.gz HWBXALBKSWUOEL-JKIFEVAISA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000247376571 510859134 /nfs/dbraw/zinc/85/91/34/510859134.db2.gz HWBXALBKSWUOEL-JKIFEVAISA-N 1 1 357.414 2.701 20 5 FFBDMO CCCN1CC[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000360466147 510911277 /nfs/dbraw/zinc/91/12/77/510911277.db2.gz JCOVNGSVFLUWJT-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC([C@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000364657565 510999373 /nfs/dbraw/zinc/99/93/73/510999373.db2.gz MRCJOUJJCKBXDL-ZBFHGGJFSA-N 1 1 361.442 2.979 20 5 FFBDMO CC(=O)Nc1cccc(NC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282537239 511017621 /nfs/dbraw/zinc/01/76/21/511017621.db2.gz VSLZYFKQPDQCTP-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO CC(=O)Nc1cccc(NC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282537239 511017626 /nfs/dbraw/zinc/01/76/26/511017626.db2.gz VSLZYFKQPDQCTP-UHFFFAOYSA-N 1 1 370.409 2.666 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000282643552 511057771 /nfs/dbraw/zinc/05/77/71/511057771.db2.gz LLTQQUAQVCJOAT-INIZCTEOSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)[C@@H](C)C1 ZINC000279388522 511065210 /nfs/dbraw/zinc/06/52/10/511065210.db2.gz IOUVZFKQKOMXMU-SWLSCSKDSA-N 1 1 366.437 2.602 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000271127071 511090887 /nfs/dbraw/zinc/09/08/87/511090887.db2.gz PHTAYJIRZSITNS-AWEZNQCLSA-N 1 1 371.441 2.633 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1 ZINC000364878009 511130325 /nfs/dbraw/zinc/13/03/25/511130325.db2.gz GYHGXQDNIPJANE-CYBMUJFWSA-N 1 1 373.413 2.665 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2n[nH]cc2NC(C)=O)C1 ZINC000364878009 511130332 /nfs/dbraw/zinc/13/03/32/511130332.db2.gz GYHGXQDNIPJANE-CYBMUJFWSA-N 1 1 373.413 2.665 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC23CCOCC3)cn1 ZINC000294685791 511142846 /nfs/dbraw/zinc/14/28/46/511142846.db2.gz AHBTXIKWMHUNRE-QGZVFWFLSA-N 1 1 374.416 2.864 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCc1cnccn1 ZINC000271312051 511159331 /nfs/dbraw/zinc/15/93/31/511159331.db2.gz IFVHTQJIFFIZNA-NSHDSACASA-N 1 1 363.805 2.540 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCc1cnccn1 ZINC000271312051 511159342 /nfs/dbraw/zinc/15/93/42/511159342.db2.gz IFVHTQJIFFIZNA-NSHDSACASA-N 1 1 363.805 2.540 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)ccc1Cl ZINC000364963631 511179710 /nfs/dbraw/zinc/17/97/10/511179710.db2.gz QLKVSNTZLLKIFZ-HNNXBMFYSA-N 1 1 350.806 2.917 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1F)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000279760294 511204070 /nfs/dbraw/zinc/20/40/70/511204070.db2.gz VNVJJPKTEMDQHN-IYBDPMFKSA-N 1 1 369.396 2.938 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818981 511228637 /nfs/dbraw/zinc/22/86/37/511228637.db2.gz QKAWNMMZTCDQOG-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818981 511228640 /nfs/dbraw/zinc/22/86/40/511228640.db2.gz QKAWNMMZTCDQOG-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2C[C@@H]1C ZINC000295107261 511283500 /nfs/dbraw/zinc/28/35/00/511283500.db2.gz HDKWOHNPEXESJW-OLZOCXBDSA-N 1 1 363.439 2.636 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)C(C)(C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000295125903 511291165 /nfs/dbraw/zinc/29/11/65/511291165.db2.gz JHQUXAABRJURKX-SNVBAGLBSA-N 1 1 362.373 2.839 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000271765835 511316017 /nfs/dbraw/zinc/31/60/17/511316017.db2.gz PSAJZUQRUCBICK-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291762544 511327825 /nfs/dbraw/zinc/32/78/25/511327825.db2.gz LGPMXEOESRVMEP-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](CO)(c2ccccc2)C1 ZINC000291762544 511327828 /nfs/dbraw/zinc/32/78/28/511327828.db2.gz LGPMXEOESRVMEP-QRWLVFNGSA-N 1 1 369.421 2.558 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000363099620 511352274 /nfs/dbraw/zinc/35/22/74/511352274.db2.gz WUANTXJMKLOOLW-QWRGUYRKSA-N 1 1 370.356 2.945 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000363097939 511352881 /nfs/dbraw/zinc/35/28/81/511352881.db2.gz RUKYGYOJSYWCCH-JKSUJKDBSA-N 1 1 358.442 2.552 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000334043767 511437030 /nfs/dbraw/zinc/43/70/30/511437030.db2.gz MOSAIZDYFMSBJX-RYUDHWBXSA-N 1 1 368.409 2.743 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292058702 511448881 /nfs/dbraw/zinc/44/88/81/511448881.db2.gz BMTHXDYRJZGVAW-CABCVRRESA-N 1 1 360.458 2.728 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@]2(CCOC2)O1 ZINC000280623845 511537198 /nfs/dbraw/zinc/53/71/98/511537198.db2.gz WVELQSDHLRNDIV-AUUYWEPGSA-N 1 1 373.409 2.672 20 5 FFBDMO C[C@@H]1CN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CC2)C1 ZINC000295960828 511569427 /nfs/dbraw/zinc/56/94/27/511569427.db2.gz HUCLNMWWVAOEJP-OAHLLOKOSA-N 1 1 369.469 2.911 20 5 FFBDMO C[C@H](c1nc(-c2cccnc2)no1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365822974 511669576 /nfs/dbraw/zinc/66/95/76/511669576.db2.gz UBHDZMCBBJUNDD-GFCCVEGCSA-N 1 1 369.385 2.634 20 5 FFBDMO C[C@]12CC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000284346510 511691443 /nfs/dbraw/zinc/69/14/43/511691443.db2.gz CMSNOQQVOHNBIB-OCCSQVGLSA-N 1 1 358.225 2.709 20 5 FFBDMO C[C@]12CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]1C2(Cl)Cl ZINC000284346510 511691446 /nfs/dbraw/zinc/69/14/46/511691446.db2.gz CMSNOQQVOHNBIB-OCCSQVGLSA-N 1 1 358.225 2.709 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000303477334 511739282 /nfs/dbraw/zinc/73/92/82/511739282.db2.gz PDQIGOWMECIXFC-CQSZACIVSA-N 1 1 369.487 2.774 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(CC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000292837254 511740243 /nfs/dbraw/zinc/74/02/43/511740243.db2.gz AXDHAWKTMYPGLZ-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO CC[N@@H+](C)[C@@H](C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000365969191 511755659 /nfs/dbraw/zinc/75/56/59/511755659.db2.gz OKWKZZLZXPWZAB-GOSISDBHSA-N 1 1 371.441 2.648 20 5 FFBDMO Cc1ccnc(C2CC[NH+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000363800251 511775185 /nfs/dbraw/zinc/77/51/85/511775185.db2.gz RBFOLNNDVZXHFP-UHFFFAOYSA-N 1 1 369.425 2.536 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000284734940 511844212 /nfs/dbraw/zinc/84/42/12/511844212.db2.gz WBRPACSDOKFBNM-SJORKVTESA-N 1 1 374.466 2.623 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)N1CC(=O)Nc2ccccc21 ZINC000296670136 511844784 /nfs/dbraw/zinc/84/47/84/511844784.db2.gz GTKHLZQGLSILIG-QWHCGFSZSA-N 1 1 368.393 2.619 20 5 FFBDMO CCc1nocc1C[N@@H+](C)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000293401625 511951299 /nfs/dbraw/zinc/95/12/99/511951299.db2.gz LOOMTPFJPUPREI-UHFFFAOYSA-N 1 1 362.386 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(CN3CC[NH+](Cc4ccccc4)CC3)n2)o1 ZINC000351150078 511967155 /nfs/dbraw/zinc/96/71/55/511967155.db2.gz SNOOXMOEYUBZKH-UHFFFAOYSA-N 1 1 369.381 2.556 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000275075345 512033818 /nfs/dbraw/zinc/03/38/18/512033818.db2.gz BQLCDVXXTFDBQS-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000275075345 512033825 /nfs/dbraw/zinc/03/38/25/512033825.db2.gz BQLCDVXXTFDBQS-VIFPVBQESA-N 1 1 365.739 2.749 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275078757 512034586 /nfs/dbraw/zinc/03/45/86/512034586.db2.gz CNZMLXQCIXFIEK-VXGBXAGGSA-N 1 1 359.348 2.965 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](CC)C[C@H]2CC)cc1OC ZINC000411068684 512458568 /nfs/dbraw/zinc/45/85/68/512458568.db2.gz XSQOTMXUVGUMNB-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](CC)C[C@H]2CC)cc1OC ZINC000411068684 512458574 /nfs/dbraw/zinc/45/85/74/512458574.db2.gz XSQOTMXUVGUMNB-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@@H+]2CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375745829 512483114 /nfs/dbraw/zinc/48/31/14/512483114.db2.gz RISWVLBNUKPAGD-OORQEUNZSA-N 1 1 365.817 2.542 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000375745829 512483116 /nfs/dbraw/zinc/48/31/16/512483116.db2.gz RISWVLBNUKPAGD-OORQEUNZSA-N 1 1 365.817 2.542 20 5 FFBDMO CCOC1CC2(C1)CC[N@H+]([C@@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)C2 ZINC000375767839 512496499 /nfs/dbraw/zinc/49/64/99/512496499.db2.gz JUAUJUPYGOPRLK-TVRKMHQQSA-N 1 1 359.426 2.591 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NCCC[N@H+]2CCCC[C@H]2C)c1F ZINC000411181705 512507872 /nfs/dbraw/zinc/50/78/72/512507872.db2.gz UYKABNHTWAWISL-CYBMUJFWSA-N 1 1 367.421 2.666 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCCC3(CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000375907743 512564938 /nfs/dbraw/zinc/56/49/38/512564938.db2.gz TZKPHQVTTCXOAY-KRWDZBQOSA-N 1 1 359.426 2.593 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)o1 ZINC000411322892 512580483 /nfs/dbraw/zinc/58/04/83/512580483.db2.gz WQPLBXMIOJBUJM-UHFFFAOYSA-N 1 1 361.398 2.973 20 5 FFBDMO COC[C@@H]1CCCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000372087433 512710273 /nfs/dbraw/zinc/71/02/73/512710273.db2.gz CXUATCJSVLAMHQ-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000372087433 512710276 /nfs/dbraw/zinc/71/02/76/512710276.db2.gz CXUATCJSVLAMHQ-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCSC1 ZINC000411751799 512793510 /nfs/dbraw/zinc/79/35/10/512793510.db2.gz BRAWESMTUYUYKZ-MRXNPFEDSA-N 1 1 367.471 2.767 20 5 FFBDMO CC(C)[C@@]1(CO)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000368229066 512855714 /nfs/dbraw/zinc/85/57/14/512855714.db2.gz STMWYFJZKONZNS-IBGZPJMESA-N 1 1 358.442 2.836 20 5 FFBDMO CNc1c(C(=O)NC[C@H](C)[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000390727043 512910529 /nfs/dbraw/zinc/91/05/29/512910529.db2.gz RZZYVGDPWNXXGR-AWEZNQCLSA-N 1 1 356.426 2.887 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071510 512993754 /nfs/dbraw/zinc/99/37/54/512993754.db2.gz QCDKOZICPCBOHH-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408071510 512993757 /nfs/dbraw/zinc/99/37/57/512993757.db2.gz QCDKOZICPCBOHH-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090913 512997335 /nfs/dbraw/zinc/99/73/35/512997335.db2.gz VXBOJXNXKQQLSK-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000408090913 512997338 /nfs/dbraw/zinc/99/73/38/512997338.db2.gz VXBOJXNXKQQLSK-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3nnc4n3CCOC4)s2)cc1 ZINC000372777233 513038991 /nfs/dbraw/zinc/03/89/91/513038991.db2.gz UNFHARLLKICSAS-UHFFFAOYSA-N 1 1 371.422 2.735 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000428553602 513129299 /nfs/dbraw/zinc/12/92/99/513129299.db2.gz XOPGYSPXHMSWAM-KRWDZBQOSA-N 1 1 359.357 2.553 20 5 FFBDMO Cc1nc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000428672346 513161193 /nfs/dbraw/zinc/16/11/93/513161193.db2.gz XPYMLELGBRQATJ-INIZCTEOSA-N 1 1 358.467 2.750 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000439898855 513206618 /nfs/dbraw/zinc/20/66/18/513206618.db2.gz JAXTYSZEDHFNIV-CYBMUJFWSA-N 1 1 350.419 2.799 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000429012246 513252330 /nfs/dbraw/zinc/25/23/30/513252330.db2.gz SVAROROQNREWGK-CKEIUWERSA-N 1 1 371.441 2.807 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000429136426 513288333 /nfs/dbraw/zinc/28/83/33/513288333.db2.gz RKRCJVXUFBCYIV-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO COC(=O)[C@H](CC(C)C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000429136426 513288335 /nfs/dbraw/zinc/28/83/35/513288335.db2.gz RKRCJVXUFBCYIV-INIZCTEOSA-N 1 1 365.430 2.751 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@@H]2CCCN(c3cc(C)ccc3[N+](=O)[O-])C2)CC1 ZINC000450763649 513330218 /nfs/dbraw/zinc/33/02/18/513330218.db2.gz BMADGVXORXGSOH-SFHVURJKSA-N 1 1 374.485 2.674 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000429366193 513354608 /nfs/dbraw/zinc/35/46/08/513354608.db2.gz QVGXFIFKMNINQQ-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C(C)C ZINC000429378032 513358106 /nfs/dbraw/zinc/35/81/06/513358106.db2.gz ONFFJKLFNQRESW-HOCLYGCPSA-N 1 1 374.397 2.664 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000421710621 513382761 /nfs/dbraw/zinc/38/27/61/513382761.db2.gz LMVCZJSKUSQYQD-GFCCVEGCSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC000425057585 513394718 /nfs/dbraw/zinc/39/47/18/513394718.db2.gz BAVWWLXHTYXVEG-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])[C@@H]2C1 ZINC000425070689 513401359 /nfs/dbraw/zinc/40/13/59/513401359.db2.gz XALVUZBIWSMHKG-DOTOQJQBSA-N 1 1 366.421 2.823 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1C ZINC000434765117 513422807 /nfs/dbraw/zinc/42/28/07/513422807.db2.gz PTLGMSZREJLTMN-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)c2C[C@@H]1C ZINC000450994360 513446517 /nfs/dbraw/zinc/44/65/17/513446517.db2.gz CHHGGETVZDHPRK-OLZOCXBDSA-N 1 1 354.410 2.751 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CCn2cc[nH+]c2C1 ZINC000447810702 513576835 /nfs/dbraw/zinc/57/68/35/513576835.db2.gz AIFICMIYOLTYHD-VIFPVBQESA-N 1 1 350.762 2.658 20 5 FFBDMO C[C@@]12C[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451360678 513700524 /nfs/dbraw/zinc/70/05/24/513700524.db2.gz FQIBKBPCPQMUSI-MJEZEWASSA-N 1 1 353.422 2.628 20 5 FFBDMO C[C@@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368284 513704714 /nfs/dbraw/zinc/70/47/14/513704714.db2.gz LIZGWTCLPXRESY-NONVJHHQSA-N 1 1 362.451 2.513 20 5 FFBDMO C[C@@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451368284 513704716 /nfs/dbraw/zinc/70/47/16/513704716.db2.gz LIZGWTCLPXRESY-NONVJHHQSA-N 1 1 362.451 2.513 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)[C@@H](C)C[N@H+]1CCO ZINC000419007336 513714911 /nfs/dbraw/zinc/71/49/11/513714911.db2.gz RKRAMHWRQYQKQS-KGLIPLIRSA-N 1 1 351.447 2.663 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)cc(F)cc1[N+](=O)[O-] ZINC000436230359 513803068 /nfs/dbraw/zinc/80/30/68/513803068.db2.gz HUQXDYGJVBXZHR-CQSZACIVSA-N 1 1 364.421 2.843 20 5 FFBDMO COc1ccc(-c2ccc(CN3C[C@@H]4C[N@H+](C)C[C@@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000425995750 513820451 /nfs/dbraw/zinc/82/04/51/513820451.db2.gz MQTWDRJRBOQEJE-OKILXGFUSA-N 1 1 357.410 2.857 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)[C@@H]1CCCC[C@H]1O ZINC000426234775 513879691 /nfs/dbraw/zinc/87/96/91/513879691.db2.gz AKUNVYOSZDNFAE-COLVAYQJSA-N 1 1 355.822 2.811 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2ccc(O)c(OC)c2)c([N+](=O)[O-])c1 ZINC000426358921 513913547 /nfs/dbraw/zinc/91/35/47/513913547.db2.gz BMOSEFPOFWUQIZ-UHFFFAOYSA-N 1 1 362.382 2.828 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)n2)cc1 ZINC000451693430 513915636 /nfs/dbraw/zinc/91/56/36/513915636.db2.gz IDGSTGGVZILEOE-YCPHGPKFSA-N 1 1 358.398 2.628 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)n2)c1 ZINC000451707783 513926660 /nfs/dbraw/zinc/92/66/60/513926660.db2.gz NBZMPBUJMVLERT-XNRPHZJLSA-N 1 1 358.398 2.628 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CCCC[N@H+]1C1CCCC1 ZINC000431625639 513949308 /nfs/dbraw/zinc/94/93/08/513949308.db2.gz ZKMWXWDUYBLNOB-GOSISDBHSA-N 1 1 360.458 2.920 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)[C@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC000451782767 513976775 /nfs/dbraw/zinc/97/67/75/513976775.db2.gz RLYNKJZXHIDZSF-ZDUSSCGKSA-N 1 1 367.446 2.661 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccnc2c1cccc2[N+](=O)[O-] ZINC000432152079 514109824 /nfs/dbraw/zinc/10/98/24/514109824.db2.gz IDVCGSGSBXUZFB-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]1[NH2+]CCc2ccccc21 ZINC000423431316 514140525 /nfs/dbraw/zinc/14/05/25/514140525.db2.gz QJRMJGWVOOYDCS-KUHUBIRLSA-N 1 1 368.437 2.789 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+][C@H](C)C(=O)NC(C)C)o2)c([N+](=O)[O-])c1 ZINC000414542907 514170838 /nfs/dbraw/zinc/17/08/38/514170838.db2.gz LZGBKQMHQHENCZ-GFCCVEGCSA-N 1 1 361.398 2.866 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)CCC(F)(F)F ZINC000427279046 514171329 /nfs/dbraw/zinc/17/13/29/514171329.db2.gz BNEGSMPIGOVNEH-UHFFFAOYSA-N 1 1 363.336 2.608 20 5 FFBDMO CC(C)(CN1CCCC1)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000452093099 514187281 /nfs/dbraw/zinc/18/72/81/514187281.db2.gz GHSGKEKTFVABQW-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO CC(C)(CN1CCCC1)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000452100023 514192342 /nfs/dbraw/zinc/19/23/42/514192342.db2.gz YHBOBPMRFQKPGD-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449558873 514254507 /nfs/dbraw/zinc/25/45/07/514254507.db2.gz XEJBXNAGRUUYSY-JTDSTZFVSA-N 1 1 370.453 2.978 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449681881 514301623 /nfs/dbraw/zinc/30/16/23/514301623.db2.gz FJSWTTORWMNKFQ-LJQANCHMSA-N 1 1 356.426 2.998 20 5 FFBDMO CC[NH+](CC)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000427908582 514343260 /nfs/dbraw/zinc/34/32/60/514343260.db2.gz NPFCRMKKYRBFFB-GOSISDBHSA-N 1 1 371.437 2.983 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000427910114 514344800 /nfs/dbraw/zinc/34/48/00/514344800.db2.gz WVUXZQSHUCQPMZ-HZPDHXFCSA-N 1 1 354.410 2.517 20 5 FFBDMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]1[NH2+]CCc2ccccc21 ZINC000414941912 514366231 /nfs/dbraw/zinc/36/62/31/514366231.db2.gz BGYNRQHGHMRWPQ-AUUYWEPGSA-N 1 1 368.437 2.789 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000433069155 514369477 /nfs/dbraw/zinc/36/94/77/514369477.db2.gz BZGKXUTZYOSOBJ-AWEZNQCLSA-N 1 1 350.419 2.526 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004364 514433169 /nfs/dbraw/zinc/43/31/69/514433169.db2.gz FSONQMKBAIZYGX-PWSUYJOCSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](O)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004364 514433171 /nfs/dbraw/zinc/43/31/71/514433171.db2.gz FSONQMKBAIZYGX-PWSUYJOCSA-N 1 1 360.357 2.593 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccc3ccccc3c2)C2CC2)c1 ZINC000438829087 514450050 /nfs/dbraw/zinc/45/00/50/514450050.db2.gz IYRUCDATLQAQLF-HXUWFJFHSA-N 1 1 366.421 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+](CCO)[C@H]3CCCSC3)co2)cc1 ZINC000439001867 514481030 /nfs/dbraw/zinc/48/10/30/514481030.db2.gz FEAJMWWIOFNJJU-INIZCTEOSA-N 1 1 363.439 2.940 20 5 FFBDMO C[C@H](C(=O)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)[NH+]1CCSCC1 ZINC000452836897 514511283 /nfs/dbraw/zinc/51/12/83/514511283.db2.gz DKBUJRMIWZDHBF-ZBFHGGJFSA-N 1 1 363.483 2.738 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000470615177 514550229 /nfs/dbraw/zinc/55/02/29/514550229.db2.gz USRMEGASIZINGR-QLFBSQMISA-N 1 1 369.487 2.548 20 5 FFBDMO C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000461255698 514552700 /nfs/dbraw/zinc/55/27/00/514552700.db2.gz DQHDKHNHFCDGME-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000461255698 514552707 /nfs/dbraw/zinc/55/27/07/514552707.db2.gz DQHDKHNHFCDGME-OAHLLOKOSA-N 1 1 353.422 2.700 20 5 FFBDMO C[NH+](C)[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000461398202 514593623 /nfs/dbraw/zinc/59/36/23/514593623.db2.gz FKCNPSHFZNZRHR-SFHVURJKSA-N 1 1 355.394 2.619 20 5 FFBDMO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488823813 514597796 /nfs/dbraw/zinc/59/77/96/514597796.db2.gz FFCSXSWGKSKMNJ-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(c2ccccc2F)C1=O ZINC000488823813 514597806 /nfs/dbraw/zinc/59/78/06/514597806.db2.gz FFCSXSWGKSKMNJ-SFHVURJKSA-N 1 1 373.384 2.850 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CCCC1)N1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000461409862 514601566 /nfs/dbraw/zinc/60/15/66/514601566.db2.gz YISYRIZLBYXWSH-QGZVFWFLSA-N 1 1 359.426 2.723 20 5 FFBDMO Cc1cc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)ccc1OCC[NH+](C)C ZINC000458193021 514616485 /nfs/dbraw/zinc/61/64/85/514616485.db2.gz IPXFECLZKCEPOK-UHFFFAOYSA-N 1 1 359.382 2.802 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NCCNc2cccc(C)[nH+]2)cc1OC ZINC000461586401 514657136 /nfs/dbraw/zinc/65/71/36/514657136.db2.gz KNJJUHUIAJGBGB-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)C2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000475567225 514716904 /nfs/dbraw/zinc/71/69/04/514716904.db2.gz CPVWCWPOUYQIRQ-UHFFFAOYSA-N 1 1 370.405 2.746 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000475719512 514776557 /nfs/dbraw/zinc/77/65/57/514776557.db2.gz UPRODPOIZFZIGR-KRWDZBQOSA-N 1 1 370.405 2.964 20 5 FFBDMO COCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCO[C@H]1C ZINC000489481870 514862824 /nfs/dbraw/zinc/86/28/24/514862824.db2.gz NSCXLJHHLAMEBF-SUMWQHHRSA-N 1 1 361.398 2.876 20 5 FFBDMO COCC[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCO[C@H]1C ZINC000489481870 514862833 /nfs/dbraw/zinc/86/28/33/514862833.db2.gz NSCXLJHHLAMEBF-SUMWQHHRSA-N 1 1 361.398 2.876 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])nn2C)cc1 ZINC000476071772 514907054 /nfs/dbraw/zinc/90/70/54/514907054.db2.gz IOFYNRVCFHMNOK-CQSZACIVSA-N 1 1 371.441 2.633 20 5 FFBDMO CNc1nc(C(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000456031611 514913787 /nfs/dbraw/zinc/91/37/87/514913787.db2.gz IJUOFMZJECJZQT-CQSZACIVSA-N 1 1 361.446 2.558 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000485203980 514955780 /nfs/dbraw/zinc/95/57/80/514955780.db2.gz ICODQMLWMXMGEJ-CQSZACIVSA-N 1 1 369.421 2.753 20 5 FFBDMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)CCCC[NH+]1CCOCC1 ZINC000456173382 514999070 /nfs/dbraw/zinc/99/90/70/514999070.db2.gz GAJCZYUGBBCAHV-UHFFFAOYSA-N 1 1 364.446 2.856 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[NH+](Cc4cccc(O)c4)CC3)c21 ZINC000509062967 515006986 /nfs/dbraw/zinc/00/69/86/515006986.db2.gz ANIKAFIQASIDCW-UHFFFAOYSA-N 1 1 365.393 2.566 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc([N+](=O)[O-])c1C ZINC000480581397 515007681 /nfs/dbraw/zinc/00/76/81/515007681.db2.gz BPVSHUCPLSRDOM-IAGOWNOFSA-N 1 1 369.421 2.739 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485411683 515029112 /nfs/dbraw/zinc/02/91/12/515029112.db2.gz IQCOMYGVSHPYKQ-MRXNPFEDSA-N 1 1 374.416 2.741 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462441383 515053750 /nfs/dbraw/zinc/05/37/50/515053750.db2.gz NOOORFQYKFPPEL-MRXNPFEDSA-N 1 1 356.426 2.887 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1C ZINC000480926159 515138655 /nfs/dbraw/zinc/13/86/55/515138655.db2.gz KNHXXMMNIVDQFS-KGLIPLIRSA-N 1 1 369.487 2.753 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000509360987 515140563 /nfs/dbraw/zinc/14/05/63/515140563.db2.gz YMPQYCAQVHXLQU-UHFFFAOYSA-N 1 1 370.434 2.573 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Cn3cc([N+](=O)[O-])nc3C)cc2)c1C ZINC000462767555 515229977 /nfs/dbraw/zinc/22/99/77/515229977.db2.gz WUNRQUJDQRYSNE-UHFFFAOYSA-N 1 1 354.370 2.541 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000490649819 515272444 /nfs/dbraw/zinc/27/24/44/515272444.db2.gz JEXAHKJTFDUJKO-UHFFFAOYSA-N 1 1 365.430 2.895 20 5 FFBDMO COC(=O)CCCN1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000462895856 515287683 /nfs/dbraw/zinc/28/76/83/515287683.db2.gz NLOAEVQZKWZDFI-UHFFFAOYSA-N 1 1 369.849 2.755 20 5 FFBDMO CNc1c(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)cccc1[N+](=O)[O-] ZINC000462901917 515290306 /nfs/dbraw/zinc/29/03/06/515290306.db2.gz GRTOHAHYUUXDBO-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000481388075 515311822 /nfs/dbraw/zinc/31/18/22/515311822.db2.gz CNZRFEKFJSZRIW-HUUCEWRRSA-N 1 1 369.487 2.705 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000468468297 515372386 /nfs/dbraw/zinc/37/23/86/515372386.db2.gz QAINQNCICTYZPL-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000499658236 515400954 /nfs/dbraw/zinc/40/09/54/515400954.db2.gz LNSWZOGIJCSXPH-MRXNPFEDSA-N 1 1 358.442 2.930 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])[nH+]c1 ZINC000477351460 515422413 /nfs/dbraw/zinc/42/24/13/515422413.db2.gz ONLAWTHYCJVUOW-UHFFFAOYSA-N 1 1 362.817 2.914 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C(C)C)N1CCN(C)CC1 ZINC000468654879 515455741 /nfs/dbraw/zinc/45/57/41/515455741.db2.gz CZBMEOGXZMIRKS-MJLBXUHQSA-N 1 1 360.502 2.860 20 5 FFBDMO CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000468672724 515462828 /nfs/dbraw/zinc/46/28/28/515462828.db2.gz BTTUPUJJLKTHHM-CYBMUJFWSA-N 1 1 360.439 2.827 20 5 FFBDMO O=C([C@@H]1CCCc2[nH+]ccn21)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000486490727 515506608 /nfs/dbraw/zinc/50/66/08/515506608.db2.gz UJIOLSXJVPIWCM-YOEHRIQHSA-N 1 1 358.423 2.943 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456998684 515574135 /nfs/dbraw/zinc/57/41/35/515574135.db2.gz SGQYNPNZANRUHH-KRWDZBQOSA-N 1 1 357.435 2.860 20 5 FFBDMO COc1cc(CN2C[C@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505627285 515613830 /nfs/dbraw/zinc/61/38/30/515613830.db2.gz BXKANRXTAPVJIS-NWDGAFQWSA-N 1 1 373.400 2.772 20 5 FFBDMO CC[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1N1CCOCC1 ZINC000493365546 515625314 /nfs/dbraw/zinc/62/53/14/515625314.db2.gz QUNSEXUJHGFBHA-CXAGYDPISA-N 1 1 353.850 2.791 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493443509 515634016 /nfs/dbraw/zinc/63/40/16/515634016.db2.gz SONUSNUPBNTFTP-CHWSQXEVSA-N 1 1 369.849 2.611 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2cc(S(C)(=O)=O)ccc2F)cc1[N+](=O)[O-] ZINC000500419676 515701813 /nfs/dbraw/zinc/70/18/13/515701813.db2.gz HJEWFTTZOQGUHI-UHFFFAOYSA-N 1 1 352.387 2.736 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000493998981 515708108 /nfs/dbraw/zinc/70/81/08/515708108.db2.gz GWLRKXLMLPSGNS-SCLBCKFNSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000493998981 515708118 /nfs/dbraw/zinc/70/81/18/515708118.db2.gz GWLRKXLMLPSGNS-SCLBCKFNSA-N 1 1 355.394 2.693 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCCCC[N@@H+](C)C2CC2)cc1SC ZINC000457193164 515715204 /nfs/dbraw/zinc/71/52/04/515715204.db2.gz CMMHAXTUFWUWTI-UHFFFAOYSA-N 1 1 367.471 2.930 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCC[N@H+]1C ZINC000454785931 515743268 /nfs/dbraw/zinc/74/32/68/515743268.db2.gz NDKQJPWBFVVXRU-UWWQBHOKSA-N 1 1 360.458 2.967 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)[NH+]1CCOCC1 ZINC000511032023 515751516 /nfs/dbraw/zinc/75/15/16/515751516.db2.gz RMUUCJJOZJWZHN-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@H]1C ZINC000478555441 515868554 /nfs/dbraw/zinc/86/85/54/515868554.db2.gz GBNRWGPDGBDBFG-HUUCEWRRSA-N 1 1 371.441 2.773 20 5 FFBDMO C[NH+](C)CCN(CCCc1ccccc1)C(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506504429 515901194 /nfs/dbraw/zinc/90/11/94/515901194.db2.gz VZZHVQSTKVJKON-UHFFFAOYSA-N 1 1 371.437 2.937 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000469741240 515948061 /nfs/dbraw/zinc/94/80/61/515948061.db2.gz GAMFGJHQTPRDTC-KRWDZBQOSA-N 1 1 370.409 2.780 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000464819723 515973458 /nfs/dbraw/zinc/97/34/58/515973458.db2.gz BXKBGIFLSRBZND-VQIMIIECSA-N 1 1 361.442 2.619 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000495084348 516059919 /nfs/dbraw/zinc/05/99/19/516059919.db2.gz MEZHHKNKRLEEGX-CYBMUJFWSA-N 1 1 366.414 2.646 20 5 FFBDMO CNC(=O)C[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000483424165 516083741 /nfs/dbraw/zinc/08/37/41/516083741.db2.gz CGYDYRXDVZGYJJ-HNNXBMFYSA-N 1 1 361.373 2.710 20 5 FFBDMO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000470131169 516134710 /nfs/dbraw/zinc/13/47/10/516134710.db2.gz FSCHRMJYMOIHEC-SKDZVZGDSA-N 1 1 355.394 2.941 20 5 FFBDMO C[C@@H](CO)[N@H+]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135464 516136465 /nfs/dbraw/zinc/13/64/65/516136465.db2.gz UILLMSXRXZVFSG-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135464 516136476 /nfs/dbraw/zinc/13/64/76/516136476.db2.gz UILLMSXRXZVFSG-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](CO)N1CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000470135464 516136484 /nfs/dbraw/zinc/13/64/84/516136484.db2.gz UILLMSXRXZVFSG-HNNXBMFYSA-N 1 1 359.426 2.743 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000512118137 516159628 /nfs/dbraw/zinc/15/96/28/516159628.db2.gz GNSNPHMBQWVICG-VXGBXAGGSA-N 1 1 367.833 2.782 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000470237254 516181108 /nfs/dbraw/zinc/18/11/08/516181108.db2.gz MBGSEIXGSWTCRP-INIZCTEOSA-N 1 1 361.442 2.554 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000488271828 516182312 /nfs/dbraw/zinc/18/23/12/516182312.db2.gz JMNYVXJYLUBXAQ-CYBMUJFWSA-N 1 1 368.865 2.822 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCc2ccccc2C1 ZINC000501817998 516235256 /nfs/dbraw/zinc/23/52/56/516235256.db2.gz ULDOJFCCZOARNX-GOSISDBHSA-N 1 1 370.453 2.746 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[N@H+]([C@H]3C[C@@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000488716167 516292507 /nfs/dbraw/zinc/29/25/07/516292507.db2.gz QYQXYXXDHYYAHS-VKJFTORMSA-N 1 1 374.485 2.900 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000488715896 516293120 /nfs/dbraw/zinc/29/31/20/516293120.db2.gz BRBPHCLHAMHVMF-WOSRLPQWSA-N 1 1 357.414 2.811 20 5 FFBDMO COc1ccc(CNC(=O)NCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000523204239 516407748 /nfs/dbraw/zinc/40/77/48/516407748.db2.gz CYEWJHYQRPCODT-UHFFFAOYSA-N 1 1 372.425 2.535 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531340096 516415512 /nfs/dbraw/zinc/41/55/12/516415512.db2.gz YKFRFJUBDVQKPX-HNNXBMFYSA-N 1 1 361.442 2.625 20 5 FFBDMO COc1cc(C[N@@H+](Cc2ccccc2)C[C@@H](C)O)c([N+](=O)[O-])cc1OC ZINC000535804937 516517183 /nfs/dbraw/zinc/51/71/83/516517183.db2.gz HFZCTELWNGCBNA-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@H+](Cc2ccccc2)C[C@@H](C)O)c([N+](=O)[O-])cc1OC ZINC000535804937 516517195 /nfs/dbraw/zinc/51/71/95/516517195.db2.gz HFZCTELWNGCBNA-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO COCCSc1ccc([C@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000540406051 516540342 /nfs/dbraw/zinc/54/03/42/516540342.db2.gz RLHIQHPOPCSXIK-LBPRGKRZSA-N 1 1 350.444 2.918 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000544144006 516611900 /nfs/dbraw/zinc/61/19/00/516611900.db2.gz MEFUQULTKIVYCV-XLIONFOSSA-N 1 1 356.422 2.998 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2nccn2C)C1 ZINC000536068650 516617364 /nfs/dbraw/zinc/61/73/64/516617364.db2.gz JUBXDXLFSWZBIR-TZMCWYRMSA-N 1 1 368.397 2.929 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240940 516656689 /nfs/dbraw/zinc/65/66/89/516656689.db2.gz TXNUUGRFVJVYRV-WDEREUQCSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000544240940 516656696 /nfs/dbraw/zinc/65/66/96/516656696.db2.gz TXNUUGRFVJVYRV-WDEREUQCSA-N 1 1 357.863 2.891 20 5 FFBDMO COc1ccccc1N1CC[C@H]([N@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O ZINC000554835221 516657486 /nfs/dbraw/zinc/65/74/86/516657486.db2.gz QFEPGNZBCSHIHG-SFHVURJKSA-N 1 1 369.421 2.883 20 5 FFBDMO COc1ccccc1N1CC[C@H]([N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O ZINC000554835221 516657497 /nfs/dbraw/zinc/65/74/97/516657497.db2.gz QFEPGNZBCSHIHG-SFHVURJKSA-N 1 1 369.421 2.883 20 5 FFBDMO C[C@H](C(=O)NCc1ccccc1F)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554843853 516660761 /nfs/dbraw/zinc/66/07/61/516660761.db2.gz OLXKJJQDPCFOPB-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO COc1ccccc1CNC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554846439 516662442 /nfs/dbraw/zinc/66/24/42/516662442.db2.gz WTNCTJGRCWNUJQ-HNNXBMFYSA-N 1 1 371.437 2.783 20 5 FFBDMO COC[C@@H](C)[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000554934340 516705366 /nfs/dbraw/zinc/70/53/66/516705366.db2.gz IYWOOXYGUISWJN-SECBINFHSA-N 1 1 364.183 2.666 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@@H](C)C1 ZINC000561760646 516754735 /nfs/dbraw/zinc/75/47/35/516754735.db2.gz IGDWIAYLRLJGFQ-AHIWAGSCSA-N 1 1 356.426 2.878 20 5 FFBDMO CCCc1n[nH]c(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637200 516775821 /nfs/dbraw/zinc/77/58/21/516775821.db2.gz QDOODUOOWSHPIF-HZSPNIEDSA-N 1 1 363.462 2.748 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637200 516775825 /nfs/dbraw/zinc/77/58/25/516775825.db2.gz QDOODUOOWSHPIF-HZSPNIEDSA-N 1 1 363.462 2.748 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000524637200 516775829 /nfs/dbraw/zinc/77/58/29/516775829.db2.gz QDOODUOOWSHPIF-HZSPNIEDSA-N 1 1 363.462 2.748 20 5 FFBDMO C[C@H]1CCC[C@@](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000518810953 516784369 /nfs/dbraw/zinc/78/43/69/516784369.db2.gz IRZJEPYJEUGTHS-KPZWWZAWSA-N 1 1 359.430 2.711 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000524696776 516792406 /nfs/dbraw/zinc/79/24/06/516792406.db2.gz DUGSWXJWRWEJHU-UHFFFAOYSA-N 1 1 372.425 2.795 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598236 516844090 /nfs/dbraw/zinc/84/40/90/516844090.db2.gz RMNASKZUCCNPSB-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536598236 516844101 /nfs/dbraw/zinc/84/41/01/516844101.db2.gz RMNASKZUCCNPSB-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@H](C(=O)NCCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000519062490 516872047 /nfs/dbraw/zinc/87/20/47/516872047.db2.gz YXEGNPXYDUZUNO-XHSDSOJGSA-N 1 1 363.458 2.704 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCN(c3cc[nH+]c(N4CCCCC4)n3)CC2)c1 ZINC000544685211 516874201 /nfs/dbraw/zinc/87/42/01/516874201.db2.gz VEWMIHQQVXXNBE-UHFFFAOYSA-N 1 1 368.441 2.702 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[N@@H+](C)[C@H](C(C)C)C1 ZINC000558859541 516974343 /nfs/dbraw/zinc/97/43/43/516974343.db2.gz DXAXLVDPFUBCAI-INIZCTEOSA-N 1 1 358.446 2.650 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)C1CC1 ZINC000548501867 517021110 /nfs/dbraw/zinc/02/11/10/517021110.db2.gz LGPSSVOXRRNATK-SFHVURJKSA-N 1 1 354.410 2.630 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N(C)CCC[N@@H+](C)Cc1ccncc1 ZINC000552112660 517087122 /nfs/dbraw/zinc/08/71/22/517087122.db2.gz OMZFDVXNDHZSRT-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO CCC[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000537221245 517094922 /nfs/dbraw/zinc/09/49/22/517094922.db2.gz RPKQIZSDSNBUKC-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO CCc1cc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c2ccccc2[nH+]1 ZINC000562577916 517206274 /nfs/dbraw/zinc/20/62/74/517206274.db2.gz SXJPBIWHQSCFIP-UHFFFAOYSA-N 1 1 357.391 2.928 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000537628038 517267743 /nfs/dbraw/zinc/26/77/43/517267743.db2.gz BMKMEXAESSCIGY-OAHLLOKOSA-N 1 1 361.442 2.828 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000533045269 517268201 /nfs/dbraw/zinc/26/82/01/517268201.db2.gz VATUFGODFSETGS-APWZRJJASA-N 1 1 366.421 2.887 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](Nc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000533045269 517268204 /nfs/dbraw/zinc/26/82/04/517268204.db2.gz VATUFGODFSETGS-APWZRJJASA-N 1 1 366.421 2.887 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)n1 ZINC000541935059 517299455 /nfs/dbraw/zinc/29/94/55/517299455.db2.gz BPAXRBXKUCJQLU-SJORKVTESA-N 1 1 356.426 2.654 20 5 FFBDMO CC[N@H+](Cc1ccc2c(c1)OCO2)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000520452926 517399951 /nfs/dbraw/zinc/39/99/51/517399951.db2.gz LPKZQRLVHNPPDT-HNNXBMFYSA-N 1 1 374.393 2.585 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000533447572 517468445 /nfs/dbraw/zinc/46/84/45/517468445.db2.gz JQMWOFNZELFBSN-OCCSQVGLSA-N 1 1 368.865 2.991 20 5 FFBDMO COCCO[C@H]1CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000549411218 517551170 /nfs/dbraw/zinc/55/11/70/517551170.db2.gz ZJGZMEILGREZDS-SFHVURJKSA-N 1 1 374.441 2.623 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000521036524 517586574 /nfs/dbraw/zinc/58/65/74/517586574.db2.gz MENACUXILHPFNY-CYBMUJFWSA-N 1 1 351.451 2.655 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000560275423 517672668 /nfs/dbraw/zinc/67/26/68/517672668.db2.gz VBBOPQKRCZQAKQ-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O[C@@H]2CCOC2)CC1 ZINC000556902261 517738049 /nfs/dbraw/zinc/73/80/49/517738049.db2.gz RFAKSWHNPQOABV-QGZVFWFLSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000534530798 517929282 /nfs/dbraw/zinc/92/92/82/517929282.db2.gz OAJFHFVDGZJHII-HNNXBMFYSA-N 1 1 356.382 2.765 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000534530798 517929293 /nfs/dbraw/zinc/92/92/93/517929293.db2.gz OAJFHFVDGZJHII-HNNXBMFYSA-N 1 1 356.382 2.765 20 5 FFBDMO Cc1[nH+]ccn1CCCCn1cc([N+](=O)[O-])c(C)c(Br)c1=O ZINC000543147838 517933282 /nfs/dbraw/zinc/93/32/82/517933282.db2.gz XUWOZXUDCABONC-UHFFFAOYSA-N 1 1 369.219 2.813 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000539292507 517981136 /nfs/dbraw/zinc/98/11/36/517981136.db2.gz KYGWRAYVRWKIGE-HNNXBMFYSA-N 1 1 369.425 2.891 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCN([C@H]3CC[N@@H+](Cc4ccccc4)C3)C2)nc1 ZINC000560729797 517991526 /nfs/dbraw/zinc/99/15/26/517991526.db2.gz OTBMXCOGLQDGPD-HKUYNNGSSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]([C@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729797 517991535 /nfs/dbraw/zinc/99/15/35/517991535.db2.gz OTBMXCOGLQDGPD-HKUYNNGSSA-N 1 1 367.453 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@H]3CCN(Cc4ccccc4)C3)C2)nc1 ZINC000560729797 517991541 /nfs/dbraw/zinc/99/15/41/517991541.db2.gz OTBMXCOGLQDGPD-HKUYNNGSSA-N 1 1 367.453 2.751 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000517054488 518002972 /nfs/dbraw/zinc/00/29/72/518002972.db2.gz KHKIXUVRKOKJNF-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])Cc2ccccc2O1 ZINC000517054488 518002983 /nfs/dbraw/zinc/00/29/83/518002983.db2.gz KHKIXUVRKOKJNF-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO CCN(CC[NH+]1CCCCCC1)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-] ZINC000517160804 518045905 /nfs/dbraw/zinc/04/59/05/518045905.db2.gz KJZMIEUEJOZHFG-UHFFFAOYSA-N 1 1 351.451 2.779 20 5 FFBDMO CC1(C)COCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534880854 518068700 /nfs/dbraw/zinc/06/87/00/518068700.db2.gz PRSWVFAQHDEYOY-UHFFFAOYSA-N 1 1 356.426 2.601 20 5 FFBDMO CC1(C)COCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000534880854 518068709 /nfs/dbraw/zinc/06/87/09/518068709.db2.gz PRSWVFAQHDEYOY-UHFFFAOYSA-N 1 1 356.426 2.601 20 5 FFBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000543459307 518102817 /nfs/dbraw/zinc/10/28/17/518102817.db2.gz YYRPNWDDWNOATJ-QMMMGPOBSA-N 1 1 360.340 2.555 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCCC[C@H]1C ZINC000535371126 518177031 /nfs/dbraw/zinc/17/70/31/518177031.db2.gz FEGMICBIGZKLSS-KGLIPLIRSA-N 1 1 358.442 2.998 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000578569177 518269385 /nfs/dbraw/zinc/26/93/85/518269385.db2.gz MJMZNQQUDIBHSM-DZGCQCFKSA-N 1 1 373.457 2.743 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000566967037 518288903 /nfs/dbraw/zinc/28/89/03/518288903.db2.gz MJBPIJRDXNYIAF-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000566967037 518288907 /nfs/dbraw/zinc/28/89/07/518288907.db2.gz MJBPIJRDXNYIAF-DZGCQCFKSA-N 1 1 370.409 2.815 20 5 FFBDMO CC(C)Oc1cc(C(=O)NCc2c[nH+]c3n2CCCC3)ccc1[N+](=O)[O-] ZINC000584456261 518351410 /nfs/dbraw/zinc/35/14/10/518351410.db2.gz CYOCGTHRBWEQLR-UHFFFAOYSA-N 1 1 358.398 2.845 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000578839241 518395633 /nfs/dbraw/zinc/39/56/33/518395633.db2.gz ZNHOXMMAKWLBRT-GFCCVEGCSA-N 1 1 371.235 2.915 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000576082151 518418857 /nfs/dbraw/zinc/41/88/57/518418857.db2.gz CQBICGSREIFXAW-HNNXBMFYSA-N 1 1 356.426 2.527 20 5 FFBDMO CC(C)(C)[C@@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000584850578 518508126 /nfs/dbraw/zinc/50/81/26/518508126.db2.gz HOXRPZIKJVGBEN-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)[C@@]2(CO)CCOC2)cc1 ZINC000585718545 518574102 /nfs/dbraw/zinc/57/41/02/518574102.db2.gz KUTUSPJIHIWYPO-HXUWFJFHSA-N 1 1 356.422 2.791 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000582081314 518579209 /nfs/dbraw/zinc/57/92/09/518579209.db2.gz APAATHDRIUYROC-KRWDZBQOSA-N 1 1 371.441 2.727 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]21 ZINC000585767619 518591332 /nfs/dbraw/zinc/59/13/32/518591332.db2.gz RBFJXEREKWLYBA-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC(=O)CC12CCC2 ZINC000582189733 518631762 /nfs/dbraw/zinc/63/17/62/518631762.db2.gz ZNVNLYDROYYRRS-UHFFFAOYSA-N 1 1 361.398 2.520 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC(=O)CC12CCC2 ZINC000582189733 518631769 /nfs/dbraw/zinc/63/17/69/518631769.db2.gz ZNVNLYDROYYRRS-UHFFFAOYSA-N 1 1 361.398 2.520 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000582202868 518635199 /nfs/dbraw/zinc/63/51/99/518635199.db2.gz FWKZBPLNYPXLHM-INIZCTEOSA-N 1 1 373.457 2.792 20 5 FFBDMO C[C@@]1(NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000568011308 518830520 /nfs/dbraw/zinc/83/05/20/518830520.db2.gz JCOQRJPOQFOKEA-HXUWFJFHSA-N 1 1 369.421 2.754 20 5 FFBDMO C[C@@H](O)C[C@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000573889416 518883324 /nfs/dbraw/zinc/88/33/24/518883324.db2.gz NKFMSPYWPOVYMF-ZIAGYGMSSA-N 1 1 363.414 2.518 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CCCO)c2ccccc2)c1 ZINC000589506598 519019334 /nfs/dbraw/zinc/01/93/34/519019334.db2.gz HDGOFTNRLMYTHH-QGZVFWFLSA-N 1 1 358.394 2.985 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000589634570 519049012 /nfs/dbraw/zinc/04/90/12/519049012.db2.gz HBZHWONMHYAJBG-GJZGRUSLSA-N 1 1 371.441 2.545 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000583057228 519053358 /nfs/dbraw/zinc/05/33/58/519053358.db2.gz LDXZDONIXGXTSP-ZJUUUORDSA-N 1 1 358.345 2.800 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000583141158 519097310 /nfs/dbraw/zinc/09/73/10/519097310.db2.gz ZMHBITYFKFGQEZ-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590140276 519160162 /nfs/dbraw/zinc/16/01/62/519160162.db2.gz ODLNOKVGPNXAAQ-GJZGRUSLSA-N 1 1 359.348 2.831 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC3(CCOCC3)[C@@H]1C1CC1)OCCO2 ZINC000590378487 519211170 /nfs/dbraw/zinc/21/11/70/519211170.db2.gz LNGDHJRXESOTAW-SFHVURJKSA-N 1 1 360.410 2.757 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000590523114 519254540 /nfs/dbraw/zinc/25/45/40/519254540.db2.gz SLRMDIZUJGKFLJ-LBPRGKRZSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)c(C)c([N+](=O)[O-])c1 ZINC000590523114 519254546 /nfs/dbraw/zinc/25/45/46/519254546.db2.gz SLRMDIZUJGKFLJ-LBPRGKRZSA-N 1 1 370.247 2.832 20 5 FFBDMO COC(=O)Cc1ccc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000590695615 519320608 /nfs/dbraw/zinc/32/06/08/519320608.db2.gz ZIVRZATWJWBWNN-QGZVFWFLSA-N 1 1 355.394 2.909 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000580806920 519366831 /nfs/dbraw/zinc/36/68/31/519366831.db2.gz JLMGXLWGBMBBIT-HNNXBMFYSA-N 1 1 350.463 2.899 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000578234703 519489394 /nfs/dbraw/zinc/48/93/94/519489394.db2.gz OCGIEHRYWMLFDF-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000569350986 519505202 /nfs/dbraw/zinc/50/52/02/519505202.db2.gz GNAISZDUMFHEGD-AWEZNQCLSA-N 1 1 372.429 2.763 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000578378712 519562642 /nfs/dbraw/zinc/56/26/42/519562642.db2.gz NATDIKHUYVSEBY-AWEZNQCLSA-N 1 1 366.437 2.857 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CN(c2ccccc2)CCO1 ZINC000584061112 519571629 /nfs/dbraw/zinc/57/16/29/519571629.db2.gz AXZVEDLVPAYKKR-IBGZPJMESA-N 1 1 355.438 2.975 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000594420536 519956688 /nfs/dbraw/zinc/95/66/88/519956688.db2.gz WGCQUQRGERUJIA-HOTGVXAUSA-N 1 1 361.442 2.805 20 5 FFBDMO Cc1c(Br)c(N[C@H]2CC[N@@H+](CC3CC3)C2)ncc1[N+](=O)[O-] ZINC000612444228 519963009 /nfs/dbraw/zinc/96/30/09/519963009.db2.gz KXMOQVQEKGRADQ-NSHDSACASA-N 1 1 355.236 2.957 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1C ZINC000616405554 520002774 /nfs/dbraw/zinc/00/27/74/520002774.db2.gz ZGZQAEQIQAQAGX-INIZCTEOSA-N 1 1 355.394 2.828 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1C ZINC000616405554 520002780 /nfs/dbraw/zinc/00/27/80/520002780.db2.gz ZGZQAEQIQAQAGX-INIZCTEOSA-N 1 1 355.394 2.828 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@@H+]3C[C@@H](O)C[C@@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588230 520037731 /nfs/dbraw/zinc/03/77/31/520037731.db2.gz VPBIBLVAIPSIOT-CVEARBPZSA-N 1 1 374.462 2.982 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@H+]3C[C@@H](O)C[C@@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588230 520037741 /nfs/dbraw/zinc/03/77/41/520037741.db2.gz VPBIBLVAIPSIOT-CVEARBPZSA-N 1 1 374.462 2.982 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000600179516 520104971 /nfs/dbraw/zinc/10/49/71/520104971.db2.gz YVOGOLNGECVGCY-HXUWFJFHSA-N 1 1 371.437 2.946 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597584053 520119836 /nfs/dbraw/zinc/11/98/36/520119836.db2.gz XDEXLKHBFNKQSG-LSDHHAIUSA-N 1 1 367.446 2.965 20 5 FFBDMO Cc1ccnc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c1 ZINC000616775524 520135193 /nfs/dbraw/zinc/13/51/93/520135193.db2.gz BJBNUCSGSHZGGN-UHFFFAOYSA-N 1 1 366.425 2.887 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000608854601 520145383 /nfs/dbraw/zinc/14/53/83/520145383.db2.gz PDLDIRASNZLGGU-LLVKDONJSA-N 1 1 352.410 2.556 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000600300487 520191254 /nfs/dbraw/zinc/19/12/54/520191254.db2.gz ZTDPQNNIYCLZNM-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000600300487 520191258 /nfs/dbraw/zinc/19/12/58/520191258.db2.gz ZTDPQNNIYCLZNM-INIZCTEOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F)C2 ZINC000597711897 520192156 /nfs/dbraw/zinc/19/21/56/520192156.db2.gz XAHRPXAMONRCED-IBGZPJMESA-N 1 1 363.433 2.956 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)C2 ZINC000597715574 520192987 /nfs/dbraw/zinc/19/29/87/520192987.db2.gz MUYOMLQNLVCPIS-LJQANCHMSA-N 1 1 358.442 2.727 20 5 FFBDMO Cn1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cc1=O ZINC000592131313 520206768 /nfs/dbraw/zinc/20/67/68/520206768.db2.gz XGFOFOWGVLEKQC-IYARVYRRSA-N 1 1 371.437 2.599 20 5 FFBDMO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CS1(=O)=O ZINC000594974463 520236088 /nfs/dbraw/zinc/23/60/88/520236088.db2.gz LUCANFQBCTYFKQ-CHWSQXEVSA-N 1 1 364.423 2.910 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](CCO)c1ccccc1F ZINC000592162351 520236298 /nfs/dbraw/zinc/23/62/98/520236298.db2.gz XRLMIEYITBNRPF-HNNXBMFYSA-N 1 1 361.373 2.694 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600470924 520279095 /nfs/dbraw/zinc/27/90/95/520279095.db2.gz JRBBCIKYCGJDFZ-SFHVURJKSA-N 1 1 360.458 2.920 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000600474034 520281945 /nfs/dbraw/zinc/28/19/45/520281945.db2.gz WLUCLYWCQKLLRI-AWEZNQCLSA-N 1 1 354.410 2.890 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000597854442 520283651 /nfs/dbraw/zinc/28/36/51/520283651.db2.gz HWHSYSGVYGTMFG-AWEZNQCLSA-N 1 1 358.442 2.786 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597859745 520286332 /nfs/dbraw/zinc/28/63/32/520286332.db2.gz GSKKZWASDOBYGT-GFCCVEGCSA-N 1 1 372.425 2.699 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000597861757 520288766 /nfs/dbraw/zinc/28/87/66/520288766.db2.gz WXLBVMSPIWIEJG-CQSZACIVSA-N 1 1 357.414 2.588 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613180183 520371133 /nfs/dbraw/zinc/37/11/33/520371133.db2.gz KISYEDGMSZXJII-MRXNPFEDSA-N 1 1 354.410 2.801 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613180183 520371139 /nfs/dbraw/zinc/37/11/39/520371139.db2.gz KISYEDGMSZXJII-MRXNPFEDSA-N 1 1 354.410 2.801 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000613178711 520371854 /nfs/dbraw/zinc/37/18/54/520371854.db2.gz WDYATMKAUVBNRW-INIZCTEOSA-N 1 1 357.410 2.942 20 5 FFBDMO CCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H]1CC[N@@H+](CC)C1 ZINC000598038255 520387517 /nfs/dbraw/zinc/38/75/17/520387517.db2.gz BOJCAYBNGNGQOW-LBPRGKRZSA-N 1 1 370.247 2.914 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705265 520411339 /nfs/dbraw/zinc/41/13/39/520411339.db2.gz NEGHAMSYECYZPG-JSGCOSHPSA-N 1 1 369.849 2.611 20 5 FFBDMO COc1ccc(CNC(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000604105510 520451848 /nfs/dbraw/zinc/45/18/48/520451848.db2.gz RHBDSDJCXQHXFK-AWEZNQCLSA-N 1 1 364.446 2.667 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604197929 520480894 /nfs/dbraw/zinc/48/08/94/520480894.db2.gz BTIWOZKUGOMFDK-GOEBONIOSA-N 1 1 360.458 2.655 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)c2)C[C@H](C)O1 ZINC000609992946 520497610 /nfs/dbraw/zinc/49/76/10/520497610.db2.gz HKQMYPVGQSJTLQ-BETUJISGSA-N 1 1 358.398 2.784 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)c2)C[C@H](C)O1 ZINC000609992946 520497613 /nfs/dbraw/zinc/49/76/13/520497613.db2.gz HKQMYPVGQSJTLQ-BETUJISGSA-N 1 1 358.398 2.784 20 5 FFBDMO O=C(C[N@H+](C1CC1)C1(CO)CCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000595533100 520531300 /nfs/dbraw/zinc/53/13/00/520531300.db2.gz FXYQDFDLLGGLSJ-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+](C1CC1)C1(CO)CCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000595533100 520531304 /nfs/dbraw/zinc/53/13/04/520531304.db2.gz FXYQDFDLLGGLSJ-UHFFFAOYSA-N 1 1 353.806 2.566 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543499 /nfs/dbraw/zinc/54/34/99/520543499.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CC[NH+]1CCC(N2CCCN(Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC000595545836 520543511 /nfs/dbraw/zinc/54/35/11/520543511.db2.gz KEWNYJAIVIMOSF-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO Cc1ccc(CNC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162186 520564269 /nfs/dbraw/zinc/56/42/69/520564269.db2.gz FWMAWSFKENIJMA-HXUWFJFHSA-N 1 1 355.438 2.630 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@]2(O)CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000610162186 520564275 /nfs/dbraw/zinc/56/42/75/520564275.db2.gz FWMAWSFKENIJMA-HXUWFJFHSA-N 1 1 355.438 2.630 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341916 520564521 /nfs/dbraw/zinc/56/45/21/520564521.db2.gz IFQMAXHRPLDISZ-LBPRGKRZSA-N 1 1 357.863 2.941 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598342195 520567121 /nfs/dbraw/zinc/56/71/21/520567121.db2.gz JYOGFPYXUUXYFF-ZDUSSCGKSA-N 1 1 355.822 2.618 20 5 FFBDMO CCc1[nH+]ccn1[C@H](C)CC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1 ZINC000592765554 520567668 /nfs/dbraw/zinc/56/76/68/520567668.db2.gz LIZYMWNHGDRVEX-LLVKDONJSA-N 1 1 360.370 2.730 20 5 FFBDMO COc1cc2c(cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000601149194 520660118 /nfs/dbraw/zinc/66/01/18/520660118.db2.gz KPCTZQIDDKSBLL-RBZFPXEDSA-N 1 1 372.421 2.924 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 ZINC000610392186 520663098 /nfs/dbraw/zinc/66/30/98/520663098.db2.gz ALPZMZZSBXXEMV-RDJZCZTQSA-N 1 1 369.425 2.513 20 5 FFBDMO Cn1c(=O)ccc2c1CCC[C@H]2Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000601186535 520678132 /nfs/dbraw/zinc/67/81/32/520678132.db2.gz OMOCJZBAPNUNHS-MRXNPFEDSA-N 1 1 350.378 2.753 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2cnn(C)c2)C(C)(C)C)c1 ZINC000593021818 520690382 /nfs/dbraw/zinc/69/03/82/520690382.db2.gz XDBXLUCPQWEHEH-MRXNPFEDSA-N 1 1 360.414 2.992 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@](O)(C2CC2)C1 ZINC000595752088 520700033 /nfs/dbraw/zinc/70/00/33/520700033.db2.gz SCEAAYIRRBNOKB-XIKOKIGWSA-N 1 1 358.398 2.943 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c1 ZINC000595786562 520723210 /nfs/dbraw/zinc/72/32/10/520723210.db2.gz BIVMLKJVFLPJEQ-WDYCEAGBSA-N 1 1 364.442 2.616 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595788974 520726070 /nfs/dbraw/zinc/72/60/70/520726070.db2.gz ORIQCFFAMLUADY-APWZRJJASA-N 1 1 373.453 2.765 20 5 FFBDMO Cc1cc(CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000593160124 520788559 /nfs/dbraw/zinc/78/85/59/520788559.db2.gz DPWKOGGKQRGESH-UHFFFAOYSA-N 1 1 372.400 2.896 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000593189115 520812642 /nfs/dbraw/zinc/81/26/42/520812642.db2.gz IKUCMWTYZNDHMR-GMTAPVOTSA-N 1 1 357.357 2.749 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1 ZINC000596039693 520872666 /nfs/dbraw/zinc/87/26/66/520872666.db2.gz RZXGQVCDWCCLEX-IEBWSBKVSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC3(CCC3)[C@H]2c2ccncc2)c1 ZINC000596039693 520872673 /nfs/dbraw/zinc/87/26/73/520872673.db2.gz RZXGQVCDWCCLEX-IEBWSBKVSA-N 1 1 369.421 2.957 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CCOC(C)(C)C ZINC000610859774 520876255 /nfs/dbraw/zinc/87/62/55/520876255.db2.gz MBULQVJOKVPDLZ-LBPRGKRZSA-N 1 1 353.419 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000610859774 520876262 /nfs/dbraw/zinc/87/62/62/520876262.db2.gz MBULQVJOKVPDLZ-LBPRGKRZSA-N 1 1 353.419 2.677 20 5 FFBDMO NC(=O)c1cc(NCCC[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000596073908 520895369 /nfs/dbraw/zinc/89/53/69/520895369.db2.gz FJPYUSWREIXYGV-UHFFFAOYSA-N 1 1 354.410 2.554 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923693 520906741 /nfs/dbraw/zinc/90/67/41/520906741.db2.gz WOYVWPQHZNKFCR-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923693 520906744 /nfs/dbraw/zinc/90/67/44/520906744.db2.gz WOYVWPQHZNKFCR-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000610923693 520906753 /nfs/dbraw/zinc/90/67/53/520906753.db2.gz WOYVWPQHZNKFCR-OAHLLOKOSA-N 1 1 371.441 2.788 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)C[C@H]1Cc1ccccc1 ZINC000593322012 520908225 /nfs/dbraw/zinc/90/82/25/520908225.db2.gz KTKFPWOBCHZBTA-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)C[C@H]1Cc1ccccc1 ZINC000593322012 520908232 /nfs/dbraw/zinc/90/82/32/520908232.db2.gz KTKFPWOBCHZBTA-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000598914386 520913635 /nfs/dbraw/zinc/91/36/35/520913635.db2.gz BYSMXULXGFQUFR-INIZCTEOSA-N 1 1 374.372 2.921 20 5 FFBDMO O=c1[nH]ccc(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000596231184 520984577 /nfs/dbraw/zinc/98/45/77/520984577.db2.gz HBFVQBJEOYLURB-LJQANCHMSA-N 1 1 354.410 2.798 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596269471 521001879 /nfs/dbraw/zinc/00/18/79/521001879.db2.gz VNTHFMYOGIFVQB-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCCOCC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596268947 521003077 /nfs/dbraw/zinc/00/30/77/521003077.db2.gz OFOIBOJJMIXNIS-UHFFFAOYSA-N 1 1 369.849 2.948 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CCCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000599068656 521012824 /nfs/dbraw/zinc/01/28/24/521012824.db2.gz BNBJUDSRHMLNCF-QAPCUYQASA-N 1 1 357.458 2.739 20 5 FFBDMO COc1cc(Cc2noc([C@@H]3CCn4cc(C)[nH+]c4C3)n2)ccc1[N+](=O)[O-] ZINC000599144825 521053290 /nfs/dbraw/zinc/05/32/90/521053290.db2.gz UANHGRJOTUITQY-CYBMUJFWSA-N 1 1 369.381 2.812 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN1CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C1)OCCO2 ZINC000611287365 521080697 /nfs/dbraw/zinc/08/06/97/521080697.db2.gz ZUDJVJXEWWGKGD-RHSMWYFYSA-N 1 1 373.453 2.815 20 5 FFBDMO CC(C)c1[nH+]ccn1CC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602141201 521169660 /nfs/dbraw/zinc/16/96/60/521169660.db2.gz IZPKMICZJUXDSQ-UHFFFAOYSA-N 1 1 350.806 2.927 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(C)[nH+]c1N1CCCC1 ZINC000611572101 521226249 /nfs/dbraw/zinc/22/62/49/521226249.db2.gz DARCGYLIDDTHHE-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CC[N@@H+](C)C1 ZINC000596694856 521227395 /nfs/dbraw/zinc/22/73/95/521227395.db2.gz PDNYRSMBBVDKGZ-NSHDSACASA-N 1 1 358.345 2.754 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593848567 521246621 /nfs/dbraw/zinc/24/66/21/521246621.db2.gz KSJIYFQOWHLZRJ-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593848567 521246624 /nfs/dbraw/zinc/24/66/24/521246624.db2.gz KSJIYFQOWHLZRJ-KRWDZBQOSA-N 1 1 368.437 2.635 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cc3cc4c(cc3[N+](=O)[O-])OCCO4)CC2)n1 ZINC000611607626 521247968 /nfs/dbraw/zinc/24/79/68/521247968.db2.gz MJMBVROAWKHESJ-UHFFFAOYSA-N 1 1 374.397 2.611 20 5 FFBDMO COCCC1CC[NH+]([C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000599507531 521265733 /nfs/dbraw/zinc/26/57/33/521265733.db2.gz YHQCTIDFHKEZCN-CYBMUJFWSA-N 1 1 365.430 2.679 20 5 FFBDMO CC(C)[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000599548066 521288037 /nfs/dbraw/zinc/28/80/37/521288037.db2.gz ALOVAEPCEKLEST-SFHVURJKSA-N 1 1 357.458 2.634 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000611711664 521293501 /nfs/dbraw/zinc/29/35/01/521293501.db2.gz NMSYUIMKLUPZEA-UGSOOPFHSA-N 1 1 353.426 2.991 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599567842 521304967 /nfs/dbraw/zinc/30/49/67/521304967.db2.gz POBTVZMUECJYRO-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000618983939 521333584 /nfs/dbraw/zinc/33/35/84/521333584.db2.gz CIXCJGWFLNRLKR-SFHVURJKSA-N 1 1 360.502 2.933 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599618798 521335824 /nfs/dbraw/zinc/33/58/24/521335824.db2.gz CNFQQIVEQIKVKH-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000593997545 521338632 /nfs/dbraw/zinc/33/86/32/521338632.db2.gz LOHCETLRXRMLSM-MRXNPFEDSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000593997545 521338639 /nfs/dbraw/zinc/33/86/39/521338639.db2.gz LOHCETLRXRMLSM-MRXNPFEDSA-N 1 1 371.441 2.701 20 5 FFBDMO COCCC[N@H+](CCOC)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602449157 521350768 /nfs/dbraw/zinc/35/07/68/521350768.db2.gz OESDHGHTOYDBAD-UHFFFAOYSA-N 1 1 367.265 2.904 20 5 FFBDMO COCCC[N@@H+](CCOC)Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602449157 521350773 /nfs/dbraw/zinc/35/07/73/521350773.db2.gz OESDHGHTOYDBAD-UHFFFAOYSA-N 1 1 367.265 2.904 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2ccc(=O)[nH]n2)cccc1[N+](=O)[O-] ZINC000599642462 521352959 /nfs/dbraw/zinc/35/29/59/521352959.db2.gz VAGMHOWMBUOHKW-INIZCTEOSA-N 1 1 371.397 2.565 20 5 FFBDMO C[C@H]1Cc2ccccc2N1C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC000602452144 521353098 /nfs/dbraw/zinc/35/30/98/521353098.db2.gz GXOXPGABHGSWKI-AWEZNQCLSA-N 1 1 355.442 2.744 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](OC2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000594026141 521358564 /nfs/dbraw/zinc/35/85/64/521358564.db2.gz DJDOLEAUZGSHSB-QGZVFWFLSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](OC2CCC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000594026141 521358575 /nfs/dbraw/zinc/35/85/75/521358575.db2.gz DJDOLEAUZGSHSB-QGZVFWFLSA-N 1 1 359.426 2.517 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc4ccncc4s3)CC2)cn1 ZINC000596980175 521418993 /nfs/dbraw/zinc/41/89/93/521418993.db2.gz URZQBIGEMHQNNC-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO O=C1[C@@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C[C@@H]2CCCCN12 ZINC000602686765 521478575 /nfs/dbraw/zinc/47/85/75/521478575.db2.gz HTGAXDMFWBPGMZ-KWQFWETISA-N 1 1 374.260 2.662 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H](OCc3ccccn3)C1)OCCO2 ZINC000602713421 521491253 /nfs/dbraw/zinc/49/12/53/521491253.db2.gz AEFVBMQUUWKMFB-MRXNPFEDSA-N 1 1 371.393 2.552 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H](OCc3ccccn3)C1)OCCO2 ZINC000602713421 521491260 /nfs/dbraw/zinc/49/12/60/521491260.db2.gz AEFVBMQUUWKMFB-MRXNPFEDSA-N 1 1 371.393 2.552 20 5 FFBDMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000612121697 521493900 /nfs/dbraw/zinc/49/39/00/521493900.db2.gz LHDBLEULJFWQIL-JHJVBQTASA-N 1 1 362.348 2.997 20 5 FFBDMO Nc1c(NC(=O)NCc2c[nH+]c3n2CCCC3)cc(Cl)cc1[N+](=O)[O-] ZINC000597092650 521498691 /nfs/dbraw/zinc/49/86/91/521498691.db2.gz PRSQLBJDCIJJFN-UHFFFAOYSA-N 1 1 364.793 2.685 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597095630 521500647 /nfs/dbraw/zinc/50/06/47/521500647.db2.gz YNAGTOVIENTCMX-JTQLQIEISA-N 1 1 355.826 2.826 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)C2)C1 ZINC000599836793 521503521 /nfs/dbraw/zinc/50/35/21/521503521.db2.gz YKNYJVDXEMFNOE-GOSISDBHSA-N 1 1 355.398 2.703 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H](C1CC1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000602816125 521549345 /nfs/dbraw/zinc/54/93/45/521549345.db2.gz AGXQYAMTFSGWAM-OAHLLOKOSA-N 1 1 350.419 2.549 20 5 FFBDMO COc1ccccc1O[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602831451 521558254 /nfs/dbraw/zinc/55/82/54/521558254.db2.gz XOMBZEKCWDRYLJ-HNNXBMFYSA-N 1 1 360.414 2.652 20 5 FFBDMO COc1c(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000619437727 521567076 /nfs/dbraw/zinc/56/70/76/521567076.db2.gz QEHVVZGZAGRSFO-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H](CCF)C2)cc1[N+](=O)[O-] ZINC000597211170 521578575 /nfs/dbraw/zinc/57/85/75/521578575.db2.gz KXGOJCBMMCUZKN-CYBMUJFWSA-N 1 1 354.378 2.718 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000597222721 521582386 /nfs/dbraw/zinc/58/23/86/521582386.db2.gz GFRAWSYMEMXMGA-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO CCCN1CC[C@@H]([NH2+]Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000597222721 521582392 /nfs/dbraw/zinc/58/23/92/521582392.db2.gz GFRAWSYMEMXMGA-CYBMUJFWSA-N 1 1 373.400 2.821 20 5 FFBDMO CC1(C)CN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC[N@H+]1CCO ZINC000619527420 521752872 /nfs/dbraw/zinc/75/28/72/521752872.db2.gz OQDNSMGZNCVNKQ-UHFFFAOYSA-N 1 1 374.416 2.689 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000026218868 535520917 /nfs/dbraw/zinc/52/09/17/535520917.db2.gz ODJKTBUQEIRPCK-CQSZACIVSA-N 1 1 363.414 2.507 20 5 FFBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)Cc1ccccc1 ZINC000736026168 598676090 /nfs/dbraw/zinc/67/60/90/598676090.db2.gz LUMBTWZFWKPCGL-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO COC1CC[NH+](CCNc2ncc([N+](=O)[O-])c(C)c2Br)CC1 ZINC000612446980 676082802 /nfs/dbraw/zinc/08/28/02/676082802.db2.gz PVVHWAVMKGQYKX-UHFFFAOYSA-N 1 1 373.251 2.583 20 5 FFBDMO Nc1cc(N2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164627835 719084007 /nfs/dbraw/zinc/08/40/07/719084007.db2.gz RBRFFDBINKJHQH-QAPCUYQASA-N 1 1 353.426 2.673 20 5 FFBDMO C[N@H+]1CCO[C@H]2CN(c3ccc4ccc5ccc(Cl)nc5c4n3)C[C@@H]21 ZINC001164671916 719396090 /nfs/dbraw/zinc/39/60/90/719396090.db2.gz ZWAGWDILYQGQTP-GJZGRUSLSA-N 1 1 354.841 2.956 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164724903 720331497 /nfs/dbraw/zinc/33/14/97/720331497.db2.gz LOYQWGLQOKCXDV-GJZGRUSLSA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1cc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1F ZINC000154236993 728799341 /nfs/dbraw/zinc/79/93/41/728799341.db2.gz ASHPAAAQZVNIRZ-CYBMUJFWSA-N 1 1 373.450 2.585 20 5 FFBDMO COC(=O)c1cc2n(n1)CCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000897990801 735301106 /nfs/dbraw/zinc/30/11/06/735301106.db2.gz ZFNVRMJMCSRHDE-LBPRGKRZSA-N 1 1 364.789 2.856 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]Cc1cnc2n1CCOC2 ZINC000898267388 735334974 /nfs/dbraw/zinc/33/49/74/735334974.db2.gz IMSCMAFBBFWWHX-UHFFFAOYSA-N 1 1 357.197 2.918 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H]2COc2ccc(Cl)cc2)c1 ZINC000746656305 735502090 /nfs/dbraw/zinc/50/20/90/735502090.db2.gz XHKWGWIDMDDQKH-AWEZNQCLSA-N 1 1 350.806 2.988 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746662692 735502528 /nfs/dbraw/zinc/50/25/28/735502528.db2.gz GCTGOXKVZJOOGE-OLZOCXBDSA-N 1 1 369.849 2.611 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c(Br)c1 ZINC000091672575 728461108 /nfs/dbraw/zinc/46/11/08/728461108.db2.gz BMPJQSJHTCPVEQ-NEPJUHHUSA-N 1 1 356.220 2.632 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000139877140 728741358 /nfs/dbraw/zinc/74/13/58/728741358.db2.gz FOAXGAVVTZMTKH-WFASDCNBSA-N 1 1 366.849 2.603 20 5 FFBDMO C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000171955011 729016090 /nfs/dbraw/zinc/01/60/90/729016090.db2.gz AIUKMNUSBYCFJD-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000779206839 738443083 /nfs/dbraw/zinc/44/30/83/738443083.db2.gz REVZJVZBTIOKHP-DOMZBBRYSA-N 1 1 369.849 2.916 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O ZINC000779206839 738443086 /nfs/dbraw/zinc/44/30/86/738443086.db2.gz REVZJVZBTIOKHP-DOMZBBRYSA-N 1 1 369.849 2.916 20 5 FFBDMO O=[N+]([O-])c1c(Br)cccc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000856717465 730349437 /nfs/dbraw/zinc/34/94/37/730349437.db2.gz GDJIBMFCMIVOBE-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2cccc(Br)c2[N+](=O)[O-])n1C ZINC000856731515 730351351 /nfs/dbraw/zinc/35/13/51/730351351.db2.gz QRBBJUNDVKARPE-UHFFFAOYSA-N 1 1 354.208 2.769 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccns1 ZINC000860055394 730474549 /nfs/dbraw/zinc/47/45/49/730474549.db2.gz XSPXYMDNIMAOFD-UWVGGRQHSA-N 1 1 350.400 2.738 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)C[N@H+](C)[C@H]1CCSC1 ZINC000767113306 737293120 /nfs/dbraw/zinc/29/31/20/737293120.db2.gz VAUSELCQXQVKCP-HNNXBMFYSA-N 1 1 368.455 2.863 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)C[N@@H+](C)[C@H]1CCSC1 ZINC000767113306 737293122 /nfs/dbraw/zinc/29/31/22/737293122.db2.gz VAUSELCQXQVKCP-HNNXBMFYSA-N 1 1 368.455 2.863 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000874832571 732105150 /nfs/dbraw/zinc/10/51/50/732105150.db2.gz FXRPAPWJXNNTGN-OLZOCXBDSA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000874837188 732106017 /nfs/dbraw/zinc/10/60/17/732106017.db2.gz IZUFOJFYQPPDAK-OLZOCXBDSA-N 1 1 368.231 2.666 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000878174960 732493796 /nfs/dbraw/zinc/49/37/96/732493796.db2.gz VPFNSNXRVBUXTM-ZIAGYGMSSA-N 1 1 350.444 2.749 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cc(Br)no1 ZINC000878598232 732562240 /nfs/dbraw/zinc/56/22/40/732562240.db2.gz AKAMYLXXSGSFRB-GFCCVEGCSA-N 1 1 370.203 2.553 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879556928 732721725 /nfs/dbraw/zinc/72/17/25/732721725.db2.gz AKPKEHGPFBTCTL-CHWSQXEVSA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000879556928 732721730 /nfs/dbraw/zinc/72/17/30/732721730.db2.gz AKPKEHGPFBTCTL-CHWSQXEVSA-N 1 1 365.455 2.617 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2CSC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000879566780 732725010 /nfs/dbraw/zinc/72/50/10/732725010.db2.gz YGUVBIMCLFDJEP-NEPJUHHUSA-N 1 1 353.419 2.747 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000881466475 733058425 /nfs/dbraw/zinc/05/84/25/733058425.db2.gz XIRIIRASFGQBJF-NWDGAFQWSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000881466474 733058453 /nfs/dbraw/zinc/05/84/53/733058453.db2.gz XIRIIRASFGQBJF-NEPJUHHUSA-N 1 1 368.231 2.666 20 5 FFBDMO CC(C)(C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000928079378 738817063 /nfs/dbraw/zinc/81/70/63/738817063.db2.gz IOMJWIRWDDRDDB-HOCLYGCPSA-N 1 1 363.483 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CCC[C@@H](C4OCCO4)C3)c2c1 ZINC000738150473 735023367 /nfs/dbraw/zinc/02/33/67/735023367.db2.gz VZIPNPBJFKAGHN-LLVKDONJSA-N 1 1 365.411 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CCC[C@@H](C4OCCO4)C3)c2c1 ZINC000738150473 735023370 /nfs/dbraw/zinc/02/33/70/735023370.db2.gz VZIPNPBJFKAGHN-LLVKDONJSA-N 1 1 365.411 2.914 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000900828364 735702155 /nfs/dbraw/zinc/70/21/55/735702155.db2.gz MEWCRFWEFXGOGT-UHFFFAOYSA-N 1 1 370.247 2.819 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000749561900 735731573 /nfs/dbraw/zinc/73/15/73/735731573.db2.gz QOYJDUBXPUOMQY-QWHCGFSZSA-N 1 1 367.833 2.935 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000901135548 735747842 /nfs/dbraw/zinc/74/78/42/735747842.db2.gz ODPGEFWEANLYOW-MFKMUULPSA-N 1 1 355.797 2.944 20 5 FFBDMO C[N@H+]1CC[C@@](O)(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000762815748 736870123 /nfs/dbraw/zinc/87/01/23/736870123.db2.gz IHDBYMGQGJCWAE-GFCCVEGCSA-N 1 1 353.728 2.746 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000910282767 737052599 /nfs/dbraw/zinc/05/25/99/737052599.db2.gz HZMYEFLEHIEHQK-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)CC1 ZINC000911289300 737190032 /nfs/dbraw/zinc/19/00/32/737190032.db2.gz XAJWLWBDELNGCA-UHFFFAOYSA-N 1 1 373.812 2.570 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000769447676 737530955 /nfs/dbraw/zinc/53/09/55/737530955.db2.gz VJCSKLIOGSJCCE-LLVKDONJSA-N 1 1 364.320 2.765 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000769447676 737530957 /nfs/dbraw/zinc/53/09/57/737530957.db2.gz VJCSKLIOGSJCCE-LLVKDONJSA-N 1 1 364.320 2.765 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(Cc3c(Br)cccc3[N+](=O)[O-])C2)C1 ZINC000814178253 741801291 /nfs/dbraw/zinc/80/12/91/741801291.db2.gz JAQRIZYRGWCTNL-OAHLLOKOSA-N 1 1 354.248 2.885 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1 ZINC000775085210 738060558 /nfs/dbraw/zinc/06/05/58/738060558.db2.gz GIOBEQCRRRXRFL-UHFFFAOYSA-N 1 1 368.455 2.974 20 5 FFBDMO Cc1nc(N2CC[NH+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)sc1C ZINC000776275487 738177141 /nfs/dbraw/zinc/17/71/41/738177141.db2.gz FMUBIOPVDBCFGV-INIZCTEOSA-N 1 1 362.455 2.524 20 5 FFBDMO C[C@@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000923982872 738352773 /nfs/dbraw/zinc/35/27/73/738352773.db2.gz IYJPYGBXHDGTAL-IVMMDQJWSA-N 1 1 364.471 2.535 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@@H]1C ZINC000787238114 739117332 /nfs/dbraw/zinc/11/73/32/739117332.db2.gz ITSRSBZRTNAZQA-MWLCHTKSSA-N 1 1 351.384 2.713 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@@H]1C ZINC000787238114 739117333 /nfs/dbraw/zinc/11/73/33/739117333.db2.gz ITSRSBZRTNAZQA-MWLCHTKSSA-N 1 1 351.384 2.713 20 5 FFBDMO CCNC(=O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Br)C(C)C ZINC000930568844 739130121 /nfs/dbraw/zinc/13/01/21/739130121.db2.gz MVXBLCYQAHKNNU-ZDUSSCGKSA-N 1 1 358.236 2.608 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000787962819 739191816 /nfs/dbraw/zinc/19/18/16/739191816.db2.gz RHHYVHIFPRAKPH-IINYFYTJSA-N 1 1 371.821 2.705 20 5 FFBDMO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1(C(N)=O)CCCC1 ZINC000788021395 739198084 /nfs/dbraw/zinc/19/80/84/739198084.db2.gz OTROBMHWSAHXSZ-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1(C(N)=O)CCCC1 ZINC000788021395 739198088 /nfs/dbraw/zinc/19/80/88/739198088.db2.gz OTROBMHWSAHXSZ-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(CN2CCC([N@H+]3CCCOCC3)CC2)c1 ZINC000931288840 739238693 /nfs/dbraw/zinc/23/86/93/739238693.db2.gz VQUWUILJMAPTCE-UHFFFAOYSA-N 1 1 353.850 2.935 20 5 FFBDMO COCC[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCOCC1 ZINC000931566468 739288534 /nfs/dbraw/zinc/28/85/34/739288534.db2.gz XLLBXWMKARDEKD-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO COCC[N@@H+](Cc1c(Br)cccc1[N+](=O)[O-])C1CCOCC1 ZINC000931566468 739288539 /nfs/dbraw/zinc/28/85/39/739288539.db2.gz XLLBXWMKARDEKD-UHFFFAOYSA-N 1 1 373.247 2.985 20 5 FFBDMO C[C@]1([C@@H]2CCC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)COC(=O)N1 ZINC000932020674 739374547 /nfs/dbraw/zinc/37/45/47/739374547.db2.gz KJFLLGVDUBFLBL-MLGOLLRUSA-N 1 1 353.806 2.959 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)s1 ZINC000932662379 739486666 /nfs/dbraw/zinc/48/66/66/739486666.db2.gz AOTXKXFKNJMRCG-JTQLQIEISA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)s1 ZINC000932662379 739486669 /nfs/dbraw/zinc/48/66/69/739486669.db2.gz AOTXKXFKNJMRCG-JTQLQIEISA-N 1 1 365.386 2.967 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000791058701 739527327 /nfs/dbraw/zinc/52/73/27/739527327.db2.gz DZQVKOFIAULKQB-CQSZACIVSA-N 1 1 355.385 2.923 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)[C@@H](C)C1 ZINC000933437411 739625090 /nfs/dbraw/zinc/62/50/90/739625090.db2.gz CJRZSJOAEAPYBI-JOYOIKCWSA-N 1 1 372.828 2.772 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1COC(=O)N(C)C ZINC000796558275 740154018 /nfs/dbraw/zinc/15/40/18/740154018.db2.gz XFKBCUKIASOHPE-OAHLLOKOSA-N 1 1 351.403 2.656 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1COC(=O)N(C)C ZINC000796558275 740154021 /nfs/dbraw/zinc/15/40/21/740154021.db2.gz XFKBCUKIASOHPE-OAHLLOKOSA-N 1 1 351.403 2.656 20 5 FFBDMO C[C@@H]1C[N@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])cc1Br ZINC000798397973 740328218 /nfs/dbraw/zinc/32/82/18/740328218.db2.gz NVMJPHXMNRKCRK-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])cc1Br ZINC000798397973 740328220 /nfs/dbraw/zinc/32/82/20/740328220.db2.gz NVMJPHXMNRKCRK-LLVKDONJSA-N 1 1 372.263 2.639 20 5 FFBDMO C[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CN(C(=O)OC(C)(C)C)C1 ZINC000810073059 741381345 /nfs/dbraw/zinc/38/13/45/741381345.db2.gz RHZYNTQJXKVCOS-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CN(C(=O)OC(C)(C)C)C1 ZINC000810073059 741381347 /nfs/dbraw/zinc/38/13/47/741381347.db2.gz RHZYNTQJXKVCOS-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)OCCOc2cccc([N+](=O)[O-])c2)C1 ZINC000811445907 741522758 /nfs/dbraw/zinc/52/27/58/741522758.db2.gz AVMGCCKQJGZOOQ-KRWDZBQOSA-N 1 1 354.378 2.729 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034642983 742927328 /nfs/dbraw/zinc/92/73/28/742927328.db2.gz IHQKEXDPBKLJBH-FPQZTECRSA-N 1 1 357.863 2.584 20 5 FFBDMO Cc1ccc(N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])c1Br ZINC000829020051 745156148 /nfs/dbraw/zinc/15/61/48/745156148.db2.gz VIWGNZPHKXXBNH-TXEJJXNPSA-N 1 1 372.263 2.557 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000830673529 745403025 /nfs/dbraw/zinc/40/30/25/745403025.db2.gz DRZZABRACPPNQB-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000830673529 745403029 /nfs/dbraw/zinc/40/30/29/745403029.db2.gz DRZZABRACPPNQB-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](CO)c1ccc(Cl)cc1 ZINC000830896422 745447581 /nfs/dbraw/zinc/44/75/81/745447581.db2.gz DVMOFXQZDNWAPO-SJORKVTESA-N 1 1 350.802 2.947 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000832779072 745754315 /nfs/dbraw/zinc/75/43/15/745754315.db2.gz TZWOPANGEOQLGY-CYBMUJFWSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000838513978 746655583 /nfs/dbraw/zinc/65/55/83/746655583.db2.gz RIXMHIGDYIIDEA-CYBMUJFWSA-N 1 1 354.838 2.874 20 5 FFBDMO CC(C)(C)C[N@@H+](CCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839486675 746836949 /nfs/dbraw/zinc/83/69/49/746836949.db2.gz QJWXENOKWXEINV-UHFFFAOYSA-N 1 1 357.838 2.917 20 5 FFBDMO CCNC(=O)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000839611807 746871266 /nfs/dbraw/zinc/87/12/66/746871266.db2.gz ZDEGHPUVBYLVMF-ZDUSSCGKSA-N 1 1 358.236 2.608 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839615198 746872212 /nfs/dbraw/zinc/87/22/12/746872212.db2.gz JHQCFAZHZKFJBD-CYBMUJFWSA-N 1 1 354.838 2.601 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCS(=O)(=O)C1CC1 ZINC000840966009 747245477 /nfs/dbraw/zinc/24/54/77/747245477.db2.gz LPWZWPHYHFQABF-UHFFFAOYSA-N 1 1 353.227 2.568 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C2(CCC2)CO1 ZINC000844422646 748026559 /nfs/dbraw/zinc/02/65/59/748026559.db2.gz RDEZEZRLHUCFKU-LBPRGKRZSA-N 1 1 351.378 2.706 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000846911859 748572940 /nfs/dbraw/zinc/57/29/40/748572940.db2.gz KQICBBFSUSRONK-CYBMUJFWSA-N 1 1 353.850 2.933 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000847087625 748618944 /nfs/dbraw/zinc/61/89/44/748618944.db2.gz XZSWUMGAFNLEMO-UHFFFAOYSA-N 1 1 371.821 2.850 20 5 FFBDMO Cc1cc(NC[C@H]2CC[N@@H+]2C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000896520522 971534895 /nfs/dbraw/zinc/53/48/95/971534895.db2.gz DALUVAPWFDVKAW-MRXNPFEDSA-N 1 1 356.426 2.539 20 5 FFBDMO Cc1cc(NC[C@H]2CC[N@H+]2C2CCOCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000896520522 971534904 /nfs/dbraw/zinc/53/49/04/971534904.db2.gz DALUVAPWFDVKAW-MRXNPFEDSA-N 1 1 356.426 2.539 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])cc(Br)[n+]1[O-] ZINC001167753143 971721677 /nfs/dbraw/zinc/72/16/77/971721677.db2.gz LIRXDSOXYUABEF-LLVKDONJSA-N 1 1 373.251 2.667 20 5 FFBDMO O=C(CCN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911834 960120524 /nfs/dbraw/zinc/12/05/24/960120524.db2.gz HWCVXQRWTPCDGW-BEFAXECRSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911834 960120556 /nfs/dbraw/zinc/12/05/56/960120556.db2.gz HWCVXQRWTPCDGW-BEFAXECRSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2[C@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911834 960120562 /nfs/dbraw/zinc/12/05/62/960120562.db2.gz HWCVXQRWTPCDGW-BEFAXECRSA-N 1 1 372.469 2.872 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)CN(C)C(=O)OC(C)(C)C ZINC001175390976 1013467919 /nfs/dbraw/zinc/46/79/19/1013467919.db2.gz UPWAULQUHBCLGL-KBPBESRZSA-N 1 1 367.446 2.815 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(OC[C@H]4CCCCO4)CC3)c2c1 ZINC000176208476 965620522 /nfs/dbraw/zinc/62/05/22/965620522.db2.gz XXXXWMURAZXICR-GOSISDBHSA-N 1 1 374.441 2.952 20 5 FFBDMO C[NH+](C)CCOc1cc(N(C(=N)N)c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001167995184 967173973 /nfs/dbraw/zinc/17/39/73/967173973.db2.gz VNKSAGPPSSSYFE-UHFFFAOYSA-N 1 1 361.377 2.706 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179548478 968973680 /nfs/dbraw/zinc/97/36/80/968973680.db2.gz XHKFFOLFVDAMEW-CYBMUJFWSA-N 1 1 360.414 2.874 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c2cc([N+](=O)[O-])ccc12 ZINC000179548478 968973686 /nfs/dbraw/zinc/97/36/86/968973686.db2.gz XHKFFOLFVDAMEW-CYBMUJFWSA-N 1 1 360.414 2.874 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000874850093 1013918119 /nfs/dbraw/zinc/91/81/19/1013918119.db2.gz NVRIIWQFORTVQY-WBVHZDCISA-N 1 1 358.442 2.504 20 5 FFBDMO CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]2C1 ZINC000895575328 970750702 /nfs/dbraw/zinc/75/07/02/970750702.db2.gz BAKXRRHTLMBUSA-IYBDPMFKSA-N 1 1 355.394 2.765 20 5 FFBDMO C[N@@H+](Cc1cc2ccccc2o1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985430778 974067870 /nfs/dbraw/zinc/06/78/70/974067870.db2.gz JXWKBVMYYGFTDF-IAGOWNOFSA-N 1 1 357.410 2.521 20 5 FFBDMO C[N@H+](Cc1cc2ccccc2o1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430778 974067881 /nfs/dbraw/zinc/06/78/81/974067881.db2.gz JXWKBVMYYGFTDF-IAGOWNOFSA-N 1 1 357.410 2.521 20 5 FFBDMO C[N@@H+](Cc1cc2ccccc2o1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430778 974067893 /nfs/dbraw/zinc/06/78/93/974067893.db2.gz JXWKBVMYYGFTDF-IAGOWNOFSA-N 1 1 357.410 2.521 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000893531018 974913659 /nfs/dbraw/zinc/91/36/59/974913659.db2.gz GKAQISMYXVZPLW-CYBMUJFWSA-N 1 1 367.409 2.564 20 5 FFBDMO CC(C)Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000981137967 976263654 /nfs/dbraw/zinc/26/36/54/976263654.db2.gz IQEPBMUWVCLTRP-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CC(C)Cc1ccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981137967 976263659 /nfs/dbraw/zinc/26/36/59/976263659.db2.gz IQEPBMUWVCLTRP-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO CC(C)Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000981137967 976263660 /nfs/dbraw/zinc/26/36/60/976263660.db2.gz IQEPBMUWVCLTRP-RTBURBONSA-N 1 1 359.470 2.585 20 5 FFBDMO Cc1ncccc1OC[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000842173441 976714655 /nfs/dbraw/zinc/71/46/55/976714655.db2.gz PSEPUHRJAQKREQ-MSOLQXFVSA-N 1 1 357.410 2.875 20 5 FFBDMO COc1c(O)ccc(CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000894135132 977942603 /nfs/dbraw/zinc/94/26/03/977942603.db2.gz RJCGGJWPMZIVKW-MRXNPFEDSA-N 1 1 371.437 2.921 20 5 FFBDMO COc1cc(CNC2CC([NH3+])C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000906510165 980673105 /nfs/dbraw/zinc/67/31/05/980673105.db2.gz OVWWYPKKBOIACK-UHFFFAOYSA-N 1 1 357.410 2.762 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688809 1014682757 /nfs/dbraw/zinc/68/27/57/1014682757.db2.gz VVSITRAYMJBBJG-QZTJIDSGSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@@H]1C[C@@H]2C[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688809 1014682762 /nfs/dbraw/zinc/68/27/62/1014682762.db2.gz VVSITRAYMJBBJG-QZTJIDSGSA-N 1 1 368.437 2.908 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000908249040 981400116 /nfs/dbraw/zinc/40/01/16/981400116.db2.gz JVEDGUKYRDHJTM-KDOFPFPSSA-N 1 1 356.426 2.752 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000897535544 981638411 /nfs/dbraw/zinc/63/84/11/981638411.db2.gz AGHICEPDSRIGQO-JCGIZDLHSA-N 1 1 358.442 2.949 20 5 FFBDMO CCCCCCNC(=O)[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000878020659 1014815743 /nfs/dbraw/zinc/81/57/43/1014815743.db2.gz TZKWWCHBCUEXSN-INIZCTEOSA-N 1 1 365.478 2.508 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCc2ccc3ccccc3c2)CC1 ZINC000996439149 984346165 /nfs/dbraw/zinc/34/61/65/984346165.db2.gz CEHMXHDFQRGGTH-WOJBJXKFSA-N 1 1 367.449 2.628 20 5 FFBDMO O=[N+]([O-])c1ccnn1CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000164804449 984402810 /nfs/dbraw/zinc/40/28/10/984402810.db2.gz KQBAMIQRLUYGQL-ROUUACIJSA-N 1 1 355.442 2.735 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000173469390 985836017 /nfs/dbraw/zinc/83/60/17/985836017.db2.gz YANHQHYGMKZWPD-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000173469390 985836033 /nfs/dbraw/zinc/83/60/33/985836033.db2.gz YANHQHYGMKZWPD-CYBMUJFWSA-N 1 1 373.369 2.593 20 5 FFBDMO CCOC(=O)c1cc(C(=O)OCCCn2cc[nH+]c2C)cc([N+](=O)[O-])c1 ZINC000763111319 989043758 /nfs/dbraw/zinc/04/37/58/989043758.db2.gz HINOXBCRZYNOQR-UHFFFAOYSA-N 1 1 361.354 2.524 20 5 FFBDMO COc1cccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000193889533 989098085 /nfs/dbraw/zinc/09/80/85/989098085.db2.gz KNQGHVPCKDFYPD-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1cc([N+](=O)[O-])ccc1F ZINC000879419995 1015522697 /nfs/dbraw/zinc/52/26/97/1015522697.db2.gz RGIZYICYQZNXON-JQFCIGGWSA-N 1 1 365.405 2.688 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000919212896 990591102 /nfs/dbraw/zinc/59/11/02/990591102.db2.gz YROSITJGURJSHY-OAHLLOKOSA-N 1 1 362.382 2.855 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000919877938 990752842 /nfs/dbraw/zinc/75/28/42/990752842.db2.gz QOHUWSFDJGMABG-ZNMIVQPWSA-N 1 1 362.474 2.757 20 5 FFBDMO COc1cccc(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000195358143 990866321 /nfs/dbraw/zinc/86/63/21/990866321.db2.gz HZZKJVPUNGYKGB-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C(=O)OCc1cccnc1[N+](=O)[O-] ZINC000923853426 990972018 /nfs/dbraw/zinc/97/20/18/990972018.db2.gz YDKRYZRHFPHGHH-PBHICJAKSA-N 1 1 355.394 2.801 20 5 FFBDMO COc1cc(C[NH2+][C@@H](C)c2ccnn2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000879685304 1015637120 /nfs/dbraw/zinc/63/71/20/1015637120.db2.gz GETCHUAKCTUVIV-JTQLQIEISA-N 1 1 370.356 2.832 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)cc1 ZINC000879691109 1015641625 /nfs/dbraw/zinc/64/16/25/1015641625.db2.gz OOAYYCKZDCNQRJ-ZWKOTPCHSA-N 1 1 354.410 2.508 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001127682977 992007046 /nfs/dbraw/zinc/00/70/46/992007046.db2.gz GWBOTSRWJSZEOG-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001127682977 992007058 /nfs/dbraw/zinc/00/70/58/992007058.db2.gz GWBOTSRWJSZEOG-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000880007160 1015729515 /nfs/dbraw/zinc/72/95/15/1015729515.db2.gz CJILUIUYMDHSQO-CQSZACIVSA-N 1 1 372.450 2.738 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](CC(=O)N3CCc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000880007160 1015729523 /nfs/dbraw/zinc/72/95/23/1015729523.db2.gz CJILUIUYMDHSQO-CQSZACIVSA-N 1 1 372.450 2.738 20 5 FFBDMO CN(CCOC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000810556023 994817902 /nfs/dbraw/zinc/81/79/02/994817902.db2.gz WZRWZLCAWCUIRK-GOSISDBHSA-N 1 1 367.421 2.787 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001132801142 995143940 /nfs/dbraw/zinc/14/39/40/995143940.db2.gz JVPGUTLUPTXHAX-YQQAZPJKSA-N 1 1 374.485 2.901 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@@H]2C1 ZINC000812333561 995418518 /nfs/dbraw/zinc/41/85/18/995418518.db2.gz JBWXDBWLFMXLOE-KGLIPLIRSA-N 1 1 372.450 2.742 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@H](n3cccn3)C2)o1 ZINC001170704660 995667320 /nfs/dbraw/zinc/66/73/20/995667320.db2.gz URODNEUOSPBORS-GFCCVEGCSA-N 1 1 374.788 2.942 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H](n3cccn3)C2)o1 ZINC001170704660 995667324 /nfs/dbraw/zinc/66/73/24/995667324.db2.gz URODNEUOSPBORS-GFCCVEGCSA-N 1 1 374.788 2.942 20 5 FFBDMO Cc1cc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c(N)c([N+](=O)[O-])c1 ZINC000727767343 995939292 /nfs/dbraw/zinc/93/92/92/995939292.db2.gz WWCOHFLDXXBWKH-INIZCTEOSA-N 1 1 368.437 2.880 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)NCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000825466548 997389963 /nfs/dbraw/zinc/38/99/63/997389963.db2.gz GSOGPNSUKQZPNO-UHFFFAOYSA-N 1 1 366.437 2.794 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000844021576 997588217 /nfs/dbraw/zinc/58/82/17/997588217.db2.gz COIJRTBSEIWCHM-REJXWNQVSA-N 1 1 361.442 2.566 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1COC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000845733426 998640503 /nfs/dbraw/zinc/64/05/03/998640503.db2.gz ARKAULCFYDSCMD-INIZCTEOSA-N 1 1 358.398 2.810 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000803858857 1016246681 /nfs/dbraw/zinc/24/66/81/1016246681.db2.gz KAAYAFNFRFMAPT-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO O=C(NC1(C2CC[NH+](C/C=C/c3ccccc3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000152892 1016247549 /nfs/dbraw/zinc/24/75/49/1016247549.db2.gz GUOQSPXTPOBMHC-LVLPYEQSSA-N 1 1 369.465 2.726 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](Nc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)C1 ZINC000734483333 999296148 /nfs/dbraw/zinc/29/61/48/999296148.db2.gz YSZLMUOOXCPPMD-LSDHHAIUSA-N 1 1 361.446 2.791 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741016728 999702765 /nfs/dbraw/zinc/70/27/65/999702765.db2.gz JYZRDVOVZBXSJR-XUXIUFHCSA-N 1 1 363.414 2.726 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741024620 999704152 /nfs/dbraw/zinc/70/41/52/999704152.db2.gz XOWZMIJNYZWACU-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741024620 999704153 /nfs/dbraw/zinc/70/41/53/999704153.db2.gz XOWZMIJNYZWACU-MJBXVCDLSA-N 1 1 363.414 2.646 20 5 FFBDMO COc1ccc([C@@H]2[C@H](COC(=O)c3ccc([N+](=O)[O-])n3C)CC[N@H+]2C)cc1 ZINC000741120411 999709716 /nfs/dbraw/zinc/70/97/16/999709716.db2.gz GDBLFSODIDKNKH-KBXCAEBGSA-N 1 1 373.409 2.792 20 5 FFBDMO Cc1c(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000741579291 999732226 /nfs/dbraw/zinc/73/22/26/999732226.db2.gz LBKYRFSFRUIMJM-IINYFYTJSA-N 1 1 364.402 2.532 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000741724494 999738875 /nfs/dbraw/zinc/73/88/75/999738875.db2.gz MRHRSZXEYXGMSZ-GJZGRUSLSA-N 1 1 360.458 2.798 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C1 ZINC000744798033 999876287 /nfs/dbraw/zinc/87/62/87/999876287.db2.gz FIOHOQHGTRZRPD-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]2(CC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169013964 1000015627 /nfs/dbraw/zinc/01/56/27/1000015627.db2.gz WYQQLNSUPPUZPK-RKVPGOIHSA-N 1 1 353.463 2.907 20 5 FFBDMO O=C1N(CC2CC2)c2ccccc2[C@]12CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169026750 1000018172 /nfs/dbraw/zinc/01/81/72/1000018172.db2.gz NTDYIXVYNAKWSE-XGHQBKJUSA-N 1 1 369.465 2.832 20 5 FFBDMO CS(=O)(=O)c1cccc([C@@H]2CCC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)c1 ZINC001169046922 1000018378 /nfs/dbraw/zinc/01/83/78/1000018378.db2.gz OLCBYTPVVWIEOR-OIISXLGYSA-N 1 1 366.483 2.715 20 5 FFBDMO C[N@@H+]1CCc2c(NC[C@@H](CO)Cc3ccccc3)ccc([N+](=O)[O-])c2C1 ZINC001169902546 1000084856 /nfs/dbraw/zinc/08/48/56/1000084856.db2.gz BCQDINWPRUJIFN-INIZCTEOSA-N 1 1 355.438 2.846 20 5 FFBDMO C[N@H+]1CCc2c(NC[C@@H](CO)Cc3ccccc3)ccc([N+](=O)[O-])c2C1 ZINC001169902546 1000084857 /nfs/dbraw/zinc/08/48/57/1000084857.db2.gz BCQDINWPRUJIFN-INIZCTEOSA-N 1 1 355.438 2.846 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117230 1000100318 /nfs/dbraw/zinc/10/03/18/1000100318.db2.gz CDSCAIKMLPAHND-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117230 1000100320 /nfs/dbraw/zinc/10/03/20/1000100320.db2.gz CDSCAIKMLPAHND-HUUCEWRRSA-N 1 1 368.437 2.912 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001147148014 1000832987 /nfs/dbraw/zinc/83/29/87/1000832987.db2.gz XCDBKFNROXDPOE-SECBINFHSA-N 1 1 372.828 2.820 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC001147493645 1000904759 /nfs/dbraw/zinc/90/47/59/1000904759.db2.gz FHABEAJJXGEPBL-IUODEOHRSA-N 1 1 353.850 2.979 20 5 FFBDMO C[C@@H]1CC[C@@H](C)[NH+]1CC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000785740022 1001473915 /nfs/dbraw/zinc/47/39/15/1001473915.db2.gz BHYPREPRHOCZRW-VXGBXAGGSA-N 1 1 360.370 2.561 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[NH+](CCOc3ccccc3)CC2)cc1F ZINC000788473895 1001809438 /nfs/dbraw/zinc/80/94/38/1001809438.db2.gz MCXHDXSOCHMUQG-UHFFFAOYSA-N 1 1 359.401 2.931 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000789519593 1002107375 /nfs/dbraw/zinc/10/73/75/1002107375.db2.gz LYDQBZUKRMFEAG-SFHVURJKSA-N 1 1 371.441 2.797 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCOCC4(CCCC4)C3)n2)c1 ZINC000774658550 1002337324 /nfs/dbraw/zinc/33/73/24/1002337324.db2.gz NQUVDSHIMRGDFU-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCOCC4(CCCC4)C3)n2)c1 ZINC000774658550 1002337334 /nfs/dbraw/zinc/33/73/34/1002337334.db2.gz NQUVDSHIMRGDFU-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1cc(N(C)C)cc[nH+]1 ZINC001183847220 1002410047 /nfs/dbraw/zinc/41/00/47/1002410047.db2.gz XZXXBZDWWBPLJJ-CYBMUJFWSA-N 1 1 357.414 2.563 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000791395347 1002689064 /nfs/dbraw/zinc/68/90/64/1002689064.db2.gz RQTYWCKWLFZGDE-SJCJKPOMSA-N 1 1 372.400 2.566 20 5 FFBDMO COCc1noc2c1C[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341898 1003129806 /nfs/dbraw/zinc/12/98/06/1003129806.db2.gz UCZGLLZTEGQKBT-LBPRGKRZSA-N 1 1 361.398 2.727 20 5 FFBDMO COCc1noc2c1C[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170341898 1003129811 /nfs/dbraw/zinc/12/98/11/1003129811.db2.gz UCZGLLZTEGQKBT-LBPRGKRZSA-N 1 1 361.398 2.727 20 5 FFBDMO COc1ccc(C[C@@H](C)N2CC([NH+]3CCC(F)(F)CC3)C2)c([N+](=O)[O-])c1 ZINC001170347163 1003134141 /nfs/dbraw/zinc/13/41/41/1003134141.db2.gz QYOLAQZXEQXGCC-CYBMUJFWSA-N 1 1 369.412 2.950 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000804777026 1003830339 /nfs/dbraw/zinc/83/03/39/1003830339.db2.gz MLGSMBDDIAVIOD-INIZCTEOSA-N 1 1 360.458 2.799 20 5 FFBDMO CCc1ccc(S(=O)(=O)N2CC[NH+](C(C)(C)CC)CC2)cc1[N+](=O)[O-] ZINC001191905964 1003995941 /nfs/dbraw/zinc/99/59/41/1003995941.db2.gz BAIFGUDFRGBSCB-UHFFFAOYSA-N 1 1 369.487 2.652 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001197819257 1004387096 /nfs/dbraw/zinc/38/70/96/1004387096.db2.gz ZQZVWNUQJNSOSF-SFHVURJKSA-N 1 1 360.410 2.956 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001131095271 1004720456 /nfs/dbraw/zinc/72/04/56/1004720456.db2.gz CTOXBIPYRUKPSR-CYBMUJFWSA-N 1 1 356.426 2.933 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000807927021 1004720686 /nfs/dbraw/zinc/72/06/86/1004720686.db2.gz ZUVYWJHEVLFWPI-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000807927021 1004720691 /nfs/dbraw/zinc/72/06/91/1004720691.db2.gz ZUVYWJHEVLFWPI-GOSISDBHSA-N 1 1 369.421 2.629 20 5 FFBDMO CC(=O)NCC[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000808218014 1004777462 /nfs/dbraw/zinc/77/74/62/1004777462.db2.gz MKCLFJITFNVINC-INIZCTEOSA-N 1 1 371.441 2.654 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-n2ccnc2)nc1 ZINC001199137259 1004839619 /nfs/dbraw/zinc/83/96/19/1004839619.db2.gz RWPXWAGAZCJYBZ-UHFFFAOYSA-N 1 1 353.382 2.864 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCN(Cc3ccc(F)cc3)CC2)cc1 ZINC000776276457 1005343256 /nfs/dbraw/zinc/34/32/56/1005343256.db2.gz NDJBTNCZWHGJGC-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2CCC[N@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000776276457 1005343259 /nfs/dbraw/zinc/34/32/59/1005343259.db2.gz NDJBTNCZWHGJGC-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2CCC[N@@H+](Cc3ccc(F)cc3)CC2)cc1 ZINC000776276457 1005343261 /nfs/dbraw/zinc/34/32/61/1005343261.db2.gz NDJBTNCZWHGJGC-HXUWFJFHSA-N 1 1 373.428 2.975 20 5 FFBDMO O=C(OC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000851466497 1005889263 /nfs/dbraw/zinc/88/92/63/1005889263.db2.gz UIZGRFYKEMVHRX-AWEZNQCLSA-N 1 1 370.361 2.755 20 5 FFBDMO O=C(OC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000851466497 1005889264 /nfs/dbraw/zinc/88/92/64/1005889264.db2.gz UIZGRFYKEMVHRX-AWEZNQCLSA-N 1 1 370.361 2.755 20 5 FFBDMO CC(C)n1cc(C2=CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000852135480 1005944625 /nfs/dbraw/zinc/94/46/25/1005944625.db2.gz RSLGTLDNXZOAQR-IBGZPJMESA-N 1 1 371.441 2.980 20 5 FFBDMO COCC[N@H+](Cc1ccc2c(c1)OCO2)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581304 1005961009 /nfs/dbraw/zinc/96/10/09/1005961009.db2.gz BWDXSXRBNXBCFP-KRWDZBQOSA-N 1 1 374.393 2.506 20 5 FFBDMO CC(C)(CCC(=O)Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1)[N+](=O)[O-] ZINC000882398115 1006386567 /nfs/dbraw/zinc/38/65/67/1006386567.db2.gz YUZHNMXECKNHQD-QGZVFWFLSA-N 1 1 360.458 2.745 20 5 FFBDMO O=C1CN(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000853634212 1006488068 /nfs/dbraw/zinc/48/80/68/1006488068.db2.gz LZXZTAJSVFZNKZ-YOEHRIQHSA-N 1 1 372.425 2.976 20 5 FFBDMO Cc1noc(COC(=O)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000853898228 1006576528 /nfs/dbraw/zinc/57/65/28/1006576528.db2.gz GBBSORBSFYJULA-HNNXBMFYSA-N 1 1 359.382 2.847 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)CCNc4ccccc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001135076469 1006666468 /nfs/dbraw/zinc/66/64/68/1006666468.db2.gz QEELEYFMZLNZBV-BGYRXZFFSA-N 1 1 372.469 2.731 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC001189997669 1007417564 /nfs/dbraw/zinc/41/75/64/1007417564.db2.gz RXDSCSBXJAPLIO-OAHLLOKOSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1cc(F)ccc1[N+](=O)[O-] ZINC000817179873 1007458969 /nfs/dbraw/zinc/45/89/69/1007458969.db2.gz UZYWIEYUSDXNLT-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@@H](C3CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000817370745 1007565181 /nfs/dbraw/zinc/56/51/81/1007565181.db2.gz NERCOPCKRXLCEH-OAHLLOKOSA-N 1 1 372.425 2.833 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@H](C3CCCC3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000817370744 1007566055 /nfs/dbraw/zinc/56/60/55/1007566055.db2.gz NERCOPCKRXLCEH-HNNXBMFYSA-N 1 1 372.425 2.833 20 5 FFBDMO N[C@H](CCC[NH3+])Nc1ccc2ccc3ccc(Br)nc3c2n1 ZINC001170900126 1007899869 /nfs/dbraw/zinc/89/98/69/1007899869.db2.gz IQENUZZNBSSTGK-ZDUSSCGKSA-N 1 1 360.259 2.981 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000819412346 1008140987 /nfs/dbraw/zinc/14/09/87/1008140987.db2.gz XFFNDLKOJDCEIF-FQEVSTJZSA-N 1 1 370.453 2.882 20 5 FFBDMO COc1cccc(C2([NH2+]Cc3cccnc3[N+](=O)[O-])CCOCC2)c1F ZINC000886175408 1008598971 /nfs/dbraw/zinc/59/89/71/1008598971.db2.gz ZTMWCFDOWWUZPY-UHFFFAOYSA-N 1 1 361.373 2.933 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@H+](Cc3cccnc3[N+](=O)[O-])CC[C@@H]21 ZINC000886215989 1008602236 /nfs/dbraw/zinc/60/22/36/1008602236.db2.gz UOLABBPTJNPJHY-ZFWWWQNUSA-N 1 1 362.430 2.821 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]2C[N@@H+](Cc3cccnc3[N+](=O)[O-])CC[C@@H]21 ZINC000886215989 1008602242 /nfs/dbraw/zinc/60/22/42/1008602242.db2.gz UOLABBPTJNPJHY-ZFWWWQNUSA-N 1 1 362.430 2.821 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCC2)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001177744748 1008730256 /nfs/dbraw/zinc/73/02/56/1008730256.db2.gz BKYKCZHFTBJKOR-UHFFFAOYSA-N 1 1 354.288 2.686 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780623 1009149113 /nfs/dbraw/zinc/14/91/13/1009149113.db2.gz MLKMWHZAOFGVNA-LQZABQIISA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860780623 1009149125 /nfs/dbraw/zinc/14/91/25/1009149125.db2.gz MLKMWHZAOFGVNA-LQZABQIISA-N 1 1 362.426 2.772 20 5 FFBDMO C[C@H](CNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402707 1009196436 /nfs/dbraw/zinc/19/64/36/1009196436.db2.gz HUIKLDGKUTWCDT-BEFAXECRSA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@H](CNC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402707 1009196442 /nfs/dbraw/zinc/19/64/42/1009196442.db2.gz HUIKLDGKUTWCDT-BEFAXECRSA-N 1 1 368.437 2.874 20 5 FFBDMO O=[N+]([O-])c1ncccc1Cn1cc(C[NH2+][C@H]2CCCc3ccccc32)nn1 ZINC000887463087 1009241667 /nfs/dbraw/zinc/24/16/67/1009241667.db2.gz OUKCVHJAJMDQQQ-SFHVURJKSA-N 1 1 364.409 2.797 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000823945749 1009288927 /nfs/dbraw/zinc/28/89/27/1009288927.db2.gz VQFHDYUTRUKTQK-INIZCTEOSA-N 1 1 369.425 2.568 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1Cc1ccccc1 ZINC000823945749 1009288938 /nfs/dbraw/zinc/28/89/38/1009288938.db2.gz VQFHDYUTRUKTQK-INIZCTEOSA-N 1 1 369.425 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCC(CN3CCc4c[nH]nc4C3)CC2)cc1 ZINC001180147703 1009580720 /nfs/dbraw/zinc/58/07/20/1009580720.db2.gz LKZLDKJLJYCUCV-UHFFFAOYSA-N 1 1 369.469 2.631 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000889158583 1009842615 /nfs/dbraw/zinc/84/26/15/1009842615.db2.gz OTZNPRPDFSQIRI-WBMJQRKESA-N 1 1 356.426 2.742 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865625648 1010829614 /nfs/dbraw/zinc/82/96/14/1010829614.db2.gz TVQBQBXFUZKJII-UGSOOPFHSA-N 1 1 367.409 2.827 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000868316998 1011244308 /nfs/dbraw/zinc/24/43/08/1011244308.db2.gz BUCNHKACHQHOHR-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000868316998 1011244319 /nfs/dbraw/zinc/24/43/19/1011244319.db2.gz BUCNHKACHQHOHR-SFHVURJKSA-N 1 1 354.410 2.623 20 5 FFBDMO COCCCN1CCC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172901375 1012075638 /nfs/dbraw/zinc/07/56/38/1012075638.db2.gz MOENENSXTYDVIY-GOSISDBHSA-N 1 1 361.486 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](Oc3cnccn3)C1)CC2 ZINC001172914035 1012096759 /nfs/dbraw/zinc/09/67/59/1012096759.db2.gz YCBUBEMZOWCYPQ-FUHWJXTLSA-N 1 1 354.410 2.786 20 5 FFBDMO CSc1ccc(C(=O)N2CC[NH2+][C@H](c3ccc(O)cc3)C2)cc1[N+](=O)[O-] ZINC000870078675 1012109643 /nfs/dbraw/zinc/10/96/43/1012109643.db2.gz GGDVVQWGNBBXJP-HNNXBMFYSA-N 1 1 373.434 2.809 20 5 FFBDMO CC(C)(C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870081411 1012111590 /nfs/dbraw/zinc/11/15/90/1012111590.db2.gz GFOCTZDBGYPQKM-SFHVURJKSA-N 1 1 369.421 2.751 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC000870086972 1012117809 /nfs/dbraw/zinc/11/78/09/1012117809.db2.gz HRCPLYLPGRFVIJ-IFMUVIIVSA-N 1 1 367.405 2.877 20 5 FFBDMO COCC[N@@H+](C1CCN(C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912304 1012126214 /nfs/dbraw/zinc/12/62/14/1012126214.db2.gz ZAEBFWGDDLWPED-GOSISDBHSA-N 1 1 361.486 2.885 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@H](O)[C@@H](F)CC3)CC2)c(F)c1 ZINC001173010150 1012179993 /nfs/dbraw/zinc/17/99/93/1012179993.db2.gz NCXLQIAVZKAYIZ-BBRMVZONSA-N 1 1 373.375 2.637 20 5 FFBDMO C[C@@H]1CN(C)[C@@H](C)C[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012966 1012184760 /nfs/dbraw/zinc/18/47/60/1012184760.db2.gz KPPYPELFWFNELS-QWHCGFSZSA-N 1 1 368.428 2.866 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012966 1012184765 /nfs/dbraw/zinc/18/47/65/1012184765.db2.gz KPPYPELFWFNELS-QWHCGFSZSA-N 1 1 368.428 2.866 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173012966 1012184774 /nfs/dbraw/zinc/18/47/74/1012184774.db2.gz KPPYPELFWFNELS-QWHCGFSZSA-N 1 1 368.428 2.866 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC000870138476 1012184955 /nfs/dbraw/zinc/18/49/55/1012184955.db2.gz FTECHQNPFSGWGO-INIZCTEOSA-N 1 1 359.357 2.529 20 5 FFBDMO COC(=O)[C@@H]1CC[C@@H](C)[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173180476 1012323926 /nfs/dbraw/zinc/32/39/26/1012323926.db2.gz KZVXTUDAZFPCSF-JHJVBQTASA-N 1 1 368.405 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCCC[C@](O)(CF)C2)c1F ZINC001173180364 1012324711 /nfs/dbraw/zinc/32/47/11/1012324711.db2.gz KDXKJIGCXIUXKB-PXAZEXFGSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@H](n3ccnn3)C2)c1F ZINC001173191179 1012332106 /nfs/dbraw/zinc/33/21/06/1012332106.db2.gz AVCYMOQDUJCPSB-OLZOCXBDSA-N 1 1 363.393 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC3(C[NH+](C)C3)CC2)c1F ZINC001173194277 1012338055 /nfs/dbraw/zinc/33/80/55/1012338055.db2.gz YZXVNYNYGJZAJZ-CYBMUJFWSA-N 1 1 351.422 2.701 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2C[C@H](C(=O)NC3CC3)C[C@@H]2C1 ZINC001173223173 1012355841 /nfs/dbraw/zinc/35/58/41/1012355841.db2.gz AGDCNOFDHZXTPT-DZUCGIPZSA-N 1 1 357.454 2.762 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870863286 1012609264 /nfs/dbraw/zinc/60/92/64/1012609264.db2.gz XWKQVVODOXSQQC-HKUYNNGSSA-N 1 1 373.384 2.508 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000828490099 1032725074 /nfs/dbraw/zinc/72/50/74/1032725074.db2.gz XEVVKIFSCMRJDD-GOSISDBHSA-N 1 1 357.385 2.969 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC000828490099 1032725089 /nfs/dbraw/zinc/72/50/89/1032725089.db2.gz XEVVKIFSCMRJDD-GOSISDBHSA-N 1 1 357.385 2.969 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1cccc([N+](=O)[O-])c1 ZINC000926917163 1018290389 /nfs/dbraw/zinc/29/03/89/1018290389.db2.gz XNGLDUCQADJGLX-ZHALLVOQSA-N 1 1 356.426 2.967 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2cccc3ccccc32)CC1 ZINC001045436348 1019965167 /nfs/dbraw/zinc/96/51/67/1019965167.db2.gz QBTQFJKQEPTLJA-RTBURBONSA-N 1 1 367.449 2.976 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505649 1020061547 /nfs/dbraw/zinc/06/15/47/1020061547.db2.gz UWNFOACSADQXAZ-IAGOWNOFSA-N 1 1 371.462 2.934 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505649 1020061558 /nfs/dbraw/zinc/06/15/58/1020061558.db2.gz UWNFOACSADQXAZ-IAGOWNOFSA-N 1 1 371.462 2.934 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCC[C@H](C4OCCO4)C3)c2)c1 ZINC000777957022 1020330791 /nfs/dbraw/zinc/33/07/91/1020330791.db2.gz OOPZJHVKAUBSDW-HNNXBMFYSA-N 1 1 358.398 2.501 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)CC[C@H]21 ZINC000777963012 1020356966 /nfs/dbraw/zinc/35/69/66/1020356966.db2.gz FORBQYITJLOWBY-QFBILLFUSA-N 1 1 355.442 2.832 20 5 FFBDMO CCC1(C)CC[NH+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000726590788 1020491537 /nfs/dbraw/zinc/49/15/37/1020491537.db2.gz UGGXHGNJCGXEEW-UHFFFAOYSA-N 1 1 360.414 2.833 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H]2COC(=O)N2)CC1 ZINC000932780208 1020899215 /nfs/dbraw/zinc/89/92/15/1020899215.db2.gz SZQONVMKGQFQPD-MRXNPFEDSA-N 1 1 363.414 2.702 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933080538 1020954109 /nfs/dbraw/zinc/95/41/09/1020954109.db2.gz YXABQERTJWAIEV-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1cc(CN2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000933745832 1021082636 /nfs/dbraw/zinc/08/26/36/1021082636.db2.gz OTUZNYASCHEHFS-YVEFUNNKSA-N 1 1 371.384 2.588 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@@H]2OCCc3ccccc32)c2ncc([N+](=O)[O-])cc12 ZINC000749949813 1021159033 /nfs/dbraw/zinc/15/90/33/1021159033.db2.gz ZGDMFMGJJGUDGD-SFHVURJKSA-N 1 1 367.409 2.851 20 5 FFBDMO Cc1nn(C[N@@H+](C)C[C@@H]2OCCc3ccccc32)c2ncc([N+](=O)[O-])cc12 ZINC000749949813 1021159034 /nfs/dbraw/zinc/15/90/34/1021159034.db2.gz ZGDMFMGJJGUDGD-SFHVURJKSA-N 1 1 367.409 2.851 20 5 FFBDMO Cc1cccc(C2=CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)c1C ZINC000934845917 1021427525 /nfs/dbraw/zinc/42/75/25/1021427525.db2.gz ZQXLTXCXLZVMPM-SFHVURJKSA-N 1 1 356.426 2.558 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000158003347 1022470748 /nfs/dbraw/zinc/47/07/48/1022470748.db2.gz RHZKAPPCNKGVBE-RDTXWAMCSA-N 1 1 355.442 2.851 20 5 FFBDMO C[C@@H](CCNC(=O)c1cc([N+](=O)[O-])ccc1N)[N@@H+](C)Cc1ccccc1 ZINC000188216917 1023042008 /nfs/dbraw/zinc/04/20/08/1023042008.db2.gz BSNLWAKEBMKZFB-AWEZNQCLSA-N 1 1 356.426 2.817 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350643 1033113995 /nfs/dbraw/zinc/11/39/95/1033113995.db2.gz QZTFXIFXSSZUCD-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350643 1033114005 /nfs/dbraw/zinc/11/40/05/1033114005.db2.gz QZTFXIFXSSZUCD-JLTOFOAXSA-N 1 1 369.421 2.688 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1cccc([N+](=O)[O-])c1 ZINC001120249137 1023282188 /nfs/dbraw/zinc/28/21/88/1023282188.db2.gz GARQODQUCPUNDB-KVSKMBFKSA-N 1 1 368.437 2.967 20 5 FFBDMO Cc1ccc(CCC[NH2+]C2CC3(CC(NC(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)cc1 ZINC001121087485 1023598886 /nfs/dbraw/zinc/59/88/86/1023598886.db2.gz KOENDQSTCSXZPU-JGQKGBITSA-N 1 1 371.481 2.610 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC001121200893 1023646328 /nfs/dbraw/zinc/64/63/28/1023646328.db2.gz YXWALRDAPKQGHE-CYZMBNFOSA-N 1 1 369.874 2.797 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N(C)[C@@H]1CC[N@@H+](CC)C[C@H]1C ZINC001121698216 1023934162 /nfs/dbraw/zinc/93/41/62/1023934162.db2.gz CVHSMZVGPNHNLK-CHWSQXEVSA-N 1 1 362.434 2.633 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[C@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001121700870 1023934602 /nfs/dbraw/zinc/93/46/02/1023934602.db2.gz ZVSKEEFDUHQURK-JKSUJKDBSA-N 1 1 372.473 2.737 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC001121791819 1024027558 /nfs/dbraw/zinc/02/75/58/1024027558.db2.gz LSVSDZFUOIXXBD-ZDUSSCGKSA-N 1 1 374.445 2.777 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](c2cccnc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000829522714 1033198773 /nfs/dbraw/zinc/19/87/73/1033198773.db2.gz OEBAMYPAXGOTQU-CQSZACIVSA-N 1 1 358.373 2.947 20 5 FFBDMO CC(C)(C[NH2+]Cc1ccccc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540814 1024884073 /nfs/dbraw/zinc/88/40/73/1024884073.db2.gz VLJOOXPQDVSSKJ-QZTJIDSGSA-N 1 1 359.470 2.706 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C2OCCO2)CC1 ZINC000195157976 1024949339 /nfs/dbraw/zinc/94/93/39/1024949339.db2.gz COMHQIALQCZFLU-LBPRGKRZSA-N 1 1 374.397 2.791 20 5 FFBDMO CC(C)([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000795219690 1025358752 /nfs/dbraw/zinc/35/87/52/1025358752.db2.gz GNOPQOAFRMBDCZ-UHFFFAOYSA-N 1 1 358.354 2.627 20 5 FFBDMO O=C(N1CC[NH2+][C@H](c2ccccc2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000837158885 1025623320 /nfs/dbraw/zinc/62/33/20/1025623320.db2.gz DNFRNIXSPXBEFJ-INIZCTEOSA-N 1 1 361.348 2.860 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)c1 ZINC000246569159 1026273507 /nfs/dbraw/zinc/27/35/07/1026273507.db2.gz LVMMOPYPBKELBB-WOJBJXKFSA-N 1 1 356.422 2.901 20 5 FFBDMO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1 ZINC000838906491 1026530885 /nfs/dbraw/zinc/53/08/85/1026530885.db2.gz NHJKJTVEGOGUFP-RYQLBKOJSA-N 1 1 362.426 2.570 20 5 FFBDMO O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000838904081 1026531145 /nfs/dbraw/zinc/53/11/45/1026531145.db2.gz GQODWSNWKJOLOB-TXEJJXNPSA-N 1 1 374.315 2.634 20 5 FFBDMO CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000839417178 1026672507 /nfs/dbraw/zinc/67/25/07/1026672507.db2.gz ZNOKBOQNXQNGKM-CYBMUJFWSA-N 1 1 364.402 2.676 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000839417178 1026672512 /nfs/dbraw/zinc/67/25/12/1026672512.db2.gz ZNOKBOQNXQNGKM-CYBMUJFWSA-N 1 1 364.402 2.676 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@H]3CCC[C@H]3O)n2)cc1 ZINC000840117678 1026965748 /nfs/dbraw/zinc/96/57/48/1026965748.db2.gz WCVCOESDWYUQCK-KZNAEPCWSA-N 1 1 371.441 2.826 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@H](Nc2cc([N+](=O)[O-])ccn2)C1 ZINC001158586517 1027069146 /nfs/dbraw/zinc/06/91/46/1027069146.db2.gz ZKKYNWOCKSAJSH-NVXWUHKLSA-N 1 1 370.409 2.861 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000247912585 1027279259 /nfs/dbraw/zinc/27/92/59/1027279259.db2.gz ALUAMKVJKPPKEB-PKOBYXMFSA-N 1 1 368.437 2.836 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC001153807238 1028006874 /nfs/dbraw/zinc/00/68/74/1028006874.db2.gz DDDVOHQGIWGPNH-GFCCVEGCSA-N 1 1 357.357 2.799 20 5 FFBDMO CN1CC2(C1)CN(C(=O)[C@@H]([NH3+])Cc1c3ccccc3cc3ccccc31)C2 ZINC001161531176 1028215368 /nfs/dbraw/zinc/21/53/68/1028215368.db2.gz BIKMDHJZPGJYAK-NRFANRHFSA-N 1 1 359.473 2.637 20 5 FFBDMO Cc1ccn2c(c1)nnc2CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2 ZINC001162705020 1028626108 /nfs/dbraw/zinc/62/61/08/1028626108.db2.gz XXGYGLBVZDSJSY-UHFFFAOYSA-N 1 1 352.398 2.546 20 5 FFBDMO Cc1ccn2c(c1)nnc2CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2 ZINC001162705020 1028626132 /nfs/dbraw/zinc/62/61/32/1028626132.db2.gz XXGYGLBVZDSJSY-UHFFFAOYSA-N 1 1 352.398 2.546 20 5 FFBDMO CCOc1ccc([C@@H](CO)Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cn1 ZINC001162996994 1028749974 /nfs/dbraw/zinc/74/99/74/1028749974.db2.gz AEKPDRCGBFOPDI-QGZVFWFLSA-N 1 1 372.425 2.522 20 5 FFBDMO CCOc1ccc([C@@H](CO)Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cn1 ZINC001162996994 1028749981 /nfs/dbraw/zinc/74/99/81/1028749981.db2.gz AEKPDRCGBFOPDI-QGZVFWFLSA-N 1 1 372.425 2.522 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cc(C)cc([N+](=O)[O-])c3N)CC[NH2+]2)cc1 ZINC001155726505 1028875198 /nfs/dbraw/zinc/87/51/98/1028875198.db2.gz IMHPDNHMYWOWBG-KRWDZBQOSA-N 1 1 368.437 2.835 20 5 FFBDMO O=C(c1cc(=S)cc2[nH]c3ccccc3nc1-2)N1CC[N@H+]2CC[C@H]2C1 ZINC001155996105 1029006408 /nfs/dbraw/zinc/00/64/08/1029006408.db2.gz KOUAPZVUHSARBX-LBPRGKRZSA-N 1 1 350.447 2.927 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(N2CC[NH+](CCc3ccncc3)CC2)nc1Cl ZINC001165059635 1029355621 /nfs/dbraw/zinc/35/56/21/1029355621.db2.gz DUBQLPVEWGIQQT-UHFFFAOYSA-N 1 1 361.833 2.711 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC001165108651 1029395060 /nfs/dbraw/zinc/39/50/60/1029395060.db2.gz ORIQFIFCZGYSRC-AWEZNQCLSA-N 1 1 354.838 2.723 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cnc3ccc([N+](=O)[O-])cc3n2)CC1 ZINC001165109299 1029397901 /nfs/dbraw/zinc/39/79/01/1029397901.db2.gz SQTBEYVHGORTPD-INIZCTEOSA-N 1 1 371.441 2.618 20 5 FFBDMO COc1cc(C)nc(N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC001165122790 1029405500 /nfs/dbraw/zinc/40/55/00/1029405500.db2.gz PRXBETBDHCFHHU-UHFFFAOYSA-N 1 1 354.410 2.629 20 5 FFBDMO Nc1cc(N2CCC([N@H+]3CCc4ccccc4C3)CC2)ncc1[N+](=O)[O-] ZINC001165150801 1029423534 /nfs/dbraw/zinc/42/35/34/1029423534.db2.gz PVOZLZWLDVIFHS-UHFFFAOYSA-N 1 1 353.426 2.599 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc([C@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)cc1 ZINC000782226194 1029617424 /nfs/dbraw/zinc/61/74/24/1029617424.db2.gz HGGCRZKMJJGUOW-IBGZPJMESA-N 1 1 366.377 2.738 20 5 FFBDMO C[C@@H]1C[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC(C)(C)C1 ZINC000784008239 1030412014 /nfs/dbraw/zinc/41/20/14/1030412014.db2.gz MWXRFUBNROXTOO-ZDUSSCGKSA-N 1 1 360.414 2.689 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)nc1-c1ccncc1 ZINC000842620352 1030834427 /nfs/dbraw/zinc/83/44/27/1030834427.db2.gz ZZKCNXDMRPBSTA-JKSUJKDBSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842629284 1030854337 /nfs/dbraw/zinc/85/43/37/1030854337.db2.gz TYXIOSSJSLHCNQ-MRXNPFEDSA-N 1 1 367.409 2.679 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@@H](c3cccnc3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842629284 1030854341 /nfs/dbraw/zinc/85/43/41/1030854341.db2.gz TYXIOSSJSLHCNQ-MRXNPFEDSA-N 1 1 367.409 2.679 20 5 FFBDMO C[NH+](C)Cc1ccc(C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)o1 ZINC001150286063 1031693480 /nfs/dbraw/zinc/69/34/80/1031693480.db2.gz GRSUPGFRZLVFGR-UHFFFAOYSA-N 1 1 355.753 2.972 20 5 FFBDMO CS(=O)(=O)c1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC001205802704 1032006068 /nfs/dbraw/zinc/00/60/68/1032006068.db2.gz IIGLEEYUEFZIPC-UHFFFAOYSA-N 1 1 354.815 2.942 20 5 FFBDMO NC[C@H]([NH3+])c1ccc(C(=O)Nc2cc3cccnc3c3ncccc23)cc1 ZINC001218980021 1033441719 /nfs/dbraw/zinc/44/17/19/1033441719.db2.gz PQJPJZQCRGFMGZ-KRWDZBQOSA-N 1 1 357.417 2.994 20 5 FFBDMO COc1cc(C(=O)OCC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])cc1OC ZINC000835599094 1035898534 /nfs/dbraw/zinc/89/85/34/1035898534.db2.gz XLBPYZGVOBOVSJ-YHWZYXNKSA-N 1 1 364.398 2.642 20 5 FFBDMO COC(=O)c1cc(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)cc([N+](=O)[O-])c1 ZINC001228772460 1036316505 /nfs/dbraw/zinc/31/65/05/1036316505.db2.gz WXKKDVXBHQWISL-XJKSGUPXSA-N 1 1 371.393 2.991 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CC[N@H+]([C@H](C)c2ccccn2)C1 ZINC001229058667 1036477884 /nfs/dbraw/zinc/47/78/84/1036477884.db2.gz BYMNFRAQLCFWQX-UKRRQHHQSA-N 1 1 371.393 2.991 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380305 1036642081 /nfs/dbraw/zinc/64/20/81/1036642081.db2.gz KQMBGZJPRQSHCW-SWLSCSKDSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380305 1036642086 /nfs/dbraw/zinc/64/20/86/1036642086.db2.gz KQMBGZJPRQSHCW-SWLSCSKDSA-N 1 1 358.398 2.688 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOC[C@H]3C3CC3)CC2)ccc1[N+](=O)[O-] ZINC001256101494 1038388041 /nfs/dbraw/zinc/38/80/41/1038388041.db2.gz LAEBJOJWGQMDMB-SFHVURJKSA-N 1 1 361.442 2.683 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc(/C=C/c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC001258013783 1039113051 /nfs/dbraw/zinc/11/30/51/1039113051.db2.gz YOFGHAAOJDOENN-GODNBWANSA-N 1 1 358.398 2.800 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(Cc2nnc(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c1 ZINC001258089634 1039163866 /nfs/dbraw/zinc/16/38/66/1039163866.db2.gz AKZWGEPJMKRETB-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(Cc2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)c1 ZINC001258089634 1039163875 /nfs/dbraw/zinc/16/38/75/1039163875.db2.gz AKZWGEPJMKRETB-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1ccc(Cc2nnc(CC[NH+]3C[C@H](C)O[C@@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258092016 1039165157 /nfs/dbraw/zinc/16/51/57/1039165157.db2.gz PXFKHZGOPQSVIF-KBPBESRZSA-N 1 1 360.414 2.529 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H](C)CC[C@@H]3CN)CC2)ccc1[N+](=O)[O-] ZINC001246555915 1039395822 /nfs/dbraw/zinc/39/58/22/1039395822.db2.gz INGQHGQDNATJBQ-WMLDXEAASA-N 1 1 362.474 2.631 20 5 FFBDMO COc1cc(N2CCC(N3C[C@@H](C)CC[C@@H]3C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001246555915 1039395834 /nfs/dbraw/zinc/39/58/34/1039395834.db2.gz INGQHGQDNATJBQ-WMLDXEAASA-N 1 1 362.474 2.631 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H]1C ZINC001254479692 1040745153 /nfs/dbraw/zinc/74/51/53/1040745153.db2.gz HWLIDPOPHJSTBW-KDOFPFPSSA-N 1 1 361.442 2.837 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC[C@@H]21 ZINC001254481304 1040747721 /nfs/dbraw/zinc/74/77/21/1040747721.db2.gz AQQZMDUUFJKLLF-BEFAXECRSA-N 1 1 372.469 2.506 20 5 FFBDMO O=C1CC[C@]2(CCC[N@H+](C3CCN(c4ccc([N+](=O)[O-])cc4)CC3)C2)O1 ZINC001254481090 1040748396 /nfs/dbraw/zinc/74/83/96/1040748396.db2.gz RKDXBNUKDREEEK-IBGZPJMESA-N 1 1 359.426 2.735 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254562122 1040798773 /nfs/dbraw/zinc/79/87/73/1040798773.db2.gz JRNMPSYYLSUULN-ZDUSSCGKSA-N 1 1 372.425 2.710 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254562122 1040798786 /nfs/dbraw/zinc/79/87/86/1040798786.db2.gz JRNMPSYYLSUULN-ZDUSSCGKSA-N 1 1 372.425 2.710 20 5 FFBDMO COC(=O)c1cnc2c(c1)C[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254570659 1040809098 /nfs/dbraw/zinc/80/90/98/1040809098.db2.gz PHIKDFJYTLIFKM-CYBMUJFWSA-N 1 1 355.394 2.766 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCCN(c3ccc(F)cn3)CC1)C2 ZINC001254595970 1040824137 /nfs/dbraw/zinc/82/41/37/1040824137.db2.gz AORXEWLIIYQSTL-SFHVURJKSA-N 1 1 356.401 2.808 20 5 FFBDMO CC(C)(C)OC(=O)N[C@H]1[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254595676 1040824662 /nfs/dbraw/zinc/82/46/62/1040824662.db2.gz XXSSWIDLHLTGIE-NXOAAHMSSA-N 1 1 359.426 2.517 20 5 FFBDMO COCC[C@@H]1CO[C@]2(C1)CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595269 1040824853 /nfs/dbraw/zinc/82/48/53/1040824853.db2.gz HZNKYTAZIFEJHK-YSSFQJQWSA-N 1 1 360.454 2.970 20 5 FFBDMO COc1cc(O[C@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ccn1 ZINC001254605393 1040834790 /nfs/dbraw/zinc/83/47/90/1040834790.db2.gz BNQXGHOGWQDNMU-WMZOPIPTSA-N 1 1 355.394 2.619 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1ccc([N+](=O)[O-])cc1 ZINC001262481418 1041700724 /nfs/dbraw/zinc/70/07/24/1041700724.db2.gz RPIPLNLJTMVEDF-VDZJLULYSA-N 1 1 368.437 2.967 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC001262826547 1041880957 /nfs/dbraw/zinc/88/09/57/1041880957.db2.gz MCTONCAHEVUKKL-BIMULSAOSA-N 1 1 357.332 2.684 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001263021037 1042039518 /nfs/dbraw/zinc/03/95/18/1042039518.db2.gz JIIGWJJKRLONOU-OAHLLOKOSA-N 1 1 364.494 2.728 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC001538547510 1070450549 /nfs/dbraw/zinc/45/05/49/1070450549.db2.gz ZECRQIFHYPLJTI-KRWDZBQOSA-N 1 1 358.442 2.738 20 5 FFBDMO C[C@@H](C[NH+]1CCOCC1)N(C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001320992617 1045508384 /nfs/dbraw/zinc/50/83/84/1045508384.db2.gz JZYRTLTURCUESN-LBPRGKRZSA-N 1 1 372.263 2.510 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc3cc[nH]c3c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282608191 1045955862 /nfs/dbraw/zinc/95/58/62/1045955862.db2.gz XYIWIQYGUJFJJL-SJLPKXTDSA-N 1 1 370.453 2.742 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001325063897 1046360464 /nfs/dbraw/zinc/36/04/64/1046360464.db2.gz HIVHKOZQVPLMDM-QGZVFWFLSA-N 1 1 374.384 2.842 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001325063897 1046360476 /nfs/dbraw/zinc/36/04/76/1046360476.db2.gz HIVHKOZQVPLMDM-QGZVFWFLSA-N 1 1 374.384 2.842 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CN[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC001325874436 1046670642 /nfs/dbraw/zinc/67/06/42/1046670642.db2.gz PSSGMDGXGFYNIE-YJBOKZPZSA-N 1 1 357.458 2.739 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)c(Br)c1 ZINC001327896113 1048087292 /nfs/dbraw/zinc/08/72/92/1048087292.db2.gz AFBYQUGTDINDSN-SCDSUCTJSA-N 1 1 355.232 2.950 20 5 FFBDMO O=C1Nc2ccccc2[C@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC001332363985 1048364126 /nfs/dbraw/zinc/36/41/26/1048364126.db2.gz BMJXCIANXOKFQR-QGZVFWFLSA-N 1 1 352.394 2.938 20 5 FFBDMO CCn1c(-c2c[nH]c([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001340187589 1050593286 /nfs/dbraw/zinc/59/32/86/1050593286.db2.gz OYFJNZLIDNPTRQ-UHFFFAOYSA-N 1 1 361.450 2.512 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC001342117724 1050712773 /nfs/dbraw/zinc/71/27/73/1050712773.db2.gz DALMTXBAJOKORW-CYBMUJFWSA-N 1 1 352.398 2.731 20 5 FFBDMO CC(C)Cn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC001342989089 1051605246 /nfs/dbraw/zinc/60/52/46/1051605246.db2.gz VPVVEIQODFYXKR-KGLIPLIRSA-N 1 1 374.445 2.633 20 5 FFBDMO CCN(c1nnc([C@H](C)[N+](=O)[O-])n1C)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001341358506 1051718176 /nfs/dbraw/zinc/71/81/76/1051718176.db2.gz HAPLULUUIGCPAP-YQQAZPJKSA-N 1 1 372.473 2.815 20 5 FFBDMO COc1ccc(NC(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001345745511 1052597975 /nfs/dbraw/zinc/59/79/75/1052597975.db2.gz LDGKRACACROXLV-HNNXBMFYSA-N 1 1 370.409 2.999 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc2ccccc21)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001334901692 1053142196 /nfs/dbraw/zinc/14/21/96/1053142196.db2.gz GMYCDCLMWYCLOB-KRWDZBQOSA-N 1 1 369.421 2.685 20 5 FFBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CCC[C@H](CCF)C1 ZINC001347239000 1053747261 /nfs/dbraw/zinc/74/72/61/1053747261.db2.gz TWKOMCRUXTUNNF-CXAGYDPISA-N 1 1 351.378 2.561 20 5 FFBDMO O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CCC[C@H](CCF)C1 ZINC001347239000 1053747277 /nfs/dbraw/zinc/74/72/77/1053747277.db2.gz TWKOMCRUXTUNNF-CXAGYDPISA-N 1 1 351.378 2.561 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC001347390475 1053926583 /nfs/dbraw/zinc/92/65/83/1053926583.db2.gz DWUIOQWBTSYGBD-SNVBAGLBSA-N 1 1 355.826 2.684 20 5 FFBDMO CCOc1ccc(C(=O)N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)cc1[N+](=O)[O-] ZINC001337619722 1054898793 /nfs/dbraw/zinc/89/87/93/1054898793.db2.gz VURVEPOPOXHWIJ-BGYRXZFFSA-N 1 1 373.453 2.942 20 5 FFBDMO CN1C[C@@H](C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC001353351259 1056324738 /nfs/dbraw/zinc/32/47/38/1056324738.db2.gz ICHWYMSAFBDRDB-YZGWKJHDSA-N 1 1 355.438 2.563 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])s3)n2C)C1 ZINC001339440915 1056455145 /nfs/dbraw/zinc/45/51/45/1056455145.db2.gz QXRWFXMFPQCMFM-LBPRGKRZSA-N 1 1 364.475 2.620 20 5 FFBDMO CCn1c(-c2cc(C)cc([N+](=O)[O-])c2)nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1 ZINC001339653789 1056680644 /nfs/dbraw/zinc/68/06/44/1056680644.db2.gz OVKYOZOWNKJVRV-RHSMWYFYSA-N 1 1 370.457 2.712 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001544799089 1071694494 /nfs/dbraw/zinc/69/44/94/1071694494.db2.gz RLTOAMFOJJBLTL-QMMMGPOBSA-N 1 1 369.784 2.541 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001446876526 1058567542 /nfs/dbraw/zinc/56/75/42/1058567542.db2.gz ASZMQHQSRFOHSX-HUUCEWRRSA-N 1 1 351.834 2.924 20 5 FFBDMO CCC1([NH2+]CCCc2ccccc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001502495028 1058865875 /nfs/dbraw/zinc/86/58/75/1058865875.db2.gz YLFDLIXXWBUJAI-QZTJIDSGSA-N 1 1 359.470 2.645 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1[nH]c(C)[nH+]c1C ZINC001456045270 1059999053 /nfs/dbraw/zinc/99/90/53/1059999053.db2.gz ZKWKNMNUFOGELJ-UHFFFAOYSA-N 1 1 364.427 2.603 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848473985 1060088632 /nfs/dbraw/zinc/08/86/32/1060088632.db2.gz SSHISFGVOOGFTJ-AWEZNQCLSA-N 1 1 358.398 2.691 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848473985 1060088651 /nfs/dbraw/zinc/08/86/51/1060088651.db2.gz SSHISFGVOOGFTJ-AWEZNQCLSA-N 1 1 358.398 2.691 20 5 FFBDMO COC(=O)[C@@H](C)C[N@@H+](Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1 ZINC000848477121 1060098787 /nfs/dbraw/zinc/09/87/87/1060098787.db2.gz OWMOZIFWKPPOJM-ZDUSSCGKSA-N 1 1 358.398 2.689 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)C1 ZINC000848488153 1060136700 /nfs/dbraw/zinc/13/67/00/1060136700.db2.gz BRJPWRVMYDQSBV-IBGZPJMESA-N 1 1 355.442 2.834 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C3CC3)[C@H]2C1 ZINC001521372851 1060562474 /nfs/dbraw/zinc/56/24/74/1060562474.db2.gz JYEXLZVYNAYHNC-WBAXXEDZSA-N 1 1 358.442 2.609 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848784346 1060689555 /nfs/dbraw/zinc/68/95/55/1060689555.db2.gz ZIZRZWZLSWGIJR-ZBFHGGJFSA-N 1 1 360.414 2.980 20 5 FFBDMO C[C@H]1[C@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227609 1060926113 /nfs/dbraw/zinc/92/61/13/1060926113.db2.gz RJIFMRAXXULWKV-QWRGUYRKSA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@H]1[C@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227609 1060926117 /nfs/dbraw/zinc/92/61/17/1060926117.db2.gz RJIFMRAXXULWKV-QWRGUYRKSA-N 1 1 366.805 2.891 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(Cc3c(Br)cccc3[N+](=O)[O-])C[C@]2(C)C1 ZINC001460874171 1061135670 /nfs/dbraw/zinc/13/56/70/1061135670.db2.gz PWHNIEYCSQQGLF-ABAIWWIYSA-N 1 1 354.248 2.741 20 5 FFBDMO C[C@@H]1CC[C@@](CO)([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c2ccccc21 ZINC001460944261 1061160933 /nfs/dbraw/zinc/16/09/33/1061160933.db2.gz FSPUJIQUCPSIRO-XCLFUZPHSA-N 1 1 369.421 2.568 20 5 FFBDMO Cc1nc2ccccc2nc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC001462501458 1061649473 /nfs/dbraw/zinc/64/94/73/1061649473.db2.gz FSSZSGDGWJXTPD-LJQANCHMSA-N 1 1 352.394 2.844 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](C)C[C@@H]1CC(C)C ZINC001465160357 1062994951 /nfs/dbraw/zinc/99/49/51/1062994951.db2.gz WEHDTQCKYCSPOB-AWEZNQCLSA-N 1 1 350.419 2.797 20 5 FFBDMO CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC001524992779 1063087131 /nfs/dbraw/zinc/08/71/31/1063087131.db2.gz FFFOSXRYFKTYDJ-OAHLLOKOSA-N 1 1 364.494 2.727 20 5 FFBDMO O=C(Nc1ccc2cc([N+](=O)[O-])ccc2n1)c1cnn(-c2cc[nH+]cc2)c1 ZINC001525137332 1063167347 /nfs/dbraw/zinc/16/73/47/1063167347.db2.gz SUEXEZPMFCBQIX-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001532859709 1063195228 /nfs/dbraw/zinc/19/52/28/1063195228.db2.gz NOCBFWSMGPPQRB-QGZVFWFLSA-N 1 1 368.437 2.892 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC001442033072 1063495375 /nfs/dbraw/zinc/49/53/75/1063495375.db2.gz MHLPMZNFIDZFDD-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC001470176735 1064269906 /nfs/dbraw/zinc/26/99/06/1064269906.db2.gz HTPWIOCTIVUMMM-ZDUSSCGKSA-N 1 1 366.849 2.967 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1cccc(Br)c1[N+](=O)[O-] ZINC001472798973 1065148235 /nfs/dbraw/zinc/14/82/35/1065148235.db2.gz DOWLLNGZSUTFER-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO CN(CCCN(C)c1cccc(Br)c1[N+](=O)[O-])CC[NH+](C)C ZINC001472798973 1065148240 /nfs/dbraw/zinc/14/82/40/1065148240.db2.gz DOWLLNGZSUTFER-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c1[N+](=O)[O-] ZINC001472844146 1065155536 /nfs/dbraw/zinc/15/55/36/1065155536.db2.gz GKMNKPWRYDBPIS-HNNXBMFYSA-N 1 1 370.409 2.771 20 5 FFBDMO O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](CCc2ccncc2)CC1 ZINC001472854520 1065158378 /nfs/dbraw/zinc/15/83/78/1065158378.db2.gz OIPSILMGJYWOHT-UHFFFAOYSA-N 1 1 363.421 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4ncccn4)CC3)n2)cc1 ZINC001473810689 1065372818 /nfs/dbraw/zinc/37/28/18/1065372818.db2.gz HNMZNYBMNUGBMG-UHFFFAOYSA-N 1 1 366.381 2.814 20 5 FFBDMO CC(C)(C)[S@](=O)CC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001474013096 1065439394 /nfs/dbraw/zinc/43/93/94/1065439394.db2.gz KEYIFZJEFSEBFC-HXUWFJFHSA-N 1 1 363.277 2.994 20 5 FFBDMO C[C@@H](CN)[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC001579395910 1078625637 /nfs/dbraw/zinc/62/56/37/1078625637.db2.gz SHEJCIPNICPPMG-AWEZNQCLSA-N 1 1 351.410 2.884 20 5 FFBDMO CCOc1cc(C(=O)NCCNc2ccc(C)c[nH+]2)c([N+](=O)[O-])cc1OC ZINC001558485408 1076014140 /nfs/dbraw/zinc/01/41/40/1076014140.db2.gz AWPWVKWCZMFGGZ-UHFFFAOYSA-N 1 1 374.397 2.547 20 5 FFBDMO CC[C@@]1(C)CCC[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001559563252 1076173187 /nfs/dbraw/zinc/17/31/87/1076173187.db2.gz RUDXKBUFUOHHLV-FQEVSTJZSA-N 1 1 374.485 2.756 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC001560038210 1076216105 /nfs/dbraw/zinc/21/61/05/1076216105.db2.gz ITOZNVTZTSSVAX-KRWDZBQOSA-N 1 1 371.441 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccc2c(c1)OCO2 ZINC001560147770 1076235915 /nfs/dbraw/zinc/23/59/15/1076235915.db2.gz BNDXJKSYBUWSAW-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccc2c(c1)OCO2 ZINC001560147770 1076235917 /nfs/dbraw/zinc/23/59/17/1076235917.db2.gz BNDXJKSYBUWSAW-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO C[N@@H+](CCc1ccc2c(c1)OCO2)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001560148499 1076236561 /nfs/dbraw/zinc/23/65/61/1076236561.db2.gz WJFMWPMJEUTWLT-UHFFFAOYSA-N 1 1 354.366 2.874 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C ZINC001560641541 1076287264 /nfs/dbraw/zinc/28/72/64/1076287264.db2.gz HMGBIKPDKDEHEI-HNNXBMFYSA-N 1 1 370.409 2.771 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001562575423 1076504441 /nfs/dbraw/zinc/50/44/41/1076504441.db2.gz NSMLPPRGEOGWNQ-JTQLQIEISA-N 1 1 371.235 2.821 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C2CCCCC2)cc1 ZINC001567281445 1077010901 /nfs/dbraw/zinc/01/09/01/1077010901.db2.gz NGZFOJFKRHLIPN-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCCCC2)cc1 ZINC001567281445 1077010905 /nfs/dbraw/zinc/01/09/05/1077010905.db2.gz NGZFOJFKRHLIPN-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C2CCCCC2)cc1 ZINC001567281445 1077010909 /nfs/dbraw/zinc/01/09/09/1077010909.db2.gz NGZFOJFKRHLIPN-RTBURBONSA-N 1 1 359.470 2.948 20 5 FFBDMO O=C(Nc1nccc2ccc([N+](=O)[O-])cc21)c1ccn(-c2cc[nH+]cc2)n1 ZINC001585842104 1079505246 /nfs/dbraw/zinc/50/52/46/1079505246.db2.gz RKRRIMKURWQAIE-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO C[C@]12CN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C[C@@]1(C)C[N@@H+](Cc1ccccc1)C2 ZINC001586472425 1079635018 /nfs/dbraw/zinc/63/50/18/1079635018.db2.gz YJRFLYRCCTZZIH-BGYRXZFFSA-N 1 1 368.437 2.907 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(-c2nn[nH]n2)c1 ZINC001590187261 1081077315 /nfs/dbraw/zinc/07/73/15/1081077315.db2.gz IHVISSFLQRRTMA-XQQFMLRXSA-N 1 1 359.434 2.553 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1 ZINC001590227455 1081108867 /nfs/dbraw/zinc/10/88/67/1081108867.db2.gz OZFFPCNJZRFHMY-VNHYZAJKSA-N 1 1 371.445 2.617 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCOCC2)c([N+](=O)[O-])c1 ZINC000018061355 249324613 /nfs/dbraw/zinc/32/46/13/249324613.db2.gz GDSCTDDWQDQQSC-UHFFFAOYSA-N 1 1 372.381 2.947 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000021055037 249326575 /nfs/dbraw/zinc/32/65/75/249326575.db2.gz KLCRWFQXNAQDQF-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864234 250297403 /nfs/dbraw/zinc/29/74/03/250297403.db2.gz JOIYYSNVQCIDBB-PWSUYJOCSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@H]2[C@@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864234 250297406 /nfs/dbraw/zinc/29/74/06/250297406.db2.gz JOIYYSNVQCIDBB-PWSUYJOCSA-N 1 1 360.357 2.940 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000181099830 251242152 /nfs/dbraw/zinc/24/21/52/251242152.db2.gz DYOGCTWIMJSEFU-UHFFFAOYSA-N 1 1 363.414 2.660 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ccccc2[C@H]1CO ZINC000268073650 251367269 /nfs/dbraw/zinc/36/72/69/251367269.db2.gz DHMYIJOAHGRUAX-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCCOC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000272565368 252069807 /nfs/dbraw/zinc/06/98/07/252069807.db2.gz UVKGOPXUJGZQFV-ZWKOTPCHSA-N 1 1 374.441 2.593 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000272569924 252070612 /nfs/dbraw/zinc/07/06/12/252070612.db2.gz TULDXKIZZVSERX-DOMZBBRYSA-N 1 1 368.865 2.772 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272584332 252073806 /nfs/dbraw/zinc/07/38/06/252073806.db2.gz YRAWSUXZBQFIFI-QZTJIDSGSA-N 1 1 357.458 2.882 20 5 FFBDMO CC(C)[N@@H+]1CCC[C@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000272833566 252142478 /nfs/dbraw/zinc/14/24/78/252142478.db2.gz LLXUHHQNNTVOBL-LLVKDONJSA-N 1 1 361.489 2.592 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000272833566 252142481 /nfs/dbraw/zinc/14/24/81/252142481.db2.gz LLXUHHQNNTVOBL-LLVKDONJSA-N 1 1 361.489 2.592 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000273308095 252278652 /nfs/dbraw/zinc/27/86/52/252278652.db2.gz XIEJWRYFRJJEJG-RISCZKNCSA-N 1 1 369.874 2.893 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000277199420 256171174 /nfs/dbraw/zinc/17/11/74/256171174.db2.gz FKYUVUSDSZOFAY-GUYCJALGSA-N 1 1 359.426 2.692 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)ccc1[N+](=O)[O-] ZINC000276934722 256144284 /nfs/dbraw/zinc/14/42/84/256144284.db2.gz RLVPMXKRKYNSSX-INIZCTEOSA-N 1 1 363.458 2.978 20 5 FFBDMO CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C)C1 ZINC000277891992 256252119 /nfs/dbraw/zinc/25/21/19/256252119.db2.gz DLZVOGBXXXCXCE-MRVPVSSYSA-N 1 1 362.249 2.585 20 5 FFBDMO CN(C(=O)c1sc(Br)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000277891992 256252120 /nfs/dbraw/zinc/25/21/20/256252120.db2.gz DLZVOGBXXXCXCE-MRVPVSSYSA-N 1 1 362.249 2.585 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@H](C)C2)c1 ZINC000278534309 256322701 /nfs/dbraw/zinc/32/27/01/256322701.db2.gz NPOBTWWYQYCSFZ-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO CN(C)c1ncc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000278628095 256332465 /nfs/dbraw/zinc/33/24/65/256332465.db2.gz FDXIJXVNYAYHPN-UHFFFAOYSA-N 1 1 355.320 2.759 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H](Oc3ncccc3F)C2)c1 ZINC000278905137 256360676 /nfs/dbraw/zinc/36/06/76/256360676.db2.gz SBIOXCNICBLMJF-WBVHZDCISA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](Oc3ncccc3F)C2)c1 ZINC000278905137 256360678 /nfs/dbraw/zinc/36/06/78/256360678.db2.gz SBIOXCNICBLMJF-WBVHZDCISA-N 1 1 361.373 2.706 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000286348307 257032351 /nfs/dbraw/zinc/03/23/51/257032351.db2.gz FJUJMJBFHZJIAG-RFLUGMABSA-N 1 1 356.382 2.500 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000286667089 257048596 /nfs/dbraw/zinc/04/85/96/257048596.db2.gz UXLLRWWVENPUFZ-GXTWGEPZSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H](CO)C1 ZINC000286667089 257048597 /nfs/dbraw/zinc/04/85/97/257048597.db2.gz UXLLRWWVENPUFZ-GXTWGEPZSA-N 1 1 362.348 2.986 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](OCc4ccncc4)C3)nc2c1 ZINC000287848854 257121035 /nfs/dbraw/zinc/12/10/35/257121035.db2.gz RAQBJJRQQXTGOL-OAHLLOKOSA-N 1 1 354.366 2.922 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](OCc4ccncc4)C3)nc2c1 ZINC000287848854 257121036 /nfs/dbraw/zinc/12/10/36/257121036.db2.gz RAQBJJRQQXTGOL-OAHLLOKOSA-N 1 1 354.366 2.922 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1 ZINC000289403847 257279279 /nfs/dbraw/zinc/27/92/79/257279279.db2.gz GDZWVQIKPIXANS-UYAOXDASSA-N 1 1 353.422 2.765 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CCCO1 ZINC000289618951 257290356 /nfs/dbraw/zinc/29/03/56/257290356.db2.gz JSDMLVTVJMZBHQ-GFCCVEGCSA-N 1 1 370.837 2.871 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705304 257294728 /nfs/dbraw/zinc/29/47/28/257294728.db2.gz CBNIGHRQBPPQOM-HUUCEWRRSA-N 1 1 357.414 2.682 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000289705304 257294729 /nfs/dbraw/zinc/29/47/29/257294729.db2.gz CBNIGHRQBPPQOM-HUUCEWRRSA-N 1 1 357.414 2.682 20 5 FFBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1[C@@H]1CCCO1 ZINC000289969455 257309207 /nfs/dbraw/zinc/30/92/07/257309207.db2.gz XELNISAFCGOFOM-DOTOQJQBSA-N 1 1 365.405 2.952 20 5 FFBDMO COc1ccc(OCC[N@@H+]2CC[C@H](n3cc(Cl)cn3)C2)c([N+](=O)[O-])c1 ZINC000289999159 257310812 /nfs/dbraw/zinc/31/08/12/257310812.db2.gz SXUDQJDGNKXGOZ-ZDUSSCGKSA-N 1 1 366.805 2.779 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)c([N+](=O)[O-])c1 ZINC000289999159 257310813 /nfs/dbraw/zinc/31/08/13/257310813.db2.gz SXUDQJDGNKXGOZ-ZDUSSCGKSA-N 1 1 366.805 2.779 20 5 FFBDMO CC(C)S(=O)(=O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290265714 257322780 /nfs/dbraw/zinc/32/27/80/257322780.db2.gz XEDQKDKGSQINSN-UHFFFAOYSA-N 1 1 352.412 2.768 20 5 FFBDMO COc1ccc(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC000290354224 257327764 /nfs/dbraw/zinc/32/77/64/257327764.db2.gz LOQOHEWVLPYECJ-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000291247137 257393555 /nfs/dbraw/zinc/39/35/55/257393555.db2.gz LPOKMWWBBGNKND-GOSISDBHSA-N 1 1 357.366 2.639 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]([C@@H](C)CO)C1CCCC1 ZINC000298491756 257915883 /nfs/dbraw/zinc/91/58/83/257915883.db2.gz JOMYVAWYSTUZOM-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000301231499 258035330 /nfs/dbraw/zinc/03/53/30/258035330.db2.gz FRJWWFZECXLSDQ-JKSUJKDBSA-N 1 1 369.425 2.598 20 5 FFBDMO C[N@H+]1CCC[C@@H](N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C1 ZINC000301277925 258039602 /nfs/dbraw/zinc/03/96/02/258039602.db2.gz JFVJFQHBHROUEM-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO Cc1cnc(NCc2ccccc2C[N@H+]2CCC[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000302059728 258085702 /nfs/dbraw/zinc/08/57/02/258085702.db2.gz SJEWIUNJISEQIY-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000302195414 258093890 /nfs/dbraw/zinc/09/38/90/258093890.db2.gz SIKKGOJPXNILNB-GDBMZVCRSA-N 1 1 359.426 2.835 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000302494059 258103857 /nfs/dbraw/zinc/10/38/57/258103857.db2.gz ATKVBVCDEFMLGP-HNNXBMFYSA-N 1 1 370.453 2.938 20 5 FFBDMO CCOc1cc(NC[C@]2([NH+]3CCOCC3)CCSC2)ccc1[N+](=O)[O-] ZINC000301447025 258050402 /nfs/dbraw/zinc/05/04/02/258050402.db2.gz QNZSOILWDOHFLT-QGZVFWFLSA-N 1 1 367.471 2.613 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000301826372 258069626 /nfs/dbraw/zinc/06/96/26/258069626.db2.gz JEEOUYIKFUQJAT-AEFFLSMTSA-N 1 1 372.400 2.951 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c(F)c1 ZINC000301888840 258073117 /nfs/dbraw/zinc/07/31/17/258073117.db2.gz RWGWIVXSUUFPOM-GJZGRUSLSA-N 1 1 363.364 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000301888840 258073118 /nfs/dbraw/zinc/07/31/18/258073118.db2.gz RWGWIVXSUUFPOM-GJZGRUSLSA-N 1 1 363.364 2.920 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C(C)C)CC1 ZINC000330471245 258164409 /nfs/dbraw/zinc/16/44/09/258164409.db2.gz NQFGEOKGBGEKCV-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H](C)[N@H+]1C ZINC000331515514 258189425 /nfs/dbraw/zinc/18/94/25/258189425.db2.gz IVAQQABVHOKCHI-OKILXGFUSA-N 1 1 354.410 2.821 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000331515514 258189426 /nfs/dbraw/zinc/18/94/26/258189426.db2.gz IVAQQABVHOKCHI-OKILXGFUSA-N 1 1 354.410 2.821 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332371415 258227384 /nfs/dbraw/zinc/22/73/84/258227384.db2.gz BDMNEAVBILOFPC-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3CC[N@@H+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332371415 258227385 /nfs/dbraw/zinc/22/73/85/258227385.db2.gz BDMNEAVBILOFPC-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO Cn1c(=O)c2ccc([N+](=O)[O-])cc2nc1SCC[C@@H]1CCCC[N@H+]1C ZINC000332502244 258232554 /nfs/dbraw/zinc/23/25/54/258232554.db2.gz RMBMFBMNUKWQCM-LBPRGKRZSA-N 1 1 362.455 2.808 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1C ZINC000332608922 258237220 /nfs/dbraw/zinc/23/72/20/258237220.db2.gz BEIAPZKVXFXAJR-AAEUAGOBSA-N 1 1 360.439 2.931 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000331736833 258198735 /nfs/dbraw/zinc/19/87/35/258198735.db2.gz VGROSAPUHNITQH-MRXNPFEDSA-N 1 1 361.442 2.828 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000373055934 512150667 /nfs/dbraw/zinc/15/06/67/512150667.db2.gz GLOPGMLBBDCUQL-CYBMUJFWSA-N 1 1 355.398 2.597 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2c(Br)cncc2[N+](=O)[O-])C1 ZINC000373059803 512153078 /nfs/dbraw/zinc/15/30/78/512153078.db2.gz RQGIGUCZTSIZPG-SNVBAGLBSA-N 1 1 366.219 2.870 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000032499578 506260739 /nfs/dbraw/zinc/26/07/39/506260739.db2.gz BXRFCJIKWIQTDC-UHFFFAOYSA-N 1 1 353.422 2.790 20 5 FFBDMO CC(=O)NCC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000052848837 506263114 /nfs/dbraw/zinc/26/31/14/506263114.db2.gz DXGSRIMWOBVHNU-LBPRGKRZSA-N 1 1 373.413 2.554 20 5 FFBDMO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(OC)c1 ZINC000065208655 506269702 /nfs/dbraw/zinc/26/97/02/506269702.db2.gz RHWYUUWOLYCIEU-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)Nc1cccc(OC)c1 ZINC000065208655 506269711 /nfs/dbraw/zinc/26/97/11/506269711.db2.gz RHWYUUWOLYCIEU-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCC[C@@H](C)C1 ZINC000053160497 506324160 /nfs/dbraw/zinc/32/41/60/506324160.db2.gz JAHANGZZVCXIMP-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO COC[C@@H]1CCCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000375104758 512164721 /nfs/dbraw/zinc/16/47/21/512164721.db2.gz HYDIVPQZVTZASM-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3nccn3C)C2)c([N+](=O)[O-])c1 ZINC000377261354 512190747 /nfs/dbraw/zinc/19/07/47/512190747.db2.gz INWAVLJILUPPLD-AWEZNQCLSA-N 1 1 360.414 2.595 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC000371063018 512199751 /nfs/dbraw/zinc/19/97/51/512199751.db2.gz MQNMTFMQZGDEQC-PKOBYXMFSA-N 1 1 357.385 2.838 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000375294338 512253659 /nfs/dbraw/zinc/25/36/59/512253659.db2.gz VJQBRNCQKMUIAS-UHFFFAOYSA-N 1 1 366.324 2.659 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2sccc2C1 ZINC000054763718 506615766 /nfs/dbraw/zinc/61/57/66/506615766.db2.gz BUPGFUUQROKGOS-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2sccc2C1 ZINC000054763718 506615770 /nfs/dbraw/zinc/61/57/70/506615770.db2.gz BUPGFUUQROKGOS-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)[N@H+]1CCc2ccccc2C1 ZINC000054761454 506616848 /nfs/dbraw/zinc/61/68/48/506616848.db2.gz QKLCZARINNGGCZ-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000066921861 506695915 /nfs/dbraw/zinc/69/59/15/506695915.db2.gz WGKXSGNKZJCFOW-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000055389464 506740781 /nfs/dbraw/zinc/74/07/81/506740781.db2.gz HADDVNGZXWKDOA-IYBDPMFKSA-N 1 1 363.458 2.848 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000067299067 506820804 /nfs/dbraw/zinc/82/08/04/506820804.db2.gz SNDOWXVADNKYPV-MRXNPFEDSA-N 1 1 359.382 2.763 20 5 FFBDMO O=C(NCc1cccc(C[NH+]2CCOCC2)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000056328456 506984959 /nfs/dbraw/zinc/98/49/59/506984959.db2.gz BWFFMTKOPACIFI-UHFFFAOYSA-N 1 1 370.409 2.749 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000067793057 507010512 /nfs/dbraw/zinc/01/05/12/507010512.db2.gz HDSPZYBRXJEEFI-QGZVFWFLSA-N 1 1 369.421 2.537 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000068105281 507113127 /nfs/dbraw/zinc/11/31/27/507113127.db2.gz WSWAKVLAIANBSY-UHFFFAOYSA-N 1 1 359.430 2.808 20 5 FFBDMO CN(CC[N@H+](C)C1CCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068105281 507113130 /nfs/dbraw/zinc/11/31/30/507113130.db2.gz WSWAKVLAIANBSY-UHFFFAOYSA-N 1 1 359.430 2.808 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000068105281 507113138 /nfs/dbraw/zinc/11/31/38/507113138.db2.gz WSWAKVLAIANBSY-UHFFFAOYSA-N 1 1 359.430 2.808 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835983 507205115 /nfs/dbraw/zinc/20/51/15/507205115.db2.gz CCKCFCBLMDYVTQ-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835983 507205121 /nfs/dbraw/zinc/20/51/21/507205121.db2.gz CCKCFCBLMDYVTQ-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Nc2cccc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000057778191 507327430 /nfs/dbraw/zinc/32/74/30/507327430.db2.gz AQILZEARDPVHIZ-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](C)CC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000047593093 507362789 /nfs/dbraw/zinc/36/27/89/507362789.db2.gz WEUIFICSPGIORH-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)CC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000047593093 507362792 /nfs/dbraw/zinc/36/27/92/507362792.db2.gz WEUIFICSPGIORH-UHFFFAOYSA-N 1 1 370.409 2.802 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCC1 ZINC000026448196 507590317 /nfs/dbraw/zinc/59/03/17/507590317.db2.gz UZLPURJYRWJBAC-UHFFFAOYSA-N 1 1 365.430 2.823 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])c1 ZINC000375472970 512349229 /nfs/dbraw/zinc/34/92/29/512349229.db2.gz UVNLRDJAZIVDQS-ZDUSSCGKSA-N 1 1 374.397 2.732 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CC1 ZINC000063723343 507764663 /nfs/dbraw/zinc/76/46/63/507764663.db2.gz UQUNXGBPASXUKE-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[NH+]1CCOCC1 ZINC000029208226 507768499 /nfs/dbraw/zinc/76/84/99/507768499.db2.gz GPFREXDZFMPYRQ-GOSISDBHSA-N 1 1 363.458 2.770 20 5 FFBDMO CCOc1ccccc1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000051426305 507770012 /nfs/dbraw/zinc/77/00/12/507770012.db2.gz DUNNWAKVJIEYNG-QGZVFWFLSA-N 1 1 360.410 2.865 20 5 FFBDMO Cc1[nH+]ccn1CCCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000078333598 507861478 /nfs/dbraw/zinc/86/14/78/507861478.db2.gz PNNNAKPAEIZGEH-UHFFFAOYSA-N 1 1 368.397 2.566 20 5 FFBDMO CCCO[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000108391996 507892502 /nfs/dbraw/zinc/89/25/02/507892502.db2.gz PPTVIXQMGCUHAG-IRXDYDNUSA-N 1 1 352.431 2.616 20 5 FFBDMO Cc1ccc(C(=O)C2CC[NH+](CCn3cc([N+](=O)[O-])ccc3=O)CC2)cc1 ZINC000090518952 507924999 /nfs/dbraw/zinc/92/49/99/507924999.db2.gz BSLRYOFXBQWDQQ-UHFFFAOYSA-N 1 1 369.421 2.660 20 5 FFBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090548805 507926871 /nfs/dbraw/zinc/92/68/71/507926871.db2.gz JHAHLRBDEBUFDO-ZRGWGRIASA-N 1 1 357.410 2.607 20 5 FFBDMO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090548805 507926872 /nfs/dbraw/zinc/92/68/72/507926872.db2.gz JHAHLRBDEBUFDO-ZRGWGRIASA-N 1 1 357.410 2.607 20 5 FFBDMO O=C(C[NH+]1CCC(n2cccn2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109008643 507931406 /nfs/dbraw/zinc/93/14/06/507931406.db2.gz UMIVRXLRXBPLEW-UHFFFAOYSA-N 1 1 363.805 2.720 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)COc1ccccc1[N+](=O)[O-] ZINC000079576898 507977490 /nfs/dbraw/zinc/97/74/90/507977490.db2.gz RBKWABZNYBCMRK-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000091480168 507988770 /nfs/dbraw/zinc/98/87/70/507988770.db2.gz BTDVEAHSDMJCKI-VIFPVBQESA-N 1 1 352.192 2.859 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079683587 507990491 /nfs/dbraw/zinc/99/04/91/507990491.db2.gz FRJSJHXYWLZTHN-JTQLQIEISA-N 1 1 357.332 2.828 20 5 FFBDMO CCc1nn(C)c(N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091729097 508005569 /nfs/dbraw/zinc/00/55/69/508005569.db2.gz CGYBOIAZYMBQHD-INIZCTEOSA-N 1 1 357.458 2.849 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000074320190 508011757 /nfs/dbraw/zinc/01/17/57/508011757.db2.gz RBMBTYWZNFWNMG-OAHLLOKOSA-N 1 1 372.469 2.973 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000074320184 508011950 /nfs/dbraw/zinc/01/19/50/508011950.db2.gz RBMBTYWZNFWNMG-HNNXBMFYSA-N 1 1 372.469 2.973 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000079945110 508017894 /nfs/dbraw/zinc/01/78/94/508017894.db2.gz NHQZZPYMXFUOGZ-GDBMZVCRSA-N 1 1 368.437 2.960 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765693 508053132 /nfs/dbraw/zinc/05/31/32/508053132.db2.gz OUYRRRQTEHAZPF-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cc(N[C@@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765693 508053135 /nfs/dbraw/zinc/05/31/35/508053135.db2.gz OUYRRRQTEHAZPF-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1 ZINC000110975333 508062135 /nfs/dbraw/zinc/06/21/35/508062135.db2.gz QZSNUOHCNXDDLR-CQSZACIVSA-N 1 1 365.478 2.543 20 5 FFBDMO COc1cc(C[NH+]2CCC([C@H](C)O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000111287093 508086759 /nfs/dbraw/zinc/08/67/59/508086759.db2.gz NTECCIOIZFFUNR-JTQLQIEISA-N 1 1 360.357 2.798 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000075324340 508097916 /nfs/dbraw/zinc/09/79/16/508097916.db2.gz VXYIITUCNZRHMX-INIZCTEOSA-N 1 1 356.426 2.907 20 5 FFBDMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)Cc1cccc(O)c1 ZINC000080919753 508112057 /nfs/dbraw/zinc/11/20/57/508112057.db2.gz DQQAOZPDTFLJMM-UHFFFAOYSA-N 1 1 357.366 2.730 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)CCN3CCCC3=O)o2)c([N+](=O)[O-])c1 ZINC000093320337 508139583 /nfs/dbraw/zinc/13/95/83/508139583.db2.gz GVBJSYLQDCAMGF-UHFFFAOYSA-N 1 1 373.409 2.918 20 5 FFBDMO COc1ccc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000081125937 508140129 /nfs/dbraw/zinc/14/01/29/508140129.db2.gz JMHKPAFLCLLWFG-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1 ZINC000081126539 508140496 /nfs/dbraw/zinc/14/04/96/508140496.db2.gz LQBVJPUMDNBANL-QGZVFWFLSA-N 1 1 368.437 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3=Cc4ccccc4OC3)C2)nc1 ZINC000093534454 508148091 /nfs/dbraw/zinc/14/80/91/508148091.db2.gz QRGUBYGOVDJBHR-MRXNPFEDSA-N 1 1 352.394 2.952 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])cc1OC ZINC000093865961 508157840 /nfs/dbraw/zinc/15/78/40/508157840.db2.gz XKCFEZAWOVTSDA-OAHLLOKOSA-N 1 1 359.382 2.660 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])cc1OC ZINC000093865961 508157841 /nfs/dbraw/zinc/15/78/41/508157841.db2.gz XKCFEZAWOVTSDA-OAHLLOKOSA-N 1 1 359.382 2.660 20 5 FFBDMO CCc1ccc([C@@H]2C[C@H](C)CC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000076145400 508163734 /nfs/dbraw/zinc/16/37/34/508163734.db2.gz OGSLSUSBVGTMMU-KMFMINBZSA-N 1 1 362.430 2.781 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000112918667 508233192 /nfs/dbraw/zinc/23/31/92/508233192.db2.gz OSDYLMNJAKTIGK-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC[C@H]2CCCO2)CC1 ZINC000083414658 508245070 /nfs/dbraw/zinc/24/50/70/508245070.db2.gz YLXLNOCUFDQKKO-QGZVFWFLSA-N 1 1 350.415 2.763 20 5 FFBDMO CC1(C)C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000083414944 508245522 /nfs/dbraw/zinc/24/55/22/508245522.db2.gz CVJXCMABANODCI-UHFFFAOYSA-N 1 1 351.428 2.720 20 5 FFBDMO C[C@H](CC[NH+]1CCOCC1)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000114370989 508307995 /nfs/dbraw/zinc/30/79/95/508307995.db2.gz MMGQQRUYHOIUNM-CQSZACIVSA-N 1 1 363.458 2.733 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000114489960 508321233 /nfs/dbraw/zinc/32/12/33/508321233.db2.gz HBFABCLKBNOQIX-IEBWSBKVSA-N 1 1 356.422 2.824 20 5 FFBDMO COc1ccc(COC[C@@H](O)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088605743 508379084 /nfs/dbraw/zinc/37/90/84/508379084.db2.gz MZINCTHIWOFZHF-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO COc1ccc(COC[C@@H](O)C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000088605743 508379085 /nfs/dbraw/zinc/37/90/85/508379085.db2.gz MZINCTHIWOFZHF-IBGZPJMESA-N 1 1 372.421 2.539 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000077938417 508393917 /nfs/dbraw/zinc/39/39/17/508393917.db2.gz AHQOEWVZIOPSFQ-CYBMUJFWSA-N 1 1 350.419 2.699 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])s3)cc2)CC1 ZINC000106186144 508397348 /nfs/dbraw/zinc/39/73/48/508397348.db2.gz GICSFPBYZROSGL-UHFFFAOYSA-N 1 1 360.439 2.656 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000156421928 508418732 /nfs/dbraw/zinc/41/87/32/508418732.db2.gz XPCJQVIKZKOTPM-JSGCOSHPSA-N 1 1 373.413 2.506 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121819237 508425086 /nfs/dbraw/zinc/42/50/86/508425086.db2.gz QQFVUHJLUNAZKK-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121819237 508425089 /nfs/dbraw/zinc/42/50/89/508425089.db2.gz QQFVUHJLUNAZKK-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000121838746 508429246 /nfs/dbraw/zinc/42/92/46/508429246.db2.gz OTYMKNFDBOBNEU-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1c(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000133755997 508444697 /nfs/dbraw/zinc/44/46/97/508444697.db2.gz RYHOMIURMXDPAD-IYBDPMFKSA-N 1 1 374.485 2.534 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000127562162 508469090 /nfs/dbraw/zinc/46/90/90/508469090.db2.gz PLLQUDYBQBVUFE-HNNXBMFYSA-N 1 1 364.446 2.786 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122040014 508471511 /nfs/dbraw/zinc/47/15/11/508471511.db2.gz JCFCNHHAKNKPLN-LBPRGKRZSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1OC(F)F ZINC000157631945 508590495 /nfs/dbraw/zinc/59/04/95/508590495.db2.gz IOEMVWJJOKKNRQ-UHFFFAOYSA-N 1 1 356.329 2.533 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000122861746 508598678 /nfs/dbraw/zinc/59/86/78/508598678.db2.gz VYBNPNGWRNFNOM-UHFFFAOYSA-N 1 1 370.409 2.783 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000154100238 508717395 /nfs/dbraw/zinc/71/73/95/508717395.db2.gz PMKRVMUJCUCJMA-SUMWQHHRSA-N 1 1 359.426 2.692 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[NH2+]CCc2nc[nH]n2)cc1[N+](=O)[O-] ZINC000119112413 508728378 /nfs/dbraw/zinc/72/83/78/508728378.db2.gz BGEBWWMPQZHQMF-UHFFFAOYSA-N 1 1 352.398 2.813 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000137114094 508738323 /nfs/dbraw/zinc/73/83/23/508738323.db2.gz OSWLXAUHYZIPLO-HNNXBMFYSA-N 1 1 369.425 2.891 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000158887893 508764489 /nfs/dbraw/zinc/76/44/89/508764489.db2.gz BCVHJWXYGYQDIN-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cc1[N+](=O)[O-] ZINC000159067750 508789230 /nfs/dbraw/zinc/78/92/30/508789230.db2.gz PSPPSIBUDBTRKY-CQSZACIVSA-N 1 1 357.414 2.909 20 5 FFBDMO Cc1nn(C)c(C(=O)N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)c1[N+](=O)[O-] ZINC000119423671 508792926 /nfs/dbraw/zinc/79/29/26/508792926.db2.gz ZUCIKJMHKHVHMX-NSHDSACASA-N 1 1 368.397 2.622 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000139911172 508796783 /nfs/dbraw/zinc/79/67/83/508796783.db2.gz HWCALUSISDRHGN-WFASDCNBSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)cc1[N+](=O)[O-] ZINC000159270078 508816542 /nfs/dbraw/zinc/81/65/42/508816542.db2.gz BGZNFYROGILDKC-GDBMZVCRSA-N 1 1 359.426 2.579 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130662885 508828146 /nfs/dbraw/zinc/82/81/46/508828146.db2.gz LBTUWULMVWVQAH-QGZVFWFLSA-N 1 1 369.425 2.661 20 5 FFBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130662885 508828151 /nfs/dbraw/zinc/82/81/51/508828151.db2.gz LBTUWULMVWVQAH-QGZVFWFLSA-N 1 1 369.425 2.661 20 5 FFBDMO COC(=O)C1([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CCCC1 ZINC000159460112 508845111 /nfs/dbraw/zinc/84/51/11/508845111.db2.gz NWMYVYVIXAMGIR-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000120209107 508950706 /nfs/dbraw/zinc/95/07/06/508950706.db2.gz QZSGHVJNBOFYCJ-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000125257347 508956262 /nfs/dbraw/zinc/95/62/62/508956262.db2.gz FKVCWPLYQLQRDL-QFBILLFUSA-N 1 1 372.469 2.796 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000120366809 508981988 /nfs/dbraw/zinc/98/19/88/508981988.db2.gz GLSJGDKHDNTIKG-DOMZBBRYSA-N 1 1 350.419 2.797 20 5 FFBDMO C[C@@H](CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000120616781 509032603 /nfs/dbraw/zinc/03/26/03/509032603.db2.gz UHSLSOFOSUEXEH-VIFPVBQESA-N 1 1 356.220 2.570 20 5 FFBDMO COCCC[N@@H+](C)CCNc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000161128782 509074863 /nfs/dbraw/zinc/07/48/63/509074863.db2.gz FGPRXUVGZGULRJ-UHFFFAOYSA-N 1 1 359.430 2.740 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1Br)[N@@H+](C)C1CC1 ZINC000120992141 509104697 /nfs/dbraw/zinc/10/46/97/509104697.db2.gz LWFKQGZWWLSLKE-SECBINFHSA-N 1 1 356.220 2.570 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000133028225 509106325 /nfs/dbraw/zinc/10/63/25/509106325.db2.gz DWWLYCZPJGOVAX-AWEZNQCLSA-N 1 1 350.806 2.988 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000121273563 509160828 /nfs/dbraw/zinc/16/08/28/509160828.db2.gz GOCPPBIQRDMCPQ-UHFFFAOYSA-N 1 1 358.236 2.819 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[N@H+]1C1CC1 ZINC000182350675 509189681 /nfs/dbraw/zinc/18/96/81/509189681.db2.gz AGTQNNUJVALKDH-UWVGGRQHSA-N 1 1 355.341 2.551 20 5 FFBDMO Cc1cccc(N2CC[NH+](CCCNc3ncc([N+](=O)[O-])s3)CC2)c1 ZINC000195508334 509199001 /nfs/dbraw/zinc/19/90/01/509199001.db2.gz AJQCQEFSNWQCQF-UHFFFAOYSA-N 1 1 361.471 2.984 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000248062581 509226473 /nfs/dbraw/zinc/22/64/73/509226473.db2.gz PHSFRAZEXPGHGA-PKOBYXMFSA-N 1 1 355.394 2.535 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000248062577 509227365 /nfs/dbraw/zinc/22/73/65/509227365.db2.gz PHSFRAZEXPGHGA-IEBWSBKVSA-N 1 1 355.394 2.535 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000179137081 509281479 /nfs/dbraw/zinc/28/14/79/509281479.db2.gz PBPFDDWLBMIDCI-MSOLQXFVSA-N 1 1 354.410 2.839 20 5 FFBDMO COc1cccc2c1CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000182694098 509376964 /nfs/dbraw/zinc/37/69/64/509376964.db2.gz XGYRGGOWZWNZCQ-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)C1([NH+]2CCOCC2)CCCC1 ZINC000173182634 509442434 /nfs/dbraw/zinc/44/24/34/509442434.db2.gz FUKFESZYGHGUFD-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO CCCC[C@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000236744675 509494560 /nfs/dbraw/zinc/49/45/60/509494560.db2.gz HANFQSKENKFEFK-SECBINFHSA-N 1 1 370.258 2.697 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000248894074 509533808 /nfs/dbraw/zinc/53/38/08/509533808.db2.gz SXODRSZEHVVRLM-RHSMWYFYSA-N 1 1 369.421 2.854 20 5 FFBDMO COc1ccc(OCCN2CCC(C[NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000173533995 509645404 /nfs/dbraw/zinc/64/54/04/509645404.db2.gz RNIVWTPPQBTIBD-UHFFFAOYSA-N 1 1 363.458 2.790 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000249398966 509671173 /nfs/dbraw/zinc/67/11/73/509671173.db2.gz BNONDLCJFYFDKF-ZNMIVQPWSA-N 1 1 364.446 2.766 20 5 FFBDMO COc1cccc([C@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@@H+]2C2CC2)c1 ZINC000183245852 509676621 /nfs/dbraw/zinc/67/66/21/509676621.db2.gz AJAOZHRDTFPTDX-QAPCUYQASA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cccc([C@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@H+]2C2CC2)c1 ZINC000183245852 509676623 /nfs/dbraw/zinc/67/66/23/509676623.db2.gz AJAOZHRDTFPTDX-QAPCUYQASA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@@H+]2C2CC2)c1 ZINC000183245866 509676844 /nfs/dbraw/zinc/67/68/44/509676844.db2.gz AJAOZHRDTFPTDX-MAUKXSAKSA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cccc([C@@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@H+]2C2CC2)c1 ZINC000183245866 509676851 /nfs/dbraw/zinc/67/68/51/509676851.db2.gz AJAOZHRDTFPTDX-MAUKXSAKSA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179939592 509683173 /nfs/dbraw/zinc/68/31/73/509683173.db2.gz DWHVELHPNCYESK-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179939592 509683174 /nfs/dbraw/zinc/68/31/74/509683174.db2.gz DWHVELHPNCYESK-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO C[C@H]1CC[C@](CO)([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657758 509687648 /nfs/dbraw/zinc/68/76/48/509687648.db2.gz ABYNXKHOKKJAJM-SJCJKPOMSA-N 1 1 353.394 2.545 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@H](C)O1 ZINC000267960523 509689270 /nfs/dbraw/zinc/68/92/70/509689270.db2.gz DLSIWYQWBDFLAO-OKILXGFUSA-N 1 1 374.441 2.695 20 5 FFBDMO COCCO[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000189668555 509692443 /nfs/dbraw/zinc/69/24/43/509692443.db2.gz RBKSBJIJZNLIKA-INIZCTEOSA-N 1 1 361.398 2.530 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NCC1([NH+]2CCOCC2)CCCCC1 ZINC000192908709 509695109 /nfs/dbraw/zinc/69/51/09/509695109.db2.gz BJHZSYIQIYZALE-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO CN(CC(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000180208132 509812557 /nfs/dbraw/zinc/81/25/57/509812557.db2.gz SZZHGDNOFSXMND-JXFKEZNVSA-N 1 1 368.437 2.593 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268228828 509824939 /nfs/dbraw/zinc/82/49/39/509824939.db2.gz PUFMUXVYOULKAZ-LLVKDONJSA-N 1 1 365.821 2.889 20 5 FFBDMO Cc1csc([C@@H]([NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C2CC2)n1 ZINC000183505090 509832029 /nfs/dbraw/zinc/83/20/29/509832029.db2.gz OCMVXZBEQZVVCE-KRWDZBQOSA-N 1 1 372.450 2.990 20 5 FFBDMO Cc1csc([C@H]([NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C2CC2)n1 ZINC000183524303 509841005 /nfs/dbraw/zinc/84/10/05/509841005.db2.gz NWLONCDKSSOVLG-QGZVFWFLSA-N 1 1 372.450 2.990 20 5 FFBDMO Cc1sc(C(=O)NCC[N@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000177068888 509853510 /nfs/dbraw/zinc/85/35/10/509853510.db2.gz VXEQEIULGFTMOI-UHFFFAOYSA-N 1 1 351.403 2.966 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000186746619 509885804 /nfs/dbraw/zinc/88/58/04/509885804.db2.gz GJEXKNIFJQYQHA-NSHDSACASA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCC[C@H](C)C1 ZINC000253542023 509890221 /nfs/dbraw/zinc/89/02/21/509890221.db2.gz MWKCHWVNIGDFBR-QWHCGFSZSA-N 1 1 372.425 2.699 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000253542021 509890309 /nfs/dbraw/zinc/89/03/09/509890309.db2.gz IKLDQANEDPJOKK-STQMWFEESA-N 1 1 372.425 2.699 20 5 FFBDMO CC(C)[NH+]1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000268412070 509913942 /nfs/dbraw/zinc/91/39/42/509913942.db2.gz IFWCRXQEXWYDMP-UHFFFAOYSA-N 1 1 373.400 2.521 20 5 FFBDMO CC[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1c1ccccc1 ZINC000245437372 509933496 /nfs/dbraw/zinc/93/34/96/509933496.db2.gz RMABLHTUTRQBLT-ATZDWAIDSA-N 1 1 358.442 2.668 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@H]2CCCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177201312 509934372 /nfs/dbraw/zinc/93/43/72/509934372.db2.gz RTEGVVDQIVDMAI-IRXDYDNUSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@H]2CCCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000177201312 509934378 /nfs/dbraw/zinc/93/43/78/509934378.db2.gz RTEGVVDQIVDMAI-IRXDYDNUSA-N 1 1 361.467 2.844 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000268510967 509978901 /nfs/dbraw/zinc/97/89/01/509978901.db2.gz WOQUWPXJLMZBJK-VIFPVBQESA-N 1 1 352.192 2.859 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)c([N+](=O)[O-])c1 ZINC000245526789 509984273 /nfs/dbraw/zinc/98/42/73/509984273.db2.gz FLCKJRJFCIFRML-WMLDXEAASA-N 1 1 360.414 2.762 20 5 FFBDMO C[C@H](C[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000183956356 510055979 /nfs/dbraw/zinc/05/59/79/510055979.db2.gz OUYCLKPUDCHDFI-IUODEOHRSA-N 1 1 360.439 2.892 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nccs1 ZINC000183956356 510055988 /nfs/dbraw/zinc/05/59/88/510055988.db2.gz OUYCLKPUDCHDFI-IUODEOHRSA-N 1 1 360.439 2.892 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000265458015 510065028 /nfs/dbraw/zinc/06/50/28/510065028.db2.gz YBDLZASEOCJNRL-CQSZACIVSA-N 1 1 354.410 2.577 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000245716654 510104293 /nfs/dbraw/zinc/10/42/93/510104293.db2.gz QILUOPAPUCFFIS-WBVHZDCISA-N 1 1 360.414 2.512 20 5 FFBDMO CCc1n[nH]c(C(=O)NCc2ccccc2C[N@@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000171371652 510112336 /nfs/dbraw/zinc/11/23/36/510112336.db2.gz MWFUPWAKZWHTNT-UHFFFAOYSA-N 1 1 359.430 2.651 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000180848446 510143331 /nfs/dbraw/zinc/14/33/31/510143331.db2.gz LSQILKSERRLOMD-GDBMZVCRSA-N 1 1 368.437 2.960 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000193969449 510153794 /nfs/dbraw/zinc/15/37/94/510153794.db2.gz CLOMJAFGBKDERN-GASCZTMLSA-N 1 1 364.446 2.785 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000193969449 510153800 /nfs/dbraw/zinc/15/38/00/510153800.db2.gz CLOMJAFGBKDERN-GASCZTMLSA-N 1 1 364.446 2.785 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194070943 510201452 /nfs/dbraw/zinc/20/14/52/510201452.db2.gz CQCSMUONIYWUCZ-GOSISDBHSA-N 1 1 368.437 2.916 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCS[C@@H]4COCC[C@H]43)co2)cc1 ZINC000245920616 510207653 /nfs/dbraw/zinc/20/76/53/510207653.db2.gz SMCKWUFUDGNRKU-HZPDHXFCSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@@H]4COCC[C@H]43)co2)cc1 ZINC000245920616 510207658 /nfs/dbraw/zinc/20/76/58/510207658.db2.gz SMCKWUFUDGNRKU-HZPDHXFCSA-N 1 1 361.423 2.956 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)[C@@H](C)C1 ZINC000245930845 510213189 /nfs/dbraw/zinc/21/31/89/510213189.db2.gz YLQFHDVUSLADMN-HOCLYGCPSA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)[NH2+]Cc2ccccc21 ZINC000262301004 510236783 /nfs/dbraw/zinc/23/67/83/510236783.db2.gz XLYGSZPRFHNQMR-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO COc1ccc([C@H](CCO)[NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000184301076 510248292 /nfs/dbraw/zinc/24/82/92/510248292.db2.gz LSRWRZCQNAOHOC-INIZCTEOSA-N 1 1 364.373 2.964 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000174692775 510254049 /nfs/dbraw/zinc/25/40/49/510254049.db2.gz JJEVMAIOYXHNMD-IBGZPJMESA-N 1 1 358.442 2.940 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184435935 510323844 /nfs/dbraw/zinc/32/38/44/510323844.db2.gz LWLXHEQJVJKRPU-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])c1 ZINC000269327266 510343413 /nfs/dbraw/zinc/34/34/13/510343413.db2.gz DICWDTOLKSTCDZ-UHFFFAOYSA-N 1 1 359.430 2.823 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000246186641 510348391 /nfs/dbraw/zinc/34/83/91/510348391.db2.gz LLPXYKKWZXEULX-BBRMVZONSA-N 1 1 357.414 2.876 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000266024509 510365820 /nfs/dbraw/zinc/36/58/20/510365820.db2.gz MHOSTMVIFJYHSG-WBVHZDCISA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@H](NCC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000184622125 510422439 /nfs/dbraw/zinc/42/24/39/510422439.db2.gz OEHKPWIMDFYBGN-KXBFYZLASA-N 1 1 370.453 2.665 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3F)CC2)nc(C)[nH+]1 ZINC000178174357 510470729 /nfs/dbraw/zinc/47/07/29/510470729.db2.gz JMCLJGKULULNLL-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C(=O)NCC2CC2)C1 ZINC000175097346 510482047 /nfs/dbraw/zinc/48/20/47/510482047.db2.gz ANPJLPBPHRFKOQ-HNNXBMFYSA-N 1 1 361.442 2.732 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3c(C)cccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000194807124 510537106 /nfs/dbraw/zinc/53/71/06/510537106.db2.gz ICQLJHLNVXPTQA-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO COc1cc(C[NH+]2[C@H](C)CC(O)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000191185436 510538172 /nfs/dbraw/zinc/53/81/72/510538172.db2.gz NCPWLNQCRVUXJP-GHMZBOCLSA-N 1 1 374.384 2.981 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000175224822 510541555 /nfs/dbraw/zinc/54/15/55/510541555.db2.gz FIXIXTAIOJORGC-INIZCTEOSA-N 1 1 363.458 2.538 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1 ZINC000175224822 510541565 /nfs/dbraw/zinc/54/15/65/510541565.db2.gz FIXIXTAIOJORGC-INIZCTEOSA-N 1 1 363.458 2.538 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@@H+](CCc2ccccc2)Cc2cccnc2)n1 ZINC000191354134 510620008 /nfs/dbraw/zinc/62/00/08/510620008.db2.gz PMBQNPQPBXBTQW-UHFFFAOYSA-N 1 1 351.410 2.931 20 5 FFBDMO CCN(C)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000191383934 510632268 /nfs/dbraw/zinc/63/22/68/510632268.db2.gz AVQNSFNMEREWHY-HNNXBMFYSA-N 1 1 356.430 2.527 20 5 FFBDMO CCS[C@H]1CCCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000181871809 510634764 /nfs/dbraw/zinc/63/47/64/510634764.db2.gz ILYHZCRRLAXEQV-GJZGRUSLSA-N 1 1 354.472 2.942 20 5 FFBDMO Cn1c(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000172358936 510689104 /nfs/dbraw/zinc/68/91/04/510689104.db2.gz ROFVXFCRCRYENA-CYBMUJFWSA-N 1 1 352.398 2.563 20 5 FFBDMO Cn1c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000172358936 510689110 /nfs/dbraw/zinc/68/91/10/510689110.db2.gz ROFVXFCRCRYENA-CYBMUJFWSA-N 1 1 352.398 2.563 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H](CCO)c1ccccc1 ZINC000266628747 510697263 /nfs/dbraw/zinc/69/72/63/510697263.db2.gz ORDKQCMMSMCGPT-GOSISDBHSA-N 1 1 369.421 2.539 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H](CCO)c1ccccc1 ZINC000266628747 510697268 /nfs/dbraw/zinc/69/72/68/510697268.db2.gz ORDKQCMMSMCGPT-GOSISDBHSA-N 1 1 369.421 2.539 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246927371 510750168 /nfs/dbraw/zinc/75/01/68/510750168.db2.gz WWUHAFMOMORZDA-GXTWGEPZSA-N 1 1 355.460 2.523 20 5 FFBDMO Cc1noc(C)c1C(C)(C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000285480257 510923607 /nfs/dbraw/zinc/92/36/07/510923607.db2.gz BJXVHTCXROJGRH-UHFFFAOYSA-N 1 1 358.398 2.614 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000364619585 510975668 /nfs/dbraw/zinc/97/56/68/510975668.db2.gz GIRUKCSMSRQDIP-LBPRGKRZSA-N 1 1 368.231 2.668 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1Br)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000364619583 510975915 /nfs/dbraw/zinc/97/59/15/510975915.db2.gz GIRUKCSMSRQDIP-GFCCVEGCSA-N 1 1 368.231 2.668 20 5 FFBDMO Cn1c(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O ZINC000282458178 510986213 /nfs/dbraw/zinc/98/62/13/510986213.db2.gz MJPFUSXOVPVMRT-UHFFFAOYSA-N 1 1 352.394 2.516 20 5 FFBDMO Cn1c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O ZINC000282458178 510986219 /nfs/dbraw/zinc/98/62/19/510986219.db2.gz MJPFUSXOVPVMRT-UHFFFAOYSA-N 1 1 352.394 2.516 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000361067450 510988657 /nfs/dbraw/zinc/98/86/57/510988657.db2.gz NADYXNLPAFHAKC-QWRGUYRKSA-N 1 1 355.341 2.553 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000285682649 511008076 /nfs/dbraw/zinc/00/80/76/511008076.db2.gz GKOLIQOXZUBDFF-IBGZPJMESA-N 1 1 355.394 2.926 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000279288565 511032578 /nfs/dbraw/zinc/03/25/78/511032578.db2.gz MDFOMBQMZIJHLJ-UONOGXRCSA-N 1 1 355.797 2.673 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000279408190 511072986 /nfs/dbraw/zinc/07/29/86/511072986.db2.gz XBLXCHDOPRWBKL-CMPLNLGQSA-N 1 1 357.813 2.871 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC23CCOCC3)cn1 ZINC000294685786 511142734 /nfs/dbraw/zinc/14/27/34/511142734.db2.gz AHBTXIKWMHUNRE-KRWDZBQOSA-N 1 1 374.416 2.864 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1C[C@@H](C)O ZINC000279726327 511190750 /nfs/dbraw/zinc/19/07/50/511190750.db2.gz JEINTXLOAHJMIE-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CNC(=O)C(F)(F)F)C1 ZINC000291575574 511252404 /nfs/dbraw/zinc/25/24/04/511252404.db2.gz OHFVZUKPTRJHKQ-LBPRGKRZSA-N 1 1 359.348 2.794 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)C1 ZINC000295061716 511267020 /nfs/dbraw/zinc/26/70/20/511267020.db2.gz UCABMNUNCGZJAH-ZDUSSCGKSA-N 1 1 366.437 2.604 20 5 FFBDMO C[C@@H]1Cc2c([nH+]cn2CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000295107262 511283803 /nfs/dbraw/zinc/28/38/03/511283803.db2.gz HDKWOHNPEXESJW-QWHCGFSZSA-N 1 1 363.439 2.636 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000363026744 511306314 /nfs/dbraw/zinc/30/63/14/511306314.db2.gz MPRFWZOOZVMRJA-GJZGRUSLSA-N 1 1 358.442 2.552 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000298698226 511379224 /nfs/dbraw/zinc/37/92/24/511379224.db2.gz ZSKUUYKHUGMLKW-JKSUJKDBSA-N 1 1 363.414 2.575 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1CSC ZINC000298738813 511394971 /nfs/dbraw/zinc/39/49/71/511394971.db2.gz VTCITBLYJYGRGU-ZDUSSCGKSA-N 1 1 353.444 2.759 20 5 FFBDMO CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000295415513 511396378 /nfs/dbraw/zinc/39/63/78/511396378.db2.gz WRLVNUSJZNETIH-FKEKPDDDSA-N 1 1 359.426 2.641 20 5 FFBDMO C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272234600 511474000 /nfs/dbraw/zinc/47/40/00/511474000.db2.gz FKJJGNRKFGTEHT-YOEHRIQHSA-N 1 1 368.437 2.817 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000273846514 511629591 /nfs/dbraw/zinc/62/95/91/511629591.db2.gz GTYXDUFQMOSIBD-GUYCJALGSA-N 1 1 363.433 2.954 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000280958101 511667368 /nfs/dbraw/zinc/66/73/68/511667368.db2.gz JKDRNTJSEKQQJC-LZLYRXPVSA-N 1 1 361.442 2.599 20 5 FFBDMO Cc1cc(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000365842426 511682289 /nfs/dbraw/zinc/68/22/89/511682289.db2.gz BXECYHDCBKDUAV-AWEZNQCLSA-N 1 1 362.430 2.620 20 5 FFBDMO Cc1[nH+]ccn1CCN1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000284352687 511693768 /nfs/dbraw/zinc/69/37/68/511693768.db2.gz CYKBYRCTFAGJBA-UHFFFAOYSA-N 1 1 365.231 2.921 20 5 FFBDMO Cc1cc(Cc2noc(CCCC[NH+]3CCOCC3)n2)ccc1[N+](=O)[O-] ZINC000274114617 511723182 /nfs/dbraw/zinc/72/31/82/511723182.db2.gz ZLOLYMFCQBUSJB-UHFFFAOYSA-N 1 1 360.414 2.532 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000303653306 511746100 /nfs/dbraw/zinc/74/61/00/511746100.db2.gz XLCQQALHLURLON-HUUCEWRRSA-N 1 1 362.474 2.759 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)[C@H]2C1 ZINC000284550295 511768104 /nfs/dbraw/zinc/76/81/04/511768104.db2.gz HHLDLYHSLCXYIK-PKOBYXMFSA-N 1 1 357.410 2.760 20 5 FFBDMO Cc1cc(OCc2nc([C@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348705 511786899 /nfs/dbraw/zinc/78/68/99/511786899.db2.gz GWZNFBDUFZDXNI-QAPCUYQASA-N 1 1 374.397 2.791 20 5 FFBDMO Cc1cc(OCc2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)ccc1[N+](=O)[O-] ZINC000350348705 511786904 /nfs/dbraw/zinc/78/69/04/511786904.db2.gz GWZNFBDUFZDXNI-QAPCUYQASA-N 1 1 374.397 2.791 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@@H]2C1 ZINC000284634916 511804497 /nfs/dbraw/zinc/80/44/97/511804497.db2.gz NNJKFACVQCNCDF-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCN([C@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000363898278 511837082 /nfs/dbraw/zinc/83/70/82/511837082.db2.gz ANJXSCBOKIDNEU-KRWDZBQOSA-N 1 1 374.485 2.570 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000366123153 511853774 /nfs/dbraw/zinc/85/37/74/511853774.db2.gz GQVWYQRGBISGTO-QGZVFWFLSA-N 1 1 354.410 2.726 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1 ZINC000293715929 512061014 /nfs/dbraw/zinc/06/10/14/512061014.db2.gz OXERXWKTKHRNKG-CQSZACIVSA-N 1 1 361.442 2.940 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 ZINC000373776415 512500395 /nfs/dbraw/zinc/50/03/95/512500395.db2.gz HBNKLKGCHOGGSE-CXAGYDPISA-N 1 1 359.426 2.579 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@@H](CC)O[C@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806890 512514940 /nfs/dbraw/zinc/51/49/40/512514940.db2.gz TUMZEVHPYBQVMI-CRAIPNDOSA-N 1 1 350.415 2.763 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@@H](CC)O[C@]3(CCOC3)C2)ccc1[N+](=O)[O-] ZINC000373806890 512514941 /nfs/dbraw/zinc/51/49/41/512514941.db2.gz TUMZEVHPYBQVMI-CRAIPNDOSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCS[C@H](C)[C@H]1C ZINC000411283475 512561514 /nfs/dbraw/zinc/56/15/14/512561514.db2.gz YWDDEOAGNFFLQC-VXGBXAGGSA-N 1 1 353.444 2.758 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCCC2 ZINC000367585853 512570630 /nfs/dbraw/zinc/57/06/30/512570630.db2.gz FLIAHQLPVRCJPE-UHFFFAOYSA-N 1 1 357.414 2.636 20 5 FFBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](Cc4c([N+](=O)[O-])ncn4C)C3)nc2c1 ZINC000367618543 512586955 /nfs/dbraw/zinc/58/69/55/512586955.db2.gz PSXYMKVULYNTER-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@H+](Cc4c([N+](=O)[O-])ncn4C)C3)nc2c1 ZINC000367618543 512586960 /nfs/dbraw/zinc/58/69/60/512586960.db2.gz PSXYMKVULYNTER-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4c([N+](=O)[O-])ncn4C)C3)[nH]c2c1 ZINC000367618543 512586966 /nfs/dbraw/zinc/58/69/66/512586966.db2.gz PSXYMKVULYNTER-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4c([N+](=O)[O-])ncn4C)C3)[nH]c2c1 ZINC000367618543 512586971 /nfs/dbraw/zinc/58/69/71/512586971.db2.gz PSXYMKVULYNTER-CYBMUJFWSA-N 1 1 354.414 2.893 20 5 FFBDMO COC(=O)c1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000411378111 512606732 /nfs/dbraw/zinc/60/67/32/512606732.db2.gz YNANWYDZWNCXNJ-GFCCVEGCSA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cs1 ZINC000411378111 512606735 /nfs/dbraw/zinc/60/67/35/512606735.db2.gz YNANWYDZWNCXNJ-GFCCVEGCSA-N 1 1 362.411 2.524 20 5 FFBDMO C[C@@H]1C[C@]2(CCO1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H](C)O2 ZINC000374015517 512623661 /nfs/dbraw/zinc/62/36/61/512623661.db2.gz VZJLRBJVHHBXER-RVKKMQEKSA-N 1 1 350.415 2.632 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000378539154 512814320 /nfs/dbraw/zinc/81/43/20/512814320.db2.gz NZXWIFBBNGNODD-HNNXBMFYSA-N 1 1 354.410 2.524 20 5 FFBDMO COCCn1cc2c(n1)[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC000378563766 512825917 /nfs/dbraw/zinc/82/59/17/512825917.db2.gz TYVTTXFXCSRZFB-OAHLLOKOSA-N 1 1 360.414 2.614 20 5 FFBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000378639139 512860460 /nfs/dbraw/zinc/86/04/60/512860460.db2.gz DPBGPSSFWATKAO-RDTXWAMCSA-N 1 1 357.410 2.848 20 5 FFBDMO CCc1nn(C)c(N2C[C@@H]3C[N@H+](Cc4ccccc4)CC[C@@H]3C2)c1[N+](=O)[O-] ZINC000381013585 512874331 /nfs/dbraw/zinc/87/43/31/512874331.db2.gz PYPMNWCQMZQPGN-SJORKVTESA-N 1 1 369.469 2.849 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000382767765 512878631 /nfs/dbraw/zinc/87/86/31/512878631.db2.gz IGIMXTATYCDDRW-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO CNc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000382767765 512878634 /nfs/dbraw/zinc/87/86/34/512878634.db2.gz IGIMXTATYCDDRW-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000411975384 512898978 /nfs/dbraw/zinc/89/89/78/512898978.db2.gz GTHGUABWDKJVFZ-GOSISDBHSA-N 1 1 361.348 2.502 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000411975384 512898979 /nfs/dbraw/zinc/89/89/79/512898979.db2.gz GTHGUABWDKJVFZ-GOSISDBHSA-N 1 1 361.348 2.502 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC000411990255 512904060 /nfs/dbraw/zinc/90/40/60/512904060.db2.gz VPJPSPBYSVWPAL-AEFFLSMTSA-N 1 1 372.421 2.878 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)nc1 ZINC000368345338 512908204 /nfs/dbraw/zinc/90/82/04/512908204.db2.gz TTXQAASTQKCYQY-IBGZPJMESA-N 1 1 353.426 2.877 20 5 FFBDMO C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000412017522 512912820 /nfs/dbraw/zinc/91/28/20/512912820.db2.gz ZVXFYNROHFGSCH-FHWLQOOXSA-N 1 1 358.442 2.810 20 5 FFBDMO COC(=O)[C@H]1CSCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000412071609 512942609 /nfs/dbraw/zinc/94/26/09/512942609.db2.gz JITKNIPXQUCQGR-CQSZACIVSA-N 1 1 368.455 2.720 20 5 FFBDMO COC(=O)[C@H]1CSCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000412071609 512942615 /nfs/dbraw/zinc/94/26/15/512942615.db2.gz JITKNIPXQUCQGR-CQSZACIVSA-N 1 1 368.455 2.720 20 5 FFBDMO C[N@H+]1CCCC12CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000368611244 513025876 /nfs/dbraw/zinc/02/58/76/513025876.db2.gz HQAZEMBFEPWLRT-UHFFFAOYSA-N 1 1 366.849 2.747 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c([N+](=O)[O-])cc1F ZINC000412317574 513036467 /nfs/dbraw/zinc/03/64/67/513036467.db2.gz OUDYKCZMHLQWPT-UHFFFAOYSA-N 1 1 365.405 2.691 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000374866689 513045984 /nfs/dbraw/zinc/04/59/84/513045984.db2.gz XAIJSQVVKWAJSS-IBGZPJMESA-N 1 1 373.384 2.656 20 5 FFBDMO Cc1nc(NC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450537434 513240923 /nfs/dbraw/zinc/24/09/23/513240923.db2.gz DKNIMFYMRNVJJY-KRWDZBQOSA-N 1 1 355.442 2.829 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428994676 513244541 /nfs/dbraw/zinc/24/45/41/513244541.db2.gz PJOYOFYKABARLM-QIIPPGSGSA-N 1 1 360.458 2.504 20 5 FFBDMO C[C@H](c1ccccc1)[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450566532 513253572 /nfs/dbraw/zinc/25/35/72/513253572.db2.gz KXYFLUQDTWFPPN-UWWQBHOKSA-N 1 1 356.426 2.641 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429023175 513259200 /nfs/dbraw/zinc/25/92/00/513259200.db2.gz DOXPTPZECWZEIZ-ATNYBXOESA-N 1 1 360.458 2.584 20 5 FFBDMO C[C@@H]1CN(c2ccc(Cl)c(F)c2)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000429032020 513261644 /nfs/dbraw/zinc/26/16/44/513261644.db2.gz VYFOHKVWVQNMRJ-GFCCVEGCSA-N 1 1 367.812 2.795 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000434419755 513318777 /nfs/dbraw/zinc/31/87/77/513318777.db2.gz BJIRCDDVNLOVKX-MRXNPFEDSA-N 1 1 369.425 2.527 20 5 FFBDMO Cn1c(CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nc2ccccc21 ZINC000440494247 513333215 /nfs/dbraw/zinc/33/32/15/513333215.db2.gz IGMNQVXQJNMFDF-AWEZNQCLSA-N 1 1 366.425 2.605 20 5 FFBDMO Cc1cc(NCCN2CC[N@H+](C)C(C)(C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000440651773 513370835 /nfs/dbraw/zinc/37/08/35/513370835.db2.gz QEWGYGWHMCQGLL-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO Cc1cc(NCC[N@H+]2CCN(C)C(C)(C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000440651773 513370838 /nfs/dbraw/zinc/37/08/38/513370838.db2.gz QEWGYGWHMCQGLL-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO Cc1cc(NCC[N@@H+]2CCN(C)C(C)(C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000440651773 513370842 /nfs/dbraw/zinc/37/08/42/513370842.db2.gz QEWGYGWHMCQGLL-UHFFFAOYSA-N 1 1 357.458 2.889 20 5 FFBDMO COCCO[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000447101478 513398727 /nfs/dbraw/zinc/39/87/27/513398727.db2.gz XKEBAFFYIDRKLY-DLBZAZTESA-N 1 1 366.458 2.564 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441191473 513508138 /nfs/dbraw/zinc/50/81/38/513508138.db2.gz BXIZPRVYZKVHGP-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1ccc(C[NH2+]Cc2ccncc2OCC(F)F)cc1[N+](=O)[O-] ZINC000441376128 513556247 /nfs/dbraw/zinc/55/62/47/513556247.db2.gz JKZZOUNWKPRGDR-UHFFFAOYSA-N 1 1 353.325 2.932 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425423249 513556229 /nfs/dbraw/zinc/55/62/29/513556229.db2.gz UDXYYNUNXVSOQL-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000425423249 513556233 /nfs/dbraw/zinc/55/62/33/513556233.db2.gz UDXYYNUNXVSOQL-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CN1CCOCC1)c1ccccc1 ZINC000430211499 513589203 /nfs/dbraw/zinc/58/92/03/513589203.db2.gz ALKCQPNCJHSXDR-LJQANCHMSA-N 1 1 371.437 2.767 20 5 FFBDMO Cc1c(CNC(=O)CC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000416223012 513654656 /nfs/dbraw/zinc/65/46/56/513654656.db2.gz DYIVOLSQCKRMKP-UHFFFAOYSA-N 1 1 353.422 2.968 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@H]3O)n2)cc1 ZINC000451426680 513743918 /nfs/dbraw/zinc/74/39/18/513743918.db2.gz VWTLGOUEYAYGRX-ARFHVFGLSA-N 1 1 358.398 2.770 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](Oc2ccccc2)C1 ZINC000419319162 513774290 /nfs/dbraw/zinc/77/42/90/513774290.db2.gz VPJPSPBYSVWPAL-FUHWJXTLSA-N 1 1 372.421 2.878 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562217 513834109 /nfs/dbraw/zinc/83/41/09/513834109.db2.gz IXEDDWXVNDLWNG-MLGOLLRUSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562217 513834114 /nfs/dbraw/zinc/83/41/14/513834114.db2.gz IXEDDWXVNDLWNG-MLGOLLRUSA-N 1 1 365.430 2.677 20 5 FFBDMO Cc1cc(NC(=O)CC[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000451569252 513840656 /nfs/dbraw/zinc/84/06/56/513840656.db2.gz OOYVPLUWLXXFPM-OAHLLOKOSA-N 1 1 358.398 2.521 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000426151166 513858910 /nfs/dbraw/zinc/85/89/10/513858910.db2.gz UYURCVZPVZHSOF-SNVBAGLBSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C(NCC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000426151166 513858914 /nfs/dbraw/zinc/85/89/14/513858914.db2.gz UYURCVZPVZHSOF-SNVBAGLBSA-N 1 1 365.739 2.749 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1F ZINC000448823618 513915967 /nfs/dbraw/zinc/91/59/67/513915967.db2.gz OYCLVNWPCCKFBL-LBPRGKRZSA-N 1 1 353.394 2.593 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CO)CC(C)(C)C ZINC000451780052 513975594 /nfs/dbraw/zinc/97/55/94/513975594.db2.gz MRLDKTZXDNKDSR-LBPRGKRZSA-N 1 1 357.838 2.916 20 5 FFBDMO COc1cc(C[N@@H+]2CCN(CC(F)(F)F)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000451877032 514039971 /nfs/dbraw/zinc/03/99/71/514039971.db2.gz CALPNTYNODNXCQ-GFCCVEGCSA-N 1 1 361.364 2.919 20 5 FFBDMO COc1cc(C[N@H+]2CCN(CC(F)(F)F)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000451877032 514039974 /nfs/dbraw/zinc/03/99/74/514039974.db2.gz CALPNTYNODNXCQ-GFCCVEGCSA-N 1 1 361.364 2.919 20 5 FFBDMO C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000432138358 514105149 /nfs/dbraw/zinc/10/51/49/514105149.db2.gz LBZFVSZTYOSWPT-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CCN1C1CC[NH+](C)CC1 ZINC000432138358 514105155 /nfs/dbraw/zinc/10/51/55/514105155.db2.gz LBZFVSZTYOSWPT-HNNXBMFYSA-N 1 1 369.469 2.748 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000420454739 514152482 /nfs/dbraw/zinc/15/24/82/514152482.db2.gz DORKLHLCAXOKHN-UHFFFAOYSA-N 1 1 361.423 2.510 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432322185 514158716 /nfs/dbraw/zinc/15/87/16/514158716.db2.gz YIRJJOITBOVXAD-AWEZNQCLSA-N 1 1 352.866 2.855 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCN2CCO[C@H]1C2 ZINC000449362661 514181849 /nfs/dbraw/zinc/18/18/49/514181849.db2.gz LPAIQKKUXYOXHM-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000420589081 514193694 /nfs/dbraw/zinc/19/36/94/514193694.db2.gz SPPQDEQBGPMDRF-OAHLLOKOSA-N 1 1 354.410 2.770 20 5 FFBDMO COC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000452106477 514194554 /nfs/dbraw/zinc/19/45/54/514194554.db2.gz QQXQKQVOUZDKGK-UONOGXRCSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1 ZINC000420602874 514196675 /nfs/dbraw/zinc/19/66/75/514196675.db2.gz OWQXDYKJQUIUHL-HUUCEWRRSA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000420639510 514211548 /nfs/dbraw/zinc/21/15/48/514211548.db2.gz QNGIJNANFGFNFG-HNNXBMFYSA-N 1 1 368.437 2.652 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)CC23CCOCC3)cn1 ZINC000449464183 514219448 /nfs/dbraw/zinc/21/94/48/514219448.db2.gz XXFGMCVRJLFQBH-HNNXBMFYSA-N 1 1 362.455 2.786 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nn(C)cc1Br ZINC000449483133 514225826 /nfs/dbraw/zinc/22/58/26/514225826.db2.gz GPRCQGKFEVIMII-JTQLQIEISA-N 1 1 353.220 2.812 20 5 FFBDMO C[C@H](NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000452183975 514236552 /nfs/dbraw/zinc/23/65/52/514236552.db2.gz QHXAVNSUJQHEIW-HNAYVOBHSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@H](NC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1)c1ccc([N+](=O)[O-])cc1 ZINC000452183975 514236559 /nfs/dbraw/zinc/23/65/59/514236559.db2.gz QHXAVNSUJQHEIW-HNAYVOBHSA-N 1 1 369.421 2.673 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449558871 514254957 /nfs/dbraw/zinc/25/49/57/514254957.db2.gz XEJBXNAGRUUYSY-GJYPPUQNSA-N 1 1 370.453 2.978 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)no1 ZINC000427603424 514262097 /nfs/dbraw/zinc/26/20/97/514262097.db2.gz UUYSIEWZUCULJS-UHFFFAOYSA-N 1 1 372.303 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](CCO)[C@H]3CCc4ccccc43)nc2c1 ZINC000444652357 514284935 /nfs/dbraw/zinc/28/49/35/514284935.db2.gz RNNSZKZSLZUGPR-SFHVURJKSA-N 1 1 352.394 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](CCO)[C@H]3CCc4ccccc43)nc2c1 ZINC000444652357 514284937 /nfs/dbraw/zinc/28/49/37/514284937.db2.gz RNNSZKZSLZUGPR-SFHVURJKSA-N 1 1 352.394 2.953 20 5 FFBDMO C[N@H+](Cc1cc(F)cc(F)c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000444697800 514297995 /nfs/dbraw/zinc/29/79/95/514297995.db2.gz ZAVWZGNFQACLAW-MRXNPFEDSA-N 1 1 352.337 2.745 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000444770174 514325143 /nfs/dbraw/zinc/32/51/43/514325143.db2.gz YRVHXMZMGCMUHI-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO CCC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccc(OCC)cc1[N+](=O)[O-] ZINC000444770174 514325148 /nfs/dbraw/zinc/32/51/48/514325148.db2.gz YRVHXMZMGCMUHI-SFHVURJKSA-N 1 1 365.430 2.559 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000432934560 514326951 /nfs/dbraw/zinc/32/69/51/514326951.db2.gz VIURVHPHDITJAC-UHFFFAOYSA-N 1 1 359.373 2.743 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000432934560 514326955 /nfs/dbraw/zinc/32/69/55/514326955.db2.gz VIURVHPHDITJAC-UHFFFAOYSA-N 1 1 359.373 2.743 20 5 FFBDMO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ncc(Br)cn1 ZINC000432988502 514341928 /nfs/dbraw/zinc/34/19/28/514341928.db2.gz JCSGCQLQUNFEIE-SNVBAGLBSA-N 1 1 367.203 2.877 20 5 FFBDMO CS(=O)(=O)c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000428543339 514494155 /nfs/dbraw/zinc/49/41/55/514494155.db2.gz WKPSZVGKBQWEMF-UHFFFAOYSA-N 1 1 354.815 2.942 20 5 FFBDMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470705409 514581547 /nfs/dbraw/zinc/58/15/47/514581547.db2.gz YHJGKODKLKXEMR-SFHVURJKSA-N 1 1 373.384 2.964 20 5 FFBDMO O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470705409 514581551 /nfs/dbraw/zinc/58/15/51/514581551.db2.gz YHJGKODKLKXEMR-SFHVURJKSA-N 1 1 373.384 2.964 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@](C)(C(N)=O)C3)o2)c([N+](=O)[O-])c1 ZINC000475664901 514752661 /nfs/dbraw/zinc/75/26/61/514752661.db2.gz AOVAOQGDYLUFCX-SFHVURJKSA-N 1 1 359.382 2.561 20 5 FFBDMO C[C@@H](C(=O)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1 ZINC000498140445 514776782 /nfs/dbraw/zinc/77/67/82/514776782.db2.gz NYRWQJYFJPLWJC-LRDDRELGSA-N 1 1 367.496 2.606 20 5 FFBDMO Cc1cc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cn2cc[nH+]c12 ZINC000502980033 514866963 /nfs/dbraw/zinc/86/69/63/514866963.db2.gz GUMRYLWQUFYKOL-UHFFFAOYSA-N 1 1 354.322 2.574 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](S(C)(=O)=O)CC1 ZINC000503074086 514907785 /nfs/dbraw/zinc/90/77/85/514907785.db2.gz KBPNVHAVFOKBNB-WKOYGUFESA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](S(C)(=O)=O)CC1 ZINC000503074086 514907796 /nfs/dbraw/zinc/90/77/96/514907796.db2.gz KBPNVHAVFOKBNB-WKOYGUFESA-N 1 1 352.456 2.897 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458621938 514962361 /nfs/dbraw/zinc/96/23/61/514962361.db2.gz DPCDRWXHWNBHKR-ZDUSSCGKSA-N 1 1 368.865 2.822 20 5 FFBDMO CC[C@H]1CCCC[N@@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467407788 514997894 /nfs/dbraw/zinc/99/78/94/514997894.db2.gz YBWRUNTXZBEZQV-LBPRGKRZSA-N 1 1 361.489 2.508 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000467407788 514997905 /nfs/dbraw/zinc/99/79/05/514997905.db2.gz YBWRUNTXZBEZQV-LBPRGKRZSA-N 1 1 361.489 2.508 20 5 FFBDMO CC[NH+](CC)CCO[C@@H]1CCN(Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490012927 515067986 /nfs/dbraw/zinc/06/79/86/515067986.db2.gz KFNRASDACANNFT-MRXNPFEDSA-N 1 1 351.447 2.536 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)C1 ZINC000462481511 515075176 /nfs/dbraw/zinc/07/51/76/515075176.db2.gz ASAQLWNEUWVSHD-MRXNPFEDSA-N 1 1 356.426 2.885 20 5 FFBDMO C[C@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCC[C@@H](C)C1 ZINC000485824629 515204282 /nfs/dbraw/zinc/20/42/82/515204282.db2.gz ZWSLRBVJPVKRQN-VXGBXAGGSA-N 1 1 355.385 2.652 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])c(N)n1 ZINC000509528479 515219324 /nfs/dbraw/zinc/21/93/24/515219324.db2.gz QPFZAXDJFCVSPR-OAHLLOKOSA-N 1 1 356.430 2.510 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)c1 ZINC000485878584 515231051 /nfs/dbraw/zinc/23/10/51/515231051.db2.gz YBLSXIIAQALGEU-IYWMVGAKSA-N 1 1 370.453 2.810 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000462776128 515237711 /nfs/dbraw/zinc/23/77/11/515237711.db2.gz DWOSZURTWAOTNI-YJBOKZPZSA-N 1 1 354.410 2.812 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)CCn3cc([N+](=O)[O-])cn3)cc2)c1C ZINC000462782505 515242728 /nfs/dbraw/zinc/24/27/28/515242728.db2.gz WHYNHUSJKRIDNJ-UHFFFAOYSA-N 1 1 354.370 2.623 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000509591625 515248058 /nfs/dbraw/zinc/24/80/58/515248058.db2.gz JXVBXULEXCNTCU-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000509591625 515248063 /nfs/dbraw/zinc/24/80/63/515248063.db2.gz JXVBXULEXCNTCU-NXEZZACHSA-N 1 1 370.247 2.830 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@]3(CCCOC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000477051874 515302829 /nfs/dbraw/zinc/30/28/29/515302829.db2.gz RBZSOYHJYGJXED-IEBWSBKVSA-N 1 1 359.426 2.593 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000486031901 515305083 /nfs/dbraw/zinc/30/50/83/515305083.db2.gz GLEUEZDBFCAFSS-KSSFIOAISA-N 1 1 366.425 2.995 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510845 515355548 /nfs/dbraw/zinc/35/55/48/515355548.db2.gz NTGCSIJXIZNIIR-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481510845 515355559 /nfs/dbraw/zinc/35/55/59/515355559.db2.gz NTGCSIJXIZNIIR-LRDDRELGSA-N 1 1 363.414 2.505 20 5 FFBDMO CC[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000499541463 515364478 /nfs/dbraw/zinc/36/44/78/515364478.db2.gz QRDROVBVLGWZJX-MRXNPFEDSA-N 1 1 368.437 2.744 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@H](C)c2ccncc2F)cc1[N+](=O)[O-] ZINC000509948470 515378769 /nfs/dbraw/zinc/37/87/69/515378769.db2.gz ISRQXFSFVDIIHH-LLVKDONJSA-N 1 1 363.345 2.532 20 5 FFBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 ZINC000510089589 515430491 /nfs/dbraw/zinc/43/04/91/515430491.db2.gz WXABREHIBCKDLP-RBUKOAKNSA-N 1 1 358.442 2.596 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736173 515446578 /nfs/dbraw/zinc/44/65/78/515446578.db2.gz MYFBBDAKYXLZOL-HOTGVXAUSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OCC ZINC000481736173 515446592 /nfs/dbraw/zinc/44/65/92/515446592.db2.gz MYFBBDAKYXLZOL-HOTGVXAUSA-N 1 1 366.414 2.536 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1O ZINC000459347179 515491831 /nfs/dbraw/zinc/49/18/31/515491831.db2.gz POSWQIJHKJUSTK-AWEZNQCLSA-N 1 1 358.398 2.781 20 5 FFBDMO Cn1cc(-c2ncc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])cn2)cn1 ZINC000492155490 515509081 /nfs/dbraw/zinc/50/90/81/515509081.db2.gz WBAMPQUKIYKMAG-UHFFFAOYSA-N 1 1 352.398 2.810 20 5 FFBDMO CN(C)[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000505445368 515536654 /nfs/dbraw/zinc/53/66/54/515536654.db2.gz JHCWSSOWWICXLF-INIZCTEOSA-N 1 1 363.801 2.987 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3OC)CC[NH2+]2)cc1 ZINC000505508876 515565702 /nfs/dbraw/zinc/56/57/02/515565702.db2.gz XXTWAINLJKKXLA-SFHVURJKSA-N 1 1 369.421 2.953 20 5 FFBDMO CCC[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1CCOC ZINC000492835972 515569242 /nfs/dbraw/zinc/56/92/42/515569242.db2.gz UJIMFDUCVUHQNR-MRXNPFEDSA-N 1 1 351.447 2.536 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500068218 515579037 /nfs/dbraw/zinc/57/90/37/515579037.db2.gz AHRZNYGSUFRLCZ-OAHLLOKOSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)OC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500068218 515579046 /nfs/dbraw/zinc/57/90/46/515579046.db2.gz AHRZNYGSUFRLCZ-OAHLLOKOSA-N 1 1 363.414 2.730 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000500122176 515598379 /nfs/dbraw/zinc/59/83/79/515598379.db2.gz OALMKLUFYQOBMM-RYUDHWBXSA-N 1 1 367.471 2.880 20 5 FFBDMO C[NH+]1CCC(O)(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000493246877 515614324 /nfs/dbraw/zinc/61/43/24/515614324.db2.gz JPZFOMHSHYKQOL-LJQANCHMSA-N 1 1 355.438 2.731 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000494068635 515723553 /nfs/dbraw/zinc/72/35/53/515723553.db2.gz JAFNWAUNPSJCKU-YOEHRIQHSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000494070187 515727113 /nfs/dbraw/zinc/72/71/13/515727113.db2.gz VOEDGIWECGYNNV-HNAYVOBHSA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929498 515727588 /nfs/dbraw/zinc/72/75/88/515727588.db2.gz DOCMPUOMVGAASJ-XJKSGUPXSA-N 1 1 355.394 2.866 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000505929498 515727594 /nfs/dbraw/zinc/72/75/94/515727594.db2.gz DOCMPUOMVGAASJ-XJKSGUPXSA-N 1 1 355.394 2.866 20 5 FFBDMO CC[N@@H+](CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000487035142 515728917 /nfs/dbraw/zinc/72/89/17/515728917.db2.gz UKDICOBJGYWZNW-UHFFFAOYSA-N 1 1 354.838 2.574 20 5 FFBDMO CCC1(CC)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCS1 ZINC000464589556 515884686 /nfs/dbraw/zinc/88/46/86/515884686.db2.gz YSGPKSIITGIMNK-HNNXBMFYSA-N 1 1 354.472 2.942 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NCc1c([N+](=O)[O-])ncn1C ZINC000469764073 515955948 /nfs/dbraw/zinc/95/59/48/515955948.db2.gz NDDBUGOJRHNKQJ-HWWDLCQESA-N 1 1 357.458 2.575 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000488028081 516085983 /nfs/dbraw/zinc/08/59/83/516085983.db2.gz SGOHGLFXGBDLPN-RLFYNMQTSA-N 1 1 360.458 2.509 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N(C)CC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000474564503 516097444 /nfs/dbraw/zinc/09/74/44/516097444.db2.gz TZPSEJBHPHFXPL-OAHLLOKOSA-N 1 1 374.485 2.997 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000488075354 516106800 /nfs/dbraw/zinc/10/68/00/516106800.db2.gz OKSGYIPEDQKAIL-CABCVRRESA-N 1 1 366.849 2.717 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000470114481 516126527 /nfs/dbraw/zinc/12/65/27/516126527.db2.gz LESBSXBXWCTOAS-TXEJJXNPSA-N 1 1 368.409 2.743 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000470114481 516126536 /nfs/dbraw/zinc/12/65/36/516126536.db2.gz LESBSXBXWCTOAS-TXEJJXNPSA-N 1 1 368.409 2.743 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000470170582 516160020 /nfs/dbraw/zinc/16/00/20/516160020.db2.gz XLDKBAZJJWKQKN-QIPRVMPFSA-N 1 1 373.453 2.569 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1CCOC ZINC000501596650 516166898 /nfs/dbraw/zinc/16/68/98/516166898.db2.gz ZEDCGJGKSWCMAP-HNNXBMFYSA-N 1 1 374.441 2.649 20 5 FFBDMO CCOc1cc(N2CC[NH+](CCOCC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000501848683 516242562 /nfs/dbraw/zinc/24/25/62/516242562.db2.gz FLPRCUUEOYKAFH-UHFFFAOYSA-N 1 1 351.447 2.788 20 5 FFBDMO CC(C)(C)[C@@H](C[N@H+]1CCc2ccccc2C1)NC(=O)c1cc([N+](=O)[O-])n[nH]1 ZINC000507688769 516284010 /nfs/dbraw/zinc/28/40/10/516284010.db2.gz OVKLOUQDGKSZKT-MRXNPFEDSA-N 1 1 371.441 2.521 20 5 FFBDMO CCOC(=O)c1cc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000488741185 516298015 /nfs/dbraw/zinc/29/80/15/516298015.db2.gz BLZCGOZKVSEBHT-QWQRMKEZSA-N 1 1 361.442 2.938 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](CC(C)C)C2)n1 ZINC000557639234 516351147 /nfs/dbraw/zinc/35/11/47/516351147.db2.gz KTSGVSDCVODPAX-CYBMUJFWSA-N 1 1 350.419 2.556 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000535659935 516440365 /nfs/dbraw/zinc/44/03/65/516440365.db2.gz QRGJTCBJISGUTH-GDBMZVCRSA-N 1 1 362.817 2.762 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000535659935 516440372 /nfs/dbraw/zinc/44/03/72/516440372.db2.gz QRGJTCBJISGUTH-GDBMZVCRSA-N 1 1 362.817 2.762 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544072357 516568163 /nfs/dbraw/zinc/56/81/63/516568163.db2.gz VCPAIHQGOYAHRG-ZTFGCOKTSA-N 1 1 366.458 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000558230092 516658351 /nfs/dbraw/zinc/65/83/51/516658351.db2.gz PZXNVCQCOFJEQN-UHFFFAOYSA-N 1 1 370.409 2.952 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[NH+](Cc4ccsc4)CC3)c21 ZINC000544394124 516740274 /nfs/dbraw/zinc/74/02/74/516740274.db2.gz KTJKSFYWGICRFG-UHFFFAOYSA-N 1 1 355.423 2.922 20 5 FFBDMO Cc1cccc(NCCNc2ncc([N+](=O)[O-])c(C)c2Br)[nH+]1 ZINC000544394964 516740359 /nfs/dbraw/zinc/74/03/59/516740359.db2.gz SFWMFJYNEAUORW-UHFFFAOYSA-N 1 1 366.219 2.710 20 5 FFBDMO Cc1c([C@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cnn1-c1ccc(F)cc1 ZINC000544434231 516758646 /nfs/dbraw/zinc/75/86/46/516758646.db2.gz UJVZNCLBGYZKSD-NSHDSACASA-N 1 1 358.377 2.812 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000558562479 516810807 /nfs/dbraw/zinc/81/08/07/516810807.db2.gz NENAJSPLENJEIQ-CYBMUJFWSA-N 1 1 362.817 2.674 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000541025123 516835939 /nfs/dbraw/zinc/83/59/39/516835939.db2.gz DJNSFGOSPYZQID-SNVBAGLBSA-N 1 1 355.341 2.576 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000525105566 516918861 /nfs/dbraw/zinc/91/88/61/516918861.db2.gz IYQRQKQRTFHKTD-GMXVVIOVSA-N 1 1 355.822 2.614 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@H+](C(C)C)CC2 ZINC000541271311 516961736 /nfs/dbraw/zinc/96/17/36/516961736.db2.gz CCDAYNOMPZMGMV-UHFFFAOYSA-N 1 1 361.427 2.774 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[N@@H+](C(C)C)CC2 ZINC000541271311 516961748 /nfs/dbraw/zinc/96/17/48/516961748.db2.gz CCDAYNOMPZMGMV-UHFFFAOYSA-N 1 1 361.427 2.774 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000525291264 516995019 /nfs/dbraw/zinc/99/50/19/516995019.db2.gz BOQVESYHISDJST-INIZCTEOSA-N 1 1 363.461 2.613 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000562272870 517000187 /nfs/dbraw/zinc/00/01/87/517000187.db2.gz JGYWQCVJRCKRHM-GOSISDBHSA-N 1 1 373.457 2.600 20 5 FFBDMO CCO[C@H]1C[C@H]1[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000514707987 517013509 /nfs/dbraw/zinc/01/35/09/517013509.db2.gz HSKTULGYGPXBEU-PWSUYJOCSA-N 1 1 364.320 2.812 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@H]1C ZINC000525396031 517028419 /nfs/dbraw/zinc/02/84/19/517028419.db2.gz KRAKLPRVNUDROD-RDTXWAMCSA-N 1 1 371.441 2.725 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000552190220 517132243 /nfs/dbraw/zinc/13/22/43/517132243.db2.gz CWKCLRQDWNYIFS-ZIAGYGMSSA-N 1 1 350.415 2.861 20 5 FFBDMO CNC(=O)[C@H](Cc1c[nH]c2ccccc12)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000537315561 517141696 /nfs/dbraw/zinc/14/16/96/517141696.db2.gz KGFHMEUAQFGWHI-HNNXBMFYSA-N 1 1 358.423 2.585 20 5 FFBDMO CC1(C)C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]2CCC[C@H]21 ZINC000559424971 517248308 /nfs/dbraw/zinc/24/83/08/517248308.db2.gz FTPIHDLQBCLCLL-DGCLKSJQSA-N 1 1 361.398 2.773 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3c[nH]nc3-c3ccsc3)CC2)cn1 ZINC000526114343 517351250 /nfs/dbraw/zinc/35/12/50/517351250.db2.gz COLPUOQFVNGVSG-UHFFFAOYSA-N 1 1 370.438 2.764 20 5 FFBDMO C[N@H+]1CC[C@@H](c2nc(Cc3ccc([N+](=O)[O-])cc3Br)no2)C1 ZINC000545762749 517359086 /nfs/dbraw/zinc/35/90/86/517359086.db2.gz PYIWRHFHAQMJOL-SNVBAGLBSA-N 1 1 367.203 2.750 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000516158266 517591734 /nfs/dbraw/zinc/59/17/34/517591734.db2.gz SEKFVQXAAWWZHE-KBPBESRZSA-N 1 1 364.446 2.666 20 5 FFBDMO COC(=O)CC1CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000553254263 517604649 /nfs/dbraw/zinc/60/46/49/517604649.db2.gz TWLOXJJJGPESCN-CYBMUJFWSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCC[C@H](C)C1 ZINC000533823974 517629937 /nfs/dbraw/zinc/62/99/37/517629937.db2.gz CKCFWNCEUNXKAI-LSDHHAIUSA-N 1 1 360.458 2.783 20 5 FFBDMO CCc1nn(C)c(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000553337503 517653041 /nfs/dbraw/zinc/65/30/41/517653041.db2.gz LOTLBPDULMQNOE-FQEVSTJZSA-N 1 1 369.469 2.993 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000549813501 517723735 /nfs/dbraw/zinc/72/37/35/517723735.db2.gz OZIGVOJUDQLXLP-GJZGRUSLSA-N 1 1 360.385 2.963 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000521670965 517821122 /nfs/dbraw/zinc/82/11/22/517821122.db2.gz CPTNZLOLAIQJRK-BETUJISGSA-N 1 1 365.430 2.605 20 5 FFBDMO Cc1ccc(CC[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000550113435 517867353 /nfs/dbraw/zinc/86/73/53/517867353.db2.gz YPUJQECVIDBMOU-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO C[C@@H]1C[C@@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000560524577 517872213 /nfs/dbraw/zinc/87/22/13/517872213.db2.gz GWANERQKUTYDLY-SIIHOXLZSA-N 1 1 355.442 2.633 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000560538850 517880652 /nfs/dbraw/zinc/88/06/52/517880652.db2.gz USGRNJOKOSOFQH-UHFFFAOYSA-N 1 1 374.441 2.605 20 5 FFBDMO CCc1nc(C[NH+]2CCC(CNc3c([N+](=O)[O-])ncn3C)CC2)cs1 ZINC000521971946 517925025 /nfs/dbraw/zinc/92/50/25/517925025.db2.gz SBYJKHWKNXAQOM-UHFFFAOYSA-N 1 1 364.475 2.671 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000522032432 517958769 /nfs/dbraw/zinc/95/87/69/517958769.db2.gz CEBDEQJEADLYJY-UHFFFAOYSA-N 1 1 364.490 2.506 20 5 FFBDMO CN(CCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)CC[NH+](C)C ZINC000522032432 517958773 /nfs/dbraw/zinc/95/87/73/517958773.db2.gz CEBDEQJEADLYJY-UHFFFAOYSA-N 1 1 364.490 2.506 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](OCc3c(C)noc3C)C2)ccc1[N+](=O)[O-] ZINC000547295066 518061773 /nfs/dbraw/zinc/06/17/73/518061773.db2.gz RZASKNJXEZEICX-OAHLLOKOSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](OCc3c(C)noc3C)C2)ccc1[N+](=O)[O-] ZINC000547295066 518061786 /nfs/dbraw/zinc/06/17/86/518061786.db2.gz RZASKNJXEZEICX-OAHLLOKOSA-N 1 1 361.398 2.999 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000534996024 518111806 /nfs/dbraw/zinc/11/18/06/518111806.db2.gz JYIQSPWLHBDZSX-INIZCTEOSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000534996024 518111814 /nfs/dbraw/zinc/11/18/14/518111814.db2.gz JYIQSPWLHBDZSX-INIZCTEOSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000535274537 518172609 /nfs/dbraw/zinc/17/26/09/518172609.db2.gz GDVNNKNXQNMFHB-KRWDZBQOSA-N 1 1 357.435 2.990 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000535274537 518172611 /nfs/dbraw/zinc/17/26/11/518172611.db2.gz GDVNNKNXQNMFHB-KRWDZBQOSA-N 1 1 357.435 2.990 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCCC[C@@H]1C ZINC000535282375 518173055 /nfs/dbraw/zinc/17/30/55/518173055.db2.gz VVUAHSCYWNADNB-GJZGRUSLSA-N 1 1 360.458 2.925 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c([N+](=O)[O-])c1 ZINC000584409122 518327178 /nfs/dbraw/zinc/32/71/78/518327178.db2.gz LYJSKNOPMKYMCL-ZBFHGGJFSA-N 1 1 350.415 2.873 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000567207133 518405259 /nfs/dbraw/zinc/40/52/59/518405259.db2.gz GWXOAQIESFZKPX-KGLIPLIRSA-N 1 1 373.457 2.743 20 5 FFBDMO COc1c(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000576079677 518417363 /nfs/dbraw/zinc/41/73/63/518417363.db2.gz YBXDLSSHPKUQOZ-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)c1 ZINC000581846484 518465409 /nfs/dbraw/zinc/46/54/09/518465409.db2.gz UHRDXZHNIPNCRF-UHFFFAOYSA-N 1 1 372.425 2.593 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000579035610 518489404 /nfs/dbraw/zinc/48/94/04/518489404.db2.gz AEMZLPXIYYGBTG-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000579035610 518489407 /nfs/dbraw/zinc/48/94/07/518489407.db2.gz AEMZLPXIYYGBTG-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C[C@@H]1C ZINC000585701119 518566076 /nfs/dbraw/zinc/56/60/76/518566076.db2.gz GJENLNDYZQSYIK-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C[C@@H]1C ZINC000585701119 518566081 /nfs/dbraw/zinc/56/60/81/518566081.db2.gz GJENLNDYZQSYIK-JTQLQIEISA-N 1 1 370.247 2.832 20 5 FFBDMO C[NH+]1CCC([C@H]2CCN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)CC1 ZINC000589199408 518949440 /nfs/dbraw/zinc/94/94/40/518949440.db2.gz HYJWSAWPCLDAEO-HNNXBMFYSA-N 1 1 361.442 2.530 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCCC[C@H]1C ZINC000565502242 518987614 /nfs/dbraw/zinc/98/76/14/518987614.db2.gz ABTQXLHMEPZTKM-NEPJUHHUSA-N 1 1 355.385 2.795 20 5 FFBDMO CCCC[C@H](C(=O)Nc1cc(C)on1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565544991 519010081 /nfs/dbraw/zinc/01/00/81/519010081.db2.gz PTNKTZWULQBNLU-QGZVFWFLSA-N 1 1 374.441 2.985 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000577341618 519029747 /nfs/dbraw/zinc/02/97/47/519029747.db2.gz FRNLBBRFKVITJG-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000577341618 519029755 /nfs/dbraw/zinc/02/97/55/519029755.db2.gz FRNLBBRFKVITJG-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1 ZINC000589581606 519034596 /nfs/dbraw/zinc/03/45/96/519034596.db2.gz QWWKIFOGMHKYID-INIZCTEOSA-N 1 1 356.426 2.955 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(=O)OC)c2Cl)C1 ZINC000590578798 519272989 /nfs/dbraw/zinc/27/29/89/519272989.db2.gz RPUGSCIIDVFILR-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO CC1=CC[N@@H+](CCN[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000568990078 519320374 /nfs/dbraw/zinc/32/03/74/519320374.db2.gz CSIQIFVBLAHYHR-GOSISDBHSA-N 1 1 355.442 2.659 20 5 FFBDMO Cc1ccc(NCCCNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000569147153 519400038 /nfs/dbraw/zinc/40/00/38/519400038.db2.gz XIYWYZINECGVFB-UHFFFAOYSA-N 1 1 356.426 2.616 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)CC1 ZINC000569149538 519402463 /nfs/dbraw/zinc/40/24/63/519402463.db2.gz MOEKGFSCCHVWRZ-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO CCOc1ccc(C(=O)Nc2c[nH+]ccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000566342203 519442488 /nfs/dbraw/zinc/44/24/88/519442488.db2.gz ALZLEHXWDZPNLQ-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](Nc2c([N+](=O)[O-])nc(C)n2CC)[C@@H](C)C1 ZINC000578159844 519450581 /nfs/dbraw/zinc/45/05/81/519450581.db2.gz ZHYLNGBDGGEDOG-ZFWWWQNUSA-N 1 1 353.467 2.669 20 5 FFBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000591019691 519479300 /nfs/dbraw/zinc/47/93/00/519479300.db2.gz VLYYUYFSSMNPQE-MRXNPFEDSA-N 1 1 357.414 2.666 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000581085225 519516764 /nfs/dbraw/zinc/51/67/64/519516764.db2.gz GQNQZAMNRASCOG-SFHVURJKSA-N 1 1 370.405 2.595 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000581085225 519516770 /nfs/dbraw/zinc/51/67/70/519516770.db2.gz GQNQZAMNRASCOG-SFHVURJKSA-N 1 1 370.405 2.595 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(C(F)(F)F)c1 ZINC000591138783 519526872 /nfs/dbraw/zinc/52/68/72/519526872.db2.gz RPWZYPJMPUPHBZ-ZDUSSCGKSA-N 1 1 374.363 2.700 20 5 FFBDMO CC[N@@H+](CCNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000584075339 519577605 /nfs/dbraw/zinc/57/76/05/519577605.db2.gz CJFKFGKBQHVZKW-UHFFFAOYSA-N 1 1 361.446 2.648 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@H]2CCC[N@@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594551507 520022867 /nfs/dbraw/zinc/02/28/67/520022867.db2.gz FLTBQCAUUYHFLJ-QILLFSRXSA-N 1 1 360.458 2.837 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-] ZINC000594551507 520022871 /nfs/dbraw/zinc/02/28/71/520022871.db2.gz FLTBQCAUUYHFLJ-QILLFSRXSA-N 1 1 360.458 2.837 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1N(C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000594575566 520035659 /nfs/dbraw/zinc/03/56/59/520035659.db2.gz KMEQARLHSVAUNL-FQEVSTJZSA-N 1 1 371.437 2.677 20 5 FFBDMO O=[N+]([O-])c1cc2c(nc1N1CCC[N@@H+](C[C@@H]3CCCO3)CC1)CCCC2 ZINC000591895809 520073559 /nfs/dbraw/zinc/07/35/59/520073559.db2.gz CLZUICORNRYWNN-INIZCTEOSA-N 1 1 360.458 2.560 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)ccc1[N+](=O)[O-] ZINC000597574911 520112648 /nfs/dbraw/zinc/11/26/48/520112648.db2.gz IVBIASRDWMOPEL-GJZGRUSLSA-N 1 1 365.405 2.640 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000594793941 520161270 /nfs/dbraw/zinc/16/12/70/520161270.db2.gz WUTUVIZDBSJQCT-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000609075646 520185972 /nfs/dbraw/zinc/18/59/72/520185972.db2.gz MSWTZZJQLFEWRW-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000609157387 520212880 /nfs/dbraw/zinc/21/28/80/520212880.db2.gz HSWIFQRRJYJSOE-OAHLLOKOSA-N 1 1 357.414 2.765 20 5 FFBDMO COc1ccccc1C1([NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000592143131 520221076 /nfs/dbraw/zinc/22/10/76/520221076.db2.gz QZIRZZIEFASZLI-UHFFFAOYSA-N 1 1 355.394 2.845 20 5 FFBDMO COc1cc(C[NH2+][C@H](C)CN2CCC(C)CC2)c([N+](=O)[O-])cc1OC ZINC000594979856 520240552 /nfs/dbraw/zinc/24/05/52/520240552.db2.gz MNCJJTGEZUIXLI-CQSZACIVSA-N 1 1 351.447 2.822 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000603402034 520250050 /nfs/dbraw/zinc/25/00/50/520250050.db2.gz LSHBFUXXDUYSOV-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccnc1N1CCOCC1 ZINC000595005956 520253028 /nfs/dbraw/zinc/25/30/28/520253028.db2.gz CDBDJIIAOPVSBM-CQSZACIVSA-N 1 1 372.425 2.686 20 5 FFBDMO Cc1ccncc1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000595072093 520281463 /nfs/dbraw/zinc/28/14/63/520281463.db2.gz FGKNUDFQIGZHIS-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000597859592 520285961 /nfs/dbraw/zinc/28/59/61/520285961.db2.gz VSGYGINELXBMJD-MRXNPFEDSA-N 1 1 374.485 2.800 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294922 520392490 /nfs/dbraw/zinc/39/24/90/520392490.db2.gz UPZMZDSDCGQORJ-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294922 520392504 /nfs/dbraw/zinc/39/25/04/520392504.db2.gz UPZMZDSDCGQORJ-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294922 520392512 /nfs/dbraw/zinc/39/25/12/520392512.db2.gz UPZMZDSDCGQORJ-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492969 520416610 /nfs/dbraw/zinc/41/66/10/520416610.db2.gz JVAUFIOWCXKHLM-HZPDHXFCSA-N 1 1 360.458 2.553 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](c2ccco2)C1 ZINC000609767260 520425781 /nfs/dbraw/zinc/42/57/81/520425781.db2.gz OQAHDGFANMPEEX-ZDUSSCGKSA-N 1 1 357.366 2.975 20 5 FFBDMO Cc1noc(C[NH+]2CCC(C(=O)N3CCc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595361979 520431391 /nfs/dbraw/zinc/43/13/91/520431391.db2.gz FELSJGFEXOKWEY-UHFFFAOYSA-N 1 1 370.409 2.693 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604198966 520483291 /nfs/dbraw/zinc/48/32/91/520483291.db2.gz NCPBBWDWEGDPGM-BFYDXBDKSA-N 1 1 374.485 2.901 20 5 FFBDMO CCOc1cc(N2CC[NH+](CCO[C@@H]3CC3(F)F)CC2)ccc1[N+](=O)[O-] ZINC000595464087 520487998 /nfs/dbraw/zinc/48/79/98/520487998.db2.gz GKOLALCDSSBWDP-MRXNPFEDSA-N 1 1 371.384 2.540 20 5 FFBDMO Nc1n[nH]c(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)n1 ZINC000595488203 520503705 /nfs/dbraw/zinc/50/37/05/520503705.db2.gz FFDXEABCPJLVKR-UHFFFAOYSA-N 1 1 370.335 2.524 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505522 520514118 /nfs/dbraw/zinc/51/41/18/520514118.db2.gz VOGAPSXVLLCXER-BEFAXECRSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610065066 520521968 /nfs/dbraw/zinc/52/19/68/520521968.db2.gz GYRPIAWTIGGAQI-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000595536196 520534699 /nfs/dbraw/zinc/53/46/99/520534699.db2.gz OPILITPXVQUEKE-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595584471 520570475 /nfs/dbraw/zinc/57/04/75/520570475.db2.gz GLQLXVSSJLMBIU-AWEZNQCLSA-N 1 1 368.865 2.963 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000595629398 520604835 /nfs/dbraw/zinc/60/48/35/520604835.db2.gz OQAXSHPXCOMRQK-OLZOCXBDSA-N 1 1 360.332 2.811 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000592879816 520630003 /nfs/dbraw/zinc/63/00/03/520630003.db2.gz DTTDTZKPRAAFNR-SJORKVTESA-N 1 1 368.437 2.712 20 5 FFBDMO COc1ccc(NC(=O)CC[NH2+][C@H](C)c2cscn2)c([N+](=O)[O-])c1 ZINC000595668704 520634587 /nfs/dbraw/zinc/63/45/87/520634587.db2.gz OPDWGYGNFOXPSM-SNVBAGLBSA-N 1 1 350.400 2.739 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC2(CCC2)OC[C@@H]1C ZINC000595684063 520646583 /nfs/dbraw/zinc/64/65/83/520646583.db2.gz ZXGKIWXTBBCNLH-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC2)c1 ZINC000593014173 520684622 /nfs/dbraw/zinc/68/46/22/520684622.db2.gz WAQUDCIBMKPOMZ-UHFFFAOYSA-N 1 1 371.412 2.929 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C2(O)CC2)CC1 ZINC000593049296 520708209 /nfs/dbraw/zinc/70/82/09/520708209.db2.gz KRJMDTPJJRMNKM-LBPRGKRZSA-N 1 1 358.398 2.943 20 5 FFBDMO CC(C)O[C@H]1CCC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1 ZINC000593054493 520712027 /nfs/dbraw/zinc/71/20/27/520712027.db2.gz FADJHBWHWBDOON-HNNXBMFYSA-N 1 1 363.414 2.782 20 5 FFBDMO CC[C@@H]1COC(C)(C)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000593056652 520714138 /nfs/dbraw/zinc/71/41/38/520714138.db2.gz MNXHFGHDZQMWFB-CYBMUJFWSA-N 1 1 365.430 2.821 20 5 FFBDMO C[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2(CCC2)CO1 ZINC000593092364 520741477 /nfs/dbraw/zinc/74/14/77/520741477.db2.gz NKBDOUARLGUWOO-ZDUSSCGKSA-N 1 1 361.398 2.536 20 5 FFBDMO C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C2(CCC2)CO1 ZINC000593092364 520741479 /nfs/dbraw/zinc/74/14/79/520741479.db2.gz NKBDOUARLGUWOO-ZDUSSCGKSA-N 1 1 361.398 2.536 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)[C@H](C)C1 ZINC000598612511 520743005 /nfs/dbraw/zinc/74/30/05/520743005.db2.gz QABNONDTEPFOBP-HIFRSBDPSA-N 1 1 369.487 2.562 20 5 FFBDMO COC(=O)c1ccnc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000598614582 520743443 /nfs/dbraw/zinc/74/34/43/520743443.db2.gz LTOAOYBEIWCOPI-BBRMVZONSA-N 1 1 370.409 2.709 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc([S@](C)=O)cc2)c([N+](=O)[O-])cc1OC ZINC000610574827 520744859 /nfs/dbraw/zinc/74/48/59/520744859.db2.gz KNFUDDIXUVKMGD-VWLOTQADSA-N 1 1 364.423 2.639 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCOc3ccc(O)cc3C2)cccc1[N+](=O)[O-] ZINC000595843829 520759124 /nfs/dbraw/zinc/75/91/24/520759124.db2.gz CVRUZQFYJRBGDQ-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCOc3ccc(O)cc3C2)cccc1[N+](=O)[O-] ZINC000595843829 520759133 /nfs/dbraw/zinc/75/91/33/520759133.db2.gz CVRUZQFYJRBGDQ-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595851159 520767486 /nfs/dbraw/zinc/76/74/86/520767486.db2.gz OTBPSBFKRAPRAD-OAHLLOKOSA-N 1 1 372.425 2.986 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000595851159 520767494 /nfs/dbraw/zinc/76/74/94/520767494.db2.gz OTBPSBFKRAPRAD-OAHLLOKOSA-N 1 1 372.425 2.986 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CC1=CCSC1 ZINC000595889059 520795703 /nfs/dbraw/zinc/79/57/03/520795703.db2.gz RJLJYQHOMWEKEL-UHFFFAOYSA-N 1 1 351.428 2.537 20 5 FFBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(=O)Nc1ccccc1C ZINC000610703114 520804786 /nfs/dbraw/zinc/80/47/86/520804786.db2.gz WJIBAZAARCYGOI-UHFFFAOYSA-N 1 1 359.430 2.759 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC000595916022 520821335 /nfs/dbraw/zinc/82/13/35/520821335.db2.gz KTXZGVAFIVZSCA-PXAZEXFGSA-N 1 1 371.384 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@](C)(C(F)F)C1 ZINC000595916022 520821341 /nfs/dbraw/zinc/82/13/41/520821341.db2.gz KTXZGVAFIVZSCA-PXAZEXFGSA-N 1 1 371.384 2.976 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNc1cc(N)c([N+](=O)[O-])c(CO)c1)C1CC1 ZINC000614153757 520827803 /nfs/dbraw/zinc/82/78/03/520827803.db2.gz VDTNJQOYHXFBQS-LJQANCHMSA-N 1 1 370.453 2.992 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C2)C1 ZINC000601602029 520862384 /nfs/dbraw/zinc/86/23/84/520862384.db2.gz FVZZVMICUVYFJE-IBGZPJMESA-N 1 1 357.454 2.961 20 5 FFBDMO COc1ccc(OCC[NH+]2CC(c3nc4ccccc4[nH]3)C2)c([N+](=O)[O-])c1 ZINC000610844795 520867847 /nfs/dbraw/zinc/86/78/47/520867847.db2.gz YZJWMXBALDCRAO-UHFFFAOYSA-N 1 1 368.393 2.958 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1 ZINC000596039697 520872420 /nfs/dbraw/zinc/87/24/20/520872420.db2.gz RZXGQVCDWCCLEX-MJGOQNOKSA-N 1 1 369.421 2.957 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC3(CCC3)[C@@H]2c2ccncc2)c1 ZINC000596039697 520872429 /nfs/dbraw/zinc/87/24/29/520872429.db2.gz RZXGQVCDWCCLEX-MJGOQNOKSA-N 1 1 369.421 2.957 20 5 FFBDMO NC(=O)c1cc(N2CC[NH+](C/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000596055095 520881616 /nfs/dbraw/zinc/88/16/16/520881616.db2.gz DKDHZASUMZJPLW-QPJJXVBHSA-N 1 1 366.421 2.529 20 5 FFBDMO COC(=O)c1c(Cl)c(NC[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000596079596 520899176 /nfs/dbraw/zinc/89/91/76/520899176.db2.gz UBCUEZRNKCCSID-SNVBAGLBSA-N 1 1 353.806 2.931 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596127021 520929703 /nfs/dbraw/zinc/92/97/03/520929703.db2.gz SOULVUBANZLBNL-GJZGRUSLSA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596140015 520934270 /nfs/dbraw/zinc/93/42/70/520934270.db2.gz AMLQPHFKMMACSR-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000596200618 520968010 /nfs/dbraw/zinc/96/80/10/520968010.db2.gz NGPYWRNTANGSKQ-VIFPVBQESA-N 1 1 350.762 2.658 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088200 520979334 /nfs/dbraw/zinc/97/93/34/520979334.db2.gz JJFJFIKISMFWLI-HOTGVXAUSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000611088200 520979342 /nfs/dbraw/zinc/97/93/42/520979342.db2.gz JJFJFIKISMFWLI-HOTGVXAUSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)Nc1ccccc1 ZINC000618287149 520980691 /nfs/dbraw/zinc/98/06/91/520980691.db2.gz IEISRNGSBDKCTC-UHFFFAOYSA-N 1 1 353.382 2.978 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-] ZINC000596238903 520988888 /nfs/dbraw/zinc/98/88/88/520988888.db2.gz RDEORDPMLWVQQB-MRVPVSSYSA-N 1 1 350.762 2.727 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000596238903 520988893 /nfs/dbraw/zinc/98/88/93/520988893.db2.gz RDEORDPMLWVQQB-MRVPVSSYSA-N 1 1 350.762 2.727 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)s1 ZINC000593496323 521031565 /nfs/dbraw/zinc/03/15/65/521031565.db2.gz NZMWOXOSKOPVTL-GJZGRUSLSA-N 1 1 360.439 2.531 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000599125546 521042648 /nfs/dbraw/zinc/04/26/48/521042648.db2.gz BHRRNBRFNJKGMH-DLBZAZTESA-N 1 1 369.421 2.565 20 5 FFBDMO COc1cc(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)ccc1[N+](=O)[O-] ZINC000596423629 521062278 /nfs/dbraw/zinc/06/22/78/521062278.db2.gz MYEHOPZBWDRGNN-KRWDZBQOSA-N 1 1 357.410 2.782 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000593545677 521066233 /nfs/dbraw/zinc/06/62/33/521066233.db2.gz XTIAQGGUOUQGOT-WMLDXEAASA-N 1 1 361.417 2.752 20 5 FFBDMO Cc1ccc(CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000593594289 521097537 /nfs/dbraw/zinc/09/75/37/521097537.db2.gz QMDJTQXPKSCLBU-UHFFFAOYSA-N 1 1 372.400 2.896 20 5 FFBDMO COC[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000611518607 521197323 /nfs/dbraw/zinc/19/73/23/521197323.db2.gz PVWLBCJCEQCQDJ-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO COC[C@@H]1CCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000611518607 521197329 /nfs/dbraw/zinc/19/73/29/521197329.db2.gz PVWLBCJCEQCQDJ-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](OC(F)F)C2)cccc1[N+](=O)[O-] ZINC000611580112 521234152 /nfs/dbraw/zinc/23/41/52/521234152.db2.gz QXSOCSATOBFDDT-GFCCVEGCSA-N 1 1 357.357 2.935 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000599463573 521240585 /nfs/dbraw/zinc/24/05/85/521240585.db2.gz GIXSSWOSWNMZMG-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000611711660 521293248 /nfs/dbraw/zinc/29/32/48/521293248.db2.gz NMSYUIMKLUPZEA-FZKQIMNGSA-N 1 1 353.426 2.991 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000596828957 521315406 /nfs/dbraw/zinc/31/54/06/521315406.db2.gz OUWKNHYMRYAOTM-MRXNPFEDSA-N 1 1 370.409 2.999 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)C2(CCCCC2)C1 ZINC000593997930 521337868 /nfs/dbraw/zinc/33/78/68/521337868.db2.gz DRMUXMCLSVSJCI-OAHLLOKOSA-N 1 1 360.458 2.872 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000593997742 521338275 /nfs/dbraw/zinc/33/82/75/521338275.db2.gz NMGMGGPYYLKGQN-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000593997742 521338284 /nfs/dbraw/zinc/33/82/84/521338284.db2.gz NMGMGGPYYLKGQN-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC000593997742 521338287 /nfs/dbraw/zinc/33/82/87/521338287.db2.gz NMGMGGPYYLKGQN-UHFFFAOYSA-N 1 1 360.458 2.874 20 5 FFBDMO C[NH+](C)C[C@@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)c(Cl)c1 ZINC000599626407 521341393 /nfs/dbraw/zinc/34/13/93/521341393.db2.gz FYMLTPUBNHKTIH-CQSZACIVSA-N 1 1 372.256 2.991 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000594050245 521372097 /nfs/dbraw/zinc/37/20/97/521372097.db2.gz CJCRSMLBQLVCIL-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000594050245 521372104 /nfs/dbraw/zinc/37/21/04/521372104.db2.gz CJCRSMLBQLVCIL-UHFFFAOYSA-N 1 1 362.386 2.808 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000594052453 521373889 /nfs/dbraw/zinc/37/38/89/521373889.db2.gz XZMSWTDCRZEAKE-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO C/C=C/C[C@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690291 521405179 /nfs/dbraw/zinc/40/51/79/521405179.db2.gz NCVDAMHDZIGTGG-IBUXWKBASA-N 1 1 361.398 2.940 20 5 FFBDMO C/C=C/C[C@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000599690291 521405188 /nfs/dbraw/zinc/40/51/88/521405188.db2.gz NCVDAMHDZIGTGG-IBUXWKBASA-N 1 1 361.398 2.940 20 5 FFBDMO O=C1CCCN1[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602635001 521449585 /nfs/dbraw/zinc/44/95/85/521449585.db2.gz RHKWJDFKNIQVMS-CYBMUJFWSA-N 1 1 357.332 2.810 20 5 FFBDMO O=C1CCCN1[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602635001 521449594 /nfs/dbraw/zinc/44/95/94/521449594.db2.gz RHKWJDFKNIQVMS-CYBMUJFWSA-N 1 1 357.332 2.810 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594200366 521466904 /nfs/dbraw/zinc/46/69/04/521466904.db2.gz LADIVLITZKLPOF-FUHWJXTLSA-N 1 1 369.425 2.527 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn(C[C@@H]4CCOC4)nn3)C2)cc1 ZINC000602686594 521479515 /nfs/dbraw/zinc/47/95/15/521479515.db2.gz XULPULULSIWRCD-DOTOQJQBSA-N 1 1 371.441 2.602 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cn(C[C@@H]4CCOC4)nn3)C2)cc1 ZINC000602686594 521479521 /nfs/dbraw/zinc/47/95/21/521479521.db2.gz XULPULULSIWRCD-DOTOQJQBSA-N 1 1 371.441 2.602 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](CCC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1 ZINC000602693472 521480734 /nfs/dbraw/zinc/48/07/34/521480734.db2.gz MOAVKQHNLYURAL-CYBMUJFWSA-N 1 1 352.435 2.662 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599827797 521496580 /nfs/dbraw/zinc/49/65/80/521496580.db2.gz DGPLMYCMABJNTQ-ZDUSSCGKSA-N 1 1 370.247 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(CCO)(CCO)CC2)c1 ZINC000602731487 521502091 /nfs/dbraw/zinc/50/20/91/521502091.db2.gz KOSPFERIGLLIFT-UHFFFAOYSA-N 1 1 374.384 2.543 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000597103910 521508675 /nfs/dbraw/zinc/50/86/75/521508675.db2.gz MQUMWIRNVRHAFU-GXSJLCMTSA-N 1 1 355.826 2.777 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000612310026 521570423 /nfs/dbraw/zinc/57/04/23/521570423.db2.gz GLNDMIPWSULRSH-LLVKDONJSA-N 1 1 357.863 2.893 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000612310026 521570432 /nfs/dbraw/zinc/57/04/32/521570432.db2.gz GLNDMIPWSULRSH-LLVKDONJSA-N 1 1 357.863 2.893 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC(CO)(CO)C3)o2)c(Cl)c1 ZINC000597218380 521581077 /nfs/dbraw/zinc/58/10/77/521581077.db2.gz IIECIIVTTJLUSE-UHFFFAOYSA-N 1 1 366.801 2.685 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CN3CCC([N@H+]4CC[C@@H](O)C4)CC3)o2)c1 ZINC000597234858 521588408 /nfs/dbraw/zinc/58/84/08/521588408.db2.gz CEJIGTOWIVWPOV-GOSISDBHSA-N 1 1 371.437 2.886 20 5 FFBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1(CO)CCOCC1 ZINC000597252988 521597039 /nfs/dbraw/zinc/59/70/39/521597039.db2.gz YGDXCWOFNFJAGC-UHFFFAOYSA-N 1 1 363.439 2.692 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000616117040 521625140 /nfs/dbraw/zinc/62/51/40/521625140.db2.gz ZIXBQJHSUCEAQH-OAHLLOKOSA-N 1 1 362.430 2.540 20 5 FFBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])cc3-c3nn[nH]n3)ccc2n1C ZINC000822458927 599108767 /nfs/dbraw/zinc/10/87/67/599108767.db2.gz JFJKFPLBIZOJQW-UHFFFAOYSA-N 1 1 350.342 2.714 20 5 FFBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1ccc(-c2nn[nH]n2)cc1 ZINC000825914779 608524493 /nfs/dbraw/zinc/52/44/93/608524493.db2.gz NUSVAEYUBKCCET-XQRVVYSFSA-N 1 1 350.382 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)c1 ZINC001164786797 721390501 /nfs/dbraw/zinc/39/05/01/721390501.db2.gz PFFSAVIXJFMZLF-GHMZBOCLSA-N 1 1 365.846 2.668 20 5 FFBDMO COc1cc(C)nc(N2CC[NH+](CCOc3ccccc3)CC2)c1[N+](=O)[O-] ZINC001165044348 721955928 /nfs/dbraw/zinc/95/59/28/721955928.db2.gz MPRJTRNIRZWEIK-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@@H+]1CCOC ZINC000153686243 728785837 /nfs/dbraw/zinc/78/58/37/728785837.db2.gz SGYWDXGVRYGSRV-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1CCOC ZINC000153686243 728785841 /nfs/dbraw/zinc/78/58/41/728785841.db2.gz SGYWDXGVRYGSRV-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000154659421 728809210 /nfs/dbraw/zinc/80/92/10/728809210.db2.gz ITXWQQYZDAVLIB-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000154659421 728809213 /nfs/dbraw/zinc/80/92/13/728809213.db2.gz ITXWQQYZDAVLIB-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CC1CCOCC1 ZINC000155784696 728836123 /nfs/dbraw/zinc/83/61/23/728836123.db2.gz GNPALBBBPKIKFG-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000744345145 735350483 /nfs/dbraw/zinc/35/04/83/735350483.db2.gz LALFSDRVCBIEGK-GFCCVEGCSA-N 1 1 360.439 2.932 20 5 FFBDMO O=C(CN1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746453388 735484931 /nfs/dbraw/zinc/48/49/31/735484931.db2.gz JHLBUDWDLPNLDB-LLVKDONJSA-N 1 1 363.805 2.789 20 5 FFBDMO CC1CC[NH+](CCCNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1 ZINC000129095292 728710362 /nfs/dbraw/zinc/71/03/62/728710362.db2.gz MPPVZUVYTBMKLP-UHFFFAOYSA-N 1 1 361.489 2.594 20 5 FFBDMO CC(C)(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCS(C)(=O)=O ZINC000131535004 728722493 /nfs/dbraw/zinc/72/24/93/728722493.db2.gz YBWIFDRGXNKDFB-UHFFFAOYSA-N 1 1 358.460 2.509 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1c(Br)cccc1[N+](=O)[O-])C(C)C ZINC000859366572 730452134 /nfs/dbraw/zinc/45/21/34/730452134.db2.gz ODHGGWJSJCGVRX-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000861345978 730602002 /nfs/dbraw/zinc/60/20/02/730602002.db2.gz BXUMUVXWNGKSAY-MAUKXSAKSA-N 1 1 350.415 2.525 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000861352740 730603273 /nfs/dbraw/zinc/60/32/73/730603273.db2.gz KBLBWDUJCDIMMU-SCLBCKFNSA-N 1 1 350.415 2.525 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000863937744 730816810 /nfs/dbraw/zinc/81/68/10/730816810.db2.gz HEICLJCNJRFXQY-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1nn(CCC(=O)O[C@H](C)C[C@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000870789664 731558422 /nfs/dbraw/zinc/55/84/22/731558422.db2.gz IVBKYGQYYIZNSY-IUODEOHRSA-N 1 1 352.435 2.604 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1 ZINC000780282034 738530764 /nfs/dbraw/zinc/53/07/64/738530764.db2.gz CVZQFHDTYPNGHP-UHFFFAOYSA-N 1 1 368.455 2.976 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000872020348 731721160 /nfs/dbraw/zinc/72/11/60/731721160.db2.gz GJNAAKDXYZWAGP-YOEHRIQHSA-N 1 1 352.454 2.657 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)ncc1[N+](=O)[O-] ZINC000872778394 731830204 /nfs/dbraw/zinc/83/02/04/731830204.db2.gz AEDHIYARZUMZJR-MNOVXSKESA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)ncc1[N+](=O)[O-] ZINC000872778394 731830207 /nfs/dbraw/zinc/83/02/07/731830207.db2.gz AEDHIYARZUMZJR-MNOVXSKESA-N 1 1 355.236 2.734 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000874828668 732104713 /nfs/dbraw/zinc/10/47/13/732104713.db2.gz YDWCAOHAGXAPES-KGLIPLIRSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000874837252 732105876 /nfs/dbraw/zinc/10/58/76/732105876.db2.gz KDHRYTIVDCPRMV-OLZOCXBDSA-N 1 1 357.332 2.922 20 5 FFBDMO Cn1cc(C[NH+]2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])n1 ZINC000876722319 732272453 /nfs/dbraw/zinc/27/24/53/732272453.db2.gz RTZSJRRXULWINU-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC2(CCSCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000877146846 732328484 /nfs/dbraw/zinc/32/84/84/732328484.db2.gz LEOAQFLPDJXGKR-QGZVFWFLSA-N 1 1 363.483 2.905 20 5 FFBDMO CC1(C)OCC([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CO1 ZINC000877338546 732346864 /nfs/dbraw/zinc/34/68/64/732346864.db2.gz HEXQHUJFDJLGGA-UHFFFAOYSA-N 1 1 351.222 2.660 20 5 FFBDMO O=C1OCCN1[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877626911 732400619 /nfs/dbraw/zinc/40/06/19/732400619.db2.gz ZQKUCZGQGXOFJV-GFCCVEGCSA-N 1 1 359.304 2.640 20 5 FFBDMO O=C1OCCN1[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877626911 732400622 /nfs/dbraw/zinc/40/06/22/732400622.db2.gz ZQKUCZGQGXOFJV-GFCCVEGCSA-N 1 1 359.304 2.640 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cc(Br)no1 ZINC000877917519 732451753 /nfs/dbraw/zinc/45/17/53/732451753.db2.gz WOQWUMQAJJSVNV-LLVKDONJSA-N 1 1 356.176 2.511 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)c1cc(Br)no1 ZINC000877917519 732451756 /nfs/dbraw/zinc/45/17/56/732451756.db2.gz WOQWUMQAJJSVNV-LLVKDONJSA-N 1 1 356.176 2.511 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878341251 732516858 /nfs/dbraw/zinc/51/68/58/732516858.db2.gz ZTTRZKVXQWPQBK-GHMZBOCLSA-N 1 1 365.821 2.823 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879556937 732721983 /nfs/dbraw/zinc/72/19/83/732721983.db2.gz AKPKEHGPFBTCTL-STQMWFEESA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000879556937 732721986 /nfs/dbraw/zinc/72/19/86/732721986.db2.gz AKPKEHGPFBTCTL-STQMWFEESA-N 1 1 365.455 2.617 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000879557763 732721995 /nfs/dbraw/zinc/72/19/95/732721995.db2.gz FLOHMRJPGPSRCO-AVGNSLFASA-N 1 1 365.455 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000879557763 732721997 /nfs/dbraw/zinc/72/19/97/732721997.db2.gz FLOHMRJPGPSRCO-AVGNSLFASA-N 1 1 365.455 2.615 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000879561707 732723559 /nfs/dbraw/zinc/72/35/59/732723559.db2.gz SLWYFZSPQIARIF-STQMWFEESA-N 1 1 365.455 2.617 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000879563082 732724305 /nfs/dbraw/zinc/72/43/05/732724305.db2.gz QGCXSGGKWFGBFE-QWHCGFSZSA-N 1 1 363.439 2.578 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H]2CSC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000879566782 732725120 /nfs/dbraw/zinc/72/51/20/732725120.db2.gz YGUVBIMCLFDJEP-RYUDHWBXSA-N 1 1 353.419 2.747 20 5 FFBDMO COc1ccccc1[C@H]1CSCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000880174853 732859690 /nfs/dbraw/zinc/85/96/90/732859690.db2.gz RSDGPCXBMGOPBW-MRXNPFEDSA-N 1 1 362.455 2.980 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])CC(C)(C)CNC(=O)OC(C)(C)C ZINC000886030888 733741839 /nfs/dbraw/zinc/74/18/39/733741839.db2.gz WYXMEOFLWYYUIV-UHFFFAOYSA-N 1 1 352.435 2.973 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])CC(C)(C)CNC(=O)OC(C)(C)C ZINC000886030888 733741841 /nfs/dbraw/zinc/74/18/41/733741841.db2.gz WYXMEOFLWYYUIV-UHFFFAOYSA-N 1 1 352.435 2.973 20 5 FFBDMO Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000888288152 734032372 /nfs/dbraw/zinc/03/23/72/734032372.db2.gz CQBGLVFOVSDULT-RYUDHWBXSA-N 1 1 368.821 2.541 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095119 738821894 /nfs/dbraw/zinc/82/18/94/738821894.db2.gz MXWARXGLFCHIQZ-QWHCGFSZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095119 738821897 /nfs/dbraw/zinc/82/18/97/738821897.db2.gz MXWARXGLFCHIQZ-QWHCGFSZSA-N 1 1 355.847 2.558 20 5 FFBDMO COc1c(O)ccc(CNC[C@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000893200030 734667205 /nfs/dbraw/zinc/66/72/05/734667205.db2.gz LISATHOMXTZGEM-CQSZACIVSA-N 1 1 351.447 2.767 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)COC(=O)N1 ZINC000896459357 735165174 /nfs/dbraw/zinc/16/51/74/735165174.db2.gz FGAZCVOCHZCFSH-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO ZINC000897220406 735207933 /nfs/dbraw/zinc/20/79/33/735207933.db2.gz ASLDRYCVEADEEZ-OLZOCXBDSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC[N@@H+](C[C@H]4CCCO4)CC3)sc2c1 ZINC000748272235 735632103 /nfs/dbraw/zinc/63/21/03/735632103.db2.gz MBHVYEDBRXIMAZ-CQSZACIVSA-N 1 1 362.455 2.896 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(Cn2cc(C[NH+]3CCCC3)nn2)c1 ZINC000900595512 735665909 /nfs/dbraw/zinc/66/59/09/735665909.db2.gz HAHPDOQLFZUYHX-UHFFFAOYSA-N 1 1 366.219 2.593 20 5 FFBDMO COc1cc([C@H](C)[NH2+]CCS(=O)(=O)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903082316 736027633 /nfs/dbraw/zinc/02/76/33/736027633.db2.gz YHXQBIYDTVWSHN-ZDUSSCGKSA-N 1 1 364.423 2.728 20 5 FFBDMO COc1cc([C@@H](C)NCCC[N@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160468 736044873 /nfs/dbraw/zinc/04/48/73/736044873.db2.gz MMOYSLOTQZGUPN-HUUCEWRRSA-N 1 1 351.447 2.755 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]CCCN2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160468 736044878 /nfs/dbraw/zinc/04/48/78/736044878.db2.gz MMOYSLOTQZGUPN-HUUCEWRRSA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] ZINC000754510020 736166768 /nfs/dbraw/zinc/16/67/68/736166768.db2.gz MPMAZHDFROXKCR-INIZCTEOSA-N 1 1 354.378 2.570 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000906617310 736524982 /nfs/dbraw/zinc/52/49/82/736524982.db2.gz PROWZXZDMQNYHU-CQSZACIVSA-N 1 1 351.834 2.781 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906790859 736543994 /nfs/dbraw/zinc/54/39/94/736543994.db2.gz JTAALZSLRNHMLW-BLLLJJGKSA-N 1 1 353.850 2.979 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1 ZINC000763810132 736970600 /nfs/dbraw/zinc/97/06/00/736970600.db2.gz HKZQNGRTGWNDGI-UHFFFAOYSA-N 1 1 354.428 2.586 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000763977330 736983757 /nfs/dbraw/zinc/98/37/57/736983757.db2.gz IANQIAVNAKHSMS-YOEHRIQHSA-N 1 1 350.415 2.598 20 5 FFBDMO Cc1[nH+]ccn1CCCC(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913384663 737396534 /nfs/dbraw/zinc/39/65/34/737396534.db2.gz AUIGTDTYESPQIY-UHFFFAOYSA-N 1 1 354.769 2.989 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc(Br)ncc1[N+](=O)[O-] ZINC000769838139 737572342 /nfs/dbraw/zinc/57/23/42/737572342.db2.gz GSOKFJOBBLGXME-JTQLQIEISA-N 1 1 372.219 2.784 20 5 FFBDMO C[C@H](NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000921806124 738047763 /nfs/dbraw/zinc/04/77/63/738047763.db2.gz IYJPYGBXHDGTAL-DUVNUKRYSA-N 1 1 364.471 2.535 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776597756 738212685 /nfs/dbraw/zinc/21/26/85/738212685.db2.gz MECYMXMUXMJSMG-ZBFHGGJFSA-N 1 1 350.415 2.539 20 5 FFBDMO C[C@H](CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000778237134 738365608 /nfs/dbraw/zinc/36/56/08/738365608.db2.gz SWUMTKQWJZSJRH-GHMZBOCLSA-N 1 1 363.443 2.592 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546164 738976050 /nfs/dbraw/zinc/97/60/50/738976050.db2.gz NBWHLJPGIHJFMU-GYSYKLTISA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546164 738976055 /nfs/dbraw/zinc/97/60/55/738976055.db2.gz NBWHLJPGIHJFMU-GYSYKLTISA-N 1 1 355.822 2.668 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000932302878 739426385 /nfs/dbraw/zinc/42/63/85/739426385.db2.gz WZIHWWLSEFSQFV-ZDUSSCGKSA-N 1 1 351.834 2.781 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000933247690 739588713 /nfs/dbraw/zinc/58/87/13/739588713.db2.gz IENQQYLKYYLAPN-CQSZACIVSA-N 1 1 368.865 2.849 20 5 FFBDMO Cn1cc([C@@H]2CSCCC[N@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000933976760 739713293 /nfs/dbraw/zinc/71/32/93/739713293.db2.gz UTIIHEBBAAVLTO-IRXDYDNUSA-N 1 1 362.455 2.542 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3N)CC[C@H]21 ZINC000934892537 739862441 /nfs/dbraw/zinc/86/24/41/739862441.db2.gz XVMLUSMOGMKLCE-BXKDBHETSA-N 1 1 370.812 2.526 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000796174765 740112089 /nfs/dbraw/zinc/11/20/89/740112089.db2.gz URYVSVWLAMEQDY-OAHLLOKOSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC000796174765 740112090 /nfs/dbraw/zinc/11/20/90/740112090.db2.gz URYVSVWLAMEQDY-OAHLLOKOSA-N 1 1 351.403 2.704 20 5 FFBDMO CC1([NH2+]Cc2cc(Cl)ccc2F)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000940107388 740146864 /nfs/dbraw/zinc/14/68/64/740146864.db2.gz KLKCFLYTLXDYKD-UKRRQHHQSA-N 1 1 369.824 2.615 20 5 FFBDMO CC1([NH2+]Cc2ccc(F)c(Cl)c2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000940107921 740146989 /nfs/dbraw/zinc/14/69/89/740146989.db2.gz RYRRZYDZZMGXHM-IUODEOHRSA-N 1 1 369.824 2.615 20 5 FFBDMO CC(C)[N@H+]1CCO[C@H](COC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000802136908 740676882 /nfs/dbraw/zinc/67/68/82/740676882.db2.gz KWQCGNZEWCIZFO-INIZCTEOSA-N 1 1 350.415 2.525 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000809982023 741369370 /nfs/dbraw/zinc/36/93/70/741369370.db2.gz FOBHJCXRQWGUNY-WDEREUQCSA-N 1 1 362.257 2.789 20 5 FFBDMO O=C(OCCC[NH+]1CCOCC1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811372689 741512959 /nfs/dbraw/zinc/51/29/59/741512959.db2.gz DGLJVMPLXKLPEZ-UHFFFAOYSA-N 1 1 363.197 2.781 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](CCO)c2cccs2)c1 ZINC000811481036 741527854 /nfs/dbraw/zinc/52/78/54/741527854.db2.gz MYEPAUVWTSXJCQ-CYBMUJFWSA-N 1 1 350.396 2.656 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000816682236 742053279 /nfs/dbraw/zinc/05/32/79/742053279.db2.gz SDXMFDNNPAUETJ-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccc(F)cc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643792 742927472 /nfs/dbraw/zinc/92/74/72/742927472.db2.gz SJVGLLDWTUODPM-IXYNUQLISA-N 1 1 369.824 2.661 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@H](O)CNC(=O)OC(C)(C)C ZINC000824571629 743109407 /nfs/dbraw/zinc/10/94/07/743109407.db2.gz NTFZMRGDWCZQME-GFCCVEGCSA-N 1 1 373.837 2.566 20 5 FFBDMO COC(=O)c1nc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl ZINC000826980972 743482835 /nfs/dbraw/zinc/48/28/35/743482835.db2.gz DIYAHMVWVSPJPW-UHFFFAOYSA-N 1 1 365.773 2.728 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000832344170 745680433 /nfs/dbraw/zinc/68/04/33/745680433.db2.gz UTESCBRUHNPKKF-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000832344170 745680436 /nfs/dbraw/zinc/68/04/36/745680436.db2.gz UTESCBRUHNPKKF-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000834595327 745864401 /nfs/dbraw/zinc/86/44/01/745864401.db2.gz XHEOFQACJZSHOC-ZIAGYGMSSA-N 1 1 355.797 2.815 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000836477786 746233804 /nfs/dbraw/zinc/23/38/04/746233804.db2.gz QBERNSDFWPQIAX-LLVKDONJSA-N 1 1 371.235 2.915 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839480825 746835778 /nfs/dbraw/zinc/83/57/78/746835778.db2.gz JXIYFUKLYMZDJI-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839480825 746835787 /nfs/dbraw/zinc/83/57/87/746835787.db2.gz JXIYFUKLYMZDJI-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@H]1C ZINC000839580942 746861315 /nfs/dbraw/zinc/86/13/15/746861315.db2.gz OVMIDZVRKGFZLE-GXSJLCMTSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@H]1C ZINC000839580942 746861321 /nfs/dbraw/zinc/86/13/21/746861321.db2.gz OVMIDZVRKGFZLE-GXSJLCMTSA-N 1 1 357.204 2.741 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000843433151 747836472 /nfs/dbraw/zinc/83/64/72/747836472.db2.gz VCHCAOUBMQJKAC-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000843433151 747836474 /nfs/dbraw/zinc/83/64/74/747836474.db2.gz VCHCAOUBMQJKAC-CYBMUJFWSA-N 1 1 365.739 2.749 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437602 748029357 /nfs/dbraw/zinc/02/93/57/748029357.db2.gz ODFUAHQHNGXEPL-ZBFHGGJFSA-N 1 1 351.353 2.821 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000844437602 748029363 /nfs/dbraw/zinc/02/93/63/748029363.db2.gz ODFUAHQHNGXEPL-ZBFHGGJFSA-N 1 1 351.353 2.821 20 5 FFBDMO CCC[N@H+](C)CC(C)(C)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852715965 749931132 /nfs/dbraw/zinc/93/11/32/749931132.db2.gz FBSANJYFFFHHHJ-UHFFFAOYSA-N 1 1 354.426 2.773 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000852715965 749931138 /nfs/dbraw/zinc/93/11/38/749931138.db2.gz FBSANJYFFFHHHJ-UHFFFAOYSA-N 1 1 354.426 2.773 20 5 FFBDMO COC(=O)NC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000852768559 749951020 /nfs/dbraw/zinc/95/10/20/749951020.db2.gz BPIJRFNMBGQLJP-UHFFFAOYSA-N 1 1 351.403 2.702 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000853355108 750051970 /nfs/dbraw/zinc/05/19/70/750051970.db2.gz GXPSHBKIOOXSTF-UHFFFAOYSA-N 1 1 355.320 2.674 20 5 FFBDMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000853774848 750160452 /nfs/dbraw/zinc/16/04/52/750160452.db2.gz WURUZAWTFJOJBG-LBPRGKRZSA-N 1 1 351.476 2.888 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000853774848 750160455 /nfs/dbraw/zinc/16/04/55/750160455.db2.gz WURUZAWTFJOJBG-LBPRGKRZSA-N 1 1 351.476 2.888 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](OC2CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000872280182 1013198082 /nfs/dbraw/zinc/19/80/82/1013198082.db2.gz OMBLRKRUOXPHAN-SFHVURJKSA-N 1 1 361.442 2.981 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000121090715 961858933 /nfs/dbraw/zinc/85/89/33/961858933.db2.gz RIUSRXFPQFLGNK-UHFFFAOYSA-N 1 1 360.414 2.876 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c(C)cc1[N+](=O)[O-] ZINC001211531645 965605729 /nfs/dbraw/zinc/60/57/29/965605729.db2.gz YZARDEOMEJUYMZ-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cnn(CC4CCC4)c3)C2)nc1 ZINC000892077892 965944505 /nfs/dbraw/zinc/94/45/05/965944505.db2.gz BQLIKTSMFKLMGU-MRXNPFEDSA-N 1 1 356.430 2.673 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cnn(CC4CCC4)c3)C2)nc1 ZINC000892077892 965944514 /nfs/dbraw/zinc/94/45/14/965944514.db2.gz BQLIKTSMFKLMGU-MRXNPFEDSA-N 1 1 356.430 2.673 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176709393 966709362 /nfs/dbraw/zinc/70/93/62/966709362.db2.gz RCFLIZALDDYDMN-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176709393 966709369 /nfs/dbraw/zinc/70/93/69/966709369.db2.gz RCFLIZALDDYDMN-BETUJISGSA-N 1 1 367.421 2.660 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2ncccn2)C1 ZINC001176524918 1013722162 /nfs/dbraw/zinc/72/21/62/1013722162.db2.gz VVIWNGRPXZNIKM-TZMCWYRMSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2ncccn2)C1 ZINC001176524918 1013722168 /nfs/dbraw/zinc/72/21/68/1013722168.db2.gz VVIWNGRPXZNIKM-TZMCWYRMSA-N 1 1 366.381 2.985 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901221 968104248 /nfs/dbraw/zinc/10/42/48/968104248.db2.gz AHXFCSGMUBLMCX-GOEBONIOSA-N 1 1 373.457 2.919 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000050901221 968104255 /nfs/dbraw/zinc/10/42/55/968104255.db2.gz AHXFCSGMUBLMCX-GOEBONIOSA-N 1 1 373.457 2.919 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000874847388 1013917275 /nfs/dbraw/zinc/91/72/75/1013917275.db2.gz PBMBBLHGKQLCHA-RBUKOAKNSA-N 1 1 372.469 2.894 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000103458167 970401957 /nfs/dbraw/zinc/40/19/57/970401957.db2.gz OZJSAFVLCIHBAA-INIZCTEOSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[NH2+]C1(c2ccccc2)CCC1 ZINC000728708176 970512368 /nfs/dbraw/zinc/51/23/68/970512368.db2.gz ZHXWPTJHTHKDMH-UHFFFAOYSA-N 1 1 351.362 2.817 20 5 FFBDMO CCCc1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000985426858 974051291 /nfs/dbraw/zinc/05/12/91/974051291.db2.gz UXNFHYHQFGIVGN-RTBURBONSA-N 1 1 359.470 2.727 20 5 FFBDMO CCCc1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985426858 974051302 /nfs/dbraw/zinc/05/13/02/974051302.db2.gz UXNFHYHQFGIVGN-RTBURBONSA-N 1 1 359.470 2.727 20 5 FFBDMO CCCc1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985426858 974051314 /nfs/dbraw/zinc/05/13/14/974051314.db2.gz UXNFHYHQFGIVGN-RTBURBONSA-N 1 1 359.470 2.727 20 5 FFBDMO C[Si](C)(C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC001167778361 974281123 /nfs/dbraw/zinc/28/11/23/974281123.db2.gz FCEQCRPIVCTGHX-HNNXBMFYSA-N 1 1 356.502 2.631 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@@H]2C1 ZINC000644826903 975329360 /nfs/dbraw/zinc/32/93/60/975329360.db2.gz GWEFPKSHCDONKU-MGPUTAFESA-N 1 1 361.445 2.848 20 5 FFBDMO CC(C)C(=O)NC1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728895883 976835733 /nfs/dbraw/zinc/83/57/33/976835733.db2.gz CZIHKOVXNCLJPY-UHFFFAOYSA-N 1 1 371.441 2.652 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H]([C@@H](O)c2nccn2C)C1 ZINC000876809103 1014402058 /nfs/dbraw/zinc/40/20/58/1014402058.db2.gz CQMKDISFWGMRKT-CRAIPNDOSA-N 1 1 358.442 2.891 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001029964670 980156728 /nfs/dbraw/zinc/15/67/28/980156728.db2.gz VBKIQVXUHOHKRI-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964670 980156731 /nfs/dbraw/zinc/15/67/31/980156731.db2.gz VBKIQVXUHOHKRI-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001029964670 980156737 /nfs/dbraw/zinc/15/67/37/980156737.db2.gz VBKIQVXUHOHKRI-RTBURBONSA-N 1 1 359.470 2.639 20 5 FFBDMO CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC2(CCCC2)O1 ZINC000190980152 980358907 /nfs/dbraw/zinc/35/89/07/980358907.db2.gz DGIWMBCPQFGDQY-HNNXBMFYSA-N 1 1 364.442 2.758 20 5 FFBDMO CC(C)c1ccccc1C[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC000963791196 1014766822 /nfs/dbraw/zinc/76/68/22/1014766822.db2.gz OXJQMQDPCSFUTF-LYBMJUBJSA-N 1 1 371.481 2.992 20 5 FFBDMO CCOc1cc(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000910293306 981901768 /nfs/dbraw/zinc/90/17/68/981901768.db2.gz NXCNJWAIBISPGW-CYBMUJFWSA-N 1 1 365.430 2.558 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878259044 1014953207 /nfs/dbraw/zinc/95/32/07/1014953207.db2.gz XYNQIUFVOSGHPH-HIFRSBDPSA-N 1 1 359.430 2.807 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000046404161 984675634 /nfs/dbraw/zinc/67/56/34/984675634.db2.gz VCOYCJPOTYXEOS-UHFFFAOYSA-N 1 1 368.437 2.918 20 5 FFBDMO C[N@H+]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)[C@H](c2ccccc2)C1 ZINC000170639342 985099158 /nfs/dbraw/zinc/09/91/58/985099158.db2.gz JYXJAOHGHXNPPB-IBGZPJMESA-N 1 1 366.421 2.973 20 5 FFBDMO CO[C@@]1(C)C[C@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000173545939 985874851 /nfs/dbraw/zinc/87/48/51/985874851.db2.gz QZTQURRKUFMOHV-YJBOKZPZSA-N 1 1 359.430 2.946 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000063661070 986007845 /nfs/dbraw/zinc/00/78/45/986007845.db2.gz OUJDAMXIXPKRFB-CQSZACIVSA-N 1 1 371.441 2.766 20 5 FFBDMO CCOC(=O)CC1CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000130251335 987338065 /nfs/dbraw/zinc/33/80/65/987338065.db2.gz IIEJWGDTBJIUSB-ZDUSSCGKSA-N 1 1 363.414 2.587 20 5 FFBDMO CC[C@@H]([NH2+]Cc1ccc(N2CCN(C)CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000130505012 987370125 /nfs/dbraw/zinc/37/01/25/987370125.db2.gz OOERUPSOCYESIJ-LJQANCHMSA-N 1 1 369.469 2.983 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(-c2noc(-c3ccc([N+](=O)[O-])n3C)n2)cn1 ZINC000761920241 987979776 /nfs/dbraw/zinc/97/97/76/987979776.db2.gz WOPOAKRUINEUKV-UHFFFAOYSA-N 1 1 351.326 2.539 20 5 FFBDMO C[C@@H]1CC2(CCC2)C[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000762147236 988154286 /nfs/dbraw/zinc/15/42/86/988154286.db2.gz XXBMDPXQKYFKLW-FZKQIMNGSA-N 1 1 372.425 2.584 20 5 FFBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1 ZINC000673514239 988433656 /nfs/dbraw/zinc/43/36/56/988433656.db2.gz LVZDMHZMZZYRKR-IRXDYDNUSA-N 1 1 361.445 2.669 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]2CC1 ZINC000946589140 988764413 /nfs/dbraw/zinc/76/44/13/988764413.db2.gz IHMRJPBSCUQVNW-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]2CC1 ZINC000946589140 988764420 /nfs/dbraw/zinc/76/44/20/988764420.db2.gz IHMRJPBSCUQVNW-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]2CC1 ZINC000946589140 988764431 /nfs/dbraw/zinc/76/44/31/988764431.db2.gz IHMRJPBSCUQVNW-FCGDIQPGSA-N 1 1 363.502 2.792 20 5 FFBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C12CCC2 ZINC000763236638 989248450 /nfs/dbraw/zinc/24/84/50/989248450.db2.gz RMGLPYVMHMUEKB-HOTGVXAUSA-N 1 1 359.430 2.885 20 5 FFBDMO COc1cccc(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000194580778 990340979 /nfs/dbraw/zinc/34/09/79/990340979.db2.gz LBNUGRXQTJAFOH-UHFFFAOYSA-N 1 1 361.373 2.604 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC3)c1 ZINC001035187533 990409676 /nfs/dbraw/zinc/40/96/76/990409676.db2.gz VXEYQRRAWFWMKH-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035187533 990409678 /nfs/dbraw/zinc/40/96/78/990409678.db2.gz VXEYQRRAWFWMKH-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2CCC3(C2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC3)c1 ZINC001035187533 990409686 /nfs/dbraw/zinc/40/96/86/990409686.db2.gz VXEYQRRAWFWMKH-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO C[N@@H+](CCC1CCOCC1)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000154784089 990459735 /nfs/dbraw/zinc/45/97/35/990459735.db2.gz KYRNYWBLVOOWKN-UHFFFAOYSA-N 1 1 362.430 2.543 20 5 FFBDMO O=C(COc1ccccc1C[NH2+]Cc1ccccc1[N+](=O)[O-])N1CCCC1 ZINC000238001330 991428474 /nfs/dbraw/zinc/42/84/74/991428474.db2.gz YPGLLIRCFGCXAE-UHFFFAOYSA-N 1 1 369.421 2.886 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000880009109 1015730947 /nfs/dbraw/zinc/73/09/47/1015730947.db2.gz ZWWRKPBOWHEHGM-CQSZACIVSA-N 1 1 372.450 2.738 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000880009109 1015730954 /nfs/dbraw/zinc/73/09/54/1015730954.db2.gz ZWWRKPBOWHEHGM-CQSZACIVSA-N 1 1 372.450 2.738 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC000880460713 1015840878 /nfs/dbraw/zinc/84/08/78/1015840878.db2.gz BTBDACUXNLGQKU-SFHVURJKSA-N 1 1 357.410 2.979 20 5 FFBDMO C[C@]1(COC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000747772349 995372535 /nfs/dbraw/zinc/37/25/35/995372535.db2.gz ORYXUMADQVFMCM-LJQANCHMSA-N 1 1 372.425 2.779 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000812393583 995427256 /nfs/dbraw/zinc/42/72/56/995427256.db2.gz FNFUETPELJGIRH-NSHDSACASA-N 1 1 366.418 2.970 20 5 FFBDMO Cn1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C2CC2)n1 ZINC000813170955 995632111 /nfs/dbraw/zinc/63/21/11/995632111.db2.gz OFYOPGURJADKFD-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO Cn1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C2CC2)n1 ZINC000813170955 995632117 /nfs/dbraw/zinc/63/21/17/995632117.db2.gz OFYOPGURJADKFD-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO O=C(CCc1ccccn1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171045 995632229 /nfs/dbraw/zinc/63/22/29/995632229.db2.gz CUQLTRRUYAZOAN-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(CCc1ccccn1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171045 995632233 /nfs/dbraw/zinc/63/22/33/995632233.db2.gz CUQLTRRUYAZOAN-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(/C=C/c1cncc(F)c1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172320 995633986 /nfs/dbraw/zinc/63/39/86/995633986.db2.gz IQDQTXLLZPIXRG-WRFKIARRSA-N 1 1 371.368 2.960 20 5 FFBDMO O=C(/C=C/c1cncc(F)c1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172320 995633991 /nfs/dbraw/zinc/63/39/91/995633991.db2.gz IQDQTXLLZPIXRG-WRFKIARRSA-N 1 1 371.368 2.960 20 5 FFBDMO CCc1cccnc1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173248 995635219 /nfs/dbraw/zinc/63/52/19/995635219.db2.gz WQLMMRINOLYBMD-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO CCc1cccnc1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173248 995635224 /nfs/dbraw/zinc/63/52/24/995635224.db2.gz WQLMMRINOLYBMD-KRWDZBQOSA-N 1 1 355.394 2.984 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC[C@H]21 ZINC000827268055 1016088508 /nfs/dbraw/zinc/08/85/08/1016088508.db2.gz QFZYCCXORCPEQT-DOTOQJQBSA-N 1 1 366.421 2.823 20 5 FFBDMO CC(C)OCCOC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000825207137 997257591 /nfs/dbraw/zinc/25/75/91/997257591.db2.gz FGTOOIYIYGDZIT-UHFFFAOYSA-N 1 1 367.402 2.909 20 5 FFBDMO C[C@@H](OC(=O)CC[C@H]1CCCC[N@H+]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000803859749 1016248665 /nfs/dbraw/zinc/24/86/65/1016248665.db2.gz VQSNJIRZDMNBQP-ZIAGYGMSSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC000741028286 999705325 /nfs/dbraw/zinc/70/53/25/999705325.db2.gz FABWMMMVSIUOKW-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO O=C(NC[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3s2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001086083236 999754594 /nfs/dbraw/zinc/75/45/94/999754594.db2.gz RRZHEDIJWSJCKW-WXYCVUISSA-N 1 1 359.451 2.551 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC000742419173 999773144 /nfs/dbraw/zinc/77/31/44/999773144.db2.gz VTPGSMCJXQMHPU-OAHLLOKOSA-N 1 1 360.458 2.798 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000744391030 999853758 /nfs/dbraw/zinc/85/37/58/999853758.db2.gz SRLQOYPQZXTMAA-UHFFFAOYSA-N 1 1 355.398 2.686 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]2(CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1 ZINC001169010291 1000015385 /nfs/dbraw/zinc/01/53/85/1000015385.db2.gz CHLDJXDLQQBEJJ-MPGHIAIKSA-N 1 1 353.463 2.765 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[C@]12CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011813 1000015573 /nfs/dbraw/zinc/01/55/73/1000015573.db2.gz MLGMBZGUDFVQEU-RLFYNMQTSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011963 1000015580 /nfs/dbraw/zinc/01/55/80/1000015580.db2.gz NYYQCMDXDIIWTO-CAOSSQGBSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036854 1000016615 /nfs/dbraw/zinc/01/66/15/1000016615.db2.gz QIJDEHQFRWOMBH-KHEOEIQESA-N 1 1 353.463 2.952 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018472 1000017186 /nfs/dbraw/zinc/01/71/86/1000017186.db2.gz CNYAPEJHBNSURC-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(CC3CC3)c21 ZINC001169018472 1000017188 /nfs/dbraw/zinc/01/71/88/1000017188.db2.gz CNYAPEJHBNSURC-IKGGRYGDSA-N 1 1 362.474 2.674 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cnn(CC3CC3)c21 ZINC001169018262 1000017223 /nfs/dbraw/zinc/01/72/23/1000017223.db2.gz AJHDBIKSNIBXSZ-RYQLBKOJSA-N 1 1 362.474 2.674 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC3(CC2)CN(Cc2ccccc2)CCO3)C1 ZINC001169019593 1000017521 /nfs/dbraw/zinc/01/75/21/1000017521.db2.gz GSNAMIYUYWHECH-PMACEKPBSA-N 1 1 373.497 2.799 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000766869230 1000082855 /nfs/dbraw/zinc/08/28/55/1000082855.db2.gz MQRMGDGUSQUKIL-GOSISDBHSA-N 1 1 364.348 2.975 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000766869230 1000082856 /nfs/dbraw/zinc/08/28/56/1000082856.db2.gz MQRMGDGUSQUKIL-GOSISDBHSA-N 1 1 364.348 2.975 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[NH+]1CCN(c2ccccc2)CC1 ZINC000804344441 1000095507 /nfs/dbraw/zinc/09/55/07/1000095507.db2.gz RHVKMSBPIBYJJX-UHFFFAOYSA-N 1 1 371.397 2.737 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000767733086 1000141738 /nfs/dbraw/zinc/14/17/38/1000141738.db2.gz URBVWVWKRKOVSN-UHFFFAOYSA-N 1 1 355.354 2.533 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846105955 1000209354 /nfs/dbraw/zinc/20/93/54/1000209354.db2.gz ZHAHFEHIURQWNN-INIZCTEOSA-N 1 1 370.352 2.768 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000846368736 1000290028 /nfs/dbraw/zinc/29/00/28/1000290028.db2.gz HSTLZOZKGRXLPR-GOSISDBHSA-N 1 1 363.458 2.789 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC001146308777 1000654474 /nfs/dbraw/zinc/65/44/74/1000654474.db2.gz YQLCGKPIUKXODR-CQSZACIVSA-N 1 1 372.425 2.512 20 5 FFBDMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000770044659 1000663871 /nfs/dbraw/zinc/66/38/71/1000663871.db2.gz RHXJSRSMLDLSKA-UYAOXDASSA-N 1 1 374.437 2.779 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1c[nH]c(C)n1 ZINC001146870515 1000782774 /nfs/dbraw/zinc/78/27/74/1000782774.db2.gz XRJPUDHMVUFTIM-UHFFFAOYSA-N 1 1 361.405 2.975 20 5 FFBDMO C[NH+]1CCN([C@@H](C(=O)Oc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000771486823 1001123335 /nfs/dbraw/zinc/12/33/35/1001123335.db2.gz QARJWTWLJMHYJT-GOSISDBHSA-N 1 1 373.384 2.628 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000785744859 1001485954 /nfs/dbraw/zinc/48/59/54/1001485954.db2.gz QPWXKNLCWOQROA-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000785744859 1001485956 /nfs/dbraw/zinc/48/59/56/1001485956.db2.gz QPWXKNLCWOQROA-TXEJJXNPSA-N 1 1 360.370 2.561 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)c1 ZINC000791331155 1002656551 /nfs/dbraw/zinc/65/65/51/1002656551.db2.gz CGPWTJJUQDFEFB-UHFFFAOYSA-N 1 1 360.389 2.698 20 5 FFBDMO C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774904319 1003005449 /nfs/dbraw/zinc/00/54/49/1003005449.db2.gz HHPHAPPGRBOESW-UHFFFAOYSA-N 1 1 368.390 2.850 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774904319 1003005463 /nfs/dbraw/zinc/00/54/63/1003005463.db2.gz HHPHAPPGRBOESW-UHFFFAOYSA-N 1 1 368.390 2.850 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2C[C@H](CO)[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170329358 1003115134 /nfs/dbraw/zinc/11/51/34/1003115134.db2.gz PJSZDRLXKYWKEN-QKCSRTOESA-N 1 1 362.348 2.637 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC001186222107 1003228064 /nfs/dbraw/zinc/22/80/64/1003228064.db2.gz ZASKQXOJIWBUEV-UHFFFAOYSA-N 1 1 351.366 2.800 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)n2)cc1 ZINC000793743967 1003488392 /nfs/dbraw/zinc/48/83/92/1003488392.db2.gz OYQQIZWBALTKGT-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCOC[C@@H](C4CCC4)C3)n2)cc1 ZINC000793743967 1003488397 /nfs/dbraw/zinc/48/83/97/1003488397.db2.gz OYQQIZWBALTKGT-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])c(F)c2)cc1 ZINC001001522586 1016828827 /nfs/dbraw/zinc/82/88/27/1016828827.db2.gz FYNKSCOKINSADC-IEBWSBKVSA-N 1 1 371.412 2.705 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805776975 1004129239 /nfs/dbraw/zinc/12/92/39/1004129239.db2.gz XGUHLJNGIOGXGW-SJORKVTESA-N 1 1 365.430 2.619 20 5 FFBDMO CC1(C)OCC[C@@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194436823 1004736011 /nfs/dbraw/zinc/73/60/11/1004736011.db2.gz YSFZEPCULYKPQL-LBPRGKRZSA-N 1 1 352.778 2.955 20 5 FFBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275133 1005342129 /nfs/dbraw/zinc/34/21/29/1005342129.db2.gz JJYJYYWHIXVVDU-AUUYWEPGSA-N 1 1 367.409 2.902 20 5 FFBDMO O=C1NCCCN1c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000850414786 1005814127 /nfs/dbraw/zinc/81/41/27/1005814127.db2.gz YMHSZEWYKMCHEJ-UHFFFAOYSA-N 1 1 358.373 2.943 20 5 FFBDMO C[C@H]1CO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000851415943 1005885064 /nfs/dbraw/zinc/88/50/64/1005885064.db2.gz QXXFOEYPUDVSSF-DOTOQJQBSA-N 1 1 364.442 2.655 20 5 FFBDMO C[C@H]1CO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000851415943 1005885066 /nfs/dbraw/zinc/88/50/66/1005885066.db2.gz QXXFOEYPUDVSSF-DOTOQJQBSA-N 1 1 364.442 2.655 20 5 FFBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 ZINC000851714544 1005908453 /nfs/dbraw/zinc/90/84/53/1005908453.db2.gz HKMMVSQZXRNDJD-OAHLLOKOSA-N 1 1 365.430 2.663 20 5 FFBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 ZINC000851714544 1005908455 /nfs/dbraw/zinc/90/84/55/1005908455.db2.gz HKMMVSQZXRNDJD-OAHLLOKOSA-N 1 1 365.430 2.663 20 5 FFBDMO Cc1noc(CN2CC[NH+](Cc3cccc4cccnc43)CC2)c1[N+](=O)[O-] ZINC000851729582 1005909536 /nfs/dbraw/zinc/90/95/36/1005909536.db2.gz OTFWSICMWFSWQR-UHFFFAOYSA-N 1 1 367.409 2.757 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776582265 1005962657 /nfs/dbraw/zinc/96/26/57/1005962657.db2.gz NPGYJZFWJWALEB-RHSMWYFYSA-N 1 1 363.458 2.503 20 5 FFBDMO C[C@H]1C[N@H+](Cc2cccc(CNc3ccnc(F)c3[N+](=O)[O-])c2)CCO1 ZINC000881844998 1006240734 /nfs/dbraw/zinc/24/07/34/1006240734.db2.gz YABKHZKBNSCVBT-ZDUSSCGKSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ccnc(F)c3[N+](=O)[O-])c2)CCO1 ZINC000881844998 1006240746 /nfs/dbraw/zinc/24/07/46/1006240746.db2.gz YABKHZKBNSCVBT-ZDUSSCGKSA-N 1 1 360.389 2.962 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)nc1-c1ccccn1 ZINC000853517709 1006423367 /nfs/dbraw/zinc/42/33/67/1006423367.db2.gz BUMWRRKLBAJKBQ-GOEBONIOSA-N 1 1 357.414 2.702 20 5 FFBDMO O=C1CN(C[NH+]2CCC(C3CCC3)CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000853535823 1006432421 /nfs/dbraw/zinc/43/24/21/1006432421.db2.gz CVGIGFARYUGINZ-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)nc1-c1ccccn1 ZINC000853623878 1006481845 /nfs/dbraw/zinc/48/18/45/1006481845.db2.gz VPGVMHGNTNUMCO-KDURUIRLSA-N 1 1 369.425 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)nc1-c1ccccn1 ZINC000853623878 1006481852 /nfs/dbraw/zinc/48/18/52/1006481852.db2.gz VPGVMHGNTNUMCO-KDURUIRLSA-N 1 1 369.425 2.703 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccc([N+](=O)[O-])cn3)C2)O1 ZINC000882979988 1006585799 /nfs/dbraw/zinc/58/57/99/1006585799.db2.gz VIHLOYJCFHAXDG-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC001152412246 1032160836 /nfs/dbraw/zinc/16/08/36/1032160836.db2.gz UBJYSQZQMDIKOF-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162890 1032163820 /nfs/dbraw/zinc/16/38/20/1032163820.db2.gz YZXHORPIWLIYLZ-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162890 1032163823 /nfs/dbraw/zinc/16/38/23/1032163823.db2.gz YZXHORPIWLIYLZ-XJKSGUPXSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1)[C@@]1(O)CCC[N@@H+](Cc2ccccc2)C1 ZINC001135504712 1006982355 /nfs/dbraw/zinc/98/23/55/1006982355.db2.gz QQLKHHDBBSJTOW-LJQANCHMSA-N 1 1 355.394 2.560 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1C ZINC001189997595 1007417755 /nfs/dbraw/zinc/41/77/55/1007417755.db2.gz QNGQVVGOHIHWHE-MRXNPFEDSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000817184952 1007466854 /nfs/dbraw/zinc/46/68/54/1007466854.db2.gz XTTMPSKYUQGHBK-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3cc(C)c([N+](=O)[O-])cn3)C2)ccn1 ZINC000856533283 1007872496 /nfs/dbraw/zinc/87/24/96/1007872496.db2.gz COSNCSJZANQMKI-KRWDZBQOSA-N 1 1 371.441 2.803 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3ccc([N+](=O)[O-])c(C)n3)C2)ccn1 ZINC000856533271 1007873259 /nfs/dbraw/zinc/87/32/59/1007873259.db2.gz COCZSWMJNNGUPA-KRWDZBQOSA-N 1 1 371.441 2.803 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)CC1 ZINC000818626350 1007956234 /nfs/dbraw/zinc/95/62/34/1007956234.db2.gz XIEAWNKCKOIGEG-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)CC1 ZINC000818626350 1007956240 /nfs/dbraw/zinc/95/62/40/1007956240.db2.gz XIEAWNKCKOIGEG-IYBDPMFKSA-N 1 1 374.485 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000819275535 1008097686 /nfs/dbraw/zinc/09/76/86/1008097686.db2.gz WVMUDIRSGWFRGN-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000819275535 1008097690 /nfs/dbraw/zinc/09/76/90/1008097690.db2.gz WVMUDIRSGWFRGN-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000819275535 1008097695 /nfs/dbraw/zinc/09/76/95/1008097695.db2.gz WVMUDIRSGWFRGN-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nc1 ZINC000858012370 1008277380 /nfs/dbraw/zinc/27/73/80/1008277380.db2.gz GCPIIEHKLCNOFV-OAHLLOKOSA-N 1 1 358.354 2.860 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nc1 ZINC000858012370 1008277383 /nfs/dbraw/zinc/27/73/83/1008277383.db2.gz GCPIIEHKLCNOFV-OAHLLOKOSA-N 1 1 358.354 2.860 20 5 FFBDMO Nc1ccc([N+](=O)[O-])c(N2CC[NH+](Cc3cc4ccccc4[nH]3)CC2)c1 ZINC000858821838 1008430060 /nfs/dbraw/zinc/43/00/60/1008430060.db2.gz RLLZXIBPVBFAHH-UHFFFAOYSA-N 1 1 351.410 2.981 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001177198927 1008515665 /nfs/dbraw/zinc/51/56/65/1008515665.db2.gz AVULCUOUIRNTKD-UHFFFAOYSA-N 1 1 372.469 2.970 20 5 FFBDMO COc1cc(C)cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1OC ZINC000886174661 1008597916 /nfs/dbraw/zinc/59/79/16/1008597916.db2.gz GIXRJWVXXVGMOP-IBGZPJMESA-N 1 1 360.410 2.918 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC([N@@H+]2CCOC[C@@H]2C)CC1 ZINC000823057588 1008887767 /nfs/dbraw/zinc/88/77/67/1008887767.db2.gz VHOLOOGLBKJUGY-AWEZNQCLSA-N 1 1 361.442 2.537 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000823559279 1009130059 /nfs/dbraw/zinc/13/00/59/1009130059.db2.gz UMMJZXVEDWLGDV-UHFFFAOYSA-N 1 1 361.442 2.539 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598051 1009135607 /nfs/dbraw/zinc/13/56/07/1009135607.db2.gz FFLKCIIOPQWKMJ-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598051 1009135612 /nfs/dbraw/zinc/13/56/12/1009135612.db2.gz FFLKCIIOPQWKMJ-IFXJQAMLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@](C)(O)c1ccccc1 ZINC000823599745 1009137187 /nfs/dbraw/zinc/13/71/87/1009137187.db2.gz WNGNUGCUCKKYJF-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@](C)(O)c1ccccc1 ZINC000823599745 1009137193 /nfs/dbraw/zinc/13/71/93/1009137193.db2.gz WNGNUGCUCKKYJF-IBGZPJMESA-N 1 1 368.393 2.984 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823938656 1009287658 /nfs/dbraw/zinc/28/76/58/1009287658.db2.gz LDEQXKRNGZNWSQ-UHFFFAOYSA-N 1 1 361.402 2.756 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861984537 1009647942 /nfs/dbraw/zinc/64/79/42/1009647942.db2.gz GUEYPPLSBAZSRU-NXVVXOECSA-N 1 1 373.453 2.711 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000862142301 1009717191 /nfs/dbraw/zinc/71/71/91/1009717191.db2.gz XLQMXVDAAPOHSB-KFWWJZLASA-N 1 1 371.437 2.976 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc2ccccc21)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000862142301 1009717201 /nfs/dbraw/zinc/71/72/01/1009717201.db2.gz XLQMXVDAAPOHSB-KFWWJZLASA-N 1 1 371.437 2.976 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000863029188 1010085217 /nfs/dbraw/zinc/08/52/17/1010085217.db2.gz BDHNURBAOMKPGK-AWEZNQCLSA-N 1 1 362.386 2.558 20 5 FFBDMO C[C@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000864809494 1010586432 /nfs/dbraw/zinc/58/64/32/1010586432.db2.gz VUUXZKZYXRSXOK-CQSZACIVSA-N 1 1 371.412 2.839 20 5 FFBDMO CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000865536361 1010808356 /nfs/dbraw/zinc/80/83/56/1010808356.db2.gz WSJTYDAQIXCIIN-CQSZACIVSA-N 1 1 368.315 2.742 20 5 FFBDMO CC(C)[C@@H](C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000866226186 1010955242 /nfs/dbraw/zinc/95/52/42/1010955242.db2.gz HCLLTTOKXJVHMZ-DNVCBOLYSA-N 1 1 366.481 2.527 20 5 FFBDMO COc1ccc([C@H]2CCN(C(=O)[C@@](C)([NH3+])c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000867954432 1011130615 /nfs/dbraw/zinc/13/06/15/1011130615.db2.gz MWGJIBRIUDSKGH-YWZLYKJASA-N 1 1 369.421 2.793 20 5 FFBDMO CC[N@@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001274950323 1011773373 /nfs/dbraw/zinc/77/33/73/1011773373.db2.gz LVADVAILHQQCQT-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CC[N@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001274950323 1011773381 /nfs/dbraw/zinc/77/33/81/1011773381.db2.gz LVADVAILHQQCQT-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CC[N@@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001274950323 1011773389 /nfs/dbraw/zinc/77/33/89/1011773389.db2.gz LVADVAILHQQCQT-QZTJIDSGSA-N 1 1 351.491 2.792 20 5 FFBDMO CCOC(=O)[C@H]1CSCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921347 1012102196 /nfs/dbraw/zinc/10/21/96/1012102196.db2.gz PAIFPNQHMCQBHI-NVXWUHKLSA-N 1 1 364.467 2.823 20 5 FFBDMO CCOC(=O)[C@H]1CSCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921347 1012102198 /nfs/dbraw/zinc/10/21/98/1012102198.db2.gz PAIFPNQHMCQBHI-NVXWUHKLSA-N 1 1 364.467 2.823 20 5 FFBDMO C[C@H](C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870087305 1012117891 /nfs/dbraw/zinc/11/78/91/1012117891.db2.gz BYCRXBQKUHZVTG-SCLBCKFNSA-N 1 1 355.394 2.577 20 5 FFBDMO C/C(=C\C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000870087823 1012119139 /nfs/dbraw/zinc/11/91/39/1012119139.db2.gz ULRAFMXSIWGZQH-XYDKVEKUSA-N 1 1 367.405 2.877 20 5 FFBDMO CN(C)C(=O)N[C@@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172911749 1012126094 /nfs/dbraw/zinc/12/60/94/1012126094.db2.gz FQLZBYRIVNNLNU-SJORKVTESA-N 1 1 360.458 2.578 20 5 FFBDMO C[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@H]1CCCOC1 ZINC001173020474 1012191378 /nfs/dbraw/zinc/19/13/78/1012191378.db2.gz SAPVSOLAVISIHO-CYBMUJFWSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870146455 1012200282 /nfs/dbraw/zinc/20/02/82/1012200282.db2.gz YWTQGONZQDESPB-LIRRHRJNSA-N 1 1 369.421 2.880 20 5 FFBDMO COC(=O)CC[N@@H+]([C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC001173193149 1012335897 /nfs/dbraw/zinc/33/58/97/1012335897.db2.gz QTXIHPLUFTYQDF-NSHDSACASA-N 1 1 354.378 2.701 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195695 1012337848 /nfs/dbraw/zinc/33/78/48/1012337848.db2.gz ISOYDZHYXDKQKR-KPZWWZAWSA-N 1 1 368.405 2.949 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@]12CCC[C@H]1OCC2 ZINC000870378491 1012341024 /nfs/dbraw/zinc/34/10/24/1012341024.db2.gz UHIUVKMMYNSTEW-SCTDSRPQSA-N 1 1 360.410 2.672 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@]12CCC[C@H]1OCC2 ZINC000870378491 1012341040 /nfs/dbraw/zinc/34/10/40/1012341040.db2.gz UHIUVKMMYNSTEW-SCTDSRPQSA-N 1 1 360.410 2.672 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227721 1012360966 /nfs/dbraw/zinc/36/09/66/1012360966.db2.gz VIRLWRKLZXORJF-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227721 1012360985 /nfs/dbraw/zinc/36/09/85/1012360985.db2.gz VIRLWRKLZXORJF-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[N@H+](C3CCC3)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000828241253 1032636651 /nfs/dbraw/zinc/63/66/51/1032636651.db2.gz JBDRVFUOVMTRPI-AWEZNQCLSA-N 1 1 361.442 2.621 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000828241254 1032636682 /nfs/dbraw/zinc/63/66/82/1032636682.db2.gz JBDRVFUOVMTRPI-CQSZACIVSA-N 1 1 361.442 2.621 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C[C@H]1COCC2 ZINC000475566174 1019501500 /nfs/dbraw/zinc/50/15/00/1019501500.db2.gz NURMSNWODOCVSI-HNAYVOBHSA-N 1 1 362.426 2.730 20 5 FFBDMO C[C@H](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)Cc1ccccc1 ZINC000801914256 1019508155 /nfs/dbraw/zinc/50/81/55/1019508155.db2.gz VHUHBBBSBDOPQF-CYBMUJFWSA-N 1 1 374.416 2.957 20 5 FFBDMO COC(=O)/C(C)=C/C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000828806766 1032843739 /nfs/dbraw/zinc/84/37/39/1032843739.db2.gz DBXROCWSPMBIMD-QFIZVMTBSA-N 1 1 362.426 2.820 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482681506 1020097815 /nfs/dbraw/zinc/09/78/15/1020097815.db2.gz IHLAOXKPZCWMET-UHFFFAOYSA-N 1 1 356.382 2.991 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482681506 1020097825 /nfs/dbraw/zinc/09/78/25/1020097825.db2.gz IHLAOXKPZCWMET-UHFFFAOYSA-N 1 1 356.382 2.991 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1 ZINC000777956830 1020330867 /nfs/dbraw/zinc/33/08/67/1020330867.db2.gz QXPCCVHMIYFGGW-CYBMUJFWSA-N 1 1 358.398 2.689 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(O[C@@H]4CCOC4)CC3)c2)c1 ZINC000777963425 1020353384 /nfs/dbraw/zinc/35/33/84/1020353384.db2.gz LHMIUCMBGROCFY-LJQANCHMSA-N 1 1 372.425 2.686 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000800846689 1020587267 /nfs/dbraw/zinc/58/72/67/1020587267.db2.gz VSMBYKIWFFJVID-UHFFFAOYSA-N 1 1 356.426 2.816 20 5 FFBDMO O=C1NCC2(CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)Oc2ccccc21 ZINC000932048601 1020688318 /nfs/dbraw/zinc/68/83/18/1020688318.db2.gz XMLFEVZOIQEPEQ-UHFFFAOYSA-N 1 1 367.405 2.752 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000932134194 1020713874 /nfs/dbraw/zinc/71/38/74/1020713874.db2.gz HZFXSYJGUIJUFA-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO CC[C@@H](NC(=O)CC[NH+]1CCN(C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000900967802 1020756184 /nfs/dbraw/zinc/75/61/84/1020756184.db2.gz MUUKLVRITLFNTM-GOSISDBHSA-N 1 1 362.474 2.578 20 5 FFBDMO CC(C)(C)c1cc2n(n1)CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000932613855 1020849745 /nfs/dbraw/zinc/84/97/45/1020849745.db2.gz SRHVKKUWGZEGBL-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO CC(C)(C)c1cc2n(n1)CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2 ZINC000932613855 1020849752 /nfs/dbraw/zinc/84/97/52/1020849752.db2.gz SRHVKKUWGZEGBL-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000749667117 1021018841 /nfs/dbraw/zinc/01/88/41/1021018841.db2.gz VIOHJILCKSGOCM-MSOLQXFVSA-N 1 1 352.394 2.741 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001116331449 1021168507 /nfs/dbraw/zinc/16/85/07/1021168507.db2.gz QDWCLFVZAMLKFT-FZKQIMNGSA-N 1 1 358.442 2.725 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001116397855 1021197399 /nfs/dbraw/zinc/19/73/99/1021197399.db2.gz DXEWJTSTVNKAKH-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001116397855 1021197407 /nfs/dbraw/zinc/19/74/07/1021197407.db2.gz DXEWJTSTVNKAKH-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2C[C@@H](O)COc2cccc([N+](=O)[O-])c2)nc1 ZINC000934344941 1021204539 /nfs/dbraw/zinc/20/45/39/1021204539.db2.gz IFFOIBUUSGZDKV-BEFAXECRSA-N 1 1 373.409 2.575 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000934895539 1021451634 /nfs/dbraw/zinc/45/16/34/1021451634.db2.gz CDRQEPDKDIZKCI-QZTJIDSGSA-N 1 1 366.421 2.751 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)NCC(F)F ZINC001116877288 1021466125 /nfs/dbraw/zinc/46/61/25/1021466125.db2.gz ONGVXIUYRBOSNX-UHFFFAOYSA-N 1 1 373.743 2.979 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001116886168 1021470968 /nfs/dbraw/zinc/47/09/68/1021470968.db2.gz HGTDXTKQULVHSW-UONOGXRCSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001116886168 1021470975 /nfs/dbraw/zinc/47/09/75/1021470975.db2.gz HGTDXTKQULVHSW-UONOGXRCSA-N 1 1 358.398 2.881 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](C/C=C/c1ccccc1)CC2 ZINC001040699206 1022954699 /nfs/dbraw/zinc/95/46/99/1022954699.db2.gz AGTHQEUJVQUOCH-LVLPYEQSSA-N 1 1 369.465 2.680 20 5 FFBDMO CN(Cc1cc(F)ccc1[N+](=O)[O-])C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188288123 1023049974 /nfs/dbraw/zinc/04/99/74/1023049974.db2.gz VINSKQQLSMJPRL-HXUWFJFHSA-N 1 1 373.428 2.803 20 5 FFBDMO CC[NH+]1CCN(CCCCNC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000752355751 1023126664 /nfs/dbraw/zinc/12/66/64/1023126664.db2.gz RUMAUHZLJYFEHC-MSUUIHNZSA-N 1 1 374.485 2.532 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@H]1C ZINC000754225191 1023443185 /nfs/dbraw/zinc/44/31/85/1023443185.db2.gz PUFPTURFJGJRPU-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)C[C@H]1C ZINC000754225191 1023443188 /nfs/dbraw/zinc/44/31/88/1023443188.db2.gz PUFPTURFJGJRPU-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000077958238 1023711819 /nfs/dbraw/zinc/71/18/19/1023711819.db2.gz WTIWCLHWYSTDBU-KRWDZBQOSA-N 1 1 372.425 2.637 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2CC)C1 ZINC001121791963 1024028770 /nfs/dbraw/zinc/02/87/70/1024028770.db2.gz PAUXPWDGTHNYMC-ZDUSSCGKSA-N 1 1 362.434 2.634 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC001122066702 1024311071 /nfs/dbraw/zinc/31/10/71/1024311071.db2.gz OFTSBJFXAORSJN-KRWDZBQOSA-N 1 1 374.828 2.749 20 5 FFBDMO CC(C)(C[NH2+]CC1CC(C)(C)C1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540501 1024885178 /nfs/dbraw/zinc/88/51/78/1024885178.db2.gz GYSBJANRXNODJH-IAGOWNOFSA-N 1 1 365.518 2.942 20 5 FFBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)O[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000837667670 1025953975 /nfs/dbraw/zinc/95/39/75/1025953975.db2.gz ZLRHCAGEDHFLJK-CQSZACIVSA-N 1 1 371.393 2.617 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[NH+](CCc2ccccc2)CC1 ZINC000839231414 1026627653 /nfs/dbraw/zinc/62/76/53/1026627653.db2.gz RSGXFWHYLYVMQB-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)nc1-c1ccncc1 ZINC000840113699 1026961617 /nfs/dbraw/zinc/96/16/17/1026961617.db2.gz CBQUNPLTBXKMRI-JZXOWHBKSA-N 1 1 371.441 2.826 20 5 FFBDMO Cc1nn(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000840117175 1026964609 /nfs/dbraw/zinc/96/46/09/1026964609.db2.gz SKSGVOHMYIMWDP-USXIJHARSA-N 1 1 359.430 2.621 20 5 FFBDMO O=c1c2ccc[nH]c-2cn1C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000840126063 1026967636 /nfs/dbraw/zinc/96/76/36/1026967636.db2.gz NYKOQECVAITLTO-HNNXBMFYSA-N 1 1 352.394 2.783 20 5 FFBDMO O=c1c2ccc[nH]c-2cn1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000840126063 1026967642 /nfs/dbraw/zinc/96/76/42/1026967642.db2.gz NYKOQECVAITLTO-HNNXBMFYSA-N 1 1 352.394 2.783 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])cn1 ZINC001141956759 1027220743 /nfs/dbraw/zinc/22/07/43/1027220743.db2.gz AORPBLSGORTZEU-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO CCOC(=O)[C@@H]([NH3+])Cc1ccc(Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001159846366 1027515877 /nfs/dbraw/zinc/51/58/77/1027515877.db2.gz URFIUDQBSWRKGB-HNNXBMFYSA-N 1 1 359.382 2.780 20 5 FFBDMO Cc1ccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cc1 ZINC000957547558 1028324461 /nfs/dbraw/zinc/32/44/61/1028324461.db2.gz JAJMKFSQTFMSOA-RTBURBONSA-N 1 1 371.481 2.865 20 5 FFBDMO COC(=O)C12CCC(Nc3cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn3)(CC1)C2 ZINC001162976391 1028742179 /nfs/dbraw/zinc/74/21/79/1028742179.db2.gz AFEMYVVQVFUJAT-RUDMXATFSA-N 1 1 360.414 2.810 20 5 FFBDMO COc1ccc(CCNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)cc1O ZINC001155884999 1028958292 /nfs/dbraw/zinc/95/82/92/1028958292.db2.gz JMURXYOVUAOFDD-VQHVLOKHSA-N 1 1 358.398 2.891 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC001163672157 1029020045 /nfs/dbraw/zinc/02/00/45/1029020045.db2.gz IUUOOWHPPXUSGP-KRWDZBQOSA-N 1 1 370.409 2.660 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC001163672157 1029020059 /nfs/dbraw/zinc/02/00/59/1029020059.db2.gz IUUOOWHPPXUSGP-KRWDZBQOSA-N 1 1 370.409 2.660 20 5 FFBDMO Nc1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001156317359 1029143738 /nfs/dbraw/zinc/14/37/38/1029143738.db2.gz LYJUSNZELZZLQZ-YQQAZPJKSA-N 1 1 353.426 2.895 20 5 FFBDMO C[C@H]1CC[C@]2(CC[N@@H+](CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000781585734 1029289336 /nfs/dbraw/zinc/28/93/36/1029289336.db2.gz IAETVQPVCUYNON-LIRRHRJNSA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CN3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000781585732 1029290935 /nfs/dbraw/zinc/29/09/35/1029290935.db2.gz IAETVQPVCUYNON-KUHUBIRLSA-N 1 1 372.425 2.833 20 5 FFBDMO CC(C)c1ccc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001164491039 1029298165 /nfs/dbraw/zinc/29/81/65/1029298165.db2.gz YDYSGJUUYIDVPK-QZTJIDSGSA-N 1 1 359.470 2.851 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCc2cccnc2-n2cc[nH+]c2C)c1 ZINC000782360984 1029670978 /nfs/dbraw/zinc/67/09/78/1029670978.db2.gz HLWNRJVZXZIEPB-UHFFFAOYSA-N 1 1 367.365 2.883 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCCc2cn3ccccc3n2)ncc1[N+](=O)[O-] ZINC001158145107 1029744783 /nfs/dbraw/zinc/74/47/83/1029744783.db2.gz HEYPJORMDZVRHK-JXMROGBWSA-N 1 1 352.398 2.824 20 5 FFBDMO C[N@@H+](C1CN(c2ccc3c(ccc(Cl)c3[N+](=O)[O-])n2)C1)[C@@H]1CCOC1 ZINC001165205358 1029892980 /nfs/dbraw/zinc/89/29/80/1029892980.db2.gz JQPCXIPCIBJIBL-LLVKDONJSA-N 1 1 362.817 2.706 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CC[C@@H](O)[C@@H]2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001165899550 1030161831 /nfs/dbraw/zinc/16/18/31/1030161831.db2.gz YKKKGBYJWGVLLT-VXFSWMFESA-N 1 1 368.437 2.704 20 5 FFBDMO C[C@H]1C[N@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007730 1030411915 /nfs/dbraw/zinc/41/19/15/1030411915.db2.gz LCJVZDCRVVHQRX-YJYMSZOUSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H]1C[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007730 1030411925 /nfs/dbraw/zinc/41/19/25/1030411925.db2.gz LCJVZDCRVVHQRX-YJYMSZOUSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H]1C[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007721 1030412417 /nfs/dbraw/zinc/41/24/17/1030412417.db2.gz LCJVZDCRVVHQRX-BFUOFWGJSA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H]1C[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC(C)(C)C1 ZINC000784007721 1030412422 /nfs/dbraw/zinc/41/24/22/1030412422.db2.gz LCJVZDCRVVHQRX-BFUOFWGJSA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000784034538 1030431539 /nfs/dbraw/zinc/43/15/39/1030431539.db2.gz LCUWVXCXQLCSPI-CYBMUJFWSA-N 1 1 360.414 2.689 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000796880918 1030942117 /nfs/dbraw/zinc/94/21/17/1030942117.db2.gz ACLJKYJPHCPPDS-OAHLLOKOSA-N 1 1 364.442 2.772 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC001142847422 1030950088 /nfs/dbraw/zinc/95/00/88/1030950088.db2.gz PFRNKQLLSFUGTB-UHFFFAOYSA-N 1 1 369.396 2.763 20 5 FFBDMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC001142847422 1030950103 /nfs/dbraw/zinc/95/01/03/1030950103.db2.gz PFRNKQLLSFUGTB-UHFFFAOYSA-N 1 1 369.396 2.763 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@H+](C)CC[C@H]1N2C(=O)c1cc([N+](=O)[O-])cn1C ZINC000797080953 1030990976 /nfs/dbraw/zinc/99/09/76/1030990976.db2.gz KUCZCSNEEFIHMB-NVXWUHKLSA-N 1 1 354.410 2.690 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cc(F)cc(F)c2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530500 1031787098 /nfs/dbraw/zinc/78/70/98/1031787098.db2.gz AIBLYODXYCFISI-HZPDHXFCSA-N 1 1 367.396 2.539 20 5 FFBDMO Cc1cc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c(C)s1 ZINC001115530822 1031788734 /nfs/dbraw/zinc/78/87/34/1031788734.db2.gz SZFBRBPPAXDQBM-HZPDHXFCSA-N 1 1 365.499 2.939 20 5 FFBDMO O=[N+]([O-])c1ccc(COC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cn1 ZINC001224114244 1033724382 /nfs/dbraw/zinc/72/43/82/1033724382.db2.gz MSFWKTUINKCGTC-SFHVURJKSA-N 1 1 357.410 2.798 20 5 FFBDMO COc1cc(OC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)ncc1[N+](=O)[O-] ZINC001226582040 1034746532 /nfs/dbraw/zinc/74/65/32/1034746532.db2.gz VBYJWQJWLFLZCK-INIZCTEOSA-N 1 1 373.409 2.668 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ccc([N+](=O)[O-])nc3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001226712895 1034800050 /nfs/dbraw/zinc/80/00/50/1034800050.db2.gz RIRYEXRLZBWYMR-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ncc(F)cc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001226754501 1034820501 /nfs/dbraw/zinc/82/05/01/1034820501.db2.gz QKTAMVOCVSGXAO-LESCRADOSA-N 1 1 371.368 2.882 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ncc(F)cc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001226754501 1034820513 /nfs/dbraw/zinc/82/05/13/1034820513.db2.gz QKTAMVOCVSGXAO-LESCRADOSA-N 1 1 371.368 2.882 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001161186245 1035045741 /nfs/dbraw/zinc/04/57/41/1035045741.db2.gz FYSCOXIRIGUGJE-AWEZNQCLSA-N 1 1 362.430 2.843 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001536194302 1069933992 /nfs/dbraw/zinc/93/39/92/1069933992.db2.gz IZVWJGMTCIXHLX-INIZCTEOSA-N 1 1 358.442 2.807 20 5 FFBDMO COc1cc(O[C@H]2CCC[N@@H+](C)C2)c2c(c1)oc1c(O)ccc(O)c1c2=O ZINC001227645977 1035653282 /nfs/dbraw/zinc/65/32/82/1035653282.db2.gz LTBPZXUKOKBYMT-NSHDSACASA-N 1 1 371.389 2.839 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c2[nH]cnc21 ZINC001227691030 1035674952 /nfs/dbraw/zinc/67/49/52/1035674952.db2.gz LWDSNJCECCRTHS-CQSZACIVSA-N 1 1 353.382 2.910 20 5 FFBDMO O=[N+]([O-])c1c[nH]c(O[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c2ncnc1-2 ZINC001227691030 1035674960 /nfs/dbraw/zinc/67/49/60/1035674960.db2.gz LWDSNJCECCRTHS-CQSZACIVSA-N 1 1 353.382 2.910 20 5 FFBDMO O=[N+]([O-])c1c[nH]c(O[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c2ncnc1-2 ZINC001227691030 1035674967 /nfs/dbraw/zinc/67/49/67/1035674967.db2.gz LWDSNJCECCRTHS-CQSZACIVSA-N 1 1 353.382 2.910 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3cnccc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001228881433 1036382945 /nfs/dbraw/zinc/38/29/45/1036382945.db2.gz DTALPHYSTJHXRW-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3cnccc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001228881433 1036382963 /nfs/dbraw/zinc/38/29/63/1036382963.db2.gz DTALPHYSTJHXRW-QGTPRVQTSA-N 1 1 353.378 2.743 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2cc(I)ccc2[N+](=O)[O-])C1 ZINC001229153050 1036525740 /nfs/dbraw/zinc/52/57/40/1036525740.db2.gz ZCGBZQNGBWTPOQ-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(O[C@H]2COCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001233578573 1036685983 /nfs/dbraw/zinc/68/59/83/1036685983.db2.gz VCPCPJISLAYBCU-OAHLLOKOSA-N 1 1 373.365 2.783 20 5 FFBDMO O=[N+]([O-])c1cccc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001233578573 1036685995 /nfs/dbraw/zinc/68/59/95/1036685995.db2.gz VCPCPJISLAYBCU-OAHLLOKOSA-N 1 1 373.365 2.783 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2cccc(I)c2[N+](=O)[O-])C1 ZINC001229656277 1036806175 /nfs/dbraw/zinc/80/61/75/1036806175.db2.gz ATISNDXGSOXZGY-SECBINFHSA-N 1 1 362.167 2.672 20 5 FFBDMO CC(=O)Nc1ccc(C(C)=O)c(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC001234682845 1037138901 /nfs/dbraw/zinc/13/89/01/1037138901.db2.gz XNCKHQXKVVQMNG-BTTYYORXSA-N 1 1 361.398 2.760 20 5 FFBDMO COc1cc(O[C@@H]2CC[N@@H+](C)C2)c2c(c1)oc1ccc(OC)c(O)c1c2=O ZINC001230526117 1037302217 /nfs/dbraw/zinc/30/22/17/1037302217.db2.gz QLUZHLQTQNOBHA-LLVKDONJSA-N 1 1 371.389 2.752 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001230639071 1037326383 /nfs/dbraw/zinc/32/63/83/1037326383.db2.gz RENICGJYOLZVKR-OAHLLOKOSA-N 1 1 350.463 2.975 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2c3ccccc3c3cc4ccccc4oc2-3)CCN1 ZINC001235753654 1037725553 /nfs/dbraw/zinc/72/55/53/1037725553.db2.gz AGGUDZBZBBYQRL-IBGZPJMESA-N 1 1 359.429 2.950 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@H](C)[C@H](O)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092916 1038377568 /nfs/dbraw/zinc/37/75/68/1038377568.db2.gz BAVBIQLQVUHDCF-RDTXWAMCSA-N 1 1 363.458 2.665 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc(/C=C/c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258013782 1039113243 /nfs/dbraw/zinc/11/32/43/1039113243.db2.gz YOFGHAAOJDOENN-CWZTWBIVSA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(/C=C/c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258013782 1039113248 /nfs/dbraw/zinc/11/32/48/1039113248.db2.gz YOFGHAAOJDOENN-CWZTWBIVSA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc(C(C)(C)c3ccccc3[N+](=O)[O-])o2)C[C@@H](C)O1 ZINC001258091311 1039163275 /nfs/dbraw/zinc/16/32/75/1039163275.db2.gz LIFHFKMKVIIQIB-ZIAGYGMSSA-N 1 1 374.441 2.955 20 5 FFBDMO NC1(C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCCC1 ZINC001246074416 1039236450 /nfs/dbraw/zinc/23/64/50/1039236450.db2.gz CZNMVCDGXQROKO-UHFFFAOYSA-N 1 1 354.401 2.703 20 5 FFBDMO CC1(C)CNCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246812371 1039489776 /nfs/dbraw/zinc/48/97/76/1039489776.db2.gz ZGCMLDJEEPQQLU-UHFFFAOYSA-N 1 1 354.401 2.526 20 5 FFBDMO CC1(C)CNCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246812371 1039489778 /nfs/dbraw/zinc/48/97/78/1039489778.db2.gz ZGCMLDJEEPQQLU-UHFFFAOYSA-N 1 1 354.401 2.526 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@H+](C)CCO1 ZINC001210683679 1039668508 /nfs/dbraw/zinc/66/85/08/1039668508.db2.gz YFJSMLFZAPECRX-SJKOYZFVSA-N 1 1 358.398 2.589 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@H]1C[N@@H+](C)CCO1 ZINC001210683679 1039668515 /nfs/dbraw/zinc/66/85/15/1039668515.db2.gz YFJSMLFZAPECRX-SJKOYZFVSA-N 1 1 358.398 2.589 20 5 FFBDMO CN(C)c1ccccc1-c1noc([C@H]([NH3+])Cc2cccc([N+](=O)[O-])c2)n1 ZINC001248208814 1040172419 /nfs/dbraw/zinc/17/24/19/1040172419.db2.gz LDKVGXPGHXMGGE-OAHLLOKOSA-N 1 1 353.382 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCC[C@](F)(CO)CC3)CC2)cc1 ZINC001254475020 1040743237 /nfs/dbraw/zinc/74/32/37/1040743237.db2.gz YGQWUYDVVMXKCA-GOSISDBHSA-N 1 1 351.422 2.750 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]12C[C@H]1COC21CCC1)c1ccc([N+](=O)[O-])cc1 ZINC001262481417 1041699251 /nfs/dbraw/zinc/69/92/51/1041699251.db2.gz RPIPLNLJTMVEDF-KVSKMBFKSA-N 1 1 368.437 2.967 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H](C)[N@@H+]2CCc3sccc3C2)n1 ZINC001264872601 1042828413 /nfs/dbraw/zinc/82/84/13/1042828413.db2.gz PLSWRFLGPIKFLU-LBPRGKRZSA-N 1 1 360.439 2.536 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H](C)[N@H+]2CCc3sccc3C2)n1 ZINC001264872601 1042828418 /nfs/dbraw/zinc/82/84/18/1042828418.db2.gz PLSWRFLGPIKFLU-LBPRGKRZSA-N 1 1 360.439 2.536 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]Cc1ccsc1)Cc1ccccc1 ZINC001279304808 1042992241 /nfs/dbraw/zinc/99/22/41/1042992241.db2.gz QVGOODCOCYSSIN-IAGOWNOFSA-N 1 1 359.451 2.532 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001310506869 1043698825 /nfs/dbraw/zinc/69/88/25/1043698825.db2.gz IPTRAANRPGZYDQ-JTQLQIEISA-N 1 1 371.235 2.963 20 5 FFBDMO C[N@@H+](CCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)Cc1ccc(F)cc1 ZINC001310992644 1043777755 /nfs/dbraw/zinc/77/77/55/1043777755.db2.gz RPKATBKTLKTIFP-UHFFFAOYSA-N 1 1 361.377 2.570 20 5 FFBDMO c1nn(CC[NH+]2CCOCC2)cc1-c1ccc2ccc3cccnc3c2n1 ZINC001240538972 1044375986 /nfs/dbraw/zinc/37/59/86/1044375986.db2.gz JXSKXLYAYWHTSQ-UHFFFAOYSA-N 1 1 359.433 2.979 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3NC)sc2C1 ZINC001318106498 1045215453 /nfs/dbraw/zinc/21/54/53/1045215453.db2.gz LSMNEWVBTLHWNG-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3NC)sc2C1 ZINC001318106498 1045215462 /nfs/dbraw/zinc/21/54/62/1045215462.db2.gz LSMNEWVBTLHWNG-UHFFFAOYSA-N 1 1 361.427 2.723 20 5 FFBDMO Cc1c(C(=O)OCc2c(F)cccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001320067448 1045342008 /nfs/dbraw/zinc/34/20/08/1045342008.db2.gz NQSVHQRZLOPVME-UHFFFAOYSA-N 1 1 356.313 2.980 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC001539537145 1070654689 /nfs/dbraw/zinc/65/46/89/1070654689.db2.gz AKQAANONNKMOSC-UHFFFAOYSA-N 1 1 357.357 2.658 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC001320950273 1045500603 /nfs/dbraw/zinc/50/06/03/1045500603.db2.gz DUGVGSKMSCVQSU-JOYOIKCWSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@H]1C ZINC001320950273 1045500607 /nfs/dbraw/zinc/50/06/07/1045500607.db2.gz DUGVGSKMSCVQSU-JOYOIKCWSA-N 1 1 357.204 2.741 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cnn1C ZINC001320994694 1045509499 /nfs/dbraw/zinc/50/94/99/1045509499.db2.gz SUTVWJSSZMJTGV-SECBINFHSA-N 1 1 351.794 2.579 20 5 FFBDMO Cc1noc([C@H]([NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC001474763187 1045851980 /nfs/dbraw/zinc/85/19/80/1045851980.db2.gz ZHTAUKPMIISQOB-BDJLRTHQSA-N 1 1 361.402 2.990 20 5 FFBDMO CC(C)Oc1nc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC001326835929 1047107859 /nfs/dbraw/zinc/10/78/59/1047107859.db2.gz CIDFEHMDBUKPHQ-CQSZACIVSA-N 1 1 359.430 2.970 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC001540523991 1070916122 /nfs/dbraw/zinc/91/61/22/1070916122.db2.gz GWVHDSGOFHRWQP-UHFFFAOYSA-N 1 1 371.412 2.663 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001290240847 1047949303 /nfs/dbraw/zinc/94/93/03/1047949303.db2.gz KLFGMIHGYPRULY-AWEZNQCLSA-N 1 1 371.441 2.979 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])NCC[N@H+]1CCc2ccccc2C1 ZINC001290674109 1048298462 /nfs/dbraw/zinc/29/84/62/1048298462.db2.gz NVSWNXUNFQXXHH-UHFFFAOYSA-N 1 1 371.412 2.841 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])[C@@H](C)C1 ZINC001333706605 1049066943 /nfs/dbraw/zinc/06/69/43/1049066943.db2.gz KAQGKDNDLBUIAW-ZFWWWQNUSA-N 1 1 358.442 2.613 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ccncc3[N+](=O)[O-])C2)O1 ZINC001330829257 1049350699 /nfs/dbraw/zinc/35/06/99/1049350699.db2.gz JRXKTHHIRXNDMR-OXQOHEQNSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H](NC(=O)[C@@]1([NH+](C)C)COc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC001303302274 1051325280 /nfs/dbraw/zinc/32/52/80/1051325280.db2.gz ANVMYOAZSNUJQG-VLIAUNLRSA-N 1 1 369.421 2.708 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC001303469151 1051360217 /nfs/dbraw/zinc/36/02/17/1051360217.db2.gz BLUZHAFQXDIQRM-UHFFFAOYSA-N 1 1 367.203 2.546 20 5 FFBDMO Cc1nn(C)c(-n2cc[nH+]c2C)c1C(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC001303498611 1051368362 /nfs/dbraw/zinc/36/83/62/1051368362.db2.gz ZIGLBYMEQFWPEQ-LLVKDONJSA-N 1 1 368.397 2.622 20 5 FFBDMO CC1(C)CO[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC001307665655 1052332976 /nfs/dbraw/zinc/33/29/76/1052332976.db2.gz ZSKOHPAGJJIPRD-OAHLLOKOSA-N 1 1 373.457 2.798 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2CC(C)C)CC1 ZINC001343632001 1052346689 /nfs/dbraw/zinc/34/66/89/1052346689.db2.gz UELOZPWINOQRJY-UHFFFAOYSA-N 1 1 362.434 2.634 20 5 FFBDMO CN(C)c1ccc(F)cc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC001308606080 1052476516 /nfs/dbraw/zinc/47/65/16/1052476516.db2.gz XHPZKWUZMINYPR-UHFFFAOYSA-N 1 1 359.405 2.517 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC001309172343 1052566671 /nfs/dbraw/zinc/56/66/71/1052566671.db2.gz BIZIWVOTPPLHGB-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)CCCO1 ZINC001335188151 1053250607 /nfs/dbraw/zinc/25/06/07/1053250607.db2.gz NEXGPOHLISBHRW-OAHLLOKOSA-N 1 1 371.437 2.979 20 5 FFBDMO O=C(NCC[N@H+]1CCCOCC1)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001347866173 1054397981 /nfs/dbraw/zinc/39/79/81/1054397981.db2.gz GXEUAANOBQNRQW-UHFFFAOYSA-N 1 1 358.398 2.592 20 5 FFBDMO COC(=O)/C=C/c1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1 ZINC000848877485 1055286782 /nfs/dbraw/zinc/28/67/82/1055286782.db2.gz SDUDRQYJNHUHEW-CMDGGOBGSA-N 1 1 371.393 2.696 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC(c3c[nH+]cn3C)CC2)c([N+](=O)[O-])c1 ZINC001338317705 1055415425 /nfs/dbraw/zinc/41/54/25/1055415425.db2.gz FCTPYMVXEWBQTM-UHFFFAOYSA-N 1 1 371.441 2.851 20 5 FFBDMO CCc1cc(NC(=O)[C@@H]2CCC[N@H+]2C(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC001357970467 1056084880 /nfs/dbraw/zinc/08/48/80/1056084880.db2.gz WAWODVMSIOUFOK-SFHVURJKSA-N 1 1 356.426 2.939 20 5 FFBDMO CCN(c1nnc(C[N+](=O)[O-])n1CC)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC001339454016 1056468986 /nfs/dbraw/zinc/46/89/86/1056468986.db2.gz FYQHAQQLYLLUFW-NVXWUHKLSA-N 1 1 372.473 2.737 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]C/C=C/c2ccc(Cl)cc2)CC1 ZINC001200471095 1058297405 /nfs/dbraw/zinc/29/74/05/1058297405.db2.gz DIIDKMQQPMKQRQ-KBXQFXQKSA-N 1 1 363.845 2.599 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC001447426808 1058642593 /nfs/dbraw/zinc/64/25/93/1058642593.db2.gz JBYIYKGJVQYCTI-HNNXBMFYSA-N 1 1 371.441 2.598 20 5 FFBDMO Cc1ccc(CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704259 1059151098 /nfs/dbraw/zinc/15/10/98/1059151098.db2.gz SCUNSGSORUPPDI-UXHICEINSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cc1[N+](=O)[O-] ZINC001200704259 1059151113 /nfs/dbraw/zinc/15/11/13/1059151113.db2.gz SCUNSGSORUPPDI-UXHICEINSA-N 1 1 369.465 2.876 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC001454633559 1059589008 /nfs/dbraw/zinc/58/90/08/1059589008.db2.gz KFDDQRVMLJCEMH-GOEBONIOSA-N 1 1 368.437 2.675 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000848591733 1060325486 /nfs/dbraw/zinc/32/54/86/1060325486.db2.gz XILPTXBHYHAMAU-MRXNPFEDSA-N 1 1 369.368 2.511 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001458135730 1060522214 /nfs/dbraw/zinc/52/22/14/1060522214.db2.gz XUCVCJLSLSYXSU-LBPRGKRZSA-N 1 1 359.386 2.617 20 5 FFBDMO CN(C)C(=O)C[NH+]1CCC(Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001458168586 1060531850 /nfs/dbraw/zinc/53/18/50/1060531850.db2.gz QIXVKMGHFHVUIQ-UHFFFAOYSA-N 1 1 374.363 2.578 20 5 FFBDMO CCC(=O)c1ccc(N2CCC[C@@H]([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1 ZINC000848795511 1060715524 /nfs/dbraw/zinc/71/55/24/1060715524.db2.gz IPJNYZWSPKYNPM-MRXNPFEDSA-N 1 1 361.442 2.879 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCN(CC(F)(F)F)C1 ZINC001460544269 1061013348 /nfs/dbraw/zinc/01/33/48/1061013348.db2.gz VGKMEVAHYDJFNB-ZDUSSCGKSA-N 1 1 361.364 2.932 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001460844355 1061125827 /nfs/dbraw/zinc/12/58/27/1061125827.db2.gz GYCGZOHPOUMIAG-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001460844355 1061125835 /nfs/dbraw/zinc/12/58/35/1061125835.db2.gz GYCGZOHPOUMIAG-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO COC(=O)c1cc(C2C[NH+](CC(C)=Cc3cccc([N+](=O)[O-])c3)C2)[nH]n1 ZINC001462640362 1061703225 /nfs/dbraw/zinc/70/32/25/1061703225.db2.gz BZLNNDXUKYPIHQ-SDQBBNPISA-N 1 1 356.382 2.607 20 5 FFBDMO Cc1cccc(Cl)c1C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 ZINC001479869148 1063012006 /nfs/dbraw/zinc/01/20/06/1063012006.db2.gz SNFCDTAZDUWYOQ-RHSMWYFYSA-N 1 1 365.861 2.784 20 5 FFBDMO Cc1cccc(Cl)c1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001479869148 1063012025 /nfs/dbraw/zinc/01/20/25/1063012025.db2.gz SNFCDTAZDUWYOQ-RHSMWYFYSA-N 1 1 365.861 2.784 20 5 FFBDMO Cc1cccc(Cl)c1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001479869148 1063012044 /nfs/dbraw/zinc/01/20/44/1063012044.db2.gz SNFCDTAZDUWYOQ-RHSMWYFYSA-N 1 1 365.861 2.784 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001465619774 1063156934 /nfs/dbraw/zinc/15/69/34/1063156934.db2.gz AAQULNOJVCOACW-ZBFHGGJFSA-N 1 1 368.437 2.960 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@@H]2C1 ZINC001467071003 1063629059 /nfs/dbraw/zinc/62/90/59/1063629059.db2.gz ZURZCCPDJRVEFR-SGIREYDYSA-N 1 1 355.398 2.605 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C[C@@H]1C(C)(C)C ZINC001469614175 1064179822 /nfs/dbraw/zinc/17/98/22/1064179822.db2.gz ACBCGURCNXNVSP-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC001470779882 1064449583 /nfs/dbraw/zinc/44/95/83/1064449583.db2.gz JWCBVQSDJMIVMU-YOEHRIQHSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1cc(NC[C@@H]2CCCC[N@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001472831847 1065153979 /nfs/dbraw/zinc/15/39/79/1065153979.db2.gz URFOTXRBQBYDTH-HNNXBMFYSA-N 1 1 355.442 2.926 20 5 FFBDMO COC(=O)/C=C/c1ccc(NCc2cc(N(C)C)cc[nH+]2)c([N+](=O)[O-])c1 ZINC001472879030 1065165617 /nfs/dbraw/zinc/16/56/17/1065165617.db2.gz WHFCODQDPNASAC-FNORWQNLSA-N 1 1 356.382 2.854 20 5 FFBDMO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1nc(Cc2ccccc2)no1 ZINC001474496244 1065536189 /nfs/dbraw/zinc/53/61/89/1065536189.db2.gz IDSJSWAPSOYXHF-GRTSSRMGSA-N 1 1 368.397 2.819 20 5 FFBDMO COc1cccc(C[C@H]([NH3+])C(=O)OCc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC001579273799 1078607545 /nfs/dbraw/zinc/60/75/45/1078607545.db2.gz BTHJONWXJGPRDQ-KRWDZBQOSA-N 1 1 358.394 2.833 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C[C@@]2(C)C1 ZINC001557740846 1075882663 /nfs/dbraw/zinc/88/26/63/1075882663.db2.gz CVPYQSZHNXMPHO-KDURUIRLSA-N 1 1 357.454 2.817 20 5 FFBDMO C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C1CCCC1 ZINC001559280884 1076145449 /nfs/dbraw/zinc/14/54/49/1076145449.db2.gz YYMLLRHYRSFPIJ-CYBMUJFWSA-N 1 1 358.442 2.933 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC001559675384 1076181688 /nfs/dbraw/zinc/18/16/88/1076181688.db2.gz HPDIIEULWPZAJR-INIZCTEOSA-N 1 1 374.485 2.611 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC001561699924 1076409340 /nfs/dbraw/zinc/40/93/40/1076409340.db2.gz GBWWIQGQLYTJAI-HZPDHXFCSA-N 1 1 367.471 2.507 20 5 FFBDMO CCOc1cc(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC001567354557 1077020496 /nfs/dbraw/zinc/02/04/96/1077020496.db2.gz FBGUMFYXYRXJJN-ZDUSSCGKSA-N 1 1 365.430 2.605 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC001567356437 1077021355 /nfs/dbraw/zinc/02/13/55/1077021355.db2.gz VYNUYBDQCYLGAZ-ZDUSSCGKSA-N 1 1 370.247 2.960 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(-c2nn[nH]n2)c1 ZINC001589969604 1080910960 /nfs/dbraw/zinc/91/09/60/1080910960.db2.gz GXDKPLUFZGISMM-JTQLQIEISA-N 1 1 369.341 2.534 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590049059 1080978419 /nfs/dbraw/zinc/97/84/19/1080978419.db2.gz CXIAYYRRVQREOX-LLVKDONJSA-N 1 1 354.370 2.674 20 5 FFBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590049059 1080978421 /nfs/dbraw/zinc/97/84/21/1080978421.db2.gz CXIAYYRRVQREOX-LLVKDONJSA-N 1 1 354.370 2.674 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1 ZINC001590188071 1081077295 /nfs/dbraw/zinc/07/72/95/1081077295.db2.gz PRDVKQCJBVROLQ-FRRDWIJNSA-N 1 1 359.434 2.553 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNc2nc3sccn3c2[N+](=O)[O-])C[C@H](C)O1 ZINC000115415176 210169320 /nfs/dbraw/zinc/16/93/20/210169320.db2.gz KHNNQCPDGFBAON-QWRGUYRKSA-N 1 1 353.448 2.604 20 5 FFBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)c2C1 ZINC000102733425 250121009 /nfs/dbraw/zinc/12/10/09/250121009.db2.gz ZSMWNWFCGNYIJZ-UHFFFAOYSA-N 1 1 357.414 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OC[C@H]4CCOC4)CC3)nc2c1 ZINC000131674086 251008698 /nfs/dbraw/zinc/00/86/98/251008698.db2.gz BMTHOZJFMSPINF-ZDUSSCGKSA-N 1 1 361.398 2.754 20 5 FFBDMO C[C@@H](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000181150229 251248186 /nfs/dbraw/zinc/24/81/86/251248186.db2.gz WZVRVQGGFGACBF-AWEZNQCLSA-N 1 1 356.426 2.817 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272510458 252056499 /nfs/dbraw/zinc/05/64/99/252056499.db2.gz IWLHHDHJBGLMTL-UYAOXDASSA-N 1 1 366.421 2.915 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000272510449 252056959 /nfs/dbraw/zinc/05/69/59/252056959.db2.gz IWLHHDHJBGLMTL-AZUAARDMSA-N 1 1 366.421 2.915 20 5 FFBDMO C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000272677368 252097192 /nfs/dbraw/zinc/09/71/92/252097192.db2.gz MLWPHGYPEXNQPQ-ZDUSSCGKSA-N 1 1 370.409 2.651 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C1=CC[N@@H+](C)CC1 ZINC000272761513 252123674 /nfs/dbraw/zinc/12/36/74/252123674.db2.gz PRIKZBUKPXMEKQ-JTQLQIEISA-N 1 1 355.341 2.576 20 5 FFBDMO CC(C)[N@@H+]1CCC[C@@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000272833568 252142884 /nfs/dbraw/zinc/14/28/84/252142884.db2.gz LLXUHHQNNTVOBL-NSHDSACASA-N 1 1 361.489 2.592 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000272833568 252142887 /nfs/dbraw/zinc/14/28/87/252142887.db2.gz LLXUHHQNNTVOBL-NSHDSACASA-N 1 1 361.489 2.592 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](C)Cc2cn3c(n2)CCCC3)cccc1[N+](=O)[O-] ZINC000372995601 512123686 /nfs/dbraw/zinc/12/36/86/512123686.db2.gz BISKEDJQZYGXNQ-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2cn3c(n2)CCCC3)cccc1[N+](=O)[O-] ZINC000372995601 512123690 /nfs/dbraw/zinc/12/36/90/512123690.db2.gz BISKEDJQZYGXNQ-UHFFFAOYSA-N 1 1 371.441 2.897 20 5 FFBDMO COC(=O)c1cnc(N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000276690041 256122014 /nfs/dbraw/zinc/12/20/14/256122014.db2.gz HBGCPSHNAVSIPV-OLZOCXBDSA-N 1 1 362.430 2.841 20 5 FFBDMO O=c1[nH]ccc2c1C[N@@H+](CCc1ncc(-c3cccc([N+](=O)[O-])c3)o1)CC2 ZINC000277010906 256151516 /nfs/dbraw/zinc/15/15/16/256151516.db2.gz XZRAZSGPVLHZPE-UHFFFAOYSA-N 1 1 366.377 2.951 20 5 FFBDMO O=C1OCCN1c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000277463564 256200550 /nfs/dbraw/zinc/20/05/50/256200550.db2.gz PINSLCZPNNCFBT-OAHLLOKOSA-N 1 1 360.414 2.980 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])cc2Br)CCCO1 ZINC000277568700 256212427 /nfs/dbraw/zinc/21/24/27/256212427.db2.gz AZWQIWOYENESRC-LLVKDONJSA-N 1 1 373.251 2.665 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000277650089 256222314 /nfs/dbraw/zinc/22/23/14/256222314.db2.gz YVTOUJOIAKQFFO-ZDUSSCGKSA-N 1 1 362.386 2.558 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000277630225 256219536 /nfs/dbraw/zinc/21/95/36/256219536.db2.gz XDMNMJALOOTBMM-AWEZNQCLSA-N 1 1 370.409 2.595 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[NH+](C2CC2)CC1 ZINC000279011610 256371901 /nfs/dbraw/zinc/37/19/01/256371901.db2.gz LRKHWSNZQGWZPS-UHFFFAOYSA-N 1 1 372.347 2.603 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000286120818 257021350 /nfs/dbraw/zinc/02/13/50/257021350.db2.gz MIIMQASMYCFSNA-INIZCTEOSA-N 1 1 370.409 2.578 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000286120818 257021351 /nfs/dbraw/zinc/02/13/51/257021351.db2.gz MIIMQASMYCFSNA-INIZCTEOSA-N 1 1 370.409 2.578 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286186365 257024626 /nfs/dbraw/zinc/02/46/26/257024626.db2.gz AGEUTFRJJYJCMB-FKEKPDDDSA-N 1 1 372.469 2.892 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000286667093 257048497 /nfs/dbraw/zinc/04/84/97/257048497.db2.gz UXLLRWWVENPUFZ-JSGCOSHPSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H](CO)C1 ZINC000286667093 257048498 /nfs/dbraw/zinc/04/84/98/257048498.db2.gz UXLLRWWVENPUFZ-JSGCOSHPSA-N 1 1 362.348 2.986 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]([C@@H](C)CO)C2CCCC2)c([N+](=O)[O-])c1 ZINC000287934711 257131311 /nfs/dbraw/zinc/13/13/11/257131311.db2.gz WZAYTOGFKYNDDL-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000289419091 257280123 /nfs/dbraw/zinc/28/01/23/257280123.db2.gz BSYLRKKCMAFFKJ-FUHWJXTLSA-N 1 1 359.426 2.957 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H](n3cccn3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000291351704 257399290 /nfs/dbraw/zinc/39/92/90/257399290.db2.gz XGOGSPKMRNAGCR-QGZVFWFLSA-N 1 1 352.398 2.639 20 5 FFBDMO CN(C)C(=O)c1cccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000299085316 257963253 /nfs/dbraw/zinc/96/32/53/257963253.db2.gz SCFNYGKYSRFDAH-UHFFFAOYSA-N 1 1 368.437 2.619 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000298667486 257931825 /nfs/dbraw/zinc/93/18/25/257931825.db2.gz YHBKQLQPQKGCEC-DOTOQJQBSA-N 1 1 363.414 2.575 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000301145176 258028901 /nfs/dbraw/zinc/02/89/01/258028901.db2.gz AIFONBSYEGNFKK-ZDUSSCGKSA-N 1 1 369.487 2.921 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000301183343 258031788 /nfs/dbraw/zinc/03/17/88/258031788.db2.gz IRUQXEKSXUGNRY-HNNXBMFYSA-N 1 1 352.866 2.855 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299641445 258012674 /nfs/dbraw/zinc/01/26/74/258012674.db2.gz NEDGJYLFARRQTI-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]1C[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000299641445 258012676 /nfs/dbraw/zinc/01/26/76/258012676.db2.gz NEDGJYLFARRQTI-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO CC(C)NC(=O)c1ccc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])c1 ZINC000302663312 258107514 /nfs/dbraw/zinc/10/75/14/258107514.db2.gz MAVOUYIPMNGBRK-UHFFFAOYSA-N 1 1 371.441 2.920 20 5 FFBDMO COc1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1 ZINC000301477716 258051561 /nfs/dbraw/zinc/05/15/61/258051561.db2.gz PSKQKQKMVIDDOJ-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000301557120 258055864 /nfs/dbraw/zinc/05/58/64/258055864.db2.gz SMXRGFCYDOZBOX-CYBMUJFWSA-N 1 1 352.391 2.590 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301878826 258072597 /nfs/dbraw/zinc/07/25/97/258072597.db2.gz JKUUSJZCPJZXSP-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330691303 258168334 /nfs/dbraw/zinc/16/83/34/258168334.db2.gz BCWRWYNUVGNVTC-RDJZCZTQSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000330703741 258168895 /nfs/dbraw/zinc/16/88/95/258168895.db2.gz JIRFKMQMQMCWJK-RDJZCZTQSA-N 1 1 363.458 2.961 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000330783050 258170505 /nfs/dbraw/zinc/17/05/05/258170505.db2.gz HRWUWZBYUGSXLM-JQWIXIFHSA-N 1 1 357.357 2.751 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@H]2CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000332474806 258231672 /nfs/dbraw/zinc/23/16/72/258231672.db2.gz KZQJCBUARLCRDO-OCCSQVGLSA-N 1 1 366.849 2.745 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(OC(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000332485922 258231947 /nfs/dbraw/zinc/23/19/47/258231947.db2.gz AWAGWPRYPZUFAR-OLZOCXBDSA-N 1 1 369.368 2.753 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757813 258199501 /nfs/dbraw/zinc/19/95/01/258199501.db2.gz BDRCIYKNQRZUME-HZSPNIEDSA-N 1 1 363.462 2.919 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757813 258199502 /nfs/dbraw/zinc/19/95/02/258199502.db2.gz BDRCIYKNQRZUME-HZSPNIEDSA-N 1 1 363.462 2.919 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000331757813 258199503 /nfs/dbraw/zinc/19/95/03/258199503.db2.gz BDRCIYKNQRZUME-HZSPNIEDSA-N 1 1 363.462 2.919 20 5 FFBDMO O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3o1)C2 ZINC000375318791 512264772 /nfs/dbraw/zinc/26/47/72/512264772.db2.gz KFKHGZJFRYJHJD-LJQANCHMSA-N 1 1 364.361 2.832 20 5 FFBDMO CNC(=O)c1ccc(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000053558305 506405691 /nfs/dbraw/zinc/40/56/91/506405691.db2.gz NLIMTSTWTARIQB-CQSZACIVSA-N 1 1 368.437 2.813 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1C[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000066378115 506501177 /nfs/dbraw/zinc/50/11/77/506501177.db2.gz FWXBQMVUJQFKKJ-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000066378115 506501185 /nfs/dbraw/zinc/50/11/85/506501185.db2.gz FWXBQMVUJQFKKJ-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1CN1C[C@@H](C)O[C@@H](C)C1 ZINC000066378115 506501190 /nfs/dbraw/zinc/50/11/90/506501190.db2.gz FWXBQMVUJQFKKJ-DAYGRLMNSA-N 1 1 363.458 2.677 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000041903367 506566842 /nfs/dbraw/zinc/56/68/42/506566842.db2.gz QNHBPUBXJAUXKR-MRXNPFEDSA-N 1 1 358.398 2.848 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])cn1 ZINC000054626151 506591202 /nfs/dbraw/zinc/59/12/02/506591202.db2.gz CTCKLRNLQSOYKV-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1 ZINC000067387604 506856594 /nfs/dbraw/zinc/85/65/94/506856594.db2.gz BIKLOTAFLNMHLQ-NUJGCVRESA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000045623080 506993428 /nfs/dbraw/zinc/99/34/28/506993428.db2.gz NOOZOTSIOAUBTM-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000045623080 506993430 /nfs/dbraw/zinc/99/34/30/506993430.db2.gz NOOZOTSIOAUBTM-CYBMUJFWSA-N 1 1 374.466 2.902 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067794546 507010666 /nfs/dbraw/zinc/01/06/66/507010666.db2.gz BQCZJLFPCJYPPR-SFHVURJKSA-N 1 1 369.421 2.661 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000067794546 507010676 /nfs/dbraw/zinc/01/06/76/507010676.db2.gz BQCZJLFPCJYPPR-SFHVURJKSA-N 1 1 369.421 2.661 20 5 FFBDMO C[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCCC[C@H]1C ZINC000067830429 507020444 /nfs/dbraw/zinc/02/04/44/507020444.db2.gz LCVDQMPWFRYJEE-CABCVRRESA-N 1 1 358.442 2.929 20 5 FFBDMO C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000057004567 507144028 /nfs/dbraw/zinc/14/40/28/507144028.db2.gz VTJFJOCBAGLVPS-OAHLLOKOSA-N 1 1 368.437 2.841 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)CC1 ZINC000047272518 507297699 /nfs/dbraw/zinc/29/76/99/507297699.db2.gz FOXUELJWIFDQNO-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000069476496 507497090 /nfs/dbraw/zinc/49/70/90/507497090.db2.gz GILLHGASBHBMLV-KRWDZBQOSA-N 1 1 369.421 2.998 20 5 FFBDMO O=C(CC[NH+]1CCN(c2ccccc2F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000026160580 507563525 /nfs/dbraw/zinc/56/35/25/507563525.db2.gz JLOLCECABNQHOR-UHFFFAOYSA-N 1 1 372.400 2.885 20 5 FFBDMO COc1cc(C[NH+]2CCC3(CC2)OCCO3)c([N+](=O)[O-])cc1OC(F)F ZINC000026935555 507622061 /nfs/dbraw/zinc/62/20/61/507622061.db2.gz WYOYSUHJNNYYKZ-UHFFFAOYSA-N 1 1 374.340 2.544 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026923494 507622551 /nfs/dbraw/zinc/62/25/51/507622551.db2.gz RYTJIFDWKUNDRG-LBPRGKRZSA-N 1 1 357.366 2.955 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000026923494 507622557 /nfs/dbraw/zinc/62/25/57/507622557.db2.gz RYTJIFDWKUNDRG-LBPRGKRZSA-N 1 1 357.366 2.955 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000027346982 507649222 /nfs/dbraw/zinc/64/92/22/507649222.db2.gz AEBNCGFEFQIILG-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000027346982 507649226 /nfs/dbraw/zinc/64/92/26/507649226.db2.gz AEBNCGFEFQIILG-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO Cc1ccc(C[N@@H+](C)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000050784443 507714565 /nfs/dbraw/zinc/71/45/65/507714565.db2.gz WQAOVTJXRCDVAR-QGZVFWFLSA-N 1 1 353.378 2.667 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000050784443 507714569 /nfs/dbraw/zinc/71/45/69/507714569.db2.gz WQAOVTJXRCDVAR-QGZVFWFLSA-N 1 1 353.378 2.667 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051341616 507762665 /nfs/dbraw/zinc/76/26/65/507762665.db2.gz HZNYDNYNSCJMFG-CQSZACIVSA-N 1 1 360.439 2.932 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000029207977 507768659 /nfs/dbraw/zinc/76/86/59/507768659.db2.gz FCVCLQDSZZKDLM-KRWDZBQOSA-N 1 1 363.458 2.770 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000108341364 507888212 /nfs/dbraw/zinc/88/82/12/507888212.db2.gz JSXNORCJCVZCRN-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000074323826 508012344 /nfs/dbraw/zinc/01/23/44/508012344.db2.gz ZTHBWHCWWGZSIG-AWEZNQCLSA-N 1 1 365.861 2.981 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000074326952 508012382 /nfs/dbraw/zinc/01/23/82/508012382.db2.gz GKFTWYLRNGWFQU-KRWDZBQOSA-N 1 1 374.485 2.977 20 5 FFBDMO CC(C)CC[NH+]1CCC(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000079996392 508024651 /nfs/dbraw/zinc/02/46/51/508024651.db2.gz OEDLQWMSYBITAY-UHFFFAOYSA-N 1 1 373.457 2.959 20 5 FFBDMO C[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000110966866 508061500 /nfs/dbraw/zinc/06/15/00/508061500.db2.gz NMAQZJXQOOLGIK-ZDUSSCGKSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@H+](C)Cc1ccccc1 ZINC000110966866 508061503 /nfs/dbraw/zinc/06/15/03/508061503.db2.gz NMAQZJXQOOLGIK-ZDUSSCGKSA-N 1 1 367.409 2.721 20 5 FFBDMO C[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)Cc1ccccc1 ZINC000110966866 508061505 /nfs/dbraw/zinc/06/15/05/508061505.db2.gz NMAQZJXQOOLGIK-ZDUSSCGKSA-N 1 1 367.409 2.721 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(n3ccnc3)CC2)cccc1[N+](=O)[O-] ZINC000111243939 508081680 /nfs/dbraw/zinc/08/16/80/508081680.db2.gz WCWSZLXLCWMESX-CQSZACIVSA-N 1 1 357.414 2.764 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092660739 508092017 /nfs/dbraw/zinc/09/20/17/508092017.db2.gz QMZGWFUUPRGSEG-LLVKDONJSA-N 1 1 357.357 2.674 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000092660739 508092020 /nfs/dbraw/zinc/09/20/20/508092020.db2.gz QMZGWFUUPRGSEG-LLVKDONJSA-N 1 1 357.357 2.674 20 5 FFBDMO COc1ccc(C[NH2+]CC2(N3CCCCC3)CCOCC2)cc1[N+](=O)[O-] ZINC000111403860 508096995 /nfs/dbraw/zinc/09/69/95/508096995.db2.gz MKSATHYVDYLODK-UHFFFAOYSA-N 1 1 363.458 2.728 20 5 FFBDMO CCc1ccc(C2=CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1 ZINC000093262747 508131960 /nfs/dbraw/zinc/13/19/60/508131960.db2.gz ZASDAFUFOWGTBO-LJQANCHMSA-N 1 1 356.426 2.504 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])cc[nH+]1 ZINC000112496218 508190369 /nfs/dbraw/zinc/19/03/69/508190369.db2.gz SEPXAKZJAMEIGV-UHFFFAOYSA-N 1 1 372.200 2.862 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)[C@H](C)C1 ZINC000076491679 508213620 /nfs/dbraw/zinc/21/36/20/508213620.db2.gz DGOMFXLTEIGFAL-KDOFPFPSSA-N 1 1 371.441 2.583 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)cn1 ZINC000077222754 508289479 /nfs/dbraw/zinc/28/94/79/508289479.db2.gz CUVHBIXMUNHZKX-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])C(C)C ZINC000103194152 508301577 /nfs/dbraw/zinc/30/15/77/508301577.db2.gz LCVDPVHKFYJEQD-UHFFFAOYSA-N 1 1 355.460 2.785 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])nc3)C2)cc(OC)c1 ZINC000088751409 508382375 /nfs/dbraw/zinc/38/23/75/508382375.db2.gz KNFVWYRJUDYIAS-OAHLLOKOSA-N 1 1 358.398 2.693 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](CCNc1nc(C)ccc1[N+](=O)[O-])CC2 ZINC000121862865 508434847 /nfs/dbraw/zinc/43/48/47/508434847.db2.gz LPCCSTAVTFHPNO-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](CCNc1nc(C)ccc1[N+](=O)[O-])CC2 ZINC000121862865 508434850 /nfs/dbraw/zinc/43/48/50/508434850.db2.gz LPCCSTAVTFHPNO-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO COC(=O)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCCC1 ZINC000134089792 508491731 /nfs/dbraw/zinc/49/17/31/508491731.db2.gz GXDWUVMKRZMGTL-UHFFFAOYSA-N 1 1 363.414 2.649 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1 ZINC000157202990 508536676 /nfs/dbraw/zinc/53/66/76/508536676.db2.gz HAJOZZWQRQTNLP-PBHICJAKSA-N 1 1 358.442 2.725 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](Nc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000116780521 508560533 /nfs/dbraw/zinc/56/05/33/508560533.db2.gz ZSTPALXHRNSGDY-KRWDZBQOSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](Nc2ccccc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000116780521 508560535 /nfs/dbraw/zinc/56/05/35/508560535.db2.gz ZSTPALXHRNSGDY-KRWDZBQOSA-N 1 1 366.421 2.670 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122900777 508604665 /nfs/dbraw/zinc/60/46/65/508604665.db2.gz ZYZCYIQCLLDJGU-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000122946070 508612057 /nfs/dbraw/zinc/61/20/57/508612057.db2.gz LHOFJONZTILPNW-AWEZNQCLSA-N 1 1 362.430 2.989 20 5 FFBDMO CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652530 /nfs/dbraw/zinc/65/25/30/508652530.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 1 1 364.421 2.621 20 5 FFBDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652533 /nfs/dbraw/zinc/65/25/33/508652533.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 1 1 364.421 2.621 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128860028 508652538 /nfs/dbraw/zinc/65/25/38/508652538.db2.gz FHFWNCXIAVBRGP-HIFRSBDPSA-N 1 1 364.421 2.621 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1[nH]ncc1[N+](=O)[O-] ZINC000136071716 508668316 /nfs/dbraw/zinc/66/83/16/508668316.db2.gz XETJMRNSFMRIAY-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136071716 508668321 /nfs/dbraw/zinc/66/83/21/508668321.db2.gz XETJMRNSFMRIAY-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000136071716 508668324 /nfs/dbraw/zinc/66/83/24/508668324.db2.gz XETJMRNSFMRIAY-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000153934291 508680299 /nfs/dbraw/zinc/68/02/99/508680299.db2.gz NUINZWWGNJDQLP-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1 ZINC000136314455 508685842 /nfs/dbraw/zinc/68/58/42/508685842.db2.gz SIKVQYHYUYJXCJ-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000136314455 508685844 /nfs/dbraw/zinc/68/58/44/508685844.db2.gz SIKVQYHYUYJXCJ-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1 ZINC000136314455 508685846 /nfs/dbraw/zinc/68/58/46/508685846.db2.gz SIKVQYHYUYJXCJ-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1cccc(F)c1 ZINC000118866463 508688482 /nfs/dbraw/zinc/68/84/82/508688482.db2.gz HZFLEDVYHICCGH-OAHLLOKOSA-N 1 1 373.388 2.644 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(-n4cccn4)cc3)C2)nc1 ZINC000118866495 508688806 /nfs/dbraw/zinc/68/88/06/508688806.db2.gz LWOUHMXXDLSYNZ-MRXNPFEDSA-N 1 1 364.409 2.862 20 5 FFBDMO CN(CC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000154012468 508698980 /nfs/dbraw/zinc/69/89/80/508698980.db2.gz LQQNTLQXGWRPDS-WBVHZDCISA-N 1 1 372.469 2.506 20 5 FFBDMO O=C(CC[N@@H+]1CCOC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000375597027 512412362 /nfs/dbraw/zinc/41/23/62/512412362.db2.gz JMXSMAFECXJRKF-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000375597027 512412366 /nfs/dbraw/zinc/41/23/66/512412366.db2.gz JMXSMAFECXJRKF-GOSISDBHSA-N 1 1 355.394 2.997 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)C2 ZINC000154097338 508716639 /nfs/dbraw/zinc/71/66/39/508716639.db2.gz LMNZQGOEBPAEJU-QWHCGFSZSA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137431698 508756557 /nfs/dbraw/zinc/75/65/57/508756557.db2.gz YVMAOMFZVKPBQA-IUODEOHRSA-N 1 1 372.400 2.709 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000137476396 508757523 /nfs/dbraw/zinc/75/75/23/508757523.db2.gz WLSZNRQAIHCRDW-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000138375706 508773042 /nfs/dbraw/zinc/77/30/42/508773042.db2.gz ICQHNMGZEHVNLF-CQSZACIVSA-N 1 1 357.410 2.826 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]Cc2ccnc(N3CCN(C)CC3)c2)cccc1[N+](=O)[O-] ZINC000159165611 508801599 /nfs/dbraw/zinc/80/15/99/508801599.db2.gz ARQUTBXCAIKOHX-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000119593786 508825154 /nfs/dbraw/zinc/82/51/54/508825154.db2.gz WNDFNMFVYCTQEZ-BEFAXECRSA-N 1 1 368.437 2.915 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-] ZINC000119749399 508855974 /nfs/dbraw/zinc/85/59/74/508855974.db2.gz MAABMHMPKPHZLZ-QAPCUYQASA-N 1 1 353.422 2.774 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC[N@H+]1CCOC ZINC000154872261 508873572 /nfs/dbraw/zinc/87/35/72/508873572.db2.gz WKZRNDVCTWQWPT-INIZCTEOSA-N 1 1 364.446 2.868 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000159716376 508879879 /nfs/dbraw/zinc/87/98/79/508879879.db2.gz RDWKSZORPWPIEE-UHFFFAOYSA-N 1 1 374.441 2.507 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](OCC(C)C)C1 ZINC000119874131 508881751 /nfs/dbraw/zinc/88/17/51/508881751.db2.gz JEULZMRYLIHUQN-OAHLLOKOSA-N 1 1 365.430 2.679 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1CCOC ZINC000131071630 508883904 /nfs/dbraw/zinc/88/39/04/508883904.db2.gz MIYYXFRFXWEFFV-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CCOC ZINC000131071630 508883905 /nfs/dbraw/zinc/88/39/05/508883905.db2.gz MIYYXFRFXWEFFV-CQSZACIVSA-N 1 1 369.849 2.821 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1ccc([N+](=O)[O-])cc1F ZINC000150809034 508897543 /nfs/dbraw/zinc/89/75/43/508897543.db2.gz YHOSLLIJBBAAMO-HZSPNIEDSA-N 1 1 351.422 2.759 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC(=O)OC(C)(C)C ZINC000150830025 508902785 /nfs/dbraw/zinc/90/27/85/508902785.db2.gz XMOPCOOAWJWQRX-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO CC(C)[N@H+](CCc1nccs1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000159931639 508913227 /nfs/dbraw/zinc/91/32/27/508913227.db2.gz IIUCIGHNQLKPQD-UHFFFAOYSA-N 1 1 374.466 2.894 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000159931639 508913231 /nfs/dbraw/zinc/91/32/31/508913231.db2.gz IIUCIGHNQLKPQD-UHFFFAOYSA-N 1 1 374.466 2.894 20 5 FFBDMO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000150930573 508924681 /nfs/dbraw/zinc/92/46/81/508924681.db2.gz CGPSSKQAKKCORW-AWEZNQCLSA-N 1 1 353.382 2.905 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)CCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000150953086 508929491 /nfs/dbraw/zinc/92/94/91/508929491.db2.gz BFTSJVRXMHQRBK-ZDUSSCGKSA-N 1 1 365.430 2.894 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCC(=O)OC(C)(C)C)cccc1[N+](=O)[O-] ZINC000150953086 508929495 /nfs/dbraw/zinc/92/94/95/508929495.db2.gz BFTSJVRXMHQRBK-ZDUSSCGKSA-N 1 1 365.430 2.894 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000150979570 508934708 /nfs/dbraw/zinc/93/47/08/508934708.db2.gz ODGMJEIEJNKIGU-LLVKDONJSA-N 1 1 372.263 2.746 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000160270865 508963638 /nfs/dbraw/zinc/96/36/38/508963638.db2.gz NOHNTHXBNOOJPK-MRXNPFEDSA-N 1 1 362.474 2.949 20 5 FFBDMO C[NH+](C)[C@H](CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)c1ccco1 ZINC000161141968 509077016 /nfs/dbraw/zinc/07/70/16/509077016.db2.gz UIAYXXSZKAQRPE-MRXNPFEDSA-N 1 1 358.398 2.558 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000155842439 509080430 /nfs/dbraw/zinc/08/04/30/509080430.db2.gz GJEJBNOHHNBZGN-BBRMVZONSA-N 1 1 351.834 2.733 20 5 FFBDMO CSCC[C@H](C)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000126604970 509101456 /nfs/dbraw/zinc/10/14/56/509101456.db2.gz MQRSOHGBAUZDSV-LBPRGKRZSA-N 1 1 353.444 2.966 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126672458 509110902 /nfs/dbraw/zinc/11/09/02/509110902.db2.gz JMAQVGOSVLKZEB-LBPRGKRZSA-N 1 1 372.450 2.932 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCCC[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000162049656 509170510 /nfs/dbraw/zinc/17/05/10/509170510.db2.gz KMERQRHABHEACK-HNNXBMFYSA-N 1 1 359.382 2.703 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCCC[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000162049656 509170511 /nfs/dbraw/zinc/17/05/11/509170511.db2.gz KMERQRHABHEACK-HNNXBMFYSA-N 1 1 359.382 2.703 20 5 FFBDMO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1c(C)noc1C ZINC000182423083 509231541 /nfs/dbraw/zinc/23/15/41/509231541.db2.gz VYLWFZCHDFPQFN-ZDUSSCGKSA-N 1 1 362.386 2.888 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000162588708 509259724 /nfs/dbraw/zinc/25/97/24/509259724.db2.gz XMHGYVZRYANTBY-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000172831505 509260953 /nfs/dbraw/zinc/26/09/53/509260953.db2.gz CCRCEJKFRBYMPV-HNNXBMFYSA-N 1 1 371.441 2.727 20 5 FFBDMO CCN1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)CC1 ZINC000266987098 509294638 /nfs/dbraw/zinc/29/46/38/509294638.db2.gz SOZCILFKFQYHPU-CQSZACIVSA-N 1 1 372.391 2.830 20 5 FFBDMO CC(C)c1ccnc(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000185829190 509376230 /nfs/dbraw/zinc/37/62/30/509376230.db2.gz BBOARNITAVRLSI-UHFFFAOYSA-N 1 1 355.442 2.873 20 5 FFBDMO C[C@@H]1C[C@H]([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CCN1Cc1ccccc1 ZINC000176250985 509402241 /nfs/dbraw/zinc/40/22/41/509402241.db2.gz KBFZPODSEAHQJZ-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@@H+]1Cc1ccccc1 ZINC000176250985 509402248 /nfs/dbraw/zinc/40/22/48/509402248.db2.gz KBFZPODSEAHQJZ-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176250985 509402254 /nfs/dbraw/zinc/40/22/54/509402254.db2.gz KBFZPODSEAHQJZ-SJLPKXTDSA-N 1 1 357.458 2.776 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000179367581 509405024 /nfs/dbraw/zinc/40/50/24/509405024.db2.gz VEOXTEQXXPKOMN-ACJLOTCBSA-N 1 1 356.426 2.561 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000264282625 509432368 /nfs/dbraw/zinc/43/23/68/509432368.db2.gz IOLULUWQVABXRN-IBGZPJMESA-N 1 1 367.449 2.818 20 5 FFBDMO O=C1[C@H]([NH+]2CCC([C@H]3CCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000189163679 509443619 /nfs/dbraw/zinc/44/36/19/509443619.db2.gz RCJVGPMQKGMJJV-QZTJIDSGSA-N 1 1 359.426 2.591 20 5 FFBDMO CCOc1ccc(NC(=O)CN2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000267416859 509469744 /nfs/dbraw/zinc/46/97/44/509469744.db2.gz JMZOGFBMTQZZRT-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000267428318 509476706 /nfs/dbraw/zinc/47/67/06/509476706.db2.gz CCYFAPWRIXRXOA-JQWIXIFHSA-N 1 1 370.247 2.912 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000192383526 509495936 /nfs/dbraw/zinc/49/59/36/509495936.db2.gz AKKJBJYNDPXQFY-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000189300284 509508225 /nfs/dbraw/zinc/50/82/25/509508225.db2.gz AFXSSMUGPFQFLL-INIZCTEOSA-N 1 1 370.409 2.853 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](OCCO)C3)cs2)c1 ZINC000179570533 509517779 /nfs/dbraw/zinc/51/77/79/509517779.db2.gz ZVPQXWHGNRMWDU-MRXNPFEDSA-N 1 1 363.439 2.692 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](OCCO)C3)cs2)c1 ZINC000179570533 509517789 /nfs/dbraw/zinc/51/77/89/509517789.db2.gz ZVPQXWHGNRMWDU-MRXNPFEDSA-N 1 1 363.439 2.692 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000249119395 509612128 /nfs/dbraw/zinc/61/21/28/509612128.db2.gz SMTIKIQJZILMKB-XJKSGUPXSA-N 1 1 373.409 2.923 20 5 FFBDMO COc1ccc(OCC[NH+]2CCN(c3ccc(O)cc3)CC2)c([N+](=O)[O-])c1 ZINC000173464955 509618088 /nfs/dbraw/zinc/61/80/88/509618088.db2.gz ASDNEXQFJQBAON-UHFFFAOYSA-N 1 1 373.409 2.510 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CCC(CCC[N@@H+](C)CCOC)CC1 ZINC000192734356 509620765 /nfs/dbraw/zinc/62/07/65/509620765.db2.gz XACZXTKGGVZFSX-UHFFFAOYSA-N 1 1 367.494 2.694 20 5 FFBDMO CCN1CCN(C[C@@H](C)C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192823652 509658942 /nfs/dbraw/zinc/65/89/42/509658942.db2.gz DIVNSLQBRXHOEZ-OXJNMPFZSA-N 1 1 360.502 2.835 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192823698 509659456 /nfs/dbraw/zinc/65/94/56/509659456.db2.gz DIVNSLQBRXHOEZ-UZLBHIALSA-N 1 1 360.502 2.835 20 5 FFBDMO Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2C)[NH+]2CCCC2)o1 ZINC000170633835 509687862 /nfs/dbraw/zinc/68/78/62/509687862.db2.gz NOWSPLDOAXQPDO-INIZCTEOSA-N 1 1 358.398 2.767 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1C ZINC000173668515 509708610 /nfs/dbraw/zinc/70/86/10/509708610.db2.gz AOIUTEMNVPELPV-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)Cc1ccccc1 ZINC000180013230 509710192 /nfs/dbraw/zinc/71/01/92/509710192.db2.gz RRELYULUAORAJH-UHFFFAOYSA-N 1 1 371.393 2.575 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058755 509729510 /nfs/dbraw/zinc/72/95/10/509729510.db2.gz JDTOHROUYBIIBZ-WCQYABFASA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2C[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180170748 509792035 /nfs/dbraw/zinc/79/20/35/509792035.db2.gz UZUJYEKQINDYBV-AAEUAGOBSA-N 1 1 374.384 2.983 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177038929 509832875 /nfs/dbraw/zinc/83/28/75/509832875.db2.gz QVQLKCZCPRCVED-CYBMUJFWSA-N 1 1 360.414 2.864 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000177038929 509832880 /nfs/dbraw/zinc/83/28/80/509832880.db2.gz QVQLKCZCPRCVED-CYBMUJFWSA-N 1 1 360.414 2.864 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180259897 509837762 /nfs/dbraw/zinc/83/77/62/509837762.db2.gz WSBZJWCEBIFDBD-FZMZJTMJSA-N 1 1 374.384 2.840 20 5 FFBDMO COC(=O)[C@H]1CCCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906603 509842351 /nfs/dbraw/zinc/84/23/51/509842351.db2.gz YZMZWSZTCAEGPN-OAHLLOKOSA-N 1 1 359.382 2.820 20 5 FFBDMO COC(=O)[C@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906603 509842357 /nfs/dbraw/zinc/84/23/57/509842357.db2.gz YZMZWSZTCAEGPN-OAHLLOKOSA-N 1 1 359.382 2.820 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1SC ZINC000177073649 509854334 /nfs/dbraw/zinc/85/43/34/509854334.db2.gz VURIHQHJSWRKDB-QWRGUYRKSA-N 1 1 365.455 2.680 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1SC ZINC000177073674 509855229 /nfs/dbraw/zinc/85/52/29/509855229.db2.gz VURIHQHJSWRKDB-WDEREUQCSA-N 1 1 365.455 2.680 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000253096741 509861927 /nfs/dbraw/zinc/86/19/27/509861927.db2.gz QTFRHOKPMXUARR-BXKDBHETSA-N 1 1 357.204 2.598 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000253096741 509861936 /nfs/dbraw/zinc/86/19/36/509861936.db2.gz QTFRHOKPMXUARR-BXKDBHETSA-N 1 1 357.204 2.598 20 5 FFBDMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000268336893 509875589 /nfs/dbraw/zinc/87/55/89/509875589.db2.gz GEQYWZQDEIRWSE-GXFFZTMASA-N 1 1 370.247 2.816 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C1 ZINC000190028601 509893994 /nfs/dbraw/zinc/89/39/94/509893994.db2.gz BHHJQEADZYNKQZ-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000177144779 509899919 /nfs/dbraw/zinc/89/99/19/509899919.db2.gz QOJICPSGNNCOFI-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000177144779 509899924 /nfs/dbraw/zinc/89/99/24/509899924.db2.gz QOJICPSGNNCOFI-LLVKDONJSA-N 1 1 363.414 2.972 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 ZINC000245446675 509943040 /nfs/dbraw/zinc/94/30/40/509943040.db2.gz LILSXLFDWVYFNM-VQIMIIECSA-N 1 1 369.425 2.861 20 5 FFBDMO COCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 ZINC000171128091 509958540 /nfs/dbraw/zinc/95/85/40/509958540.db2.gz KWEMCXHEOYJZRO-UHFFFAOYSA-N 1 1 373.409 2.695 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000193584347 509976621 /nfs/dbraw/zinc/97/66/21/509976621.db2.gz XAXORVKZAROZCN-KBPBESRZSA-N 1 1 364.446 2.913 20 5 FFBDMO O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NCc1ccccc1 ZINC000174241676 510020722 /nfs/dbraw/zinc/02/07/22/510020722.db2.gz HVJNAEXUACYWPZ-UHFFFAOYSA-N 1 1 369.421 2.754 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H](C)O1 ZINC000193738943 510044663 /nfs/dbraw/zinc/04/46/63/510044663.db2.gz JEHSLGDUKUTAQX-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H](C)O1 ZINC000193738943 510044669 /nfs/dbraw/zinc/04/46/69/510044669.db2.gz JEHSLGDUKUTAQX-TXEJJXNPSA-N 1 1 359.373 2.742 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])cc1F ZINC000180706110 510063121 /nfs/dbraw/zinc/06/31/21/510063121.db2.gz GEFHNOIZAGAVKM-UHFFFAOYSA-N 1 1 369.356 2.740 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000193947938 510143131 /nfs/dbraw/zinc/14/31/31/510143131.db2.gz JCTBIILOVMSSRH-KBPBESRZSA-N 1 1 364.446 2.523 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190459894 510143145 /nfs/dbraw/zinc/14/31/45/510143145.db2.gz KGFNLXQDDUSBIU-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCSC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000190459894 510143152 /nfs/dbraw/zinc/14/31/52/510143152.db2.gz KGFNLXQDDUSBIU-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000174536701 510165124 /nfs/dbraw/zinc/16/51/24/510165124.db2.gz AILAKFJBCPFXPW-INIZCTEOSA-N 1 1 374.485 2.611 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194107125 510218430 /nfs/dbraw/zinc/21/84/30/510218430.db2.gz SUTFAQGUYXPPKH-GOSISDBHSA-N 1 1 368.437 2.916 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000174721317 510269075 /nfs/dbraw/zinc/26/90/75/510269075.db2.gz MVZOVJDKHONBLT-HOTGVXAUSA-N 1 1 350.806 2.643 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@](O)(C(F)(F)F)C3)o2)c1 ZINC000174751500 510292619 /nfs/dbraw/zinc/29/26/19/510292619.db2.gz VOVXBASBBIUBLF-HNNXBMFYSA-N 1 1 371.315 2.791 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1CN1CCCC1 ZINC000171708295 510323124 /nfs/dbraw/zinc/32/31/24/510323124.db2.gz HETRIHGBHVCUMD-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1CN1CCCC1 ZINC000171708295 510323129 /nfs/dbraw/zinc/32/31/29/510323129.db2.gz HETRIHGBHVCUMD-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NC[C@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000246154451 510325294 /nfs/dbraw/zinc/32/52/94/510325294.db2.gz KQLWXKXSDWELGB-BZUAXINKSA-N 1 1 374.485 2.759 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000194398749 510345062 /nfs/dbraw/zinc/34/50/62/510345062.db2.gz YLLUBVBTXOOKIA-KRWDZBQOSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(S(N)(=O)=O)cc1 ZINC000181561254 510475651 /nfs/dbraw/zinc/47/56/51/510475651.db2.gz ASDHEZFZODWCPP-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)cccc1[N+](=O)[O-] ZINC000178182822 510475843 /nfs/dbraw/zinc/47/58/43/510475843.db2.gz LHCJRGXKSFHAGY-ZDUSSCGKSA-N 1 1 374.466 2.881 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000175138557 510500506 /nfs/dbraw/zinc/50/05/06/510500506.db2.gz IXIFYVGHZIQIKA-OAHLLOKOSA-N 1 1 369.487 2.707 20 5 FFBDMO COc1cc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000181673193 510532259 /nfs/dbraw/zinc/53/22/59/510532259.db2.gz AAGRVIRNFKFMGS-UKRRQHHQSA-N 1 1 361.442 2.986 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000181908846 510653589 /nfs/dbraw/zinc/65/35/89/510653589.db2.gz CBWLAQRPRGMQBV-MSOLQXFVSA-N 1 1 356.422 2.899 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000181909008 510655021 /nfs/dbraw/zinc/65/50/21/510655021.db2.gz LOBMBIPCASHXEM-QGZVFWFLSA-N 1 1 374.462 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000181909008 510655027 /nfs/dbraw/zinc/65/50/27/510655027.db2.gz LOBMBIPCASHXEM-QGZVFWFLSA-N 1 1 374.462 2.933 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC3(CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000266555468 510656364 /nfs/dbraw/zinc/65/63/64/510656364.db2.gz VSLHYMJEVKGRJU-UHFFFAOYSA-N 1 1 350.415 2.875 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000246876516 510722552 /nfs/dbraw/zinc/72/25/52/510722552.db2.gz ICNIFBROMZCDNS-UONOGXRCSA-N 1 1 351.472 2.876 20 5 FFBDMO C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1ccccc1 ZINC000270235556 510728492 /nfs/dbraw/zinc/72/84/92/510728492.db2.gz BEGHVEQKPREZPX-OALUTQOASA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1ccccc1 ZINC000270235556 510728502 /nfs/dbraw/zinc/72/85/02/510728502.db2.gz BEGHVEQKPREZPX-OALUTQOASA-N 1 1 369.421 2.996 20 5 FFBDMO CCC1(CC)C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[S@]1=O ZINC000185236667 510764575 /nfs/dbraw/zinc/76/45/75/510764575.db2.gz CGVDCSOGFSVKKM-RUZDIDTESA-N 1 1 367.471 2.547 20 5 FFBDMO CCC1(CC)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[S@]1=O ZINC000185236667 510764580 /nfs/dbraw/zinc/76/45/80/510764580.db2.gz CGVDCSOGFSVKKM-RUZDIDTESA-N 1 1 367.471 2.547 20 5 FFBDMO O=C(C[NH+]1CCC(OC2CCCC2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000195322581 510783014 /nfs/dbraw/zinc/78/30/14/510783014.db2.gz NFUYEEQKTJTWJQ-UHFFFAOYSA-N 1 1 373.453 2.908 20 5 FFBDMO CC[N@H+](Cc1ccc(OC)cc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182215016 510816708 /nfs/dbraw/zinc/81/67/08/510816708.db2.gz ZEGQJCDPXCJBQH-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248063 510833139 /nfs/dbraw/zinc/83/31/39/510833139.db2.gz XRIQBWMFKKWUMI-CJNGLKHVSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000182248063 510833146 /nfs/dbraw/zinc/83/31/46/510833146.db2.gz XRIQBWMFKKWUMI-CJNGLKHVSA-N 1 1 364.833 2.927 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000360321069 510895353 /nfs/dbraw/zinc/89/53/53/510895353.db2.gz BPOZYCVWOUNEFB-OAHLLOKOSA-N 1 1 370.409 2.502 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@H](Cc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000360321069 510895360 /nfs/dbraw/zinc/89/53/60/510895360.db2.gz BPOZYCVWOUNEFB-OAHLLOKOSA-N 1 1 370.409 2.502 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2cc(O)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000285455664 510914253 /nfs/dbraw/zinc/91/42/53/510914253.db2.gz JKFRNLWAMANHQR-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=C(CC[N@H+]1CCOc2cc(O)ccc2C1)Nc1ccccc1[N+](=O)[O-] ZINC000285455664 510914257 /nfs/dbraw/zinc/91/42/57/510914257.db2.gz JKFRNLWAMANHQR-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297354289 510914424 /nfs/dbraw/zinc/91/44/24/510914424.db2.gz BRYJFFCKROFKSX-NVXWUHKLSA-N 1 1 373.453 2.763 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@H](O)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000294071598 510946591 /nfs/dbraw/zinc/94/65/91/510946591.db2.gz YLUHNWAUBUCDEY-MRXNPFEDSA-N 1 1 360.410 2.647 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000294071598 510946597 /nfs/dbraw/zinc/94/65/97/510946597.db2.gz YLUHNWAUBUCDEY-MRXNPFEDSA-N 1 1 360.410 2.647 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1SCCOC ZINC000270731428 510966782 /nfs/dbraw/zinc/96/67/82/510966782.db2.gz UNFPBUAIXUHXID-CYBMUJFWSA-N 1 1 369.487 2.793 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000361067449 510988276 /nfs/dbraw/zinc/98/82/76/510988276.db2.gz NADYXNLPAFHAKC-MNOVXSKESA-N 1 1 355.341 2.553 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286515336 511027432 /nfs/dbraw/zinc/02/74/32/511027432.db2.gz NACHZEYTDQXRCR-DOMZBBRYSA-N 1 1 362.348 2.856 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](C2CC2)O1 ZINC000279366756 511058039 /nfs/dbraw/zinc/05/80/39/511058039.db2.gz RLZXPHZVDIUSFW-MEDUHNTESA-N 1 1 351.378 2.562 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H](C2CC2)O1 ZINC000279366743 511058688 /nfs/dbraw/zinc/05/86/88/511058688.db2.gz RLZXPHZVDIUSFW-BDJLRTHQSA-N 1 1 351.378 2.562 20 5 FFBDMO CCC[N@@H+](CCO)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000271032839 511063922 /nfs/dbraw/zinc/06/39/22/511063922.db2.gz IXRJPAAQORGJPR-UHFFFAOYSA-N 1 1 366.336 2.749 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000364761143 511066400 /nfs/dbraw/zinc/06/64/00/511066400.db2.gz UJMJZHJCYWQPJV-QGZVFWFLSA-N 1 1 361.329 2.736 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000364761143 511066403 /nfs/dbraw/zinc/06/64/03/511066403.db2.gz UJMJZHJCYWQPJV-QGZVFWFLSA-N 1 1 361.329 2.736 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccncc1OC[C@@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294457277 511071437 /nfs/dbraw/zinc/07/14/37/511071437.db2.gz VYVKJCRCVGZMRT-ZIAGYGMSSA-N 1 1 372.425 2.838 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@@H](c2ccncn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000361653695 511076229 /nfs/dbraw/zinc/07/62/29/511076229.db2.gz VCCCULUWYVSRNN-CQSZACIVSA-N 1 1 355.398 2.593 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCc1cnccn1 ZINC000271287298 511150700 /nfs/dbraw/zinc/15/07/00/511150700.db2.gz BITPPQLGZDKEJP-NSHDSACASA-N 1 1 363.805 2.540 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCc1cnccn1 ZINC000271287298 511150707 /nfs/dbraw/zinc/15/07/07/511150707.db2.gz BITPPQLGZDKEJP-NSHDSACASA-N 1 1 363.805 2.540 20 5 FFBDMO COCCCOCC[N@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000271442940 511205975 /nfs/dbraw/zinc/20/59/75/511205975.db2.gz BRCMDXSNYLKACA-CYBMUJFWSA-N 1 1 364.402 2.691 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000271442940 511205977 /nfs/dbraw/zinc/20/59/77/511205977.db2.gz BRCMDXSNYLKACA-CYBMUJFWSA-N 1 1 364.402 2.691 20 5 FFBDMO COCCCOCC[N@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000271442942 511206105 /nfs/dbraw/zinc/20/61/05/511206105.db2.gz BRCMDXSNYLKACA-ZDUSSCGKSA-N 1 1 364.402 2.691 20 5 FFBDMO COCCCOCC[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000271442942 511206107 /nfs/dbraw/zinc/20/61/07/511206107.db2.gz BRCMDXSNYLKACA-ZDUSSCGKSA-N 1 1 364.402 2.691 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000283255740 511296478 /nfs/dbraw/zinc/29/64/78/511296478.db2.gz KHKBZKORZDRQBA-KRWDZBQOSA-N 1 1 357.410 2.979 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000283255750 511296985 /nfs/dbraw/zinc/29/69/85/511296985.db2.gz KHKBZKORZDRQBA-QGZVFWFLSA-N 1 1 357.410 2.979 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000271772382 511318302 /nfs/dbraw/zinc/31/83/02/511318302.db2.gz ALDWCVBRMCRLOH-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](O)CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000295209745 511322490 /nfs/dbraw/zinc/32/24/90/511322490.db2.gz LKWDUESDBNRPDP-KRWDZBQOSA-N 1 1 358.442 2.978 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](C)(O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000280096580 511333976 /nfs/dbraw/zinc/33/39/76/511333976.db2.gz OULBBORONVCRMF-QGZVFWFLSA-N 1 1 374.384 2.984 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000283511157 511395440 /nfs/dbraw/zinc/39/54/40/511395440.db2.gz PTWIGPQMXZFAEK-LBPRGKRZSA-N 1 1 352.410 2.701 20 5 FFBDMO CC[NH+](CC)C[C@@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295432964 511404121 /nfs/dbraw/zinc/40/41/21/511404121.db2.gz WTODFJJNQHNLBD-AWEZNQCLSA-N 1 1 371.441 2.789 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000295471105 511417182 /nfs/dbraw/zinc/41/71/82/511417182.db2.gz GDRDFIGSLCCTPC-GFCCVEGCSA-N 1 1 367.421 2.856 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])cc1F ZINC000295471105 511417183 /nfs/dbraw/zinc/41/71/83/511417183.db2.gz GDRDFIGSLCCTPC-GFCCVEGCSA-N 1 1 367.421 2.856 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000295517820 511432399 /nfs/dbraw/zinc/43/23/99/511432399.db2.gz RTDUWNLCRFWFFJ-UHFFFAOYSA-N 1 1 358.398 2.611 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000363271884 511455117 /nfs/dbraw/zinc/45/51/17/511455117.db2.gz VRSWUOXASQTPPP-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-] ZINC000283743328 511484574 /nfs/dbraw/zinc/48/45/74/511484574.db2.gz JNEKZVBJOHZLGH-KGLIPLIRSA-N 1 1 362.430 2.536 20 5 FFBDMO C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+](C2CCC2)C1 ZINC000292180739 511495592 /nfs/dbraw/zinc/49/55/92/511495592.db2.gz DXVYAXAAXPDTHA-HNNXBMFYSA-N 1 1 360.458 2.653 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)c1ccc([N+](=O)[O-])[nH]1 ZINC000299106839 511517608 /nfs/dbraw/zinc/51/76/08/511517608.db2.gz XGVOYMOZUMEPDO-UHFFFAOYSA-N 1 1 364.352 2.596 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000292245553 511520119 /nfs/dbraw/zinc/52/01/19/511520119.db2.gz XFSUQIDGMPBMKH-PXAZEXFGSA-N 1 1 366.849 2.603 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000296215976 511658784 /nfs/dbraw/zinc/65/87/84/511658784.db2.gz CXJXRUGELZTOEC-WBVHZDCISA-N 1 1 359.426 2.500 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000280958086 511667466 /nfs/dbraw/zinc/66/74/66/511667466.db2.gz JKDRNTJSEKQQJC-JFIYKMOQSA-N 1 1 361.442 2.599 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCCO)Cc1ccccn1 ZINC000280985828 511677463 /nfs/dbraw/zinc/67/74/63/511677463.db2.gz LLFQPGSPFKQHMH-UHFFFAOYSA-N 1 1 372.425 2.511 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@](CO)(Cc3ccccc3)C2)c1 ZINC000365841947 511682131 /nfs/dbraw/zinc/68/21/31/511682131.db2.gz PAZKGTREQWRUQX-SFTDATJTSA-N 1 1 370.449 2.945 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318223 511682230 /nfs/dbraw/zinc/68/22/30/511682230.db2.gz AXCHPEWEMUIPBT-RDJZCZTQSA-N 1 1 363.414 2.575 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318223 511682234 /nfs/dbraw/zinc/68/22/34/511682234.db2.gz AXCHPEWEMUIPBT-RDJZCZTQSA-N 1 1 363.414 2.575 20 5 FFBDMO O=C1CC2(CN1)CC[NH+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC2 ZINC000292723092 511698145 /nfs/dbraw/zinc/69/81/45/511698145.db2.gz FZCQMPBJZKOPRY-UHFFFAOYSA-N 1 1 357.332 2.716 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN(C)c1ccccc1 ZINC000303245123 511730005 /nfs/dbraw/zinc/73/00/05/511730005.db2.gz ALKCXBDQJISWID-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN(C)c1ccccc1 ZINC000303245123 511730007 /nfs/dbraw/zinc/73/00/07/511730007.db2.gz ALKCXBDQJISWID-HNNXBMFYSA-N 1 1 356.426 2.990 20 5 FFBDMO CN(CC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1 ZINC000303329867 511735159 /nfs/dbraw/zinc/73/51/59/511735159.db2.gz BMBOLIAZOHTVJG-IBGZPJMESA-N 1 1 368.437 2.768 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]cc(Cc3noc([C@@H]4CCn5cc[nH+]c5C4)n3)c2c1 ZINC000350181466 511736879 /nfs/dbraw/zinc/73/68/79/511736879.db2.gz JAHKDAYPCSCCEP-LLVKDONJSA-N 1 1 364.365 2.976 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3c(Cl)nc4ccccn43)CC2)n1 ZINC000365950813 511745077 /nfs/dbraw/zinc/74/50/77/511745077.db2.gz PWSVYPILJVUTNI-UHFFFAOYSA-N 1 1 360.805 2.930 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@H]2C1 ZINC000284734918 511843502 /nfs/dbraw/zinc/84/35/02/511843502.db2.gz WBRPACSDOKFBNM-DLBZAZTESA-N 1 1 374.466 2.623 20 5 FFBDMO COc1cc(C[N@@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])cc1OC ZINC000274466763 511844885 /nfs/dbraw/zinc/84/48/85/511844885.db2.gz ISPCAAXRBKZBQU-UHFFFAOYSA-N 1 1 368.455 2.710 20 5 FFBDMO COc1cc(C[N@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])cc1OC ZINC000274466763 511844890 /nfs/dbraw/zinc/84/48/90/511844890.db2.gz ISPCAAXRBKZBQU-UHFFFAOYSA-N 1 1 368.455 2.710 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000281643878 511919006 /nfs/dbraw/zinc/91/90/06/511919006.db2.gz RHLAVWFOFXJCPO-MQVJKMGUSA-N 1 1 361.442 2.804 20 5 FFBDMO Cn1c[nH+]cc1CCc1nc(-c2ccc([N+](=O)[O-])c3c2CCCN3)no1 ZINC000351164296 511969309 /nfs/dbraw/zinc/96/93/09/511969309.db2.gz SEOVNZHWIXUTAX-UHFFFAOYSA-N 1 1 354.370 2.522 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000366382903 511991192 /nfs/dbraw/zinc/99/11/92/511991192.db2.gz BUXNARYJOAHEJI-RDJZCZTQSA-N 1 1 358.442 2.896 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293601840 512022803 /nfs/dbraw/zinc/02/28/03/512022803.db2.gz VBXMPEWWCOEUHF-KBPBESRZSA-N 1 1 357.332 2.970 20 5 FFBDMO O=C1Nc2ccccc2[C@@]12CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000364434814 512109029 /nfs/dbraw/zinc/10/90/29/512109029.db2.gz OXUPGPCHRCQNAY-IBGZPJMESA-N 1 1 353.378 2.569 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C[C@H](C)OC)C(C)C ZINC000411282249 512560432 /nfs/dbraw/zinc/56/04/32/512560432.db2.gz IRJZBYOYGLUURE-ZDUSSCGKSA-N 1 1 353.419 2.677 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000378288103 512677733 /nfs/dbraw/zinc/67/77/33/512677733.db2.gz JOAVRBNWXNRZAX-IBGZPJMESA-N 1 1 364.405 2.922 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000378288103 512677736 /nfs/dbraw/zinc/67/77/36/512677736.db2.gz JOAVRBNWXNRZAX-IBGZPJMESA-N 1 1 364.405 2.922 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158780 512739566 /nfs/dbraw/zinc/73/95/66/512739566.db2.gz YYIMTECVGBDOMQ-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158780 512739571 /nfs/dbraw/zinc/73/95/71/512739571.db2.gz YYIMTECVGBDOMQ-NWDGAFQWSA-N 1 1 353.806 2.545 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCCSC1 ZINC000411751798 512793329 /nfs/dbraw/zinc/79/33/29/512793329.db2.gz BRAWESMTUYUYKZ-INIZCTEOSA-N 1 1 367.471 2.767 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CC2 ZINC000378513857 512799197 /nfs/dbraw/zinc/79/91/97/512799197.db2.gz UBWWSXZMPMZQNZ-UHFFFAOYSA-N 1 1 372.469 2.895 20 5 FFBDMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CN1 ZINC000372335066 512821045 /nfs/dbraw/zinc/82/10/45/512821045.db2.gz ZASXSHDYHKKIPJ-WMLDXEAASA-N 1 1 370.409 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000376515053 512852297 /nfs/dbraw/zinc/85/22/97/512852297.db2.gz MSRBZDOLHXAQIV-MRXNPFEDSA-N 1 1 358.354 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000376515053 512852301 /nfs/dbraw/zinc/85/23/01/512852301.db2.gz MSRBZDOLHXAQIV-MRXNPFEDSA-N 1 1 358.354 2.689 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000412048873 512930779 /nfs/dbraw/zinc/93/07/79/512930779.db2.gz QVJNINDUBRCWHA-CZXHOFHRSA-N 1 1 367.833 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000412048873 512930783 /nfs/dbraw/zinc/93/07/83/512930783.db2.gz QVJNINDUBRCWHA-CZXHOFHRSA-N 1 1 367.833 2.668 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000412079902 512948074 /nfs/dbraw/zinc/94/80/74/512948074.db2.gz VJFVADUOZQQRAL-KZULUSFZSA-N 1 1 374.397 2.981 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000412081963 512949772 /nfs/dbraw/zinc/94/97/72/512949772.db2.gz WZMHVSBCBBSTAI-AWEZNQCLSA-N 1 1 352.435 2.625 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[N@H+]1Cc1ccccc1 ZINC000397984491 512951575 /nfs/dbraw/zinc/95/15/75/512951575.db2.gz NSYJWHNOGIFWFJ-UKRRQHHQSA-N 1 1 351.410 2.968 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000368457243 512957437 /nfs/dbraw/zinc/95/74/37/512957437.db2.gz HWTQXCAAKUMCMT-UHFFFAOYSA-N 1 1 372.400 2.664 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000412192644 512992799 /nfs/dbraw/zinc/99/27/99/512992799.db2.gz KMIKDVQIROZJOE-CVEARBPZSA-N 1 1 361.442 2.938 20 5 FFBDMO C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374881056 513053041 /nfs/dbraw/zinc/05/30/41/513053041.db2.gz VYDIYBQKKOSPFG-GDBMZVCRSA-N 1 1 354.410 2.630 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)ccc1[N+](=O)[O-] ZINC000372810108 513053400 /nfs/dbraw/zinc/05/34/00/513053400.db2.gz NIZGUZCUQBUEIL-AEFFLSMTSA-N 1 1 374.441 2.815 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000412371747 513056715 /nfs/dbraw/zinc/05/67/15/513056715.db2.gz YQOCRIFTQOZLOO-HLQCWHFUSA-N 1 1 357.454 2.887 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000445992918 513162302 /nfs/dbraw/zinc/16/23/02/513162302.db2.gz RGHUBULXJLTGGT-UHFFFAOYSA-N 1 1 373.478 2.976 20 5 FFBDMO CO[C@@H](Cc1ccccc1)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450561471 513252001 /nfs/dbraw/zinc/25/20/01/513252001.db2.gz FWHODNXLEFAXHT-AEFFLSMTSA-N 1 1 356.426 2.734 20 5 FFBDMO COc1ccc(OCCN2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000429046928 513268264 /nfs/dbraw/zinc/26/82/64/513268264.db2.gz XZRLEYMNYUZBCT-BFYDXBDKSA-N 1 1 363.458 2.644 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)c3cc([N+](=O)[O-])c(C)cc3C)CC2)c1 ZINC000421491170 513283471 /nfs/dbraw/zinc/28/34/71/513283471.db2.gz NQWDQFKBAPRJPT-UHFFFAOYSA-N 1 1 354.410 2.877 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNc2nccc(C(N)=O)c2[N+](=O)[O-])CCC1 ZINC000450719705 513314916 /nfs/dbraw/zinc/31/49/16/513314916.db2.gz WQXJLRKPCMHAEF-UHFFFAOYSA-N 1 1 369.425 2.555 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000434444800 513324959 /nfs/dbraw/zinc/32/49/59/513324959.db2.gz FNWZILMWUMUXIT-QGZVFWFLSA-N 1 1 372.469 2.942 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000424988192 513353934 /nfs/dbraw/zinc/35/39/34/513353934.db2.gz FAQDWOWMBOORHM-UHFFFAOYSA-N 1 1 363.458 2.703 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](O)C2)cc1OC ZINC000434705635 513401185 /nfs/dbraw/zinc/40/11/85/513401185.db2.gz HEMYBACJDJOIPN-HIFRSBDPSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](O)C2)cc1OC ZINC000434705635 513401190 /nfs/dbraw/zinc/40/11/90/513401190.db2.gz HEMYBACJDJOIPN-HIFRSBDPSA-N 1 1 352.431 2.985 20 5 FFBDMO Cc1cccc2c1C[N@H+](CC(=O)N1CCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000429563210 513410524 /nfs/dbraw/zinc/41/05/24/513410524.db2.gz BQWQPJQVGKUFCD-UHFFFAOYSA-N 1 1 351.406 2.851 20 5 FFBDMO Cc1cccc2c1C[N@@H+](CC(=O)N1CCc3ccc([N+](=O)[O-])cc31)CC2 ZINC000429563210 513410533 /nfs/dbraw/zinc/41/05/33/513410533.db2.gz BQWQPJQVGKUFCD-UHFFFAOYSA-N 1 1 351.406 2.851 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CC1)CCS(=O)(=O)CC2 ZINC000430222347 513592276 /nfs/dbraw/zinc/59/22/76/513592276.db2.gz FXIMZXDDVVVRCH-UHFFFAOYSA-N 1 1 352.456 2.694 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000451221734 513604525 /nfs/dbraw/zinc/60/45/25/513604525.db2.gz ZZPFNIHDEKXIGY-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO Cc1c(Br)c(NCC[C@@H]2CCC[N@H+](C)C2)ncc1[N+](=O)[O-] ZINC000413451375 513662334 /nfs/dbraw/zinc/66/23/34/513662334.db2.gz ZQNLDEBFBFYKFG-NSHDSACASA-N 1 1 357.252 2.626 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000451347707 513694170 /nfs/dbraw/zinc/69/41/70/513694170.db2.gz UPPXXMMJHIFWJK-KZNAEPCWSA-N 1 1 361.442 2.573 20 5 FFBDMO C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)[C@@H](C)C[N@H+]1CCO ZINC000419005199 513714490 /nfs/dbraw/zinc/71/44/90/513714490.db2.gz RSRXEUPNVUIGBN-OLZOCXBDSA-N 1 1 362.455 2.610 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000413620307 513738555 /nfs/dbraw/zinc/73/85/55/513738555.db2.gz AASQFCLTQGYJIX-CVEARBPZSA-N 1 1 361.442 2.938 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000451428943 513745881 /nfs/dbraw/zinc/74/58/81/513745881.db2.gz WVRSOEDPENAZCP-JFTQMJAMSA-N 1 1 361.442 2.856 20 5 FFBDMO Nc1c(F)c(NC[C@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000436198461 513790720 /nfs/dbraw/zinc/79/07/20/513790720.db2.gz PKAINJREYUZGEM-AWEZNQCLSA-N 1 1 360.389 2.629 20 5 FFBDMO Nc1c(F)c(NC[C@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000436198461 513790728 /nfs/dbraw/zinc/79/07/28/513790728.db2.gz PKAINJREYUZGEM-AWEZNQCLSA-N 1 1 360.389 2.629 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451545457 513824530 /nfs/dbraw/zinc/82/45/30/513824530.db2.gz RBCWNEFVYIAMFH-SUMWQHHRSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549681 513825084 /nfs/dbraw/zinc/82/50/84/513825084.db2.gz QCNRZUDXXDSVGS-NVXWUHKLSA-N 1 1 363.458 2.706 20 5 FFBDMO CC(C)S(=O)(=O)CCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451546724 513825162 /nfs/dbraw/zinc/82/51/62/513825162.db2.gz JMEPMJSVCLSWIF-MRXNPFEDSA-N 1 1 354.472 2.988 20 5 FFBDMO CC(C)S(=O)(=O)CCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451546724 513825173 /nfs/dbraw/zinc/82/51/73/513825173.db2.gz JMEPMJSVCLSWIF-MRXNPFEDSA-N 1 1 354.472 2.988 20 5 FFBDMO CCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451548228 513825564 /nfs/dbraw/zinc/82/55/64/513825564.db2.gz UVELROSRFPTZKX-XJKCOSOUSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451548228 513825572 /nfs/dbraw/zinc/82/55/72/513825572.db2.gz UVELROSRFPTZKX-XJKCOSOUSA-N 1 1 365.430 2.677 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C ZINC000451552577 513827998 /nfs/dbraw/zinc/82/79/98/513827998.db2.gz YWVCWUMXJCMTQA-BBRMVZONSA-N 1 1 365.430 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@H]3CCCS(=O)(=O)C3)C2)cc1 ZINC000451551218 513828480 /nfs/dbraw/zinc/82/84/80/513828480.db2.gz TWGUDNAGOYWUIQ-ZBFHGGJFSA-N 1 1 352.456 2.599 20 5 FFBDMO C[C@@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H]1C ZINC000448697166 513850798 /nfs/dbraw/zinc/85/07/98/513850798.db2.gz LFKBBLCFFQQHBF-CABCVRRESA-N 1 1 361.442 2.937 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2CCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000426236578 513879748 /nfs/dbraw/zinc/87/97/48/513879748.db2.gz JTVQMQOMGOQLHL-GFCCVEGCSA-N 1 1 360.357 2.594 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H]4C[C@@H](O)CC[C@H]4C3)n2)c1 ZINC000451707781 513927021 /nfs/dbraw/zinc/92/70/21/513927021.db2.gz NBZMPBUJMVLERT-INWMFGNUSA-N 1 1 358.398 2.628 20 5 FFBDMO COc1cc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000451711986 513931134 /nfs/dbraw/zinc/93/11/34/513931134.db2.gz QOKGEYJZORMYER-UHFFFAOYSA-N 1 1 373.384 2.699 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc2ncccn2n1 ZINC000414265156 514026256 /nfs/dbraw/zinc/02/62/56/514026256.db2.gz LBDRJENSEVQICC-GFCCVEGCSA-N 1 1 358.427 2.693 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](c1ccccc1OC)[NH+](C)C ZINC000426872979 514063601 /nfs/dbraw/zinc/06/36/01/514063601.db2.gz CIDNMZHKNMHLEO-MRXNPFEDSA-N 1 1 373.409 2.645 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000426889825 514068377 /nfs/dbraw/zinc/06/83/77/514068377.db2.gz OWLRKTMWIAORAP-MRXNPFEDSA-N 1 1 369.421 2.998 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C[C@H]1c1ccccc1 ZINC000451995133 514120781 /nfs/dbraw/zinc/12/07/81/514120781.db2.gz MYZKLHVLLYCHNQ-ZWKOTPCHSA-N 1 1 370.405 2.992 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000437355351 514146713 /nfs/dbraw/zinc/14/67/13/514146713.db2.gz OLXDPXUDAJBBGS-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1 ZINC000437355351 514146722 /nfs/dbraw/zinc/14/67/22/514146722.db2.gz OLXDPXUDAJBBGS-RTWAWAEBSA-N 1 1 367.449 2.988 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1c(C(N)=O)cccc1[N+](=O)[O-] ZINC000420601936 514196572 /nfs/dbraw/zinc/19/65/72/514196572.db2.gz AKIBCHRISHFJPG-XJKSGUPXSA-N 1 1 354.410 2.626 20 5 FFBDMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000449427516 514206337 /nfs/dbraw/zinc/20/63/37/514206337.db2.gz SLWGINYTKIQFPD-AAEUAGOBSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1ccc(C[N@@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422713 514206687 /nfs/dbraw/zinc/20/66/87/514206687.db2.gz NHOPBVPXGKQRMN-VQIMIIECSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422713 514206696 /nfs/dbraw/zinc/20/66/96/514206696.db2.gz NHOPBVPXGKQRMN-VQIMIIECSA-N 1 1 360.385 2.903 20 5 FFBDMO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449460600 514219922 /nfs/dbraw/zinc/21/99/22/514219922.db2.gz ZIJRIHNHUCEEON-LJQANCHMSA-N 1 1 374.393 2.866 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000444631721 514278926 /nfs/dbraw/zinc/27/89/26/514278926.db2.gz WINXOAVTRWHKTF-UHFFFAOYSA-N 1 1 371.441 2.632 20 5 FFBDMO C[C@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[N@H+]1CCCC[C@@H]1C ZINC000444850052 514350870 /nfs/dbraw/zinc/35/08/70/514350870.db2.gz NXVSPXIIPWBEMQ-QWHCGFSZSA-N 1 1 374.445 2.533 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C ZINC000444896549 514363337 /nfs/dbraw/zinc/36/33/37/514363337.db2.gz MMDNJTKMWZUHCW-CHWSQXEVSA-N 1 1 350.419 2.940 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000433056334 514364682 /nfs/dbraw/zinc/36/46/82/514364682.db2.gz COTUFPCTUMJCAY-SFHVURJKSA-N 1 1 371.437 2.767 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@H](O)Cc1ccccc1 ZINC000433056332 514365183 /nfs/dbraw/zinc/36/51/83/514365183.db2.gz COTUFPCTUMJCAY-GOSISDBHSA-N 1 1 371.437 2.767 20 5 FFBDMO CCn1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1=O ZINC000433210941 514423115 /nfs/dbraw/zinc/42/31/15/514423115.db2.gz WHJCPAUZBFXUIA-UHFFFAOYSA-N 1 1 353.325 2.668 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000445245438 514451130 /nfs/dbraw/zinc/45/11/30/514451130.db2.gz BBRJAQRZTSLYOT-AWEZNQCLSA-N 1 1 369.849 2.643 20 5 FFBDMO CN(c1ccccc1)c1ccc(CN2CCC(O)(C[NH3+])CC2)cc1[N+](=O)[O-] ZINC000415141342 514466367 /nfs/dbraw/zinc/46/63/67/514466367.db2.gz MZJUNPHUKVGEAV-UHFFFAOYSA-N 1 1 370.453 2.648 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000450145587 514510668 /nfs/dbraw/zinc/51/06/68/514510668.db2.gz KCDRGLNOLHYTRR-AWEZNQCLSA-N 1 1 371.441 2.693 20 5 FFBDMO Cc1ccc(C[N@@H+](C)C[C@@H]2C[C@H](F)CN2Cc2ncccn2)cc1[N+](=O)[O-] ZINC000475094538 514555269 /nfs/dbraw/zinc/55/52/69/514555269.db2.gz REFUBQQBRVTREW-IRXDYDNUSA-N 1 1 373.432 2.738 20 5 FFBDMO CC(C)(C)c1ccc(C(=O)NCC[NH+]2CCSCC2)cc1[N+](=O)[O-] ZINC000489012824 514673742 /nfs/dbraw/zinc/67/37/42/514673742.db2.gz JBOYPODAKNESDD-UHFFFAOYSA-N 1 1 351.472 2.671 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000489339297 514805484 /nfs/dbraw/zinc/80/54/84/514805484.db2.gz XRDDYWFDQOZATM-ZDUSSCGKSA-N 1 1 357.357 2.608 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCNc1ccccc1[N+](=O)[O-] ZINC000471396557 514866347 /nfs/dbraw/zinc/86/63/47/514866347.db2.gz CCQSPQDXSMUCRY-UHFFFAOYSA-N 1 1 368.437 2.571 20 5 FFBDMO C[C@H](CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[N@@H+](C)Cc1ccccc1 ZINC000471463584 514895543 /nfs/dbraw/zinc/89/55/43/514895543.db2.gz ZDCGURAFQNWTJR-OAHLLOKOSA-N 1 1 373.457 2.553 20 5 FFBDMO CC[NH+](CC)[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)CC(C)C ZINC000498454866 514911733 /nfs/dbraw/zinc/91/17/33/514911733.db2.gz PBORHHPYOVIQBA-AWEZNQCLSA-N 1 1 361.446 2.957 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471541106 514923524 /nfs/dbraw/zinc/92/35/24/514923524.db2.gz WGYHZSCFNVJYJW-AWEZNQCLSA-N 1 1 354.838 2.603 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCC[N@@H+](C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000480464449 514966573 /nfs/dbraw/zinc/96/65/73/514966573.db2.gz WBLZLUIIYIMZNA-UHFFFAOYSA-N 1 1 371.441 2.846 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC000498569553 514976665 /nfs/dbraw/zinc/97/66/65/514976665.db2.gz APAHKWGQNLHEOD-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO COCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCOC1 ZINC000490047439 515081137 /nfs/dbraw/zinc/08/11/37/515081137.db2.gz SWMOGSAKDCPIOR-MRXNPFEDSA-N 1 1 361.398 2.530 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485548177 515083949 /nfs/dbraw/zinc/08/39/49/515083949.db2.gz PEKKKLTUNPRUES-GFCCVEGCSA-N 1 1 355.385 2.796 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000456326214 515094187 /nfs/dbraw/zinc/09/41/87/515094187.db2.gz GLIKNIOOYBZELR-OAHLLOKOSA-N 1 1 369.421 2.895 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000456335122 515102255 /nfs/dbraw/zinc/10/22/55/515102255.db2.gz AFAIENKKTFKOMR-QGZVFWFLSA-N 1 1 374.485 2.754 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)ccc(C)c2[N+](=O)[O-])C[C@@H]1C ZINC000481057238 515190028 /nfs/dbraw/zinc/19/00/28/515190028.db2.gz KGXDYLUPCCJQCX-GJZGRUSLSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@H+]1CCC[C@@H](C)C1 ZINC000485824621 515204560 /nfs/dbraw/zinc/20/45/60/515204560.db2.gz ZWSLRBVJPVKRQN-NEPJUHHUSA-N 1 1 355.385 2.652 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472371487 515247923 /nfs/dbraw/zinc/24/79/23/515247923.db2.gz ZQMSLZGREYVVQE-INIZCTEOSA-N 1 1 362.474 2.571 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681679 515287691 /nfs/dbraw/zinc/28/76/91/515287691.db2.gz NFBXQLQUAACKGV-HZPDHXFCSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681679 515287700 /nfs/dbraw/zinc/28/77/00/515287700.db2.gz NFBXQLQUAACKGV-HZPDHXFCSA-N 1 1 363.461 2.706 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000462902920 515289863 /nfs/dbraw/zinc/28/98/63/515289863.db2.gz ARRHZWOYIYTVHS-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO CNc1c(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000462902920 515289871 /nfs/dbraw/zinc/28/98/71/515289871.db2.gz ARRHZWOYIYTVHS-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000463143381 515378267 /nfs/dbraw/zinc/37/82/67/515378267.db2.gz OEQSODDHOSCARK-OWCLPIDISA-N 1 1 362.474 2.514 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@](CO)(c4ccccc4)C3)nc2c1 ZINC000463453859 515507579 /nfs/dbraw/zinc/50/75/79/515507579.db2.gz MCHKBCQOWOLLMK-IBGZPJMESA-N 1 1 352.394 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@](CO)(c4ccccc4)C3)nc2c1 ZINC000463453859 515507587 /nfs/dbraw/zinc/50/75/87/515507587.db2.gz MCHKBCQOWOLLMK-IBGZPJMESA-N 1 1 352.394 2.607 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505467461 515544250 /nfs/dbraw/zinc/54/42/50/515544250.db2.gz GAWTZZMXZZYUBC-LJQANCHMSA-N 1 1 353.422 2.873 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2CCCC[N@H+]2CC(C)C)c([N+](=O)[O-])c1 ZINC000477719870 515567002 /nfs/dbraw/zinc/56/70/02/515567002.db2.gz PCOSPXWEMAQTDB-AWEZNQCLSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1cc(CN2CC[NH+](Cc3cccc(O)c3)CC2)ccc1[N+](=O)[O-] ZINC000492834445 515568995 /nfs/dbraw/zinc/56/89/95/515568995.db2.gz SFJAUOSPPJEETM-UHFFFAOYSA-N 1 1 357.410 2.627 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000468969924 515607574 /nfs/dbraw/zinc/60/75/74/515607574.db2.gz LWDBXBLRAASLIB-OAHLLOKOSA-N 1 1 356.426 2.550 20 5 FFBDMO C[NH+]1CCC(O)(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000493246876 515614060 /nfs/dbraw/zinc/61/40/60/515614060.db2.gz JPZFOMHSHYKQOL-IBGZPJMESA-N 1 1 355.438 2.731 20 5 FFBDMO COc1ccc(C[N@@H+]2CC(C)(C)O[C@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000482449894 515680745 /nfs/dbraw/zinc/68/07/45/515680745.db2.gz QBKPXFRDZUHYSC-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1ccc(C[N@H+]2CC(C)(C)O[C@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000482449894 515680751 /nfs/dbraw/zinc/68/07/51/515680751.db2.gz QBKPXFRDZUHYSC-GOSISDBHSA-N 1 1 350.415 2.763 20 5 FFBDMO C[C@@H]1CN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000454780996 515738398 /nfs/dbraw/zinc/73/83/98/515738398.db2.gz SMDLCVSCYUSZLO-TXEJJXNPSA-N 1 1 354.838 2.525 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCC[N@H+]1C ZINC000454785924 515743990 /nfs/dbraw/zinc/74/39/90/515743990.db2.gz NDKQJPWBFVVXRU-HFTRVMKXSA-N 1 1 360.458 2.967 20 5 FFBDMO C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511068353 515765236 /nfs/dbraw/zinc/76/52/36/515765236.db2.gz ZZWOLOZDGQUUHW-UHFFFAOYSA-N 1 1 370.409 2.808 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000459769482 515793878 /nfs/dbraw/zinc/79/38/78/515793878.db2.gz BYOPFCMAIHQAOP-MAUKXSAKSA-N 1 1 361.442 2.796 20 5 FFBDMO COc1ccc(Br)cc1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478423432 515818341 /nfs/dbraw/zinc/81/83/41/515818341.db2.gz YPKFQCMQODLGTF-UHFFFAOYSA-N 1 1 369.219 2.694 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1 ZINC000506328100 515851289 /nfs/dbraw/zinc/85/12/89/515851289.db2.gz TWHZOAKVDOCEGS-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000500872056 515890579 /nfs/dbraw/zinc/89/05/79/515890579.db2.gz VPLNYCRGBXVGIF-OAHLLOKOSA-N 1 1 363.462 2.570 20 5 FFBDMO CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000474217732 515939205 /nfs/dbraw/zinc/93/92/05/515939205.db2.gz YJPJYIPUBBDESF-QGZVFWFLSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@H](CO)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000483143798 515950592 /nfs/dbraw/zinc/95/05/92/515950592.db2.gz AYITVGQAVLIIOA-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000506699610 515956785 /nfs/dbraw/zinc/95/67/85/515956785.db2.gz UQPXQXKPMMNAFL-CQSZACIVSA-N 1 1 357.410 2.941 20 5 FFBDMO C[C@H](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000506699610 515956793 /nfs/dbraw/zinc/95/67/93/515956793.db2.gz UQPXQXKPMMNAFL-CQSZACIVSA-N 1 1 357.410 2.941 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]2COCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853990 515988546 /nfs/dbraw/zinc/98/85/46/515988546.db2.gz PEPATMYMOLUVQB-BXUZGUMPSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464853990 515988554 /nfs/dbraw/zinc/98/85/54/515988554.db2.gz PEPATMYMOLUVQB-BXUZGUMPSA-N 1 1 353.806 2.688 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000487838948 516001065 /nfs/dbraw/zinc/00/10/65/516001065.db2.gz OGNRVOFGNIAEHK-SMDDNHRTSA-N 1 1 354.838 2.573 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000469997509 516067514 /nfs/dbraw/zinc/06/75/14/516067514.db2.gz ZYKKEKUDSOQWOE-IUODEOHRSA-N 1 1 359.382 2.676 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000507285925 516158346 /nfs/dbraw/zinc/15/83/46/516158346.db2.gz VVQAYHBELADXFU-CZUORRHYSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000507285925 516158349 /nfs/dbraw/zinc/15/83/49/516158349.db2.gz VVQAYHBELADXFU-CZUORRHYSA-N 1 1 355.394 2.693 20 5 FFBDMO Cc1cc(C)c(S(N)(=O)=O)cc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000479398071 516180366 /nfs/dbraw/zinc/18/03/66/516180366.db2.gz YLPZZXWRMWLGDW-ZDUSSCGKSA-N 1 1 363.439 2.710 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000512420957 516271601 /nfs/dbraw/zinc/27/16/01/516271601.db2.gz ORAWUNPIHFCYSA-HUUCEWRRSA-N 1 1 352.431 2.998 20 5 FFBDMO C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000465875058 516278186 /nfs/dbraw/zinc/27/81/86/516278186.db2.gz LNACPVNSTJXJRF-INIZCTEOSA-N 1 1 370.453 2.957 20 5 FFBDMO Cc1n[nH]c(C(=O)NCC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000512570888 516307366 /nfs/dbraw/zinc/30/73/66/516307366.db2.gz WQMZFVWBSZUBJN-BBRMVZONSA-N 1 1 371.441 2.657 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000461040160 516309856 /nfs/dbraw/zinc/30/98/56/516309856.db2.gz CLKQURZDWUIURX-VXGBXAGGSA-N 1 1 357.838 2.860 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497514056 516324906 /nfs/dbraw/zinc/32/49/06/516324906.db2.gz ABYLRJRBWHWRGG-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497514056 516324907 /nfs/dbraw/zinc/32/49/07/516324907.db2.gz ABYLRJRBWHWRGG-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000561015897 516338529 /nfs/dbraw/zinc/33/85/29/516338529.db2.gz OTVSPINKXJYZFI-QGZVFWFLSA-N 1 1 369.421 2.673 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)n1 ZINC000557639237 516351883 /nfs/dbraw/zinc/35/18/83/516351883.db2.gz KTSGVSDCVODPAX-ZDUSSCGKSA-N 1 1 350.419 2.556 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CC1 ZINC000517561104 516364850 /nfs/dbraw/zinc/36/48/50/516364850.db2.gz BMTRTSKUSUPDTN-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+](C)C2(CO)CC2)cc1OC ZINC000512835320 516382189 /nfs/dbraw/zinc/38/21/89/516382189.db2.gz WDOMTEFRUVJENG-CYBMUJFWSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+](C)C2(CO)CC2)cc1OC ZINC000512835320 516382195 /nfs/dbraw/zinc/38/21/95/516382195.db2.gz WDOMTEFRUVJENG-CYBMUJFWSA-N 1 1 352.431 2.985 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000561157828 516414897 /nfs/dbraw/zinc/41/48/97/516414897.db2.gz XGLZCCUOJWLWBM-WCQYABFASA-N 1 1 350.419 2.617 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)n1 ZINC000561182965 516433948 /nfs/dbraw/zinc/43/39/48/516433948.db2.gz CVFCURIVAZTMHK-GFCCVEGCSA-N 1 1 350.419 2.699 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])[nH]1 ZINC000513111073 516479704 /nfs/dbraw/zinc/47/97/04/516479704.db2.gz XUMNIMDMIBOOJZ-MRXNPFEDSA-N 1 1 356.426 2.953 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000557877163 516484340 /nfs/dbraw/zinc/48/43/40/516484340.db2.gz AKYCUOJHBRQFFU-HOTGVXAUSA-N 1 1 362.474 2.899 20 5 FFBDMO NC(=O)c1cccc(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000561349498 516534646 /nfs/dbraw/zinc/53/46/46/516534646.db2.gz TVBFCBKKMMHZHE-ZDUSSCGKSA-N 1 1 369.425 2.611 20 5 FFBDMO CCOC(=O)c1ccnc(N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000524105634 516642763 /nfs/dbraw/zinc/64/27/63/516642763.db2.gz FJAMEFXXACMUHE-UHFFFAOYSA-N 1 1 364.446 2.723 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000536169431 516661638 /nfs/dbraw/zinc/66/16/38/516661638.db2.gz MEHWUSCXZGQORR-HNNXBMFYSA-N 1 1 370.453 2.809 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000524199366 516667128 /nfs/dbraw/zinc/66/71/28/516667128.db2.gz XQXWMFZWVOGCIS-UHFFFAOYSA-N 1 1 369.849 2.960 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000536187754 516667372 /nfs/dbraw/zinc/66/73/72/516667372.db2.gz ARHWUOADEFVLFL-OKILXGFUSA-N 1 1 358.442 2.998 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](CC(C)C)C(=O)NCC[NH+](C)C ZINC000540747236 516694731 /nfs/dbraw/zinc/69/47/31/516694731.db2.gz NCLFURBGNLQEHR-QAPCUYQASA-N 1 1 364.490 2.646 20 5 FFBDMO CC[C@@H](CO)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000544408510 516745060 /nfs/dbraw/zinc/74/50/60/516745060.db2.gz QCXROKSJUOCGPC-KRWDZBQOSA-N 1 1 371.437 2.831 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000558562482 516809282 /nfs/dbraw/zinc/80/92/82/516809282.db2.gz NENAJSPLENJEIQ-ZDUSSCGKSA-N 1 1 362.817 2.674 20 5 FFBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000558584173 516820583 /nfs/dbraw/zinc/82/05/83/516820583.db2.gz XTPINXZOGLAXEJ-INIZCTEOSA-N 1 1 365.477 3.000 20 5 FFBDMO C[C@H](NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000541025122 516837425 /nfs/dbraw/zinc/83/74/25/516837425.db2.gz DJNSFGOSPYZQID-JTQLQIEISA-N 1 1 355.341 2.576 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@H+]1C ZINC000536598233 516844459 /nfs/dbraw/zinc/84/44/59/516844459.db2.gz RMNASKZUCCNPSB-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC[N@@H+]1C ZINC000536598233 516844463 /nfs/dbraw/zinc/84/44/63/516844463.db2.gz RMNASKZUCCNPSB-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO CCOc1cc(CN2CCC([N@H+]3CCOC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000518995792 516849989 /nfs/dbraw/zinc/84/99/89/516849989.db2.gz IYGUWBZKTBYZSC-HNNXBMFYSA-N 1 1 363.458 2.679 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000541106691 516878617 /nfs/dbraw/zinc/87/86/17/516878617.db2.gz UPAHZQKNWVBKJU-QWHCGFSZSA-N 1 1 350.419 2.845 20 5 FFBDMO Cn1c(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000525040930 516900200 /nfs/dbraw/zinc/90/02/00/516900200.db2.gz VIQGSLLLMHTHOU-WBMJQRKESA-N 1 1 362.455 2.808 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCCC2)cc([N+](=O)[O-])c1OC ZINC000525068379 516906634 /nfs/dbraw/zinc/90/66/34/516906634.db2.gz GXPRBOXFOIQRNM-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCOc2ccccc21 ZINC000551899645 516942589 /nfs/dbraw/zinc/94/25/89/516942589.db2.gz PLHQJDUDLHSWFF-UHFFFAOYSA-N 1 1 367.405 2.769 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)nc1 ZINC000532394069 516951857 /nfs/dbraw/zinc/95/18/57/516951857.db2.gz XTPAVVPJGVEGDM-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH+]2CCC(C)(COC)CC2)c([N+](=O)[O-])c1 ZINC000536885452 516964242 /nfs/dbraw/zinc/96/42/42/516964242.db2.gz KZDWXYAHPQWNNZ-UHFFFAOYSA-N 1 1 365.430 2.681 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000562223531 516966497 /nfs/dbraw/zinc/96/64/97/516966497.db2.gz LOVJSHGKTRZTII-AWEZNQCLSA-N 1 1 373.457 2.846 20 5 FFBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000532484371 516998736 /nfs/dbraw/zinc/99/87/36/516998736.db2.gz SBZJHYPKCMVXKL-KRWDZBQOSA-N 1 1 369.421 2.909 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CC[N@H+](CC)[C@@H](C)C1 ZINC000525385636 517023798 /nfs/dbraw/zinc/02/37/98/517023798.db2.gz FCQCQYPGIBKAQG-DZGCQCFKSA-N 1 1 369.487 2.651 20 5 FFBDMO C[C@@H](C(=O)NCC(C)(C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719601 517086406 /nfs/dbraw/zinc/08/64/06/517086406.db2.gz IYHHNRSVZXGMTK-QLFBSQMISA-N 1 1 363.458 2.702 20 5 FFBDMO C[C@@H](C(=O)NCC(C)(C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000555719601 517086408 /nfs/dbraw/zinc/08/64/08/517086408.db2.gz IYHHNRSVZXGMTK-QLFBSQMISA-N 1 1 363.458 2.702 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000552190219 517131031 /nfs/dbraw/zinc/13/10/31/517131031.db2.gz CWKCLRQDWNYIFS-UONOGXRCSA-N 1 1 350.415 2.861 20 5 FFBDMO NC(=O)c1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)on1 ZINC000541763440 517204338 /nfs/dbraw/zinc/20/43/38/517204338.db2.gz KWIDAXSSPKJMST-UHFFFAOYSA-N 1 1 358.379 2.700 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[NH+]2CCN(c3ccc(Cl)cn3)CC2)cc1 ZINC000520059348 517265847 /nfs/dbraw/zinc/26/58/47/517265847.db2.gz NOGJNVLDPOTBNP-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000537810950 517354686 /nfs/dbraw/zinc/35/46/86/517354686.db2.gz MMKVRHYBZGJQMQ-GHMZBOCLSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000537810950 517354692 /nfs/dbraw/zinc/35/46/92/517354692.db2.gz MMKVRHYBZGJQMQ-GHMZBOCLSA-N 1 1 370.247 2.830 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCCC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000533428281 517457746 /nfs/dbraw/zinc/45/77/46/517457746.db2.gz BXAWQAHEOQNSEV-UHFFFAOYSA-N 1 1 365.430 2.611 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCCC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000533428281 517457755 /nfs/dbraw/zinc/45/77/55/517457755.db2.gz BXAWQAHEOQNSEV-UHFFFAOYSA-N 1 1 365.430 2.611 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000556565019 517495126 /nfs/dbraw/zinc/49/51/26/517495126.db2.gz XSSYAYKWDJHIJV-DOTOQJQBSA-N 1 1 360.458 2.826 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000556588317 517505216 /nfs/dbraw/zinc/50/52/16/517505216.db2.gz CFBIXCJOJXQFRW-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000556588317 517505227 /nfs/dbraw/zinc/50/52/27/517505227.db2.gz CFBIXCJOJXQFRW-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO CN(c1cccc(C(N)=O)c1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000553155110 517548415 /nfs/dbraw/zinc/54/84/15/517548415.db2.gz YGJGBOQPTQKWQA-MRXNPFEDSA-N 1 1 368.437 2.795 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000516158268 517591803 /nfs/dbraw/zinc/59/18/03/517591803.db2.gz SEKFVQXAAWWZHE-UONOGXRCSA-N 1 1 364.446 2.666 20 5 FFBDMO CCC[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000542520328 517607494 /nfs/dbraw/zinc/60/74/94/517607494.db2.gz BZWNONOKJMXMAO-LLVKDONJSA-N 1 1 357.252 2.626 20 5 FFBDMO C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1Cc1ccccc1 ZINC000553343488 517654865 /nfs/dbraw/zinc/65/48/65/517654865.db2.gz ROVSHSOWGQWSBX-INIZCTEOSA-N 1 1 352.438 2.926 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CCCc2ccccc2)CC[NH+](C)C)c1[N+](=O)[O-] ZINC000521234649 517662547 /nfs/dbraw/zinc/66/25/47/517662547.db2.gz DRSFWSRIFMAVCO-UHFFFAOYSA-N 1 1 373.457 2.517 20 5 FFBDMO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(S(N)(=O)=O)c1 ZINC000543059970 517887486 /nfs/dbraw/zinc/88/74/86/517887486.db2.gz OTAPAYWMRCDIOE-CYBMUJFWSA-N 1 1 355.441 2.545 20 5 FFBDMO CNc1ccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000557166220 517895467 /nfs/dbraw/zinc/89/54/67/517895467.db2.gz XIKIEMLAPVIZJE-UHFFFAOYSA-N 1 1 360.414 2.824 20 5 FFBDMO Cc1cccc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000557198340 517914478 /nfs/dbraw/zinc/91/44/78/517914478.db2.gz ZHUGFGKATSQSFM-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cccc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000557198340 517914487 /nfs/dbraw/zinc/91/44/87/517914487.db2.gz ZHUGFGKATSQSFM-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000522044536 517963744 /nfs/dbraw/zinc/96/37/44/517963744.db2.gz ZDFAEFXHXPXPKL-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000522044536 517963750 /nfs/dbraw/zinc/96/37/50/517963750.db2.gz ZDFAEFXHXPXPKL-MRXNPFEDSA-N 1 1 368.437 2.740 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000563650292 518045057 /nfs/dbraw/zinc/04/50/57/518045057.db2.gz NCRVYNCWXAKVIZ-BLVKFPJESA-N 1 1 372.377 2.758 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000557534564 518060581 /nfs/dbraw/zinc/06/05/81/518060581.db2.gz FGZCAGCBDXXYNA-AWEZNQCLSA-N 1 1 354.410 2.823 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000557534564 518060589 /nfs/dbraw/zinc/06/05/89/518060589.db2.gz FGZCAGCBDXXYNA-AWEZNQCLSA-N 1 1 354.410 2.823 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000522364768 518088175 /nfs/dbraw/zinc/08/81/75/518088175.db2.gz BJLIFOBMXLCTDQ-SUMWQHHRSA-N 1 1 367.421 2.601 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)c21 ZINC000543435061 518088366 /nfs/dbraw/zinc/08/83/66/518088366.db2.gz CTVYKKKYZQINBC-CZUORRHYSA-N 1 1 353.426 2.991 20 5 FFBDMO C[C@@H]1CN(C[C@H]2CCC[N@H+]2CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000557603229 518101734 /nfs/dbraw/zinc/10/17/34/518101734.db2.gz JXEBVYCAEYMYPY-JFIYKMOQSA-N 1 1 363.458 2.547 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558264 518111767 /nfs/dbraw/zinc/11/17/67/518111767.db2.gz FPNFCBZDYRRKKI-DYVFJYSZSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CCCO[C@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000550558264 518111776 /nfs/dbraw/zinc/11/17/76/518111776.db2.gz FPNFCBZDYRRKKI-DYVFJYSZSA-N 1 1 365.430 2.677 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000539780687 518159703 /nfs/dbraw/zinc/15/97/03/518159703.db2.gz UHHPGFGNDJVYNT-SFHVURJKSA-N 1 1 354.410 2.568 20 5 FFBDMO COc1ccc(CNC(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000535266753 518171609 /nfs/dbraw/zinc/17/16/09/518171609.db2.gz XWIPRRIGOKNPDK-MRXNPFEDSA-N 1 1 370.409 2.589 20 5 FFBDMO COc1ccc(CNC(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000535266753 518171611 /nfs/dbraw/zinc/17/16/11/518171611.db2.gz XWIPRRIGOKNPDK-MRXNPFEDSA-N 1 1 370.409 2.589 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000575768545 518273379 /nfs/dbraw/zinc/27/33/79/518273379.db2.gz IEVAUCDOMIVESU-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000575768545 518273382 /nfs/dbraw/zinc/27/33/82/518273382.db2.gz IEVAUCDOMIVESU-GOSISDBHSA-N 1 1 354.410 2.985 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1 ZINC000567066022 518335899 /nfs/dbraw/zinc/33/58/99/518335899.db2.gz XEANFRJSBTYVGG-UHFFFAOYSA-N 1 1 360.458 2.731 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CN(c1cc[nH+]c(N3CCCCC3)n1)CCO2 ZINC000564261151 518372176 /nfs/dbraw/zinc/37/21/76/518372176.db2.gz JHRMCGOJQRGHCH-UHFFFAOYSA-N 1 1 355.398 2.774 20 5 FFBDMO C[C@H](C(=O)N[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000573158585 518531751 /nfs/dbraw/zinc/53/17/51/518531751.db2.gz DTYWGWKNYPLSDT-ZOCIIQOWSA-N 1 1 353.422 2.912 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C[C@H]21 ZINC000585781918 518595770 /nfs/dbraw/zinc/59/57/70/518595770.db2.gz CXXAPYLQXGSABT-IAGOWNOFSA-N 1 1 372.400 2.705 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)[C@H]2C1 ZINC000585783608 518596084 /nfs/dbraw/zinc/59/60/84/518596084.db2.gz KQEBSEGZCLRTHT-DLBZAZTESA-N 1 1 372.400 2.705 20 5 FFBDMO CN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000565128459 518801522 /nfs/dbraw/zinc/80/15/22/518801522.db2.gz VWGJFAIJHFGMSY-QGZVFWFLSA-N 1 1 368.441 2.861 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000570848081 518809018 /nfs/dbraw/zinc/80/90/18/518809018.db2.gz DZRPFJZHCGUQAR-TXEJJXNPSA-N 1 1 367.471 2.880 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000565175763 518826454 /nfs/dbraw/zinc/82/64/54/518826454.db2.gz WLHCZJDXFLVKFZ-MRXNPFEDSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000565175763 518826461 /nfs/dbraw/zinc/82/64/61/518826461.db2.gz WLHCZJDXFLVKFZ-MRXNPFEDSA-N 1 1 371.441 2.701 20 5 FFBDMO O=C(C[NH+]1CCC2(CCCC2)CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000577026500 518879678 /nfs/dbraw/zinc/87/96/78/518879678.db2.gz PPZOEUZRBONIAD-UHFFFAOYSA-N 1 1 361.398 2.918 20 5 FFBDMO C[C@@H]1C[C@@H](C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)CCO1 ZINC000571019500 518886667 /nfs/dbraw/zinc/88/66/67/518886667.db2.gz GJLREGDKHUZYLS-CABCVRRESA-N 1 1 373.457 2.798 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCN(C)c3ccccc3C2)c1 ZINC000589498479 519017715 /nfs/dbraw/zinc/01/77/15/519017715.db2.gz QXEFMGRLGYCVGT-UHFFFAOYSA-N 1 1 355.394 2.833 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCN(C)c3ccccc3C2)c1 ZINC000589498479 519017720 /nfs/dbraw/zinc/01/77/20/519017720.db2.gz QXEFMGRLGYCVGT-UHFFFAOYSA-N 1 1 355.394 2.833 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](Cc2ccccc2)C[C@@H](C)O)c1 ZINC000589496179 519018117 /nfs/dbraw/zinc/01/81/17/519018117.db2.gz YJCFXCICPFQISI-CQSZACIVSA-N 1 1 358.394 2.764 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](Cc2ccccc2)C[C@@H](C)O)c1 ZINC000589496179 519018120 /nfs/dbraw/zinc/01/81/20/519018120.db2.gz YJCFXCICPFQISI-CQSZACIVSA-N 1 1 358.394 2.764 20 5 FFBDMO C[C@H](C(=O)Nc1cccc(C[N@H+]2CC[C@H](O)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000577338973 519028624 /nfs/dbraw/zinc/02/86/24/519028624.db2.gz FKVNDYPICYXYEN-LIRRHRJNSA-N 1 1 369.421 2.904 20 5 FFBDMO Cc1cc(N(C)[C@H]2CC[N@H+](C3CCN(C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687924 519064635 /nfs/dbraw/zinc/06/46/35/519064635.db2.gz RPIYNPNLXPOFRY-HNNXBMFYSA-N 1 1 350.438 2.647 20 5 FFBDMO Cc1cc(N(C)[C@H]2CCN(C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687924 519064637 /nfs/dbraw/zinc/06/46/37/519064637.db2.gz RPIYNPNLXPOFRY-HNNXBMFYSA-N 1 1 350.438 2.647 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCOC[C@H]2[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590566391 519268959 /nfs/dbraw/zinc/26/89/59/519268959.db2.gz ZRKUXBIHXYTAME-WMZOPIPTSA-N 1 1 361.442 2.653 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)CC1 ZINC000590626636 519294208 /nfs/dbraw/zinc/29/42/08/519294208.db2.gz LVAPWAJSQYEJMQ-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1 ZINC000574950131 519417752 /nfs/dbraw/zinc/41/77/52/519417752.db2.gz RFZPGHQJLNIKOY-INIZCTEOSA-N 1 1 356.426 2.955 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000569374933 519518786 /nfs/dbraw/zinc/51/87/86/519518786.db2.gz YXGKZZYTEVOMOA-INIZCTEOSA-N 1 1 358.442 2.951 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](O)[C@@H]1CCc1ccccc1 ZINC000602851526 519923900 /nfs/dbraw/zinc/92/39/00/519923900.db2.gz LOIRZUISEHHLNW-ZWKOTPCHSA-N 1 1 358.442 2.558 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC3(C2)CC[NH+](C)CC3)cccc1[N+](=O)[O-] ZINC000602878503 519944378 /nfs/dbraw/zinc/94/43/78/519944378.db2.gz XOYFIRWYOCUOJH-HNNXBMFYSA-N 1 1 360.458 2.648 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000594417592 519954090 /nfs/dbraw/zinc/95/40/90/519954090.db2.gz CCRYPJQOOHITKG-YJBOKZPZSA-N 1 1 369.425 2.732 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594420538 519956614 /nfs/dbraw/zinc/95/66/14/519956614.db2.gz WGCQUQRGERUJIA-HZPDHXFCSA-N 1 1 361.442 2.805 20 5 FFBDMO Cn1cc(C[NH2+][C@H](CCO)c2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])n1 ZINC000602917522 519970868 /nfs/dbraw/zinc/97/08/68/519970868.db2.gz LVEZKKXSAYKKCN-CYBMUJFWSA-N 1 1 359.213 2.848 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594485147 519994211 /nfs/dbraw/zinc/99/42/11/519994211.db2.gz XJZYGDVAOOVVMP-GJZGRUSLSA-N 1 1 367.471 2.507 20 5 FFBDMO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594520672 520013532 /nfs/dbraw/zinc/01/35/32/520013532.db2.gz AWPGWTBBPTWZJZ-AWEZNQCLSA-N 1 1 372.377 2.988 20 5 FFBDMO O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1 ZINC000600075431 520032132 /nfs/dbraw/zinc/03/21/32/520032132.db2.gz DRFILGUOTSAJOQ-UHFFFAOYSA-N 1 1 363.311 2.731 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccnc(C[NH+](C)C)c1 ZINC000603142908 520105075 /nfs/dbraw/zinc/10/50/75/520105075.db2.gz QMZCWLMJAQNYPT-UHFFFAOYSA-N 1 1 357.414 2.758 20 5 FFBDMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597584924 520119667 /nfs/dbraw/zinc/11/96/67/520119667.db2.gz YKQRPVAZFUSQAI-JKSUJKDBSA-N 1 1 367.396 2.656 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC(C[NH+]3CCCCCC3)CC2)c1[N+](=O)[O-] ZINC000608800304 520132284 /nfs/dbraw/zinc/13/22/84/520132284.db2.gz OOWAUUPMRFVXDS-UHFFFAOYSA-N 1 1 363.462 2.609 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000600315928 520200578 /nfs/dbraw/zinc/20/05/78/520200578.db2.gz XHNZJBUASGVIKZ-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000609196594 520228702 /nfs/dbraw/zinc/22/87/02/520228702.db2.gz ZRWIMUSZIXRFDF-AWEZNQCLSA-N 1 1 369.487 2.700 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CN[C@@H]1CC[N@H+](C3CCCCC3)C1)OCCO2 ZINC000594977638 520240095 /nfs/dbraw/zinc/24/00/95/520240095.db2.gz MACCUJOYXGXPIU-OAHLLOKOSA-N 1 1 361.442 2.863 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC3(C[C@@H]2C)CCOCC3)c([N+](=O)[O-])c1 ZINC000592181531 520250720 /nfs/dbraw/zinc/25/07/20/520250720.db2.gz HHSHWOMVIVNISV-AWEZNQCLSA-N 1 1 350.415 2.873 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000595003781 520252713 /nfs/dbraw/zinc/25/27/13/520252713.db2.gz JZUDNWCXPKGJLX-ZBFHGGJFSA-N 1 1 351.447 2.611 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CN(CC(C)C)CCO1 ZINC000595003781 520252720 /nfs/dbraw/zinc/25/27/20/520252720.db2.gz JZUDNWCXPKGJLX-ZBFHGGJFSA-N 1 1 351.447 2.611 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597859165 520285513 /nfs/dbraw/zinc/28/55/13/520285513.db2.gz AJECOXGMBSPKCX-CYBMUJFWSA-N 1 1 356.426 2.993 20 5 FFBDMO CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000609509327 520336078 /nfs/dbraw/zinc/33/60/78/520336078.db2.gz PYUPCEUULQVJHJ-MRXNPFEDSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCC[C@H](C)C1 ZINC000603895041 520393918 /nfs/dbraw/zinc/39/39/18/520393918.db2.gz JAHANGZZVCXIMP-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[N@H+]1CCc2ccccc2C1 ZINC000604096879 520450748 /nfs/dbraw/zinc/45/07/48/520450748.db2.gz DMPMKDYHDXHKNA-QGZVFWFLSA-N 1 1 356.426 2.736 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@H]1C ZINC000610125935 520550975 /nfs/dbraw/zinc/55/09/75/520550975.db2.gz ZCPQSERXIKGIHJ-ZBFHGGJFSA-N 1 1 358.442 2.881 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000610129636 520552784 /nfs/dbraw/zinc/55/27/84/520552784.db2.gz VOVCXNLGXULQHT-VXGBXAGGSA-N 1 1 351.378 2.949 20 5 FFBDMO COc1cccc(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000592882022 520633204 /nfs/dbraw/zinc/63/32/04/520633204.db2.gz QGUMCFYOXYKHEV-WBVHZDCISA-N 1 1 369.421 2.679 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c1 ZINC000592883121 520633569 /nfs/dbraw/zinc/63/35/69/520633569.db2.gz XEFRWVUZWKKDHR-AEFFLSMTSA-N 1 1 353.422 2.978 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595684228 520647726 /nfs/dbraw/zinc/64/77/26/520647726.db2.gz MENDSCJOIWAMEP-INIZCTEOSA-N 1 1 373.409 2.828 20 5 FFBDMO Cc1nccc(N2CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000601142602 520658024 /nfs/dbraw/zinc/65/80/24/520658024.db2.gz VZQVSNJLVFRJJM-UHFFFAOYSA-N 1 1 350.382 2.568 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(Oc4cnccn4)CC3)c2c1 ZINC000601154720 520663686 /nfs/dbraw/zinc/66/36/86/520663686.db2.gz UQZZSVYRCRFMSZ-UHFFFAOYSA-N 1 1 351.366 2.981 20 5 FFBDMO CC(=O)N1C[C@@H]2CCC[C@H](Nc3cc[nH+]c4ccc([N+](=O)[O-])cc34)[C@H]2C1 ZINC000601166778 520668557 /nfs/dbraw/zinc/66/85/57/520668557.db2.gz SEEDZUWDRQNZRM-OWQGQXMQSA-N 1 1 354.410 2.624 20 5 FFBDMO CC(=O)N1C[C@@H]2CCC[C@@H](Nc3cc[nH+]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1 ZINC000601166777 520669325 /nfs/dbraw/zinc/66/93/25/520669325.db2.gz SEEDZUWDRQNZRM-FDQGKXFDSA-N 1 1 354.410 2.624 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598511618 520671469 /nfs/dbraw/zinc/67/14/69/520671469.db2.gz TWVVAHYZTAMCQV-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598511618 520671475 /nfs/dbraw/zinc/67/14/75/520671475.db2.gz TWVVAHYZTAMCQV-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422076 520675396 /nfs/dbraw/zinc/67/53/96/520675396.db2.gz UQBGJHKCKVKUQR-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422076 520675406 /nfs/dbraw/zinc/67/54/06/520675406.db2.gz UQBGJHKCKVKUQR-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)C(=O)Nc2ccccc2)c1 ZINC000593023412 520690221 /nfs/dbraw/zinc/69/02/21/520690221.db2.gz SEYXGVKDXHBHKZ-UHFFFAOYSA-N 1 1 371.393 2.888 20 5 FFBDMO O=C(C[NH+]1CCC2(CC2(F)F)CC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000593073777 520724485 /nfs/dbraw/zinc/72/44/85/520724485.db2.gz YLRDAKXJNCABEV-UHFFFAOYSA-N 1 1 351.353 2.605 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)CC[C@H]21 ZINC000601334224 520745091 /nfs/dbraw/zinc/74/50/91/520745091.db2.gz ZGEFKMFZJJSQQB-MAUKXSAKSA-N 1 1 357.454 2.959 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000595825261 520749668 /nfs/dbraw/zinc/74/96/68/520749668.db2.gz DQABTBKBHFWYEO-MRXNPFEDSA-N 1 1 354.410 2.744 20 5 FFBDMO CN(c1ccccc1)[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000595825261 520749674 /nfs/dbraw/zinc/74/96/74/520749674.db2.gz DQABTBKBHFWYEO-MRXNPFEDSA-N 1 1 354.410 2.744 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@@H](N(C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595829157 520754494 /nfs/dbraw/zinc/75/44/94/520754494.db2.gz WXNVJYSLCFQPBZ-LJQANCHMSA-N 1 1 368.437 2.768 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@@H](N(C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595829157 520754503 /nfs/dbraw/zinc/75/45/03/520754503.db2.gz WXNVJYSLCFQPBZ-LJQANCHMSA-N 1 1 368.437 2.768 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900782 520804515 /nfs/dbraw/zinc/80/45/15/520804515.db2.gz LDZAMUXLZMYIFT-GOEBONIOSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901291 520808518 /nfs/dbraw/zinc/80/85/18/520808518.db2.gz UUEAVHDNCMVHTI-HOCLYGCPSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@](C)(C(F)F)O1 ZINC000595922327 520826765 /nfs/dbraw/zinc/82/67/65/520826765.db2.gz ORBCTMARFPSOFF-BZNIZROVSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@](C)(C(F)F)O1 ZINC000595922327 520826766 /nfs/dbraw/zinc/82/67/66/520826766.db2.gz ORBCTMARFPSOFF-BZNIZROVSA-N 1 1 357.357 2.668 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000593316804 520905131 /nfs/dbraw/zinc/90/51/31/520905131.db2.gz XSTOSIDBOQRWFF-URLQWDBASA-N 1 1 363.458 2.712 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000610986870 520932174 /nfs/dbraw/zinc/93/21/74/520932174.db2.gz AYTHWFBSENGGAI-LJQANCHMSA-N 1 1 372.469 2.650 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596176212 520953717 /nfs/dbraw/zinc/95/37/17/520953717.db2.gz BBYSXHJNSPSKBM-GJZGRUSLSA-N 1 1 368.437 2.793 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cnc3C)C2)c1 ZINC000601848555 520985075 /nfs/dbraw/zinc/98/50/75/520985075.db2.gz AAUUMQUFJYENOT-MRXNPFEDSA-N 1 1 354.410 2.611 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NC[C@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])c1 ZINC000596306592 521019020 /nfs/dbraw/zinc/01/90/20/521019020.db2.gz GZAOWZINLUMKFM-CQSZACIVSA-N 1 1 371.441 2.844 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c(Br)cccc1[N+](=O)[O-] ZINC000599080990 521021214 /nfs/dbraw/zinc/02/12/14/521021214.db2.gz RNZFMPSWJROURB-NEPJUHHUSA-N 1 1 368.231 2.714 20 5 FFBDMO Cc1cc(N2CCO[C@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000593496675 521033877 /nfs/dbraw/zinc/03/38/77/521033877.db2.gz VRLFQICXLHGHHM-OALUTQOASA-N 1 1 368.437 2.778 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CCn4cc(C)[nH+]c4C3)n2)c1 ZINC000599154487 521058299 /nfs/dbraw/zinc/05/82/99/521058299.db2.gz ZYUKHGLGLANKDK-LBPRGKRZSA-N 1 1 369.381 2.812 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000599157263 521061117 /nfs/dbraw/zinc/06/11/17/521061117.db2.gz QJYONIFZHSGRDC-AWEZNQCLSA-N 1 1 373.457 2.650 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c2ncccc12 ZINC000611296543 521085780 /nfs/dbraw/zinc/08/57/80/521085780.db2.gz UJHGSGIJEATIRY-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO CCOc1cc(N(C)[C@H]2CC[N@H+](C3CCN(C)CC3)C2)ccc1[N+](=O)[O-] ZINC000611297288 521086315 /nfs/dbraw/zinc/08/63/15/521086315.db2.gz COTMBPVAEHNJOH-KRWDZBQOSA-N 1 1 362.474 2.598 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)Nc1ccc([N+](=O)[O-])cc1F ZINC000596498856 521100562 /nfs/dbraw/zinc/10/05/62/521100562.db2.gz IQNKEGSTJLWMDF-ZDUSSCGKSA-N 1 1 350.394 2.977 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596559588 521132181 /nfs/dbraw/zinc/13/21/81/521132181.db2.gz ZMVCUNROLAUCJV-HNNXBMFYSA-N 1 1 370.409 2.853 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000611543825 521212515 /nfs/dbraw/zinc/21/25/15/521212515.db2.gz KCXDUPVNHHGEIO-IUODEOHRSA-N 1 1 367.471 2.546 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000611543825 521212519 /nfs/dbraw/zinc/21/25/19/521212519.db2.gz KCXDUPVNHHGEIO-IUODEOHRSA-N 1 1 367.471 2.546 20 5 FFBDMO CCOc1cc(C[N@H+]2CC3(CCOCC3)CC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000599543149 521285879 /nfs/dbraw/zinc/28/58/79/521285879.db2.gz MOLFBRMFLFDWPN-MRXNPFEDSA-N 1 1 364.442 2.747 20 5 FFBDMO C[N@@H+](CCNc1ncnc2ccc([N+](=O)[O-])cc21)Cc1ccc(F)cc1 ZINC000611705805 521289190 /nfs/dbraw/zinc/28/91/90/521289190.db2.gz BPRCSHPDUROQAT-UHFFFAOYSA-N 1 1 355.373 2.643 20 5 FFBDMO CC1(C)CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1CCO ZINC000615140578 521289344 /nfs/dbraw/zinc/28/93/44/521289344.db2.gz ZUGZMUANLOCHKE-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1CCO ZINC000615140578 521289349 /nfs/dbraw/zinc/28/93/49/521289349.db2.gz ZUGZMUANLOCHKE-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1CCO ZINC000615140578 521289357 /nfs/dbraw/zinc/28/93/57/521289357.db2.gz ZUGZMUANLOCHKE-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599552643 521292964 /nfs/dbraw/zinc/29/29/64/521292964.db2.gz HCIHXWOHSCXKRZ-KGLIPLIRSA-N 1 1 365.455 2.902 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(Cl)c1 ZINC000611773136 521322928 /nfs/dbraw/zinc/32/29/28/521322928.db2.gz AYPPADNGKAYICO-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000618983938 521333455 /nfs/dbraw/zinc/33/34/55/521333455.db2.gz CIXCJGWFLNRLKR-GOSISDBHSA-N 1 1 360.502 2.933 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O ZINC000599632408 521344915 /nfs/dbraw/zinc/34/49/15/521344915.db2.gz KACGHOOGTSQVSI-JRLRZGBRSA-N 1 1 352.456 2.867 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O ZINC000599632408 521344923 /nfs/dbraw/zinc/34/49/23/521344923.db2.gz KACGHOOGTSQVSI-JRLRZGBRSA-N 1 1 352.456 2.867 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2c(O)cccc2C1 ZINC000599644864 521354566 /nfs/dbraw/zinc/35/45/66/521354566.db2.gz AEBQVNGELCQKEI-UHFFFAOYSA-N 1 1 371.393 2.696 20 5 FFBDMO CC(C)CN1CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602508417 521386040 /nfs/dbraw/zinc/38/60/40/521386040.db2.gz BVAPUNBOZLXHQB-UHFFFAOYSA-N 1 1 361.490 2.669 20 5 FFBDMO C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(=O)NC(C)(C)C ZINC000602536617 521400475 /nfs/dbraw/zinc/40/04/75/521400475.db2.gz VJNQNCUMKWUJQX-SSDOTTSWSA-N 1 1 364.265 2.812 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(Cc3cc(Br)c([N+](=O)[O-])s3)[C@@H]2C1 ZINC000602592401 521428820 /nfs/dbraw/zinc/42/88/20/521428820.db2.gz QWUKHRIZZNYFOB-JOYOIKCWSA-N 1 1 360.277 2.945 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594198646 521464080 /nfs/dbraw/zinc/46/40/80/521464080.db2.gz UGOKFLHPTHOFOL-CVEARBPZSA-N 1 1 353.369 2.549 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]2N1 ZINC000602711488 521491276 /nfs/dbraw/zinc/49/12/76/521491276.db2.gz ZUNYBYNPPIJPIX-MFKMUULPSA-N 1 1 357.332 2.714 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC000597105141 521509310 /nfs/dbraw/zinc/50/93/10/521509310.db2.gz WTDGIMUMZWRAOK-NSHDSACASA-N 1 1 369.853 2.930 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1nc2ccccc2n1C ZINC000602794383 521536098 /nfs/dbraw/zinc/53/60/98/521536098.db2.gz WJLMBHCZVNRODI-MRXNPFEDSA-N 1 1 354.414 2.824 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C ZINC000602794383 521536103 /nfs/dbraw/zinc/53/61/03/521536103.db2.gz WJLMBHCZVNRODI-MRXNPFEDSA-N 1 1 354.414 2.824 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)Cc1cccc(Cl)c1 ZINC000602796422 521537660 /nfs/dbraw/zinc/53/76/60/521537660.db2.gz NQHVPIAEFKGJSG-UHFFFAOYSA-N 1 1 352.822 2.638 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[NH2+]C1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C ZINC000602808853 521545193 /nfs/dbraw/zinc/54/51/93/521545193.db2.gz FGXGHVCYZDOGHH-HOTGVXAUSA-N 1 1 371.485 2.846 20 5 FFBDMO COc1c(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000619437728 521567598 /nfs/dbraw/zinc/56/75/98/521567598.db2.gz QEHVVZGZAGRSFO-MRXNPFEDSA-N 1 1 369.421 2.950 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC[C@@H]2N1 ZINC000597207814 521575307 /nfs/dbraw/zinc/57/53/07/521575307.db2.gz VTRRKYDXDPBJHP-PBHICJAKSA-N 1 1 355.394 2.955 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](Cc2cc(C)ccc2OC)CC1 ZINC000619474489 521587910 /nfs/dbraw/zinc/58/79/10/521587910.db2.gz SXBBTDHGRBBUBR-UHFFFAOYSA-N 1 1 373.457 2.759 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000619566919 521772999 /nfs/dbraw/zinc/77/29/99/521772999.db2.gz AFNYMYGTIBNPIP-KRWDZBQOSA-N 1 1 374.485 2.754 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000619895838 521930890 /nfs/dbraw/zinc/93/08/90/521930890.db2.gz NWOGCCRCMHEULR-MRXNPFEDSA-N 1 1 363.461 2.755 20 5 FFBDMO C[C@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485396630 561318389 /nfs/dbraw/zinc/31/83/89/561318389.db2.gz XMROFSWLRPXXMK-CQSZACIVSA-N 1 1 373.432 2.844 20 5 FFBDMO COc1ccc(-c2nn[nH]n2)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000826184026 608564213 /nfs/dbraw/zinc/56/42/13/608564213.db2.gz IHMMSFPNDBXNMD-NSHDSACASA-N 1 1 354.370 2.634 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CCC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001164625863 719087282 /nfs/dbraw/zinc/08/72/82/719087282.db2.gz HESZIOCQDDWPKB-MJGOQNOKSA-N 1 1 368.437 2.637 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@@H+]1CCOC ZINC000153686329 728785814 /nfs/dbraw/zinc/78/58/14/728785814.db2.gz SGYWDXGVRYGSRV-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1CCOC ZINC000153686329 728785815 /nfs/dbraw/zinc/78/58/15/728785815.db2.gz SGYWDXGVRYGSRV-AWEZNQCLSA-N 1 1 369.849 2.821 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1(C)C ZINC000110732993 728532943 /nfs/dbraw/zinc/53/29/43/728532943.db2.gz CVRFDJHXHRVKAM-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1(C)C ZINC000110732993 728532946 /nfs/dbraw/zinc/53/29/46/728532946.db2.gz CVRFDJHXHRVKAM-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000127170104 728705662 /nfs/dbraw/zinc/70/56/62/728705662.db2.gz JGDLQRSBUHXIER-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000127170104 728705663 /nfs/dbraw/zinc/70/56/63/728705663.db2.gz JGDLQRSBUHXIER-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1cnc(CC[N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000165189563 728971576 /nfs/dbraw/zinc/97/15/76/728971576.db2.gz DRZKUGKGSPYJCD-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO Cc1cnc(CC[N@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)s1 ZINC000165189563 728971580 /nfs/dbraw/zinc/97/15/80/728971580.db2.gz DRZKUGKGSPYJCD-UHFFFAOYSA-N 1 1 358.427 2.750 20 5 FFBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](CN3CCSC3=S)CC2)cc1 ZINC000173434929 729047149 /nfs/dbraw/zinc/04/71/49/729047149.db2.gz BKILWKOMVPAQIB-UHFFFAOYSA-N 1 1 353.469 2.729 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccc1Cl ZINC000195133913 729530420 /nfs/dbraw/zinc/53/04/20/729530420.db2.gz QSIKIDASXIQVSB-INIZCTEOSA-N 1 1 362.817 2.863 20 5 FFBDMO CC(C)[C@@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1CCCC1 ZINC000859567255 730459217 /nfs/dbraw/zinc/45/92/17/730459217.db2.gz QCLVNKYBQLFYPT-INIZCTEOSA-N 1 1 352.362 2.580 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000859689109 730463041 /nfs/dbraw/zinc/46/30/41/730463041.db2.gz NAPSEDPDIQJLEA-LBPRGKRZSA-N 1 1 352.362 2.724 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000860189969 730485483 /nfs/dbraw/zinc/48/54/83/730485483.db2.gz NXUWUNOWJUYXKM-PTEHBNRSSA-N 1 1 351.359 2.665 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000860189969 730485484 /nfs/dbraw/zinc/48/54/84/730485484.db2.gz NXUWUNOWJUYXKM-PTEHBNRSSA-N 1 1 351.359 2.665 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cccc(SC)c2[N+](=O)[O-])C1 ZINC000861349813 730602818 /nfs/dbraw/zinc/60/28/18/730602818.db2.gz VUJIKWNTCMTFHF-BDJLRTHQSA-N 1 1 354.428 2.583 20 5 FFBDMO C[C@@H]([NH2+]Cc1c(Br)cnn1C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866432158 731059760 /nfs/dbraw/zinc/05/97/60/731059760.db2.gz MJVMWOMECNUDPF-MRVPVSSYSA-N 1 1 354.208 2.524 20 5 FFBDMO COCCNC(=O)[C@H](CC(C)C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872058745 731724718 /nfs/dbraw/zinc/72/47/18/731724718.db2.gz YKPJYCHHZMICGA-JSGCOSHPSA-N 1 1 355.410 2.562 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+](Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872807597 731834965 /nfs/dbraw/zinc/83/49/65/731834965.db2.gz WOWIUHANWDGQPR-LLVKDONJSA-N 1 1 360.395 2.715 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](Cn3c(=O)oc4ccc([N+](=O)[O-])cc43)C2)n1 ZINC000872807597 731834969 /nfs/dbraw/zinc/83/49/69/731834969.db2.gz WOWIUHANWDGQPR-LLVKDONJSA-N 1 1 360.395 2.715 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000874831653 732104937 /nfs/dbraw/zinc/10/49/37/732104937.db2.gz ADNZDQMANBLELV-NEPJUHHUSA-N 1 1 355.341 2.505 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000874831654 732105112 /nfs/dbraw/zinc/10/51/12/732105112.db2.gz ADNZDQMANBLELV-NWDGAFQWSA-N 1 1 355.341 2.505 20 5 FFBDMO CCCCC[N@H+](CC(N)=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000780782791 738576094 /nfs/dbraw/zinc/57/60/94/738576094.db2.gz VPFXYIBXIDJDNF-UHFFFAOYSA-N 1 1 358.236 2.835 20 5 FFBDMO CCCCC[N@@H+](CC(N)=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000780782791 738576098 /nfs/dbraw/zinc/57/60/98/738576098.db2.gz VPFXYIBXIDJDNF-UHFFFAOYSA-N 1 1 358.236 2.835 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@@H](O)CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877752387 732423653 /nfs/dbraw/zinc/42/36/53/732423653.db2.gz DRBUFSFHDWEYII-NSHDSACASA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877752387 732423656 /nfs/dbraw/zinc/42/36/56/732423656.db2.gz DRBUFSFHDWEYII-NSHDSACASA-N 1 1 360.357 2.798 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000879961214 732809494 /nfs/dbraw/zinc/80/94/94/732809494.db2.gz BFIAYBHIEKZQFO-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000879961214 732809498 /nfs/dbraw/zinc/80/94/98/732809498.db2.gz BFIAYBHIEKZQFO-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000879961770 732809595 /nfs/dbraw/zinc/80/95/95/732809595.db2.gz HWHXMOGZURRGMX-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000879961770 732809599 /nfs/dbraw/zinc/80/95/99/732809599.db2.gz HWHXMOGZURRGMX-LLVKDONJSA-N 1 1 355.822 2.670 20 5 FFBDMO O=C(C[NH2+][C@H](CO)c1cccc(F)c1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782060842 738684683 /nfs/dbraw/zinc/68/46/83/738684683.db2.gz GYTGKNDFLIKEML-CQSZACIVSA-N 1 1 367.764 2.649 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])n(C)c1C ZINC000883344415 733371208 /nfs/dbraw/zinc/37/12/08/733371208.db2.gz ZQUNCCQMQKHMQP-UHFFFAOYSA-N 1 1 351.790 2.972 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000886141024 733753394 /nfs/dbraw/zinc/75/33/94/733753394.db2.gz VRQAQPGFISTSLC-CQSZACIVSA-N 1 1 350.419 2.725 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000886141024 733753397 /nfs/dbraw/zinc/75/33/97/733753397.db2.gz VRQAQPGFISTSLC-CQSZACIVSA-N 1 1 350.419 2.725 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000886319849 733773084 /nfs/dbraw/zinc/77/30/84/733773084.db2.gz QTGLHVLEYSCGME-ZIAGYGMSSA-N 1 1 355.316 2.614 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ncc(Br)s2)cc1 ZINC000714930819 734370843 /nfs/dbraw/zinc/37/08/43/734370843.db2.gz QHKAJKBWQFLWRR-SNVBAGLBSA-N 1 1 358.217 2.637 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)c1 ZINC000928093964 738821230 /nfs/dbraw/zinc/82/12/30/738821230.db2.gz FJOYNNLWZKETII-HIFRSBDPSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c1 ZINC000928093964 738821234 /nfs/dbraw/zinc/82/12/34/738821234.db2.gz FJOYNNLWZKETII-HIFRSBDPSA-N 1 1 367.496 2.626 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000928094116 738821729 /nfs/dbraw/zinc/82/17/29/738821729.db2.gz ZTAKZFPYWZZLPF-JSGCOSHPSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000928094116 738821733 /nfs/dbraw/zinc/82/17/33/738821733.db2.gz ZTAKZFPYWZZLPF-JSGCOSHPSA-N 1 1 369.874 2.866 20 5 FFBDMO C[C@]1(Br)C[C@@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078498 734512571 /nfs/dbraw/zinc/51/25/71/734512571.db2.gz NNZPRCFSJWHBIQ-GYSYKLTISA-N 1 1 355.236 2.650 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000928094117 738822083 /nfs/dbraw/zinc/82/20/83/738822083.db2.gz ZTAKZFPYWZZLPF-OCCSQVGLSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000928094117 738822089 /nfs/dbraw/zinc/82/20/89/738822089.db2.gz ZTAKZFPYWZZLPF-OCCSQVGLSA-N 1 1 369.874 2.866 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102354 738824965 /nfs/dbraw/zinc/82/49/65/738824965.db2.gz HTSSBSKXVNLSKS-WCQYABFASA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1c(Cl)cccc1[N+](=O)[O-] ZINC000928102354 738824971 /nfs/dbraw/zinc/82/49/71/738824971.db2.gz HTSSBSKXVNLSKS-WCQYABFASA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CC1(N2CCCC2)CCOCC1 ZINC000892928531 734624710 /nfs/dbraw/zinc/62/47/10/734624710.db2.gz HYHAORXSLHGUPJ-UHFFFAOYSA-N 1 1 353.850 2.983 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(Cl)cc2c1N1CC(C[NH+]2CCOCC2)C1 ZINC000893942337 734775649 /nfs/dbraw/zinc/77/56/49/734775649.db2.gz DZQQXSOMNGEUJG-UHFFFAOYSA-N 1 1 362.817 2.565 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894048516 734793212 /nfs/dbraw/zinc/79/32/12/734793212.db2.gz ZGGTVGPRGYJEQO-LSDHHAIUSA-N 1 1 366.849 2.669 20 5 FFBDMO COc1cc(N2CC[NH+](CCCCCO)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000894967841 734945730 /nfs/dbraw/zinc/94/57/30/734945730.db2.gz XFVXYFXWISHKAL-UHFFFAOYSA-N 1 1 357.838 2.541 20 5 FFBDMO Cc1c(Br)c(N2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)ncc1[N+](=O)[O-] ZINC000895192687 734972857 /nfs/dbraw/zinc/97/28/57/734972857.db2.gz KOOJRFWMCBFTPV-WDEREUQCSA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)ncc1[N+](=O)[O-] ZINC000895192687 734972862 /nfs/dbraw/zinc/97/28/62/734972862.db2.gz KOOJRFWMCBFTPV-WDEREUQCSA-N 1 1 355.236 2.734 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC[N@H+]1C ZINC000928431792 738868572 /nfs/dbraw/zinc/86/85/72/738868572.db2.gz OJTVZHCEBCXKIQ-RCOVLWMOSA-N 1 1 350.177 2.863 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](C4OCCO4)C3)cs2)c1 ZINC000896386177 735150808 /nfs/dbraw/zinc/15/08/08/735150808.db2.gz LMSGWRACRXRFNW-CYBMUJFWSA-N 1 1 361.423 2.913 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900284430 735623915 /nfs/dbraw/zinc/62/39/15/735623915.db2.gz TXIMBWHWHSCWLP-VIFPVBQESA-N 1 1 354.769 2.958 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC000754968993 736219870 /nfs/dbraw/zinc/21/98/70/736219870.db2.gz UEAHEVSONSWNBQ-SECBINFHSA-N 1 1 374.210 2.568 20 5 FFBDMO CC[N@H+]1CCN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000755032023 736228315 /nfs/dbraw/zinc/22/83/15/736228315.db2.gz VSWWZQHQZMGIBL-JTQLQIEISA-N 1 1 371.235 2.915 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756951476 736376409 /nfs/dbraw/zinc/37/64/09/736376409.db2.gz RTJQWQQVZRNXDQ-LBPRGKRZSA-N 1 1 354.838 2.778 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757262489 736399325 /nfs/dbraw/zinc/39/93/25/736399325.db2.gz NALIJTLLSUDXRX-HNNXBMFYSA-N 1 1 354.838 2.730 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000757261884 736399358 /nfs/dbraw/zinc/39/93/58/736399358.db2.gz LAPLKVMOCPVLFM-UHFFFAOYSA-N 1 1 354.838 2.874 20 5 FFBDMO CN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000758333758 736476663 /nfs/dbraw/zinc/47/66/63/736476663.db2.gz CACDDPIYEFCZAU-NSHDSACASA-N 1 1 368.231 2.666 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875071 736676232 /nfs/dbraw/zinc/67/62/32/736676232.db2.gz XVYGXDPKJKRDIA-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875071 736676234 /nfs/dbraw/zinc/67/62/34/736676234.db2.gz XVYGXDPKJKRDIA-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000762968598 736888606 /nfs/dbraw/zinc/88/86/06/736888606.db2.gz OWWKDALYIVNLOP-NSHDSACASA-N 1 1 350.400 2.631 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000913813841 737452381 /nfs/dbraw/zinc/45/23/81/737452381.db2.gz HUFFSBSOGDVGMF-CVEARBPZSA-N 1 1 351.834 2.876 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCCS1(=O)=O ZINC000811484786 741528511 /nfs/dbraw/zinc/52/85/11/741528511.db2.gz KPNXNYVNWKZWDO-SNVBAGLBSA-N 1 1 353.227 2.568 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774625868 738006644 /nfs/dbraw/zinc/00/66/44/738006644.db2.gz HUQZIYHUQZFMNS-NSHDSACASA-N 1 1 365.821 2.533 20 5 FFBDMO NC(=O)CC[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774625868 738006645 /nfs/dbraw/zinc/00/66/45/738006645.db2.gz HUQZIYHUQZFMNS-NSHDSACASA-N 1 1 365.821 2.533 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000774635467 738007655 /nfs/dbraw/zinc/00/76/55/738007655.db2.gz ITSXENFWCFKNBY-LBPRGKRZSA-N 1 1 351.838 2.829 20 5 FFBDMO CC(C)[C@@H]1[N@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385380 738134748 /nfs/dbraw/zinc/13/47/48/738134748.db2.gz ASZDZKJNAYTHMH-BDXSIMOUSA-N 1 1 367.877 2.818 20 5 FFBDMO CC(C)[C@@H]1[N@@H+](C)C[C@]12C[C@@H](O)[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000922385380 738134751 /nfs/dbraw/zinc/13/47/51/738134751.db2.gz ASZDZKJNAYTHMH-BDXSIMOUSA-N 1 1 367.877 2.818 20 5 FFBDMO C[C@H](CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)C1 ZINC000778231246 738365085 /nfs/dbraw/zinc/36/50/85/738365085.db2.gz FKQDNZCHWLLUPM-CHWSQXEVSA-N 1 1 355.385 2.923 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C[C@H]1C ZINC000778287358 738369806 /nfs/dbraw/zinc/36/98/06/738369806.db2.gz IGQJZEXAKMGWCH-ZYHUDNBSSA-N 1 1 363.443 2.544 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929364766 738976422 /nfs/dbraw/zinc/97/64/22/738976422.db2.gz LRKDVVMMIXWROE-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929364766 738976426 /nfs/dbraw/zinc/97/64/26/738976426.db2.gz LRKDVVMMIXWROE-LBPRGKRZSA-N 1 1 370.247 2.705 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000929630502 739006186 /nfs/dbraw/zinc/00/61/86/739006186.db2.gz BHTGITGZLBCPTH-BETUJISGSA-N 1 1 367.471 2.546 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[NH+]2CCC(c3nnc[nH]3)CC2)c1 ZINC000929819941 739025254 /nfs/dbraw/zinc/02/52/54/739025254.db2.gz ZSYVFFDDJFJJNO-UHFFFAOYSA-N 1 1 366.219 2.855 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930088953 739058234 /nfs/dbraw/zinc/05/82/34/739058234.db2.gz CYFAEFXICMRPTA-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000930088953 739058238 /nfs/dbraw/zinc/05/82/38/739058238.db2.gz CYFAEFXICMRPTA-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000931296833 739239767 /nfs/dbraw/zinc/23/97/67/739239767.db2.gz ALAMZDJIFJOQFB-MFKMUULPSA-N 1 1 370.862 2.950 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000788596400 739261890 /nfs/dbraw/zinc/26/18/90/739261890.db2.gz FIFIQCOEDJVXTH-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000788596400 739261892 /nfs/dbraw/zinc/26/18/92/739261892.db2.gz FIFIQCOEDJVXTH-TXEJJXNPSA-N 1 1 370.837 2.821 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CCCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000931903935 739350034 /nfs/dbraw/zinc/35/00/34/739350034.db2.gz REIQOZLIHMMWOS-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000932302877 739426399 /nfs/dbraw/zinc/42/63/99/739426399.db2.gz WZIHWWLSEFSQFV-CYBMUJFWSA-N 1 1 351.834 2.781 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790765575 739492785 /nfs/dbraw/zinc/49/27/85/739492785.db2.gz QBRVLMHFSCRVIJ-HNNXBMFYSA-N 1 1 357.813 2.728 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[C@@H]1C ZINC000790912661 739512209 /nfs/dbraw/zinc/51/22/09/739512209.db2.gz XXEXAOOPHYJDFG-QWRGUYRKSA-N 1 1 357.813 2.871 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000933440254 739626246 /nfs/dbraw/zinc/62/62/46/739626246.db2.gz CJVOLHRQAMPQPS-IUCAKERBSA-N 1 1 358.801 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCCSC[C@H]2C2CC2)cc1 ZINC000933914022 739704051 /nfs/dbraw/zinc/70/40/51/739704051.db2.gz GNGIWNVOYBXAKW-INIZCTEOSA-N 1 1 370.496 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCCSC[C@H]2C2CC2)cc1 ZINC000933914022 739704058 /nfs/dbraw/zinc/70/40/58/739704058.db2.gz GNGIWNVOYBXAKW-INIZCTEOSA-N 1 1 370.496 2.586 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000934576250 739808548 /nfs/dbraw/zinc/80/85/48/739808548.db2.gz MDKZAALLJLVTHY-IAQYHMDHSA-N 1 1 351.834 2.780 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000935656837 739989158 /nfs/dbraw/zinc/98/91/58/739989158.db2.gz LDGNYNBYBRDOBX-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO C[C@H]1C[NH+](CN2Cc3cc(Br)c([N+](=O)[O-])cc3C2=O)C[C@@H]1C ZINC000795436132 740021861 /nfs/dbraw/zinc/02/18/61/740021861.db2.gz VEUOARDMBDYSFR-UWVGGRQHSA-N 1 1 368.231 2.858 20 5 FFBDMO CN(C)C(=O)OC[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796550687 740152979 /nfs/dbraw/zinc/15/29/79/740152979.db2.gz FHFZCTUHEWWDBF-OAHLLOKOSA-N 1 1 351.403 2.526 20 5 FFBDMO O=[N+]([O-])c1cc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)cs1 ZINC000797844224 740279992 /nfs/dbraw/zinc/27/99/92/740279992.db2.gz AMJBVOILSJTNFM-CYBMUJFWSA-N 1 1 373.500 2.732 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000809741413 741338914 /nfs/dbraw/zinc/33/89/14/741338914.db2.gz OKNSKTODEVTERV-INIZCTEOSA-N 1 1 366.893 2.849 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1COC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811449519 741523780 /nfs/dbraw/zinc/52/37/80/741523780.db2.gz REHKXVCABCRGAF-KRWDZBQOSA-N 1 1 354.378 2.859 20 5 FFBDMO Cc1ccc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000997773912 742024918 /nfs/dbraw/zinc/02/49/18/742024918.db2.gz YXDBGQGIDLBSEV-NVXWUHKLSA-N 1 1 365.861 2.642 20 5 FFBDMO CC1(C)CCC(C[NH+]2CCC(C)(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001045437408 743275169 /nfs/dbraw/zinc/27/51/69/743275169.db2.gz PIAMJSFLUZJUGA-HZPDHXFCSA-N 1 1 351.491 2.839 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000827247191 743541717 /nfs/dbraw/zinc/54/17/17/743541717.db2.gz VKLGSWYNABMJFB-MFKMUULPSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3C(F)(F)F)CC[C@H]21 ZINC000827254391 743542159 /nfs/dbraw/zinc/54/21/59/743542159.db2.gz PCVXXYFWNPEZTG-QMTHXVAHSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)CC[C@@H]21 ZINC000827300394 743551490 /nfs/dbraw/zinc/55/14/90/743551490.db2.gz MQXLNXZWLBHPBT-HZMBPMFUSA-N 1 1 368.231 2.524 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000832344169 745680414 /nfs/dbraw/zinc/68/04/14/745680414.db2.gz UTESCBRUHNPKKF-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000832344169 745680418 /nfs/dbraw/zinc/68/04/18/745680418.db2.gz UTESCBRUHNPKKF-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839392881 746821411 /nfs/dbraw/zinc/82/14/11/746821411.db2.gz RQGACCBKJPLJBN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000839392881 746821419 /nfs/dbraw/zinc/82/14/19/746821419.db2.gz RQGACCBKJPLJBN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1NCC1([NH+]2CCOCC2)CCOCC1 ZINC000840331768 747067271 /nfs/dbraw/zinc/06/72/71/747067271.db2.gz QBFSQMQCAAOARA-UHFFFAOYSA-N 1 1 355.822 2.542 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCc1ccc([N+](=O)[O-])c(F)c1 ZINC000842650650 747648845 /nfs/dbraw/zinc/64/88/45/747648845.db2.gz QMEFAJSXAGYXBL-UHFFFAOYSA-N 1 1 356.354 2.647 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652785 747649732 /nfs/dbraw/zinc/64/97/32/747649732.db2.gz YLMVYJHHMLNNJE-JQWIXIFHSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@H](SC[C@@H]1C[N@@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652785 747649737 /nfs/dbraw/zinc/64/97/37/747649737.db2.gz YLMVYJHHMLNNJE-JQWIXIFHSA-N 1 1 373.862 2.639 20 5 FFBDMO O=C(CN1CCC[C@H]([C@@H]2CC[NH2+]C2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000843387115 747822503 /nfs/dbraw/zinc/82/25/03/747822503.db2.gz FEFXJYPLBQTVHU-OLZOCXBDSA-N 1 1 366.849 2.508 20 5 FFBDMO C[C@H](CO)C1CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000844416409 748025387 /nfs/dbraw/zinc/02/53/87/748025387.db2.gz OEVBPZBHDYJYHE-LLVKDONJSA-N 1 1 355.822 2.527 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847140900 748629128 /nfs/dbraw/zinc/62/91/28/748629128.db2.gz DSWBYZLUPXXQBY-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847140900 748629133 /nfs/dbraw/zinc/62/91/33/748629133.db2.gz DSWBYZLUPXXQBY-UTUOFQBUSA-N 1 1 370.837 2.867 20 5 FFBDMO COc1cc(CO[NH+]=C(N)[C@H]2C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000848523088 748949166 /nfs/dbraw/zinc/94/91/66/748949166.db2.gz ZOPQIFZNHDPSLD-WPRPVWTQSA-N 1 1 359.329 2.902 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)ccc1Cl ZINC000848930042 749037720 /nfs/dbraw/zinc/03/77/20/749037720.db2.gz MUVZDUJIIMPMEE-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)ccc1Cl ZINC000848930042 749037724 /nfs/dbraw/zinc/03/77/24/749037724.db2.gz MUVZDUJIIMPMEE-HNNXBMFYSA-N 1 1 353.850 2.935 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422721 749856656 /nfs/dbraw/zinc/85/66/56/749856656.db2.gz HPDKRBYXLKAPQU-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852422721 749856661 /nfs/dbraw/zinc/85/66/61/749856661.db2.gz HPDKRBYXLKAPQU-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO CCOC(=O)N[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055903512 845341741 /nfs/dbraw/zinc/34/17/41/845341741.db2.gz VYDYTBPOFDBYRX-AWEZNQCLSA-N 1 1 351.403 2.574 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1[N+](=O)[O-] ZINC000893317717 971570642 /nfs/dbraw/zinc/57/06/42/971570642.db2.gz OJZNSSZFQMQTAM-SFHVURJKSA-N 1 1 362.357 2.542 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121247061 958827773 /nfs/dbraw/zinc/82/77/73/958827773.db2.gz RJDHOXBIFVJXAQ-KRWDZBQOSA-N 1 1 374.441 2.870 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000866846361 958885666 /nfs/dbraw/zinc/88/56/66/958885666.db2.gz CSLFNZWWYZZHSD-WMLDXEAASA-N 1 1 361.417 2.752 20 5 FFBDMO O=C(CCN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911807 960120109 /nfs/dbraw/zinc/12/01/09/960120109.db2.gz HWCVXQRWTPCDGW-DNVCBOLYSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911807 960120142 /nfs/dbraw/zinc/12/01/42/960120142.db2.gz HWCVXQRWTPCDGW-DNVCBOLYSA-N 1 1 372.469 2.872 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H]2[C@H](CCCN2C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000134911807 960120147 /nfs/dbraw/zinc/12/01/47/960120147.db2.gz HWCVXQRWTPCDGW-DNVCBOLYSA-N 1 1 372.469 2.872 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C)c3ncccc3C2)cccc1[N+](=O)[O-] ZINC000872318086 1013210082 /nfs/dbraw/zinc/21/00/82/1013210082.db2.gz LTQDBABLOBZBGZ-UHFFFAOYSA-N 1 1 369.425 2.579 20 5 FFBDMO Cc1nn(C[N@H+]2CCCCCCNC(=O)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000872667547 1013244775 /nfs/dbraw/zinc/24/47/75/1013244775.db2.gz JQFZPOBLQJTHHC-UHFFFAOYSA-N 1 1 359.430 2.593 20 5 FFBDMO Cc1nn(C[NH+]2CCC(N3CCCCC3=O)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121262405 961496767 /nfs/dbraw/zinc/49/67/67/961496767.db2.gz PPXWDLCJBJUGTO-UHFFFAOYSA-N 1 1 371.441 2.687 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000124428619 1013413689 /nfs/dbraw/zinc/41/36/89/1013413689.db2.gz RSTJVXCWRLOEDJ-OAHLLOKOSA-N 1 1 362.474 2.759 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)C[C@H]1CC(C)C ZINC000933250135 963753972 /nfs/dbraw/zinc/75/39/72/963753972.db2.gz VIVMYIGZPMKKGE-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)C[C@H]1CC(C)C ZINC000933250135 963753975 /nfs/dbraw/zinc/75/39/75/963753975.db2.gz VIVMYIGZPMKKGE-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)C[C@H]1CC(C)C ZINC000933250135 963753982 /nfs/dbraw/zinc/75/39/82/963753982.db2.gz VIVMYIGZPMKKGE-QGZVFWFLSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCC(C)(C)[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000843759526 965672768 /nfs/dbraw/zinc/67/27/68/965672768.db2.gz QYARXCONVJTBMM-RYUDHWBXSA-N 1 1 367.421 2.660 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)ccc1Cl ZINC001176767499 1013777009 /nfs/dbraw/zinc/77/70/09/1013777009.db2.gz LQXADRUIVBXLLL-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)ccc1Cl ZINC001176767499 1013777012 /nfs/dbraw/zinc/77/70/12/1013777012.db2.gz LQXADRUIVBXLLL-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[N@H+]1C1CC1 ZINC000177132653 969060657 /nfs/dbraw/zinc/06/06/57/969060657.db2.gz DIXHNCBAMZVSOI-HUUCEWRRSA-N 1 1 372.469 2.940 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000874828464 1013910263 /nfs/dbraw/zinc/91/02/63/1013910263.db2.gz GZEHSYMZCCZGIV-DLBZAZTESA-N 1 1 366.421 2.966 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[C@H](c3[nH+]ccn3C)C2)cc1C ZINC000892984404 970470568 /nfs/dbraw/zinc/47/05/68/970470568.db2.gz CMUUSFPWKRHZFA-ZDUSSCGKSA-N 1 1 358.398 2.807 20 5 FFBDMO C[C@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1ccccc1[N+](=O)[O-] ZINC000876466366 1014277944 /nfs/dbraw/zinc/27/79/44/1014277944.db2.gz BCITYVLUSRUNCJ-RRQGHBQHSA-N 1 1 372.425 2.668 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCC3(CC3)CC1)C2 ZINC000981763855 976763788 /nfs/dbraw/zinc/76/37/88/976763788.db2.gz LYPNGLZCVIIDMH-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CC1CCC3(CC3)CC1)C2 ZINC000981763855 976763796 /nfs/dbraw/zinc/76/37/96/976763796.db2.gz LYPNGLZCVIIDMH-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCC3(CC3)CC1)C2 ZINC000981763855 976763805 /nfs/dbraw/zinc/76/38/05/976763805.db2.gz LYPNGLZCVIIDMH-IAGOWNOFSA-N 1 1 361.486 2.546 20 5 FFBDMO CCCNC(=O)C1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728898362 976859479 /nfs/dbraw/zinc/85/94/79/976859479.db2.gz UEFPYDUJEMYSDB-UHFFFAOYSA-N 1 1 371.441 2.654 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H]([C@@H](O)c2nccn2C)C1 ZINC000876809104 1014402270 /nfs/dbraw/zinc/40/22/70/1014402270.db2.gz CQMKDISFWGMRKT-MAUKXSAKSA-N 1 1 358.442 2.891 20 5 FFBDMO C[C@H](CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000174411348 977752212 /nfs/dbraw/zinc/75/22/12/977752212.db2.gz UPPFAQORXFNGKJ-CQSZACIVSA-N 1 1 356.426 2.817 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]CCCc2ccsc2)CC1 ZINC001481997907 977905825 /nfs/dbraw/zinc/90/58/25/977905825.db2.gz BPSCQYWTNXSDSF-IAGOWNOFSA-N 1 1 365.499 2.564 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688810 1014682829 /nfs/dbraw/zinc/68/28/29/1014682829.db2.gz VVSITRAYMJBBJG-ROUUACIJSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688810 1014682833 /nfs/dbraw/zinc/68/28/33/1014682833.db2.gz VVSITRAYMJBBJG-ROUUACIJSA-N 1 1 368.437 2.908 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000897536125 981638002 /nfs/dbraw/zinc/63/80/02/981638002.db2.gz INOKEBHDYCUMLS-WBAXXEDZSA-N 1 1 358.442 2.949 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000164789871 984402111 /nfs/dbraw/zinc/40/21/11/984402111.db2.gz LDOUXNSCMXYNRX-HKUYNNGSSA-N 1 1 355.442 2.735 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764964111 984892152 /nfs/dbraw/zinc/89/21/52/984892152.db2.gz FHNFBWOENZMUQQ-HNNXBMFYSA-N 1 1 373.457 2.695 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000765086111 984956381 /nfs/dbraw/zinc/95/63/81/984956381.db2.gz DJKDSDZCJFJYBI-CYBMUJFWSA-N 1 1 374.466 2.899 20 5 FFBDMO CCCC(=O)NC1CC[NH+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000761288115 985114047 /nfs/dbraw/zinc/11/40/47/985114047.db2.gz LNEUTZHSFFHBFH-UHFFFAOYSA-N 1 1 359.430 2.591 20 5 FFBDMO CC(C)c1ccc(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000997773781 985737084 /nfs/dbraw/zinc/73/70/84/985737084.db2.gz YEVQHALKDAGXMD-RTBURBONSA-N 1 1 359.470 2.803 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cc1 ZINC001000155495 986724844 /nfs/dbraw/zinc/72/48/44/986724844.db2.gz RYSRSTPPVRQGHO-QZTJIDSGSA-N 1 1 357.454 2.521 20 5 FFBDMO Cc1ccc(N2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)[C@H](C)C2)cc1C ZINC000761668491 987696506 /nfs/dbraw/zinc/69/65/06/987696506.db2.gz GATSUEVZTUZIAZ-QGZVFWFLSA-N 1 1 370.453 2.584 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000153934847 989772459 /nfs/dbraw/zinc/77/24/59/989772459.db2.gz YMULQTBONWRDKO-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2cccc(C[NH+]3CCOCC3)c2)c2nonc21 ZINC000917084780 990121770 /nfs/dbraw/zinc/12/17/70/990121770.db2.gz GLZFNJLFKCINHF-UHFFFAOYSA-N 1 1 369.381 2.575 20 5 FFBDMO Cc1c[nH+]cn1CC(=O)O[C@@H](c1cccnc1)c1ccccc1[N+](=O)[O-] ZINC001127564600 991200096 /nfs/dbraw/zinc/20/00/96/991200096.db2.gz KSOQHUNTMYQGFQ-SFHVURJKSA-N 1 1 352.350 2.828 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccc(C(F)F)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001484742416 991742430 /nfs/dbraw/zinc/74/24/30/991742430.db2.gz XSGJHWNIZHXQKS-HUUCEWRRSA-N 1 1 355.385 2.570 20 5 FFBDMO CN(CCC[N@H+](C)Cc1ccc(C(F)F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001484742416 991742440 /nfs/dbraw/zinc/74/24/40/991742440.db2.gz XSGJHWNIZHXQKS-HUUCEWRRSA-N 1 1 355.385 2.570 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccc(C(F)F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001484742416 991742452 /nfs/dbraw/zinc/74/24/52/991742452.db2.gz XSGJHWNIZHXQKS-HUUCEWRRSA-N 1 1 355.385 2.570 20 5 FFBDMO CC[N@@H+](C/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001485031277 991821261 /nfs/dbraw/zinc/82/12/61/991821261.db2.gz KMTJLRLIEMSIAS-ZNIXBBRXSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@H+](C/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031277 991821267 /nfs/dbraw/zinc/82/12/67/991821267.db2.gz KMTJLRLIEMSIAS-ZNIXBBRXSA-N 1 1 371.481 2.926 20 5 FFBDMO CC[N@@H+](C/C=C\c1ccccc1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031277 991821273 /nfs/dbraw/zinc/82/12/73/991821273.db2.gz KMTJLRLIEMSIAS-ZNIXBBRXSA-N 1 1 371.481 2.926 20 5 FFBDMO Cc1cncc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccccc2[N+](=O)[O-])c1 ZINC000879750343 1015664224 /nfs/dbraw/zinc/66/42/24/1015664224.db2.gz TUJGKQFAKNHLFA-IAGOWNOFSA-N 1 1 357.410 2.875 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)Cc2ccccc2[N+](=O)[O-])[nH+]1 ZINC001116097547 1032125303 /nfs/dbraw/zinc/12/53/03/1032125303.db2.gz XPEXGTPQMPBTER-INIZCTEOSA-N 1 1 354.410 2.944 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000880518589 1015862064 /nfs/dbraw/zinc/86/20/64/1015862064.db2.gz NVUSIRKTCAZHMO-SOXMVSPVSA-N 1 1 356.426 2.772 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000880519701 1015862916 /nfs/dbraw/zinc/86/29/16/1015862916.db2.gz UWMQMSAZLJOUEC-VHRNVKJDSA-N 1 1 369.425 2.677 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3CC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000880519701 1015862921 /nfs/dbraw/zinc/86/29/21/1015862921.db2.gz UWMQMSAZLJOUEC-VHRNVKJDSA-N 1 1 369.425 2.677 20 5 FFBDMO CC(C)[NH+]1CCC(CCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC001131879308 994618239 /nfs/dbraw/zinc/61/82/39/994618239.db2.gz VFMOWKQOVXWCRG-UHFFFAOYSA-N 1 1 359.430 2.711 20 5 FFBDMO Cn1cc(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000810848502 994953005 /nfs/dbraw/zinc/95/30/05/994953005.db2.gz VSJLCJMOPDGURP-HOTGVXAUSA-N 1 1 370.409 2.779 20 5 FFBDMO CCc1c(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)ccn1C ZINC000813174006 995633645 /nfs/dbraw/zinc/63/36/45/995633645.db2.gz NTKJWLBJLVNWIX-INIZCTEOSA-N 1 1 357.410 2.927 20 5 FFBDMO CCc1c(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)ccn1C ZINC000813174006 995633647 /nfs/dbraw/zinc/63/36/47/995633647.db2.gz NTKJWLBJLVNWIX-INIZCTEOSA-N 1 1 357.410 2.927 20 5 FFBDMO Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2F)cc(N2CCCC2)[nH+]1 ZINC000813281878 995657773 /nfs/dbraw/zinc/65/77/73/995657773.db2.gz JIHMEEDVCPVISZ-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCCC[C@@H]1C ZINC000825460551 997386831 /nfs/dbraw/zinc/38/68/31/997386831.db2.gz AHPAKNJVZGSREG-QWHCGFSZSA-N 1 1 366.437 2.793 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)CC[C@H]21 ZINC000827277680 1016124321 /nfs/dbraw/zinc/12/43/21/1016124321.db2.gz OFLVQJLQUYSQLA-MGPUTAFESA-N 1 1 361.445 2.848 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000844049341 997627843 /nfs/dbraw/zinc/62/78/43/997627843.db2.gz LBYKKOQUTUOBRZ-WBVHZDCISA-N 1 1 368.437 2.561 20 5 FFBDMO Cc1cc(N2CCC[C@@H](OC(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)nc(C)[nH+]1 ZINC000731552655 998021076 /nfs/dbraw/zinc/02/10/76/998021076.db2.gz SBXIEOLMKLNCGH-MRXNPFEDSA-N 1 1 374.372 2.967 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000732286274 998598550 /nfs/dbraw/zinc/59/85/50/998598550.db2.gz PUTMSXYIGOEVNQ-UHFFFAOYSA-N 1 1 360.418 2.831 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CC[C@H]1CCCC[N@@H+]1C ZINC000803855723 1016244166 /nfs/dbraw/zinc/24/41/66/1016244166.db2.gz KCOIRJAAAWLCOO-CQSZACIVSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1cc(C[NH2+]Cc2cccc3c2OCCO3)c([N+](=O)[O-])cc1OC ZINC000733331683 998964625 /nfs/dbraw/zinc/96/46/25/998964625.db2.gz LVPPRSOOFOPLEK-UHFFFAOYSA-N 1 1 360.366 2.673 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)[NH+]1CCCCCC1 ZINC000741031699 999701334 /nfs/dbraw/zinc/70/13/34/999701334.db2.gz VYYMJRMXXFTDSP-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000745085792 999891084 /nfs/dbraw/zinc/89/10/84/999891084.db2.gz GBWWCHVSAOIRRZ-CJNGLKHVSA-N 1 1 363.414 2.585 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(N(C)CC(F)F)CC1 ZINC000746482475 999998265 /nfs/dbraw/zinc/99/82/65/999998265.db2.gz REDBDNBPBZBKDT-GFCCVEGCSA-N 1 1 370.400 2.583 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168978592 1000012124 /nfs/dbraw/zinc/01/21/24/1000012124.db2.gz SPRUKNASMVVVSC-ZXYWRSMDSA-N 1 1 359.426 2.692 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn([C@@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168978590 1000012227 /nfs/dbraw/zinc/01/22/27/1000012227.db2.gz SPRUKNASMVVVSC-ZBQZNYHESA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]12CCC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011025 1000015338 /nfs/dbraw/zinc/01/53/38/1000015338.db2.gz HJVQLCGPXUFKPK-RKVPGOIHSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169035898 1000016671 /nfs/dbraw/zinc/01/66/71/1000016671.db2.gz MFILNIGVFBKUHA-GJZGRUSLSA-N 1 1 353.463 2.765 20 5 FFBDMO O=C1C[C@]2(CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)CN1c1cccc(F)c1 ZINC001169018876 1000017259 /nfs/dbraw/zinc/01/72/59/1000017259.db2.gz CWPGKPOHYMLZIA-ALKREAHSSA-N 1 1 361.417 2.700 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2C[C@@H]3COC[C@]3(COCC3CCCC3)C2)C1 ZINC001169025798 1000018139 /nfs/dbraw/zinc/01/81/39/1000018139.db2.gz VJGAENBQOIRTFY-NCXUSEDFSA-N 1 1 352.475 2.587 20 5 FFBDMO O=C(OCc1ccccc1)[C@@H]1CCC[NH2+][C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001169503739 1000054182 /nfs/dbraw/zinc/05/41/82/1000054182.db2.gz LMIYVMYVBNJWBN-CRAIPNDOSA-N 1 1 370.409 2.861 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000846972053 1000490285 /nfs/dbraw/zinc/49/02/85/1000490285.db2.gz LMGZPSISSDAFIJ-ZDUSSCGKSA-N 1 1 364.402 2.676 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000771395795 1001100260 /nfs/dbraw/zinc/10/02/60/1001100260.db2.gz MAAAMAFFMSRTRP-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@@H+]1C ZINC000771395795 1001100263 /nfs/dbraw/zinc/10/02/63/1001100263.db2.gz MAAAMAFFMSRTRP-CABCVRRESA-N 1 1 360.458 2.750 20 5 FFBDMO Cn1cc(NC(=[NH2+])c2ccc(Br)cc2F)cc([N+](=O)[O-])c1=O ZINC001170461557 1003779764 /nfs/dbraw/zinc/77/97/64/1003779764.db2.gz VDPNUUJQYJTJJW-UHFFFAOYSA-N 1 1 369.150 2.633 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nnc(N)o2)C1 ZINC001196526350 1003806483 /nfs/dbraw/zinc/80/64/83/1003806483.db2.gz OTLZSZXOGCRGIG-LBPRGKRZSA-N 1 1 361.402 2.727 20 5 FFBDMO O=C(NCc1ccc(C[NH2+]CC2CCCCC2)cc1F)[C@@H]1CC1[N+](=O)[O-] ZINC001001522777 1016829545 /nfs/dbraw/zinc/82/95/45/1016829545.db2.gz IAPSEUISLPDNCA-SJLPKXTDSA-N 1 1 363.433 2.777 20 5 FFBDMO CCCNC(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805777055 1004128859 /nfs/dbraw/zinc/12/88/59/1004128859.db2.gz YQGLURAAPUWPQQ-DLBZAZTESA-N 1 1 365.430 2.619 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685295 1004709817 /nfs/dbraw/zinc/70/98/17/1004709817.db2.gz IRRNZLKZUHUUEW-SJLPKXTDSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685295 1004709825 /nfs/dbraw/zinc/70/98/25/1004709825.db2.gz IRRNZLKZUHUUEW-SJLPKXTDSA-N 1 1 359.426 2.517 20 5 FFBDMO COc1ccc(CC(N)=[NH+]OCCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000808254650 1004783665 /nfs/dbraw/zinc/78/36/65/1004783665.db2.gz CYTJQSJGTICEJX-UHFFFAOYSA-N 1 1 359.382 2.896 20 5 FFBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275140 1005342338 /nfs/dbraw/zinc/34/23/38/1005342338.db2.gz JJYJYYWHIXVVDU-LIRRHRJNSA-N 1 1 367.409 2.902 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326373 1016970145 /nfs/dbraw/zinc/97/01/45/1016970145.db2.gz ZNZDDOYPKIBPSN-HUYLIWGRSA-N 1 1 371.481 2.994 20 5 FFBDMO CN(CC[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000107669288 1005507989 /nfs/dbraw/zinc/50/79/89/1005507989.db2.gz CRBPBJQNKZMJJY-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CN(CC[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000107669288 1005507992 /nfs/dbraw/zinc/50/79/92/1005507992.db2.gz CRBPBJQNKZMJJY-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580515 1005961254 /nfs/dbraw/zinc/96/12/54/1005961254.db2.gz VYLMDUQXSLRZSW-YXJHDRRASA-N 1 1 363.458 2.645 20 5 FFBDMO CCc1nn(C)c(Nc2ccc(N3CC[N@H+]4CCC[C@H]4C3)cc2)c1[N+](=O)[O-] ZINC001187454750 1006090580 /nfs/dbraw/zinc/09/05/80/1006090580.db2.gz PPLOURHOYUFBNQ-INIZCTEOSA-N 1 1 370.457 2.919 20 5 FFBDMO CC(C)c1ccccc1C[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001050516452 1017036069 /nfs/dbraw/zinc/03/60/69/1017036069.db2.gz BPYQXZYLQNXGLS-RTBURBONSA-N 1 1 371.481 2.900 20 5 FFBDMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCN(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1 ZINC000882133872 1006305281 /nfs/dbraw/zinc/30/52/81/1006305281.db2.gz FLXDKFQFLNVRLI-SJPCQFCGSA-N 1 1 372.469 2.545 20 5 FFBDMO CC[N@@H+]1CC[C@H]1CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000882492021 1006412417 /nfs/dbraw/zinc/41/24/17/1006412417.db2.gz PAMWXLBQXQVQPR-ZDUSSCGKSA-N 1 1 371.387 2.784 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000882492021 1006412425 /nfs/dbraw/zinc/41/24/25/1006412425.db2.gz PAMWXLBQXQVQPR-ZDUSSCGKSA-N 1 1 371.387 2.784 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)nc1-c1ccccn1 ZINC000853503302 1006417728 /nfs/dbraw/zinc/41/77/28/1006417728.db2.gz GJNSHIGOBAJSBA-CABCVRRESA-N 1 1 357.414 2.559 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC001152412247 1032162435 /nfs/dbraw/zinc/16/24/35/1032162435.db2.gz UBJYSQZQMDIKOF-QGZVFWFLSA-N 1 1 369.421 2.916 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC001189253716 1006976715 /nfs/dbraw/zinc/97/67/15/1006976715.db2.gz OXGOZMKJXZWKEB-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@H]3C3CCOCC3)n2)c1 ZINC000776769393 1007059305 /nfs/dbraw/zinc/05/93/05/1007059305.db2.gz FJDCATSZGUTWRK-QGZVFWFLSA-N 1 1 357.414 2.702 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCC[N@H+]2C)CC1 ZINC000817492646 1007619936 /nfs/dbraw/zinc/61/99/36/1007619936.db2.gz ZOPZPGZXIZWWGC-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000856281764 1007748488 /nfs/dbraw/zinc/74/84/88/1007748488.db2.gz JYNYSBSVSMIKQB-UHFFFAOYSA-N 1 1 366.418 2.672 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ncc(C)cc3[N+](=O)[O-])C2)ccn1 ZINC000856533782 1007873689 /nfs/dbraw/zinc/87/36/89/1007873689.db2.gz MRRRUDJQWYUKJE-QGZVFWFLSA-N 1 1 371.441 2.803 20 5 FFBDMO Nc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000114694409 1008017869 /nfs/dbraw/zinc/01/78/69/1008017869.db2.gz YZQTXRFBWZGLLJ-INIZCTEOSA-N 1 1 354.410 2.571 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000819275534 1008097712 /nfs/dbraw/zinc/09/77/12/1008097712.db2.gz WVMUDIRSGWFRGN-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000819275534 1008097716 /nfs/dbraw/zinc/09/77/16/1008097716.db2.gz WVMUDIRSGWFRGN-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)c1 ZINC000819275534 1008097720 /nfs/dbraw/zinc/09/77/20/1008097720.db2.gz WVMUDIRSGWFRGN-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000819275537 1008097741 /nfs/dbraw/zinc/09/77/41/1008097741.db2.gz WVMUDIRSGWFRGN-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000819275537 1008097745 /nfs/dbraw/zinc/09/77/45/1008097745.db2.gz WVMUDIRSGWFRGN-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)c1 ZINC000819275537 1008097747 /nfs/dbraw/zinc/09/77/47/1008097747.db2.gz WVMUDIRSGWFRGN-YLJYHZDGSA-N 1 1 355.438 2.740 20 5 FFBDMO CN1CC[N@@H+](C)Cc2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc21 ZINC000819466217 1008160699 /nfs/dbraw/zinc/16/06/99/1008160699.db2.gz LOVADGBTDKQAJI-IBGZPJMESA-N 1 1 356.426 2.622 20 5 FFBDMO CC(=O)N1CCCCC[C@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886003826 1008516421 /nfs/dbraw/zinc/51/64/21/1008516421.db2.gz LRBMOHKEGJJBKA-SFHVURJKSA-N 1 1 360.458 2.993 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000886435533 1008681936 /nfs/dbraw/zinc/68/19/36/1008681936.db2.gz BBZBMNAGPIMKGJ-SFHVURJKSA-N 1 1 357.410 2.531 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000886435533 1008681942 /nfs/dbraw/zinc/68/19/42/1008681942.db2.gz BBZBMNAGPIMKGJ-SFHVURJKSA-N 1 1 357.410 2.531 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCN(c3cccc4[nH]ccc43)CC2)c1 ZINC000859832991 1008687516 /nfs/dbraw/zinc/68/75/16/1008687516.db2.gz MFVNFWCGIXZKEP-FQEVSTJZSA-N 1 1 366.421 2.932 20 5 FFBDMO O=C(O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 ZINC000860739200 1009132614 /nfs/dbraw/zinc/13/26/14/1009132614.db2.gz ILPHLSAGRXAOBF-TZMCWYRMSA-N 1 1 374.372 2.703 20 5 FFBDMO Nc1ccc(NC(=O)N2CC[NH+](CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000824008636 1009291368 /nfs/dbraw/zinc/29/13/68/1009291368.db2.gz RXIXXISVBJMQBH-UHFFFAOYSA-N 1 1 369.425 2.569 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)cc1[N+](=O)[O-] ZINC000862545388 1009876510 /nfs/dbraw/zinc/87/65/10/1009876510.db2.gz RIBHGKGKPLEDOF-NVXWUHKLSA-N 1 1 367.405 2.968 20 5 FFBDMO C[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCC(C)(C)C1 ZINC000794688347 1010474345 /nfs/dbraw/zinc/47/43/45/1010474345.db2.gz YKPFAOIYBFZVLJ-KXBFYZLASA-N 1 1 374.441 2.830 20 5 FFBDMO Cc1noc(C2CC[NH+](Cn3nc(C)c4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000121120363 1011012494 /nfs/dbraw/zinc/01/24/94/1011012494.db2.gz PHTSNYGDHOHEFN-UHFFFAOYSA-N 1 1 356.386 2.781 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000868391362 1011278007 /nfs/dbraw/zinc/27/80/07/1011278007.db2.gz IZAOXEUFNSHVIG-UHFFFAOYSA-N 1 1 374.416 2.652 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001171862407 1011512554 /nfs/dbraw/zinc/51/25/54/1011512554.db2.gz ZBQDAESGLPMSPV-ZDUSSCGKSA-N 1 1 364.421 2.843 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCCN(c3ncccn3)CC1)CC2 ZINC001172914480 1012095805 /nfs/dbraw/zinc/09/58/05/1012095805.db2.gz GXGZYBNDHGOCDL-GOSISDBHSA-N 1 1 367.453 2.845 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC000870092956 1012125776 /nfs/dbraw/zinc/12/57/76/1012125776.db2.gz OCNBHFSAAZKDBM-QGZVFWFLSA-N 1 1 355.394 2.704 20 5 FFBDMO CNc1nccc(C(=O)N2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000870124140 1012171253 /nfs/dbraw/zinc/17/12/53/1012171253.db2.gz SYOCZTMMFLTTFM-AWEZNQCLSA-N 1 1 369.425 2.551 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@H]1O ZINC001173010581 1012179096 /nfs/dbraw/zinc/17/90/96/1012179096.db2.gz VLHVJDAPEPGJQD-SJKOYZFVSA-N 1 1 369.412 2.935 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)O1 ZINC001173014082 1012184013 /nfs/dbraw/zinc/18/40/13/1012184013.db2.gz JYIBXLPFHSVCBV-TXEJJXNPSA-N 1 1 355.385 2.951 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)CC[NH2+]2)cc1 ZINC000870138571 1012185297 /nfs/dbraw/zinc/18/52/97/1012185297.db2.gz MPWRKDMXMLWWRX-RRPUDGLYSA-N 1 1 367.405 2.790 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCC[C@@](F)(CO)CC2)c1F ZINC001173180026 1012325187 /nfs/dbraw/zinc/32/51/87/1012325187.db2.gz ICRAJDFRILJDPH-SJCJKPOMSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)[C@H]2CCCN(C(C)=O)C2)c1F ZINC001173191462 1012331080 /nfs/dbraw/zinc/33/10/80/1012331080.db2.gz FKBXUVGSJHVORN-OCCSQVGLSA-N 1 1 367.421 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@H]([N@@H+](C)C3CC3)C2)c1F ZINC001173192118 1012335610 /nfs/dbraw/zinc/33/56/10/1012335610.db2.gz IGMNMOLOKYITOV-OCCSQVGLSA-N 1 1 351.422 2.842 20 5 FFBDMO CC1(C)CC(C[N@H+]2CCc3c(CNC(=O)[C@@H]4C[C@H]4[N+](=O)[O-])cccc3C2)C1 ZINC001051291650 1017271036 /nfs/dbraw/zinc/27/10/36/1017271036.db2.gz WTXCEIMIEMWRRL-RTBURBONSA-N 1 1 371.481 2.762 20 5 FFBDMO CC1(C)CC(C[N@@H+]2CCc3c(CNC(=O)[C@@H]4CC4[N+](=O)[O-])cccc3C2)C1 ZINC001051291650 1017271048 /nfs/dbraw/zinc/27/10/48/1017271048.db2.gz WTXCEIMIEMWRRL-RTBURBONSA-N 1 1 371.481 2.762 20 5 FFBDMO CC1(C)CC(C[N@H+]2CCc3c(CNC(=O)[C@@H]4CC4[N+](=O)[O-])cccc3C2)C1 ZINC001051291650 1017271059 /nfs/dbraw/zinc/27/10/59/1017271059.db2.gz WTXCEIMIEMWRRL-RTBURBONSA-N 1 1 371.481 2.762 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)CC[C@@H](O)c1ccccc1 ZINC000930353088 1019992662 /nfs/dbraw/zinc/99/26/62/1019992662.db2.gz GUUZMJKYGOZIGJ-VQTJNVASSA-N 1 1 358.438 2.944 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777955712 1020316335 /nfs/dbraw/zinc/31/63/35/1020316335.db2.gz QUMIYOOLOGSYRF-GOSISDBHSA-N 1 1 369.425 2.503 20 5 FFBDMO O=C1CCCN1[C@@H]1CCC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1 ZINC000777955712 1020316348 /nfs/dbraw/zinc/31/63/48/1020316348.db2.gz QUMIYOOLOGSYRF-GOSISDBHSA-N 1 1 369.425 2.503 20 5 FFBDMO COc1c(C)[nH]cc(C[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1=O ZINC000931322980 1020422422 /nfs/dbraw/zinc/42/24/22/1020422422.db2.gz ITFZQMZWPPDFDN-UHFFFAOYSA-N 1 1 361.398 2.501 20 5 FFBDMO COc1cc([C@H](C)[NH2+]C[C@H](C(C)C)N2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC000903064940 1020659716 /nfs/dbraw/zinc/65/97/16/1020659716.db2.gz CBIGZESDGKLCQW-HNAYVOBHSA-N 1 1 364.490 2.526 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]([C@@]2(C)COC(=O)N2)C1 ZINC000932027432 1020674108 /nfs/dbraw/zinc/67/41/08/1020674108.db2.gz YJUYQKNGZWJLKY-RDTXWAMCSA-N 1 1 363.414 2.704 20 5 FFBDMO O=C1NCC2(CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)Oc2ccccc21 ZINC000932044022 1020685961 /nfs/dbraw/zinc/68/59/61/1020685961.db2.gz AOQKRTRFXZIYQO-UHFFFAOYSA-N 1 1 367.405 2.752 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000778300984 1021559160 /nfs/dbraw/zinc/55/91/60/1021559160.db2.gz ZRPXAYYXCIJXBA-CQSZACIVSA-N 1 1 367.396 2.877 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC001118774447 1022394438 /nfs/dbraw/zinc/39/44/38/1022394438.db2.gz DCVSPSYUSZJBMQ-HNNXBMFYSA-N 1 1 360.458 2.799 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271086 1022648037 /nfs/dbraw/zinc/64/80/37/1022648037.db2.gz SXOMQJCKKUTJES-KBPBESRZSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001119271086 1022648047 /nfs/dbraw/zinc/64/80/47/1022648047.db2.gz SXOMQJCKKUTJES-KBPBESRZSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351087 1033114436 /nfs/dbraw/zinc/11/44/36/1033114436.db2.gz SRNHDZKCHZBUFO-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829351087 1033114441 /nfs/dbraw/zinc/11/44/41/1033114441.db2.gz SRNHDZKCHZBUFO-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO CCC1(CC)CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000755930058 1023653145 /nfs/dbraw/zinc/65/31/45/1023653145.db2.gz GLPGKLCEDKKEPQ-GOSISDBHSA-N 1 1 374.441 2.831 20 5 FFBDMO CC[N@@H+](CCC1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC1)CC(C)C ZINC001121295862 1023692936 /nfs/dbraw/zinc/69/29/36/1023692936.db2.gz AJUZVZOYTKGJGT-OAHLLOKOSA-N 1 1 366.510 2.737 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000757604185 1023834941 /nfs/dbraw/zinc/83/49/41/1023834941.db2.gz VJTKTJSETJRGAF-KRWDZBQOSA-N 1 1 354.410 2.577 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000757604185 1023834948 /nfs/dbraw/zinc/83/49/48/1023834948.db2.gz VJTKTJSETJRGAF-KRWDZBQOSA-N 1 1 354.410 2.577 20 5 FFBDMO CCn1c(-c2csc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)C)CC1 ZINC001121680626 1023923406 /nfs/dbraw/zinc/92/34/06/1023923406.db2.gz GUNQMQNIAIFQOZ-UHFFFAOYSA-N 1 1 364.475 2.855 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 ZINC000837385761 1025763540 /nfs/dbraw/zinc/76/35/40/1025763540.db2.gz DKJUCQDEJMNOGY-OAHLLOKOSA-N 1 1 373.413 2.595 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)O[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000837574278 1025907937 /nfs/dbraw/zinc/90/79/37/1025907937.db2.gz XVPCXRVWWKBEMP-CYBMUJFWSA-N 1 1 359.357 2.747 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@](C(N)=O)(c2ccccc2)C1 ZINC000839643358 1026771609 /nfs/dbraw/zinc/77/16/09/1026771609.db2.gz RQPYJQFDBLNXDC-FQEVSTJZSA-N 1 1 369.421 2.623 20 5 FFBDMO C[C@@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000839646240 1026773739 /nfs/dbraw/zinc/77/37/39/1026773739.db2.gz KTFRQWYFISFAJL-UZLBHIALSA-N 1 1 355.438 2.835 20 5 FFBDMO CN(CCC[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000839654082 1026776197 /nfs/dbraw/zinc/77/61/97/1026776197.db2.gz FAEZVYJANZKIPN-INIZCTEOSA-N 1 1 367.446 2.817 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cc([N+](=O)[O-])c(-c4ccncc4)n3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000840114585 1026961401 /nfs/dbraw/zinc/96/14/01/1026961401.db2.gz GXLQRWKQSBUHMH-OLMMMNRUSA-N 1 1 351.410 2.955 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)C(C)(C)C[NH+]1CCOCC1 ZINC000840568252 1027118096 /nfs/dbraw/zinc/11/80/96/1027118096.db2.gz KCTRXMIDLUQDPL-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO Nc1ccc2cc3ccc(Nc4cnc(N5CC[NH2+]CC5)nc4)cc3nc2c1 ZINC001159700803 1027470392 /nfs/dbraw/zinc/47/03/92/1027470392.db2.gz SYWDVTZRGBPNNY-UHFFFAOYSA-N 1 1 371.448 2.913 20 5 FFBDMO Cc1cccc(CCC[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001160096989 1027588218 /nfs/dbraw/zinc/58/82/18/1027588218.db2.gz DMRJXFACJMQHBN-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1cccc(CCC[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160096989 1027588220 /nfs/dbraw/zinc/58/82/20/1027588220.db2.gz DMRJXFACJMQHBN-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cc1cccc(CCC[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160096989 1027588225 /nfs/dbraw/zinc/58/82/25/1027588225.db2.gz DMRJXFACJMQHBN-WOJBJXKFSA-N 1 1 371.481 2.731 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970088 1028371156 /nfs/dbraw/zinc/37/11/56/1028371156.db2.gz STBUNPQDMIGMGZ-YVEFUNNKSA-N 1 1 366.368 2.695 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)cn1 ZINC000795970088 1028371170 /nfs/dbraw/zinc/37/11/70/1028371170.db2.gz STBUNPQDMIGMGZ-YVEFUNNKSA-N 1 1 366.368 2.695 20 5 FFBDMO Cc1c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000249948064 1028410849 /nfs/dbraw/zinc/41/08/49/1028410849.db2.gz ZUIGOERPKCBCHM-VXGBXAGGSA-N 1 1 364.402 2.662 20 5 FFBDMO COc1ccc(OC)c([C@@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000796110454 1028474207 /nfs/dbraw/zinc/47/42/07/1028474207.db2.gz CWGALJCHDYRLFV-SFHVURJKSA-N 1 1 360.410 2.820 20 5 FFBDMO CC(C)[C@@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000780499097 1028714781 /nfs/dbraw/zinc/71/47/81/1028714781.db2.gz RJKBQHPCPQPFBH-CQSZACIVSA-N 1 1 360.414 2.689 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)[nH+]1 ZINC001156214418 1029094508 /nfs/dbraw/zinc/09/45/08/1029094508.db2.gz NBIRKHLHKWJNMC-UHFFFAOYSA-N 1 1 357.395 2.988 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)[nH+]1 ZINC001156470329 1029204365 /nfs/dbraw/zinc/20/43/65/1029204365.db2.gz OHBIVJYDRTWZOK-UHFFFAOYSA-N 1 1 352.753 2.933 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c1 ZINC001165089305 1029380629 /nfs/dbraw/zinc/38/06/29/1029380629.db2.gz TUBMRDFKGLAKAP-ZBFHGGJFSA-N 1 1 374.828 2.592 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1ncc([N+](=O)[O-])cc1N ZINC001165181865 1029437202 /nfs/dbraw/zinc/43/72/02/1029437202.db2.gz RTNNQCSVBOIDRF-RDTXWAMCSA-N 1 1 355.442 2.919 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1N(C)c1ncc([N+](=O)[O-])cc1N ZINC001165181863 1029437839 /nfs/dbraw/zinc/43/78/39/1029437839.db2.gz RTNNQCSVBOIDRF-KBXCAEBGSA-N 1 1 355.442 2.919 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCc2ccc(OC3COC3)cc2)ncc1[N+](=O)[O-] ZINC001157671349 1029641475 /nfs/dbraw/zinc/64/14/75/1029641475.db2.gz CZVCWOQIHPJWIB-BQYQJAHWSA-N 1 1 370.409 2.912 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cn1 ZINC000782525961 1029732546 /nfs/dbraw/zinc/73/25/46/1029732546.db2.gz FREBXSAYWISXBP-UHFFFAOYSA-N 1 1 362.361 2.598 20 5 FFBDMO O=C1NCC2(CC[NH+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC2)O1 ZINC000783721493 1030251829 /nfs/dbraw/zinc/25/18/29/1030251829.db2.gz AMOQRTQFYYOEDH-UHFFFAOYSA-N 1 1 374.422 2.793 20 5 FFBDMO COc1cc2ccn(C(=O)C[NH+](C)C)c2cc1Nc1ccc([N+](=O)[O-])nc1 ZINC001203580346 1030769512 /nfs/dbraw/zinc/76/95/12/1030769512.db2.gz NKAOSHZWTJSZJY-UHFFFAOYSA-N 1 1 369.381 2.899 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000798523431 1031445651 /nfs/dbraw/zinc/44/56/51/1031445651.db2.gz JPSVODBMTOLQGB-IBGZPJMESA-N 1 1 356.426 2.575 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc3c(c2)CCC3)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530845 1031789790 /nfs/dbraw/zinc/78/97/90/1031789790.db2.gz UZTDCZXRQQNYGN-RTBURBONSA-N 1 1 371.481 2.749 20 5 FFBDMO CCOc1ccc2c(c1)c(=N)c1ccc(N)cc1n2C(=O)[C@@]1(C)CC[NH2+]C1 ZINC001219005896 1033456165 /nfs/dbraw/zinc/45/61/65/1033456165.db2.gz XRMXQXCQDJSLNS-NRFANRHFSA-N 1 1 364.449 2.895 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ncccc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001225598709 1034327974 /nfs/dbraw/zinc/32/79/74/1034327974.db2.gz YJCKPKDFDNJDJF-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ncccc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225598709 1034327975 /nfs/dbraw/zinc/32/79/75/1034327975.db2.gz YJCKPKDFDNJDJF-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@H](Oc3ccc([N+](=O)[O-])cn3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225634752 1034347091 /nfs/dbraw/zinc/34/70/91/1034347091.db2.gz NXVUSHQIDZUPEF-JQHSSLGASA-N 1 1 353.378 2.743 20 5 FFBDMO C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ccc2c(c1)oc1cc(=O)ccc-1[n+]2[O-] ZINC001227454159 1035561917 /nfs/dbraw/zinc/56/19/17/1035561917.db2.gz YFRYHZBPTBGCIR-GFENJXEQSA-N 1 1 366.417 2.640 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001228016148 1035879867 /nfs/dbraw/zinc/87/98/67/1035879867.db2.gz BJNBKNVPXKXUTG-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1c(Cl)ccnc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001228016148 1035879884 /nfs/dbraw/zinc/87/98/84/1035879884.db2.gz BJNBKNVPXKXUTG-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Br)c3)[C@H]1CC(=O)C2 ZINC001229079804 1036487551 /nfs/dbraw/zinc/48/75/51/1036487551.db2.gz AYWDLKMKMNTPOJ-PCTYZZJISA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Br)c3)[C@H]1CC(=O)C2 ZINC001229079804 1036487558 /nfs/dbraw/zinc/48/75/58/1036487558.db2.gz AYWDLKMKMNTPOJ-PCTYZZJISA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2cc([O-])cc3oc4c(O)ccc(O)c4c(=O)c23)CC1 ZINC001234122935 1036927252 /nfs/dbraw/zinc/92/72/52/1036927252.db2.gz CHAPHEWBGHVQPV-GFCCVEGCSA-N 1 1 371.389 2.926 20 5 FFBDMO C[N@@H+]1CCC[C@@H](Oc2cc(O)cc3oc4c(O)ccc(O)c4c(=O)c23)CC1 ZINC001234122935 1036927270 /nfs/dbraw/zinc/92/72/70/1036927270.db2.gz CHAPHEWBGHVQPV-GFCCVEGCSA-N 1 1 371.389 2.926 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3cccc(Br)c3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001230326078 1037223350 /nfs/dbraw/zinc/22/33/50/1037223350.db2.gz HGXUIMCBURVAOF-KDDOJWQBSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cccc(Br)c3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001230326078 1037223363 /nfs/dbraw/zinc/22/33/63/1037223363.db2.gz HGXUIMCBURVAOF-KDDOJWQBSA-N 1 1 355.188 2.540 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2c([N+](=O)[O-])cc(C(C)(C)C)cc2[N+](=O)[O-])C1 ZINC001231197997 1037496519 /nfs/dbraw/zinc/49/65/19/1037496519.db2.gz KIUCEYKBJKYNFA-CYBMUJFWSA-N 1 1 367.402 2.900 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001537097844 1070120123 /nfs/dbraw/zinc/12/01/23/1070120123.db2.gz YLVWWSJLCRAZCN-RDJZCZTQSA-N 1 1 368.437 2.939 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@]4(CCCO4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093553 1038380319 /nfs/dbraw/zinc/38/03/19/1038380319.db2.gz NKITWMIHABUWSX-IBGZPJMESA-N 1 1 361.442 2.827 20 5 FFBDMO C[C@@H](c1nnc(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013857 1039112775 /nfs/dbraw/zinc/11/27/75/1039112775.db2.gz ZCNRFNPRWDITMY-HZSPNIEDSA-N 1 1 360.414 2.781 20 5 FFBDMO C[C@@H](c1nnc(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013857 1039112784 /nfs/dbraw/zinc/11/27/84/1039112784.db2.gz ZCNRFNPRWDITMY-HZSPNIEDSA-N 1 1 360.414 2.781 20 5 FFBDMO C[C@@H](c1nnc(CC[NH+]2C[C@@H](C)O[C@H](C)C2)o1)c1ccc([N+](=O)[O-])cc1 ZINC001258013860 1039113186 /nfs/dbraw/zinc/11/31/86/1039113186.db2.gz ZCNRFNPRWDITMY-MGPQQGTHSA-N 1 1 360.414 2.781 20 5 FFBDMO COC(=O)c1cc(-c2nc3ccc(C[NH+](C)C)cc3[nH]2)cc([N+](=O)[O-])c1 ZINC001251528890 1039167501 /nfs/dbraw/zinc/16/75/01/1039167501.db2.gz JXLZBPSOYQGYJJ-UHFFFAOYSA-N 1 1 354.366 2.986 20 5 FFBDMO C[C@H]1CC[C@H](C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)NC1 ZINC001246108301 1039246452 /nfs/dbraw/zinc/24/64/52/1039246452.db2.gz UVYGIGRMYHQSQD-GXTWGEPZSA-N 1 1 368.428 2.820 20 5 FFBDMO C[C@H]1CC[C@H](CNC2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[NH2+]C1 ZINC001246108301 1039246469 /nfs/dbraw/zinc/24/64/69/1039246469.db2.gz UVYGIGRMYHQSQD-GXTWGEPZSA-N 1 1 368.428 2.820 20 5 FFBDMO Cc1ccc(NCCCNC(=O)C[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001252039930 1039414644 /nfs/dbraw/zinc/41/46/44/1039414644.db2.gz XJSWTJVRZVIZND-UHFFFAOYSA-N 1 1 370.453 2.953 20 5 FFBDMO Cc1ccc(NCCCNC(=O)C[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001252039930 1039414652 /nfs/dbraw/zinc/41/46/52/1039414652.db2.gz XJSWTJVRZVIZND-UHFFFAOYSA-N 1 1 370.453 2.953 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667815 1070231590 /nfs/dbraw/zinc/23/15/90/1070231590.db2.gz LXOYHGJUYJAFKR-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667815 1070231603 /nfs/dbraw/zinc/23/16/03/1070231603.db2.gz LXOYHGJUYJAFKR-KBPBESRZSA-N 1 1 355.847 2.558 20 5 FFBDMO [NH3+][C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3c(c2)OCCO3)no1 ZINC001248209940 1040173770 /nfs/dbraw/zinc/17/37/70/1040173770.db2.gz FVQGFIMXUCTUCG-AWEZNQCLSA-N 1 1 368.349 2.659 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([NH+]3CC4(C3)CC(F)(F)CO4)CC2)cc1 ZINC001254480818 1040746822 /nfs/dbraw/zinc/74/68/22/1040746822.db2.gz MLYHNLJNTQBRQT-UHFFFAOYSA-N 1 1 353.369 2.674 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])[C@H]1Cc1cnn(C)c1 ZINC001254558799 1040796104 /nfs/dbraw/zinc/79/61/04/1040796104.db2.gz VTYPNAYEHZABER-YSSFQJQWSA-N 1 1 372.469 2.981 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001254555885 1040797178 /nfs/dbraw/zinc/79/71/78/1040797178.db2.gz IVKYXKVBQMCOKU-BQTBQCLESA-N 1 1 369.421 2.900 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC2CC1(C(=O)NCc1ccco1)C2 ZINC001254555885 1040797198 /nfs/dbraw/zinc/79/71/98/1040797198.db2.gz IVKYXKVBQMCOKU-BQTBQCLESA-N 1 1 369.421 2.900 20 5 FFBDMO CC[C@@H]1[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCC[C@]12CCC(=O)N2C ZINC001254596876 1040827143 /nfs/dbraw/zinc/82/71/43/1040827143.db2.gz SIVPAEZXBGFSHX-HBFSDRIKSA-N 1 1 357.454 2.927 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@H]2COC ZINC001254599337 1040829442 /nfs/dbraw/zinc/82/94/42/1040829442.db2.gz YDQSJTNNKVBGDB-DOTOQJQBSA-N 1 1 356.426 2.524 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@H]2COC ZINC001254599337 1040829452 /nfs/dbraw/zinc/82/94/52/1040829452.db2.gz YDQSJTNNKVBGDB-DOTOQJQBSA-N 1 1 356.426 2.524 20 5 FFBDMO O=c1[nH]cc([N+](=O)[O-])cc1-c1nnc([C@H]2CC[N@@H+](Cc3ccccc3)C2)o1 ZINC001255457331 1041347022 /nfs/dbraw/zinc/34/70/22/1041347022.db2.gz ULPUJBFHXSXDMJ-ZDUSSCGKSA-N 1 1 367.365 2.735 20 5 FFBDMO COc1cc(C[N@@H+]2C3CCC2(CO)CC3)c([N+](=O)[O-])cc1OC(F)F ZINC001262313369 1041638774 /nfs/dbraw/zinc/63/87/74/1041638774.db2.gz FQIAPPYMFXGAPN-UHFFFAOYSA-N 1 1 358.341 2.694 20 5 FFBDMO COc1cc(C[N@H+]2C3CCC2(CO)CC3)c([N+](=O)[O-])cc1OC(F)F ZINC001262313369 1041638777 /nfs/dbraw/zinc/63/87/77/1041638777.db2.gz FQIAPPYMFXGAPN-UHFFFAOYSA-N 1 1 358.341 2.694 20 5 FFBDMO CN(C)c1ccc(COC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001538253602 1070383844 /nfs/dbraw/zinc/38/38/44/1070383844.db2.gz LXGBKOWFPOMKLF-UHFFFAOYSA-N 1 1 367.365 2.599 20 5 FFBDMO Cc1cc(NC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn2cc[nH+]c12 ZINC001310810053 1043745876 /nfs/dbraw/zinc/74/58/76/1043745876.db2.gz PIXUZIFHQLGLPY-UHFFFAOYSA-N 1 1 365.353 2.749 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001313895003 1044439483 /nfs/dbraw/zinc/43/94/83/1044439483.db2.gz FOTAKDIFAHZPED-QGZVFWFLSA-N 1 1 370.457 2.938 20 5 FFBDMO Cc1cc(NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)cc(C)[nH+]1 ZINC001319543280 1045188515 /nfs/dbraw/zinc/18/85/15/1045188515.db2.gz RIPLTPGNBGAWCA-UHFFFAOYSA-N 1 1 352.350 2.594 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001319704735 1045246855 /nfs/dbraw/zinc/24/68/55/1045246855.db2.gz QSRBXEHWMYAWFQ-HIFRSBDPSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001319704735 1045246864 /nfs/dbraw/zinc/24/68/64/1045246864.db2.gz QSRBXEHWMYAWFQ-HIFRSBDPSA-N 1 1 358.398 2.881 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[N@H+]2CCC[C@H]2C1 ZINC001320810952 1045472382 /nfs/dbraw/zinc/47/23/82/1045472382.db2.gz KOVGDXARTWRMRB-JSGCOSHPSA-N 1 1 367.833 2.712 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001323545081 1045632442 /nfs/dbraw/zinc/63/24/42/1045632442.db2.gz FEIMRRUNHIEMOM-UHFFFAOYSA-N 1 1 356.407 2.531 20 5 FFBDMO Cc1nc2sccn2c(=O)c1CC[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001323545081 1045632446 /nfs/dbraw/zinc/63/24/46/1045632446.db2.gz FEIMRRUNHIEMOM-UHFFFAOYSA-N 1 1 356.407 2.531 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001290892614 1048485745 /nfs/dbraw/zinc/48/57/45/1048485745.db2.gz ZSOBMVKEFKDHSV-ZDUSSCGKSA-N 1 1 356.426 2.792 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1 ZINC001540934016 1071034814 /nfs/dbraw/zinc/03/48/14/1071034814.db2.gz DJXHAEVWBHSHGC-OKILXGFUSA-N 1 1 351.422 2.761 20 5 FFBDMO CC1(C)COCC[N@@H+]1CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001330635482 1049242993 /nfs/dbraw/zinc/24/29/93/1049242993.db2.gz KUDKCGCAZLRPGN-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO CC1(C)COCC[N@H+]1CCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001330635482 1049243000 /nfs/dbraw/zinc/24/30/00/1049243000.db2.gz KUDKCGCAZLRPGN-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)n1 ZINC001294189192 1049704106 /nfs/dbraw/zinc/70/41/06/1049704106.db2.gz KBJVBPRIJYXWCB-MRXNPFEDSA-N 1 1 354.410 2.645 20 5 FFBDMO CC[N@H+]1CCC[C@H]1Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1 ZINC001296059325 1050017867 /nfs/dbraw/zinc/01/78/67/1050017867.db2.gz CHFNVKAPGGSXCX-KRWDZBQOSA-N 1 1 370.457 2.936 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC001340800038 1051145052 /nfs/dbraw/zinc/14/50/52/1051145052.db2.gz ALXNUBXNBZAHPO-DGCLKSJQSA-N 1 1 353.444 2.758 20 5 FFBDMO C[C@H](NC(=O)[C@]1([NH+](C)C)COc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC001303552582 1051385003 /nfs/dbraw/zinc/38/50/03/1051385003.db2.gz KHSHATNSWDLZSO-VBKZILBWSA-N 1 1 369.421 2.708 20 5 FFBDMO CC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001308029727 1052387482 /nfs/dbraw/zinc/38/74/82/1052387482.db2.gz RGVKJISEVIKUPT-GOSISDBHSA-N 1 1 358.394 2.937 20 5 FFBDMO CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001308029727 1052387487 /nfs/dbraw/zinc/38/74/87/1052387487.db2.gz RGVKJISEVIKUPT-GOSISDBHSA-N 1 1 358.394 2.937 20 5 FFBDMO CC(C)C[C@H](C)C[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC001308653484 1052482752 /nfs/dbraw/zinc/48/27/52/1052482752.db2.gz CYOYQTDRLHVULG-HNNXBMFYSA-N 1 1 369.487 2.583 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348234064 1054562351 /nfs/dbraw/zinc/56/23/51/1054562351.db2.gz HXBKELQCFZILDD-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348234064 1054562360 /nfs/dbraw/zinc/56/23/60/1054562360.db2.gz HXBKELQCFZILDD-QRWLVFNGSA-N 1 1 369.421 2.905 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@H+](C)CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470095 1054720243 /nfs/dbraw/zinc/72/02/43/1054720243.db2.gz JIDMMAXCIMVRBC-UNEWFSDZSA-N 1 1 365.455 2.705 20 5 FFBDMO CS[C@@H]1CC[C@@H]([N@@H+](C)CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001348470095 1054720257 /nfs/dbraw/zinc/72/02/57/1054720257.db2.gz JIDMMAXCIMVRBC-UNEWFSDZSA-N 1 1 365.455 2.705 20 5 FFBDMO COC(=O)/C=C\c1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)o1 ZINC000848882622 1055297064 /nfs/dbraw/zinc/29/70/64/1055297064.db2.gz VZZYUPFAUVEENN-FPLPWBNLSA-N 1 1 371.393 2.696 20 5 FFBDMO C[N@H+]1C[C@@]23CN(c4ncnc5ccc([N+](=O)[O-])cc54)C[C@]2(C1)CCCC3 ZINC001338201334 1055316506 /nfs/dbraw/zinc/31/65/06/1055316506.db2.gz UPYPAAIXIGFSCO-KDURUIRLSA-N 1 1 353.426 2.850 20 5 FFBDMO C[NH+](C)C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001338447962 1055523132 /nfs/dbraw/zinc/52/31/32/1055523132.db2.gz GDFQTPRJGMYKBX-QGZVFWFLSA-N 1 1 374.416 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@H](C[NH+]2CCOCC2)C1 ZINC001356499290 1055538860 /nfs/dbraw/zinc/53/88/60/1055538860.db2.gz PKQKZYJYDUXMGK-GFCCVEGCSA-N 1 1 359.348 2.772 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000538096319 1056796062 /nfs/dbraw/zinc/79/60/62/1056796062.db2.gz BLEGVECDXVMQOJ-ZFWWWQNUSA-N 1 1 352.398 2.885 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC000538096313 1056796166 /nfs/dbraw/zinc/79/61/66/1056796166.db2.gz BLEGVECDXVMQOJ-DZGCQCFKSA-N 1 1 352.398 2.885 20 5 FFBDMO C[C@@H](CCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)[N@@H+](C)Cc1ccccc1 ZINC001545281174 1071756825 /nfs/dbraw/zinc/75/68/25/1071756825.db2.gz LAEUOANFDIZWGP-NSHDSACASA-N 1 1 365.821 2.612 20 5 FFBDMO CC(C)(C(=O)Nc1cccc2c1C[N@H+](C1CC1)C2)n1cc([N+](=O)[O-])cn1 ZINC001447233526 1058613643 /nfs/dbraw/zinc/61/36/43/1058613643.db2.gz SZTIJJPTGDKMBW-UHFFFAOYSA-N 1 1 355.398 2.643 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC001447426810 1058642140 /nfs/dbraw/zinc/64/21/40/1058642140.db2.gz JBYIYKGJVQYCTI-OAHLLOKOSA-N 1 1 371.441 2.598 20 5 FFBDMO CC[N@@H+](CCn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1)C(C)C ZINC001515719065 1059759005 /nfs/dbraw/zinc/75/90/05/1059759005.db2.gz SALHIJHWFBVHNU-UHFFFAOYSA-N 1 1 374.489 2.904 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1CN1CC[C@@H](c3ccc([N+](=O)[O-])cc3)C1=O)CCOCC2 ZINC000848489103 1060144030 /nfs/dbraw/zinc/14/40/30/1060144030.db2.gz JCZROMWSYNDSHK-YJBOKZPZSA-N 1 1 373.453 2.759 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC001458239182 1060547762 /nfs/dbraw/zinc/54/77/62/1060547762.db2.gz NCHDSTUFJRADAP-IRXDYDNUSA-N 1 1 355.442 2.819 20 5 FFBDMO Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1nc3ccccc3cc1[N+](=O)[O-])C2 ZINC001458467217 1060597143 /nfs/dbraw/zinc/59/71/43/1060597143.db2.gz GJZQHLVMNFJCLZ-CQSZACIVSA-N 1 1 367.409 2.610 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC001460371104 1060979860 /nfs/dbraw/zinc/97/98/60/1060979860.db2.gz VSNNUBZNDIHQOJ-RBUKOAKNSA-N 1 1 370.405 2.862 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2c2ncccn2)cccc1[N+](=O)[O-] ZINC001460462149 1060998641 /nfs/dbraw/zinc/99/86/41/1060998641.db2.gz CIONIMKDGPHMOG-MRXNPFEDSA-N 1 1 355.398 2.859 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2ncccn2)cccc1[N+](=O)[O-] ZINC001460462149 1060998660 /nfs/dbraw/zinc/99/86/60/1060998660.db2.gz CIONIMKDGPHMOG-MRXNPFEDSA-N 1 1 355.398 2.859 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001460602333 1061027342 /nfs/dbraw/zinc/02/73/42/1061027342.db2.gz AFOQLRRWBKNWFY-XNRPHZJLSA-N 1 1 365.430 2.616 20 5 FFBDMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C[C@H]1C[C@@H](O)C1 ZINC001460620565 1061033735 /nfs/dbraw/zinc/03/37/35/1061033735.db2.gz MSIIEUYJANDMIE-JGZJWPJOSA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cccc2c1OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC001460622870 1061036132 /nfs/dbraw/zinc/03/61/32/1061036132.db2.gz YJKKNGWFVQJOCN-INIZCTEOSA-N 1 1 366.320 2.914 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCS(=O)(=O)CC3CC3)o2)c1 ZINC001461287377 1061281275 /nfs/dbraw/zinc/28/12/75/1061281275.db2.gz SSFLREFBADBWDF-UHFFFAOYSA-N 1 1 364.423 2.769 20 5 FFBDMO CC[N@H+]1CC[C@H]1CNC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1C ZINC001476520640 1061426609 /nfs/dbraw/zinc/42/66/09/1061426609.db2.gz DDJPHNYNPVRNPM-NSHDSACASA-N 1 1 371.235 2.881 20 5 FFBDMO O=C(Nc1nccc2cc([N+](=O)[O-])ccc21)c1cnn(-c2cc[nH+]cc2)c1 ZINC001528131905 1061767995 /nfs/dbraw/zinc/76/79/95/1061767995.db2.gz XJUQROIGQOSCQH-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC001530919679 1062663144 /nfs/dbraw/zinc/66/31/44/1062663144.db2.gz WECKVMXMABBESE-FNUUXAGOSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC001530919679 1062663153 /nfs/dbraw/zinc/66/31/53/1062663153.db2.gz WECKVMXMABBESE-FNUUXAGOSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC001530919681 1062663781 /nfs/dbraw/zinc/66/37/81/1062663781.db2.gz WECKVMXMABBESE-RGFVMQALSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC001530919681 1062663792 /nfs/dbraw/zinc/66/37/92/1062663792.db2.gz WECKVMXMABBESE-RGFVMQALSA-N 1 1 365.433 2.993 20 5 FFBDMO COc1ccc(CNC(=O)[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC001472493493 1065080136 /nfs/dbraw/zinc/08/01/36/1065080136.db2.gz ANLOAFIRXSIQGM-LPHOPBHVSA-N 1 1 369.421 2.913 20 5 FFBDMO Cc1nc(C)c(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)[nH]1 ZINC001473363708 1065248786 /nfs/dbraw/zinc/24/87/86/1065248786.db2.gz DHPWKAOLANCUPN-UHFFFAOYSA-N 1 1 369.429 2.523 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC001473416819 1065258412 /nfs/dbraw/zinc/25/84/12/1065258412.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC001473416819 1065258425 /nfs/dbraw/zinc/25/84/25/1065258425.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC001473416819 1065258438 /nfs/dbraw/zinc/25/84/38/1065258438.db2.gz VIOLRXNMFWDQAT-NRFANRHFSA-N 1 1 369.465 2.706 20 5 FFBDMO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])CCO2 ZINC001474422118 1065518543 /nfs/dbraw/zinc/51/85/43/1065518543.db2.gz QXUHEHPKVKQKIK-AWEZNQCLSA-N 1 1 360.366 2.931 20 5 FFBDMO COc1c(O)ccc(C[NH2+][C@@H](CO)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC001474653064 1065571831 /nfs/dbraw/zinc/57/18/31/1065571831.db2.gz YMTONJSEXMNYHJ-ZDUSSCGKSA-N 1 1 352.774 2.786 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CC[N@@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938750 1079406662 /nfs/dbraw/zinc/40/66/62/1079406662.db2.gz NWNLDZDCWCZDDH-HIFRSBDPSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938750 1079406664 /nfs/dbraw/zinc/40/66/64/1079406664.db2.gz NWNLDZDCWCZDDH-HIFRSBDPSA-N 1 1 369.425 2.597 20 5 FFBDMO C[N@@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC001557275314 1075831923 /nfs/dbraw/zinc/83/19/23/1075831923.db2.gz DVWMMEMJEKLXIR-OAHLLOKOSA-N 1 1 351.472 2.876 20 5 FFBDMO C[N@H+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC001557275314 1075831925 /nfs/dbraw/zinc/83/19/25/1075831925.db2.gz DVWMMEMJEKLXIR-OAHLLOKOSA-N 1 1 351.472 2.876 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C(C)(C)C1 ZINC001558504667 1076020186 /nfs/dbraw/zinc/02/01/86/1076020186.db2.gz SYZMVPBLMWIWBZ-OAHLLOKOSA-N 1 1 354.410 2.727 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001558998944 1076112360 /nfs/dbraw/zinc/11/23/60/1076112360.db2.gz VMPMZXZZPMSJMB-LBPRGKRZSA-N 1 1 351.834 2.876 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC001559127515 1076128054 /nfs/dbraw/zinc/12/80/54/1076128054.db2.gz NMUOJEYICKCKND-UHFFFAOYSA-N 1 1 362.405 2.829 20 5 FFBDMO O=[N+]([O-])c1ccc2ncc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3C3CCCC3)c2c1 ZINC001559252111 1076139735 /nfs/dbraw/zinc/13/97/35/1076139735.db2.gz TXJZCXHRMLULFD-CQSZACIVSA-N 1 1 371.397 2.902 20 5 FFBDMO CCc1cc(N2CC[N@H+]3C[C@@H](F)C[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559295841 1076147299 /nfs/dbraw/zinc/14/72/99/1076147299.db2.gz PSIPTZBEXKYWBB-YOEHRIQHSA-N 1 1 371.416 2.847 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1c1ncccn1 ZINC001560014324 1076213425 /nfs/dbraw/zinc/21/34/25/1076213425.db2.gz PIJKDYVFKUHQJK-OAHLLOKOSA-N 1 1 371.397 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ncccn1 ZINC001560014324 1076213429 /nfs/dbraw/zinc/21/34/29/1076213429.db2.gz PIJKDYVFKUHQJK-OAHLLOKOSA-N 1 1 371.397 2.559 20 5 FFBDMO Cc1cccc(C[C@@]2(C)CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC001560040537 1076216541 /nfs/dbraw/zinc/21/65/41/1076216541.db2.gz SXXRILBUSUTIAY-RBUKOAKNSA-N 1 1 358.442 2.558 20 5 FFBDMO Cn1cc([C@H]2CCC[N@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)nn1 ZINC001560217731 1076249140 /nfs/dbraw/zinc/24/91/40/1076249140.db2.gz NIFBFNOUOYCHDY-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1cc([C@H]2CCC[N@@H+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C2)nn1 ZINC001560217731 1076249145 /nfs/dbraw/zinc/24/91/45/1076249145.db2.gz NIFBFNOUOYCHDY-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOC[C@@H]1CCOC1 ZINC001560312855 1076263129 /nfs/dbraw/zinc/26/31/29/1076263129.db2.gz WQXQUTKCJBDJRE-LLVKDONJSA-N 1 1 359.220 2.500 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1cc2ccccc2s1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001570197017 1077189064 /nfs/dbraw/zinc/18/90/64/1077189064.db2.gz UPZZSZOFJATMEP-HZPDHXFCSA-N 1 1 361.467 2.847 20 5 FFBDMO CN(CCC[N@H+](C)Cc1cc2ccccc2s1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570197017 1077189066 /nfs/dbraw/zinc/18/90/66/1077189066.db2.gz UPZZSZOFJATMEP-HZPDHXFCSA-N 1 1 361.467 2.847 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1cc2ccccc2s1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570197017 1077189068 /nfs/dbraw/zinc/18/90/68/1077189068.db2.gz UPZZSZOFJATMEP-HZPDHXFCSA-N 1 1 361.467 2.847 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001590259595 1081128660 /nfs/dbraw/zinc/12/86/60/1081128660.db2.gz LJFADHBLXFYPRM-CYBMUJFWSA-N 1 1 359.434 2.699 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000152832496 251073019 /nfs/dbraw/zinc/07/30/19/251073019.db2.gz GPCZJRLWTJWWRA-CMPLNLGQSA-N 1 1 360.357 2.940 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153335012 251126117 /nfs/dbraw/zinc/12/61/17/251126117.db2.gz MUWAPVRAXUHACS-RDJZCZTQSA-N 1 1 373.453 2.839 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000162882464 251157614 /nfs/dbraw/zinc/15/76/14/251157614.db2.gz ZSCHVHCIHDTMEU-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO CCC[N@@H+](C)[C@@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000285767826 257003536 /nfs/dbraw/zinc/00/35/36/257003536.db2.gz AASSRKZJTBVYLQ-ZDUSSCGKSA-N 1 1 365.821 2.784 20 5 FFBDMO CCC[N@@H+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000285767826 257003538 /nfs/dbraw/zinc/00/35/38/257003538.db2.gz AASSRKZJTBVYLQ-ZDUSSCGKSA-N 1 1 365.821 2.784 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000278365686 256304741 /nfs/dbraw/zinc/30/47/41/256304741.db2.gz FUSMTUZQBDMXCC-ZDUSSCGKSA-N 1 1 373.409 2.666 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000278322106 256299804 /nfs/dbraw/zinc/29/98/04/256299804.db2.gz AIDRXABLIJKQFZ-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000279215378 256394160 /nfs/dbraw/zinc/39/41/60/256394160.db2.gz OLXHLXXYTSGEGX-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO O=c1[nH]c(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)nc2ccc([N+](=O)[O-])cc21 ZINC000286290901 257029668 /nfs/dbraw/zinc/02/96/68/257029668.db2.gz RXPLBPGCTVARNC-SJKOYZFVSA-N 1 1 369.425 2.697 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000286597346 257044929 /nfs/dbraw/zinc/04/49/29/257044929.db2.gz QWENXVPZSBEMTG-JCNUMZABSA-N 1 1 359.426 2.587 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000289419094 257280012 /nfs/dbraw/zinc/28/00/12/257280012.db2.gz BSYLRKKCMAFFKJ-SJLPKXTDSA-N 1 1 359.426 2.957 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC=C(c2cccnc2)C1 ZINC000289267229 257270656 /nfs/dbraw/zinc/27/06/56/257270656.db2.gz DPLLVJQHAWRFNC-QGZVFWFLSA-N 1 1 355.394 2.519 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)[C@@H](C)C1 ZINC000289875171 257303916 /nfs/dbraw/zinc/30/39/16/257303916.db2.gz NYSWEUUKDGENEO-BBRMVZONSA-N 1 1 358.446 2.557 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](n3cccn3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000291351701 257399464 /nfs/dbraw/zinc/39/94/64/257399464.db2.gz XGOGSPKMRNAGCR-KRWDZBQOSA-N 1 1 352.398 2.639 20 5 FFBDMO Cc1cccc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1F ZINC000294942290 257609381 /nfs/dbraw/zinc/60/93/81/257609381.db2.gz CSQNVXFQVKRGRW-UHFFFAOYSA-N 1 1 352.387 2.606 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000301108008 258026411 /nfs/dbraw/zinc/02/64/11/258026411.db2.gz NEXABIYUCIFOCJ-UHFFFAOYSA-N 1 1 368.437 2.667 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000301116403 258026683 /nfs/dbraw/zinc/02/66/83/258026683.db2.gz PVVIZTYSMWCOHV-OAHLLOKOSA-N 1 1 360.458 2.975 20 5 FFBDMO Cc1nn(C)c(Nc2ccc(N3CC[NH+](C)CC3)c(Cl)c2)c1[N+](=O)[O-] ZINC000301290590 258040109 /nfs/dbraw/zinc/04/01/09/258040109.db2.gz QBOGFUCGZMMBLA-UHFFFAOYSA-N 1 1 364.837 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1N1CC[NH+](Cc3cccc(O)c3)CC1)CCN2 ZINC000302401859 258100657 /nfs/dbraw/zinc/10/06/57/258100657.db2.gz FBYYMEMXQWKGLF-UHFFFAOYSA-N 1 1 354.410 2.591 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302759781 258109974 /nfs/dbraw/zinc/10/99/74/258109974.db2.gz JVBCLTNEWWLPIJ-MRXNPFEDSA-N 1 1 370.409 2.853 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301856293 258071278 /nfs/dbraw/zinc/07/12/78/258071278.db2.gz CEGWMLRQGDFASF-AWEZNQCLSA-N 1 1 369.487 2.778 20 5 FFBDMO CS(=O)(=O)c1cccc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-] ZINC000301866932 258071505 /nfs/dbraw/zinc/07/15/05/258071505.db2.gz GDUFMSDBQBRAQW-CQSZACIVSA-N 1 1 367.471 2.675 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000331973202 258208296 /nfs/dbraw/zinc/20/82/96/258208296.db2.gz SROKMVAHTWEEME-MRXNPFEDSA-N 1 1 360.458 2.799 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1C[C@@H]2CC[C@H](O)C[C@H]2C1 ZINC000332238932 258220746 /nfs/dbraw/zinc/22/07/46/258220746.db2.gz OOBSNOVTJSRJRT-JKOKRWQUSA-N 1 1 355.232 2.950 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000332248825 258221000 /nfs/dbraw/zinc/22/10/00/258221000.db2.gz BUDPSXYMUQWPIL-IYBDPMFKSA-N 1 1 364.465 2.724 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000332465399 258231428 /nfs/dbraw/zinc/23/14/28/258231428.db2.gz ISJOMPUJCRECGY-GXTWGEPZSA-N 1 1 366.849 2.745 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000064965210 506246204 /nfs/dbraw/zinc/24/62/04/506246204.db2.gz MPDNDDHQPGPPLQ-ZDUSSCGKSA-N 1 1 369.487 2.692 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)cc2)C1 ZINC000053191144 506331000 /nfs/dbraw/zinc/33/10/00/506331000.db2.gz BLDOQYVQWJCUPD-AWEZNQCLSA-N 1 1 357.414 2.662 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000377262654 512190564 /nfs/dbraw/zinc/19/05/64/512190564.db2.gz QGMFMQPBXYAPGZ-CQSZACIVSA-N 1 1 368.397 2.758 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)CC1 ZINC000377321154 512215169 /nfs/dbraw/zinc/21/51/69/512215169.db2.gz JYTYTMGKNJWTJL-UHFFFAOYSA-N 1 1 373.369 2.794 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000065872313 506383989 /nfs/dbraw/zinc/38/39/89/506383989.db2.gz UYDGDJGCSFTZBS-UHFFFAOYSA-N 1 1 352.354 2.535 20 5 FFBDMO Cc1c(C(=O)NCC2([NH+]3CCOCC3)CCCCC2)cccc1[N+](=O)[O-] ZINC000036329970 506401308 /nfs/dbraw/zinc/40/13/08/506401308.db2.gz AKMLPAIMLARAJO-UHFFFAOYSA-N 1 1 361.442 2.668 20 5 FFBDMO Cc1ccc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000053666654 506424242 /nfs/dbraw/zinc/42/42/42/506424242.db2.gz NLHGYJGYLVORJK-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CCC[N@@H+]1Cc2cccc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)c2C1 ZINC000066513924 506544134 /nfs/dbraw/zinc/54/41/34/506544134.db2.gz CDTYGDANWFWWBT-UHFFFAOYSA-N 1 1 357.414 2.854 20 5 FFBDMO CCC[N@H+]1Cc2cccc(NC(=O)CCn3cc([N+](=O)[O-])nc3C)c2C1 ZINC000066513924 506544137 /nfs/dbraw/zinc/54/41/37/506544137.db2.gz CDTYGDANWFWWBT-UHFFFAOYSA-N 1 1 357.414 2.854 20 5 FFBDMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@H](C)O1 ZINC000041865248 506561810 /nfs/dbraw/zinc/56/18/10/506561810.db2.gz KEEMMTXRWUEQJR-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@H](C)O1 ZINC000041865248 506561817 /nfs/dbraw/zinc/56/18/17/506561817.db2.gz KEEMMTXRWUEQJR-BETUJISGSA-N 1 1 374.441 2.694 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCc1ccc(F)cc1 ZINC000055022833 506661016 /nfs/dbraw/zinc/66/10/16/506661016.db2.gz BTIKHJLYRNSKHP-UHFFFAOYSA-N 1 1 361.373 2.856 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCc1ccc(F)cc1 ZINC000055022833 506661021 /nfs/dbraw/zinc/66/10/21/506661021.db2.gz BTIKHJLYRNSKHP-UHFFFAOYSA-N 1 1 361.373 2.856 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])CC1 ZINC000066924707 506696378 /nfs/dbraw/zinc/69/63/78/506696378.db2.gz KLBGXWAPTMSGAI-UHFFFAOYSA-N 1 1 360.458 2.655 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000043149466 506709363 /nfs/dbraw/zinc/70/93/63/506709363.db2.gz DHUKRCGCIJMSRR-OKILXGFUSA-N 1 1 350.419 2.524 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000055402220 506742810 /nfs/dbraw/zinc/74/28/10/506742810.db2.gz XWTVORWYCAUNKQ-LSDHHAIUSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CNC(=O)C1 ZINC000367027750 512302565 /nfs/dbraw/zinc/30/25/65/512302565.db2.gz GURUJLDDOZSQFH-WMLDXEAASA-N 1 1 361.442 2.873 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000056519607 507035254 /nfs/dbraw/zinc/03/52/54/507035254.db2.gz ZNYXUAWRUPAZGT-CHWSQXEVSA-N 1 1 350.419 2.845 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC000056681112 507069697 /nfs/dbraw/zinc/06/96/97/507069697.db2.gz IJOWVFIKZYNQLA-UHFFFAOYSA-N 1 1 364.405 2.864 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1 ZINC000016222736 507079091 /nfs/dbraw/zinc/07/90/91/507079091.db2.gz XHTQIBCDDYQOCV-MRXNPFEDSA-N 1 1 369.421 2.879 20 5 FFBDMO C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085441 507104949 /nfs/dbraw/zinc/10/49/49/507104949.db2.gz OXWAEQIICRSNFG-KBPBESRZSA-N 1 1 373.457 2.959 20 5 FFBDMO C[C@H](CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000068195858 507143987 /nfs/dbraw/zinc/14/39/87/507143987.db2.gz VDDVPDOWMFPUOC-GHMZBOCLSA-N 1 1 355.822 2.614 20 5 FFBDMO C[C@@H](NC(=O)NCC[NH+]1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000068406626 507220397 /nfs/dbraw/zinc/22/03/97/507220397.db2.gz DBTFIWHCUYKMOX-CQSZACIVSA-N 1 1 354.410 2.971 20 5 FFBDMO Cc1c(C[N@@H+](C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000057843599 507339266 /nfs/dbraw/zinc/33/92/66/507339266.db2.gz SHSLSWGJUWNVTK-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1c(C[N@H+](C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000057843599 507339272 /nfs/dbraw/zinc/33/92/72/507339272.db2.gz SHSLSWGJUWNVTK-ZDUSSCGKSA-N 1 1 363.439 2.744 20 5 FFBDMO O=C(NC1CC1)[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000068951193 507368873 /nfs/dbraw/zinc/36/88/73/507368873.db2.gz OOGPVDWNTCEWAJ-GOSISDBHSA-N 1 1 373.384 2.722 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000373444373 512334980 /nfs/dbraw/zinc/33/49/80/512334980.db2.gz VVOBICGTSHSBLY-HDICACEKSA-N 1 1 351.406 2.799 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000069045074 507389712 /nfs/dbraw/zinc/38/97/12/507389712.db2.gz GQVFQIRSHVJVGU-AWEZNQCLSA-N 1 1 351.472 2.924 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000025402689 507496458 /nfs/dbraw/zinc/49/64/58/507496458.db2.gz XEZHKUSYRUCQCR-MRXNPFEDSA-N 1 1 369.421 2.879 20 5 FFBDMO C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000026729824 507605701 /nfs/dbraw/zinc/60/57/01/507605701.db2.gz XHEPSXYRCZCZDP-CYBMUJFWSA-N 1 1 354.410 2.552 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000051377121 507765292 /nfs/dbraw/zinc/76/52/92/507765292.db2.gz IWRAMYLFKQUGGL-ZDUSSCGKSA-N 1 1 360.439 2.932 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000051380780 507766439 /nfs/dbraw/zinc/76/64/39/507766439.db2.gz JWDVMLKHTGLNLA-LBPRGKRZSA-N 1 1 358.423 2.685 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000072758951 507849924 /nfs/dbraw/zinc/84/99/24/507849924.db2.gz ROSABGVFFJKBRH-CRAIPNDOSA-N 1 1 360.458 2.506 20 5 FFBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000090519227 507925318 /nfs/dbraw/zinc/92/53/18/507925318.db2.gz JGWBYNMFYPHNPC-UHFFFAOYSA-N 1 1 360.370 2.575 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCCO)CC(C)(C)C ZINC000109747814 507984260 /nfs/dbraw/zinc/98/42/60/507984260.db2.gz PMTLTLYTWSIYPT-UHFFFAOYSA-N 1 1 351.447 2.962 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000109852442 507992194 /nfs/dbraw/zinc/99/21/94/507992194.db2.gz LTURZQSVKMNCCK-OAHLLOKOSA-N 1 1 355.460 2.528 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)cc1 ZINC000091629122 507997899 /nfs/dbraw/zinc/99/78/99/507997899.db2.gz XVIMBUMUGGURQE-AWEZNQCLSA-N 1 1 357.414 2.780 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](C)C2CCN(S(C)(=O)=O)CC2)cc1[N+](=O)[O-] ZINC000091963886 508028518 /nfs/dbraw/zinc/02/85/18/508028518.db2.gz HAVSWLGEGVWOQH-UHFFFAOYSA-N 1 1 369.487 2.574 20 5 FFBDMO COc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(OC)c1 ZINC000092047756 508037957 /nfs/dbraw/zinc/03/79/57/508037957.db2.gz MIKZHUADKIENNW-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000092532078 508079887 /nfs/dbraw/zinc/07/98/87/508079887.db2.gz DCEJAAPUTYHKOO-UHFFFAOYSA-N 1 1 372.425 2.913 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(n3ccnc3)CC2)cccc1[N+](=O)[O-] ZINC000111243940 508081685 /nfs/dbraw/zinc/08/16/85/508081685.db2.gz WCWSZLXLCWMESX-AWEZNQCLSA-N 1 1 357.414 2.764 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000080708013 508096225 /nfs/dbraw/zinc/09/62/25/508096225.db2.gz KHQFQYLKAUKBHJ-INIZCTEOSA-N 1 1 360.458 2.511 20 5 FFBDMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000081095873 508136474 /nfs/dbraw/zinc/13/64/74/508136474.db2.gz QZEDUSYWWSDMSM-CRAIPNDOSA-N 1 1 362.474 2.894 20 5 FFBDMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1 ZINC000081095873 508136477 /nfs/dbraw/zinc/13/64/77/508136477.db2.gz QZEDUSYWWSDMSM-CRAIPNDOSA-N 1 1 362.474 2.894 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000081122697 508139913 /nfs/dbraw/zinc/13/99/13/508139913.db2.gz FTMSLEFOMZOKEP-SFHVURJKSA-N 1 1 353.422 2.870 20 5 FFBDMO Cc1ccc2ncc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2c1 ZINC000093534931 508148525 /nfs/dbraw/zinc/14/85/25/508148525.db2.gz ZCCDSBJZNFREOQ-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1ccc2ncc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)n2c1 ZINC000093534931 508148527 /nfs/dbraw/zinc/14/85/27/508148527.db2.gz ZCCDSBJZNFREOQ-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1cccc([C@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1C ZINC000075999874 508150176 /nfs/dbraw/zinc/15/01/76/508150176.db2.gz CDZSQJOJSNPEKF-PKOBYXMFSA-N 1 1 358.442 2.996 20 5 FFBDMO CCc1nn(C)c(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000094155359 508170984 /nfs/dbraw/zinc/17/09/84/508170984.db2.gz XCNOAMIREJTZDV-INIZCTEOSA-N 1 1 357.458 2.867 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OC[C@H]4CCCO4)CC3)nc2c1 ZINC000083412517 508244400 /nfs/dbraw/zinc/24/44/00/508244400.db2.gz VWQYUQVYPZGIAZ-OAHLLOKOSA-N 1 1 361.398 2.896 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000076757174 508251371 /nfs/dbraw/zinc/25/13/71/508251371.db2.gz PEFMUNWZNDACBX-AEFFLSMTSA-N 1 1 357.410 2.521 20 5 FFBDMO COc1cc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000113268061 508256078 /nfs/dbraw/zinc/25/60/78/508256078.db2.gz MHGPJHSWEVKVNP-WCQYABFASA-N 1 1 371.384 2.873 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1C ZINC000103145467 508298682 /nfs/dbraw/zinc/29/86/82/508298682.db2.gz LXIXPUURPGCXNN-UHFFFAOYSA-N 1 1 373.409 2.991 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1C ZINC000103145467 508298685 /nfs/dbraw/zinc/29/86/85/508298685.db2.gz LXIXPUURPGCXNN-UHFFFAOYSA-N 1 1 373.409 2.991 20 5 FFBDMO COc1ccc(C[N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1C ZINC000103144681 508298877 /nfs/dbraw/zinc/29/88/77/508298877.db2.gz WPZJVILKQTXOKW-UHFFFAOYSA-N 1 1 369.421 2.933 20 5 FFBDMO COc1ccc(C[N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1C ZINC000103144681 508298879 /nfs/dbraw/zinc/29/88/79/508298879.db2.gz WPZJVILKQTXOKW-UHFFFAOYSA-N 1 1 369.421 2.933 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCC[C@H](C)C1 ZINC000087103058 508336967 /nfs/dbraw/zinc/33/69/67/508336967.db2.gz UTXNTDQZZXHQOK-GJZGRUSLSA-N 1 1 360.458 2.783 20 5 FFBDMO COc1cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1O ZINC000156908083 508495530 /nfs/dbraw/zinc/49/55/30/508495530.db2.gz CDEVTRXQSXWARD-UHFFFAOYSA-N 1 1 359.382 2.770 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000157071423 508518713 /nfs/dbraw/zinc/51/87/13/508518713.db2.gz DKAKDNPOTBOWCM-HNNXBMFYSA-N 1 1 354.410 2.670 20 5 FFBDMO NC(=O)[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000157174844 508532981 /nfs/dbraw/zinc/53/29/81/508532981.db2.gz RHTWXPAMMXBTEK-ZDUSSCGKSA-N 1 1 359.357 2.833 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153243585 508562814 /nfs/dbraw/zinc/56/28/14/508562814.db2.gz JACNQKBOYUAHOC-UHFFFAOYSA-N 1 1 365.389 2.639 20 5 FFBDMO O=C1c2ccccc2C(=O)N1CCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000153243585 508562816 /nfs/dbraw/zinc/56/28/16/508562816.db2.gz JACNQKBOYUAHOC-UHFFFAOYSA-N 1 1 365.389 2.639 20 5 FFBDMO CC(C)C[C@H]1COCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341925 508593525 /nfs/dbraw/zinc/59/35/25/508593525.db2.gz LXYFNCNGZHTBRU-HNNXBMFYSA-N 1 1 363.414 2.640 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000123032215 508624818 /nfs/dbraw/zinc/62/48/18/508624818.db2.gz YKTCJNFMMZQPHB-UHFFFAOYSA-N 1 1 358.398 2.857 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2[nH]nc(CCC)c2[N+](=O)[O-])CC1 ZINC000117985537 508626308 /nfs/dbraw/zinc/62/63/08/508626308.db2.gz BUPPPAZQARBBJO-UHFFFAOYSA-N 1 1 365.478 2.855 20 5 FFBDMO CCCC[N@H+](C)CC1CCN(C(=O)c2n[nH]c(CCC)c2[N+](=O)[O-])CC1 ZINC000117985537 508626313 /nfs/dbraw/zinc/62/63/13/508626313.db2.gz BUPPPAZQARBBJO-UHFFFAOYSA-N 1 1 365.478 2.855 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2n[nH]c(CCC)c2[N+](=O)[O-])CC1 ZINC000117985537 508626319 /nfs/dbraw/zinc/62/63/19/508626319.db2.gz BUPPPAZQARBBJO-UHFFFAOYSA-N 1 1 365.478 2.855 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128687341 508629204 /nfs/dbraw/zinc/62/92/04/508629204.db2.gz PANLCJGDJSBBKI-HOTGVXAUSA-N 1 1 353.394 2.688 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000123199435 508650900 /nfs/dbraw/zinc/65/09/00/508650900.db2.gz UHUBGROLADNFKN-YPMHNXCESA-N 1 1 354.838 2.601 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1SC ZINC000123207123 508652124 /nfs/dbraw/zinc/65/21/24/508652124.db2.gz SLUFCUOHQUGOLZ-NEPJUHHUSA-N 1 1 367.471 2.880 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000153828107 508657023 /nfs/dbraw/zinc/65/70/23/508657023.db2.gz QIDQXGDNUYHJER-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000123755704 508734003 /nfs/dbraw/zinc/73/40/03/508734003.db2.gz QLEGXODGZWGYRI-HNNXBMFYSA-N 1 1 358.398 2.710 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc([N+](=O)[O-])o1 ZINC000123755464 508734436 /nfs/dbraw/zinc/73/44/36/508734436.db2.gz QLEGXODGZWGYRI-OAHLLOKOSA-N 1 1 358.398 2.710 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158766164 508749758 /nfs/dbraw/zinc/74/97/58/508749758.db2.gz OREVCKWDCRPQIU-NSHDSACASA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158766164 508749761 /nfs/dbraw/zinc/74/97/61/508749761.db2.gz OREVCKWDCRPQIU-NSHDSACASA-N 1 1 364.320 2.501 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137431619 508756098 /nfs/dbraw/zinc/75/60/98/508756098.db2.gz YVMAOMFZVKPBQA-WFASDCNBSA-N 1 1 372.400 2.709 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1 ZINC000137449004 508756335 /nfs/dbraw/zinc/75/63/35/508756335.db2.gz NUKCPRRANSFZRA-GOEBONIOSA-N 1 1 369.421 2.996 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000158995337 508778794 /nfs/dbraw/zinc/77/87/94/508778794.db2.gz ZTAXNAQGPNYNKP-PMACEKPBSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000158995337 508778796 /nfs/dbraw/zinc/77/87/96/508778796.db2.gz ZTAXNAQGPNYNKP-PMACEKPBSA-N 1 1 354.406 2.802 20 5 FFBDMO O=C(NCc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000124322323 508815097 /nfs/dbraw/zinc/81/50/97/508815097.db2.gz LFHSQGZGOXFUBT-RDJZCZTQSA-N 1 1 358.442 2.753 20 5 FFBDMO C[NH+](C)[C@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000144694986 508839928 /nfs/dbraw/zinc/83/99/28/508839928.db2.gz KFRVMFIXSNENNV-IBGZPJMESA-N 1 1 368.437 2.546 20 5 FFBDMO Cc1ccc([C@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)[NH+](C)C)cc1 ZINC000130921733 508866009 /nfs/dbraw/zinc/86/60/09/508866009.db2.gz VRVYZOCYDIQTNL-ZDUSSCGKSA-N 1 1 369.468 2.546 20 5 FFBDMO Cc1sc(S(=O)(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC000124828438 508890871 /nfs/dbraw/zinc/89/08/71/508890871.db2.gz GUIMQKBWXHEIED-ZDUSSCGKSA-N 1 1 373.500 2.508 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000155008429 508902603 /nfs/dbraw/zinc/90/26/03/508902603.db2.gz SVOOBCOQHPZHEH-KRWDZBQOSA-N 1 1 354.410 2.770 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]2N1C1CC1 ZINC000120162263 508941389 /nfs/dbraw/zinc/94/13/89/508941389.db2.gz NHYOTLHCQRVBOG-MLGOLLRUSA-N 1 1 370.409 2.711 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]2N1C1CC1 ZINC000120162263 508941392 /nfs/dbraw/zinc/94/13/92/508941392.db2.gz NHYOTLHCQRVBOG-MLGOLLRUSA-N 1 1 370.409 2.711 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000155287782 508967867 /nfs/dbraw/zinc/96/78/67/508967867.db2.gz WGMPRIVJHRMKPO-HRCADAONSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000155287782 508967870 /nfs/dbraw/zinc/96/78/70/508967870.db2.gz WGMPRIVJHRMKPO-HRCADAONSA-N 1 1 374.485 2.996 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCC1CCOCC1 ZINC000120680303 509043951 /nfs/dbraw/zinc/04/39/51/509043951.db2.gz LGUVRZIGKZBVJX-UHFFFAOYSA-N 1 1 365.430 2.681 20 5 FFBDMO O=C(C[N@@H+](Cc1ccccc1)[C@H](CO)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000155902789 509089882 /nfs/dbraw/zinc/08/98/82/509089882.db2.gz MGASSEFYMXFVNH-LJQANCHMSA-N 1 1 369.421 2.806 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000247975481 509205935 /nfs/dbraw/zinc/20/59/35/509205935.db2.gz GIARMDDTWZXIQX-MAUKXSAKSA-N 1 1 355.394 2.779 20 5 FFBDMO COc1cccc(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000185644288 509281376 /nfs/dbraw/zinc/28/13/76/509281376.db2.gz LQSIKEJQBMTIQD-CVEARBPZSA-N 1 1 357.410 2.651 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000248438838 509320437 /nfs/dbraw/zinc/32/04/37/509320437.db2.gz CBWLAQRPRGMQBV-ZWKOTPCHSA-N 1 1 356.422 2.899 20 5 FFBDMO C[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]21 ZINC000248465359 509335423 /nfs/dbraw/zinc/33/54/23/509335423.db2.gz RPKBFNANRJOYEG-KBRIMQKVSA-N 1 1 352.456 2.879 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@@H]2C1 ZINC000182644214 509349293 /nfs/dbraw/zinc/34/92/93/509349293.db2.gz XWOGNNRRSNPCCP-GFCCVEGCSA-N 1 1 355.847 2.647 20 5 FFBDMO C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000192171254 509386818 /nfs/dbraw/zinc/38/68/18/509386818.db2.gz WXYQPMPGNMEHJH-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO CC(C)[N@@H+]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000185858313 509390997 /nfs/dbraw/zinc/39/09/97/509390997.db2.gz FCOBEKFUDLGRNR-NHYWBVRUSA-N 1 1 354.838 2.776 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1SC ZINC000264221704 509392343 /nfs/dbraw/zinc/39/23/43/509392343.db2.gz WBQCHZBPDASGRZ-QWHCGFSZSA-N 1 1 365.455 2.682 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000248635397 509404639 /nfs/dbraw/zinc/40/46/39/509404639.db2.gz KHGUZKPBQCCCEC-WSTZPKSXSA-N 1 1 374.529 2.922 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179511808 509487879 /nfs/dbraw/zinc/48/78/79/509487879.db2.gz QUAHFHGGTSDDRO-CYBMUJFWSA-N 1 1 357.414 2.979 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183029281 509556024 /nfs/dbraw/zinc/55/60/24/509556024.db2.gz CLVYCIKZBKRTBV-KGLIPLIRSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176624032 509616253 /nfs/dbraw/zinc/61/62/53/509616253.db2.gz KPKNCKCWVOJAES-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176624032 509616258 /nfs/dbraw/zinc/61/62/58/509616258.db2.gz KPKNCKCWVOJAES-CQSZACIVSA-N 1 1 354.410 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cn4cc(Cl)ccc4n3)C2)nc1 ZINC000173464513 509617927 /nfs/dbraw/zinc/61/79/27/509617927.db2.gz CFPXJQKKNAPHPY-ZDUSSCGKSA-N 1 1 372.816 2.977 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cn4cc(Cl)ccc4n3)C2)nc1 ZINC000173464513 509617933 /nfs/dbraw/zinc/61/79/33/509617933.db2.gz CFPXJQKKNAPHPY-ZDUSSCGKSA-N 1 1 372.816 2.977 20 5 FFBDMO CC[N@H+](Cc1ccncc1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000267930968 509675918 /nfs/dbraw/zinc/67/59/18/509675918.db2.gz SGTFTBAIUQIWHJ-ZDUSSCGKSA-N 1 1 358.398 2.848 20 5 FFBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000267930968 509675926 /nfs/dbraw/zinc/67/59/26/509675926.db2.gz SGTFTBAIUQIWHJ-ZDUSSCGKSA-N 1 1 358.398 2.848 20 5 FFBDMO COC(=O)c1cnc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000192959762 509716330 /nfs/dbraw/zinc/71/63/30/509716330.db2.gz MVLZUFSIMIZSQI-OAHLLOKOSA-N 1 1 370.409 2.710 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000180115257 509760703 /nfs/dbraw/zinc/76/07/03/509760703.db2.gz GIARMDDTWZXIQX-QAPCUYQASA-N 1 1 355.394 2.779 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000173785034 509775500 /nfs/dbraw/zinc/77/55/00/509775500.db2.gz HBHIEXFGOYSJFH-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176974569 509792240 /nfs/dbraw/zinc/79/22/40/509792240.db2.gz LZDPXTGJQABDJP-MRXNPFEDSA-N 1 1 368.437 2.771 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000268231967 509827814 /nfs/dbraw/zinc/82/78/14/509827814.db2.gz SIUUPBGPXHSAJX-ZANVPECISA-N 1 1 368.231 2.570 20 5 FFBDMO C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000183591438 509875393 /nfs/dbraw/zinc/87/53/93/509875393.db2.gz ZYTVXMIZWPSFHW-CYBMUJFWSA-N 1 1 355.398 2.558 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[N@H+]1C1CC1 ZINC000177172918 509917849 /nfs/dbraw/zinc/91/78/49/509917849.db2.gz YAQPJSDDWLWLIS-ZJUUUORDSA-N 1 1 368.231 2.712 20 5 FFBDMO Cn1cc(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000180452246 509930702 /nfs/dbraw/zinc/93/07/02/509930702.db2.gz IPCRNUDDRXXLIL-IRXDYDNUSA-N 1 1 374.466 2.702 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000245437273 509933869 /nfs/dbraw/zinc/93/38/69/509933869.db2.gz DSEGCQSEGMBDPR-OLZOCXBDSA-N 1 1 368.865 2.849 20 5 FFBDMO CC(C)N(C(=O)[C@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(C)C ZINC000245440586 509936680 /nfs/dbraw/zinc/93/66/80/509936680.db2.gz GPDZTUYYFUHXDI-LSDHHAIUSA-N 1 1 363.462 2.510 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[NH2+]CCS(=O)(=O)c1ccc(Cl)cc1 ZINC000171129009 509958734 /nfs/dbraw/zinc/95/87/34/509958734.db2.gz MHENTFXHXPLGPE-UHFFFAOYSA-N 1 1 354.815 2.812 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000180531191 509969704 /nfs/dbraw/zinc/96/97/04/509969704.db2.gz CHIPZPVINPFHAW-LLVKDONJSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c([N+](=O)[O-])c1 ZINC000193585106 509978451 /nfs/dbraw/zinc/97/84/51/509978451.db2.gz MOGOKJBQMNDMJE-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO COC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193679279 510018007 /nfs/dbraw/zinc/01/80/07/510018007.db2.gz XCZXFKKQXXUFTG-OAHLLOKOSA-N 1 1 363.801 2.824 20 5 FFBDMO CCOc1cccc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000184051088 510105713 /nfs/dbraw/zinc/10/57/13/510105713.db2.gz QCTKHDPAZRQRQR-QGZVFWFLSA-N 1 1 371.437 2.825 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000245751447 510127850 /nfs/dbraw/zinc/12/78/50/510127850.db2.gz GSSYJAFYXRIVIN-KBXCAEBGSA-N 1 1 357.410 2.896 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000245751447 510127856 /nfs/dbraw/zinc/12/78/56/510127856.db2.gz GSSYJAFYXRIVIN-KBXCAEBGSA-N 1 1 357.410 2.896 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](c4cc[nH]n4)C3)o2)cc1 ZINC000193997028 510167158 /nfs/dbraw/zinc/16/71/58/510167158.db2.gz UVGFIWGVQHDWMF-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)o2)cc1 ZINC000193997028 510167164 /nfs/dbraw/zinc/16/71/64/510167164.db2.gz UVGFIWGVQHDWMF-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000184259324 510225123 /nfs/dbraw/zinc/22/51/23/510225123.db2.gz BZPRIWUVWVLTRB-AWEZNQCLSA-N 1 1 369.487 2.525 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1 ZINC000174705570 510262724 /nfs/dbraw/zinc/26/27/24/510262724.db2.gz VNNONRMTHGRSFG-KXBFYZLASA-N 1 1 369.421 2.897 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1 ZINC000174705570 510262733 /nfs/dbraw/zinc/26/27/33/510262733.db2.gz VNNONRMTHGRSFG-KXBFYZLASA-N 1 1 369.421 2.897 20 5 FFBDMO C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184463477 510335808 /nfs/dbraw/zinc/33/58/08/510335808.db2.gz VWGYXBFATYNFND-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+](CCO)CCOCC(F)(F)F ZINC000174860280 510349513 /nfs/dbraw/zinc/34/95/13/510349513.db2.gz LOCMVKNUUOZPRP-UHFFFAOYSA-N 1 1 356.728 2.621 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](CCO)CCOCC(F)(F)F ZINC000174860280 510349521 /nfs/dbraw/zinc/34/95/21/510349521.db2.gz LOCMVKNUUOZPRP-UHFFFAOYSA-N 1 1 356.728 2.621 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000246239040 510383978 /nfs/dbraw/zinc/38/39/78/510383978.db2.gz RKUJBHQCFCHVGZ-LSDHHAIUSA-N 1 1 369.487 2.562 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000174923323 510389044 /nfs/dbraw/zinc/38/90/44/510389044.db2.gz KANWWOQLTABXPM-INIZCTEOSA-N 1 1 368.437 2.771 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCC[C@@H]1O ZINC000181424486 510401950 /nfs/dbraw/zinc/40/19/50/510401950.db2.gz JJWOKJULEMPVBO-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CCCC[C@@H]1O ZINC000181424486 510401958 /nfs/dbraw/zinc/40/19/58/510401958.db2.gz JJWOKJULEMPVBO-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1cc(CN[C@H]2CCC[C@H]([NH+](C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000175012922 510435663 /nfs/dbraw/zinc/43/56/63/510435663.db2.gz ZNDGVASYFSFNGK-WMZOPIPTSA-N 1 1 357.458 2.958 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000246371108 510452708 /nfs/dbraw/zinc/45/27/08/510452708.db2.gz NZZAUIHXTMPWOB-XJKSGUPXSA-N 1 1 374.441 2.620 20 5 FFBDMO C[C@@H](NC(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000181547858 510467097 /nfs/dbraw/zinc/46/70/97/510467097.db2.gz IWEGGORCUWLMNP-HZPDHXFCSA-N 1 1 374.485 2.800 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246424230 510482478 /nfs/dbraw/zinc/48/24/78/510482478.db2.gz JXKKXJSJZSHVDP-GTNSWQLSSA-N 1 1 360.370 2.591 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1cccnc1 ZINC000191240161 510563931 /nfs/dbraw/zinc/56/39/31/510563931.db2.gz FUOHEFVNZGHKIG-UHFFFAOYSA-N 1 1 372.425 2.775 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000184920780 510584573 /nfs/dbraw/zinc/58/45/73/510584573.db2.gz NVZHOHKJGLTWAX-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000184920780 510584580 /nfs/dbraw/zinc/58/45/80/510584580.db2.gz NVZHOHKJGLTWAX-MRXNPFEDSA-N 1 1 368.437 2.914 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOC2(C1)CCCCCC2 ZINC000182020846 510714557 /nfs/dbraw/zinc/71/45/57/510714557.db2.gz ZYLQALYBWWSVLI-MRXNPFEDSA-N 1 1 364.442 2.760 20 5 FFBDMO O=C([O-])C[N@H+](CC1CC1)C1CC([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000263523875 510735674 /nfs/dbraw/zinc/73/56/74/510735674.db2.gz SJVFQECOFFHGKE-HWKANZROSA-N 1 1 359.426 2.525 20 5 FFBDMO O=C([O-])C[N@@H+](CC1CC1)C1CC([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000263523875 510735682 /nfs/dbraw/zinc/73/56/82/510735682.db2.gz SJVFQECOFFHGKE-HWKANZROSA-N 1 1 359.426 2.525 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(c2ccncc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000191626787 510759066 /nfs/dbraw/zinc/75/90/66/510759066.db2.gz XUMIIWBCCSNCKR-UHFFFAOYSA-N 1 1 354.410 2.832 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000182206520 510814354 /nfs/dbraw/zinc/81/43/54/510814354.db2.gz KKHSEBDEYDQSSC-MSOLQXFVSA-N 1 1 371.437 2.911 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000247310579 510856348 /nfs/dbraw/zinc/85/63/48/510856348.db2.gz HLKBCJFEBOYTGU-QMTHXVAHSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)cc1SC ZINC000247420715 510860217 /nfs/dbraw/zinc/86/02/17/510860217.db2.gz NZLISILUGQDXEJ-WCQYABFASA-N 1 1 367.471 2.738 20 5 FFBDMO CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285372765 510881281 /nfs/dbraw/zinc/88/12/81/510881281.db2.gz CGDLLDKSYJROMV-MZBDJJRSSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1cccc(C(=O)N2CCC([NH+]3CCN(C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000270932736 511029204 /nfs/dbraw/zinc/02/92/04/511029204.db2.gz QKGPPFYYRCWNNN-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000279288561 511032199 /nfs/dbraw/zinc/03/21/99/511032199.db2.gz MDFOMBQMZIJHLJ-KGLIPLIRSA-N 1 1 355.797 2.673 20 5 FFBDMO COCCCn1nccc1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000282894026 511151701 /nfs/dbraw/zinc/15/17/01/511151701.db2.gz YDOZYGPPXMEHFC-UHFFFAOYSA-N 1 1 374.441 2.871 20 5 FFBDMO COC(=O)CCn1nc(C)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1C ZINC000283020413 511202320 /nfs/dbraw/zinc/20/23/20/511202320.db2.gz MFKOXZKBSIDQDA-UHFFFAOYSA-N 1 1 374.441 2.646 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CC23CCOCC3)cn1 ZINC000294943764 511229112 /nfs/dbraw/zinc/22/91/12/511229112.db2.gz HBJFTYCCRQWMKZ-GOSISDBHSA-N 1 1 356.426 2.725 20 5 FFBDMO Cc1nc(N2CCC[C@H]([N@@H+](C)Cc3ccccn3)CC2)ncc1[N+](=O)[O-] ZINC000295044419 511262209 /nfs/dbraw/zinc/26/22/09/511262209.db2.gz OBUNIEMBBZLDLK-INIZCTEOSA-N 1 1 356.430 2.579 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000295088311 511277497 /nfs/dbraw/zinc/27/74/97/511277497.db2.gz JDZYRORQHMZNSO-HNNXBMFYSA-N 1 1 361.442 2.652 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959638 511281721 /nfs/dbraw/zinc/28/17/21/511281721.db2.gz YEYKZPVPGPSUAS-SUNYJGFJSA-N 1 1 350.415 2.762 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959638 511281723 /nfs/dbraw/zinc/28/17/23/511281723.db2.gz YEYKZPVPGPSUAS-SUNYJGFJSA-N 1 1 350.415 2.762 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3Br)C2)C1 ZINC000295218978 511326368 /nfs/dbraw/zinc/32/63/68/511326368.db2.gz AWVIOTRYKHDNFQ-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](Cc2cnn(C)c2)C1 ZINC000363135517 511375128 /nfs/dbraw/zinc/37/51/28/511375128.db2.gz VTAFPKCPRBAHJN-OAHLLOKOSA-N 1 1 371.441 2.530 20 5 FFBDMO C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+](C2CCC2)C1 ZINC000292109564 511467456 /nfs/dbraw/zinc/46/74/56/511467456.db2.gz GWXJTCIQSPCILP-AWEZNQCLSA-N 1 1 371.441 2.951 20 5 FFBDMO C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000295697530 511487004 /nfs/dbraw/zinc/48/70/04/511487004.db2.gz IXJHZUKYRZDBJP-JTQLQIEISA-N 1 1 357.332 2.994 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H](C2CCC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000292157528 511486988 /nfs/dbraw/zinc/48/69/88/511486988.db2.gz OFUIDWOUBKMORZ-CQSZACIVSA-N 1 1 365.405 2.811 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)C2)C1 ZINC000292311919 511547933 /nfs/dbraw/zinc/54/79/33/511547933.db2.gz SKVVPGMCDNOORA-HNNXBMFYSA-N 1 1 357.332 2.781 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000363582747 511640253 /nfs/dbraw/zinc/64/02/53/511640253.db2.gz KFJDCFBVTZACGN-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO CCOC(=O)[C@H](C)[C@@H](C)[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000273966707 511673108 /nfs/dbraw/zinc/67/31/08/511673108.db2.gz HCXQCTZMZLWEHU-IJLUTSLNSA-N 1 1 362.386 2.883 20 5 FFBDMO O=C1N[C@H]2CC[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]2CO1 ZINC000281143032 511736046 /nfs/dbraw/zinc/73/60/46/511736046.db2.gz DWOMDPINNCDQDB-CJNGLKHVSA-N 1 1 357.366 2.785 20 5 FFBDMO CC[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000303477332 511739791 /nfs/dbraw/zinc/73/97/91/511739791.db2.gz PDQIGOWMECIXFC-AWEZNQCLSA-N 1 1 369.487 2.774 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000281157886 511741748 /nfs/dbraw/zinc/74/17/48/511741748.db2.gz CHELTEWVFGWGKW-JKSUJKDBSA-N 1 1 363.458 2.861 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281334911 511807944 /nfs/dbraw/zinc/80/79/44/511807944.db2.gz UIMXDIDYNTZHHA-AWEZNQCLSA-N 1 1 360.414 2.630 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])C1 ZINC000281447642 511851153 /nfs/dbraw/zinc/85/11/53/511851153.db2.gz DYQYKCQBTIHZIA-MRXNPFEDSA-N 1 1 363.458 2.862 20 5 FFBDMO CC(C)Cc1nnc(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000296726554 511872510 /nfs/dbraw/zinc/87/25/10/511872510.db2.gz NMWVDLQUHNUOIQ-NSHDSACASA-N 1 1 363.443 2.934 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366199076 511895766 /nfs/dbraw/zinc/89/57/66/511895766.db2.gz GKZBWHACVKFNKU-GDBMZVCRSA-N 1 1 354.410 2.773 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1 ZINC000366399580 512000708 /nfs/dbraw/zinc/00/07/08/512000708.db2.gz QONCLPIQZVMXPA-UHFFFAOYSA-N 1 1 372.410 2.582 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000297143036 512036027 /nfs/dbraw/zinc/03/60/27/512036027.db2.gz NTMSYWZUSXDQFB-GOSISDBHSA-N 1 1 369.469 2.749 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1 ZINC000293715925 512060878 /nfs/dbraw/zinc/06/08/78/512060878.db2.gz OXERXWKTKHRNKG-AWEZNQCLSA-N 1 1 361.442 2.940 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc(N)ccc1F)CCc1ccccc1[N+](=O)[O-] ZINC000285301740 512070395 /nfs/dbraw/zinc/07/03/95/512070395.db2.gz LGAUSJVEPGTYGT-UHFFFAOYSA-N 1 1 360.389 2.819 20 5 FFBDMO CCS(=O)(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)s1 ZINC000285310243 512072431 /nfs/dbraw/zinc/07/24/31/512072431.db2.gz SMFJPBDXVGQZTI-JTQLQIEISA-N 1 1 369.468 2.883 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)c([N+](=O)[O-])c1 ZINC000375729105 512475947 /nfs/dbraw/zinc/47/59/47/512475947.db2.gz FFUOURUXUADZFV-ZDUSSCGKSA-N 1 1 365.386 2.521 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375757475 512489013 /nfs/dbraw/zinc/48/90/13/512489013.db2.gz JRVCAMASPSGTIP-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375757475 512489015 /nfs/dbraw/zinc/48/90/15/512489015.db2.gz JRVCAMASPSGTIP-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO CCOc1cc(C[N@H+]2CCOC3(CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000373802007 512512638 /nfs/dbraw/zinc/51/26/38/512512638.db2.gz VIPPHJXRJGMPLQ-UHFFFAOYSA-N 1 1 350.415 2.765 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C[C@@H](C)OC)C(C)C ZINC000411282247 512560234 /nfs/dbraw/zinc/56/02/34/512560234.db2.gz IRJZBYOYGLUURE-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO O=C1[C@H]([N@H+]2CCCC3(CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000375907744 512564971 /nfs/dbraw/zinc/56/49/71/512564971.db2.gz TZKPHQVTTCXOAY-QGZVFWFLSA-N 1 1 359.426 2.593 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000369708256 512565678 /nfs/dbraw/zinc/56/56/78/512565678.db2.gz AQFLDBIPRADGPC-MRXNPFEDSA-N 1 1 354.410 2.645 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000374067908 512647373 /nfs/dbraw/zinc/64/73/73/512647373.db2.gz UCSRKBKXLJJJDH-FQEVSTJZSA-N 1 1 369.469 2.816 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC(OCC3CC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000374091955 512655814 /nfs/dbraw/zinc/65/58/14/512655814.db2.gz HDXSSCQFWPCLLL-SFHVURJKSA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@@]1(CNC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000374162082 512686030 /nfs/dbraw/zinc/68/60/30/512686030.db2.gz LNHZWTOAZMTGNQ-FQEVSTJZSA-N 1 1 368.437 2.819 20 5 FFBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000374169846 512690471 /nfs/dbraw/zinc/69/04/71/512690471.db2.gz GURCWZVDKSGFST-DEICHXMPSA-N 1 1 361.442 2.795 20 5 FFBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000374211261 512708795 /nfs/dbraw/zinc/70/87/95/512708795.db2.gz MZOSNIBJUNAPNN-OAHLLOKOSA-N 1 1 357.414 2.666 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c1 ZINC000378491502 512788975 /nfs/dbraw/zinc/78/89/75/512788975.db2.gz GXSVOIRQMMANJA-KSSFIOAISA-N 1 1 362.405 2.561 20 5 FFBDMO COC(=O)[C@]1(C)C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000374373649 512797799 /nfs/dbraw/zinc/79/77/99/512797799.db2.gz IVEGPSZFKWUCFZ-SEDUGSJDSA-N 1 1 374.397 2.837 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCSC[C@H]2C2CC2)c([N+](=O)[O-])c1 ZINC000411783214 512809245 /nfs/dbraw/zinc/80/92/45/512809245.db2.gz FNAPVHFLQGCUJX-INIZCTEOSA-N 1 1 365.455 2.759 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000376515052 512851963 /nfs/dbraw/zinc/85/19/63/512851963.db2.gz MSRBZDOLHXAQIV-INIZCTEOSA-N 1 1 358.354 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](OCc3ccncc3)C2)c([N+](=O)[O-])c1 ZINC000376515052 512851966 /nfs/dbraw/zinc/85/19/66/512851966.db2.gz MSRBZDOLHXAQIV-INIZCTEOSA-N 1 1 358.354 2.689 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(=NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000388556243 512896300 /nfs/dbraw/zinc/89/63/00/512896300.db2.gz YLDJMBLOMDMQDI-OAHLLOKOSA-N 1 1 351.410 2.827 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](Oc2ccccc2)C1 ZINC000411990258 512903567 /nfs/dbraw/zinc/90/35/67/512903567.db2.gz VPJPSPBYSVWPAL-WMZOPIPTSA-N 1 1 372.421 2.878 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+](C)Cc2ccccc2)n1 ZINC000390491312 512907014 /nfs/dbraw/zinc/90/70/14/512907014.db2.gz QNJHILDZBRSTLX-ZDUSSCGKSA-N 1 1 358.398 2.709 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000412074661 512945398 /nfs/dbraw/zinc/94/53/98/512945398.db2.gz IOZDLDAEMQODJV-NEPJUHHUSA-N 1 1 374.384 2.840 20 5 FFBDMO O=[N+]([O-])c1cc(CNCC2(O)CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000397542357 512948294 /nfs/dbraw/zinc/94/82/94/512948294.db2.gz BOQZIGZDOVILPR-UHFFFAOYSA-N 1 1 361.467 2.773 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3[C@@H](C)C[NH+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000407999467 512981797 /nfs/dbraw/zinc/98/17/97/512981797.db2.gz WGMPRIVJHRMKPO-PMPSAXMXSA-N 1 1 374.485 2.996 20 5 FFBDMO CC(=O)c1cc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000368542257 512993362 /nfs/dbraw/zinc/99/33/62/512993362.db2.gz CKACEVGSRKPSSH-ROUUACIJSA-N 1 1 369.421 2.845 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](Cc2ccncc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000368621177 513029776 /nfs/dbraw/zinc/02/97/76/513029776.db2.gz HWMKKVICYKNIOC-MRXNPFEDSA-N 1 1 354.410 2.883 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCC[C@H](C)C1 ZINC000445887809 513139129 /nfs/dbraw/zinc/13/91/29/513139129.db2.gz UTXNTDQZZXHQOK-LSDHHAIUSA-N 1 1 360.458 2.783 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[NH+](CCOC(C)C)CC1 ZINC000450360971 513159215 /nfs/dbraw/zinc/15/92/15/513159215.db2.gz BJPFQOCSYRZGFS-UHFFFAOYSA-N 1 1 374.441 2.699 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450477566 513213783 /nfs/dbraw/zinc/21/37/83/513213783.db2.gz WZDLPSINEXQQOC-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]([C@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000428997150 513246928 /nfs/dbraw/zinc/24/69/28/513246928.db2.gz RYVYKWQUXBKSLB-FSZRXZPDSA-N 1 1 360.458 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+]2CCO)c(Br)c1 ZINC000450613667 513273320 /nfs/dbraw/zinc/27/33/20/513273320.db2.gz MDOOECKTYLMLNH-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2CCO)c(Br)c1 ZINC000450613667 513273329 /nfs/dbraw/zinc/27/33/29/513273329.db2.gz MDOOECKTYLMLNH-GFCCVEGCSA-N 1 1 358.236 2.616 20 5 FFBDMO COCC(C)(C)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000429236301 513311005 /nfs/dbraw/zinc/31/10/05/513311005.db2.gz HZKLEENFYTXBLX-UHFFFAOYSA-N 1 1 374.235 2.653 20 5 FFBDMO COCC(C)(C)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000429236301 513311011 /nfs/dbraw/zinc/31/10/11/513311011.db2.gz HZKLEENFYTXBLX-UHFFFAOYSA-N 1 1 374.235 2.653 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000446724218 513323813 /nfs/dbraw/zinc/32/38/13/513323813.db2.gz YOYRUSUELMFLGY-ICSRJNTNSA-N 1 1 356.422 2.998 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC000429279144 513323928 /nfs/dbraw/zinc/32/39/28/513323928.db2.gz KJRCMQTUKAIPOS-ZDUSSCGKSA-N 1 1 365.455 2.968 20 5 FFBDMO CCc1cc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000450775660 513334991 /nfs/dbraw/zinc/33/49/91/513334991.db2.gz BLJSOKXCDKDSIN-WMLDXEAASA-N 1 1 353.426 2.755 20 5 FFBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000434622514 513370688 /nfs/dbraw/zinc/37/06/88/513370688.db2.gz FLGCVAHFCWFMNS-IRXDYDNUSA-N 1 1 350.394 2.620 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434697441 513396898 /nfs/dbraw/zinc/39/68/98/513396898.db2.gz OSRISSAHAVADDM-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434697441 513396903 /nfs/dbraw/zinc/39/69/03/513396903.db2.gz OSRISSAHAVADDM-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000434768772 513423831 /nfs/dbraw/zinc/42/38/31/513423831.db2.gz TTZOWENHALPDDA-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-] ZINC000434768772 513423842 /nfs/dbraw/zinc/42/38/42/513423842.db2.gz TTZOWENHALPDDA-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc(N2CCC[C@H]3C[N@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000425282294 513489834 /nfs/dbraw/zinc/48/98/34/513489834.db2.gz KLHFDEOCAVMCQO-DOTOQJQBSA-N 1 1 353.426 2.891 20 5 FFBDMO O=C([C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)N1CCCC1 ZINC000435055929 513498995 /nfs/dbraw/zinc/49/89/95/513498995.db2.gz DOACJJKDYDLOMI-ZDUSSCGKSA-N 1 1 358.398 2.570 20 5 FFBDMO O=C([C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)N1CCCC1 ZINC000435055929 513499001 /nfs/dbraw/zinc/49/90/01/513499001.db2.gz DOACJJKDYDLOMI-ZDUSSCGKSA-N 1 1 358.398 2.570 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441193827 513509646 /nfs/dbraw/zinc/50/96/46/513509646.db2.gz IAIWETVOMLRVAV-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441278284 513527664 /nfs/dbraw/zinc/52/76/64/513527664.db2.gz PHUJRZARBXGRFP-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CN(CC2CC2)c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413239179 513540467 /nfs/dbraw/zinc/54/04/67/513540467.db2.gz MCDBZHGWBIXVIO-OAHLLOKOSA-N 1 1 356.426 2.690 20 5 FFBDMO C[N@H+]1CCO[C@@H](CN(CC2CC2)c2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413239179 513540476 /nfs/dbraw/zinc/54/04/76/513540476.db2.gz MCDBZHGWBIXVIO-OAHLLOKOSA-N 1 1 356.426 2.690 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1 ZINC000451339695 513687022 /nfs/dbraw/zinc/68/70/22/513687022.db2.gz IWEKXYVQTYSJTD-LZLYRXPVSA-N 1 1 364.442 2.998 20 5 FFBDMO O=C1[C@H]([NH+]2CCC(OC3CCC3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000419293435 513765529 /nfs/dbraw/zinc/76/55/29/513765529.db2.gz AHHXIHZONRMDRW-GOSISDBHSA-N 1 1 359.426 2.734 20 5 FFBDMO O=C(C[N@@H+]1CCSC[C@@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000419371404 513789935 /nfs/dbraw/zinc/78/99/35/513789935.db2.gz IWCOOALYTOSBFC-QGZVFWFLSA-N 1 1 361.467 2.701 20 5 FFBDMO O=C(C[N@H+]1CCSC[C@@H]1C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000419371404 513789939 /nfs/dbraw/zinc/78/99/39/513789939.db2.gz IWCOOALYTOSBFC-QGZVFWFLSA-N 1 1 361.467 2.701 20 5 FFBDMO CC(C)(CCC[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000431042913 513812812 /nfs/dbraw/zinc/81/28/12/513812812.db2.gz MLPTVKADPOATFI-UHFFFAOYSA-N 1 1 370.258 2.697 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000451540408 513819653 /nfs/dbraw/zinc/81/96/53/513819653.db2.gz KWARWSLLMSQAOD-BBRMVZONSA-N 1 1 365.430 2.679 20 5 FFBDMO CCCCOCCNC(=O)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550487 513828430 /nfs/dbraw/zinc/82/84/30/513828430.db2.gz RXUMVRIQEJVQPM-KRWDZBQOSA-N 1 1 363.458 2.707 20 5 FFBDMO CCCCOCCNC(=O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550487 513828435 /nfs/dbraw/zinc/82/84/35/513828435.db2.gz RXUMVRIQEJVQPM-KRWDZBQOSA-N 1 1 363.458 2.707 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000443381619 513955286 /nfs/dbraw/zinc/95/52/86/513955286.db2.gz HNNXVNNPPVEDDB-UHFFFAOYSA-N 1 1 350.419 2.989 20 5 FFBDMO COc1cc(CCNc2[nH+]c3cccc(F)c3n2C)c([N+](=O)[O-])cc1OC ZINC000443429958 513967598 /nfs/dbraw/zinc/96/75/98/513967598.db2.gz OFCULUWAXQROJV-UHFFFAOYSA-N 1 1 374.372 2.714 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](CO)CC(C)(C)C ZINC000451773997 513972922 /nfs/dbraw/zinc/97/29/22/513972922.db2.gz ARSMAJBKLFGVKD-GFCCVEGCSA-N 1 1 357.838 2.916 20 5 FFBDMO Cc1cc(OCC(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000431832905 514015090 /nfs/dbraw/zinc/01/50/90/514015090.db2.gz MAQKDBCNUDQXLP-LZWOXQAQSA-N 1 1 363.458 2.765 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000427095924 514114847 /nfs/dbraw/zinc/11/48/47/514114847.db2.gz ZALMWWCCLFCZDZ-GDBMZVCRSA-N 1 1 369.421 2.996 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000452005158 514129179 /nfs/dbraw/zinc/12/91/79/514129179.db2.gz LQKWGCLBVUYQAA-IRXDYDNUSA-N 1 1 370.405 2.862 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000437289582 514132878 /nfs/dbraw/zinc/13/28/78/514132878.db2.gz QWAGYKHRRRGRRS-ZDUSSCGKSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000452055349 514164741 /nfs/dbraw/zinc/16/47/41/514164741.db2.gz UGGAAYNOWBJDNX-LTCOOKNTSA-N 1 1 364.467 2.737 20 5 FFBDMO C[C@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000452055349 514164747 /nfs/dbraw/zinc/16/47/47/514164747.db2.gz UGGAAYNOWBJDNX-LTCOOKNTSA-N 1 1 364.467 2.737 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1 ZINC000452081263 514179946 /nfs/dbraw/zinc/17/99/46/514179946.db2.gz JLIQIOVZQPMZAW-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H](COC)CC2)c([N+](=O)[O-])c1 ZINC000452081263 514179950 /nfs/dbraw/zinc/17/99/50/514179950.db2.gz JLIQIOVZQPMZAW-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO COC(=O)[C@@H]1CSCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000414580274 514191307 /nfs/dbraw/zinc/19/13/07/514191307.db2.gz JPLRHBRIYBSMRA-ODDCISTRSA-N 1 1 350.440 2.836 20 5 FFBDMO COC(=O)[C@H]1CSCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000414580276 514192037 /nfs/dbraw/zinc/19/20/37/514192037.db2.gz JPLRHBRIYBSMRA-XETPBLJFSA-N 1 1 350.440 2.836 20 5 FFBDMO C[C@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000420604076 514197412 /nfs/dbraw/zinc/19/74/12/514197412.db2.gz QZJOZZLUKOXTQG-HNNXBMFYSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000452120848 514205661 /nfs/dbraw/zinc/20/56/61/514205661.db2.gz JNTUOKHUXPMVJV-RLFYNMQTSA-N 1 1 373.453 2.746 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+](C2CC2)C1 ZINC000452171072 514230400 /nfs/dbraw/zinc/23/04/00/514230400.db2.gz JSPBFZABEANDPR-ZDUSSCGKSA-N 1 1 354.410 2.699 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714803 514301573 /nfs/dbraw/zinc/30/15/73/514301573.db2.gz FFOGYDJAUAXLSD-SMDDNHRTSA-N 1 1 357.332 2.974 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714803 514301579 /nfs/dbraw/zinc/30/15/79/514301579.db2.gz FFOGYDJAUAXLSD-SMDDNHRTSA-N 1 1 357.332 2.974 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCCO1 ZINC000432880947 514311794 /nfs/dbraw/zinc/31/17/94/514311794.db2.gz VPUDIYMMGCYRLG-INIZCTEOSA-N 1 1 370.453 2.992 20 5 FFBDMO Cc1cc(N(C)[C@H](C)C[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000432914329 514321002 /nfs/dbraw/zinc/32/10/02/514321002.db2.gz APPSLPUMEKVVIS-OAHLLOKOSA-N 1 1 371.441 2.517 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000420830615 514324130 /nfs/dbraw/zinc/32/41/30/514324130.db2.gz AMYDOKYTAAJIDZ-CYBMUJFWSA-N 1 1 374.363 2.849 20 5 FFBDMO C[C@H](C[NH+]1CCOCC1)N(C)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000432944080 514332173 /nfs/dbraw/zinc/33/21/73/514332173.db2.gz KUNJENYXSUTGPV-OAHLLOKOSA-N 1 1 356.426 2.814 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433060738 514365661 /nfs/dbraw/zinc/36/56/61/514365661.db2.gz MSIIRQIFBFVNKQ-DOTOQJQBSA-N 1 1 371.437 2.766 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H](O)Cc1ccccc1 ZINC000433061603 514366693 /nfs/dbraw/zinc/36/66/93/514366693.db2.gz PQFGRPFPDBWVKO-GOSISDBHSA-N 1 1 371.437 2.767 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(CN3CCOCC3)c1)CC2 ZINC000420943400 514391724 /nfs/dbraw/zinc/39/17/24/514391724.db2.gz WIZBGBJKALZRSZ-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(CN3CCOCC3)c1)CC2 ZINC000420943400 514391732 /nfs/dbraw/zinc/39/17/32/514391732.db2.gz WIZBGBJKALZRSZ-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](C2CCCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000420963287 514405240 /nfs/dbraw/zinc/40/52/40/514405240.db2.gz MYCXYGRBFAEQAY-CYBMUJFWSA-N 1 1 361.398 2.774 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000450145588 514510572 /nfs/dbraw/zinc/51/05/72/514510572.db2.gz KCDRGLNOLHYTRR-CQSZACIVSA-N 1 1 371.441 2.693 20 5 FFBDMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ncc(C(F)(F)F)cn2)n1 ZINC000453309838 514596309 /nfs/dbraw/zinc/59/63/09/514596309.db2.gz PXHHELFFFJXKAY-NWDGAFQWSA-N 1 1 370.335 2.874 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458181050 514606290 /nfs/dbraw/zinc/60/62/90/514606290.db2.gz ZHJWKUSCHQARBA-ZDUSSCGKSA-N 1 1 369.849 2.865 20 5 FFBDMO CCc1cc(OC)ccc1C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1 ZINC000453573437 514694004 /nfs/dbraw/zinc/69/40/04/514694004.db2.gz HCPYATSDQIWUAQ-UHFFFAOYSA-N 1 1 356.426 2.883 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470959290 514694635 /nfs/dbraw/zinc/69/46/35/514694635.db2.gz HRUBWGCKETZPAX-ZBFHGGJFSA-N 1 1 360.458 2.586 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 ZINC000461793538 514742309 /nfs/dbraw/zinc/74/23/09/514742309.db2.gz CYRLTQBLGGDBAC-HNNXBMFYSA-N 1 1 350.463 2.899 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc([N+](=O)[O-])c1C ZINC000479885330 514759325 /nfs/dbraw/zinc/75/93/25/514759325.db2.gz JSGYVRLFSCVSIP-OAHLLOKOSA-N 1 1 361.442 2.716 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000479937361 514783419 /nfs/dbraw/zinc/78/34/19/514783419.db2.gz CKDXNMBDWSRFLI-CHWSQXEVSA-N 1 1 369.849 2.816 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000489327878 514799049 /nfs/dbraw/zinc/79/90/49/514799049.db2.gz MIAMWWBSVMOMTD-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1)CC(C)C ZINC000479999025 514803642 /nfs/dbraw/zinc/80/36/42/514803642.db2.gz YKCDJMVHLFNNLM-UHFFFAOYSA-N 1 1 365.478 2.549 20 5 FFBDMO CCC[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC ZINC000508966579 514968400 /nfs/dbraw/zinc/96/84/00/514968400.db2.gz PBACGYWBXMCIQC-ZDUSSCGKSA-N 1 1 357.401 2.806 20 5 FFBDMO Cn1c(=O)c2cc3ccccc3cc2nc1SCCC[NH+]1CCOCC1 ZINC000503251881 514980587 /nfs/dbraw/zinc/98/05/87/514980587.db2.gz OXXTWIVKBNNKLV-UHFFFAOYSA-N 1 1 369.490 2.901 20 5 FFBDMO COc1cc(CN2CC[NH+]([C@@H](C)c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000490102392 515105641 /nfs/dbraw/zinc/10/56/41/515105641.db2.gz MHZRQUKPEVCXKA-HNNXBMFYSA-N 1 1 356.426 2.877 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c1 ZINC000485878586 515231673 /nfs/dbraw/zinc/23/16/73/515231673.db2.gz YBLSXIIAQALGEU-WCIQWLHISA-N 1 1 370.453 2.810 20 5 FFBDMO Cc1c(Br)cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000509649675 515274250 /nfs/dbraw/zinc/27/42/50/515274250.db2.gz FZSZOZABIQPBNM-NSHDSACASA-N 1 1 368.231 2.632 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC000499419499 515316439 /nfs/dbraw/zinc/31/64/39/515316439.db2.gz GDCFYXNUQKWXCG-CABCVRRESA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC000499419499 515316445 /nfs/dbraw/zinc/31/64/45/515316445.db2.gz GDCFYXNUQKWXCG-CABCVRRESA-N 1 1 356.426 2.668 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490844 515346538 /nfs/dbraw/zinc/34/65/38/515346538.db2.gz HAYHZHZHALWEST-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481490844 515346548 /nfs/dbraw/zinc/34/65/48/515346548.db2.gz HAYHZHZHALWEST-MLGOLLRUSA-N 1 1 363.414 2.505 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468626820 515443147 /nfs/dbraw/zinc/44/31/47/515443147.db2.gz JKVLOQNSLDDQLW-XCMFGDQWSA-N 1 1 360.502 2.861 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000486452865 515487461 /nfs/dbraw/zinc/48/74/61/515487461.db2.gz RVMFZTBZVRVHBD-UHFFFAOYSA-N 1 1 352.341 2.517 20 5 FFBDMO C[N@H+](CCc1cccc(Br)c1)CCn1ccc([N+](=O)[O-])n1 ZINC000463419260 515487700 /nfs/dbraw/zinc/48/77/00/515487700.db2.gz KWXBODGWPKKGIK-UHFFFAOYSA-N 1 1 353.220 2.728 20 5 FFBDMO C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@@H+]1C1CCN(C)CC1 ZINC000492175429 515510277 /nfs/dbraw/zinc/51/02/77/515510277.db2.gz JGDXMRNZDPNPHQ-CQSZACIVSA-N 1 1 366.893 2.849 20 5 FFBDMO C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1C1CCN(C)CC1 ZINC000492175429 515510285 /nfs/dbraw/zinc/51/02/85/515510285.db2.gz JGDXMRNZDPNPHQ-CQSZACIVSA-N 1 1 366.893 2.849 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000456982186 515563520 /nfs/dbraw/zinc/56/35/20/515563520.db2.gz GIVFJYXQZXTFSE-INIZCTEOSA-N 1 1 355.394 2.780 20 5 FFBDMO Cc1cc(N2CC[C@H]3CC[N@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000486670462 515588830 /nfs/dbraw/zinc/58/88/30/515588830.db2.gz KLWVJWZQFLADNW-RHSMWYFYSA-N 1 1 353.426 2.891 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000457085472 515638941 /nfs/dbraw/zinc/63/89/41/515638941.db2.gz HMTLROHPKWJDDX-GFCCVEGCSA-N 1 1 357.357 2.751 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000457102723 515649412 /nfs/dbraw/zinc/64/94/12/515649412.db2.gz AHPCYGKCXZDWTM-AWEZNQCLSA-N 1 1 369.849 2.958 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000494036222 515716388 /nfs/dbraw/zinc/71/63/88/515716388.db2.gz DEZNCQOWQQNQJD-WMLDXEAASA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H](C(=O)NCCc1ccc(F)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511136740 515801156 /nfs/dbraw/zinc/80/11/56/515801156.db2.gz KIPSUGPQKUMTJE-OAHLLOKOSA-N 1 1 373.428 2.956 20 5 FFBDMO C[C@H](C(=O)NCCc1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511136740 515801162 /nfs/dbraw/zinc/80/11/62/515801162.db2.gz KIPSUGPQKUMTJE-OAHLLOKOSA-N 1 1 373.428 2.956 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccc(F)cc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511136738 515801329 /nfs/dbraw/zinc/80/13/29/515801329.db2.gz KIPSUGPQKUMTJE-HNNXBMFYSA-N 1 1 373.428 2.956 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccc(F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511136738 515801339 /nfs/dbraw/zinc/80/13/39/515801339.db2.gz KIPSUGPQKUMTJE-HNNXBMFYSA-N 1 1 373.428 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)c(F)c1 ZINC000478387039 515802710 /nfs/dbraw/zinc/80/27/10/515802710.db2.gz QXFLKTQZQMAGTI-XLIONFOSSA-N 1 1 373.428 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2CO)c(F)c1 ZINC000478387039 515802715 /nfs/dbraw/zinc/80/27/15/515802715.db2.gz QXFLKTQZQMAGTI-XLIONFOSSA-N 1 1 373.428 2.707 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNC(=O)c3cc([N+](=O)[O-])n[nH]3)cc2)C1 ZINC000506357385 515857793 /nfs/dbraw/zinc/85/77/93/515857793.db2.gz QSWOEKORGQLCCT-OKILXGFUSA-N 1 1 371.441 2.726 20 5 FFBDMO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)c([N+](=O)[O-])c1 ZINC000474148869 515906085 /nfs/dbraw/zinc/90/60/85/515906085.db2.gz YCOSAJJHSDUPBV-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000483115963 515935054 /nfs/dbraw/zinc/93/50/54/515935054.db2.gz DMXIYHUAFHIBFI-QAPCUYQASA-N 1 1 360.385 2.963 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000511553022 515941484 /nfs/dbraw/zinc/94/14/84/515941484.db2.gz ISJNHBUWBDLLBR-LBPRGKRZSA-N 1 1 373.400 2.773 20 5 FFBDMO C[C@H]1CC[N@@H+](C)CCN1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501085908 515973280 /nfs/dbraw/zinc/97/32/80/515973280.db2.gz PBNREYXRSXTSGH-JTQLQIEISA-N 1 1 371.235 2.915 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])n1C ZINC000464937346 516020728 /nfs/dbraw/zinc/02/07/28/516020728.db2.gz RIGUEYAQFFSTLV-QGZVFWFLSA-N 1 1 370.453 2.918 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CCSC1 ZINC000501288808 516046074 /nfs/dbraw/zinc/04/60/74/516046074.db2.gz ITKZCKSBYSMWFD-LLVKDONJSA-N 1 1 374.260 2.733 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@@H]1CCSC1 ZINC000501288808 516046083 /nfs/dbraw/zinc/04/60/83/516046083.db2.gz ITKZCKSBYSMWFD-LLVKDONJSA-N 1 1 374.260 2.733 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000469997511 516067605 /nfs/dbraw/zinc/06/76/05/516067605.db2.gz ZYKKEKUDSOQWOE-WFASDCNBSA-N 1 1 359.382 2.676 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000470163024 516157096 /nfs/dbraw/zinc/15/70/96/516157096.db2.gz IISRYBDNEYOPFX-QGZVFWFLSA-N 1 1 356.426 2.683 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(Cc2nccn2C)CC1 ZINC000470170294 516160924 /nfs/dbraw/zinc/16/09/24/516160924.db2.gz RSJHUSNLXJYFNZ-VBKFSLOCSA-N 1 1 355.442 2.549 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000507295172 516161518 /nfs/dbraw/zinc/16/15/18/516161518.db2.gz LCHNKMISOBNGTJ-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CCC(CCC[NH+](C)C)CC2)c1[N+](=O)[O-] ZINC000501632050 516179447 /nfs/dbraw/zinc/17/94/47/516179447.db2.gz WLHDSSJRAHRIEU-UHFFFAOYSA-N 1 1 351.451 2.635 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccc1 ZINC000488390881 516213093 /nfs/dbraw/zinc/21/30/93/516213093.db2.gz NCKFLHNXHSGLLO-DZGCQCFKSA-N 1 1 359.430 2.813 20 5 FFBDMO CC(C)c1ccc(C[C@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000460984259 516297255 /nfs/dbraw/zinc/29/72/55/516297255.db2.gz VNBDAOQICXQLJM-YLJYHZDGSA-N 1 1 372.469 2.840 20 5 FFBDMO Cc1n[nH]c(C(=O)NCC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000512570891 516307287 /nfs/dbraw/zinc/30/72/87/516307287.db2.gz WQMZFVWBSZUBJN-XJKSGUPXSA-N 1 1 371.441 2.657 20 5 FFBDMO Cc1ccc(-c2nnc(C[NH+]3CCC(n4ccc([N+](=O)[O-])n4)CC3)o2)cc1 ZINC000488785084 516308307 /nfs/dbraw/zinc/30/83/07/516308307.db2.gz QPXSUXJJIUGFBE-UHFFFAOYSA-N 1 1 368.397 2.987 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000535432263 516353118 /nfs/dbraw/zinc/35/31/18/516353118.db2.gz OJQHZMIQNQTAPR-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000535432263 516353129 /nfs/dbraw/zinc/35/31/29/516353129.db2.gz OJQHZMIQNQTAPR-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000561153618 516411837 /nfs/dbraw/zinc/41/18/37/516411837.db2.gz FPRUCWBJWZQGDK-ZFWWWQNUSA-N 1 1 354.410 2.941 20 5 FFBDMO COc1ccc(NC(=O)[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000543926666 516499976 /nfs/dbraw/zinc/49/99/76/516499976.db2.gz OOENRKRYPYCDPY-OAHLLOKOSA-N 1 1 370.409 2.849 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000523620509 516522175 /nfs/dbraw/zinc/52/21/75/516522175.db2.gz BPLDGRUALTWZQN-UHFFFAOYSA-N 1 1 351.450 2.611 20 5 FFBDMO CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CCSCC1 ZINC000540452985 516563137 /nfs/dbraw/zinc/56/31/37/516563137.db2.gz JHAHKSFGXFHNMN-UHFFFAOYSA-N 1 1 369.512 2.874 20 5 FFBDMO COc1cccc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000547789656 516564861 /nfs/dbraw/zinc/56/48/61/516564861.db2.gz YNRGGPHOOSGZEI-UHFFFAOYSA-N 1 1 374.416 2.977 20 5 FFBDMO C[N@@H+](CCN1CCN(Cc2ccccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000513460619 516633807 /nfs/dbraw/zinc/63/38/07/516633807.db2.gz GVTFEGLRUFMKSM-UHFFFAOYSA-N 1 1 368.481 2.844 20 5 FFBDMO Cc1cccc(OCCNC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554845567 516660655 /nfs/dbraw/zinc/66/06/55/516660655.db2.gz BVCFOFLQZABFMH-UHFFFAOYSA-N 1 1 371.437 2.573 20 5 FFBDMO Cc1cccc(OCCNC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554845567 516660670 /nfs/dbraw/zinc/66/06/70/516660670.db2.gz BVCFOFLQZABFMH-UHFFFAOYSA-N 1 1 371.437 2.573 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000518457902 516668678 /nfs/dbraw/zinc/66/86/78/516668678.db2.gz VWEZYQUXUOYYQJ-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC000518457902 516668687 /nfs/dbraw/zinc/66/86/87/516668687.db2.gz VWEZYQUXUOYYQJ-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](c1cncc(Br)c1)C1CC1 ZINC000551426101 516705893 /nfs/dbraw/zinc/70/58/93/516705893.db2.gz QOZQBIJDKFXEPX-CYBMUJFWSA-N 1 1 366.219 2.727 20 5 FFBDMO CCN(CC)C(=O)CCC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513713618 516728698 /nfs/dbraw/zinc/72/86/98/516728698.db2.gz QSCVVGHZOJWCRZ-SFHVURJKSA-N 1 1 373.457 2.656 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000544393286 516740092 /nfs/dbraw/zinc/74/00/92/516740092.db2.gz FNFIUCLANFGYRZ-ONGXEEELSA-N 1 1 357.252 2.837 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C[C@@H](C)C1 ZINC000561760652 516754688 /nfs/dbraw/zinc/75/46/88/516754688.db2.gz IGDWIAYLRLJGFQ-OGHNNQOOSA-N 1 1 356.426 2.878 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cnn1-c1ccc(F)cc1 ZINC000544434230 516759019 /nfs/dbraw/zinc/75/90/19/516759019.db2.gz UJVZNCLBGYZKSD-LLVKDONJSA-N 1 1 358.377 2.812 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000518883343 516807363 /nfs/dbraw/zinc/80/73/63/516807363.db2.gz FKDGRCLEWAVVKL-WCQYABFASA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000532144073 516823685 /nfs/dbraw/zinc/82/36/85/516823685.db2.gz SWHYDEPFIHBCKT-AWEZNQCLSA-N 1 1 370.409 2.963 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](CC3=Cc4ccccc4OC3)CC2)cn1 ZINC000536638050 516866714 /nfs/dbraw/zinc/86/67/14/516866714.db2.gz UJUSXZZTQKTTLM-UHFFFAOYSA-N 1 1 352.394 2.588 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)OC3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000519149610 516902151 /nfs/dbraw/zinc/90/21/51/516902151.db2.gz FEDNAEIKTBSLNW-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NCCCN2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000525193200 516954421 /nfs/dbraw/zinc/95/44/21/516954421.db2.gz SAWXWFJOQSTLPI-UHFFFAOYSA-N 1 1 371.441 2.623 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552056620 517054677 /nfs/dbraw/zinc/05/46/77/517054677.db2.gz LTXZPHLFZYBNHN-KRWDZBQOSA-N 1 1 370.453 2.950 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC=C(c2ccccn2)C1 ZINC000519682495 517120831 /nfs/dbraw/zinc/12/08/31/517120831.db2.gz YDIXBZBCYZTNID-INIZCTEOSA-N 1 1 355.394 2.519 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552254472 517164487 /nfs/dbraw/zinc/16/44/87/517164487.db2.gz GHSOOFHKVVSOIX-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO C[C@@]1(CCCO)CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000537411387 517176570 /nfs/dbraw/zinc/17/65/70/517176570.db2.gz NFUHQOXUFPSSCZ-SFHVURJKSA-N 1 1 363.414 2.520 20 5 FFBDMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000519869402 517230380 /nfs/dbraw/zinc/23/03/80/517230380.db2.gz OUTUVAYKJTXMGV-OAHLLOKOSA-N 1 1 367.427 2.549 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000541821587 517232481 /nfs/dbraw/zinc/23/24/81/517232481.db2.gz UHRIUMDNCMMCFE-CQSZACIVSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000537613116 517257949 /nfs/dbraw/zinc/25/79/49/517257949.db2.gz CKSUWZGMGVUAPM-ZBFHGGJFSA-N 1 1 356.426 2.574 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000541872922 517266024 /nfs/dbraw/zinc/26/60/24/517266024.db2.gz IENBFACPVKVBML-RYUDHWBXSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000541872923 517266247 /nfs/dbraw/zinc/26/62/47/517266247.db2.gz IENBFACPVKVBML-VXGBXAGGSA-N 1 1 374.384 2.840 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000556187826 517309710 /nfs/dbraw/zinc/30/97/10/517309710.db2.gz RKEJYJQMXNSDGE-SNVBAGLBSA-N 1 1 358.345 2.754 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000537810957 517355839 /nfs/dbraw/zinc/35/58/39/517355839.db2.gz MMKVRHYBZGJQMQ-MNOVXSKESA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000537810957 517355846 /nfs/dbraw/zinc/35/58/46/517355846.db2.gz MMKVRHYBZGJQMQ-MNOVXSKESA-N 1 1 370.247 2.830 20 5 FFBDMO CCOc1ccc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC000542210640 517439182 /nfs/dbraw/zinc/43/91/82/517439182.db2.gz VTQLKRIHYBNZSX-INIZCTEOSA-N 1 1 360.410 2.865 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2n[nH]cc2Br)n1 ZINC000520720104 517489197 /nfs/dbraw/zinc/48/91/97/517489197.db2.gz NEJCNZKZSDWYNK-JQWIXIFHSA-N 1 1 369.223 2.550 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000542404959 517543273 /nfs/dbraw/zinc/54/32/73/517543273.db2.gz CQCAWXXSPBUPSW-GWCFXTLKSA-N 1 1 369.874 2.939 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000520898537 517546343 /nfs/dbraw/zinc/54/63/43/517546343.db2.gz CAHKXFJFQOFKJT-UONOGXRCSA-N 1 1 369.487 2.698 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000563063686 517625660 /nfs/dbraw/zinc/62/56/60/517625660.db2.gz LVPXDDUZZAKHND-AWEZNQCLSA-N 1 1 373.457 2.650 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)n1 ZINC000553311784 517638940 /nfs/dbraw/zinc/63/89/40/517638940.db2.gz LPEHOWFBBAGSSZ-CYBMUJFWSA-N 1 1 370.409 2.635 20 5 FFBDMO NC(=O)c1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000542694640 517690682 /nfs/dbraw/zinc/69/06/82/517690682.db2.gz ZLDZJTSPCYKLPB-UHFFFAOYSA-N 1 1 358.379 2.700 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000521408254 517717775 /nfs/dbraw/zinc/71/77/75/517717775.db2.gz AZUNICVBHTWANF-GASCZTMLSA-N 1 1 374.485 2.901 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)CC2 ZINC000563248665 517768767 /nfs/dbraw/zinc/76/87/67/517768767.db2.gz GWFSLBZDNUULIB-HNNXBMFYSA-N 1 1 354.410 2.853 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)n1 ZINC000542865476 517789097 /nfs/dbraw/zinc/78/90/97/517789097.db2.gz ICQMSEWEQUFNEW-ROUUACIJSA-N 1 1 370.453 2.902 20 5 FFBDMO CCOc1ccc2c(c1)CC[N@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C2 ZINC000543138962 517929516 /nfs/dbraw/zinc/92/95/16/517929516.db2.gz ILYNHQVTFJADOR-KRWDZBQOSA-N 1 1 372.421 2.792 20 5 FFBDMO NC(=O)c1cccc(N2CC[NH+](C/C=C\c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000517107645 518029749 /nfs/dbraw/zinc/02/97/49/518029749.db2.gz ZBPZMSWSVSMMKR-YVMONPNESA-N 1 1 366.421 2.529 20 5 FFBDMO O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000517173620 518049190 /nfs/dbraw/zinc/04/91/90/518049190.db2.gz YNUOLDHMBAHOFF-IYOUNJFTSA-N 1 1 351.406 2.863 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035617 518131083 /nfs/dbraw/zinc/13/10/83/518131083.db2.gz BSUGGUWVLXMAMD-LSDHHAIUSA-N 1 1 354.410 2.725 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035617 518131087 /nfs/dbraw/zinc/13/10/87/518131087.db2.gz BSUGGUWVLXMAMD-LSDHHAIUSA-N 1 1 354.410 2.725 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856255 518204814 /nfs/dbraw/zinc/20/48/14/518204814.db2.gz MCVVFPCEXMXSTL-MAUKXSAKSA-N 1 1 352.394 2.585 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@H](c3ccncc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000563856255 518204817 /nfs/dbraw/zinc/20/48/17/518204817.db2.gz MCVVFPCEXMXSTL-MAUKXSAKSA-N 1 1 352.394 2.585 20 5 FFBDMO C[C@@H](NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1=CC[N@@H+](C)CC1 ZINC000564076631 518296722 /nfs/dbraw/zinc/29/67/22/518296722.db2.gz MSQPKWURFSGOKA-CYBMUJFWSA-N 1 1 371.441 2.568 20 5 FFBDMO CC(C)(C)OC1CC([NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000584373644 518307938 /nfs/dbraw/zinc/30/79/38/518307938.db2.gz XSEMSAKFFSRXRA-UHFFFAOYSA-N 1 1 361.442 2.699 20 5 FFBDMO Cc1ccc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000576366479 518558620 /nfs/dbraw/zinc/55/86/20/518558620.db2.gz AEWDORYLROYTCM-KRWDZBQOSA-N 1 1 355.394 2.722 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1ccnc(OC(F)F)c1)OCCO2 ZINC000585744293 518581992 /nfs/dbraw/zinc/58/19/92/518581992.db2.gz RDPJZWMTRAJDOJ-UHFFFAOYSA-N 1 1 367.308 2.652 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC[C@H]1CCO ZINC000585754721 518585798 /nfs/dbraw/zinc/58/57/98/518585798.db2.gz XGLKUCSXFXAVGU-AWEZNQCLSA-N 1 1 365.430 2.559 20 5 FFBDMO COCC[N@@H+]1CCC[C@H]1CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483368 518703788 /nfs/dbraw/zinc/70/37/88/518703788.db2.gz MTSIFRQFFIEUEC-LSDHHAIUSA-N 1 1 361.364 2.899 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000579483368 518703794 /nfs/dbraw/zinc/70/37/94/518703794.db2.gz MTSIFRQFFIEUEC-LSDHHAIUSA-N 1 1 361.364 2.899 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000570878600 518822211 /nfs/dbraw/zinc/82/22/11/518822211.db2.gz BDUXPRSNHVEYLB-UHFFFAOYSA-N 1 1 371.485 2.977 20 5 FFBDMO CN(CCCN(C)c1ccc([N+](=O)[O-])c(-c2ccccc2)n1)CC[NH+](C)C ZINC000570878600 518822218 /nfs/dbraw/zinc/82/22/18/518822218.db2.gz BDUXPRSNHVEYLB-UHFFFAOYSA-N 1 1 371.485 2.977 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000579792226 518851486 /nfs/dbraw/zinc/85/14/86/518851486.db2.gz QJTBHRWSXOONKC-PSGMQZRDSA-N 1 1 373.453 2.863 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000579792226 518851490 /nfs/dbraw/zinc/85/14/90/518851490.db2.gz QJTBHRWSXOONKC-PSGMQZRDSA-N 1 1 373.453 2.863 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc(Br)cc1[N+](=O)[O-] ZINC000570999085 518877736 /nfs/dbraw/zinc/87/77/36/518877736.db2.gz DHBWTRJTZNBKMA-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO CN(CCCN(C)c1ccc(Br)cc1[N+](=O)[O-])CC[NH+](C)C ZINC000570999085 518877742 /nfs/dbraw/zinc/87/77/42/518877742.db2.gz DHBWTRJTZNBKMA-UHFFFAOYSA-N 1 1 373.295 2.677 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000579849775 518886586 /nfs/dbraw/zinc/88/65/86/518886586.db2.gz AWSGGHJYVXLCKD-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000589187590 518944171 /nfs/dbraw/zinc/94/41/71/518944171.db2.gz BCCPRWHRCSTQOU-DZGCQCFKSA-N 1 1 350.415 2.882 20 5 FFBDMO COCc1nc(C[NH2+][C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cs1 ZINC000583174033 519110809 /nfs/dbraw/zinc/11/08/09/519110809.db2.gz QGWZIIICODBJSK-LLVKDONJSA-N 1 1 364.427 2.705 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000590014362 519129833 /nfs/dbraw/zinc/12/98/33/519129833.db2.gz BSRIDNIQDJWCMW-PXAZEXFGSA-N 1 1 367.833 2.570 20 5 FFBDMO CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000577578151 519147608 /nfs/dbraw/zinc/14/76/08/519147608.db2.gz XIPZSBRWXGJKGQ-INIZCTEOSA-N 1 1 371.441 2.727 20 5 FFBDMO CNc1ccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000577617530 519169840 /nfs/dbraw/zinc/16/98/40/519169840.db2.gz CQJNQHNZPSABGJ-UHFFFAOYSA-N 1 1 371.441 2.626 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@](CO)(C(C)C)C2)c1 ZINC000590377236 519208453 /nfs/dbraw/zinc/20/84/53/519208453.db2.gz AABSMYKNMSUTCD-SFHVURJKSA-N 1 1 350.415 2.612 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000590581003 519273252 /nfs/dbraw/zinc/27/32/52/519273252.db2.gz GJPQAKNCGDGIEW-NEPJUHHUSA-N 1 1 367.833 2.955 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)c1 ZINC000580634849 519275724 /nfs/dbraw/zinc/27/57/24/519275724.db2.gz MQZUJGYGWGHPMJ-KRWDZBQOSA-N 1 1 369.421 2.745 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000569287119 519471408 /nfs/dbraw/zinc/47/14/08/519471408.db2.gz QFWDIYRGUUELCT-PHIMTYICSA-N 1 1 370.247 2.912 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](c2cccnc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000602855035 519927412 /nfs/dbraw/zinc/92/74/12/519927412.db2.gz OPTLYQALNYFUEN-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](c2cccnc2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000602855035 519927422 /nfs/dbraw/zinc/92/74/22/519927422.db2.gz OPTLYQALNYFUEN-KRWDZBQOSA-N 1 1 366.421 2.759 20 5 FFBDMO C[N@H+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C(C)(C)C ZINC000602874174 519941924 /nfs/dbraw/zinc/94/19/24/519941924.db2.gz OWWOYYNVLXZICZ-HNNXBMFYSA-N 1 1 359.430 2.807 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599951926 519970610 /nfs/dbraw/zinc/97/06/10/519970610.db2.gz ZYLFXXCWNIAORB-SNVBAGLBSA-N 1 1 358.236 2.816 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2c(F)c(F)cc(F)c2F)c1 ZINC000591750343 520023452 /nfs/dbraw/zinc/02/34/52/520023452.db2.gz NGUXBZWTOUFUGY-SNVBAGLBSA-N 1 1 374.290 2.681 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)N1CC[NH+](CCCF)CC1 ZINC000600076551 520032496 /nfs/dbraw/zinc/03/24/96/520032496.db2.gz PGBJMUFWOBNICK-UHFFFAOYSA-N 1 1 363.311 2.731 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@@H+]3C[C@H](O)C[C@@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588234 520037062 /nfs/dbraw/zinc/03/70/62/520037062.db2.gz VPBIBLVAIPSIOT-HZPDHXFCSA-N 1 1 374.462 2.982 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@H+]3C[C@H](O)C[C@@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000612588234 520037065 /nfs/dbraw/zinc/03/70/65/520037065.db2.gz VPBIBLVAIPSIOT-HZPDHXFCSA-N 1 1 374.462 2.982 20 5 FFBDMO Cc1c(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000616492521 520038927 /nfs/dbraw/zinc/03/89/27/520038927.db2.gz ZEACTIVWVURZJA-SFHVURJKSA-N 1 1 354.410 2.579 20 5 FFBDMO Cc1c(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000616492521 520038935 /nfs/dbraw/zinc/03/89/35/520038935.db2.gz ZEACTIVWVURZJA-SFHVURJKSA-N 1 1 354.410 2.579 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597584051 520120123 /nfs/dbraw/zinc/12/01/23/520120123.db2.gz XDEXLKHBFNKQSG-HUUCEWRRSA-N 1 1 367.446 2.965 20 5 FFBDMO Cn1cc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608836180 520140557 /nfs/dbraw/zinc/14/05/57/520140557.db2.gz NDFQMCOSAKMQIW-FUHWJXTLSA-N 1 1 355.442 2.712 20 5 FFBDMO COCC[N@@H+](C)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000608885617 520155858 /nfs/dbraw/zinc/15/58/58/520155858.db2.gz ASZFJZCYQPVANU-UHFFFAOYSA-N 1 1 357.410 2.816 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000600297806 520189683 /nfs/dbraw/zinc/18/96/83/520189683.db2.gz FXFBUTKHUBKIQL-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000600297806 520189688 /nfs/dbraw/zinc/18/96/88/520189688.db2.gz FXFBUTKHUBKIQL-SFHVURJKSA-N 1 1 369.421 2.537 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000597714282 520193438 /nfs/dbraw/zinc/19/34/38/520193438.db2.gz HZDKMWJJVXRDRV-KRWDZBQOSA-N 1 1 351.834 2.735 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000600312984 520199307 /nfs/dbraw/zinc/19/93/07/520199307.db2.gz WLWOOBSJYFPCDH-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO Nc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)ccn1 ZINC000592132271 520208227 /nfs/dbraw/zinc/20/82/27/520208227.db2.gz GIPMEKOFEBFPOU-QAQDUYKDSA-N 1 1 356.426 2.708 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](CCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000609203913 520232048 /nfs/dbraw/zinc/23/20/48/520232048.db2.gz CURRJFLYFXOSSC-NSHDSACASA-N 1 1 360.357 2.799 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](CCO)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000609203913 520232052 /nfs/dbraw/zinc/23/20/52/520232052.db2.gz CURRJFLYFXOSSC-NSHDSACASA-N 1 1 360.357 2.799 20 5 FFBDMO COCc1csc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c1 ZINC000594982616 520242920 /nfs/dbraw/zinc/24/29/20/520242920.db2.gz BRNSSDMEEXERRF-UHFFFAOYSA-N 1 1 350.396 2.864 20 5 FFBDMO CC1(C)[C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@@H]1[NH+]1CCOCC1 ZINC000603408390 520252964 /nfs/dbraw/zinc/25/29/64/520252964.db2.gz WZGXXCLGHILQDW-NEPJUHHUSA-N 1 1 363.443 2.511 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000600472748 520278670 /nfs/dbraw/zinc/27/86/70/520278670.db2.gz PMXQUFWGEPMFHH-OAHLLOKOSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000597855998 520284835 /nfs/dbraw/zinc/28/48/35/520284835.db2.gz UIEKUYDYJJWXMU-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000597861703 520289050 /nfs/dbraw/zinc/28/90/50/520289050.db2.gz VRCWMCMZMRWYPT-CQSZACIVSA-N 1 1 361.442 2.794 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000597922687 520324242 /nfs/dbraw/zinc/32/42/42/520324242.db2.gz KVKHNSIHLGBGKR-SNVBAGLBSA-N 1 1 370.247 2.960 20 5 FFBDMO CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000609509326 520336673 /nfs/dbraw/zinc/33/66/73/520336673.db2.gz PYUPCEUULQVJHJ-INIZCTEOSA-N 1 1 358.442 2.504 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000603834059 520370967 /nfs/dbraw/zinc/37/09/67/520370967.db2.gz GDTLHDJRDNDHLH-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@]2(CO)CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000609625536 520384988 /nfs/dbraw/zinc/38/49/88/520384988.db2.gz UZZVXBOFQPTBSW-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1cccc(CN[C@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)c1 ZINC000609625536 520385000 /nfs/dbraw/zinc/38/50/00/520385000.db2.gz UZZVXBOFQPTBSW-HXUWFJFHSA-N 1 1 355.438 2.712 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592493034 520415554 /nfs/dbraw/zinc/41/55/54/520415554.db2.gz MUNIEVNUEFMLNL-OAGGEKHMSA-N 1 1 360.458 2.633 20 5 FFBDMO COc1ccccc1NC(=O)C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595358305 520428268 /nfs/dbraw/zinc/42/82/68/520428268.db2.gz SZZZLLRMSSBDQN-UHFFFAOYSA-N 1 1 374.397 2.751 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000598194743 520484825 /nfs/dbraw/zinc/48/48/25/520484825.db2.gz HKQNWLCVDRMTOC-IBGZPJMESA-N 1 1 353.422 2.984 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000609963931 520492216 /nfs/dbraw/zinc/49/22/16/520492216.db2.gz JQVKYJWUSCZYCS-CHWSQXEVSA-N 1 1 350.419 2.841 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595508391 520518535 /nfs/dbraw/zinc/51/85/35/520518535.db2.gz XBUZXHNZZHOQEC-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO C[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000600991550 520579202 /nfs/dbraw/zinc/57/92/02/520579202.db2.gz CHKBNJBWPPSYFS-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO C[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000600991550 520579206 /nfs/dbraw/zinc/57/92/06/520579206.db2.gz CHKBNJBWPPSYFS-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000592881159 520631341 /nfs/dbraw/zinc/63/13/41/520631341.db2.gz LARBFAFOMAIVRK-APWZRJJASA-N 1 1 353.422 2.978 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000601136224 520654594 /nfs/dbraw/zinc/65/45/94/520654594.db2.gz YPOKGANREVMGHG-LLVKDONJSA-N 1 1 355.320 2.946 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000601136224 520654602 /nfs/dbraw/zinc/65/46/02/520654602.db2.gz YPOKGANREVMGHG-LLVKDONJSA-N 1 1 355.320 2.946 20 5 FFBDMO C[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCO ZINC000595694715 520655175 /nfs/dbraw/zinc/65/51/75/520655175.db2.gz FHZLSRMHFJOYHQ-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCO ZINC000595694715 520655181 /nfs/dbraw/zinc/65/51/81/520655181.db2.gz FHZLSRMHFJOYHQ-SMDDNHRTSA-N 1 1 355.822 2.670 20 5 FFBDMO COc1ccc(CC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598508291 520666297 /nfs/dbraw/zinc/66/62/97/520666297.db2.gz FWOBNFQUMBHAQK-QGZVFWFLSA-N 1 1 369.421 2.537 20 5 FFBDMO O=C1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CN1CCC(F)(F)F ZINC000601171079 520670090 /nfs/dbraw/zinc/67/00/90/520670090.db2.gz HJLIKPLRBHUWNI-UHFFFAOYSA-N 1 1 354.288 2.702 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598511957 520671940 /nfs/dbraw/zinc/67/19/40/520671940.db2.gz VMUQXLQXTJDHGC-IBGZPJMESA-N 1 1 353.422 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598512066 520672214 /nfs/dbraw/zinc/67/22/14/520672214.db2.gz WNFYSZDEKSFVKB-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598512066 520672219 /nfs/dbraw/zinc/67/22/19/520672219.db2.gz WNFYSZDEKSFVKB-INIZCTEOSA-N 1 1 355.394 2.608 20 5 FFBDMO C[C@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422073 520676714 /nfs/dbraw/zinc/67/67/14/520676714.db2.gz UQBGJHKCKVKUQR-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610422073 520676721 /nfs/dbraw/zinc/67/67/21/520676721.db2.gz UQBGJHKCKVKUQR-JXFKEZNVSA-N 1 1 355.438 2.882 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@H](C)O)C2CCCCC2)c1 ZINC000593012434 520684523 /nfs/dbraw/zinc/68/45/23/520684523.db2.gz XDKKXIWRCUAKIA-ZDUSSCGKSA-N 1 1 350.415 2.897 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]2(CO)CC(C)C)c1 ZINC000593027073 520691643 /nfs/dbraw/zinc/69/16/43/520691643.db2.gz KMWCHIGLWYWGSN-GOSISDBHSA-N 1 1 350.415 2.754 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]([C@H]2CCCCO2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595788976 520725226 /nfs/dbraw/zinc/72/52/26/520725226.db2.gz ORIQCFFAMLUADY-QFBILLFUSA-N 1 1 373.453 2.765 20 5 FFBDMO Cc1c2cccc(C)c2oc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000593088236 520734546 /nfs/dbraw/zinc/73/45/46/520734546.db2.gz YMYXUUKJHNCTHE-OAHLLOKOSA-N 1 1 358.398 2.647 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC000593089824 520737217 /nfs/dbraw/zinc/73/72/17/520737217.db2.gz FNPKDMTXTORGOH-RDJZCZTQSA-N 1 1 356.422 2.996 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(C)c1[N+](=O)[O-] ZINC000598614146 520743394 /nfs/dbraw/zinc/74/33/94/520743394.db2.gz JJHPMTKDTRHMQR-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)CC[C@@H]21 ZINC000601334229 520745762 /nfs/dbraw/zinc/74/57/62/520745762.db2.gz ZGEFKMFZJJSQQB-YJBOKZPZSA-N 1 1 357.454 2.959 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCc2ccc(F)cc21 ZINC000593115668 520756299 /nfs/dbraw/zinc/75/62/99/520756299.db2.gz HVAFFFIEQSGEEU-GFCCVEGCSA-N 1 1 357.385 2.995 20 5 FFBDMO CCOc1ccc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)nn1 ZINC000595890486 520797330 /nfs/dbraw/zinc/79/73/30/520797330.db2.gz HNAWQWJDUDJKAI-OAHLLOKOSA-N 1 1 371.441 2.975 20 5 FFBDMO COc1cc(NC2CC[NH+](CCN(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596075952 520897716 /nfs/dbraw/zinc/89/77/16/520897716.db2.gz KTKBWALEVVSIOZ-UHFFFAOYSA-N 1 1 356.854 2.695 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951112 520917904 /nfs/dbraw/zinc/91/79/04/520917904.db2.gz GZESEVVKGXVFRX-TZMCWYRMSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951112 520917916 /nfs/dbraw/zinc/91/79/16/520917916.db2.gz GZESEVVKGXVFRX-TZMCWYRMSA-N 1 1 361.446 2.530 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000610951112 520917922 /nfs/dbraw/zinc/91/79/22/520917922.db2.gz GZESEVVKGXVFRX-TZMCWYRMSA-N 1 1 361.446 2.530 20 5 FFBDMO Cc1c(Br)cc(C(=O)NCC[N@@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000611073032 520970737 /nfs/dbraw/zinc/97/07/37/520970737.db2.gz QPHPRSPAYSVQSS-SNVBAGLBSA-N 1 1 370.247 2.737 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088388 520978988 /nfs/dbraw/zinc/97/89/88/520978988.db2.gz SQJUMBBDZHYDKW-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088388 520978997 /nfs/dbraw/zinc/97/89/97/520978997.db2.gz SQJUMBBDZHYDKW-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000611092118 520980797 /nfs/dbraw/zinc/98/07/97/520980797.db2.gz JDHZPBLESAPXLX-NWDGAFQWSA-N 1 1 354.838 2.601 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000611181773 521028087 /nfs/dbraw/zinc/02/80/87/521028087.db2.gz SYRPHOVZYWXYOG-UHFFFAOYSA-N 1 1 369.469 2.518 20 5 FFBDMO CN1CCC[N@H+](CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000611181773 521028094 /nfs/dbraw/zinc/02/80/94/521028094.db2.gz SYRPHOVZYWXYOG-UHFFFAOYSA-N 1 1 369.469 2.518 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000611181773 521028103 /nfs/dbraw/zinc/02/81/03/521028103.db2.gz SYRPHOVZYWXYOG-UHFFFAOYSA-N 1 1 369.469 2.518 20 5 FFBDMO CC(C)[NH+]1CCN([C@H]2CCN(C/C=C\c3ccccc3[N+](=O)[O-])C2)CC1 ZINC000611276066 521075751 /nfs/dbraw/zinc/07/57/51/521075751.db2.gz JVUMXUPXUYEJOG-WPGJWXSHSA-N 1 1 358.486 2.708 20 5 FFBDMO CN1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000611296743 521086201 /nfs/dbraw/zinc/08/62/01/521086201.db2.gz KILHHAXJBDGYGK-UHFFFAOYSA-N 1 1 358.389 2.636 20 5 FFBDMO C[N@@H+]1CCCN(CCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000611296743 521086203 /nfs/dbraw/zinc/08/62/03/521086203.db2.gz KILHHAXJBDGYGK-UHFFFAOYSA-N 1 1 358.389 2.636 20 5 FFBDMO C[N@H+]1CCCN(CCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000611296743 521086212 /nfs/dbraw/zinc/08/62/12/521086212.db2.gz KILHHAXJBDGYGK-UHFFFAOYSA-N 1 1 358.389 2.636 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000596559589 521132005 /nfs/dbraw/zinc/13/20/05/521132005.db2.gz ZMVCUNROLAUCJV-OAHLLOKOSA-N 1 1 370.409 2.853 20 5 FFBDMO CS(=O)(=O)c1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596570440 521138356 /nfs/dbraw/zinc/13/83/56/521138356.db2.gz LCAIPLJARBFHSJ-AWEZNQCLSA-N 1 1 367.471 2.532 20 5 FFBDMO Cn1ncc2c1CC(C)(C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000596598726 521155980 /nfs/dbraw/zinc/15/59/80/521155980.db2.gz NXNDVAZOPLYTMC-UHFFFAOYSA-N 1 1 371.441 2.741 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000596633796 521178797 /nfs/dbraw/zinc/17/87/97/521178797.db2.gz BYGQTJNOJGOFHV-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)c(N2CCCC2)[nH+]1 ZINC000611572180 521225464 /nfs/dbraw/zinc/22/54/64/521225464.db2.gz KOEWHLWHEDWFNP-UHFFFAOYSA-N 1 1 355.398 2.532 20 5 FFBDMO CC1(C)CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1CCO ZINC000615140576 521290030 /nfs/dbraw/zinc/29/00/30/521290030.db2.gz YNVKMAWBRFCQLW-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1CCO ZINC000615140576 521290041 /nfs/dbraw/zinc/29/00/41/521290041.db2.gz YNVKMAWBRFCQLW-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCN1CCO ZINC000615140576 521290050 /nfs/dbraw/zinc/29/00/50/521290050.db2.gz YNVKMAWBRFCQLW-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553700 521295344 /nfs/dbraw/zinc/29/53/44/521295344.db2.gz YXQSJJWVXPMCRV-YUTCNCBUSA-N 1 1 365.455 2.900 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553700 521295356 /nfs/dbraw/zinc/29/53/56/521295356.db2.gz YXQSJJWVXPMCRV-YUTCNCBUSA-N 1 1 365.455 2.900 20 5 FFBDMO Cn1cc(C[N@@H+](C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)c([N+](=O)[O-])n1 ZINC000602454815 521356280 /nfs/dbraw/zinc/35/62/80/521356280.db2.gz QLJCPEVJDQNUGC-UHFFFAOYSA-N 1 1 372.404 2.922 20 5 FFBDMO COc1cccc2c1C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C2 ZINC000599645232 521357053 /nfs/dbraw/zinc/35/70/53/521357053.db2.gz OCVLNTBPXIDELI-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO COc1cccc2c1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C2 ZINC000599645232 521357062 /nfs/dbraw/zinc/35/70/62/521357062.db2.gz OCVLNTBPXIDELI-UHFFFAOYSA-N 1 1 371.393 2.956 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCc2c(O)cccc2C1 ZINC000599647514 521359683 /nfs/dbraw/zinc/35/96/83/521359683.db2.gz PVNTWDAEGXTTRD-UHFFFAOYSA-N 1 1 369.377 2.657 20 5 FFBDMO COC(=O)[C@@](C)(NC[C@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000599651141 521361184 /nfs/dbraw/zinc/36/11/84/521361184.db2.gz HGTMWXDGPBRPEN-MJGOQNOKSA-N 1 1 363.458 2.836 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000596899114 521367153 /nfs/dbraw/zinc/36/71/53/521367153.db2.gz BSSJJSSPAIMOEH-LLVKDONJSA-N 1 1 371.235 2.963 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000599659916 521373151 /nfs/dbraw/zinc/37/31/51/521373151.db2.gz LSMQKTVMFWJUDU-VHSXEESVSA-N 1 1 368.231 2.712 20 5 FFBDMO CCOC(=O)CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000594051109 521374576 /nfs/dbraw/zinc/37/45/76/521374576.db2.gz LZJYANGSSUNHSD-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO O=[N+]([O-])c1sc(CNC[C@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000602508694 521386986 /nfs/dbraw/zinc/38/69/86/521386986.db2.gz DNGNTHITBGZJCE-SECBINFHSA-N 1 1 360.277 2.993 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(CNC3CC[NH+](Cc4ccccn4)CC3)nc2c1 ZINC000602517158 521390894 /nfs/dbraw/zinc/39/08/94/521390894.db2.gz WLQODYLZKUWSFL-UHFFFAOYSA-N 1 1 367.409 2.885 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC[N@H+]1C ZINC000607688857 521430378 /nfs/dbraw/zinc/43/03/78/521430378.db2.gz YRGSADQOVQSAEQ-HZPDHXFCSA-N 1 1 363.461 2.754 20 5 FFBDMO Cc1nc2ccccc2n1C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC000602638560 521451207 /nfs/dbraw/zinc/45/12/07/521451207.db2.gz PJNPWNJJLYYXKT-UHFFFAOYSA-N 1 1 354.414 2.824 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599770870 521459768 /nfs/dbraw/zinc/45/97/68/521459768.db2.gz CZDQPROOWYVBDO-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn(C[C@@H]4CCOC4)nn3)C2)cc1 ZINC000602686598 521479348 /nfs/dbraw/zinc/47/93/48/521479348.db2.gz XULPULULSIWRCD-RDJZCZTQSA-N 1 1 371.441 2.602 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cn(C[C@@H]4CCOC4)nn3)C2)cc1 ZINC000602686598 521479359 /nfs/dbraw/zinc/47/93/59/521479359.db2.gz XULPULULSIWRCD-RDJZCZTQSA-N 1 1 371.441 2.602 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599830656 521499146 /nfs/dbraw/zinc/49/91/46/521499146.db2.gz WGIBPAJTDDCFSM-CYBMUJFWSA-N 1 1 357.414 2.949 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)C2)C1 ZINC000599836794 521502900 /nfs/dbraw/zinc/50/29/00/521502900.db2.gz YKNYJVDXEMFNOE-SFHVURJKSA-N 1 1 355.398 2.703 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1nc2ccccc2n1C ZINC000602794380 521535857 /nfs/dbraw/zinc/53/58/57/521535857.db2.gz WJLMBHCZVNRODI-INIZCTEOSA-N 1 1 354.414 2.824 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C ZINC000602794380 521535865 /nfs/dbraw/zinc/53/58/65/521535865.db2.gz WJLMBHCZVNRODI-INIZCTEOSA-N 1 1 354.414 2.824 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)C[C@H](O)C(F)(F)F ZINC000602805989 521543923 /nfs/dbraw/zinc/54/39/23/521543923.db2.gz KPQPQKDQOYOVKD-AWEZNQCLSA-N 1 1 372.347 2.525 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccccc1)C[C@H](O)C(F)(F)F ZINC000602805989 521543931 /nfs/dbraw/zinc/54/39/31/521543931.db2.gz KPQPQKDQOYOVKD-AWEZNQCLSA-N 1 1 372.347 2.525 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)o1 ZINC000597173054 521553930 /nfs/dbraw/zinc/55/39/30/521553930.db2.gz CXMACPSGGBPNCI-AWEZNQCLSA-N 1 1 353.382 2.968 20 5 FFBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC000602831453 521558183 /nfs/dbraw/zinc/55/81/83/521558183.db2.gz XOMBZEKCWDRYLJ-OAHLLOKOSA-N 1 1 360.414 2.652 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000602844495 521566096 /nfs/dbraw/zinc/56/60/96/521566096.db2.gz VBYCSUWJEXWYCG-SFHVURJKSA-N 1 1 356.426 2.953 20 5 FFBDMO O=C1CC[C@@H]2C[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]2N1 ZINC000597205843 521572610 /nfs/dbraw/zinc/57/26/10/521572610.db2.gz LICKEDIRTPREGB-CJNGLKHVSA-N 1 1 372.450 2.819 20 5 FFBDMO O=C1CC[C@@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)CC[C@@H]2N1 ZINC000597205843 521572615 /nfs/dbraw/zinc/57/26/15/521572615.db2.gz LICKEDIRTPREGB-CJNGLKHVSA-N 1 1 372.450 2.819 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597232088 521586787 /nfs/dbraw/zinc/58/67/87/521586787.db2.gz PJXUXYCZAZQBNM-GFCCVEGCSA-N 1 1 371.384 2.933 20 5 FFBDMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597232088 521586790 /nfs/dbraw/zinc/58/67/90/521586790.db2.gz PJXUXYCZAZQBNM-GFCCVEGCSA-N 1 1 371.384 2.933 20 5 FFBDMO Nc1cc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(CO)c1[N+](=O)[O-] ZINC000619570347 521775667 /nfs/dbraw/zinc/77/56/67/521775667.db2.gz VIKQWKYBQVENMO-MRXNPFEDSA-N 1 1 356.426 2.746 20 5 FFBDMO O=[N+]([O-])c1ccc(F)cc1C[NH2+]C1(c2cccc(-c3nn[nH]n3)c2)CC1 ZINC000826498123 608530040 /nfs/dbraw/zinc/53/00/40/608530040.db2.gz IEINJFOWXXMGLV-UHFFFAOYSA-N 1 1 354.345 2.693 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)nn2)cc1 ZINC001164767933 721298029 /nfs/dbraw/zinc/29/80/29/721298029.db2.gz CCUNPXKKMURGLR-UHFFFAOYSA-N 1 1 365.437 2.974 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](CCOc3ccccc3)CC2)n1 ZINC000542864670 721957107 /nfs/dbraw/zinc/95/71/07/721957107.db2.gz JELVMBDBFQHHQX-UHFFFAOYSA-N 1 1 356.426 2.808 20 5 FFBDMO CCOc1nc(N2CC[NH+](CCOc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC001165045544 721958545 /nfs/dbraw/zinc/95/85/45/721958545.db2.gz XNCTUYMJZRFWRV-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CCC[N@H+](CCF)C1 ZINC000899221964 735461726 /nfs/dbraw/zinc/46/17/26/735461726.db2.gz ZYDZGDVLKWNOGY-GFCCVEGCSA-N 1 1 357.813 2.731 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@@H]1CCC[N@@H+](CCF)C1 ZINC000899221964 735461727 /nfs/dbraw/zinc/46/17/27/735461727.db2.gz ZYDZGDVLKWNOGY-GFCCVEGCSA-N 1 1 357.813 2.731 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCOCC1 ZINC000746672764 735504009 /nfs/dbraw/zinc/50/40/09/735504009.db2.gz IRCBMYSLLJKQJV-UHFFFAOYSA-N 1 1 356.806 2.792 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000172175829 729021105 /nfs/dbraw/zinc/02/11/05/729021105.db2.gz OKAPNEZBENBSTM-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000172175829 729021106 /nfs/dbraw/zinc/02/11/06/729021106.db2.gz OKAPNEZBENBSTM-CYBMUJFWSA-N 1 1 351.834 2.986 20 5 FFBDMO COCCOC[C@@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000173395908 729046157 /nfs/dbraw/zinc/04/61/57/729046157.db2.gz XKFWXMQHJBWYBM-GFCCVEGCSA-N 1 1 367.427 2.814 20 5 FFBDMO COCCOC[C@@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C1 ZINC000173395908 729046159 /nfs/dbraw/zinc/04/61/59/729046159.db2.gz XKFWXMQHJBWYBM-GFCCVEGCSA-N 1 1 367.427 2.814 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)CNC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] ZINC000778949680 738423830 /nfs/dbraw/zinc/42/38/30/738423830.db2.gz RKHNKDPVORXXOY-LBPRGKRZSA-N 1 1 353.419 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@H](O)c3cccc(Cl)c3)C2)nc1 ZINC000245459831 729570255 /nfs/dbraw/zinc/57/02/55/729570255.db2.gz VNGRFLOADNRNHV-ZBFHGGJFSA-N 1 1 362.817 2.863 20 5 FFBDMO CC(C)OCC[NH+]1CCN(c2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000856733734 730351620 /nfs/dbraw/zinc/35/16/20/730351620.db2.gz FMSSAHFTYGLFQM-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000856799201 730358547 /nfs/dbraw/zinc/35/85/47/730358547.db2.gz AUGGSWOJWQQVNV-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@H](C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860098866 730476274 /nfs/dbraw/zinc/47/62/74/730476274.db2.gz TZKHPGNVKRRTAD-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1Cl ZINC000866205021 731040514 /nfs/dbraw/zinc/04/05/14/731040514.db2.gz IUDIKVAHRIGUDD-ZWNOBZJWSA-N 1 1 353.806 2.565 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000868480608 731296509 /nfs/dbraw/zinc/29/65/09/731296509.db2.gz BKYOBZYYSPJTDA-UKRRQHHQSA-N 1 1 366.849 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)CN1CCN(C)CC1 ZINC000872030849 731722454 /nfs/dbraw/zinc/72/24/54/731722454.db2.gz CQXDEILGHXSOIL-HUUCEWRRSA-N 1 1 366.531 2.851 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000872033930 731723042 /nfs/dbraw/zinc/72/30/42/731723042.db2.gz KKZZUQLTOWVPST-AEGPPILISA-N 1 1 351.472 2.831 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CN2CCC[C@H]2CO1 ZINC000872033930 731723045 /nfs/dbraw/zinc/72/30/45/731723045.db2.gz KKZZUQLTOWVPST-AEGPPILISA-N 1 1 351.472 2.831 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000874825156 732104010 /nfs/dbraw/zinc/10/40/10/732104010.db2.gz WZQRPJNHULKEAN-RYUDHWBXSA-N 1 1 368.231 2.666 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cc1SC ZINC000874835769 732105358 /nfs/dbraw/zinc/10/53/58/732105358.db2.gz ADXAQSOGIOANTC-STQMWFEESA-N 1 1 365.455 2.634 20 5 FFBDMO CSC(C)(C)CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 ZINC000876616210 732262102 /nfs/dbraw/zinc/26/21/02/732262102.db2.gz UNNPXWBIRAEDOH-UHFFFAOYSA-N 1 1 357.501 2.946 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC000877608632 732397907 /nfs/dbraw/zinc/39/79/07/732397907.db2.gz XSWINDXCVVUBAF-OAHLLOKOSA-N 1 1 359.348 2.712 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000878174955 732493660 /nfs/dbraw/zinc/49/36/60/732493660.db2.gz VPFNSNXRVBUXTM-KGLIPLIRSA-N 1 1 350.444 2.749 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000878943489 732619547 /nfs/dbraw/zinc/61/95/47/732619547.db2.gz GTMAWIDEYVWBED-LSDHHAIUSA-N 1 1 361.364 2.587 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2CSC[C@@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560076 732723364 /nfs/dbraw/zinc/72/33/64/732723364.db2.gz FBLCDMGVUDYBIW-QWRGUYRKSA-N 1 1 355.847 2.872 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2CSC[C@@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879560076 732723366 /nfs/dbraw/zinc/72/33/66/732723366.db2.gz FBLCDMGVUDYBIW-QWRGUYRKSA-N 1 1 355.847 2.872 20 5 FFBDMO CC(C)[C@H]1CN([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000879601312 732731605 /nfs/dbraw/zinc/73/16/05/732731605.db2.gz NVDJSXXORJWGGT-BLLLJJGKSA-N 1 1 368.865 2.847 20 5 FFBDMO CCc1ncc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000883288071 733360544 /nfs/dbraw/zinc/36/05/44/733360544.db2.gz QEMYHAZCOOZXCO-UHFFFAOYSA-N 1 1 351.204 3.000 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000886201777 733759317 /nfs/dbraw/zinc/75/93/17/733759317.db2.gz QQNJSUXFTBDGEB-OAHLLOKOSA-N 1 1 366.215 2.750 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827068 733845022 /nfs/dbraw/zinc/84/50/22/733845022.db2.gz CROXUMUWUQGQMB-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827068 733845024 /nfs/dbraw/zinc/84/50/24/733845024.db2.gz CROXUMUWUQGQMB-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095118 738821353 /nfs/dbraw/zinc/82/13/53/738821353.db2.gz MXWARXGLFCHIQZ-OLZOCXBDSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc(Cl)c1[N+](=O)[O-] ZINC000928095118 738821355 /nfs/dbraw/zinc/82/13/55/738821355.db2.gz MXWARXGLFCHIQZ-OLZOCXBDSA-N 1 1 355.847 2.558 20 5 FFBDMO C[C@]1(Br)C[C@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078500 734512643 /nfs/dbraw/zinc/51/26/43/734512643.db2.gz NNZPRCFSJWHBIQ-MJVIPROJSA-N 1 1 355.236 2.650 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000732036538 734713345 /nfs/dbraw/zinc/71/33/45/734713345.db2.gz SNYSNNBURRBCSF-LBPRGKRZSA-N 1 1 368.231 2.666 20 5 FFBDMO CN1CC[N@@H+](C)C[C@@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000732050625 734714461 /nfs/dbraw/zinc/71/44/61/734714461.db2.gz XVLWOVVDPSKBSL-VIFPVBQESA-N 1 1 366.771 2.925 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1[N+](=O)[O-] ZINC000894700176 734902675 /nfs/dbraw/zinc/90/26/75/734902675.db2.gz LQEGBWJLNCSPAL-ZNMIVQPWSA-N 1 1 350.415 2.825 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC000900284428 735623948 /nfs/dbraw/zinc/62/39/48/735623948.db2.gz TXIMBWHWHSCWLP-SECBINFHSA-N 1 1 354.769 2.958 20 5 FFBDMO COc1cc(C(=O)OCC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1OC ZINC000752449330 735987271 /nfs/dbraw/zinc/98/72/71/735987271.db2.gz WJAXBYXMHRHCJZ-LBPRGKRZSA-N 1 1 352.387 2.643 20 5 FFBDMO CO[C@]1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCSC1 ZINC000903315102 736074530 /nfs/dbraw/zinc/07/45/30/736074530.db2.gz SHMIEESRPDZKRN-WBVHZDCISA-N 1 1 362.455 2.529 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000756778359 736361203 /nfs/dbraw/zinc/36/12/03/736361203.db2.gz UZWDZKMYAJTNRK-LBPRGKRZSA-N 1 1 354.838 2.922 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000906791357 736543865 /nfs/dbraw/zinc/54/38/65/736543865.db2.gz LCGAMOLJBKMBBK-ZWNOBZJWSA-N 1 1 354.838 2.633 20 5 FFBDMO O=C(C[NH+]1CCC2(CCOC2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761060466 736691806 /nfs/dbraw/zinc/69/18/06/736691806.db2.gz VTOSGGCZPXESON-UHFFFAOYSA-N 1 1 353.806 2.689 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCS(=O)(=O)CC1CC1 ZINC000811484713 741528544 /nfs/dbraw/zinc/52/85/44/741528544.db2.gz HRAFTOAELQEQOK-UHFFFAOYSA-N 1 1 367.254 2.816 20 5 FFBDMO CC[C@@H](CSC)[N@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000773255734 737885693 /nfs/dbraw/zinc/88/56/93/737885693.db2.gz OKUZMDKAIBIMJF-AWEZNQCLSA-N 1 1 364.471 2.887 20 5 FFBDMO CC[C@@H](CSC)[N@@H+](C)Cn1cc(C)n(-c2ccccc2[N+](=O)[O-])c1=O ZINC000773255734 737885698 /nfs/dbraw/zinc/88/56/98/737885698.db2.gz OKUZMDKAIBIMJF-AWEZNQCLSA-N 1 1 364.471 2.887 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774639138 738008370 /nfs/dbraw/zinc/00/83/70/738008370.db2.gz UATZRHUYRBJQGC-HNNXBMFYSA-N 1 1 351.838 2.827 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546172 738976075 /nfs/dbraw/zinc/97/60/75/738976075.db2.gz NBWHLJPGIHJFMU-UHIISALHSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000785546172 738976079 /nfs/dbraw/zinc/97/60/79/738976079.db2.gz NBWHLJPGIHJFMU-UHIISALHSA-N 1 1 355.822 2.668 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700841 739313819 /nfs/dbraw/zinc/31/38/19/739313819.db2.gz ZPBRZOUTUMTEJK-UONOGXRCSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700841 739313823 /nfs/dbraw/zinc/31/38/23/739313823.db2.gz ZPBRZOUTUMTEJK-UONOGXRCSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700840 739313897 /nfs/dbraw/zinc/31/38/97/739313897.db2.gz ZPBRZOUTUMTEJK-KGLIPLIRSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Br ZINC000931700840 739313902 /nfs/dbraw/zinc/31/39/02/739313902.db2.gz ZPBRZOUTUMTEJK-KGLIPLIRSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@]1([C@H]2CCC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)COC(=O)N1 ZINC000932024290 739375541 /nfs/dbraw/zinc/37/55/41/739375541.db2.gz IEMTYIBALDGTQC-LRDDRELGSA-N 1 1 353.806 2.959 20 5 FFBDMO CC(C)(C)c1csc(CC2(O)C[C@H]3CC[C@@H](C2)[N@@H+]3CC[N+](=O)[O-])n1 ZINC000932751857 739509237 /nfs/dbraw/zinc/50/92/37/739509237.db2.gz XVDREMIBMJOPRF-MPYYAJLASA-N 1 1 353.488 2.618 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@H]1C ZINC000933371286 739611589 /nfs/dbraw/zinc/61/15/89/739611589.db2.gz SKBDCAAALVHGIP-ZJUUUORDSA-N 1 1 372.828 2.914 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1 ZINC000791994689 739623807 /nfs/dbraw/zinc/62/38/07/739623807.db2.gz LMTSUEPEYRLEAO-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000933436616 739624781 /nfs/dbraw/zinc/62/47/81/739624781.db2.gz USEFGVWPLFOPOW-SWLSCSKDSA-N 1 1 353.850 2.979 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334720 739767563 /nfs/dbraw/zinc/76/75/63/739767563.db2.gz FSIZCLPIOXMAJD-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334720 739767567 /nfs/dbraw/zinc/76/75/67/739767567.db2.gz FSIZCLPIOXMAJD-OLZOCXBDSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000934392855 739780464 /nfs/dbraw/zinc/78/04/64/739780464.db2.gz CYLOKQWSEZAZSV-VXGBXAGGSA-N 1 1 351.834 2.922 20 5 FFBDMO C[C@@]1(C2CC2)COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000934477434 739790546 /nfs/dbraw/zinc/79/05/46/739790546.db2.gz JRFOLSHILRWJSI-KRWDZBQOSA-N 1 1 351.378 2.563 20 5 FFBDMO C[N@H+](CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O)C1CCC1 ZINC000795432831 740021389 /nfs/dbraw/zinc/02/13/89/740021389.db2.gz QACZEQYYXCGQEE-UHFFFAOYSA-N 1 1 354.204 2.755 20 5 FFBDMO C[N@@H+](CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O)C1CCC1 ZINC000795432831 740021391 /nfs/dbraw/zinc/02/13/91/740021391.db2.gz QACZEQYYXCGQEE-UHFFFAOYSA-N 1 1 354.204 2.755 20 5 FFBDMO Cc1ccc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c([N+](=O)[O-])c1Br ZINC000804397639 740869105 /nfs/dbraw/zinc/86/91/05/740869105.db2.gz ZXWNVOBOFGMAEE-VXGBXAGGSA-N 1 1 370.247 2.941 20 5 FFBDMO CC(C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl)[NH+]1CCOCC1 ZINC000809920570 741361000 /nfs/dbraw/zinc/36/10/00/741361000.db2.gz WHEVWEHLQQBYIQ-AWEZNQCLSA-N 1 1 370.837 2.727 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000816845377 742066119 /nfs/dbraw/zinc/06/61/19/742066119.db2.gz LWJBSUAEMDUTID-GFCCVEGCSA-N 1 1 362.817 2.974 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@H]1CCC[N@H+]1C ZINC000817292264 742118731 /nfs/dbraw/zinc/11/87/31/742118731.db2.gz SCQNKSBOEBBGRS-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1cccc(Cl)c1C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001001400532 742118830 /nfs/dbraw/zinc/11/88/30/742118830.db2.gz UAVGGKVSVWUPRZ-RHSMWYFYSA-N 1 1 365.861 2.642 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC000821564987 742642934 /nfs/dbraw/zinc/64/29/34/742642934.db2.gz ZBQHBWGCPCXCFM-AOOOYVTPSA-N 1 1 371.235 2.914 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccc(Cl)c2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643210 742927662 /nfs/dbraw/zinc/92/76/62/742927662.db2.gz KFLXWFCVDASIHJ-RGCMKSIDSA-N 1 1 369.824 2.661 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC[C@@H]21 ZINC000827296196 743549794 /nfs/dbraw/zinc/54/97/94/743549794.db2.gz CUGGXENDNKZWTD-YGRLFVJLSA-N 1 1 357.332 2.780 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827308980 743552797 /nfs/dbraw/zinc/55/27/97/743552797.db2.gz DTXHRFONAXZOLO-ZWNOBZJWSA-N 1 1 357.332 2.780 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)cc1NC[C@@H]1CCC[N@@H+]1CCCO ZINC000828420519 745065107 /nfs/dbraw/zinc/06/51/07/745065107.db2.gz CPYGIYNKLKKWRE-LBPRGKRZSA-N 1 1 358.236 2.616 20 5 FFBDMO CO[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1(C)C ZINC000831544207 745544543 /nfs/dbraw/zinc/54/45/43/745544543.db2.gz VGZPMERIHMXJJY-CQSZACIVSA-N 1 1 355.822 2.934 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1(C)C ZINC000831544207 745544548 /nfs/dbraw/zinc/54/45/48/745544548.db2.gz VGZPMERIHMXJJY-CQSZACIVSA-N 1 1 355.822 2.934 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498331 746840803 /nfs/dbraw/zinc/84/08/03/746840803.db2.gz SDRUMQMHTUHIIQ-LSDHHAIUSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498331 746840811 /nfs/dbraw/zinc/84/08/11/746840811.db2.gz SDRUMQMHTUHIIQ-LSDHHAIUSA-N 1 1 355.822 2.812 20 5 FFBDMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000839643771 746880682 /nfs/dbraw/zinc/88/06/82/746880682.db2.gz SXSNGFMIFXLDEY-SFHVURJKSA-N 1 1 359.813 2.877 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]2(CC2(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000844440841 748030996 /nfs/dbraw/zinc/03/09/96/748030996.db2.gz UQCBWCZHJDUAKY-MRXNPFEDSA-N 1 1 351.353 2.605 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CC2(F)F)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000844440841 748031001 /nfs/dbraw/zinc/03/10/01/748031001.db2.gz UQCBWCZHJDUAKY-MRXNPFEDSA-N 1 1 351.353 2.605 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3cc(Cl)ccc3[N+](=O)[O-])C2)C1 ZINC000844903343 748133385 /nfs/dbraw/zinc/13/33/85/748133385.db2.gz XQEUCXROZXHCAV-SRCQZFHVSA-N 1 1 353.850 2.967 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000848482173 748937869 /nfs/dbraw/zinc/93/78/69/748937869.db2.gz LDPIZVYBQNXNCJ-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCS[C@H]3COCC[C@H]32)c1 ZINC000848482173 748937875 /nfs/dbraw/zinc/93/78/75/748937875.db2.gz LDPIZVYBQNXNCJ-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910504 749725392 /nfs/dbraw/zinc/72/53/92/749725392.db2.gz COGATNUTLLNXFQ-ZYHUDNBSSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910504 749725397 /nfs/dbraw/zinc/72/53/97/749725397.db2.gz COGATNUTLLNXFQ-ZYHUDNBSSA-N 1 1 354.407 2.626 20 5 FFBDMO Cn1cc([C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C2(CO)CCC2)cn1 ZINC000852073560 749767493 /nfs/dbraw/zinc/76/74/93/749767493.db2.gz UVCULOAOIWVDMC-INIZCTEOSA-N 1 1 364.833 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(C(F)(F)F)c1 ZINC000853966352 750211547 /nfs/dbraw/zinc/21/15/47/750211547.db2.gz SVDBJPXAAWPQKI-CYBMUJFWSA-N 1 1 359.348 2.649 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C2 ZINC000854734896 750361193 /nfs/dbraw/zinc/36/11/93/750361193.db2.gz FRPXFQYXEHUYFI-KRWDZBQOSA-N 1 1 369.824 2.874 20 5 FFBDMO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@H]1C[N@@H+](C)CCN1C ZINC000896569848 971594666 /nfs/dbraw/zinc/59/46/66/971594666.db2.gz JESHXHYSVYJZLD-FOIQADDNSA-N 1 1 362.477 2.752 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001576179855 949929343 /nfs/dbraw/zinc/92/93/43/949929343.db2.gz MHNYZMAIGGBXHL-GFCCVEGCSA-N 1 1 359.434 2.697 20 5 FFBDMO CCCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CC2CC(C)(C)C2)CC1 ZINC001266386352 960196676 /nfs/dbraw/zinc/19/66/76/960196676.db2.gz BOVTXRMQRNOXFD-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CCN1CCN(c2ccc(C[NH2+]Cc3cccc([N+](=O)[O-])c3C)cn2)CC1 ZINC000873015085 1013347785 /nfs/dbraw/zinc/34/77/85/1013347785.db2.gz XXLACTZCXRMNHJ-UHFFFAOYSA-N 1 1 369.469 2.730 20 5 FFBDMO CC[NH+]1CCN(c2ccc(CNCc3cccc([N+](=O)[O-])c3C)cn2)CC1 ZINC000873015085 1013347796 /nfs/dbraw/zinc/34/77/96/1013347796.db2.gz XXLACTZCXRMNHJ-UHFFFAOYSA-N 1 1 369.469 2.730 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H]2CCC[N@@H+]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000825648598 1013356203 /nfs/dbraw/zinc/35/62/03/1013356203.db2.gz VIKNWFHCNQIQOQ-KRWDZBQOSA-N 1 1 354.410 2.579 20 5 FFBDMO Cc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000825648598 1013356213 /nfs/dbraw/zinc/35/62/13/1013356213.db2.gz VIKNWFHCNQIQOQ-KRWDZBQOSA-N 1 1 354.410 2.579 20 5 FFBDMO CCOc1cc(N2CC[NH+](Cc3c(C)ccnc3N)CC2)ccc1[N+](=O)[O-] ZINC000894614724 965524344 /nfs/dbraw/zinc/52/43/44/965524344.db2.gz WOQQMCKOUJTRPZ-UHFFFAOYSA-N 1 1 371.441 2.601 20 5 FFBDMO Cc1nn(C)c(N2CC[NH+](Cc3cccc4cccnc43)CC2)c1[N+](=O)[O-] ZINC000051624786 966401067 /nfs/dbraw/zinc/40/10/67/966401067.db2.gz QMCXRQDMWMHDDH-UHFFFAOYSA-N 1 1 366.425 2.507 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CC2CCCCCC2)CC1 ZINC001270880133 967472026 /nfs/dbraw/zinc/47/20/26/967472026.db2.gz VNUIWRXVUCMAJM-IAGOWNOFSA-N 1 1 351.491 2.840 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001270925154 967823669 /nfs/dbraw/zinc/82/36/69/967823669.db2.gz HZRQEABZRUUDLR-HXUWFJFHSA-N 1 1 368.437 2.940 20 5 FFBDMO COc1c(O)ccc(CNC[C@H](Cc2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000892451169 968845669 /nfs/dbraw/zinc/84/56/69/968845669.db2.gz PQQSEWHZDCFIAD-INIZCTEOSA-N 1 1 359.426 2.572 20 5 FFBDMO Cc1cc(C)c(OC(=O)[C@H]2CC[N@H+](C)C[C@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000875062455 1013960241 /nfs/dbraw/zinc/96/02/41/1013960241.db2.gz UPODVVIIRNWLCB-HOTGVXAUSA-N 1 1 372.425 2.586 20 5 FFBDMO Cc1cc(C)c(OC(=O)[C@@H]2CC[N@H+](C)C[C@@H]2c2cnn(C)c2)c([N+](=O)[O-])c1 ZINC000875062456 1013960329 /nfs/dbraw/zinc/96/03/29/1013960329.db2.gz UPODVVIIRNWLCB-HZPDHXFCSA-N 1 1 372.425 2.586 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccccc2C1)OCc1cc(O)ccc1[N+](=O)[O-] ZINC000837687536 974777508 /nfs/dbraw/zinc/77/75/08/974777508.db2.gz WLEGKDGCJZPYJG-UHFFFAOYSA-N 1 1 356.378 2.792 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCc1cc(O)ccc1[N+](=O)[O-] ZINC000837687536 974777513 /nfs/dbraw/zinc/77/75/13/974777513.db2.gz WLEGKDGCJZPYJG-UHFFFAOYSA-N 1 1 356.378 2.792 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCc2ccc3ccccc3c2)CC1 ZINC000981137629 976263275 /nfs/dbraw/zinc/26/32/75/976263275.db2.gz AVROPBWBMNWPIW-WOJBJXKFSA-N 1 1 367.449 2.582 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCc2ccc3ccccc3c2)CC1 ZINC000981137629 976263285 /nfs/dbraw/zinc/26/32/85/976263285.db2.gz AVROPBWBMNWPIW-WOJBJXKFSA-N 1 1 367.449 2.582 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCc2ccc3ccccc3c2)CC1 ZINC000981137629 976263293 /nfs/dbraw/zinc/26/32/93/976263293.db2.gz AVROPBWBMNWPIW-WOJBJXKFSA-N 1 1 367.449 2.582 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)Nc1nccc2c1cccc2[N+](=O)[O-] ZINC000898461031 976477913 /nfs/dbraw/zinc/47/79/13/976477913.db2.gz CHXQWMFPAWUNAW-UHFFFAOYSA-N 1 1 358.398 2.584 20 5 FFBDMO COC(=O)C[C@@H]1C[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C[C@H]1C ZINC000905711286 980493798 /nfs/dbraw/zinc/49/37/98/980493798.db2.gz DGBZXPCZXDWCAB-ZIAGYGMSSA-N 1 1 358.398 2.547 20 5 FFBDMO Cc1ncccc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000898254675 982654368 /nfs/dbraw/zinc/65/43/68/982654368.db2.gz FOHZDKZNQBNTPM-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001299259085 984049965 /nfs/dbraw/zinc/04/99/65/984049965.db2.gz PNCPEALSGMGABK-UHFFFAOYSA-N 1 1 357.414 2.589 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000151243475 984231478 /nfs/dbraw/zinc/23/14/78/984231478.db2.gz OQEQLHDCXSETEO-UHFFFAOYSA-N 1 1 374.382 2.613 20 5 FFBDMO CC(C)(C)c1ccc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000996429258 984353085 /nfs/dbraw/zinc/35/30/85/984353085.db2.gz NYCUIXRKUWOVRH-QZTJIDSGSA-N 1 1 359.470 2.730 20 5 FFBDMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000764934093 984838384 /nfs/dbraw/zinc/83/83/84/984838384.db2.gz IXNUSRGQTSOASU-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765058980 984955305 /nfs/dbraw/zinc/95/53/05/984955305.db2.gz IHOLRYLAYWNENE-ZDUSSCGKSA-N 1 1 360.414 2.874 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765058980 984955306 /nfs/dbraw/zinc/95/53/06/984955306.db2.gz IHOLRYLAYWNENE-ZDUSSCGKSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000170647132 985103838 /nfs/dbraw/zinc/10/38/38/985103838.db2.gz MBGQBJJRALNNRH-AWEZNQCLSA-N 1 1 365.430 2.820 20 5 FFBDMO COc1cccc([C@@H](C)[NH+]2CCN(Cn3nc(C)c([N+](=O)[O-])c3C)CC2)c1 ZINC000171607620 985334296 /nfs/dbraw/zinc/33/42/96/985334296.db2.gz RMSSJMIXSSVZIV-OAHLLOKOSA-N 1 1 373.457 2.753 20 5 FFBDMO O=[N+]([O-])c1cc(NCC2([NH+]3CCCC3)COC2)ccc1OC(F)(F)F ZINC001168452059 987264239 /nfs/dbraw/zinc/26/42/39/987264239.db2.gz YPKDJSXHRDWELX-UHFFFAOYSA-N 1 1 361.320 2.770 20 5 FFBDMO CC(=O)OC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000153354027 987901255 /nfs/dbraw/zinc/90/12/55/987901255.db2.gz FOKBLMYQPMHZLS-NSHDSACASA-N 1 1 360.370 2.733 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000915512411 988772281 /nfs/dbraw/zinc/77/22/81/988772281.db2.gz RROYPVFDIJPFPX-OAHLLOKOSA-N 1 1 358.398 2.812 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC2(CC1)CC[NH+](C)CC2 ZINC000879249488 1015438917 /nfs/dbraw/zinc/43/89/17/1015438917.db2.gz RRMNSVJBHWCGQX-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO COc1cccc(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000193980867 989124083 /nfs/dbraw/zinc/12/40/83/989124083.db2.gz HVZPYPCJSUWIFC-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C12CCC2 ZINC000763236645 989248527 /nfs/dbraw/zinc/24/85/27/989248527.db2.gz RMGLPYVMHMUEKB-JKSUJKDBSA-N 1 1 359.430 2.885 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](Cc3cc4ccccc4o3)C2)CC1 ZINC001035704550 990528957 /nfs/dbraw/zinc/52/89/57/990528957.db2.gz PNPTXOMIGBTGGF-IAGOWNOFSA-N 1 1 369.421 2.522 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1F)[N@H+]1CCc2ccccc2C1 ZINC000921161644 990991762 /nfs/dbraw/zinc/99/17/62/990991762.db2.gz UAINPAQGYHBMNZ-CYBMUJFWSA-N 1 1 357.385 2.911 20 5 FFBDMO Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1 ZINC000880518588 1015862243 /nfs/dbraw/zinc/86/22/43/1015862243.db2.gz NVUSIRKTCAZHMO-KTWXZFIHSA-N 1 1 356.426 2.772 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)cc1 ZINC000810052462 994678790 /nfs/dbraw/zinc/67/87/90/994678790.db2.gz ZJHXJMPPGANHTI-ICSRJNTNSA-N 1 1 353.422 2.765 20 5 FFBDMO O=C(NC1CC1)OC[C@@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000810040481 994687349 /nfs/dbraw/zinc/68/73/49/994687349.db2.gz RTFNZHYNVNDJAP-INIZCTEOSA-N 1 1 363.414 2.717 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3nccc(C)n3)CC2)c1 ZINC000811490103 995157649 /nfs/dbraw/zinc/15/76/49/995157649.db2.gz LNFGPVJHUDJQRY-UHFFFAOYSA-N 1 1 370.409 2.859 20 5 FFBDMO CCCC[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001133396176 995498712 /nfs/dbraw/zinc/49/87/12/995498712.db2.gz UREQJQHLNYABAU-HZPDHXFCSA-N 1 1 353.850 2.724 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847377 995550893 /nfs/dbraw/zinc/55/08/93/995550893.db2.gz ATDZCURPJMQKSE-AUUYWEPGSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847377 995550903 /nfs/dbraw/zinc/55/09/03/995550903.db2.gz ATDZCURPJMQKSE-AUUYWEPGSA-N 1 1 357.410 2.977 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851776 995553330 /nfs/dbraw/zinc/55/33/30/995553330.db2.gz ZAOFRHXBPWJBEL-OXFYSEKESA-N 1 1 374.437 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)n2)cc1 ZINC000747832281 995595694 /nfs/dbraw/zinc/59/56/94/995595694.db2.gz PAFWYKOXLZZKJV-HZPDHXFCSA-N 1 1 357.414 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn2c1CCCC2 ZINC000813170989 995632519 /nfs/dbraw/zinc/63/25/19/995632519.db2.gz PSMJFKQCTKWAIP-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn2c1CCCC2 ZINC000813170989 995632522 /nfs/dbraw/zinc/63/25/22/995632522.db2.gz PSMJFKQCTKWAIP-INIZCTEOSA-N 1 1 370.409 2.559 20 5 FFBDMO Cc1noc(C)c1CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173834 995633583 /nfs/dbraw/zinc/63/35/83/995633583.db2.gz KVLWYVAOSKJHCW-INIZCTEOSA-N 1 1 359.382 2.560 20 5 FFBDMO Cc1noc(C)c1CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813173834 995633589 /nfs/dbraw/zinc/63/35/89/995633589.db2.gz KVLWYVAOSKJHCW-INIZCTEOSA-N 1 1 359.382 2.560 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000825181532 997241262 /nfs/dbraw/zinc/24/12/62/997241262.db2.gz UOHNQCPSFSVUCM-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[N@H+]1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H](Cc2ccccc2)C1 ZINC000844739939 998109188 /nfs/dbraw/zinc/10/91/88/998109188.db2.gz FFHMUPMILNQIMZ-LJQANCHMSA-N 1 1 365.437 2.761 20 5 FFBDMO Cc1cn(C[N@@H+]2CC[C@H](c3ccco3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000732180625 998527170 /nfs/dbraw/zinc/52/71/70/998527170.db2.gz BQGLAPODSHOLDT-HNNXBMFYSA-N 1 1 368.393 2.896 20 5 FFBDMO Cc1cn(C[N@H+]2CC[C@H](c3ccco3)C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000732180625 998527181 /nfs/dbraw/zinc/52/71/81/998527181.db2.gz BQGLAPODSHOLDT-HNNXBMFYSA-N 1 1 368.393 2.896 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000845738312 998629361 /nfs/dbraw/zinc/62/93/61/998629361.db2.gz DYAFHDHSTCKROA-CQSZACIVSA-N 1 1 358.398 2.810 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CC[C@@H]1CCCC[N@@H+]1C ZINC000803858043 1016247111 /nfs/dbraw/zinc/24/71/11/1016247111.db2.gz BVCSCVSDDLJCMT-AWEZNQCLSA-N 1 1 363.414 2.649 20 5 FFBDMO CC[C@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000738252815 999623336 /nfs/dbraw/zinc/62/33/36/999623336.db2.gz CANVAJFKXRALLR-IFXJQAMLSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741024153 999704306 /nfs/dbraw/zinc/70/43/06/999704306.db2.gz RCXHVFNRGVRNSB-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741024153 999704308 /nfs/dbraw/zinc/70/43/08/999704308.db2.gz RCXHVFNRGVRNSB-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000742167803 999760594 /nfs/dbraw/zinc/76/05/94/999760594.db2.gz XVWIDTYFFCKLAQ-OAHLLOKOSA-N 1 1 373.409 2.572 20 5 FFBDMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000742167803 999760597 /nfs/dbraw/zinc/76/05/97/999760597.db2.gz XVWIDTYFFCKLAQ-OAHLLOKOSA-N 1 1 373.409 2.572 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153628 999761919 /nfs/dbraw/zinc/76/19/19/999761919.db2.gz RFNIHZPWTIBTSA-CVEARBPZSA-N 1 1 359.430 2.946 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000742153628 999761921 /nfs/dbraw/zinc/76/19/21/999761921.db2.gz RFNIHZPWTIBTSA-CVEARBPZSA-N 1 1 359.430 2.946 20 5 FFBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000742154157 999762503 /nfs/dbraw/zinc/76/25/03/999762503.db2.gz DPVQCVYVAPIDBY-UONOGXRCSA-N 1 1 360.414 2.831 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000745088437 999891622 /nfs/dbraw/zinc/89/16/22/999891622.db2.gz NXKKTJTZQPYTIJ-CJNGLKHVSA-N 1 1 363.414 2.585 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019193 1000017494 /nfs/dbraw/zinc/01/74/94/1000017494.db2.gz FJIHNJWRMDVLAJ-UWAKZDDMSA-N 1 1 361.442 2.528 20 5 FFBDMO CC(=O)N1CC[C@]2(c3ccccc3)CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]12 ZINC001169024887 1000018117 /nfs/dbraw/zinc/01/81/17/1000018117.db2.gz RZHPPLDTBKZRMH-PBASOCQRSA-N 1 1 371.481 2.696 20 5 FFBDMO Cc1ccc(O[C@@H]2C[C@@H]3CN([C@@H]4CC[C@H](C[N+](=O)[O-])C4)CC[N@H+]3C2)cc1 ZINC001169026356 1000018264 /nfs/dbraw/zinc/01/82/64/1000018264.db2.gz LHCGIBCMNLZYTE-JRBPQWBISA-N 1 1 359.470 2.578 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCn3cnc(COCc4ccco4)c3C2)C1 ZINC001169026239 1000018304 /nfs/dbraw/zinc/01/83/04/1000018304.db2.gz WJYYQCINDARRHS-HOTGVXAUSA-N 1 1 374.441 2.844 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000767570975 1000127184 /nfs/dbraw/zinc/12/71/84/1000127184.db2.gz WUAVMWUBEQRYIV-UHFFFAOYSA-N 1 1 355.354 2.533 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000846291796 1000256788 /nfs/dbraw/zinc/25/67/88/1000256788.db2.gz SHCBNHLULBJINJ-UHFFFAOYSA-N 1 1 362.474 2.903 20 5 FFBDMO O=C([C@H]1CCC[N@@H+](Cc2cccnc2)C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116135890 1032147689 /nfs/dbraw/zinc/14/76/89/1032147689.db2.gz OBDZMMVZGPMGCD-KRWDZBQOSA-N 1 1 366.421 2.744 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1cnn(C)c1 ZINC001147284371 1000870790 /nfs/dbraw/zinc/87/07/90/1000870790.db2.gz NBQAWOJXRFGHOT-UHFFFAOYSA-N 1 1 361.405 2.677 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1N ZINC000786826152 1001628455 /nfs/dbraw/zinc/62/84/55/1001628455.db2.gz AWKBFXNAPZGXLN-UHFFFAOYSA-N 1 1 351.366 2.601 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCCOc1ccccc1[N+](=O)[O-] ZINC000786820296 1001633032 /nfs/dbraw/zinc/63/30/32/1001633032.db2.gz DPEMDLWXZKQSSV-UHFFFAOYSA-N 1 1 370.405 2.965 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000746665836 1001680838 /nfs/dbraw/zinc/68/08/38/1001680838.db2.gz GTXKJMCWYHXOAB-ZFWWWQNUSA-N 1 1 367.450 2.559 20 5 FFBDMO C/C(=C\C(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790128322 1002286234 /nfs/dbraw/zinc/28/62/34/1002286234.db2.gz UELRYPZTMNNLLF-YIMOIBLRSA-N 1 1 361.442 2.566 20 5 FFBDMO C/C(=C\C(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000790128322 1002286239 /nfs/dbraw/zinc/28/62/39/1002286239.db2.gz UELRYPZTMNNLLF-YIMOIBLRSA-N 1 1 361.442 2.566 20 5 FFBDMO Cn1cc(C[C@@H]2CC[N@H+](Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)cn1 ZINC000774637528 1002289527 /nfs/dbraw/zinc/28/95/27/1002289527.db2.gz NWLBGQALWXCOES-LBPRGKRZSA-N 1 1 374.832 2.854 20 5 FFBDMO Cn1cc(C[C@@H]2CC[N@@H+](Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)C2)cn1 ZINC000774637528 1002289534 /nfs/dbraw/zinc/28/95/34/1002289534.db2.gz NWLBGQALWXCOES-LBPRGKRZSA-N 1 1 374.832 2.854 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CC[C@@H](C)C1 ZINC000790476740 1002387691 /nfs/dbraw/zinc/38/76/91/1002387691.db2.gz CWGYHTKALOGZIR-PBHICJAKSA-N 1 1 359.430 2.948 20 5 FFBDMO COCCCN1CCC([NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC001170306773 1003119445 /nfs/dbraw/zinc/11/94/45/1003119445.db2.gz BUTMOVPBAPKKHL-HNNXBMFYSA-N 1 1 365.474 2.625 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](Oc3nccnc3C)C2)c([N+](=O)[O-])c1 ZINC001170354835 1003122192 /nfs/dbraw/zinc/12/21/92/1003122192.db2.gz QBKAVSZTJNUSBE-DYVFJYSZSA-N 1 1 372.425 2.786 20 5 FFBDMO CCOCc1ncn2c1C[N@@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170342633 1003130141 /nfs/dbraw/zinc/13/01/41/1003130141.db2.gz MNEYVJMVTVFQQA-AWEZNQCLSA-N 1 1 374.441 2.783 20 5 FFBDMO CCOCc1ncn2c1C[N@H+]([C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])CC2 ZINC001170342633 1003130145 /nfs/dbraw/zinc/13/01/45/1003130145.db2.gz MNEYVJMVTVFQQA-AWEZNQCLSA-N 1 1 374.441 2.783 20 5 FFBDMO CCc1cc(NCC[N@@H+]2CC=CCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001186326046 1003268700 /nfs/dbraw/zinc/26/87/00/1003268700.db2.gz XKMYESHOBPDEPO-UHFFFAOYSA-N 1 1 353.426 2.710 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001001400566 1016781928 /nfs/dbraw/zinc/78/19/28/1016781928.db2.gz UYBWDKPVYVHQDN-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO Cc1cc(N2CCC(Nc3c([N+](=O)[O-])cccc3[N+](=O)[O-])CC2)nc(C)[nH+]1 ZINC000804536113 1003721631 /nfs/dbraw/zinc/72/16/31/1003721631.db2.gz UKACYXUVFUFBST-UHFFFAOYSA-N 1 1 372.385 2.991 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC000867233451 1004182641 /nfs/dbraw/zinc/18/26/41/1004182641.db2.gz RJBDGLLCUIIWEU-CQSZACIVSA-N 1 1 359.401 2.913 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2cc(O)ccc2C1 ZINC001198827543 1004738125 /nfs/dbraw/zinc/73/81/25/1004738125.db2.gz DIMAFLBOAGOAFR-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO Cc1cc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)c(N)c([N+](=O)[O-])c1 ZINC000104821985 1004816015 /nfs/dbraw/zinc/81/60/15/1004816015.db2.gz RRGMWIMJHXHMPA-OAHLLOKOSA-N 1 1 358.398 2.645 20 5 FFBDMO C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001195595665 1004995235 /nfs/dbraw/zinc/99/52/35/1004995235.db2.gz GFIJWSIQWBJRIE-BREBYQMCSA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000108335502 1005654400 /nfs/dbraw/zinc/65/44/00/1005654400.db2.gz BGWBEWHZTFCZBH-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851742995 1005910712 /nfs/dbraw/zinc/91/07/12/1005910712.db2.gz PYTCFAARUYZCTK-CYBMUJFWSA-N 1 1 368.434 2.970 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851742995 1005910714 /nfs/dbraw/zinc/91/07/14/1005910714.db2.gz PYTCFAARUYZCTK-CYBMUJFWSA-N 1 1 368.434 2.970 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582380 1005961763 /nfs/dbraw/zinc/96/17/63/1005961763.db2.gz PLQQFCRZDLZGSJ-UZLBHIALSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc(C[NH+]3CCCC3)on1)CC2 ZINC000813507420 1005962681 /nfs/dbraw/zinc/96/26/81/1005962681.db2.gz JXOGDUAKNHBDNM-UHFFFAOYSA-N 1 1 356.382 2.690 20 5 FFBDMO CCc1nn(C)c(Nc2ccc(N3CC[N@H+]4CCC[C@@H]4C3)cc2)c1[N+](=O)[O-] ZINC001187454754 1006089614 /nfs/dbraw/zinc/08/96/14/1006089614.db2.gz PPLOURHOYUFBNQ-MRXNPFEDSA-N 1 1 370.457 2.919 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@]3(CCCOC3)C2)nc1-c1ccccn1 ZINC000853501738 1006417192 /nfs/dbraw/zinc/41/71/92/1006417192.db2.gz XQLONOMGJWTHFB-SFHVURJKSA-N 1 1 357.414 2.703 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@]3(CCCOC3)C2)nc1-c1ccccn1 ZINC000853501738 1006417197 /nfs/dbraw/zinc/41/71/97/1006417197.db2.gz XQLONOMGJWTHFB-SFHVURJKSA-N 1 1 357.414 2.703 20 5 FFBDMO O=C1CN(C[N@@H+](CCC2CC2)CC2CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000853607692 1006472099 /nfs/dbraw/zinc/47/20/99/1006472099.db2.gz SRSJPDSAUMYSKC-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)nc1 ZINC000858012100 1008277483 /nfs/dbraw/zinc/27/74/83/1008277483.db2.gz WTZDESBSQOUVPC-QGZVFWFLSA-N 1 1 371.393 2.818 20 5 FFBDMO Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)nc1 ZINC000858012100 1008277487 /nfs/dbraw/zinc/27/74/87/1008277487.db2.gz WTZDESBSQOUVPC-QGZVFWFLSA-N 1 1 371.393 2.818 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H]3C[N@H+]4CCC[C@H]4CO3)o2)c1 ZINC001177749463 1008731505 /nfs/dbraw/zinc/73/15/05/1008731505.db2.gz VWRCNUQKZFQYOQ-FUHWJXTLSA-N 1 1 357.410 2.808 20 5 FFBDMO C[C@H](CCN1CC[NH+](C)CC1)NC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860915433 1009198205 /nfs/dbraw/zinc/19/82/05/1009198205.db2.gz FLQYMCIGRIGOKF-OAHLLOKOSA-N 1 1 370.453 2.504 20 5 FFBDMO Nc1ccc(NC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000823950341 1009275771 /nfs/dbraw/zinc/27/57/71/1009275771.db2.gz IKRFZLQFFBCXID-HNNXBMFYSA-N 1 1 369.425 2.821 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)CC2)c1 ZINC000824008887 1009290829 /nfs/dbraw/zinc/29/08/29/1009290829.db2.gz XTQINWPADCOPEA-UHFFFAOYSA-N 1 1 369.425 2.835 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OC[C@]1(C)C[C@H](OC)C[N@H+]1C ZINC000861348297 1009365322 /nfs/dbraw/zinc/36/53/22/1009365322.db2.gz NZBJXQKSXAWCAH-AYBZRNKSSA-N 1 1 364.442 2.816 20 5 FFBDMO O=C1O[C@@H](c2ccccc2)CN1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000863264645 1010148852 /nfs/dbraw/zinc/14/88/52/1010148852.db2.gz JLEKLKYPELJOOT-MRXNPFEDSA-N 1 1 371.397 2.579 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCOCC2)c(C(F)F)c1 ZINC000865869395 1010878048 /nfs/dbraw/zinc/87/80/48/1010878048.db2.gz DEZLRVLFZOLRPV-UHFFFAOYSA-N 1 1 371.384 2.826 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C[C@H]2CCOC2)CC1 ZINC000866270175 1010966818 /nfs/dbraw/zinc/96/68/18/1010966818.db2.gz SOQOJBIFWLFPHK-HUUCEWRRSA-N 1 1 365.449 2.755 20 5 FFBDMO COCCCC[NH+]1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172913274 1012125780 /nfs/dbraw/zinc/12/57/80/1012125780.db2.gz QMQOCZQGAZNVPH-IBGZPJMESA-N 1 1 361.486 2.886 20 5 FFBDMO COC[C@@H]1CCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010692 1012182240 /nfs/dbraw/zinc/18/22/40/1012182240.db2.gz XUGBYRPAIWGVDV-ZDUSSCGKSA-N 1 1 355.385 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@](F)(CO)CC2)c1F ZINC001173180029 1012323999 /nfs/dbraw/zinc/32/39/99/1012323999.db2.gz ICRAJDFRILJDPH-SJKOYZFVSA-N 1 1 358.385 2.860 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2NC(=O)c3ccccc32)c1F ZINC001173184240 1012328021 /nfs/dbraw/zinc/32/80/21/1012328021.db2.gz PELISYKERYTOLS-BTDLBPIBSA-N 1 1 359.357 2.705 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1F ZINC001173191725 1012333017 /nfs/dbraw/zinc/33/30/17/1012333017.db2.gz GTIDEWLUHUJCAL-MJBXVCDLSA-N 1 1 351.422 2.842 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192839 1012333847 /nfs/dbraw/zinc/33/38/47/1012333847.db2.gz KXQKNWDLSMGYKP-GTNSWQLSSA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])CC1 ZINC001173192004 1012335335 /nfs/dbraw/zinc/33/53/35/1012335335.db2.gz HELPPXYIOMMGFX-STQMWFEESA-N 1 1 368.405 2.949 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)C[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197249 1012341908 /nfs/dbraw/zinc/34/19/08/1012341908.db2.gz RUPYHRRAZLPIBU-YNEHKIRRSA-N 1 1 368.405 2.805 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225338 1012356583 /nfs/dbraw/zinc/35/65/83/1012356583.db2.gz NMHFRTMBMHNRBC-GDBMZVCRSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225338 1012356602 /nfs/dbraw/zinc/35/66/02/1012356602.db2.gz NMHFRTMBMHNRBC-GDBMZVCRSA-N 1 1 373.457 2.773 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2onc(Cn3ccnc3)c2C1 ZINC001173224151 1012359290 /nfs/dbraw/zinc/35/92/90/1012359290.db2.gz IPAXCWSIORWSAB-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO COCCN1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2cccnc21 ZINC001173226347 1012361808 /nfs/dbraw/zinc/36/18/08/1012361808.db2.gz MAEDNHFKFQMDRO-MRXNPFEDSA-N 1 1 370.453 2.889 20 5 FFBDMO CCO[C@H]1CC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)[C@H]1Cc1cnn(C)c1 ZINC001173230272 1012364022 /nfs/dbraw/zinc/36/40/22/1012364022.db2.gz ZPZVOBPARNVQKB-YSSFQJQWSA-N 1 1 372.469 2.981 20 5 FFBDMO COC(=O)c1cnc2c(c1)C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173237132 1012381573 /nfs/dbraw/zinc/38/15/73/1012381573.db2.gz ICCPSVOEJUJFQH-CYBMUJFWSA-N 1 1 355.394 2.766 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[N@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347354 1017121051 /nfs/dbraw/zinc/12/10/51/1017121051.db2.gz VEZTZISNDZXGGM-OAGGEKHMSA-N 1 1 374.485 2.853 20 5 FFBDMO C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CC[N@@H+](C)[C@@H](C)C3)cc2[N+](=O)[O-])C1 ZINC000748347354 1017121056 /nfs/dbraw/zinc/12/10/56/1017121056.db2.gz VEZTZISNDZXGGM-OAGGEKHMSA-N 1 1 374.485 2.853 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](Cc1ccccc1)C2)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001051291672 1017271419 /nfs/dbraw/zinc/27/14/19/1017271419.db2.gz XTTSOHKJURUDPH-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@H+](Cc1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291672 1017271433 /nfs/dbraw/zinc/27/14/33/1017271433.db2.gz XTTSOHKJURUDPH-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO O=C(NCc1cccc2c1CC[N@@H+](Cc1ccccc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC001051291672 1017271442 /nfs/dbraw/zinc/27/14/42/1017271442.db2.gz XTTSOHKJURUDPH-WOJBJXKFSA-N 1 1 365.433 2.526 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801600137 1019161804 /nfs/dbraw/zinc/16/18/04/1019161804.db2.gz LUQZSUICKWJEIZ-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000801600137 1019161808 /nfs/dbraw/zinc/16/18/08/1019161808.db2.gz LUQZSUICKWJEIZ-UHFFFAOYSA-N 1 1 372.381 2.924 20 5 FFBDMO COc1ccc(OC)c([C@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000801602058 1019162323 /nfs/dbraw/zinc/16/23/23/1019162323.db2.gz UVISJLJOTRZUNT-GOSISDBHSA-N 1 1 360.410 2.820 20 5 FFBDMO COCC[C@@H]1CCN(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288645 1020056192 /nfs/dbraw/zinc/05/61/92/1020056192.db2.gz FDNPTEYBCLQZIB-DLBZAZTESA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[C@@H]1CCN(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288645 1020056202 /nfs/dbraw/zinc/05/62/02/1020056202.db2.gz FDNPTEYBCLQZIB-DLBZAZTESA-N 1 1 361.442 2.617 20 5 FFBDMO O=C1C[C@H]([C@H]2CCCO2)CN1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291668 1020058715 /nfs/dbraw/zinc/05/87/15/1020058715.db2.gz XQTZAFBRWRSUJT-ZIFCJYIRSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1C[C@H]([C@H]2CCCO2)CN1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291668 1020058730 /nfs/dbraw/zinc/05/87/30/1020058730.db2.gz XQTZAFBRWRSUJT-ZIFCJYIRSA-N 1 1 373.453 2.759 20 5 FFBDMO COc1ccc(NC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000930769529 1020170742 /nfs/dbraw/zinc/17/07/42/1020170742.db2.gz PQCSRFNHFIBMBR-CQSZACIVSA-N 1 1 362.430 2.799 20 5 FFBDMO CC(C)C[C@@H]1CCC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000726588440 1020489907 /nfs/dbraw/zinc/48/99/07/1020489907.db2.gz KDCZIDGHBMVRLS-AWEZNQCLSA-N 1 1 360.414 2.831 20 5 FFBDMO COc1cc(CN2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c([N+](=O)[O-])cc1OC(F)F ZINC000931730779 1020566611 /nfs/dbraw/zinc/56/66/11/1020566611.db2.gz XUEDQUUQKGCTQL-OLZOCXBDSA-N 1 1 371.384 2.873 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C2CCOCC2)C1 ZINC000933079999 1020953686 /nfs/dbraw/zinc/95/36/86/1020953686.db2.gz RHYZPNCPUGVEAO-MRXNPFEDSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC000933738681 1021080896 /nfs/dbraw/zinc/08/08/96/1021080896.db2.gz LKNQLANIETUHMD-XAYKYTGQSA-N 1 1 357.414 2.589 20 5 FFBDMO CC[N@@H+]1CCCC[C@H]1C(=O)O[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808509 1022397492 /nfs/dbraw/zinc/39/74/92/1022397492.db2.gz DRDBXFBGOZIZDH-YOEHRIQHSA-N 1 1 365.405 2.730 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1C(=O)O[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000778808509 1022397501 /nfs/dbraw/zinc/39/75/01/1022397501.db2.gz DRDBXFBGOZIZDH-YOEHRIQHSA-N 1 1 365.405 2.730 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@]1(O)CCc2ccccc21 ZINC000829377244 1033127582 /nfs/dbraw/zinc/12/75/82/1033127582.db2.gz SKRFWDPWAAUGIU-GOSISDBHSA-N 1 1 357.366 2.769 20 5 FFBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@]1(O)CCc2ccccc21 ZINC000829377244 1033127586 /nfs/dbraw/zinc/12/75/86/1033127586.db2.gz SKRFWDPWAAUGIU-GOSISDBHSA-N 1 1 357.366 2.769 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3cccc(C)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001120764913 1023457010 /nfs/dbraw/zinc/45/70/10/1023457010.db2.gz ALDBQXKURRDXDU-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC001121200896 1023647108 /nfs/dbraw/zinc/64/71/08/1023647108.db2.gz YXWALRDAPKQGHE-WCFLWFBJSA-N 1 1 369.874 2.797 20 5 FFBDMO C[C@@H](c1nnc(N2CCC(C[N@@H+](C)Cc3ccccc3)CC2)n1C)[N+](=O)[O-] ZINC001121389505 1023745041 /nfs/dbraw/zinc/74/50/41/1023745041.db2.gz UBBJCOHAJMZBON-HNNXBMFYSA-N 1 1 372.473 2.501 20 5 FFBDMO CCC[C@@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000757610430 1023836445 /nfs/dbraw/zinc/83/64/45/1023836445.db2.gz MWSUHVDWGANHBP-KUHUBIRLSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000079945146 1024422549 /nfs/dbraw/zinc/42/25/49/1024422549.db2.gz BXUXZKUKBQEZPH-WMLDXEAASA-N 1 1 368.437 2.960 20 5 FFBDMO C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NC[C@@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000194736012 1024884902 /nfs/dbraw/zinc/88/49/02/1024884902.db2.gz VNUKBCPTSYDOIY-ZOBUZTSGSA-N 1 1 374.485 2.901 20 5 FFBDMO O=[N+]([O-])c1c(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)nc2ccccn21 ZINC000795206898 1025356754 /nfs/dbraw/zinc/35/67/54/1025356754.db2.gz LWNRTRNIFKMZGX-CALCHBBNSA-N 1 1 363.421 2.811 20 5 FFBDMO O=C(NCC1CC[NH+](CCCCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001223114192 1033293390 /nfs/dbraw/zinc/29/33/90/1033293390.db2.gz KAEAZVXBTSOOMS-RTBURBONSA-N 1 1 359.470 2.503 20 5 FFBDMO O=C(NCC1CC[NH+](CC/C=C\c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001223113927 1033293791 /nfs/dbraw/zinc/29/37/91/1033293791.db2.gz FCFNIRHJJFVZBE-HUPPCRNXSA-N 1 1 357.454 2.583 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC4(CC3)OCCCO4)c2)c1 ZINC000840088484 1026950841 /nfs/dbraw/zinc/95/08/41/1026950841.db2.gz RJZATGOCZLOPNO-UHFFFAOYSA-N 1 1 358.398 2.645 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)nc1-c1ccncc1 ZINC000840113698 1026962201 /nfs/dbraw/zinc/96/22/01/1026962201.db2.gz CBQUNPLTBXKMRI-JFIYKMOQSA-N 1 1 371.441 2.826 20 5 FFBDMO CO[C@H]1C[C@@H]([N@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138880 1026978906 /nfs/dbraw/zinc/97/89/06/1026978906.db2.gz GNYRPFKENNJWFM-SJORKVTESA-N 1 1 374.441 2.684 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C12CCC2 ZINC000840138880 1026978914 /nfs/dbraw/zinc/97/89/14/1026978914.db2.gz GNYRPFKENNJWFM-SJORKVTESA-N 1 1 374.441 2.684 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000247702804 1027220750 /nfs/dbraw/zinc/22/07/50/1027220750.db2.gz YGYMKAHTQQLIGX-AZUAARDMSA-N 1 1 374.437 2.698 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001159288019 1027340347 /nfs/dbraw/zinc/34/03/47/1027340347.db2.gz KGKVTINREKOWAU-OSYLJGHBSA-N 1 1 354.410 2.836 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1 ZINC001160090820 1027586771 /nfs/dbraw/zinc/58/67/71/1027586771.db2.gz QCGLUHRCWQZEAC-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160090820 1027586784 /nfs/dbraw/zinc/58/67/84/1027586784.db2.gz QCGLUHRCWQZEAC-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001160090820 1027586790 /nfs/dbraw/zinc/58/67/90/1027586790.db2.gz QCGLUHRCWQZEAC-RTBURBONSA-N 1 1 357.454 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(N[C@H]3CCC[C@H]3[NH+]3CCOCC3)nn2)cc1 ZINC001160722883 1027826921 /nfs/dbraw/zinc/82/69/21/1027826921.db2.gz DJVROAJCCSMHMB-ZWKOTPCHSA-N 1 1 369.425 2.717 20 5 FFBDMO CC(C)Oc1nccc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)n1 ZINC001161607622 1028251577 /nfs/dbraw/zinc/25/15/77/1028251577.db2.gz WHZXNXRPPKCTKT-SOFGYWHQSA-N 1 1 358.402 2.711 20 5 FFBDMO CC[N@@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000957713074 1028581883 /nfs/dbraw/zinc/58/18/83/1028581883.db2.gz KJOMXNPPNDAQFJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO CC[N@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713074 1028581896 /nfs/dbraw/zinc/58/18/96/1028581896.db2.gz KJOMXNPPNDAQFJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO CC[N@@H+](CC1CC2(CCC2)C1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000957713074 1028581900 /nfs/dbraw/zinc/58/19/00/1028581900.db2.gz KJOMXNPPNDAQFJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC001162875605 1028689682 /nfs/dbraw/zinc/68/96/82/1028689682.db2.gz HXEZBEQRACXDAY-MRXNPFEDSA-N 1 1 359.430 2.697 20 5 FFBDMO COC(=O)[C@H](CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)c1ccccc1 ZINC001162998968 1028751092 /nfs/dbraw/zinc/75/10/92/1028751092.db2.gz FDXWJBJBAAOBJM-ZNFPLGDCSA-N 1 1 370.409 2.891 20 5 FFBDMO CO[C@@H](C[NH+]1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)c1ccccc1 ZINC001155706200 1028861815 /nfs/dbraw/zinc/86/18/15/1028861815.db2.gz NKKGXNFSIKKPDO-KRWDZBQOSA-N 1 1 356.426 2.808 20 5 FFBDMO Cn1c2ccccc2c(NC[C@H]2CCC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1=O ZINC001163817300 1029073485 /nfs/dbraw/zinc/07/34/85/1029073485.db2.gz HTVOILAFIZCUQM-OAHLLOKOSA-N 1 1 370.453 2.981 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCCCCC2)n1 ZINC001163942213 1029122745 /nfs/dbraw/zinc/12/27/45/1029122745.db2.gz OWHYJOQXVPKGMD-CQSZACIVSA-N 1 1 362.430 2.985 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]23)c1 ZINC001156315422 1029140980 /nfs/dbraw/zinc/14/09/80/1029140980.db2.gz NXTNGQSYPIWZKE-BPQIPLTHSA-N 1 1 354.410 2.551 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC001156318185 1029143078 /nfs/dbraw/zinc/14/30/78/1029143078.db2.gz QBMZISQPEFCCKX-FGTMMUONSA-N 1 1 368.437 2.859 20 5 FFBDMO Nc1cc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC001156317360 1029143960 /nfs/dbraw/zinc/14/39/60/1029143960.db2.gz LYJUSNZELZZLQZ-ZMSDIMECSA-N 1 1 353.426 2.895 20 5 FFBDMO CC(C)c1ccccc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001164494583 1029298636 /nfs/dbraw/zinc/29/86/36/1029298636.db2.gz NKCDHVOWSNALQH-QZTJIDSGSA-N 1 1 359.470 2.851 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2nccc(Cl)c2[N+](=O)[O-])CC1 ZINC001165109741 1029397245 /nfs/dbraw/zinc/39/72/45/1029397245.db2.gz VODMXHLWUARQNZ-CYBMUJFWSA-N 1 1 354.838 2.723 20 5 FFBDMO Cc1[nH+]c(N)ccc1CNc1nc(C(F)(F)F)nc(Cl)c1[N+](=O)[O-] ZINC001156980294 1029430371 /nfs/dbraw/zinc/43/03/71/1029430371.db2.gz DWUFLESUVOTSIH-UHFFFAOYSA-N 1 1 362.699 2.955 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(c3nc(C(F)(F)F)nc(Cl)c3[N+](=O)[O-])C[C@@H]21 ZINC001157272461 1029531979 /nfs/dbraw/zinc/53/19/79/1029531979.db2.gz MYKQWQIGNFLMCT-SFYZADRCSA-N 1 1 365.743 2.587 20 5 FFBDMO COc1cc2ncnc(N3CC[N@@H+](C)CC34CCCC4)c2cc1[N+](=O)[O-] ZINC001158409828 1029821577 /nfs/dbraw/zinc/82/15/77/1029821577.db2.gz BKEKHINYPHZKKH-UHFFFAOYSA-N 1 1 357.414 2.611 20 5 FFBDMO N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)N1CCC[C@H]2[NH2+]C[C@@H]21 ZINC001158421749 1029825752 /nfs/dbraw/zinc/82/57/52/1029825752.db2.gz FSUOAGVAJXLZKI-BDTNDASRSA-N 1 1 359.473 2.826 20 5 FFBDMO C[N@@H+](C[C@@H]1CC=CCC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000784011328 1030413346 /nfs/dbraw/zinc/41/33/46/1030413346.db2.gz PNQAFAMAWFKVTE-AUUYWEPGSA-N 1 1 372.425 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@@H]3[C@@H]3CCCOC3)n2)cc1 ZINC000842613231 1030823547 /nfs/dbraw/zinc/82/35/47/1030823547.db2.gz BEIIXWLQJIEDCH-NVXWUHKLSA-N 1 1 357.414 2.702 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CC[C@H](Oc4ccccc4)C3)n2)c1 ZINC000842618053 1030831974 /nfs/dbraw/zinc/83/19/74/1030831974.db2.gz QZDLRTCYHRJZIM-SFHVURJKSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@H](Oc4ccccc4)C3)n2)c1 ZINC000842618053 1030831994 /nfs/dbraw/zinc/83/19/94/1030831994.db2.gz QZDLRTCYHRJZIM-SFHVURJKSA-N 1 1 365.393 2.964 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1 ZINC000797530175 1031144800 /nfs/dbraw/zinc/14/48/00/1031144800.db2.gz PQLFLRLONXYTLZ-LPHOPBHVSA-N 1 1 369.421 2.613 20 5 FFBDMO O=C(NCc1ccccc1)[C@@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000830195826 1033503705 /nfs/dbraw/zinc/50/37/05/1033503705.db2.gz KDXZPHFLWBCSDF-OAHLLOKOSA-N 1 1 357.385 2.872 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@@H]3CN(C(=O)C(F)(F)F)C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000831563768 1034127055 /nfs/dbraw/zinc/12/70/55/1034127055.db2.gz POSWZBWKXZNVDG-KGLIPLIRSA-N 1 1 371.359 2.746 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@@H]3CN(C(=O)C(F)(F)F)C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000831563770 1034127782 /nfs/dbraw/zinc/12/77/82/1034127782.db2.gz POSWZBWKXZNVDG-ZIAGYGMSSA-N 1 1 371.359 2.746 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(O[C@@H]2CC[N@H+]([C@H](C)c3ccccn3)C2)c1 ZINC001227044711 1034919540 /nfs/dbraw/zinc/91/95/40/1034919540.db2.gz QXVNLPBPSLVOLS-UKRRQHHQSA-N 1 1 371.393 2.991 20 5 FFBDMO C[N@@H+]1CCO[C@@H](COc2c3ccccc3c(O)c3c(O)ccc(O)c23)C1 ZINC001228169700 1035971702 /nfs/dbraw/zinc/97/17/02/1035971702.db2.gz BLYMIXDQNKJENH-GFCCVEGCSA-N 1 1 355.390 2.819 20 5 FFBDMO C[N@H+]1CCO[C@@H](COc2c3ccccc3c(O)c3c(O)ccc(O)c23)C1 ZINC001228169700 1035971714 /nfs/dbraw/zinc/97/17/14/1035971714.db2.gz BLYMIXDQNKJENH-GFCCVEGCSA-N 1 1 355.390 2.819 20 5 FFBDMO CO[C@@H]1CC[N@H+](CCOc2c(F)cc(Br)cc2[N+](=O)[O-])C1 ZINC001228480973 1036137273 /nfs/dbraw/zinc/13/72/73/1036137273.db2.gz JOPRISAQLJEESL-SNVBAGLBSA-N 1 1 363.183 2.596 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2c(F)cc(Br)cc2[N+](=O)[O-])C1 ZINC001228480973 1036137285 /nfs/dbraw/zinc/13/72/85/1036137285.db2.gz JOPRISAQLJEESL-SNVBAGLBSA-N 1 1 363.183 2.596 20 5 FFBDMO CC[NH+]1CCC(Oc2cc(O)cc3oc4c(O)ccc(O)c4c(=O)c23)CC1 ZINC001234125646 1036929581 /nfs/dbraw/zinc/92/95/81/1036929581.db2.gz VMHUKXORYMKPPS-UHFFFAOYSA-N 1 1 371.389 2.926 20 5 FFBDMO COc1c(O)ccc(C[N@H+](C)CCCC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001207733198 1037682692 /nfs/dbraw/zinc/68/26/92/1037682692.db2.gz XJSJLYBPMOUCTE-UHFFFAOYSA-N 1 1 354.403 2.863 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)CCCC(=O)OC(C)(C)C)c1[N+](=O)[O-] ZINC001207733198 1037682703 /nfs/dbraw/zinc/68/27/03/1037682703.db2.gz XJSJLYBPMOUCTE-UHFFFAOYSA-N 1 1 354.403 2.863 20 5 FFBDMO COc1cc(N2CCC([NH2+]C3(c4nc(C)no4)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256089476 1038374465 /nfs/dbraw/zinc/37/44/65/1038374465.db2.gz VSOAHDYUBOPLGX-UHFFFAOYSA-N 1 1 373.413 2.543 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H](CO)CC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC001256092908 1038377806 /nfs/dbraw/zinc/37/78/06/1038377806.db2.gz AYVRLHZUKFRARH-GJZGRUSLSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3C[C@@H](F)C[C@H]3CF)CC2)ccc1[N+](=O)[O-] ZINC001256093119 1038379679 /nfs/dbraw/zinc/37/96/79/1038379679.db2.gz GPOVTVQAHMSXPG-WFASDCNBSA-N 1 1 355.385 2.954 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@@H](F)C[C@H]3CF)CC2)ccc1[N+](=O)[O-] ZINC001256093119 1038379693 /nfs/dbraw/zinc/37/96/93/1038379693.db2.gz GPOVTVQAHMSXPG-WFASDCNBSA-N 1 1 355.385 2.954 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](CCO)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100983 1038384435 /nfs/dbraw/zinc/38/44/35/1038384435.db2.gz XDINVAOYTIGVLU-OAHLLOKOSA-N 1 1 363.458 2.667 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3C[C@@H]4[C@H]5CC[C@H](O5)[C@@H]4C3)CC2)ccc1[N+](=O)[O-] ZINC001256100528 1038385407 /nfs/dbraw/zinc/38/54/07/1038385407.db2.gz KAEUHOOWGKUKAF-XHVUQVIVSA-N 1 1 373.453 2.681 20 5 FFBDMO CC(C)[C@@H]1CNCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246692402 1039440011 /nfs/dbraw/zinc/44/00/11/1039440011.db2.gz GZUUAFYSHPEIOM-KRWDZBQOSA-N 1 1 368.428 2.772 20 5 FFBDMO CC(C)[C@@H]1CNCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246692402 1039440019 /nfs/dbraw/zinc/44/00/19/1039440019.db2.gz GZUUAFYSHPEIOM-KRWDZBQOSA-N 1 1 368.428 2.772 20 5 FFBDMO [NH3+][C@@H](Cc1ccc(F)c(F)c1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001247662283 1039870499 /nfs/dbraw/zinc/87/04/99/1039870499.db2.gz KFOOSVPNZZAZGW-NSHDSACASA-N 1 1 365.271 2.700 20 5 FFBDMO COc1ccc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c(OC)c1 ZINC001247665282 1039874859 /nfs/dbraw/zinc/87/48/59/1039874859.db2.gz GMLHGHQLWDGLKX-AWEZNQCLSA-N 1 1 370.365 2.905 20 5 FFBDMO CN(C)c1ccc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)cc1 ZINC001247666913 1039875043 /nfs/dbraw/zinc/87/50/43/1039875043.db2.gz QBQOCVCKAHZJGP-HNNXBMFYSA-N 1 1 353.382 2.953 20 5 FFBDMO COc1ccc(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)cc1OC ZINC001248208114 1040172625 /nfs/dbraw/zinc/17/26/25/1040172625.db2.gz ISOQQMIKODCZPT-CQSZACIVSA-N 1 1 370.365 2.905 20 5 FFBDMO CN1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)Cc2cccnc21 ZINC001254477135 1040741793 /nfs/dbraw/zinc/74/17/93/1040741793.db2.gz OSGZMCCVKVUZKO-UHFFFAOYSA-N 1 1 367.453 2.911 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480133 1040747945 /nfs/dbraw/zinc/74/79/45/1040747945.db2.gz WCNRPJIGCQRVMO-OAHLLOKOSA-N 1 1 361.442 2.839 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559866 1040795673 /nfs/dbraw/zinc/79/56/73/1040795673.db2.gz ZULJBBJRRIWHEG-JKSUJKDBSA-N 1 1 358.442 2.891 20 5 FFBDMO CCOC[C@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC001254559866 1040795682 /nfs/dbraw/zinc/79/56/82/1040795682.db2.gz ZULJBBJRRIWHEG-JKSUJKDBSA-N 1 1 358.442 2.891 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCN(C(=O)c3ccco3)[C@@H]2C1 ZINC001254555878 1040797446 /nfs/dbraw/zinc/79/74/46/1040797446.db2.gz IQUVFZNOGKGGHK-UWWQBHOKSA-N 1 1 369.421 2.965 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2cccnc2)C1 ZINC001254569193 1040805496 /nfs/dbraw/zinc/80/54/96/1040805496.db2.gz IYGPQSJLQJXZAN-CRAIPNDOSA-N 1 1 368.437 2.815 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1[C@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254601049 1040832076 /nfs/dbraw/zinc/83/20/76/1040832076.db2.gz XRNHDPVZGMKIKK-TVFCKZIOSA-N 1 1 373.453 2.765 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(c3ncccc3Cl)CC1)C2 ZINC001254602629 1040833265 /nfs/dbraw/zinc/83/32/65/1040833265.db2.gz HDRVJUWNXHKYBG-MRXNPFEDSA-N 1 1 358.829 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c(F)c1N1CCOCC1 ZINC001262678649 1041789621 /nfs/dbraw/zinc/78/96/21/1041789621.db2.gz IXWLTGOIKHIGFF-UKRRQHHQSA-N 1 1 364.421 2.609 20 5 FFBDMO Cn1c(-c2ccc([N+](=O)[O-])s2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001262852411 1041902081 /nfs/dbraw/zinc/90/20/81/1041902081.db2.gz QIKFHSHWQOEVJL-UHFFFAOYSA-N 1 1 364.475 2.762 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(Cl)cc1F)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001265161328 1042845194 /nfs/dbraw/zinc/84/51/94/1042845194.db2.gz JWGRBEAQEVWVFC-GDBMZVCRSA-N 1 1 369.824 2.615 20 5 FFBDMO O=C(NCCC[N@H+](Cc1ccc(Cl)cc1F)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001265161328 1042845196 /nfs/dbraw/zinc/84/51/96/1042845196.db2.gz JWGRBEAQEVWVFC-GDBMZVCRSA-N 1 1 369.824 2.615 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(Cl)cc1F)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001265161328 1042845197 /nfs/dbraw/zinc/84/51/97/1042845197.db2.gz JWGRBEAQEVWVFC-GDBMZVCRSA-N 1 1 369.824 2.615 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNc2ccc([N+](=O)[O-])cc2F)C1 ZINC000702164211 1042884578 /nfs/dbraw/zinc/88/45/78/1042884578.db2.gz TWSRJNFLWYDWFG-QGZVFWFLSA-N 1 1 358.417 2.962 20 5 FFBDMO Cc1ccc(F)cc1C[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001319018805 1044986206 /nfs/dbraw/zinc/98/62/06/1044986206.db2.gz HDDKWMOGCQQTPX-QZTJIDSGSA-N 1 1 363.433 2.518 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC001319485173 1045167794 /nfs/dbraw/zinc/16/77/94/1045167794.db2.gz LVSGIQFSJCEXFZ-QFBILLFUSA-N 1 1 372.400 2.707 20 5 FFBDMO COC(=O)COc1ccc(C[NH+]2CC(c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC001325502241 1046531613 /nfs/dbraw/zinc/53/16/13/1046531613.db2.gz OKKXDXZSEASBDY-UHFFFAOYSA-N 1 1 374.368 2.885 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])cnn1-c1cc[nH+]cc1 ZINC001288498279 1047470921 /nfs/dbraw/zinc/47/09/21/1047470921.db2.gz SRDGMWXULUFGJH-LBPRGKRZSA-N 1 1 351.366 2.975 20 5 FFBDMO C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001332718774 1048526182 /nfs/dbraw/zinc/52/61/82/1048526182.db2.gz USSKWYINLXSSGM-PXAZEXFGSA-N 1 1 366.801 2.826 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC001329881154 1048947256 /nfs/dbraw/zinc/94/72/56/1048947256.db2.gz USXCPUABKYBFMA-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccccc2C)C1 ZINC001330272459 1049112736 /nfs/dbraw/zinc/11/27/36/1049112736.db2.gz AGWSLRSVPHAMTE-GOSISDBHSA-N 1 1 354.410 2.732 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC001306918214 1052221787 /nfs/dbraw/zinc/22/17/87/1052221787.db2.gz OOXIBDSORSLBGY-GFCCVEGCSA-N 1 1 369.347 2.840 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC001306918214 1052221791 /nfs/dbraw/zinc/22/17/91/1052221791.db2.gz OOXIBDSORSLBGY-GFCCVEGCSA-N 1 1 369.347 2.840 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(n3cccn3)CC2)o1 ZINC001307648568 1052330610 /nfs/dbraw/zinc/33/06/10/1052330610.db2.gz VHONQPJDHSUATQ-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001308140010 1052415544 /nfs/dbraw/zinc/41/55/44/1052415544.db2.gz IXTRLTFLSGXLDB-GJZGRUSLSA-N 1 1 374.268 2.933 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C ZINC001309172342 1052566920 /nfs/dbraw/zinc/56/69/20/1052566920.db2.gz BIZIWVOTPPLHGB-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC001347390463 1053926669 /nfs/dbraw/zinc/92/66/69/1053926669.db2.gz DWUIOQWBTSYGBD-JTQLQIEISA-N 1 1 355.826 2.684 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)[C@@H](C)C1 ZINC001338153341 1055276735 /nfs/dbraw/zinc/27/67/35/1055276735.db2.gz LLWFCSMTEAHQMM-XJKSGUPXSA-N 1 1 372.473 2.865 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000847253517 1055320924 /nfs/dbraw/zinc/32/09/24/1055320924.db2.gz GUJLENLJUISXIK-ZIAGYGMSSA-N 1 1 362.386 2.558 20 5 FFBDMO COCC[N@@H+](C)CCCNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12 ZINC001350433701 1055771598 /nfs/dbraw/zinc/77/15/98/1055771598.db2.gz PUVZCUAMPVZQTL-UHFFFAOYSA-N 1 1 353.810 2.572 20 5 FFBDMO CN(C)c1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)cc[nH+]1 ZINC001358150675 1056163996 /nfs/dbraw/zinc/16/39/96/1056163996.db2.gz QGDBZTPRENUPSI-UHFFFAOYSA-N 1 1 370.344 2.633 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001339454182 1056470201 /nfs/dbraw/zinc/47/02/01/1056470201.db2.gz HMXAWZDAEQQNGH-DOTOQJQBSA-N 1 1 372.473 2.564 20 5 FFBDMO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCCO1 ZINC001339476542 1056491952 /nfs/dbraw/zinc/49/19/52/1056491952.db2.gz YZOAATGQRPDKSE-KBPBESRZSA-N 1 1 359.220 2.641 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](C(=O)Oc2cccc([N+](=O)[O-])c2)[C@@H](c2cnn(C)c2)C1 ZINC000849487702 1056872787 /nfs/dbraw/zinc/87/27/87/1056872787.db2.gz FBLCPNPGHVWRPG-ZWKOTPCHSA-N 1 1 372.425 2.748 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001544801428 1071694103 /nfs/dbraw/zinc/69/41/03/1071694103.db2.gz SPAKQZFAUQTZLQ-LBPRGKRZSA-N 1 1 354.838 2.777 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001544849915 1071702308 /nfs/dbraw/zinc/70/23/08/1071702308.db2.gz DKAVYJWYQFJBJV-AWEZNQCLSA-N 1 1 353.850 2.981 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001445038640 1058361836 /nfs/dbraw/zinc/36/18/36/1058361836.db2.gz WJZUQIAZKKVJSJ-MRXNPFEDSA-N 1 1 354.410 2.524 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCn1c(C)nnc1N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001545660248 1071827961 /nfs/dbraw/zinc/82/79/61/1071827961.db2.gz VPPJYFXJFNHIIM-CQSZACIVSA-N 1 1 372.473 2.788 20 5 FFBDMO C[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC001452735223 1059288111 /nfs/dbraw/zinc/28/81/11/1059288111.db2.gz GBWUNBXUVDVSMJ-IBGZPJMESA-N 1 1 354.410 2.571 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C2CCC2)c1 ZINC001515244762 1059458401 /nfs/dbraw/zinc/45/84/01/1059458401.db2.gz UGBPLMODENOODA-SFHVURJKSA-N 1 1 370.409 2.948 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1cnn(C2CCC2)c1 ZINC001515244762 1059458415 /nfs/dbraw/zinc/45/84/15/1059458415.db2.gz UGBPLMODENOODA-SFHVURJKSA-N 1 1 370.409 2.948 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC001454489357 1059548109 /nfs/dbraw/zinc/54/81/09/1059548109.db2.gz AKSAQMCLZGVEDY-AWEZNQCLSA-N 1 1 354.410 2.696 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000848478485 1060109641 /nfs/dbraw/zinc/10/96/41/1060109641.db2.gz NYMVISCJJPZYKL-RDJZCZTQSA-N 1 1 355.394 2.951 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000848478485 1060109655 /nfs/dbraw/zinc/10/96/55/1060109655.db2.gz NYMVISCJJPZYKL-RDJZCZTQSA-N 1 1 355.394 2.951 20 5 FFBDMO CC(C)OC1CC[NH+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848478773 1060110572 /nfs/dbraw/zinc/11/05/72/1060110572.db2.gz RNFWDCHNMONXGF-SFHVURJKSA-N 1 1 361.442 2.758 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848481050 1060112712 /nfs/dbraw/zinc/11/27/12/1060112712.db2.gz VQNAJGRWCPLDFI-LPHOPBHVSA-N 1 1 374.485 2.532 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489554 1060147992 /nfs/dbraw/zinc/14/79/92/1060147992.db2.gz NXFQMCCLLUIAKN-QZTJIDSGSA-N 1 1 361.442 2.758 20 5 FFBDMO CC(C)O[C@@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489554 1060148000 /nfs/dbraw/zinc/14/80/00/1060148000.db2.gz NXFQMCCLLUIAKN-QZTJIDSGSA-N 1 1 361.442 2.758 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC001458358161 1060572342 /nfs/dbraw/zinc/57/23/42/1060572342.db2.gz RUYFZABFUYAQGP-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC001458358161 1060572354 /nfs/dbraw/zinc/57/23/54/1060572354.db2.gz RUYFZABFUYAQGP-UHFFFAOYSA-N 1 1 372.263 2.904 20 5 FFBDMO COCC[N@H+]1CCC[C@@H](Nc2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC001458449378 1060593787 /nfs/dbraw/zinc/59/37/87/1060593787.db2.gz ZYQUOXVUJHYSCE-GFCCVEGCSA-N 1 1 364.833 2.741 20 5 FFBDMO CC[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2[C@@H]2C[C@@H]2C)C[C@@H]1C ZINC001547710939 1071990862 /nfs/dbraw/zinc/99/08/62/1071990862.db2.gz QINNQVQIPAHICD-GRDNDAEWSA-N 1 1 370.457 2.965 20 5 FFBDMO C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(N2CCCOC2=O)cc1 ZINC001460173741 1060912671 /nfs/dbraw/zinc/91/26/71/1060912671.db2.gz VAEDOUVXKFLEQE-LBPRGKRZSA-N 1 1 359.386 2.526 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001462244073 1061553620 /nfs/dbraw/zinc/55/36/20/1061553620.db2.gz NPSQZQWZGIKGDU-MRXNPFEDSA-N 1 1 361.442 2.887 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1NC(=O)OC(C)(C)C ZINC000769880422 1061910205 /nfs/dbraw/zinc/91/02/05/1061910205.db2.gz NCPGXSBFOLDVPR-CZUORRHYSA-N 1 1 365.430 2.819 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001463224174 1062002440 /nfs/dbraw/zinc/00/24/40/1062002440.db2.gz SCNLOSGQLYTADA-AWEZNQCLSA-N 1 1 360.439 2.932 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001479476665 1062454068 /nfs/dbraw/zinc/45/40/68/1062454068.db2.gz NAPCDZOZGWIFTF-WBVHZDCISA-N 1 1 360.458 2.826 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001464548267 1062678222 /nfs/dbraw/zinc/67/82/22/1062678222.db2.gz XGNJHEXSMJHPAH-NSHDSACASA-N 1 1 354.838 2.681 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001471030877 1064530415 /nfs/dbraw/zinc/53/04/15/1064530415.db2.gz OBGMUKUVZNQCOQ-GDBMZVCRSA-N 1 1 368.437 2.675 20 5 FFBDMO CC(=O)c1ccc2c(c1)CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C2 ZINC001575040933 1078099769 /nfs/dbraw/zinc/09/97/69/1078099769.db2.gz IVMWCYQWZLOXFG-IBGZPJMESA-N 1 1 353.378 2.514 20 5 FFBDMO CC(=O)c1ccc2c(c1)CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C2 ZINC001575040934 1078100056 /nfs/dbraw/zinc/10/00/56/1078100056.db2.gz IVMWCYQWZLOXFG-LJQANCHMSA-N 1 1 353.378 2.514 20 5 FFBDMO CN(C)c1nc2c(s1)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC001473763712 1065350636 /nfs/dbraw/zinc/35/06/36/1065350636.db2.gz BJGAGEKELGOTOM-UHFFFAOYSA-N 1 1 362.455 2.945 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1Cc2c[nH]nc2C[C@H](C)C1 ZINC001473797168 1065365643 /nfs/dbraw/zinc/36/56/43/1065365643.db2.gz NXYJMITYFBBGEB-LBPRGKRZSA-N 1 1 357.414 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3nccc4c3CCCC4)C2)nc1 ZINC001474324237 1065493871 /nfs/dbraw/zinc/49/38/71/1065493871.db2.gz ONGPHWMOSCQAKP-OAHLLOKOSA-N 1 1 353.426 2.950 20 5 FFBDMO Cc1cc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c(F)cc1[N+](=O)[O-] ZINC001475024047 1065677171 /nfs/dbraw/zinc/67/71/71/1065677171.db2.gz ZVBGSJMGWKZQTN-ZDUSSCGKSA-N 1 1 373.450 2.537 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001558210155 1075961477 /nfs/dbraw/zinc/96/14/77/1075961477.db2.gz HZWLVNFSFVNEPQ-JTOWHCCKSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001558210155 1075961485 /nfs/dbraw/zinc/96/14/85/1075961485.db2.gz HZWLVNFSFVNEPQ-JTOWHCCKSA-N 1 1 363.458 2.906 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])c(C)[nH+]1 ZINC001558462330 1076011284 /nfs/dbraw/zinc/01/12/84/1076011284.db2.gz DPFFPZQIWXQNAN-UHFFFAOYSA-N 1 1 351.366 2.927 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001559080731 1076123714 /nfs/dbraw/zinc/12/37/14/1076123714.db2.gz SFLVBJFRNGERJM-KGLIPLIRSA-N 1 1 358.442 2.979 20 5 FFBDMO CCc1cc(N2CC[C@H]3C[N@@H+](C)C[C@@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001559200003 1076133949 /nfs/dbraw/zinc/13/39/49/1076133949.db2.gz JGYRDIFVZMNFSN-YOEHRIQHSA-N 1 1 353.426 2.755 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@@H]21 ZINC001559259891 1076140845 /nfs/dbraw/zinc/14/08/45/1076140845.db2.gz PXGCUOFWFBYLTH-NHYWBVRUSA-N 1 1 357.370 2.582 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)[C@H]1CCCc2ccccc21 ZINC001559573188 1076174432 /nfs/dbraw/zinc/17/44/32/1076174432.db2.gz YWAKTLLSQMPSFH-SFHVURJKSA-N 1 1 358.442 2.862 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C3CCCC3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001560144986 1076235223 /nfs/dbraw/zinc/23/52/23/1076235223.db2.gz VZLPJXAZKFDTNE-OAHLLOKOSA-N 1 1 363.458 2.931 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187211 1076243544 /nfs/dbraw/zinc/24/35/44/1076243544.db2.gz BMBMDZUOYUVRQD-WCQYABFASA-N 1 1 360.370 2.591 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001560187211 1076243546 /nfs/dbraw/zinc/24/35/46/1076243546.db2.gz BMBMDZUOYUVRQD-WCQYABFASA-N 1 1 360.370 2.591 20 5 FFBDMO Cc1ccc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001568084919 1077070507 /nfs/dbraw/zinc/07/05/07/1077070507.db2.gz IVAZWDVCCGFGEG-RTBURBONSA-N 1 1 359.470 2.687 20 5 FFBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590164677 1081063459 /nfs/dbraw/zinc/06/34/59/1081063459.db2.gz GSTNLWMTUYNFGI-GZMMTYOYSA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1 ZINC001590261445 1081128764 /nfs/dbraw/zinc/12/87/64/1081128764.db2.gz WJDZZEBGVHIERW-ZDUSSCGKSA-N 1 1 359.434 2.699 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C(C)C)[NH+]1CCOCC1 ZINC000093910859 250050091 /nfs/dbraw/zinc/05/00/91/250050091.db2.gz BXSWPSMBKSBMJC-MRXNPFEDSA-N 1 1 363.458 2.607 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000272390008 252025945 /nfs/dbraw/zinc/02/59/45/252025945.db2.gz UEUGYHGFTCBHCK-LBPRGKRZSA-N 1 1 363.443 2.546 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000272474559 252047556 /nfs/dbraw/zinc/04/75/56/252047556.db2.gz IRGQZQWHUKLYML-CZUORRHYSA-N 1 1 366.849 2.526 20 5 FFBDMO COc1cc(CN2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000272634394 252086098 /nfs/dbraw/zinc/08/60/98/252086098.db2.gz NOMHMQKGRILEIG-SMDDNHRTSA-N 1 1 371.384 2.731 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](CO)c1ccccc1 ZINC000275450056 256008358 /nfs/dbraw/zinc/00/83/58/256008358.db2.gz ILJJFFKBCDRWJV-KRWDZBQOSA-N 1 1 361.373 2.728 20 5 FFBDMO CC(C)[C@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)[NH+]1CCCC1 ZINC000276059839 256069623 /nfs/dbraw/zinc/06/96/23/256069623.db2.gz KJODPBLNOZJWMO-HNNXBMFYSA-N 1 1 355.460 2.531 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000277645601 256221364 /nfs/dbraw/zinc/22/13/64/256221364.db2.gz SEOJFBZXAXPZQJ-QJPKHSJYSA-N 1 1 361.442 2.615 20 5 FFBDMO C[C@H](c1cccnc1)[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000278473678 256316633 /nfs/dbraw/zinc/31/66/33/256316633.db2.gz UUKUNGVRIIRCGI-CQSZACIVSA-N 1 1 353.426 2.841 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCO[C@@H](C)C2)c1 ZINC000278534314 256322468 /nfs/dbraw/zinc/32/24/68/256322468.db2.gz NPOBTWWYQYCSFZ-ZDUSSCGKSA-N 1 1 367.471 2.547 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000286116953 257021090 /nfs/dbraw/zinc/02/10/90/257021090.db2.gz UPBZIHOCPDBYHV-BBRMVZONSA-N 1 1 350.415 2.977 20 5 FFBDMO Cc1nn(C)c(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000286260969 257028136 /nfs/dbraw/zinc/02/81/36/257028136.db2.gz GQKYKSJGPCETBL-IBGZPJMESA-N 1 1 355.442 2.739 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CCC(=O)Nc4cc([N+](=O)[O-])ccc4C)[C@H]1[C@H]3C2 ZINC000286545350 257042102 /nfs/dbraw/zinc/04/21/02/257042102.db2.gz OJFDDEJIYMADJC-RSADAIHESA-N 1 1 359.426 2.587 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCC(F)(F)CC1 ZINC000287130725 257073645 /nfs/dbraw/zinc/07/36/45/257073645.db2.gz ZWOIZSWNJFRFEW-UHFFFAOYSA-N 1 1 371.340 2.772 20 5 FFBDMO O=C(CC[N@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1)Nc1ccccc1[N+](=O)[O-] ZINC000289419089 257280061 /nfs/dbraw/zinc/28/00/61/257280061.db2.gz BSYLRKKCMAFFKJ-AEFFLSMTSA-N 1 1 359.426 2.957 20 5 FFBDMO CCC[C@]1(CO)CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000290266984 257322757 /nfs/dbraw/zinc/32/27/57/257322757.db2.gz XJHPFXBRTDTOMF-IBGZPJMESA-N 1 1 358.442 2.980 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293601849 257553679 /nfs/dbraw/zinc/55/36/79/257553679.db2.gz VBXMPEWWCOEUHF-ZIAGYGMSSA-N 1 1 357.332 2.970 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000301185885 258032655 /nfs/dbraw/zinc/03/26/55/258032655.db2.gz JYWIDCQDMZQXKQ-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOCC12CCCC2 ZINC000299680551 258016566 /nfs/dbraw/zinc/01/65/66/258016566.db2.gz MYXHGNRONPQQOA-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO CNC(=O)c1ccc(NCc2ccc(C)[nH+]c2N2CCCC2)c([N+](=O)[O-])c1 ZINC000302050555 258085102 /nfs/dbraw/zinc/08/51/02/258085102.db2.gz NPJDVQPXIFCIEX-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO COc1cccc([C@H]2[C@@H](Nc3ncc([N+](=O)[O-])cn3)CC[N@H+]2C2CC2)c1 ZINC000302236937 258097065 /nfs/dbraw/zinc/09/70/65/258097065.db2.gz WAFGPRSILACMEN-IRXDYDNUSA-N 1 1 355.398 2.783 20 5 FFBDMO C[C@@H](O)C[NH+]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000302559857 258105993 /nfs/dbraw/zinc/10/59/93/258105993.db2.gz SZCBCAFSOSLLBT-SECBINFHSA-N 1 1 367.755 2.770 20 5 FFBDMO COC(=O)c1cnc(NCc2ccc(C)[nH+]c2N2CCCC2)c([N+](=O)[O-])c1 ZINC000302783942 258110504 /nfs/dbraw/zinc/11/05/04/258110504.db2.gz UNOCSUOEDBLWFW-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N1CC[C@H]([NH+]2CC=CC2)C1 ZINC000301416797 258048477 /nfs/dbraw/zinc/04/84/77/258048477.db2.gz AVDPLVONTLNGRI-NSHDSACASA-N 1 1 372.303 2.972 20 5 FFBDMO COC(=O)c1cc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)cc(C)c1[N+](=O)[O-] ZINC000301712256 258064429 /nfs/dbraw/zinc/06/44/29/258064429.db2.gz LABBGBODCJVITE-CQSZACIVSA-N 1 1 372.425 2.882 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2C[C@@H](O)C[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000301875634 258072069 /nfs/dbraw/zinc/07/20/69/258072069.db2.gz MOLBNUYVIDEWEC-DZGCQCFKSA-N 1 1 362.817 2.691 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@H](C)[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402836 258229017 /nfs/dbraw/zinc/22/90/17/258229017.db2.gz VBBGYJYVYLCBIO-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402836 258229018 /nfs/dbraw/zinc/22/90/18/258229018.db2.gz VBBGYJYVYLCBIO-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000366653809 512125204 /nfs/dbraw/zinc/12/52/04/512125204.db2.gz NSQFDURTQVRRIK-UPJWGTAASA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H]([C@H]2CCOC2)C1 ZINC000366653809 512125198 /nfs/dbraw/zinc/12/51/98/512125198.db2.gz NSQFDURTQVRRIK-UPJWGTAASA-N 1 1 367.833 2.934 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095164 512169089 /nfs/dbraw/zinc/16/90/89/512169089.db2.gz OIUFOFCQCNLMJI-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cn1ccnc1[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000373095164 512169093 /nfs/dbraw/zinc/16/90/93/512169093.db2.gz OIUFOFCQCNLMJI-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO Cc1noc(C)c1CO[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000375157675 512187790 /nfs/dbraw/zinc/18/77/90/512187790.db2.gz GMNNRWBARAKSMD-SJLPKXTDSA-N 1 1 361.398 2.524 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC000366850902 512217583 /nfs/dbraw/zinc/21/75/83/512217583.db2.gz LJCIYOQQPVLYKB-IAGOWNOFSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC000366850902 512217585 /nfs/dbraw/zinc/21/75/85/512217585.db2.gz LJCIYOQQPVLYKB-IAGOWNOFSA-N 1 1 358.373 2.613 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCCC2(CC[NH+](C)CC2)C1 ZINC000366884815 512233362 /nfs/dbraw/zinc/23/33/62/512233362.db2.gz ORNPEGMJPZCVMJ-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CCOc1ccccc1 ZINC000007419099 506562298 /nfs/dbraw/zinc/56/22/98/506562298.db2.gz BFLDIZNZEQDPTL-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCOc1ccccc1 ZINC000007419099 506562301 /nfs/dbraw/zinc/56/23/01/506562301.db2.gz BFLDIZNZEQDPTL-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1OCC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000042180510 506607623 /nfs/dbraw/zinc/60/76/23/506607623.db2.gz OYPQEHFMTSDLPF-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(=O)c2ccoc2C)CC1 ZINC000066891373 506681823 /nfs/dbraw/zinc/68/18/23/506681823.db2.gz LAZYRCGYPSUJFA-UHFFFAOYSA-N 1 1 373.409 2.899 20 5 FFBDMO O=C(NC1CC1)[C@@H]([NH2+]CCNc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000010172946 506730219 /nfs/dbraw/zinc/73/02/19/506730219.db2.gz FKOODXVCTDTBQU-SFHVURJKSA-N 1 1 372.400 2.755 20 5 FFBDMO O=C(NC1CC1)[C@@H]([NH2+]CCNc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000010172886 506730381 /nfs/dbraw/zinc/73/03/81/506730381.db2.gz KTFUYCADOBTHJY-SFHVURJKSA-N 1 1 372.400 2.755 20 5 FFBDMO CNc1ccc(C(=O)N2CC[NH+](CCc3cccs3)CC2)cc1[N+](=O)[O-] ZINC000055643571 506811095 /nfs/dbraw/zinc/81/10/95/506811095.db2.gz GYADERRWOQSQQC-UHFFFAOYSA-N 1 1 374.466 2.699 20 5 FFBDMO Cc1cccc(C[NH+]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000067536878 506915332 /nfs/dbraw/zinc/91/53/32/506915332.db2.gz LUODAQFSBSRJDM-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000067538472 506916170 /nfs/dbraw/zinc/91/61/70/506916170.db2.gz HEQNBGTWOXACIM-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO COc1ccc(CC(=O)NCCC[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000067794983 507010811 /nfs/dbraw/zinc/01/08/11/507010811.db2.gz FRNMUTBORHHECO-UHFFFAOYSA-N 1 1 371.437 2.784 20 5 FFBDMO CCN1C(=O)N=NC1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000377567319 512330933 /nfs/dbraw/zinc/33/09/33/512330933.db2.gz XHLVMAWWOJNFKG-UHFFFAOYSA-N 1 1 365.821 2.945 20 5 FFBDMO CC(C)N(C(=O)[C@H](C)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(C)C ZINC000047744182 507387418 /nfs/dbraw/zinc/38/74/18/507387418.db2.gz SXYWMAIWCGNBSG-INIZCTEOSA-N 1 1 362.474 2.751 20 5 FFBDMO CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000071014311 507679737 /nfs/dbraw/zinc/67/97/37/507679737.db2.gz JLBLTSLOUUKGRK-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000377617389 512356162 /nfs/dbraw/zinc/35/61/62/512356162.db2.gz APUHAJUTOSPKKB-XZXOBPBMSA-N 1 1 358.486 2.708 20 5 FFBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000377617389 512356165 /nfs/dbraw/zinc/35/61/65/512356165.db2.gz APUHAJUTOSPKKB-XZXOBPBMSA-N 1 1 358.486 2.708 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C ZINC000071959597 507730148 /nfs/dbraw/zinc/73/01/48/507730148.db2.gz WYRVPTZTTRAKTR-KRWDZBQOSA-N 1 1 360.410 2.784 20 5 FFBDMO CN(C(=O)C[N@H+](C)CCOc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000029121456 507761204 /nfs/dbraw/zinc/76/12/04/507761204.db2.gz VEFDPYOCZYSNOO-UHFFFAOYSA-N 1 1 361.373 2.708 20 5 FFBDMO CN(C(=O)C[N@@H+](C)CCOc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000029121456 507761206 /nfs/dbraw/zinc/76/12/06/507761206.db2.gz VEFDPYOCZYSNOO-UHFFFAOYSA-N 1 1 361.373 2.708 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(F)c4cccnc34)CC2)cn1 ZINC000029820703 507791793 /nfs/dbraw/zinc/79/17/93/507791793.db2.gz MMUUYDCCFCTPMF-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCCOc1ccccc1 ZINC000029852055 507793126 /nfs/dbraw/zinc/79/31/26/507793126.db2.gz WUAQEYQZJVLVRN-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCCOc1ccccc1 ZINC000029852055 507793128 /nfs/dbraw/zinc/79/31/28/507793128.db2.gz WUAQEYQZJVLVRN-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO Cc1cnn(CCCCC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665106 507840027 /nfs/dbraw/zinc/84/00/27/507840027.db2.gz GWRQZEACZPGBLE-INIZCTEOSA-N 1 1 358.446 2.851 20 5 FFBDMO CC[C@@](C)([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000072685187 507842052 /nfs/dbraw/zinc/84/20/52/507842052.db2.gz QOHUDUMQKMUEDE-QGZVFWFLSA-N 1 1 360.439 2.855 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-] ZINC000078335983 507861937 /nfs/dbraw/zinc/86/19/37/507861937.db2.gz SBYIUHDYCKRKNP-UHFFFAOYSA-N 1 1 357.414 2.884 20 5 FFBDMO CN(CC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000107682162 507862493 /nfs/dbraw/zinc/86/24/93/507862493.db2.gz IOSKLUGOISQGIG-UHFFFAOYSA-N 1 1 368.437 2.552 20 5 FFBDMO CN(CC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000107682162 507862496 /nfs/dbraw/zinc/86/24/96/507862496.db2.gz IOSKLUGOISQGIG-UHFFFAOYSA-N 1 1 368.437 2.552 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCN(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000107683220 507862878 /nfs/dbraw/zinc/86/28/78/507862878.db2.gz FFVDHYGSRKQOQM-UHFFFAOYSA-N 1 1 372.425 2.610 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCN(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000107683220 507862879 /nfs/dbraw/zinc/86/28/79/507862879.db2.gz FFVDHYGSRKQOQM-UHFFFAOYSA-N 1 1 372.425 2.610 20 5 FFBDMO CN(CC[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000107683448 507863470 /nfs/dbraw/zinc/86/34/70/507863470.db2.gz AVBRADXQFSGWST-UHFFFAOYSA-N 1 1 356.426 2.626 20 5 FFBDMO CN(CC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000107683448 507863472 /nfs/dbraw/zinc/86/34/72/507863472.db2.gz AVBRADXQFSGWST-UHFFFAOYSA-N 1 1 356.426 2.626 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])c[nH]3)cc2)C1 ZINC000072932659 507873919 /nfs/dbraw/zinc/87/39/19/507873919.db2.gz PVNXQBYEKJDGDI-CYBMUJFWSA-N 1 1 358.398 2.896 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986908 507881432 /nfs/dbraw/zinc/88/14/32/507881432.db2.gz SLNLQIGKHUEVJJ-KSSFIOAISA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@H](NC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986908 507881435 /nfs/dbraw/zinc/88/14/35/507881435.db2.gz SLNLQIGKHUEVJJ-KSSFIOAISA-N 1 1 354.410 2.832 20 5 FFBDMO O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000108505983 507899695 /nfs/dbraw/zinc/89/96/95/507899695.db2.gz ITIAGLHGQUUXEY-LLVKDONJSA-N 1 1 370.356 2.802 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000090094087 507908080 /nfs/dbraw/zinc/90/80/80/507908080.db2.gz HIFDHVUNKSJJBI-UHFFFAOYSA-N 1 1 364.409 2.717 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000073842881 507960791 /nfs/dbraw/zinc/96/07/91/507960791.db2.gz ZPKQVKVQTUEMBG-QGZVFWFLSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nncn3C3CC3)C2)cc1 ZINC000091629123 507997718 /nfs/dbraw/zinc/99/77/18/507997718.db2.gz XVIMBUMUGGURQE-CQSZACIVSA-N 1 1 357.414 2.780 20 5 FFBDMO COC(=O)CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000074321249 508012011 /nfs/dbraw/zinc/01/20/11/508012011.db2.gz PRUQAKHOQDDXLT-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC=C(c3ccccc3Cl)CC2)c1 ZINC000091856877 508019400 /nfs/dbraw/zinc/01/94/00/508019400.db2.gz XJLFQRLZRXPDFO-OAHLLOKOSA-N 1 1 362.817 2.595 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)NC[C@@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000110651192 508039529 /nfs/dbraw/zinc/03/95/29/508039529.db2.gz WFDDCNBKCWLWLC-GJZGRUSLSA-N 1 1 360.458 2.513 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2CC)cc1OC ZINC000110996520 508063878 /nfs/dbraw/zinc/06/38/78/508063878.db2.gz IWMRKWZDOVCOHK-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO O=C(CN1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000080959963 508117637 /nfs/dbraw/zinc/11/76/37/508117637.db2.gz WFTINUIGOVYKPQ-LLVKDONJSA-N 1 1 363.805 2.789 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000112310550 508173262 /nfs/dbraw/zinc/17/32/62/508173262.db2.gz RHBXJWNEXICZCD-LBPRGKRZSA-N 1 1 357.838 2.864 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000081571209 508191560 /nfs/dbraw/zinc/19/15/60/508191560.db2.gz XFRPZCWSQFJHCH-ZDUSSCGKSA-N 1 1 368.865 2.850 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000083028550 508233187 /nfs/dbraw/zinc/23/31/87/508233187.db2.gz GHWFALIZIDJAHT-BETUJISGSA-N 1 1 369.849 2.867 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[NH+](C3CCC(C(C)C)CC3)CC2)c1[N+](=O)[O-] ZINC000084620896 508287448 /nfs/dbraw/zinc/28/74/48/508287448.db2.gz AJIAGJUUDYBHCH-UHFFFAOYSA-N 1 1 363.462 2.599 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087123423 508338115 /nfs/dbraw/zinc/33/81/15/508338115.db2.gz RWLHSAXFMPSOTF-UHFFFAOYSA-N 1 1 357.414 2.648 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000106317524 508399006 /nfs/dbraw/zinc/39/90/06/508399006.db2.gz JODBIPFOZHJHBQ-OLZOCXBDSA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](Oc3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000156394437 508414118 /nfs/dbraw/zinc/41/41/18/508414118.db2.gz AXDHNQJZERCPOJ-INIZCTEOSA-N 1 1 370.409 2.780 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C[N@H+]1C1CC1 ZINC000133779521 508447992 /nfs/dbraw/zinc/44/79/92/508447992.db2.gz MZMQTUPOBVSRRH-SKDRFNHKSA-N 1 1 357.332 2.969 20 5 FFBDMO Cc1cnn(-c2cc[nH+]cc2NC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000156716912 508467399 /nfs/dbraw/zinc/46/73/99/508467399.db2.gz BCLSEJWZOUDBMJ-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(c3cccnn3)CC2)o1 ZINC000127959266 508527936 /nfs/dbraw/zinc/52/79/36/508527936.db2.gz VMQMSMLQBPWEJK-UHFFFAOYSA-N 1 1 365.393 2.967 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000122833382 508593678 /nfs/dbraw/zinc/59/36/78/508593678.db2.gz WSQARMJTRPPPTF-RDJZCZTQSA-N 1 1 374.485 2.752 20 5 FFBDMO Cc1sc(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000122871098 508599566 /nfs/dbraw/zinc/59/95/66/508599566.db2.gz NEUCXARRMBREEG-LLVKDONJSA-N 1 1 361.489 2.508 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1CSC ZINC000135425327 508602410 /nfs/dbraw/zinc/60/24/10/508602410.db2.gz QCSSURBOOQYKSN-CYBMUJFWSA-N 1 1 353.444 2.759 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000153729797 508636990 /nfs/dbraw/zinc/63/69/90/508636990.db2.gz ACTNXUGRZKYWKX-GFCCVEGCSA-N 1 1 363.414 2.505 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[NH+](C2CCCCC2)CC1 ZINC000123279058 508663051 /nfs/dbraw/zinc/66/30/51/508663051.db2.gz ACGHRNISHDPDAY-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](c2ccccc2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000123377413 508677476 /nfs/dbraw/zinc/67/74/76/508677476.db2.gz JOWGNHXKGCXMRY-CQSZACIVSA-N 1 1 369.377 2.752 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](c2ccccc2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000123377413 508677481 /nfs/dbraw/zinc/67/74/81/508677481.db2.gz JOWGNHXKGCXMRY-CQSZACIVSA-N 1 1 369.377 2.752 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153938234 508681276 /nfs/dbraw/zinc/68/12/76/508681276.db2.gz FCQCBNLWFDTSHT-YJBOKZPZSA-N 1 1 372.469 2.872 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC[C@@H]21 ZINC000158468252 508708307 /nfs/dbraw/zinc/70/83/07/508708307.db2.gz DHWCIFDAUQDTRA-CJNGLKHVSA-N 1 1 354.410 2.699 20 5 FFBDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000154266987 508748725 /nfs/dbraw/zinc/74/87/25/508748725.db2.gz HCPPXYHMOGMXAA-HZMBPMFUSA-N 1 1 370.247 2.816 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137495569 508758665 /nfs/dbraw/zinc/75/86/65/508758665.db2.gz MRNWPIYBWQNBGX-DZGCQCFKSA-N 1 1 354.410 2.570 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000119384354 508785063 /nfs/dbraw/zinc/78/50/63/508785063.db2.gz GRGBRLJTAIRTJV-MRXNPFEDSA-N 1 1 374.485 2.903 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000124541237 508848728 /nfs/dbraw/zinc/84/87/28/508848728.db2.gz NMEMTOSAXWTQHN-QAPCUYQASA-N 1 1 358.442 2.753 20 5 FFBDMO CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)Cc1ccccn1 ZINC000119712072 508849356 /nfs/dbraw/zinc/84/93/56/508849356.db2.gz WRHFQLPVAVSXBQ-UHFFFAOYSA-N 1 1 356.382 2.810 20 5 FFBDMO CC(C)C[C@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[NH+]1CCOCC1 ZINC000119840505 508873570 /nfs/dbraw/zinc/87/35/70/508873570.db2.gz UWTCDNMHFNCIMY-OAHLLOKOSA-N 1 1 374.441 2.553 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c(OC)c1 ZINC000159702808 508877607 /nfs/dbraw/zinc/87/76/07/508877607.db2.gz IIUQSTKZMMISAS-QGZVFWFLSA-N 1 1 373.409 2.611 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@@H](C[NH+]3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000150776324 508891389 /nfs/dbraw/zinc/89/13/89/508891389.db2.gz UHBCWSASHYYVLI-INIZCTEOSA-N 1 1 360.458 2.650 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000125049106 508923340 /nfs/dbraw/zinc/92/33/40/508923340.db2.gz JIPFHJHUDVOADB-INIZCTEOSA-N 1 1 350.419 2.559 20 5 FFBDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000160471937 508991688 /nfs/dbraw/zinc/99/16/88/508991688.db2.gz VWQJNQHXJJGBRU-NFAWXSAZSA-N 1 1 364.402 2.581 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[NH+](C)C ZINC000132343860 509018170 /nfs/dbraw/zinc/01/81/70/509018170.db2.gz ZYYKKXWSFLDRQJ-MRXNPFEDSA-N 1 1 361.373 2.775 20 5 FFBDMO CCN1CCN([C@@H](C)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000155573361 509029625 /nfs/dbraw/zinc/02/96/25/509029625.db2.gz PADGXTXDQNEGQA-QFBILLFUSA-N 1 1 360.502 2.532 20 5 FFBDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000155599889 509035146 /nfs/dbraw/zinc/03/51/46/509035146.db2.gz IWOGOPDOCXJNGW-HOCLYGCPSA-N 1 1 360.458 2.654 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1F ZINC000151566736 509045129 /nfs/dbraw/zinc/04/51/29/509045129.db2.gz GVVWTXHORXSRHT-ZDUSSCGKSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1F ZINC000151566736 509045134 /nfs/dbraw/zinc/04/51/34/509045134.db2.gz GVVWTXHORXSRHT-ZDUSSCGKSA-N 1 1 374.372 2.602 20 5 FFBDMO NC(=O)[C@@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000160970307 509055146 /nfs/dbraw/zinc/05/51/46/509055146.db2.gz CCMUSWRHBKEPLH-LLVKDONJSA-N 1 1 374.363 2.613 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](c2nnc3ccccn32)C1 ZINC000155781936 509071098 /nfs/dbraw/zinc/07/10/98/509071098.db2.gz PNQYHKLJFKINJB-HNNXBMFYSA-N 1 1 367.409 2.896 20 5 FFBDMO CC[N@H+](CCc1nccs1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000121145612 509138315 /nfs/dbraw/zinc/13/83/15/509138315.db2.gz JTPKERFDPJIJBB-HNNXBMFYSA-N 1 1 360.439 2.721 20 5 FFBDMO CC[N@@H+](CCc1nccs1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000121145612 509138321 /nfs/dbraw/zinc/13/83/21/509138321.db2.gz JTPKERFDPJIJBB-HNNXBMFYSA-N 1 1 360.439 2.721 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CCCC[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000162049526 509170647 /nfs/dbraw/zinc/17/06/47/509170647.db2.gz KMERQRHABHEACK-OAHLLOKOSA-N 1 1 359.382 2.703 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCCC[C@@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000162049526 509170649 /nfs/dbraw/zinc/17/06/49/509170649.db2.gz KMERQRHABHEACK-OAHLLOKOSA-N 1 1 359.382 2.703 20 5 FFBDMO Cc1cccc(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000162235107 509181167 /nfs/dbraw/zinc/18/11/67/509181167.db2.gz UCIFVFIWLWKTOH-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000172894294 509297039 /nfs/dbraw/zinc/29/70/39/509297039.db2.gz MTGFKKBRIOKZIR-LBPRGKRZSA-N 1 1 364.423 2.858 20 5 FFBDMO C[C@@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]21 ZINC000248465360 509335497 /nfs/dbraw/zinc/33/54/97/509335497.db2.gz RPKBFNANRJOYEG-XOKHGSTOSA-N 1 1 352.456 2.879 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCCC2=O)CC1 ZINC000264223389 509392825 /nfs/dbraw/zinc/39/28/25/509392825.db2.gz WIHVNMUFHAOMOS-UHFFFAOYSA-N 1 1 361.442 2.969 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000185938339 509437390 /nfs/dbraw/zinc/43/73/90/509437390.db2.gz BNONDLCJFYFDKF-KKUMJFAQSA-N 1 1 364.446 2.766 20 5 FFBDMO CCC[C@@]1(COC)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000248745658 509466689 /nfs/dbraw/zinc/46/66/89/509466689.db2.gz RTWRVCGQHPOWQM-AEFFLSMTSA-N 1 1 352.431 2.616 20 5 FFBDMO COC(=O)[C@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000192384091 509496376 /nfs/dbraw/zinc/49/63/76/509496376.db2.gz RUVDLTLAFIBJLP-ZDUSSCGKSA-N 1 1 363.414 2.648 20 5 FFBDMO COc1cc(N(C)C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000186166028 509555265 /nfs/dbraw/zinc/55/52/65/509555265.db2.gz ULSPNXDCXYNLQI-HXUWFJFHSA-N 1 1 371.437 2.677 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000249119392 509611366 /nfs/dbraw/zinc/61/13/66/509611366.db2.gz SMTIKIQJZILMKB-CZUORRHYSA-N 1 1 373.409 2.923 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000264582390 509612948 /nfs/dbraw/zinc/61/29/48/509612948.db2.gz JUJMCXDODQNXSV-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](N2CCCCC2)C1 ZINC000264582390 509612953 /nfs/dbraw/zinc/61/29/53/509612953.db2.gz JUJMCXDODQNXSV-QGZVFWFLSA-N 1 1 360.458 2.792 20 5 FFBDMO COc1cccc([C@@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@@H+]2C2CC2)c1 ZINC000183245832 509676647 /nfs/dbraw/zinc/67/66/47/509676647.db2.gz AJAOZHRDTFPTDX-CRAIPNDOSA-N 1 1 371.393 2.904 20 5 FFBDMO COc1cccc([C@@H]2[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)CC[N@H+]2C2CC2)c1 ZINC000183245832 509676649 /nfs/dbraw/zinc/67/66/49/509676649.db2.gz AJAOZHRDTFPTDX-CRAIPNDOSA-N 1 1 371.393 2.904 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br)C1CC1 ZINC000267944648 509681971 /nfs/dbraw/zinc/68/19/71/509681971.db2.gz ORSDJTBXNSDFAG-UHFFFAOYSA-N 1 1 374.210 2.711 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1Nc1ccc2c(c1)[nH+]c1n2CCCCC1 ZINC000192900298 509691260 /nfs/dbraw/zinc/69/12/60/509691260.db2.gz PDTAZARCRWCQHA-UHFFFAOYSA-N 1 1 366.381 2.908 20 5 FFBDMO CN(CC(=O)N1CCC[N@H+](C2CCCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000173664275 509707594 /nfs/dbraw/zinc/70/75/94/509707594.db2.gz LBRQLLXVMVQMBZ-UHFFFAOYSA-N 1 1 360.458 2.508 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000264914915 509772651 /nfs/dbraw/zinc/77/26/51/509772651.db2.gz OEHHPRSEJWFLOV-CQSZACIVSA-N 1 1 371.441 2.844 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1c1ccccc1 ZINC000180146835 509778654 /nfs/dbraw/zinc/77/86/54/509778654.db2.gz KAUABHDMDALFDP-AEFFLSMTSA-N 1 1 365.393 2.646 20 5 FFBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])CC(C)(C)O ZINC000180160088 509785856 /nfs/dbraw/zinc/78/58/56/509785856.db2.gz QNYCKLVDOJMREK-UHFFFAOYSA-N 1 1 362.373 2.840 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000186586952 509788513 /nfs/dbraw/zinc/78/85/13/509788513.db2.gz KHGUZKPBQCCCEC-GGPKGHCWSA-N 1 1 374.529 2.922 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180170797 509791400 /nfs/dbraw/zinc/79/14/00/509791400.db2.gz UZUJYEKQINDYBV-DGCLKSJQSA-N 1 1 374.384 2.983 20 5 FFBDMO O=C1C[C@H]([N@@H+]2CC[C@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000250217492 509793601 /nfs/dbraw/zinc/79/36/01/509793601.db2.gz WEZVYEOCVWHMDJ-YJBOKZPZSA-N 1 1 365.389 2.716 20 5 FFBDMO O=C1C[C@H]([N@H+]2CC[C@H](c3ccccc3)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000250217492 509793603 /nfs/dbraw/zinc/79/36/03/509793603.db2.gz WEZVYEOCVWHMDJ-YJBOKZPZSA-N 1 1 365.389 2.716 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1ccco1 ZINC000268387063 509901315 /nfs/dbraw/zinc/90/13/15/509901315.db2.gz PALSNRGLEBIBGX-AWEZNQCLSA-N 1 1 366.805 2.943 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[N@H+]1C1CC1 ZINC000177172963 509917614 /nfs/dbraw/zinc/91/76/14/509917614.db2.gz YAQPJSDDWLWLIS-VHSXEESVSA-N 1 1 368.231 2.712 20 5 FFBDMO CCCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 ZINC000255515592 509927091 /nfs/dbraw/zinc/92/70/91/509927091.db2.gz YPIVKSNVZPAEID-IOBAAEILSA-N 1 1 352.456 2.897 20 5 FFBDMO CCCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 ZINC000255515592 509927100 /nfs/dbraw/zinc/92/71/00/509927100.db2.gz YPIVKSNVZPAEID-IOBAAEILSA-N 1 1 352.456 2.897 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000245446096 509940367 /nfs/dbraw/zinc/94/03/67/509940367.db2.gz ZMQCLQMABAHUAS-BBRMVZONSA-N 1 1 359.430 2.807 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180531317 509969791 /nfs/dbraw/zinc/96/97/91/509969791.db2.gz AMKFTGFBTZPLDF-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000193585240 509977420 /nfs/dbraw/zinc/97/74/20/509977420.db2.gz UJWKSWITMCCXQM-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585240 509977432 /nfs/dbraw/zinc/97/74/32/509977432.db2.gz UJWKSWITMCCXQM-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585240 509977435 /nfs/dbraw/zinc/97/74/35/509977435.db2.gz UJWKSWITMCCXQM-CYBMUJFWSA-N 1 1 373.413 2.535 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(F)F)CC[C@H]21 ZINC000245534640 509988503 /nfs/dbraw/zinc/98/85/03/509988503.db2.gz WDZDIJRSIPTQOP-SMDDNHRTSA-N 1 1 369.368 2.753 20 5 FFBDMO CC[C@]1(CO)CCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000190214105 510008370 /nfs/dbraw/zinc/00/83/70/510008370.db2.gz DNTRSECHQREIJK-IBGZPJMESA-N 1 1 358.442 2.980 20 5 FFBDMO C[C@]([NH2+]CCOc1ccccc1[N+](=O)[O-])(C(N)=O)c1cccc(Cl)c1 ZINC000177414438 510045098 /nfs/dbraw/zinc/04/50/98/510045098.db2.gz OOGJIMMWBZCNQA-QGZVFWFLSA-N 1 1 363.801 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CN(C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000190310382 510054830 /nfs/dbraw/zinc/05/48/30/510054830.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000190310382 510054840 /nfs/dbraw/zinc/05/48/40/510054840.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000190310382 510054847 /nfs/dbraw/zinc/05/48/47/510054847.db2.gz UAVBDTDWEAHHRR-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193794387 510074953 /nfs/dbraw/zinc/07/49/53/510074953.db2.gz ROIBMPMDRQCCEL-KRWDZBQOSA-N 1 1 353.422 2.776 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193813737 510082951 /nfs/dbraw/zinc/08/29/51/510082951.db2.gz YSUIWWIHXZLNAF-SFHVURJKSA-N 1 1 353.422 2.776 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1 ZINC000193817731 510085547 /nfs/dbraw/zinc/08/55/47/510085547.db2.gz CKMARCZJYPOCGG-INIZCTEOSA-N 1 1 365.386 2.663 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000193856338 510102160 /nfs/dbraw/zinc/10/21/60/510102160.db2.gz YOHBTCZDYDABOL-UHFFFAOYSA-N 1 1 372.425 2.535 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000171354645 510102418 /nfs/dbraw/zinc/10/24/18/510102418.db2.gz SPUJGZZYMZFJIN-KRWDZBQOSA-N 1 1 368.437 2.593 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)NCc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]21 ZINC000268936683 510146074 /nfs/dbraw/zinc/14/60/74/510146074.db2.gz OYIYIXGCKYHACO-BLLLJJGKSA-N 1 1 366.849 2.874 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](c4cc[nH]n4)C3)n2)c1 ZINC000193995644 510167366 /nfs/dbraw/zinc/16/73/66/510167366.db2.gz LVSOOSHXAPPIRH-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](c4cc[nH]n4)C3)n2)c1 ZINC000193995644 510167371 /nfs/dbraw/zinc/16/73/71/510167371.db2.gz LVSOOSHXAPPIRH-CYBMUJFWSA-N 1 1 354.370 2.748 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+]Cc3ccccc32)cc1[N+](=O)[O-] ZINC000262282637 510231450 /nfs/dbraw/zinc/23/14/50/510231450.db2.gz UUBRJCYQWVBNGH-CYBMUJFWSA-N 1 1 361.423 2.590 20 5 FFBDMO CCc1oc2ccccc2c1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174693838 510255346 /nfs/dbraw/zinc/25/53/46/510255346.db2.gz ZJVRHAOEABHOID-CQSZACIVSA-N 1 1 358.398 2.593 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2c(N)cccc2[N+](=O)[O-])c1 ZINC000181063637 510264771 /nfs/dbraw/zinc/26/47/71/510264771.db2.gz OIJHKBIVUMXBII-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)nc2)cccc1[N+](=O)[O-] ZINC000177826805 510275972 /nfs/dbraw/zinc/27/59/72/510275972.db2.gz XSHHBAMURBQFQV-MRXNPFEDSA-N 1 1 369.469 2.901 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccccc2NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000187522436 510313089 /nfs/dbraw/zinc/31/30/89/510313089.db2.gz UAEAWPOIQPNISB-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+](CCCO)Cc2ccc(Cl)c(Cl)c2)c1 ZINC000174855459 510345902 /nfs/dbraw/zinc/34/59/02/510345902.db2.gz ZAMDGKWTPHFTMM-UHFFFAOYSA-N 1 1 373.240 2.983 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000246333669 510431888 /nfs/dbraw/zinc/43/18/88/510431888.db2.gz HBFABCLKBNOQIX-HKUYNNGSSA-N 1 1 356.422 2.824 20 5 FFBDMO Cc1cc(N2CC[NH+](C3CCOCC3)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000181520460 510451652 /nfs/dbraw/zinc/45/16/52/510451652.db2.gz BBWWXADUDOJSCQ-UHFFFAOYSA-N 1 1 356.426 2.752 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)C1 ZINC000266241887 510479341 /nfs/dbraw/zinc/47/93/41/510479341.db2.gz XNXLYPFCGZMXQL-AWEZNQCLSA-N 1 1 362.430 2.720 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000172019255 510502933 /nfs/dbraw/zinc/50/29/33/510502933.db2.gz YQMHKFWUDHYGAH-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000172019255 510502941 /nfs/dbraw/zinc/50/29/41/510502941.db2.gz YQMHKFWUDHYGAH-CQSZACIVSA-N 1 1 351.834 2.986 20 5 FFBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000187946497 510514960 /nfs/dbraw/zinc/51/49/60/510514960.db2.gz RYDXEYOZGMSSGM-BDJLRTHQSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[N@@H+](C)CC12CCCCC2 ZINC000175313364 510584042 /nfs/dbraw/zinc/58/40/42/510584042.db2.gz BKLFCLWFSKZBHQ-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000175313364 510584051 /nfs/dbraw/zinc/58/40/51/510584051.db2.gz BKLFCLWFSKZBHQ-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@@H+](C)CC23CCCCC3)cc1[N+](=O)[O-] ZINC000175312209 510584484 /nfs/dbraw/zinc/58/44/84/510584484.db2.gz JBTQQGXEXOCNBO-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1ccc(S(=O)(=O)N2CC[N@H+](C)CC23CCCCC3)cc1[N+](=O)[O-] ZINC000175312209 510584492 /nfs/dbraw/zinc/58/44/92/510584492.db2.gz JBTQQGXEXOCNBO-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1 ZINC000246739296 510645517 /nfs/dbraw/zinc/64/55/17/510645517.db2.gz IITJRRMKTWHOEW-MAUKXSAKSA-N 1 1 363.458 2.770 20 5 FFBDMO Cc1cccc(C[N@H+](Cc2ccco2)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC000266611124 510687596 /nfs/dbraw/zinc/68/75/96/510687596.db2.gz CGBUSIOGZNJSBZ-GOSISDBHSA-N 1 1 370.409 2.756 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000246876483 510723198 /nfs/dbraw/zinc/72/31/98/510723198.db2.gz ICNIFBROMZCDNS-KBPBESRZSA-N 1 1 351.472 2.876 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000175800129 510797602 /nfs/dbraw/zinc/79/76/02/510797602.db2.gz FCYVJAQVECUCBB-QGZVFWFLSA-N 1 1 360.458 2.701 20 5 FFBDMO CC(C)(C)OC(=O)CCCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000182179589 510798958 /nfs/dbraw/zinc/79/89/58/510798958.db2.gz ZVAMXULFXFCIIC-CQSZACIVSA-N 1 1 364.446 2.988 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000182250140 510833788 /nfs/dbraw/zinc/83/37/88/510833788.db2.gz AQOMBOJFAPGEJB-CQSZACIVSA-N 1 1 365.455 2.744 20 5 FFBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000247486879 510862746 /nfs/dbraw/zinc/86/27/46/510862746.db2.gz KQKPZJQNADDTID-CRAIPNDOSA-N 1 1 374.437 2.906 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOc2cc(O)ccc2C1 ZINC000285374997 510881894 /nfs/dbraw/zinc/88/18/94/510881894.db2.gz CKBVLEZXFMYMKM-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOc2cc(O)ccc2C1 ZINC000285374997 510881898 /nfs/dbraw/zinc/88/18/98/510881898.db2.gz CKBVLEZXFMYMKM-UHFFFAOYSA-N 1 1 371.393 2.832 20 5 FFBDMO Cn1nccc1[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000360306298 510896053 /nfs/dbraw/zinc/89/60/53/510896053.db2.gz WHCSOSOKLCHQHU-AWEZNQCLSA-N 1 1 357.414 2.537 20 5 FFBDMO Cc1cccn2c(=O)cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])nc12 ZINC000285431422 510904057 /nfs/dbraw/zinc/90/40/57/510904057.db2.gz WRUBJEPRSCXMLW-UHFFFAOYSA-N 1 1 352.394 2.586 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000293964410 510912320 /nfs/dbraw/zinc/91/23/20/510912320.db2.gz UCEKATJJXJMODU-INIZCTEOSA-N 1 1 369.874 2.895 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C)[N@H+]1C ZINC000294090422 510951170 /nfs/dbraw/zinc/95/11/70/510951170.db2.gz XMLWVIUFQWAHDS-DTORHVGOSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C)[N@@H+]1C ZINC000294090422 510951174 /nfs/dbraw/zinc/95/11/74/510951174.db2.gz XMLWVIUFQWAHDS-DTORHVGOSA-N 1 1 374.210 2.661 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1 ZINC000282478873 510993250 /nfs/dbraw/zinc/99/32/50/510993250.db2.gz LMFNXSRCCSLQGD-RHSMWYFYSA-N 1 1 353.438 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC([C@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000364657564 510999384 /nfs/dbraw/zinc/99/93/84/510999384.db2.gz MRCJOUJJCKBXDL-HOCLYGCPSA-N 1 1 361.442 2.979 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000361193021 511011604 /nfs/dbraw/zinc/01/16/04/511011604.db2.gz YQPWDRRWOQPJFS-VQIMIIECSA-N 1 1 357.385 2.838 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC000361193021 511011609 /nfs/dbraw/zinc/01/16/09/511011609.db2.gz YQPWDRRWOQPJFS-VQIMIIECSA-N 1 1 357.385 2.838 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000270977518 511044850 /nfs/dbraw/zinc/04/48/50/511044850.db2.gz WWDNDFVLSBGWEV-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000332448499 511082807 /nfs/dbraw/zinc/08/28/07/511082807.db2.gz LTZVFHLFRQOXJO-SFHVURJKSA-N 1 1 360.458 2.607 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)CC1 ZINC000294532392 511094925 /nfs/dbraw/zinc/09/49/25/511094925.db2.gz IYBFTXDWHJMZHJ-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO CC(C)[N@@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000294532392 511094934 /nfs/dbraw/zinc/09/49/34/511094934.db2.gz IYBFTXDWHJMZHJ-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000294532392 511094936 /nfs/dbraw/zinc/09/49/36/511094936.db2.gz IYBFTXDWHJMZHJ-UHFFFAOYSA-N 1 1 357.414 2.541 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000282760029 511100641 /nfs/dbraw/zinc/10/06/41/511100641.db2.gz KYBHXDOFDUPDRB-UHFFFAOYSA-N 1 1 374.372 2.703 20 5 FFBDMO CCOc1cc(C[N@@H+](C)C2CCN(c3cnccn3)CC2)ccc1[N+](=O)[O-] ZINC000364833749 511104204 /nfs/dbraw/zinc/10/42/04/511104204.db2.gz LFNNSMCCINLWLT-UHFFFAOYSA-N 1 1 371.441 2.884 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Cc3cc(F)c(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000279683106 511175459 /nfs/dbraw/zinc/17/54/59/511175459.db2.gz AOOFZRIUNKMCQG-NHYWBVRUSA-N 1 1 369.824 2.873 20 5 FFBDMO CCOCCCN1CC[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481716 511219266 /nfs/dbraw/zinc/21/92/66/511219266.db2.gz NPSMRMKGRIXIGK-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481716 511219270 /nfs/dbraw/zinc/21/92/70/511219270.db2.gz NPSMRMKGRIXIGK-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000271481716 511219275 /nfs/dbraw/zinc/21/92/75/511219275.db2.gz NPSMRMKGRIXIGK-LPHOPBHVSA-N 1 1 365.474 2.700 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818978 511228543 /nfs/dbraw/zinc/22/85/43/511228543.db2.gz QKAWNMMZTCDQOG-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818978 511228548 /nfs/dbraw/zinc/22/85/48/511228548.db2.gz QKAWNMMZTCDQOG-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000365099734 511256117 /nfs/dbraw/zinc/25/61/17/511256117.db2.gz MROLQGGKUUVPTR-VXGBXAGGSA-N 1 1 355.797 2.673 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000365099732 511256183 /nfs/dbraw/zinc/25/61/83/511256183.db2.gz MROLQGGKUUVPTR-NWDGAFQWSA-N 1 1 355.797 2.673 20 5 FFBDMO CCOc1cc(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959633 511281768 /nfs/dbraw/zinc/28/17/68/511281768.db2.gz YEYKZPVPGPSUAS-PMUMKWKESA-N 1 1 350.415 2.762 20 5 FFBDMO CCOc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000279959633 511281772 /nfs/dbraw/zinc/28/17/72/511281772.db2.gz YEYKZPVPGPSUAS-PMUMKWKESA-N 1 1 350.415 2.762 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C1 ZINC000283257714 511296281 /nfs/dbraw/zinc/29/62/81/511296281.db2.gz ABPXNTBUYGZQSL-NSHDSACASA-N 1 1 370.247 2.737 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000365188055 511306091 /nfs/dbraw/zinc/30/60/91/511306091.db2.gz AOCIXCQLRWCVAW-NVXWUHKLSA-N 1 1 373.453 2.969 20 5 FFBDMO C[C@@H]1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295450087 511408926 /nfs/dbraw/zinc/40/89/26/511408926.db2.gz WNTXISWLMADCQG-AWEZNQCLSA-N 1 1 359.426 2.500 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000333984588 511414446 /nfs/dbraw/zinc/41/44/46/511414446.db2.gz CERYVZBOLRYYJN-KOLCDFICSA-N 1 1 370.247 2.878 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3cn[nH]c3)CC2)cccc1[N+](=O)[O-] ZINC000365392167 511421776 /nfs/dbraw/zinc/42/17/76/511421776.db2.gz NKXVLERFZYOMMO-ZDUSSCGKSA-N 1 1 357.414 2.833 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000298842445 511428157 /nfs/dbraw/zinc/42/81/57/511428157.db2.gz AZJYBNUBUXCSHY-UHFFFAOYSA-N 1 1 362.817 2.924 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000298842445 511428162 /nfs/dbraw/zinc/42/81/62/511428162.db2.gz AZJYBNUBUXCSHY-UHFFFAOYSA-N 1 1 362.817 2.924 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](n2cccn2)C1 ZINC000292026543 511436074 /nfs/dbraw/zinc/43/60/74/511436074.db2.gz YQSDMCYUZVXMOC-WFASDCNBSA-N 1 1 354.370 2.849 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](n2cccn2)C1 ZINC000292026543 511436077 /nfs/dbraw/zinc/43/60/77/511436077.db2.gz YQSDMCYUZVXMOC-WFASDCNBSA-N 1 1 354.370 2.849 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000280364667 511438704 /nfs/dbraw/zinc/43/87/04/511438704.db2.gz JZAPZDFYHXMPEP-HNNXBMFYSA-N 1 1 361.373 2.791 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](CC(N)=O)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000280364667 511438710 /nfs/dbraw/zinc/43/87/10/511438710.db2.gz JZAPZDFYHXMPEP-HNNXBMFYSA-N 1 1 361.373 2.791 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000295542500 511439232 /nfs/dbraw/zinc/43/92/32/511439232.db2.gz OLCVGVPOQQTHHH-UHFFFAOYSA-N 1 1 368.397 2.652 20 5 FFBDMO C[C@@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+](C2CCC2)C1 ZINC000292076629 511455584 /nfs/dbraw/zinc/45/55/84/511455584.db2.gz DAOGSGHNJBSGFS-CQSZACIVSA-N 1 1 371.441 2.951 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)C(N)=O ZINC000295605534 511459026 /nfs/dbraw/zinc/45/90/26/511459026.db2.gz NLFWQTDOZDTUAR-LBPRGKRZSA-N 1 1 360.414 2.850 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000363390001 511520650 /nfs/dbraw/zinc/52/06/50/511520650.db2.gz HQSKLIJHDNPTMO-OAHLLOKOSA-N 1 1 369.425 2.527 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292245564 511520790 /nfs/dbraw/zinc/52/07/90/511520790.db2.gz XFSUQIDGMPBMKH-YVEFUNNKSA-N 1 1 366.849 2.603 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CSC)C1 ZINC000292382757 511577082 /nfs/dbraw/zinc/57/70/82/511577082.db2.gz JTESFFDUDZQMJG-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CSC)C1 ZINC000292382757 511577087 /nfs/dbraw/zinc/57/70/87/511577087.db2.gz JTESFFDUDZQMJG-GFCCVEGCSA-N 1 1 353.444 2.617 20 5 FFBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)COCC(F)(F)F ZINC000292417851 511590423 /nfs/dbraw/zinc/59/04/23/511590423.db2.gz KLYODPIVFXXDRI-LLVKDONJSA-N 1 1 356.728 2.620 20 5 FFBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)COCC(F)(F)F ZINC000292417851 511590425 /nfs/dbraw/zinc/59/04/25/511590425.db2.gz KLYODPIVFXXDRI-LLVKDONJSA-N 1 1 356.728 2.620 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1c[nH+]c2c1C[C@@H](C)[C@@H](C)C2 ZINC000296049960 511602864 /nfs/dbraw/zinc/60/28/64/511602864.db2.gz UBMOCWSCONHSMU-NWDGAFQWSA-N 1 1 358.398 2.809 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)C2)C1 ZINC000292699112 511690108 /nfs/dbraw/zinc/69/01/08/511690108.db2.gz QQINZVSRLSAMFZ-INIZCTEOSA-N 1 1 370.356 2.756 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)c1 ZINC000292729365 511700890 /nfs/dbraw/zinc/70/08/90/511700890.db2.gz GLMGYTXJXUTISF-CYBMUJFWSA-N 1 1 373.375 2.768 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](CN3CCOCC3)C2)c1 ZINC000292729365 511700897 /nfs/dbraw/zinc/70/08/97/511700897.db2.gz GLMGYTXJXUTISF-CYBMUJFWSA-N 1 1 373.375 2.768 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000365969195 511756411 /nfs/dbraw/zinc/75/64/11/511756411.db2.gz OKWKZZLZXPWZAB-SFHVURJKSA-N 1 1 371.441 2.648 20 5 FFBDMO CNc1c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000311379129 511776199 /nfs/dbraw/zinc/77/61/99/511776199.db2.gz APDKPRZGCGACMB-CQSZACIVSA-N 1 1 356.426 2.887 20 5 FFBDMO C[N@H+]1CC[C@@H]2OCCN(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)[C@H]2C1 ZINC000284634914 511804124 /nfs/dbraw/zinc/80/41/24/511804124.db2.gz NNJKFACVQCNCDF-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO COC(=O)c1cn([C@H]2CC[N@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)nn1 ZINC000363904814 511840857 /nfs/dbraw/zinc/84/08/57/511840857.db2.gz AZWFKIXBXOFBTM-AWEZNQCLSA-N 1 1 373.413 2.543 20 5 FFBDMO COC(=O)c1cn([C@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)nn1 ZINC000363904814 511840861 /nfs/dbraw/zinc/84/08/61/511840861.db2.gz AZWFKIXBXOFBTM-AWEZNQCLSA-N 1 1 373.413 2.543 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000296687038 511853610 /nfs/dbraw/zinc/85/36/10/511853610.db2.gz JEGHRDQJNZEDBB-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C2CC2)C[C@@H](C)C1 ZINC000296687038 511853615 /nfs/dbraw/zinc/85/36/15/511853615.db2.gz JEGHRDQJNZEDBB-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C2CC2)C[C@@H](C)C1 ZINC000296687038 511853621 /nfs/dbraw/zinc/85/36/21/511853621.db2.gz JEGHRDQJNZEDBB-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000296745666 511881101 /nfs/dbraw/zinc/88/11/01/511881101.db2.gz PFYWMXXDMOESPP-HNAYVOBHSA-N 1 1 370.453 2.665 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000284831630 511890008 /nfs/dbraw/zinc/89/00/08/511890008.db2.gz QKXOSVOXRIYEGU-ZDUSSCGKSA-N 1 1 353.394 2.623 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000284831630 511890009 /nfs/dbraw/zinc/89/00/09/511890009.db2.gz QKXOSVOXRIYEGU-ZDUSSCGKSA-N 1 1 353.394 2.623 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(=O)NCC(F)(F)F)C1 ZINC000275078751 512034608 /nfs/dbraw/zinc/03/46/08/512034608.db2.gz CNZMLXQCIXFIEK-NWDGAFQWSA-N 1 1 359.348 2.965 20 5 FFBDMO C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000293708131 512057564 /nfs/dbraw/zinc/05/75/64/512057564.db2.gz NZVHJNVARJKCFR-HNNXBMFYSA-N 1 1 361.442 2.697 20 5 FFBDMO COc1ccc([C@@H](CO)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000411270854 512554535 /nfs/dbraw/zinc/55/45/35/512554535.db2.gz QFEMXPNBQZAEPK-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCOC[C@@H]3[C@@H]3CCCO3)o2)c1 ZINC000367571804 512564082 /nfs/dbraw/zinc/56/40/82/512564082.db2.gz BZGBAPJVVIFROO-SJORKVTESA-N 1 1 373.409 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOC[C@@H]3[C@@H]3CCCO3)o2)c1 ZINC000367571804 512564087 /nfs/dbraw/zinc/56/40/87/512564087.db2.gz BZGBAPJVVIFROO-SJORKVTESA-N 1 1 373.409 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCOC[C@@H]3[C@H]3CCCO3)o2)c1 ZINC000367571800 512564267 /nfs/dbraw/zinc/56/42/67/512564267.db2.gz BZGBAPJVVIFROO-IAGOWNOFSA-N 1 1 373.409 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOC[C@@H]3[C@H]3CCCO3)o2)c1 ZINC000367571800 512564272 /nfs/dbraw/zinc/56/42/72/512564272.db2.gz BZGBAPJVVIFROO-IAGOWNOFSA-N 1 1 373.409 2.672 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411336048 512585983 /nfs/dbraw/zinc/58/59/83/512585983.db2.gz SDMMDWKPPVHLHJ-HNNXBMFYSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411336048 512585987 /nfs/dbraw/zinc/58/59/87/512585987.db2.gz SDMMDWKPPVHLHJ-HNNXBMFYSA-N 1 1 363.414 2.730 20 5 FFBDMO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)(CN2CC[NH+](C)CC2)CC1 ZINC000367816827 512674931 /nfs/dbraw/zinc/67/49/31/512674931.db2.gz VWAMBJNNELNOSQ-UHFFFAOYSA-N 1 1 374.485 2.651 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000372012250 512678498 /nfs/dbraw/zinc/67/84/98/512678498.db2.gz GYGXWRXUJSIINF-UHFFFAOYSA-N 1 1 368.437 2.771 20 5 FFBDMO C[C@]1(CNC(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000374162084 512686135 /nfs/dbraw/zinc/68/61/35/512686135.db2.gz LNHZWTOAZMTGNQ-HXUWFJFHSA-N 1 1 368.437 2.819 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1F ZINC000411606226 512715065 /nfs/dbraw/zinc/71/50/65/512715065.db2.gz QPIDEKGZICAASE-CHWSQXEVSA-N 1 1 367.421 2.522 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSCC[C@H]1C ZINC000411629039 512726716 /nfs/dbraw/zinc/72/67/16/512726716.db2.gz ZSUZCBBQLMIMCM-GFCCVEGCSA-N 1 1 353.444 2.759 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)C1 ZINC000374301612 512753957 /nfs/dbraw/zinc/75/39/57/512753957.db2.gz KKVJQGDKDAHADR-MOPGFXCFSA-N 1 1 353.422 2.741 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCSC3(CCC3)CC2)c1 ZINC000411855036 512846013 /nfs/dbraw/zinc/84/60/13/512846013.db2.gz JUCJKCAMAYSEQG-OAHLLOKOSA-N 1 1 352.456 2.696 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(N3CCC[C@H](c4[nH+]cc5n4CCCC5)C3)nn21 ZINC000374491981 512857600 /nfs/dbraw/zinc/85/76/00/512857600.db2.gz JPEXLDJBOAEIKC-ZDUSSCGKSA-N 1 1 367.413 2.554 20 5 FFBDMO CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000383248761 512880792 /nfs/dbraw/zinc/88/07/92/512880792.db2.gz AHYPWXZDTOJNNW-OAHLLOKOSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069483 512993962 /nfs/dbraw/zinc/99/39/62/512993962.db2.gz BVICIIPKITXWPG-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408069483 512993965 /nfs/dbraw/zinc/99/39/65/512993965.db2.gz BVICIIPKITXWPG-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-] ZINC000412357443 513052288 /nfs/dbraw/zinc/05/22/88/513052288.db2.gz DWZRCQIWUCJPRB-IBGZPJMESA-N 1 1 361.442 2.940 20 5 FFBDMO CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000450391791 513173347 /nfs/dbraw/zinc/17/33/47/513173347.db2.gz RLARFJCHGLYIOZ-SJLPKXTDSA-N 1 1 371.441 2.785 20 5 FFBDMO CC[C@@H](Nc1ncc([N+](=O)[O-])c(C)n1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000450391791 513173353 /nfs/dbraw/zinc/17/33/53/513173353.db2.gz RLARFJCHGLYIOZ-SJLPKXTDSA-N 1 1 371.441 2.785 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000428994674 513244787 /nfs/dbraw/zinc/24/47/87/513244787.db2.gz PJOYOFYKABARLM-DHSIGJKJSA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429022037 513258207 /nfs/dbraw/zinc/25/82/07/513258207.db2.gz RBXIZWHAVKIKAC-QIIPPGSGSA-N 1 1 360.458 2.504 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]([C@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429023173 513259637 /nfs/dbraw/zinc/25/96/37/513259637.db2.gz DOXPTPZECWZEIZ-ADAWSYLGSA-N 1 1 360.458 2.584 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000421426974 513259803 /nfs/dbraw/zinc/25/98/03/513259803.db2.gz KZWSKZKDAXZYKF-HUUCEWRRSA-N 1 1 363.458 2.829 20 5 FFBDMO CC(C)(C)OC(=O)CN[C@@]1(C)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000440491425 513331982 /nfs/dbraw/zinc/33/19/82/513331982.db2.gz SEPYBXCEFNZZJV-IBGZPJMESA-N 1 1 363.458 2.533 20 5 FFBDMO C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000429409200 513369724 /nfs/dbraw/zinc/36/97/24/513369724.db2.gz OHFTYDAKPQCQPU-OAHLLOKOSA-N 1 1 360.458 2.730 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])CC1 ZINC000421699283 513375031 /nfs/dbraw/zinc/37/50/31/513375031.db2.gz AWKCRSPEHXOKGQ-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000421710156 513382453 /nfs/dbraw/zinc/38/24/53/513382453.db2.gz JDBMOWFXVOQDKS-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO Cc1ccccc1C1CC([N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)C1 ZINC000441461808 513573774 /nfs/dbraw/zinc/57/37/74/513573774.db2.gz HBEJJOCUQNWQBY-GXOAENINSA-N 1 1 370.453 2.871 20 5 FFBDMO C[N@@H+]1CCCC(C)(C)[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000447818354 513581072 /nfs/dbraw/zinc/58/10/72/513581072.db2.gz WHGPPLLSQRZIBT-CQSZACIVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000447818354 513581080 /nfs/dbraw/zinc/58/10/80/513581080.db2.gz WHGPPLLSQRZIBT-CQSZACIVSA-N 1 1 355.460 2.531 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430218048 513590562 /nfs/dbraw/zinc/59/05/62/513590562.db2.gz KXXAMKITEXTREZ-UHFFFAOYSA-N 1 1 371.437 2.930 20 5 FFBDMO COc1cc(C[N@H+](Cc2cccc(C(N)=O)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000451211515 513596074 /nfs/dbraw/zinc/59/60/74/513596074.db2.gz UKGSSIHDDKOEOR-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO COc1cc(C[N@@H+](Cc2cccc(C(N)=O)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000451211515 513596078 /nfs/dbraw/zinc/59/60/78/513596078.db2.gz UKGSSIHDDKOEOR-UHFFFAOYSA-N 1 1 355.394 2.867 20 5 FFBDMO O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1 ZINC000451341703 513687683 /nfs/dbraw/zinc/68/76/83/513687683.db2.gz LLBIFZGBWJZHNF-KSZLIROESA-N 1 1 361.442 2.939 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000451373549 513708277 /nfs/dbraw/zinc/70/82/77/513708277.db2.gz RPOMRGYIYSJGTJ-CFLYGVGMSA-N 1 1 357.410 2.686 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451417261 513737621 /nfs/dbraw/zinc/73/76/21/513737621.db2.gz KYOCQLBIZNWGDC-KBAYOESNSA-N 1 1 361.442 2.857 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-] ZINC000413620308 513737866 /nfs/dbraw/zinc/73/78/66/513737866.db2.gz AASQFCLTQGYJIX-HOTGVXAUSA-N 1 1 361.442 2.938 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1Cc1cc(F)ccc1F ZINC000419305571 513769571 /nfs/dbraw/zinc/76/95/71/513769571.db2.gz XEISSUQXQVLSBK-HNNXBMFYSA-N 1 1 363.364 2.742 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000416462477 513784538 /nfs/dbraw/zinc/78/45/38/513784538.db2.gz QPQAACDWGBRDMG-HUUCEWRRSA-N 1 1 369.487 2.705 20 5 FFBDMO COCCCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000419384437 513795544 /nfs/dbraw/zinc/79/55/44/513795544.db2.gz MPPKQOGMMKNFCC-UHFFFAOYSA-N 1 1 374.235 2.654 20 5 FFBDMO CCOCCCNC(=O)[C@H](C)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549680 513825456 /nfs/dbraw/zinc/82/54/56/513825456.db2.gz QCNRZUDXXDSVGS-DOTOQJQBSA-N 1 1 363.458 2.706 20 5 FFBDMO CCOC(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000451586924 513848708 /nfs/dbraw/zinc/84/87/08/513848708.db2.gz AQUDXAHIGVTNBU-CABCVRRESA-N 1 1 374.397 2.856 20 5 FFBDMO O=C(c1cccc2c(=O)c3cccc(F)c3[nH]c12)N1CC[N@H+]2CCC[C@H]2C1 ZINC000436426241 513851736 /nfs/dbraw/zinc/85/17/36/513851736.db2.gz BIMBCKGJDDAMOA-ZDUSSCGKSA-N 1 1 365.408 2.741 20 5 FFBDMO COC(=O)c1cnc([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000414069231 513962252 /nfs/dbraw/zinc/96/22/52/513962252.db2.gz BNEPXVAERYEGDX-JTQLQIEISA-N 1 1 351.384 2.568 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]2(CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451898182 514055623 /nfs/dbraw/zinc/05/56/23/514055623.db2.gz IVPSSJWJBVYQAD-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451898182 514055627 /nfs/dbraw/zinc/05/56/27/514055627.db2.gz IVPSSJWJBVYQAD-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000427095925 514114337 /nfs/dbraw/zinc/11/43/37/514114337.db2.gz ZALMWWCCLFCZDZ-GOEBONIOSA-N 1 1 369.421 2.996 20 5 FFBDMO CN(c1c(C(N)=O)cccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000420606907 514198903 /nfs/dbraw/zinc/19/89/03/514198903.db2.gz YXXPRBSYWUMQIO-MRXNPFEDSA-N 1 1 368.437 2.795 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000452169549 514226453 /nfs/dbraw/zinc/22/64/53/514226453.db2.gz GILCMHNRLPPBJK-NSHDSACASA-N 1 1 369.368 2.753 20 5 FFBDMO CCCNC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCCC1 ZINC000444656008 514285151 /nfs/dbraw/zinc/28/51/51/514285151.db2.gz BVXFHUTVYQBSCM-UHFFFAOYSA-N 1 1 359.430 2.790 20 5 FFBDMO Cn1ccnc1[C@H](NCC[N@H+]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000449784685 514352350 /nfs/dbraw/zinc/35/23/50/514352350.db2.gz YFMKXFYOAUHOOW-QGZVFWFLSA-N 1 1 357.458 2.882 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000449963540 514443533 /nfs/dbraw/zinc/44/35/33/514443533.db2.gz AOULBHQHLBLTQM-MRXNPFEDSA-N 1 1 371.441 2.727 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2OC)c1 ZINC000475126067 514566323 /nfs/dbraw/zinc/56/63/23/514566323.db2.gz ZRKDPDWCZAJQJI-UHFFFAOYSA-N 1 1 357.410 2.985 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC[C@@H]1CCC[N@@H+](C)C1 ZINC000458155831 514588896 /nfs/dbraw/zinc/58/88/96/514588896.db2.gz AXNFWQYBHQWMEO-OLZOCXBDSA-N 1 1 369.849 2.864 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)nc(C)[nH+]1 ZINC000488816910 514595090 /nfs/dbraw/zinc/59/50/90/514595090.db2.gz NSGCMXYXYMAFPN-UHFFFAOYSA-N 1 1 373.388 2.540 20 5 FFBDMO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ncc(C(F)(F)F)cn2)n1 ZINC000453310375 514596178 /nfs/dbraw/zinc/59/61/78/514596178.db2.gz PXHHELFFFJXKAY-RYUDHWBXSA-N 1 1 370.335 2.874 20 5 FFBDMO Cn1ccnc1[C@H](NCCCC[N@@H+](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000453405247 514622839 /nfs/dbraw/zinc/62/28/39/514622839.db2.gz QEUUKCSQUMXSSB-GOSISDBHSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1cccc(C[N@H+](Cc2c([N+](=O)[O-])ncn2C)C2CCC(O)CC2)c1 ZINC000475364148 514635389 /nfs/dbraw/zinc/63/53/89/514635389.db2.gz ZVRUWRNKQNEVKM-UHFFFAOYSA-N 1 1 374.441 2.643 20 5 FFBDMO COc1cccc(C[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C2CCC(O)CC2)c1 ZINC000475364148 514635399 /nfs/dbraw/zinc/63/53/99/514635399.db2.gz ZVRUWRNKQNEVKM-UHFFFAOYSA-N 1 1 374.441 2.643 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000479937362 514782535 /nfs/dbraw/zinc/78/25/35/514782535.db2.gz CKDXNMBDWSRFLI-OLZOCXBDSA-N 1 1 369.849 2.816 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000467222028 514945197 /nfs/dbraw/zinc/94/51/97/514945197.db2.gz GMIDNMPSLNUMNG-NEPJUHHUSA-N 1 1 354.838 2.872 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC000498569551 514975474 /nfs/dbraw/zinc/97/54/74/514975474.db2.gz APAHKWGQNLHEOD-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO COc1c(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000476310139 514994175 /nfs/dbraw/zinc/99/41/75/514994175.db2.gz UKMBMLZRWHSLAG-ZBFHGGJFSA-N 1 1 369.421 2.996 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000485348546 515005929 /nfs/dbraw/zinc/00/59/29/515005929.db2.gz LPGCGDDFLAVHEF-STQMWFEESA-N 1 1 367.471 2.546 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462491879 515083041 /nfs/dbraw/zinc/08/30/41/515083041.db2.gz SQHTYXHIMIPMHF-YOEHRIQHSA-N 1 1 368.437 2.885 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@@H+](Cc2ccccc2)C1 ZINC000456325124 515094691 /nfs/dbraw/zinc/09/46/91/515094691.db2.gz FRQJSZKVBMMFDW-HNNXBMFYSA-N 1 1 356.426 2.527 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000509294653 515112445 /nfs/dbraw/zinc/11/24/45/515112445.db2.gz PXACTGVPQDSBPH-HZSPNIEDSA-N 1 1 369.412 2.947 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000509294653 515112454 /nfs/dbraw/zinc/11/24/54/515112454.db2.gz PXACTGVPQDSBPH-HZSPNIEDSA-N 1 1 369.412 2.947 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000467810749 515131132 /nfs/dbraw/zinc/13/11/32/515131132.db2.gz GPHAXUGSZKJVRF-FZMZJTMJSA-N 1 1 367.833 2.616 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1C ZINC000480926160 515138203 /nfs/dbraw/zinc/13/82/03/515138203.db2.gz KNHXXMMNIVDQFS-UONOGXRCSA-N 1 1 369.487 2.753 20 5 FFBDMO CNc1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000462781604 515242901 /nfs/dbraw/zinc/24/29/01/515242901.db2.gz YWCUOZMBVPHEBY-CJNGLKHVSA-N 1 1 358.442 2.725 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000472460614 515277822 /nfs/dbraw/zinc/27/78/22/515277822.db2.gz DSOFNTWOFDWORE-NVXWUHKLSA-N 1 1 374.485 2.894 20 5 FFBDMO CCOc1cc(NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000486160693 515360654 /nfs/dbraw/zinc/36/06/54/515360654.db2.gz CNCPCZSNYHDDRC-GOSISDBHSA-N 1 1 371.437 2.825 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000468473559 515374345 /nfs/dbraw/zinc/37/43/45/515374345.db2.gz YEIKWWJJYHTLBR-QGZVFWFLSA-N 1 1 358.442 2.855 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463135234 515379189 /nfs/dbraw/zinc/37/91/89/515379189.db2.gz WBYQMCCWWMJFQQ-NWDGAFQWSA-N 1 1 357.332 2.970 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000468488421 515382374 /nfs/dbraw/zinc/38/23/74/515382374.db2.gz PLZANJGXQHHRAU-KRWDZBQOSA-N 1 1 371.441 2.631 20 5 FFBDMO COCC[N@@H+]1CC[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146010 515505377 /nfs/dbraw/zinc/50/53/77/515505377.db2.gz YCINQAZKALPDKW-AZUAARDMSA-N 1 1 355.438 2.995 20 5 FFBDMO COCC[N@H+]1CC[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000492146010 515505386 /nfs/dbraw/zinc/50/53/86/515505386.db2.gz YCINQAZKALPDKW-AZUAARDMSA-N 1 1 355.438 2.995 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)NCC[NH+]2CCC2)cc1[N+](=O)[O-])c1ccccn1 ZINC000505391918 515519436 /nfs/dbraw/zinc/51/94/36/515519436.db2.gz MKOHTHWZEILVDJ-CQSZACIVSA-N 1 1 369.425 2.598 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([O-])ccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000505419660 515529369 /nfs/dbraw/zinc/52/93/69/515529369.db2.gz FWEPXZKPVXIABA-MRXNPFEDSA-N 1 1 369.421 2.867 20 5 FFBDMO CC[C@H](CNC(=O)c1cc([O-])ccc1[N+](=O)[O-])N1CCc2ccccc2C1 ZINC000505419660 515529373 /nfs/dbraw/zinc/52/93/73/515529373.db2.gz FWEPXZKPVXIABA-MRXNPFEDSA-N 1 1 369.421 2.867 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000456984904 515565517 /nfs/dbraw/zinc/56/55/17/515565517.db2.gz IIKZCHVDYRWVKU-QGZVFWFLSA-N 1 1 369.421 2.845 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@@H]2C)cc1OC ZINC000500124134 515601485 /nfs/dbraw/zinc/60/14/85/515601485.db2.gz UTFVEKWHFGEIJZ-STQMWFEESA-N 1 1 365.430 2.557 20 5 FFBDMO COC(=O)[C@@H]([N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528576 515621373 /nfs/dbraw/zinc/62/13/73/515621373.db2.gz ZNCZPOIXCQANBM-DOTOQJQBSA-N 1 1 362.426 2.885 20 5 FFBDMO COC(=O)[C@@H]([N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528576 515621382 /nfs/dbraw/zinc/62/13/82/515621382.db2.gz ZNCZPOIXCQANBM-DOTOQJQBSA-N 1 1 362.426 2.885 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000457108680 515655236 /nfs/dbraw/zinc/65/52/36/515655236.db2.gz GDQUANXZHDCIDM-LBPRGKRZSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1ccc(CNC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000511057506 515761212 /nfs/dbraw/zinc/76/12/12/515761212.db2.gz ABZUYMXEQKJCRY-UHFFFAOYSA-N 1 1 359.401 2.833 20 5 FFBDMO Cc1ccc(CNC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000511057506 515761223 /nfs/dbraw/zinc/76/12/23/515761223.db2.gz ABZUYMXEQKJCRY-UHFFFAOYSA-N 1 1 359.401 2.833 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1C)[NH+](C)C ZINC000511527793 515934513 /nfs/dbraw/zinc/93/45/13/515934513.db2.gz BCTQQDVIJDRKDE-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501085910 515973364 /nfs/dbraw/zinc/97/33/64/515973364.db2.gz PBNREYXRSXTSGH-SNVBAGLBSA-N 1 1 371.235 2.915 20 5 FFBDMO COc1c(C(=O)N2CC[NH+](Cc3ccccc3C)CC2)cccc1[N+](=O)[O-] ZINC000474285293 515972568 /nfs/dbraw/zinc/97/25/68/515972568.db2.gz OBAQQPFTLFIFIL-UHFFFAOYSA-N 1 1 369.421 2.870 20 5 FFBDMO CC(=O)NCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000511669591 515992285 /nfs/dbraw/zinc/99/22/85/515992285.db2.gz XQMIBGLTNDVTPP-UHFFFAOYSA-N 1 1 357.357 2.544 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000465053435 516052972 /nfs/dbraw/zinc/05/29/72/516052972.db2.gz LRRDATUMDWYKNV-CQSZACIVSA-N 1 1 360.458 2.877 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000501504941 516130484 /nfs/dbraw/zinc/13/04/84/516130484.db2.gz OSDWFBGASOZICW-QWHCGFSZSA-N 1 1 350.419 2.988 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1OCCc2ccccc21 ZINC000507243644 516137751 /nfs/dbraw/zinc/13/77/51/516137751.db2.gz RPWMGTOBIXOGDK-YLJYHZDGSA-N 1 1 372.421 2.580 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000470165212 516156857 /nfs/dbraw/zinc/15/68/57/516156857.db2.gz GKJYXNMPDFUDKQ-ZDUSSCGKSA-N 1 1 369.368 2.943 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1Cc1ccccc1 ZINC000507285923 516158415 /nfs/dbraw/zinc/15/84/15/516158415.db2.gz VVQAYHBELADXFU-BBRMVZONSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000507285923 516158420 /nfs/dbraw/zinc/15/84/20/516158420.db2.gz VVQAYHBELADXFU-BBRMVZONSA-N 1 1 355.394 2.693 20 5 FFBDMO CCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000470176079 516163851 /nfs/dbraw/zinc/16/38/51/516163851.db2.gz UJTDVWRUPZGNQE-OOXMNIKJSA-N 1 1 352.456 2.897 20 5 FFBDMO CCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1 ZINC000470176079 516163858 /nfs/dbraw/zinc/16/38/58/516163858.db2.gz UJTDVWRUPZGNQE-OOXMNIKJSA-N 1 1 352.456 2.897 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCc1cccc([N+](=O)[O-])c1 ZINC000474720787 516169776 /nfs/dbraw/zinc/16/97/76/516169776.db2.gz FBXCHGQBDWVRNA-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000507328430 516173941 /nfs/dbraw/zinc/17/39/41/516173941.db2.gz HPWJBMGIKUKVHC-GFCCVEGCSA-N 1 1 373.450 2.523 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000507470139 516219127 /nfs/dbraw/zinc/21/91/27/516219127.db2.gz TXTKTYVFQAQGLF-ZFWWWQNUSA-N 1 1 357.414 2.616 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000470359790 516219487 /nfs/dbraw/zinc/21/94/87/516219487.db2.gz UCXQFVGZYUKLJB-QGZVFWFLSA-N 1 1 362.474 2.947 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2 ZINC000488493298 516239933 /nfs/dbraw/zinc/23/99/33/516239933.db2.gz KZIGGQQFICQZIE-CQSZACIVSA-N 1 1 363.414 2.708 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@H](COC(F)F)C3)n2)cc1 ZINC000512805885 516365926 /nfs/dbraw/zinc/36/59/26/516365926.db2.gz NLDPNBBOFHDQHF-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](COC(F)F)C3)n2)cc1 ZINC000512805885 516365933 /nfs/dbraw/zinc/36/59/33/516365933.db2.gz NLDPNBBOFHDQHF-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO COCC1(C)CC[NH+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CC1 ZINC000540199598 516470068 /nfs/dbraw/zinc/47/00/68/516470068.db2.gz ZSALANCHLBIFGJ-ZDUSSCGKSA-N 1 1 365.430 2.679 20 5 FFBDMO CC[N@@H+](CCC1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1)CC(C)C ZINC000540235766 516487558 /nfs/dbraw/zinc/48/75/58/516487558.db2.gz RLBHVCHCHCKHLR-UHFFFAOYSA-N 1 1 365.478 2.549 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000558024811 516556246 /nfs/dbraw/zinc/55/62/46/516556246.db2.gz HGBIIFBWBIBQFB-IIAWOOMASA-N 1 1 361.442 2.796 20 5 FFBDMO CCc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000531663304 516584700 /nfs/dbraw/zinc/58/47/00/516584700.db2.gz DPTQMVDGECVMIV-SJORKVTESA-N 1 1 361.442 2.530 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000536037553 516602843 /nfs/dbraw/zinc/60/28/43/516602843.db2.gz YJBQSDIAULAUFR-HNNXBMFYSA-N 1 1 371.393 2.529 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc([N+](=O)[O-])c1OC ZINC000536037553 516602851 /nfs/dbraw/zinc/60/28/51/516602851.db2.gz YJBQSDIAULAUFR-HNNXBMFYSA-N 1 1 371.393 2.529 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000558145443 516614914 /nfs/dbraw/zinc/61/49/14/516614914.db2.gz AJWKZVBSXMSQCM-ROUUACIJSA-N 1 1 371.437 2.934 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C ZINC000558145437 516615787 /nfs/dbraw/zinc/61/57/87/516615787.db2.gz AJWKZVBSXMSQCM-MSOLQXFVSA-N 1 1 371.437 2.934 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000544190703 516635172 /nfs/dbraw/zinc/63/51/72/516635172.db2.gz SCSLHRMJTLAERV-CYBMUJFWSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000544190703 516635178 /nfs/dbraw/zinc/63/51/78/516635178.db2.gz SCSLHRMJTLAERV-CYBMUJFWSA-N 1 1 373.409 2.811 20 5 FFBDMO Cc1nc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000513697788 516723710 /nfs/dbraw/zinc/72/37/10/516723710.db2.gz RPYXIDXKUAFZHN-KRWDZBQOSA-N 1 1 355.398 2.855 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]CCc2ncn(C)n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544380886 516732617 /nfs/dbraw/zinc/73/26/17/516732617.db2.gz GNCSSIRUVHWAIX-SFHVURJKSA-N 1 1 355.398 2.800 20 5 FFBDMO COc1nc(C)cc(C)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000561866811 516807152 /nfs/dbraw/zinc/80/71/52/516807152.db2.gz JZZNCOQSTKVQMB-CQSZACIVSA-N 1 1 357.414 2.697 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)[C@H]2C1 ZINC000555207580 516830229 /nfs/dbraw/zinc/83/02/29/516830229.db2.gz KBHHQIXKNJJAMG-ZWKOTPCHSA-N 1 1 368.437 2.956 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000541106684 516879035 /nfs/dbraw/zinc/87/90/35/516879035.db2.gz UPAHZQKNWVBKJU-CHWSQXEVSA-N 1 1 350.419 2.845 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-] ZINC000544720226 516892976 /nfs/dbraw/zinc/89/29/76/516892976.db2.gz LLRWRMNDVGHDKP-INIZCTEOSA-N 1 1 369.487 2.669 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514203299 516902547 /nfs/dbraw/zinc/90/25/47/516902547.db2.gz HTDKLSKJVHZYPQ-LBPRGKRZSA-N 1 1 357.357 2.800 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCCOC(C)C)c([N+](=O)[O-])c1 ZINC000562125383 516928545 /nfs/dbraw/zinc/92/85/45/516928545.db2.gz XOBUAKZUNUNUIT-CYBMUJFWSA-N 1 1 353.419 2.677 20 5 FFBDMO CCCC[N@@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000558780507 516941366 /nfs/dbraw/zinc/94/13/66/516941366.db2.gz XYSPHWCYAWUCTH-GFCCVEGCSA-N 1 1 361.489 2.589 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000558780507 516941376 /nfs/dbraw/zinc/94/13/76/516941376.db2.gz XYSPHWCYAWUCTH-GFCCVEGCSA-N 1 1 361.489 2.589 20 5 FFBDMO CC(=O)NC1CCC([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000541313991 516982851 /nfs/dbraw/zinc/98/28/51/516982851.db2.gz SSWIEZJRJZVKPO-UHFFFAOYSA-N 1 1 373.413 2.524 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000525397446 517029408 /nfs/dbraw/zinc/02/94/08/517029408.db2.gz PFNBQKNMEGYWTK-OLZOCXBDSA-N 1 1 372.425 2.793 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000545162246 517078682 /nfs/dbraw/zinc/07/86/82/517078682.db2.gz AZBFGVWXVBVIJJ-UHFFFAOYSA-N 1 1 355.341 2.578 20 5 FFBDMO C[C@@H]1C[C@@H]1N1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1=O ZINC000525708444 517129480 /nfs/dbraw/zinc/12/94/80/517129480.db2.gz PKHPQBYBAKCWBY-FFSVYQOJSA-N 1 1 372.450 2.817 20 5 FFBDMO Cc1cn2cc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])ccc2[nH+]1 ZINC000537397377 517171009 /nfs/dbraw/zinc/17/10/09/517171009.db2.gz YZVZWIOCKKORMH-UHFFFAOYSA-N 1 1 360.395 2.535 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000537618194 517263739 /nfs/dbraw/zinc/26/37/39/517263739.db2.gz PSLKXCJVJROUFU-HIFRSBDPSA-N 1 1 351.447 2.917 20 5 FFBDMO CCN1CC[NH+](CCC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000552741852 517373873 /nfs/dbraw/zinc/37/38/73/517373873.db2.gz LTBCIJVPRXVYBZ-UHFFFAOYSA-N 1 1 362.474 2.858 20 5 FFBDMO COC(=O)CCC1CC[NH+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000533344852 517416178 /nfs/dbraw/zinc/41/61/78/517416178.db2.gz VFEBABZVIHKEQF-UHFFFAOYSA-N 1 1 363.414 2.507 20 5 FFBDMO COCC1(C)CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000537997771 517430022 /nfs/dbraw/zinc/43/00/22/517430022.db2.gz KCZXUZRNASCYFM-CYBMUJFWSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000533375911 517432181 /nfs/dbraw/zinc/43/21/81/517432181.db2.gz LQXFJNDPMQBMST-JKIFEVAISA-N 1 1 360.458 2.531 20 5 FFBDMO O=C(NCC[N@H+]1CC=CCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000527019946 517455849 /nfs/dbraw/zinc/45/58/49/517455849.db2.gz NXCACPDACWNWGF-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000527019946 517455853 /nfs/dbraw/zinc/45/58/53/517455853.db2.gz NXCACPDACWNWGF-UHFFFAOYSA-N 1 1 358.423 2.710 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000556588319 517506344 /nfs/dbraw/zinc/50/63/44/517506344.db2.gz CFBIXCJOJXQFRW-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000556588319 517506354 /nfs/dbraw/zinc/50/63/54/517506354.db2.gz CFBIXCJOJXQFRW-MRXNPFEDSA-N 1 1 369.421 2.602 20 5 FFBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760472 517601395 /nfs/dbraw/zinc/60/13/95/517601395.db2.gz BPBMHDHOTFOOSL-CQSZACIVSA-N 1 1 354.414 2.651 20 5 FFBDMO O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000546266019 517620364 /nfs/dbraw/zinc/62/03/64/517620364.db2.gz WZNOYFKRSUHBHV-OAHLLOKOSA-N 1 1 370.409 2.891 20 5 FFBDMO COc1cccc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000553403736 517693820 /nfs/dbraw/zinc/69/38/20/517693820.db2.gz ZJYBROURZZFDHK-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)[C@@H](C)C1 ZINC000542744736 517713901 /nfs/dbraw/zinc/71/39/01/517713901.db2.gz IETPOWHUPMYGRC-DZGCQCFKSA-N 1 1 369.487 2.562 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556874432 517720298 /nfs/dbraw/zinc/72/02/98/517720298.db2.gz JUNQNMJRQSMPFS-MAUKXSAKSA-N 1 1 357.458 2.882 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000556882774 517727143 /nfs/dbraw/zinc/72/71/43/517727143.db2.gz CRSGCBJLHLNRHD-OAHLLOKOSA-N 1 1 374.441 2.969 20 5 FFBDMO CC(C)c1ccc(C[NH+]2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)cc1 ZINC000549854337 517747423 /nfs/dbraw/zinc/74/74/23/517747423.db2.gz JOZIBNWDUFZZOZ-UHFFFAOYSA-N 1 1 357.458 2.770 20 5 FFBDMO C[C@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCC[C@H](C)C1 ZINC000521533254 517765674 /nfs/dbraw/zinc/76/56/74/517765674.db2.gz SHXOTTZEGUEUEF-LSDHHAIUSA-N 1 1 358.442 2.786 20 5 FFBDMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553600852 517804620 /nfs/dbraw/zinc/80/46/20/517804620.db2.gz BOUNBMUVNLASBH-DGCLKSJQSA-N 1 1 359.348 2.913 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1(C)C ZINC000563399975 517881570 /nfs/dbraw/zinc/88/15/70/517881570.db2.gz DFHIKNIPXMYCBF-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1(C)C ZINC000563399975 517881580 /nfs/dbraw/zinc/88/15/80/517881580.db2.gz DFHIKNIPXMYCBF-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO CN1CC[N@H+](C)C[C@H]1c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000547205035 518022905 /nfs/dbraw/zinc/02/29/05/518022905.db2.gz IGYUFEQFJZIUPS-HNNXBMFYSA-N 1 1 359.430 2.861 20 5 FFBDMO CN1CC[N@@H+](C)C[C@H]1c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000547205035 518022915 /nfs/dbraw/zinc/02/29/15/518022915.db2.gz IGYUFEQFJZIUPS-HNNXBMFYSA-N 1 1 359.430 2.861 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000557525882 518053463 /nfs/dbraw/zinc/05/34/63/518053463.db2.gz AGZQOVNWFOAIQL-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)[C@@H](C)C1 ZINC000557525882 518053471 /nfs/dbraw/zinc/05/34/71/518053471.db2.gz AGZQOVNWFOAIQL-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3c([N+](=O)[O-])cccc3C(F)(F)F)C2)C1 ZINC000563733602 518097098 /nfs/dbraw/zinc/09/70/98/518097098.db2.gz ODVIAVSIKKVCGB-HNNXBMFYSA-N 1 1 357.332 2.781 20 5 FFBDMO CCc1cccnc1[C@@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000543594982 518149521 /nfs/dbraw/zinc/14/95/21/518149521.db2.gz KMUHZZKKTXULNR-CYBMUJFWSA-N 1 1 363.439 2.677 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1nc2c(s1)CCC2 ZINC000575432606 518220856 /nfs/dbraw/zinc/22/08/56/518220856.db2.gz KEJAAFBOGSYWFO-UHFFFAOYSA-N 1 1 360.439 2.653 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1nc2c(s1)CCC2 ZINC000575432606 518220864 /nfs/dbraw/zinc/22/08/64/518220864.db2.gz KEJAAFBOGSYWFO-UHFFFAOYSA-N 1 1 360.439 2.653 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000584248489 518245369 /nfs/dbraw/zinc/24/53/69/518245369.db2.gz QTSIJXKXPCGWFV-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@@H](Cc2ccccc2)C1 ZINC000584248489 518245376 /nfs/dbraw/zinc/24/53/76/518245376.db2.gz QTSIJXKXPCGWFV-KRWDZBQOSA-N 1 1 353.422 2.902 20 5 FFBDMO CC(C)N1CC[NH+]([C@@H]2CCN(c3nccc4ccc([N+](=O)[O-])cc43)C2)CC1 ZINC000572966981 518443256 /nfs/dbraw/zinc/44/32/56/518443256.db2.gz JPTGENGLEYHWFX-GOSISDBHSA-N 1 1 369.469 2.748 20 5 FFBDMO C[C@]1(NC(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000573124999 518520223 /nfs/dbraw/zinc/52/02/23/518520223.db2.gz RVRMEBXUTFEBRQ-FQEVSTJZSA-N 1 1 353.422 2.918 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]21 ZINC000585767621 518590675 /nfs/dbraw/zinc/59/06/75/518590675.db2.gz RBFJXEREKWLYBA-MJGOQNOKSA-N 1 1 357.410 2.760 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000573284328 518591893 /nfs/dbraw/zinc/59/18/93/518591893.db2.gz VAEKBBMKLSLNFD-OAHLLOKOSA-N 1 1 355.385 2.652 20 5 FFBDMO COc1cc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000564775841 518608964 /nfs/dbraw/zinc/60/89/64/518608964.db2.gz SJIFEPAPWBGMGC-UHFFFAOYSA-N 1 1 353.394 2.689 20 5 FFBDMO COc1cc(CN2CCC(CC[NH3+])CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000567617657 518616035 /nfs/dbraw/zinc/61/60/35/518616035.db2.gz QHDBFOJAQKXFFV-UHFFFAOYSA-N 1 1 373.400 2.808 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1)CC2 ZINC000576524550 518634364 /nfs/dbraw/zinc/63/43/64/518634364.db2.gz VULDVDWTSBQIOR-RDTXWAMCSA-N 1 1 372.450 2.936 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000586773223 518637329 /nfs/dbraw/zinc/63/73/29/518637329.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@@H](O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773223 518637336 /nfs/dbraw/zinc/63/73/36/518637336.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 1 1 357.454 2.562 20 5 FFBDMO CN(Cc1ccccc1)C[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000586773223 518637343 /nfs/dbraw/zinc/63/73/43/518637343.db2.gz JKPVVXOZEJHRPQ-IBGZPJMESA-N 1 1 357.454 2.562 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000579394920 518659154 /nfs/dbraw/zinc/65/91/54/518659154.db2.gz YFXMRVDEUGJASW-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000579394920 518659158 /nfs/dbraw/zinc/65/91/58/518659158.db2.gz YFXMRVDEUGJASW-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@H](C)C2)c1 ZINC000570847139 518809717 /nfs/dbraw/zinc/80/97/17/518809717.db2.gz XMROLJVSEYKOMH-CQSZACIVSA-N 1 1 373.457 2.952 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@H](C)C2)c1 ZINC000570847139 518809719 /nfs/dbraw/zinc/80/97/19/518809719.db2.gz XMROLJVSEYKOMH-CQSZACIVSA-N 1 1 373.457 2.952 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](Cc2cc(C)ccc2OC)CC1 ZINC000588806999 518836631 /nfs/dbraw/zinc/83/66/31/518836631.db2.gz UWGFHTKSQVFDNK-UHFFFAOYSA-N 1 1 373.457 2.759 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000582807916 518932136 /nfs/dbraw/zinc/93/21/36/518932136.db2.gz MGJINXAHSZODNP-BDJLRTHQSA-N 1 1 355.385 2.604 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000565670739 519073439 /nfs/dbraw/zinc/07/34/39/519073439.db2.gz RVZRNXIUNVMUQA-IBGZPJMESA-N 1 1 367.449 2.831 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000565670739 519073445 /nfs/dbraw/zinc/07/34/45/519073445.db2.gz RVZRNXIUNVMUQA-IBGZPJMESA-N 1 1 367.449 2.831 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000568544902 519093723 /nfs/dbraw/zinc/09/37/23/519093723.db2.gz WZFYWVPAXQFILR-AWEZNQCLSA-N 1 1 372.347 2.976 20 5 FFBDMO C[C@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000577493341 519109478 /nfs/dbraw/zinc/10/94/78/519109478.db2.gz DMZKBZOHPBUMBC-NHYWBVRUSA-N 1 1 363.801 2.898 20 5 FFBDMO C[C@H]1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000568582042 519109732 /nfs/dbraw/zinc/10/97/32/519109732.db2.gz VAWWGDBTBJMJIS-GFCCVEGCSA-N 1 1 357.414 2.554 20 5 FFBDMO C[C@H](C(=O)Nc1ccc2c(c1)OCO2)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565788099 519133817 /nfs/dbraw/zinc/13/38/17/519133817.db2.gz ZMMYZBQXCLMEMF-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO C[C@H](C(=O)Nc1ccc2c(c1)OCO2)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000565788099 519133819 /nfs/dbraw/zinc/13/38/19/519133819.db2.gz ZMMYZBQXCLMEMF-CYBMUJFWSA-N 1 1 371.393 2.825 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590158197 519164862 /nfs/dbraw/zinc/16/48/62/519164862.db2.gz FTMVXKVELBDBID-WDEREUQCSA-N 1 1 357.332 2.970 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000566042126 519258958 /nfs/dbraw/zinc/25/89/58/519258958.db2.gz QUBHSAYVXBEVNT-CYBMUJFWSA-N 1 1 352.435 2.523 20 5 FFBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583538388 519299132 /nfs/dbraw/zinc/29/91/32/519299132.db2.gz OCWPQTJDNZZYGI-ZDUSSCGKSA-N 1 1 361.446 2.647 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C[N@H+]1C1CC1 ZINC000583666819 519366966 /nfs/dbraw/zinc/36/69/66/519366966.db2.gz SQXBXSHQHPQYIB-UKRRQHHQSA-N 1 1 358.442 2.868 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)CC[C@H]1C ZINC000569147010 519400418 /nfs/dbraw/zinc/40/04/18/519400418.db2.gz SUKFUKWRWJXBED-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238687 519449866 /nfs/dbraw/zinc/44/98/66/519449866.db2.gz PIIWAZPZXFFRSC-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000569238687 519449870 /nfs/dbraw/zinc/44/98/70/519449870.db2.gz PIIWAZPZXFFRSC-HIFRSBDPSA-N 1 1 370.409 2.815 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C(=O)OC(C)(C)C)CC[C@@H]1C ZINC000602848463 519925059 /nfs/dbraw/zinc/92/50/59/519925059.db2.gz VNCCRDVNUCOIGI-GXTWGEPZSA-N 1 1 352.435 2.542 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](c2cccnc2)C1 ZINC000602856889 519929290 /nfs/dbraw/zinc/92/92/90/519929290.db2.gz STXWIYJJNHQBLB-IRXDYDNUSA-N 1 1 357.410 2.609 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCC3(C2)CC[NH+](C)CC3)cccc1[N+](=O)[O-] ZINC000602878504 519944839 /nfs/dbraw/zinc/94/48/39/519944839.db2.gz XOYFIRWYOCUOJH-OAHLLOKOSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC=C(c2cnn(C)c2)C1 ZINC000602888866 519950995 /nfs/dbraw/zinc/95/09/95/519950995.db2.gz TUPCMEJNTXHJPN-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(Cl)c1 ZINC000594483203 519992797 /nfs/dbraw/zinc/99/27/97/519992797.db2.gz CVLWAUGWVTYTPD-ZIAGYGMSSA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000602965451 519997179 /nfs/dbraw/zinc/99/71/79/519997179.db2.gz GEDLOAYQWDLOEG-KRWDZBQOSA-N 1 1 364.785 2.974 20 5 FFBDMO CC(C)N(C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000602965671 519997310 /nfs/dbraw/zinc/99/73/10/519997310.db2.gz LBVDEMJUISNPKQ-HXUWFJFHSA-N 1 1 371.437 2.834 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000602997802 520012791 /nfs/dbraw/zinc/01/27/91/520012791.db2.gz RCABYIWXZAOPDW-JLSDUUJJSA-N 1 1 361.442 2.857 20 5 FFBDMO C[C@@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594592745 520042873 /nfs/dbraw/zinc/04/28/73/520042873.db2.gz VJMZXDOOUXVGBV-GARJFASQSA-N 1 1 351.432 2.509 20 5 FFBDMO C[C@@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594592745 520042878 /nfs/dbraw/zinc/04/28/78/520042878.db2.gz VJMZXDOOUXVGBV-GARJFASQSA-N 1 1 351.432 2.509 20 5 FFBDMO CCn1ccc(C[N@@H+](C)Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)c1 ZINC000616737772 520114400 /nfs/dbraw/zinc/11/44/00/520114400.db2.gz VXQFSXFUJBVXGQ-UHFFFAOYSA-N 1 1 361.398 2.600 20 5 FFBDMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597584916 520119870 /nfs/dbraw/zinc/11/98/70/520119870.db2.gz YKQRPVAZFUSQAI-HZPDHXFCSA-N 1 1 367.396 2.656 20 5 FFBDMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)c1ccc([N+](=O)[O-])cc1F ZINC000597584905 520119981 /nfs/dbraw/zinc/11/99/81/520119981.db2.gz YKQRPVAZFUSQAI-CVEARBPZSA-N 1 1 367.396 2.656 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000600297331 520187764 /nfs/dbraw/zinc/18/77/64/520187764.db2.gz ASPVAVXADFTWDC-OAHLLOKOSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000600297331 520187770 /nfs/dbraw/zinc/18/77/70/520187770.db2.gz ASPVAVXADFTWDC-OAHLLOKOSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000600298100 520188253 /nfs/dbraw/zinc/18/82/53/520188253.db2.gz FZVUDXFMCPCFJZ-INIZCTEOSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000600298100 520188257 /nfs/dbraw/zinc/18/82/57/520188257.db2.gz FZVUDXFMCPCFJZ-INIZCTEOSA-N 1 1 373.384 2.747 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CCCC[N@@H+](C)C1 ZINC000600311283 520197811 /nfs/dbraw/zinc/19/78/11/520197811.db2.gz ONCJQALHURYYPL-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO COc1ccccc1C1([NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000592143108 520221230 /nfs/dbraw/zinc/22/12/30/520221230.db2.gz PFYMVLBKBJQLNU-UHFFFAOYSA-N 1 1 367.405 2.771 20 5 FFBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000592154452 520231244 /nfs/dbraw/zinc/23/12/44/520231244.db2.gz RQJULCSYXGEFBE-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000592154452 520231254 /nfs/dbraw/zinc/23/12/54/520231254.db2.gz RQJULCSYXGEFBE-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000592154452 520231262 /nfs/dbraw/zinc/23/12/62/520231262.db2.gz RQJULCSYXGEFBE-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600470724 520280009 /nfs/dbraw/zinc/28/00/09/520280009.db2.gz IEPLCQXHPGDDRJ-KRWDZBQOSA-N 1 1 356.426 2.683 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000597859762 520286713 /nfs/dbraw/zinc/28/67/13/520286713.db2.gz HGCDQRZCIGYINO-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CCN(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598042841 520391012 /nfs/dbraw/zinc/39/10/12/520391012.db2.gz YWLLCJAEDMOUEE-ZDUSSCGKSA-N 1 1 370.247 2.914 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609984187 520496273 /nfs/dbraw/zinc/49/62/73/520496273.db2.gz QSZCKIZXORNEOA-DOMZBBRYSA-N 1 1 369.849 2.814 20 5 FFBDMO Cc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996194 520499857 /nfs/dbraw/zinc/49/98/57/520499857.db2.gz XPVFFKARRNVCCO-BBRMVZONSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996194 520499862 /nfs/dbraw/zinc/49/98/62/520499862.db2.gz XPVFFKARRNVCCO-BBRMVZONSA-N 1 1 371.441 2.751 20 5 FFBDMO Cc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609996194 520499869 /nfs/dbraw/zinc/49/98/69/520499869.db2.gz XPVFFKARRNVCCO-BBRMVZONSA-N 1 1 371.441 2.751 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000598343173 520566355 /nfs/dbraw/zinc/56/63/55/520566355.db2.gz TXAWPDLCWFZPTC-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1 ZINC000604473157 520571956 /nfs/dbraw/zinc/57/19/56/520571956.db2.gz ONDMLVHQYFYVCL-GJZGRUSLSA-N 1 1 369.425 2.598 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC[NH+]2Cc3ccccc3C2)c1 ZINC000604485385 520575275 /nfs/dbraw/zinc/57/52/75/520575275.db2.gz UZQFLXSIENEOME-UHFFFAOYSA-N 1 1 369.421 2.804 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484456 520575901 /nfs/dbraw/zinc/57/59/01/520575901.db2.gz OXEBWQAPJBAMPL-MJGOQNOKSA-N 1 1 358.394 2.877 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484455 520575969 /nfs/dbraw/zinc/57/59/69/520575969.db2.gz OXEBWQAPJBAMPL-IEBWSBKVSA-N 1 1 358.394 2.877 20 5 FFBDMO CC(=O)c1ccc(OC[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000601070363 520624088 /nfs/dbraw/zinc/62/40/88/520624088.db2.gz QLSXLPIFZYQGIV-FQEVSTJZSA-N 1 1 370.405 2.813 20 5 FFBDMO Cc1cc(C)c(Cn2cc([N+](=O)[O-])cc(Br)c2=O)c(C)[nH+]1 ZINC000601078021 520628087 /nfs/dbraw/zinc/62/80/87/520628087.db2.gz GEUMOKHHEMBISH-UHFFFAOYSA-N 1 1 352.188 2.888 20 5 FFBDMO C[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CCO ZINC000595694712 520655004 /nfs/dbraw/zinc/65/50/04/520655004.db2.gz FHZLSRMHFJOYHQ-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1CCO ZINC000595694712 520655009 /nfs/dbraw/zinc/65/50/09/520655009.db2.gz FHZLSRMHFJOYHQ-RISCZKNCSA-N 1 1 355.822 2.670 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507441 520665422 /nfs/dbraw/zinc/66/54/22/520665422.db2.gz BAJWWSAHCJVFDB-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO CCOc1ccc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000598507441 520665425 /nfs/dbraw/zinc/66/54/25/520665425.db2.gz BAJWWSAHCJVFDB-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)CC23CCCCC3)c1 ZINC000593016136 520685969 /nfs/dbraw/zinc/68/59/69/520685969.db2.gz IWQHWZCBFHAQHB-UHFFFAOYSA-N 1 1 361.442 2.832 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(Nc3ccccn3)CC2)c1 ZINC000593019234 520688315 /nfs/dbraw/zinc/68/83/15/520688315.db2.gz DSMVGYKFHUEOMW-UHFFFAOYSA-N 1 1 370.409 2.853 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598561398 520706701 /nfs/dbraw/zinc/70/67/01/520706701.db2.gz QLPNDVMVEIXGPN-MRXNPFEDSA-N 1 1 370.453 2.788 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)[C@@H](CC)CO1 ZINC000593058104 520715286 /nfs/dbraw/zinc/71/52/86/520715286.db2.gz JIBYWNBKBGRJBM-DZGCQCFKSA-N 1 1 365.430 2.821 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000595801027 520734793 /nfs/dbraw/zinc/73/47/93/520734793.db2.gz VPZARTFIKBNQEY-DLBZAZTESA-N 1 1 360.458 2.968 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](Cc2ccccc2)C1 ZINC000593089892 520736988 /nfs/dbraw/zinc/73/69/88/520736988.db2.gz VEIBIXJPHRVFRV-QGZVFWFLSA-N 1 1 365.437 2.830 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598613953 520743571 /nfs/dbraw/zinc/74/35/71/520743571.db2.gz ZYUOWPVQFKBJDM-DZGCQCFKSA-N 1 1 370.409 2.851 20 5 FFBDMO COCC[N@H+]1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC000593102093 520748401 /nfs/dbraw/zinc/74/84/01/520748401.db2.gz WVGYFUBSGDVZEZ-UHFFFAOYSA-N 1 1 374.441 2.792 20 5 FFBDMO CC[C@@H](C(=O)OC(C)(C)C)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593118598 520758560 /nfs/dbraw/zinc/75/85/60/520758560.db2.gz URBRYAPASOLOAZ-AWEZNQCLSA-N 1 1 365.430 2.976 20 5 FFBDMO CC[C@@H](C(=O)OC(C)(C)C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000593118598 520758563 /nfs/dbraw/zinc/75/85/63/520758563.db2.gz URBRYAPASOLOAZ-AWEZNQCLSA-N 1 1 365.430 2.976 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593128357 520766743 /nfs/dbraw/zinc/76/67/43/520766743.db2.gz GWHKKUNERRLRSK-KDOFPFPSSA-N 1 1 371.412 2.913 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595901510 520808785 /nfs/dbraw/zinc/80/87/85/520808785.db2.gz XRLDAXUXZCMLIQ-INIZCTEOSA-N 1 1 360.458 2.553 20 5 FFBDMO O=C(CC[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccccc1[N+](=O)[O-] ZINC000595911616 520815533 /nfs/dbraw/zinc/81/55/33/520815533.db2.gz UXISFHVEDSEOJC-KDURUIRLSA-N 1 1 359.426 2.816 20 5 FFBDMO CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000610782879 520841846 /nfs/dbraw/zinc/84/18/46/520841846.db2.gz LENAXISBHUOYJS-OAHLLOKOSA-N 1 1 360.414 2.652 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593324606 520910871 /nfs/dbraw/zinc/91/08/71/520910871.db2.gz YJDBGKWJZVPCQE-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000593324606 520910874 /nfs/dbraw/zinc/91/08/74/520910874.db2.gz YJDBGKWJZVPCQE-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CCCC1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000610968322 520922494 /nfs/dbraw/zinc/92/24/94/520922494.db2.gz VQAFYFMCHKUJTI-LJQANCHMSA-N 1 1 372.469 2.650 20 5 FFBDMO CCC1([NH+]2CCCC2)CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1 ZINC000601744963 520930580 /nfs/dbraw/zinc/93/05/80/520930580.db2.gz OBZSOUWPJHGRHO-UHFFFAOYSA-N 1 1 363.462 2.922 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596176213 520953482 /nfs/dbraw/zinc/95/34/82/520953482.db2.gz BBYSXHJNSPSKBM-HUUCEWRRSA-N 1 1 368.437 2.793 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCOCC3)C2)cc1C(F)(F)F ZINC000596247431 520992798 /nfs/dbraw/zinc/99/27/98/520992798.db2.gz ONPWRQDISOKOIY-ZDUSSCGKSA-N 1 1 359.348 2.915 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C3CC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000596256095 520996734 /nfs/dbraw/zinc/99/67/34/520996734.db2.gz YUQLFHZKJFXRQJ-NSHDSACASA-N 1 1 367.833 2.955 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599074195 521015740 /nfs/dbraw/zinc/01/57/40/521015740.db2.gz UDNIHFPFJCGIAD-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1c(Br)cccc1[N+](=O)[O-] ZINC000599083377 521021429 /nfs/dbraw/zinc/02/14/29/521021429.db2.gz KPQNIPAFZOFGPK-GHMZBOCLSA-N 1 1 368.231 2.714 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596336670 521033777 /nfs/dbraw/zinc/03/37/77/521033777.db2.gz RLARMFKACDGFEP-CQSZACIVSA-N 1 1 371.441 2.844 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+]1Cc1ccc(OC)cc1 ZINC000599139367 521050913 /nfs/dbraw/zinc/05/09/13/521050913.db2.gz LCJCIFXLZFTGIT-HNNXBMFYSA-N 1 1 359.430 2.815 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1Cc1ccc(OC)cc1 ZINC000599139367 521050923 /nfs/dbraw/zinc/05/09/23/521050923.db2.gz LCJCIFXLZFTGIT-HNNXBMFYSA-N 1 1 359.430 2.815 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000596422543 521062550 /nfs/dbraw/zinc/06/25/50/521062550.db2.gz DPYQWBODCMWVFG-IBGZPJMESA-N 1 1 371.437 2.920 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-] ZINC000596477544 521090857 /nfs/dbraw/zinc/09/08/57/521090857.db2.gz AUIDCIPJSCHFEH-ZDUSSCGKSA-N 1 1 362.430 2.904 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350523 521115661 /nfs/dbraw/zinc/11/56/61/521115661.db2.gz PTCXACIVOZZPHX-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000611350523 521115669 /nfs/dbraw/zinc/11/56/69/521115669.db2.gz PTCXACIVOZZPHX-JKSUJKDBSA-N 1 1 361.442 2.980 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000596558603 521129999 /nfs/dbraw/zinc/12/99/99/521129999.db2.gz RUEOZYSTKXPPRS-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO CS(=O)(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596570827 521138112 /nfs/dbraw/zinc/13/81/12/521138112.db2.gz OIZLVMCKFMWJBD-CQSZACIVSA-N 1 1 367.471 2.532 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772759 521206478 /nfs/dbraw/zinc/20/64/78/521206478.db2.gz ZNFGYSFPJDNOOQ-NWANDNLSSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772759 521206484 /nfs/dbraw/zinc/20/64/84/521206484.db2.gz ZNFGYSFPJDNOOQ-NWANDNLSSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772759 521206503 /nfs/dbraw/zinc/20/65/03/521206503.db2.gz ZNFGYSFPJDNOOQ-NWANDNLSSA-N 1 1 371.441 2.750 20 5 FFBDMO Cc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](Cc3ccccc3)[C@H](C)[C@H]2C)c1[N+](=O)[O-] ZINC000593772759 521206510 /nfs/dbraw/zinc/20/65/10/521206510.db2.gz ZNFGYSFPJDNOOQ-NWANDNLSSA-N 1 1 371.441 2.750 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CO)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000611560713 521220027 /nfs/dbraw/zinc/22/00/27/521220027.db2.gz AIQWYZTVTYMOGW-KRWDZBQOSA-N 1 1 358.442 2.950 20 5 FFBDMO O=C(C[N@@H+]1CCCC2(CCCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000615000629 521224405 /nfs/dbraw/zinc/22/44/05/521224405.db2.gz MSPZBESDFHVBEZ-UHFFFAOYSA-N 1 1 361.398 2.918 20 5 FFBDMO O=C(C[N@H+]1CCCC2(CCCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000615000629 521224413 /nfs/dbraw/zinc/22/44/13/521224413.db2.gz MSPZBESDFHVBEZ-UHFFFAOYSA-N 1 1 361.398 2.918 20 5 FFBDMO NC(=O)c1ccc(C[NH+]2CCC(Oc3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC000599504909 521264780 /nfs/dbraw/zinc/26/47/80/521264780.db2.gz HTDWVTXPVMRIGF-UHFFFAOYSA-N 1 1 373.384 2.876 20 5 FFBDMO COc1cc(C[N@@H+](C)CC2(C)COC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000599571329 521303663 /nfs/dbraw/zinc/30/36/63/521303663.db2.gz CCQLXLCGEUJIDP-UHFFFAOYSA-N 1 1 360.357 2.716 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000596833064 521318835 /nfs/dbraw/zinc/31/88/35/521318835.db2.gz VJPPDEJIJVBHEC-LBPRGKRZSA-N 1 1 350.419 2.845 20 5 FFBDMO COC(=O)[C@@](C)(NCC[N@@H+](C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000599650237 521360597 /nfs/dbraw/zinc/36/05/97/521360597.db2.gz GRAUBBYBPLIBJN-FQEVSTJZSA-N 1 1 371.437 2.705 20 5 FFBDMO C[C@H]1C[C@H](N(C)Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000602472321 521363362 /nfs/dbraw/zinc/36/33/62/521363362.db2.gz DZEJDPCQHDCLRZ-MAUKXSAKSA-N 1 1 357.458 2.813 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](CO)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000599675643 521390986 /nfs/dbraw/zinc/39/09/86/521390986.db2.gz UMSDFGUSAUSTRK-GHMZBOCLSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CO)C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000599675643 521390991 /nfs/dbraw/zinc/39/09/91/521390991.db2.gz UMSDFGUSAUSTRK-GHMZBOCLSA-N 1 1 360.357 2.798 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c1 ZINC000619254080 521473333 /nfs/dbraw/zinc/47/33/33/521473333.db2.gz HTDHOQWOFLLHGD-ZFWWWQNUSA-N 1 1 353.419 2.575 20 5 FFBDMO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CS1(=O)=O ZINC000602711046 521489709 /nfs/dbraw/zinc/48/97/09/521489709.db2.gz WPSHGVKBAIOTDH-BXKDBHETSA-N 1 1 366.361 2.669 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000599831194 521499309 /nfs/dbraw/zinc/49/93/09/521499309.db2.gz PQNDBQBVFYTTCI-QWHCGFSZSA-N 1 1 355.398 2.891 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599831961 521500016 /nfs/dbraw/zinc/50/00/16/521500016.db2.gz BTWMVJJMOUEUEV-KRWDZBQOSA-N 1 1 357.414 2.947 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599840854 521506574 /nfs/dbraw/zinc/50/65/74/521506574.db2.gz UOQZOPVMAOXPQU-CYBMUJFWSA-N 1 1 357.414 2.996 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)Nc3cc(Cl)cc([N+](=O)[O-])c3N)CC[C@H]21 ZINC000597102539 521507642 /nfs/dbraw/zinc/50/76/42/521507642.db2.gz XUCAYUCKMYLIEO-GXFFZTMASA-N 1 1 367.837 2.778 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594284311 521536449 /nfs/dbraw/zinc/53/64/49/521536449.db2.gz VQXCHRPTSIPMBW-AEFFLSMTSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000602801547 521539805 /nfs/dbraw/zinc/53/98/05/521539805.db2.gz FNVRNVHXKMTMOL-GFCCVEGCSA-N 1 1 372.351 2.652 20 5 FFBDMO CCn1nc2c(cc1=O)C[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC2 ZINC000615835203 521552478 /nfs/dbraw/zinc/55/24/78/521552478.db2.gz ZLUQZPUMJBGGSG-NTEUORMPSA-N 1 1 354.410 2.633 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCc1ccccn1)Cc1cccnc1 ZINC000602829019 521557374 /nfs/dbraw/zinc/55/73/74/521557374.db2.gz UQSZSEGNRIQNAF-UHFFFAOYSA-N 1 1 366.425 2.635 20 5 FFBDMO COc1c(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000619442456 521570246 /nfs/dbraw/zinc/57/02/46/521570246.db2.gz VNIXBDCAZMXSLA-ZIAGYGMSSA-N 1 1 361.442 2.986 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000597250293 521596285 /nfs/dbraw/zinc/59/62/85/521596285.db2.gz VTNFEJJGUBJRGS-UHFFFAOYSA-N 1 1 367.409 2.911 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@H]3CCOC3)CC2)nc1-c1ccc(F)cc1 ZINC000619527380 521753200 /nfs/dbraw/zinc/75/32/00/521753200.db2.gz SLDVNSSGPRFAAT-INIZCTEOSA-N 1 1 372.400 2.707 20 5 FFBDMO C[C@H](C[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)C(C)(C)C ZINC000619844055 521902432 /nfs/dbraw/zinc/90/24/32/521902432.db2.gz BMRRHYKGTSHAFC-CQSZACIVSA-N 1 1 369.487 2.583 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727966 720334427 /nfs/dbraw/zinc/33/44/27/720334427.db2.gz VBYBQTGYGFJGHJ-CABCVRRESA-N 1 1 359.817 2.891 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2C[C@H]3C[NH+](Cc4nccs4)C[C@@H]3C2)n1 ZINC001164786262 721413983 /nfs/dbraw/zinc/41/39/83/721413983.db2.gz ORGQKABLDAKTPJ-ZIAGYGMSSA-N 1 1 359.455 2.631 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N2CCC[C@@]3(CC[N@H+]3Cc3cccc(F)c3)C2)c1 ZINC001164994000 722191626 /nfs/dbraw/zinc/19/16/26/722191626.db2.gz KOLZSTKRISSYDJ-LJQANCHMSA-N 1 1 372.400 2.612 20 5 FFBDMO CNC(=O)C[NH+]1CCC(Nc2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000121404970 728626357 /nfs/dbraw/zinc/62/63/57/728626357.db2.gz HLVUEEJXVHRRCS-UHFFFAOYSA-N 1 1 361.229 2.524 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+](C)[C@H](C)C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000129540616 728712046 /nfs/dbraw/zinc/71/20/46/728712046.db2.gz KYRQHNCMWYMHIW-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)C(=O)OC(C)C)cccc1[N+](=O)[O-] ZINC000129540616 728712047 /nfs/dbraw/zinc/71/20/47/728712047.db2.gz KYRQHNCMWYMHIW-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO C[C@H](CNC(=O)OC(C)(C)C)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000171955684 729016872 /nfs/dbraw/zinc/01/68/72/729016872.db2.gz DRUZQUCBLGXFSF-CYBMUJFWSA-N 1 1 353.419 2.819 20 5 FFBDMO CC(C)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](O)c1ccc(F)cc1 ZINC000174867075 729081556 /nfs/dbraw/zinc/08/15/56/729081556.db2.gz UYWMNGYDZDPGGT-QGZVFWFLSA-N 1 1 350.394 2.622 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@@H](C[N@@H+](C)CC)C1 ZINC000177546252 729138930 /nfs/dbraw/zinc/13/89/30/729138930.db2.gz NDHVBEPCPBPXSE-LBPRGKRZSA-N 1 1 353.394 2.689 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000194570919 729513921 /nfs/dbraw/zinc/51/39/21/729513921.db2.gz TWZNDYJOLZGYOG-CPUCHLNUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000194570919 729513925 /nfs/dbraw/zinc/51/39/25/729513925.db2.gz TWZNDYJOLZGYOG-CPUCHLNUSA-N 1 1 351.422 2.808 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000861349834 730602830 /nfs/dbraw/zinc/60/28/30/730602830.db2.gz WDWIFXKPTKHWGM-KBXCAEBGSA-N 1 1 350.415 2.984 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@]1(C)C[C@@H](OC)C[N@H+]1C ZINC000861350678 730602874 /nfs/dbraw/zinc/60/28/74/730602874.db2.gz QNRDTFWQIFAFLU-DYVFJYSZSA-N 1 1 368.455 2.973 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1 ZINC000861352738 730603507 /nfs/dbraw/zinc/60/35/07/730603507.db2.gz KBLBWDUJCDIMMU-ACJLOTCBSA-N 1 1 350.415 2.525 20 5 FFBDMO CCS[C@@H]1CC[C@H](N(C)C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1 ZINC000867962441 731246188 /nfs/dbraw/zinc/24/61/88/731246188.db2.gz BJGZQVZKZWSLTJ-LXZKKBNFSA-N 1 1 351.472 2.901 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000869286066 731382925 /nfs/dbraw/zinc/38/29/25/731382925.db2.gz ZWQKOPXMBSDSFV-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO C[C@@H]([NH2+]CCN1C[C@H]2CCCCN2C1=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872088819 731728515 /nfs/dbraw/zinc/72/85/15/731728515.db2.gz RIRRSKVJUNPNIE-CHWSQXEVSA-N 1 1 350.394 2.675 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000874828670 732104623 /nfs/dbraw/zinc/10/46/23/732104623.db2.gz YDWCAOHAGXAPES-ZIAGYGMSSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000874834510 732105393 /nfs/dbraw/zinc/10/53/93/732105393.db2.gz SFXIXUGLQUEWHR-ZIAGYGMSSA-N 1 1 357.332 2.922 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(Cc3cc(Br)c([N+](=O)[O-])s3)CC[C@H]21 ZINC000877741008 732421846 /nfs/dbraw/zinc/42/18/46/732421846.db2.gz MAAWBRCYEAPWDU-JOYOIKCWSA-N 1 1 360.277 2.945 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000878174954 732493859 /nfs/dbraw/zinc/49/38/59/732493859.db2.gz VPFNSNXRVBUXTM-KBPBESRZSA-N 1 1 350.444 2.749 20 5 FFBDMO CC[N@@H+]1[C@H](C)CN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000878836145 732602610 /nfs/dbraw/zinc/60/26/10/732602610.db2.gz IXVNNINZEVUYSX-TXEJJXNPSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000878943487 732619338 /nfs/dbraw/zinc/61/93/38/732619338.db2.gz GTMAWIDEYVWBED-GJZGRUSLSA-N 1 1 361.364 2.587 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000878944465 732619446 /nfs/dbraw/zinc/61/94/46/732619446.db2.gz XBLZAICEDYNOKD-HUUCEWRRSA-N 1 1 361.364 2.587 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3Br)CC[C@H]21 ZINC000881439507 733055281 /nfs/dbraw/zinc/05/52/81/733055281.db2.gz NZSXYYKHPOCFGC-CMPLNLGQSA-N 1 1 368.231 2.524 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C[C@]2(C)C1 ZINC000887921210 733993271 /nfs/dbraw/zinc/99/32/71/733993271.db2.gz XGOUJIMVYZSMSK-PXAZEXFGSA-N 1 1 351.834 2.591 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@@H+]1CC[C@@H](C2OCCO2)C1 ZINC000718978859 734377125 /nfs/dbraw/zinc/37/71/25/734377125.db2.gz GBLOGJFBSUXQQW-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1C[N@H+]1CC[C@@H](C2OCCO2)C1 ZINC000718978859 734377127 /nfs/dbraw/zinc/37/71/27/734377127.db2.gz GBLOGJFBSUXQQW-LLVKDONJSA-N 1 1 357.204 2.552 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082299 738817469 /nfs/dbraw/zinc/81/74/69/738817469.db2.gz QOVRSANIHALXBJ-DGCLKSJQSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082299 738817473 /nfs/dbraw/zinc/81/74/73/738817473.db2.gz QOVRSANIHALXBJ-DGCLKSJQSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098215 738823401 /nfs/dbraw/zinc/82/34/01/738823401.db2.gz HFYZFNMFWFTMRM-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000928098215 738823406 /nfs/dbraw/zinc/82/34/06/738823406.db2.gz HFYZFNMFWFTMRM-TZMCWYRMSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100786 738823971 /nfs/dbraw/zinc/82/39/71/738823971.db2.gz ZNOCHFUPYWPBMH-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1Cl ZINC000928100786 738823978 /nfs/dbraw/zinc/82/39/78/738823978.db2.gz ZNOCHFUPYWPBMH-ZIAGYGMSSA-N 1 1 355.847 2.558 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)ccc1C(F)(F)F ZINC000897221084 735208026 /nfs/dbraw/zinc/20/80/26/735208026.db2.gz GZOLSJIETOVTFN-ZIAGYGMSSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H]2COc2ccc(Cl)cc2)n1 ZINC000747958920 735605250 /nfs/dbraw/zinc/60/52/50/735605250.db2.gz GESRBHBGKZEXEL-CQSZACIVSA-N 1 1 350.806 2.988 20 5 FFBDMO C[N@H+]1CCC[C@@H](NC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000755031274 736228321 /nfs/dbraw/zinc/22/83/21/736228321.db2.gz UPWKIHZLAMNZBO-SNVBAGLBSA-N 1 1 357.208 2.573 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C[C@H]1C ZINC000755930283 736290480 /nfs/dbraw/zinc/29/04/80/736290480.db2.gz IJXCENPKVIHONQ-MWLCHTKSSA-N 1 1 351.384 2.570 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)C[C@H]1C ZINC000755930283 736290482 /nfs/dbraw/zinc/29/04/82/736290482.db2.gz IJXCENPKVIHONQ-MWLCHTKSSA-N 1 1 351.384 2.570 20 5 FFBDMO C[C@@H](NC(=O)CCc1ccc([N+](=O)[O-])cc1Cl)C1=CC[N@@H+](C)CC1 ZINC000907281268 736606258 /nfs/dbraw/zinc/60/62/58/736606258.db2.gz HNMUHILGMFTTNO-GFCCVEGCSA-N 1 1 351.834 2.947 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854695 736674983 /nfs/dbraw/zinc/67/49/83/736674983.db2.gz PKDXTIZKEFBNNP-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760854695 736674986 /nfs/dbraw/zinc/67/49/86/736674986.db2.gz PKDXTIZKEFBNNP-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875070 736676429 /nfs/dbraw/zinc/67/64/29/736676429.db2.gz XVYGXDPKJKRDIA-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000760875070 736676431 /nfs/dbraw/zinc/67/64/31/736676431.db2.gz XVYGXDPKJKRDIA-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910282084 737052571 /nfs/dbraw/zinc/05/25/71/737052571.db2.gz RSAJGDAMTYSWFD-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NC(C)(C)CC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000912950477 737362550 /nfs/dbraw/zinc/36/25/50/737362550.db2.gz MQTVIARFKZJJFT-UHFFFAOYSA-N 1 1 369.849 2.787 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774639141 738008498 /nfs/dbraw/zinc/00/84/98/738008498.db2.gz UATZRHUYRBJQGC-OAHLLOKOSA-N 1 1 351.838 2.827 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880868 738135367 /nfs/dbraw/zinc/13/53/67/738135367.db2.gz RNRDKVBNMJADKA-KGLIPLIRSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880868 738135369 /nfs/dbraw/zinc/13/53/69/738135369.db2.gz RNRDKVBNMJADKA-KGLIPLIRSA-N 1 1 356.806 2.791 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1S(=O)(=O)N(C)CC[C@H]1CCCC[N@H+]1C ZINC000778010108 738341835 /nfs/dbraw/zinc/34/18/35/738341835.db2.gz LAYTYZFVIDKBQJ-CYBMUJFWSA-N 1 1 373.450 2.537 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000787578885 739148227 /nfs/dbraw/zinc/14/82/27/739148227.db2.gz MZEVDADGFSDSKF-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO O=C(Nc1cccc([N+](=O)[O-])c1Cl)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000931296834 739239901 /nfs/dbraw/zinc/23/99/01/739239901.db2.gz ALAMZDJIFJOQFB-ZWNOBZJWSA-N 1 1 370.862 2.950 20 5 FFBDMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000931390008 739258234 /nfs/dbraw/zinc/25/82/34/739258234.db2.gz CFOSWXAXGQNFIJ-TXEJJXNPSA-N 1 1 363.805 2.577 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1 ZINC000931610743 739297283 /nfs/dbraw/zinc/29/72/83/739297283.db2.gz QLRXDUGWLDVMPV-CYBMUJFWSA-N 1 1 350.394 2.930 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](C3OCCO3)C2)ccc1Br ZINC000932001894 739370133 /nfs/dbraw/zinc/37/01/33/739370133.db2.gz RDGKBCUMRCZFKV-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](C3OCCO3)C2)ccc1Br ZINC000932001894 739370137 /nfs/dbraw/zinc/37/01/37/739370137.db2.gz RDGKBCUMRCZFKV-NSHDSACASA-N 1 1 357.204 2.552 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)CC2 ZINC000935219945 739915067 /nfs/dbraw/zinc/91/50/67/739915067.db2.gz UGGLAAJRZYQIAL-UHFFFAOYSA-N 1 1 370.812 2.670 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000935685973 739994344 /nfs/dbraw/zinc/99/43/44/739994344.db2.gz JBODGVCAQPCLOC-UONOGXRCSA-N 1 1 353.419 2.575 20 5 FFBDMO CN(C)C(=O)OC[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000796550685 740153012 /nfs/dbraw/zinc/15/30/12/740153012.db2.gz FHFZCTUHEWWDBF-HNNXBMFYSA-N 1 1 351.403 2.526 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[NH+](CCc2cccs2)CC1 ZINC000804371726 740865401 /nfs/dbraw/zinc/86/54/01/740865401.db2.gz JBFVNVBHNBFJRU-UHFFFAOYSA-N 1 1 362.411 2.929 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000809965213 741367549 /nfs/dbraw/zinc/36/75/49/741367549.db2.gz BBHDBFQGKYSDHA-CYBMUJFWSA-N 1 1 360.241 2.808 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000810117675 741389225 /nfs/dbraw/zinc/38/92/25/741389225.db2.gz TWQNTHRGHZWFGL-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1COC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811449520 741523968 /nfs/dbraw/zinc/52/39/68/741523968.db2.gz REHKXVCABCRGAF-QGZVFWFLSA-N 1 1 354.378 2.859 20 5 FFBDMO CC(C)([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(=O)N1CCCC1 ZINC000822996904 742816416 /nfs/dbraw/zinc/81/64/16/742816416.db2.gz QZIHDXLLOYFGJR-UHFFFAOYSA-N 1 1 370.247 2.848 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1 ZINC000824332019 743057416 /nfs/dbraw/zinc/05/74/16/743057416.db2.gz UCACEOMPMCTLHA-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC[C@H]21 ZINC000827296192 743550005 /nfs/dbraw/zinc/55/00/05/743550005.db2.gz CUGGXENDNKZWTD-IINYFYTJSA-N 1 1 357.332 2.780 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc1Cl ZINC000834598243 745864934 /nfs/dbraw/zinc/86/49/34/745864934.db2.gz JVVHCJBCQZOZID-UONOGXRCSA-N 1 1 355.797 2.815 20 5 FFBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3nnc[nH]3)CC2)c1Br ZINC000839501400 746841597 /nfs/dbraw/zinc/84/15/97/746841597.db2.gz DEWKJDURYBIBQF-UHFFFAOYSA-N 1 1 366.219 2.855 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839530219 746848012 /nfs/dbraw/zinc/84/80/12/746848012.db2.gz OBODSHXUCJAUDL-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@H+](C)Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839530219 746848015 /nfs/dbraw/zinc/84/80/15/746848015.db2.gz OBODSHXUCJAUDL-GFCCVEGCSA-N 1 1 370.247 2.658 20 5 FFBDMO CCN(C)C(=O)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000839609555 746870663 /nfs/dbraw/zinc/87/06/63/746870663.db2.gz CXAHQFXTRUGDQI-AWEZNQCLSA-N 1 1 372.263 2.950 20 5 FFBDMO C[C@@H]1[C@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C ZINC000844640410 748062128 /nfs/dbraw/zinc/06/21/28/748062128.db2.gz HIHULKSWUCLNLS-AXFHLTTASA-N 1 1 370.247 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCn3ncc(Br)c3C2)cc1 ZINC000852626043 749907039 /nfs/dbraw/zinc/90/70/39/749907039.db2.gz CVLZVZQFQLVTRT-UHFFFAOYSA-N 1 1 351.204 2.612 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCn3ncc(Br)c3C2)cc1 ZINC000852626043 749907046 /nfs/dbraw/zinc/90/70/46/749907046.db2.gz CVLZVZQFQLVTRT-UHFFFAOYSA-N 1 1 351.204 2.612 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+](CCN2CCOCC2)CC2CC2)ccc1Cl ZINC000852636276 749910552 /nfs/dbraw/zinc/91/05/52/749910552.db2.gz RGXYZTZOWTXZJA-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000853240772 750036698 /nfs/dbraw/zinc/03/66/98/750036698.db2.gz FJDJOABGWCFMDB-WDEREUQCSA-N 1 1 356.220 2.632 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000044564361 845096177 /nfs/dbraw/zinc/09/61/77/845096177.db2.gz DJIOJIZONJEASN-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@@H]3C[C@]3(O)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000895651270 970807500 /nfs/dbraw/zinc/80/75/00/970807500.db2.gz ZDAVVLHWVOXKBE-JXFKEZNVSA-N 1 1 370.405 2.749 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190512 1013079188 /nfs/dbraw/zinc/07/91/88/1013079188.db2.gz VKPXWBYETPIZFF-LIRRHRJNSA-N 1 1 359.401 2.978 20 5 FFBDMO C[C@H]1CN(c2cccc(F)c2)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000795190512 1013079205 /nfs/dbraw/zinc/07/92/05/1013079205.db2.gz VKPXWBYETPIZFF-LIRRHRJNSA-N 1 1 359.401 2.978 20 5 FFBDMO Cc1ccccc1CCC[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001267837743 971448486 /nfs/dbraw/zinc/44/84/86/971448486.db2.gz UQKPYYQMBQLACF-QZTJIDSGSA-N 1 1 359.470 2.611 20 5 FFBDMO CCc1cc(N2CCc3[nH+]ccn3CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001167180689 960366476 /nfs/dbraw/zinc/36/64/76/960366476.db2.gz PISPKKFINVLFLF-UHFFFAOYSA-N 1 1 364.409 2.873 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC001271075541 968058131 /nfs/dbraw/zinc/05/81/31/968058131.db2.gz UIKVXMDXMBPROV-INIZCTEOSA-N 1 1 354.410 2.550 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1C[N@@H+](C)CCN1C ZINC000895247762 968761312 /nfs/dbraw/zinc/76/13/12/968761312.db2.gz WFFKBKSARSTFMK-PBHICJAKSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1CN(C)CC[N@@H+]1C ZINC000895247762 968761320 /nfs/dbraw/zinc/76/13/20/968761320.db2.gz WFFKBKSARSTFMK-PBHICJAKSA-N 1 1 355.442 2.703 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[C@@H]1CN(C)CC[N@H+]1C ZINC000895247762 968761332 /nfs/dbraw/zinc/76/13/32/968761332.db2.gz WFFKBKSARSTFMK-PBHICJAKSA-N 1 1 355.442 2.703 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000311580632 970060553 /nfs/dbraw/zinc/06/05/53/970060553.db2.gz CPVXRIBCPNKFHJ-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311580632 970060563 /nfs/dbraw/zinc/06/05/63/970060563.db2.gz CPVXRIBCPNKFHJ-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311580632 970060569 /nfs/dbraw/zinc/06/05/69/970060569.db2.gz CPVXRIBCPNKFHJ-PXNSSMCTSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000311580628 970060836 /nfs/dbraw/zinc/06/08/36/970060836.db2.gz CPVXRIBCPNKFHJ-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311580628 970060844 /nfs/dbraw/zinc/06/08/44/970060844.db2.gz CPVXRIBCPNKFHJ-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311580628 970060852 /nfs/dbraw/zinc/06/08/52/970060852.db2.gz CPVXRIBCPNKFHJ-FXAWDEMLSA-N 1 1 355.438 2.740 20 5 FFBDMO C[N@@H+](CCCC(=O)[O-])CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001604161741 972577810 /nfs/dbraw/zinc/57/78/10/972577810.db2.gz UTFKECSOXZBOCC-UHFFFAOYSA-N 1 1 363.458 2.646 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1OC(F)F ZINC000760572121 975573010 /nfs/dbraw/zinc/57/30/10/975573010.db2.gz YGDZZWSCEAEIIZ-UHFFFAOYSA-N 1 1 373.400 2.991 20 5 FFBDMO CC1(C)CCC(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)CC1 ZINC000981764789 976764642 /nfs/dbraw/zinc/76/46/42/976764642.db2.gz DEMCMKNQJPNTBN-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO CC1(C)CCC(C[N@@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)CC1 ZINC000981764789 976764647 /nfs/dbraw/zinc/76/46/47/976764647.db2.gz DEMCMKNQJPNTBN-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO CC1(C)CCC(C[N@H+]2CCCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)CC1 ZINC000981764789 976764653 /nfs/dbraw/zinc/76/46/53/976764653.db2.gz DEMCMKNQJPNTBN-IAGOWNOFSA-N 1 1 363.502 2.792 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CCC[C@H]([NH+]2CCOCC2)C1 ZINC000894022822 977637735 /nfs/dbraw/zinc/63/77/35/977637735.db2.gz FPRKHDVSOQYMMY-AWEZNQCLSA-N 1 1 360.389 2.583 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000053683041 979649991 /nfs/dbraw/zinc/64/99/91/979649991.db2.gz ZOALTBGCZPOSLI-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000053683041 979650001 /nfs/dbraw/zinc/65/00/01/979650001.db2.gz ZOALTBGCZPOSLI-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000905715996 980496533 /nfs/dbraw/zinc/49/65/33/980496533.db2.gz NHLBCRXCQPZRBY-AWEZNQCLSA-N 1 1 354.414 2.824 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 ZINC000906054595 980564071 /nfs/dbraw/zinc/56/40/71/980564071.db2.gz ZSGRLEXESCQJQR-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1 ZINC000877820906 1014740633 /nfs/dbraw/zinc/74/06/33/1014740633.db2.gz KEYRNMDGQCVSBK-CYBMUJFWSA-N 1 1 366.414 2.777 20 5 FFBDMO Cn1ccnc1[C@@H](NCC[N@H+]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000898034993 982600024 /nfs/dbraw/zinc/60/00/24/982600024.db2.gz GADSGMXGXZWBFG-KRWDZBQOSA-N 1 1 357.458 2.739 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000764316256 984417987 /nfs/dbraw/zinc/41/79/87/984417987.db2.gz WAPQYKBPIKMBQD-AWEZNQCLSA-N 1 1 372.425 2.890 20 5 FFBDMO C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)[N@@H+](C)C1CC1 ZINC000057716051 984515338 /nfs/dbraw/zinc/51/53/38/984515338.db2.gz AZAWUZBIPZNZMZ-CQSZACIVSA-N 1 1 360.458 2.798 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000172355148 985518436 /nfs/dbraw/zinc/51/84/36/985518436.db2.gz BOGJNUKADOLJSJ-HNNXBMFYSA-N 1 1 354.410 2.571 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@H]2CC[N@@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715716989 987221133 /nfs/dbraw/zinc/22/11/33/987221133.db2.gz YIGVHWHQYAYSLA-CQSZACIVSA-N 1 1 374.828 2.835 20 5 FFBDMO Nc1c(Cl)cc(C(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000715716989 987221137 /nfs/dbraw/zinc/22/11/37/987221137.db2.gz YIGVHWHQYAYSLA-CQSZACIVSA-N 1 1 374.828 2.835 20 5 FFBDMO C[C@H]([N@@H+](C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C(C)(C)C ZINC000914568720 987792375 /nfs/dbraw/zinc/79/23/75/987792375.db2.gz OBAVCWCDIMWTDB-KPZWWZAWSA-N 1 1 362.430 2.686 20 5 FFBDMO CCCC[N@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000914784055 987907007 /nfs/dbraw/zinc/90/70/07/987907007.db2.gz UUVXGKINMJVZRQ-SFHVURJKSA-N 1 1 360.414 2.584 20 5 FFBDMO CCCC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000914784055 987907017 /nfs/dbraw/zinc/90/70/17/987907017.db2.gz UUVXGKINMJVZRQ-SFHVURJKSA-N 1 1 360.414 2.584 20 5 FFBDMO Cc1cc(C)c(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1 ZINC001034643213 990147360 /nfs/dbraw/zinc/14/73/60/990147360.db2.gz KGLHRGFDVAZZEA-YWTNHNAXSA-N 1 1 359.470 2.794 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](Cc3ccccc3C3CC3)C2)CC1 ZINC001035704170 990528867 /nfs/dbraw/zinc/52/88/67/990528867.db2.gz FRRDJRXXMJLCHB-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO COc1cccc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000194844332 990590961 /nfs/dbraw/zinc/59/09/61/990590961.db2.gz FODHMQFWOKRBOQ-UONOGXRCSA-N 1 1 361.442 2.986 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000919521047 990663740 /nfs/dbraw/zinc/66/37/40/990663740.db2.gz ALWMKMCSKJZBRO-AWEZNQCLSA-N 1 1 361.398 2.590 20 5 FFBDMO C[N@H+](CCOc1ccc(F)cc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068959884 991554482 /nfs/dbraw/zinc/55/44/82/991554482.db2.gz GJVROSFQYGBDFA-UHFFFAOYSA-N 1 1 371.372 2.961 20 5 FFBDMO C[N@@H+](CCOc1ccc(F)cc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000068959884 991554493 /nfs/dbraw/zinc/55/44/93/991554493.db2.gz GJVROSFQYGBDFA-UHFFFAOYSA-N 1 1 371.372 2.961 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1CCCCC1 ZINC000069499819 991764159 /nfs/dbraw/zinc/76/41/59/991764159.db2.gz SZHPCLHHYSGKKU-UHFFFAOYSA-N 1 1 364.402 2.887 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001132400116 994874417 /nfs/dbraw/zinc/87/44/17/994874417.db2.gz CMQKFSAWAKQCER-QGZVFWFLSA-N 1 1 361.442 2.887 20 5 FFBDMO C[C@@]1(COC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000747772347 995371963 /nfs/dbraw/zinc/37/19/63/995371963.db2.gz ORYXUMADQVFMCM-IBGZPJMESA-N 1 1 372.425 2.779 20 5 FFBDMO Cn1ncc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C1CC1 ZINC000813171259 995633775 /nfs/dbraw/zinc/63/37/75/995633775.db2.gz HSPYAOJGPMLSJZ-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO Cn1ncc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1C1CC1 ZINC000813171259 995633777 /nfs/dbraw/zinc/63/37/77/995633777.db2.gz HSPYAOJGPMLSJZ-INIZCTEOSA-N 1 1 370.409 2.637 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000826752360 1016047517 /nfs/dbraw/zinc/04/75/17/1016047517.db2.gz ZAYJUYNUIWGHFT-SNRMKQJTSA-N 1 1 357.454 2.937 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1 ZINC000824827937 997118453 /nfs/dbraw/zinc/11/84/53/997118453.db2.gz JUAUQOQEVCDOIO-KGLIPLIRSA-N 1 1 371.359 2.746 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000825181533 997241458 /nfs/dbraw/zinc/24/14/58/997241458.db2.gz UOHNQCPSFSVUCM-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825389878 997333671 /nfs/dbraw/zinc/33/36/71/997333671.db2.gz VZPUTLMCUBYERC-LSBZLQRGSA-N 1 1 369.421 2.580 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2CCCC[C@@H]21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000181084414 998994456 /nfs/dbraw/zinc/99/44/56/998994456.db2.gz WPEMUKSYYJMMQQ-OCCSQVGLSA-N 1 1 361.398 2.917 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C(C)C)[NH+]1CCCC1 ZINC000741014049 999700841 /nfs/dbraw/zinc/70/08/41/999700841.db2.gz ILMYNKKHGSUQLT-KRWDZBQOSA-N 1 1 363.414 2.505 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741017040 999702466 /nfs/dbraw/zinc/70/24/66/999702466.db2.gz LTXKLUMLVIPVRP-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741017040 999702468 /nfs/dbraw/zinc/70/24/68/999702468.db2.gz LTXKLUMLVIPVRP-XQQFMLRXSA-N 1 1 374.397 2.949 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000742362581 999770554 /nfs/dbraw/zinc/77/05/54/999770554.db2.gz SGYDVOWPUFVRQJ-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)C1 ZINC001169030392 1000016233 /nfs/dbraw/zinc/01/62/33/1000016233.db2.gz ZKMNCYJJLSMMCP-IMBTUZDBSA-N 1 1 361.442 2.529 20 5 FFBDMO CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169036859 1000016592 /nfs/dbraw/zinc/01/65/92/1000016592.db2.gz QIJDEHQFRWOMBH-QQOZWVEPSA-N 1 1 353.463 2.952 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@H](OCC3CC3)[C@@H]2Cc2cccnc2)C1 ZINC001169019038 1000017395 /nfs/dbraw/zinc/01/73/95/1000017395.db2.gz GKQHJOXLLLWKBB-YRPNKDGESA-N 1 1 359.470 2.939 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)C1 ZINC001169019191 1000017583 /nfs/dbraw/zinc/01/75/83/1000017583.db2.gz FJIHNJWRMDVLAJ-POGZOPGASA-N 1 1 361.442 2.528 20 5 FFBDMO CC[N@@H+](C[C@@H]1CN(Cc2ccccc2)CCO1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169053547 1000019090 /nfs/dbraw/zinc/01/90/90/1000019090.db2.gz ILKDBAONGHNECZ-UFYCRDLUSA-N 1 1 361.486 2.655 20 5 FFBDMO Cn1cc([C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846931961 1000482033 /nfs/dbraw/zinc/48/20/33/1000482033.db2.gz OLORIYFLYNEVKE-OAHLLOKOSA-N 1 1 359.386 2.862 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)CC1 ZINC000771403694 1001102834 /nfs/dbraw/zinc/10/28/34/1001102834.db2.gz HLESADPFHDFBSQ-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)CC1 ZINC000771403694 1001102839 /nfs/dbraw/zinc/10/28/39/1001102839.db2.gz HLESADPFHDFBSQ-HOTGVXAUSA-N 1 1 374.485 2.996 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)OC(=O)C[NH+]2[C@@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000785742832 1001474602 /nfs/dbraw/zinc/47/46/02/1001474602.db2.gz OYJYXBURUDWRHP-OBJOEFQTSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000786821105 1001632853 /nfs/dbraw/zinc/63/28/53/1001632853.db2.gz YIIUXHYSDUTOCI-UKRRQHHQSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1cc(F)ccc1[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000746669439 1001681810 /nfs/dbraw/zinc/68/18/10/1001681810.db2.gz CLPAQVNUVQOFET-PBHICJAKSA-N 1 1 360.389 2.657 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000774320268 1001860961 /nfs/dbraw/zinc/86/09/61/1001860961.db2.gz CMTIRBVZGAXJBR-ZDUSSCGKSA-N 1 1 366.437 2.794 20 5 FFBDMO O=C1OCCN1[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000826995330 1016545507 /nfs/dbraw/zinc/54/55/07/1016545507.db2.gz ULKWFEVJCGGQSO-HNNXBMFYSA-N 1 1 357.366 2.881 20 5 FFBDMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000789521873 1002106726 /nfs/dbraw/zinc/10/67/26/1002106726.db2.gz UJFZAZBXQLXOGE-CQSZACIVSA-N 1 1 359.430 2.591 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H]1CC[C@@H](C)C1 ZINC000790477745 1002388107 /nfs/dbraw/zinc/38/81/07/1002388107.db2.gz JHWAFSBIOYLKEK-GDBMZVCRSA-N 1 1 359.430 2.948 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCC[C@@H](C)C1 ZINC000791207734 1002617738 /nfs/dbraw/zinc/61/77/38/1002617738.db2.gz CQZJGEUIYDIDHM-OLZOCXBDSA-N 1 1 366.437 2.650 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000792189275 1002939260 /nfs/dbraw/zinc/93/92/60/1002939260.db2.gz KTZHKENIFUSOEV-MRXNPFEDSA-N 1 1 363.458 2.658 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C(C)C)[C@@H]2CCN(C(C)=O)C2)c([N+](=O)[O-])c1 ZINC001170354651 1003121064 /nfs/dbraw/zinc/12/10/64/1003121064.db2.gz NMDSRKDFAOHRGN-WMLDXEAASA-N 1 1 363.458 2.866 20 5 FFBDMO COC[C@H]1C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341360 1003130330 /nfs/dbraw/zinc/13/03/30/1003130330.db2.gz PLLFRUROHUVWSU-UKRRQHHQSA-N 1 1 374.441 2.514 20 5 FFBDMO COC[C@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001170341360 1003130332 /nfs/dbraw/zinc/13/03/32/1003130332.db2.gz PLLFRUROHUVWSU-UKRRQHHQSA-N 1 1 374.441 2.514 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000792876108 1003216225 /nfs/dbraw/zinc/21/62/25/1003216225.db2.gz LDBNWMDLFUUICM-LBPRGKRZSA-N 1 1 368.353 2.935 20 5 FFBDMO C[N@@H+]1C[C@H]2[C@@H](CCN2c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1 ZINC001186571357 1003348212 /nfs/dbraw/zinc/34/82/12/1003348212.db2.gz IGQQDROIGDIOFU-LPHOPBHVSA-N 1 1 351.406 2.966 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)[C@H](C)C2)CC1 ZINC000747142758 1003479326 /nfs/dbraw/zinc/47/93/26/1003479326.db2.gz KCXSKBMESPMNMV-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)[C@H](C)C2)CC1 ZINC000747142758 1003479331 /nfs/dbraw/zinc/47/93/31/1003479331.db2.gz KCXSKBMESPMNMV-OAHLLOKOSA-N 1 1 360.458 2.607 20 5 FFBDMO C[C@@]1(CNc2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000804684297 1003782660 /nfs/dbraw/zinc/78/26/60/1003782660.db2.gz YCOHYMLYUNNKTR-FQEVSTJZSA-N 1 1 370.453 2.993 20 5 FFBDMO CCN(C)C(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805763145 1004138123 /nfs/dbraw/zinc/13/81/23/1004138123.db2.gz PUFOHAUYELQHDV-IAGOWNOFSA-N 1 1 365.430 2.571 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001198583694 1004683623 /nfs/dbraw/zinc/68/36/23/1004683623.db2.gz FJNOTRUTWZAGGD-SNVBAGLBSA-N 1 1 358.345 2.802 20 5 FFBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000776274222 1005340299 /nfs/dbraw/zinc/34/02/99/1005340299.db2.gz CGXSZUOOFXCHIE-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO C[N@H+](Cc1ccccc1N1CCOCC1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276613 1005342675 /nfs/dbraw/zinc/34/26/75/1005342675.db2.gz OCXIIQLPLMMQDK-FQEVSTJZSA-N 1 1 371.437 2.597 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000776279559 1005345807 /nfs/dbraw/zinc/34/58/07/1005345807.db2.gz YHKLSEAYOMQICE-HXUWFJFHSA-N 1 1 364.405 2.872 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCc3c(cnn3-c3ccccc3)C2)cc1 ZINC000776279559 1005345809 /nfs/dbraw/zinc/34/58/09/1005345809.db2.gz YHKLSEAYOMQICE-HXUWFJFHSA-N 1 1 364.405 2.872 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@@H]1CC[C@H](C)C1 ZINC000853507865 1006421411 /nfs/dbraw/zinc/42/14/11/1006421411.db2.gz CHSCVPGGFXIYEQ-LSDHHAIUSA-N 1 1 359.430 2.948 20 5 FFBDMO CO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517474 1006422550 /nfs/dbraw/zinc/42/25/50/1006422550.db2.gz URWQOPLPQDPTNB-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517474 1006422556 /nfs/dbraw/zinc/42/25/56/1006422556.db2.gz URWQOPLPQDPTNB-CVEARBPZSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@H]1C[C@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517475 1006422633 /nfs/dbraw/zinc/42/26/33/1006422633.db2.gz URWQOPLPQDPTNB-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C12CCC2 ZINC000853517475 1006422643 /nfs/dbraw/zinc/42/26/43/1006422643.db2.gz URWQOPLPQDPTNB-HOTGVXAUSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](N(C)c3ccccc3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000853584158 1006460260 /nfs/dbraw/zinc/46/02/60/1006460260.db2.gz GLQZQXUANNNMFO-INIZCTEOSA-N 1 1 366.425 2.816 20 5 FFBDMO 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CC(C)[C@@H](CC[N@@H+](C)CCn1cc([N+](=O)[O-])cn1)NC(=O)OC(C)(C)C ZINC001191289583 1007956342 /nfs/dbraw/zinc/95/63/42/1007956342.db2.gz PWAGDRSUEGBVEA-OAHLLOKOSA-N 1 1 369.466 2.663 20 5 FFBDMO O=[N+]([O-])c1c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)nc2ccccn21 ZINC000819946273 1008262597 /nfs/dbraw/zinc/26/25/97/1008262597.db2.gz KLNUWWXMQBACCO-DLBZAZTESA-N 1 1 363.421 2.953 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000858177992 1008318534 /nfs/dbraw/zinc/31/85/34/1008318534.db2.gz JGXUNECFEXWKLX-KRWDZBQOSA-N 1 1 371.437 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000821226950 1008431672 /nfs/dbraw/zinc/43/16/72/1008431672.db2.gz YURIJMMSRZIYRP-UHFFFAOYSA-N 1 1 363.458 2.642 20 5 FFBDMO CC(=O)N1CCCCC[C@@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886003825 1008516372 /nfs/dbraw/zinc/51/63/72/1008516372.db2.gz LRBMOHKEGJJBKA-GOSISDBHSA-N 1 1 360.458 2.993 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)Cc1ncccn1 ZINC001177376462 1008583114 /nfs/dbraw/zinc/58/31/14/1008583114.db2.gz KAYOOWWHPWQTRK-UHFFFAOYSA-N 1 1 373.416 2.928 20 5 FFBDMO C[C@H](CNC(=O)[C@H]1CCC[N@@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402708 1009196006 /nfs/dbraw/zinc/19/60/06/1009196006.db2.gz HUIKLDGKUTWCDT-DNVCBOLYSA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@H](CNC(=O)[C@H]1CCC[N@H+]1Cc1ccccn1)c1ccccc1[N+](=O)[O-] ZINC000887402708 1009196019 /nfs/dbraw/zinc/19/60/19/1009196019.db2.gz HUIKLDGKUTWCDT-DNVCBOLYSA-N 1 1 368.437 2.874 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000823956535 1009277645 /nfs/dbraw/zinc/27/76/45/1009277645.db2.gz SKSUWUJSSLDTLM-RDJZCZTQSA-N 1 1 355.398 2.744 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000823921565 1009282845 /nfs/dbraw/zinc/28/28/45/1009282845.db2.gz YIBCCMDAANBTDC-MRXNPFEDSA-N 1 1 369.425 2.568 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000823921565 1009282861 /nfs/dbraw/zinc/28/28/61/1009282861.db2.gz YIBCCMDAANBTDC-MRXNPFEDSA-N 1 1 369.425 2.568 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134873190 1009496678 /nfs/dbraw/zinc/49/66/78/1009496678.db2.gz AEJMGEZJPBMYLI-DNVCBOLYSA-N 1 1 372.469 2.790 20 5 FFBDMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861825787 1009574468 /nfs/dbraw/zinc/57/44/68/1009574468.db2.gz YLUHYBVXRWERTG-RBUKOAKNSA-N 1 1 369.421 2.683 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC000889623030 1010033053 /nfs/dbraw/zinc/03/30/53/1010033053.db2.gz RPFFDCBIXOTFLZ-PBHICJAKSA-N 1 1 368.437 2.887 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000864630504 1010535332 /nfs/dbraw/zinc/53/53/32/1010535332.db2.gz MZXZTQVXNYGATF-MRXNPFEDSA-N 1 1 357.385 2.667 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NCCC[N@H+]1CCc2ccccc2C1 ZINC000864823831 1010589496 /nfs/dbraw/zinc/58/94/96/1010589496.db2.gz UJBVMYMIRNTLLQ-UHFFFAOYSA-N 1 1 371.412 2.841 20 5 FFBDMO CCCCNC(=O)[C@H]1CCC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000121141918 1011022370 /nfs/dbraw/zinc/02/23/70/1011022370.db2.gz VYQFKHZAZRZEFJ-HNNXBMFYSA-N 1 1 373.457 2.839 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000796170016 1011234522 /nfs/dbraw/zinc/23/45/22/1011234522.db2.gz DSINJSWFEJKYOH-INIZCTEOSA-N 1 1 365.430 2.964 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C)[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001171890042 1011522376 /nfs/dbraw/zinc/52/23/76/1011522376.db2.gz DEJWHOCTZJVRQA-HNNXBMFYSA-N 1 1 353.422 2.966 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC001171890042 1011522390 /nfs/dbraw/zinc/52/23/90/1011522390.db2.gz DEJWHOCTZJVRQA-HNNXBMFYSA-N 1 1 353.422 2.966 20 5 FFBDMO COC(=O)Cc1ccc(N2CCC(n3c[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000828059799 1032588821 /nfs/dbraw/zinc/58/88/21/1032588821.db2.gz ZFIRGBMKONGORM-UHFFFAOYSA-N 1 1 358.398 2.657 20 5 FFBDMO COC[C@@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906364 1012078379 /nfs/dbraw/zinc/07/83/79/1012078379.db2.gz HAMOYVYXMYEGPE-IRXDYDNUSA-N 1 1 370.453 2.822 20 5 FFBDMO COC[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ncn(C)c21 ZINC001172906364 1012078398 /nfs/dbraw/zinc/07/83/98/1012078398.db2.gz HAMOYVYXMYEGPE-IRXDYDNUSA-N 1 1 370.453 2.822 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCCN(c3ncccn3)CC1)CC2 ZINC001172914483 1012097380 /nfs/dbraw/zinc/09/73/80/1012097380.db2.gz GXGZYBNDHGOCDL-SFHVURJKSA-N 1 1 367.453 2.845 20 5 FFBDMO O=C(c1ccco1)N1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172909642 1012123658 /nfs/dbraw/zinc/12/36/58/1012123658.db2.gz ULKZNDMEHBSTDY-QGZVFWFLSA-N 1 1 369.421 2.893 20 5 FFBDMO C[C@]1(CO)CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010564 1012178540 /nfs/dbraw/zinc/17/85/40/1012178540.db2.gz VAPHEEQIPSDTAD-KRWDZBQOSA-N 1 1 355.385 2.546 20 5 FFBDMO C[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC[C@@H]1O ZINC001173010579 1012178660 /nfs/dbraw/zinc/17/86/60/1012178660.db2.gz VLHVJDAPEPGJQD-PXAZEXFGSA-N 1 1 369.412 2.935 20 5 FFBDMO CCN1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)C1 ZINC001173017233 1012188908 /nfs/dbraw/zinc/18/89/08/1012188908.db2.gz ZXAJRWDEJVQIQF-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO CC[N@@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)C1 ZINC001173017233 1012188917 /nfs/dbraw/zinc/18/89/17/1012188917.db2.gz ZXAJRWDEJVQIQF-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO CC[N@H+]1CCN(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@H](C)C1 ZINC001173017233 1012188924 /nfs/dbraw/zinc/18/89/24/1012188924.db2.gz ZXAJRWDEJVQIQF-CYBMUJFWSA-N 1 1 368.428 2.868 20 5 FFBDMO C[C@H]1C[C@@H](O)CC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018629 1012189528 /nfs/dbraw/zinc/18/95/28/1012189528.db2.gz XRZREGGGRIXDPZ-FZMZJTMJSA-N 1 1 355.385 2.687 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@](F)(CO)CC2)c1F ZINC001173180025 1012325366 /nfs/dbraw/zinc/32/53/66/1012325366.db2.gz ICRAJDFRILJDPH-PXAZEXFGSA-N 1 1 358.385 2.860 20 5 FFBDMO COC(=O)CC[C@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173195488 1012337766 /nfs/dbraw/zinc/33/77/66/1012337766.db2.gz GTSNHUMKQJZTJC-STQMWFEESA-N 1 1 368.405 2.949 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2c1cnn2C ZINC001173220683 1012352780 /nfs/dbraw/zinc/35/27/80/1012352780.db2.gz BUVZUAGKQMYRQU-GOEBONIOSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225344 1012357008 /nfs/dbraw/zinc/35/70/08/1012357008.db2.gz NMHFRTMBMHNRBC-GOEBONIOSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2nnn(CC)c21 ZINC001173225344 1012357028 /nfs/dbraw/zinc/35/70/28/1012357028.db2.gz NMHFRTMBMHNRBC-GOEBONIOSA-N 1 1 373.457 2.773 20 5 FFBDMO COc1cc(C)nc(O[C@@H]2CC[N@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237130 1012382511 /nfs/dbraw/zinc/38/25/11/1012382511.db2.gz IAZCJIVNXHLWAZ-WMLDXEAASA-N 1 1 372.425 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c(Br)c1 ZINC000252539384 1012559707 /nfs/dbraw/zinc/55/97/07/1012559707.db2.gz BMPJQSJHTCPVEQ-RYUDHWBXSA-N 1 1 356.220 2.632 20 5 FFBDMO Nc1ccc2c(c1)C[N@@H+]([C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CCO2 ZINC000925755798 1017839147 /nfs/dbraw/zinc/83/91/47/1017839147.db2.gz YMVREPUAXFRCSZ-HZPDHXFCSA-N 1 1 357.414 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)nc1 ZINC000801524813 1019075462 /nfs/dbraw/zinc/07/54/62/1019075462.db2.gz OBRRKXPUURMBLA-LBPRGKRZSA-N 1 1 361.333 2.724 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)nc1 ZINC000801524813 1019075478 /nfs/dbraw/zinc/07/54/78/1019075478.db2.gz OBRRKXPUURMBLA-LBPRGKRZSA-N 1 1 361.333 2.724 20 5 FFBDMO COc1cc(OC)cc(-c2nnc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)o2)c1 ZINC001217715807 1032843828 /nfs/dbraw/zinc/84/38/28/1032843828.db2.gz ZZVJCYIOZPGICP-MRXNPFEDSA-N 1 1 370.365 2.905 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CCC[C@@H](C(F)(F)F)O3)C2)nc1 ZINC000929989946 1019795381 /nfs/dbraw/zinc/79/53/81/1019795381.db2.gz TYSHQFMLJZIBCS-XBFCOCLRSA-N 1 1 374.363 2.976 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505648 1020061827 /nfs/dbraw/zinc/06/18/27/1020061827.db2.gz UWNFOACSADQXAZ-DLBZAZTESA-N 1 1 371.462 2.934 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC000930505648 1020061839 /nfs/dbraw/zinc/06/18/39/1020061839.db2.gz UWNFOACSADQXAZ-DLBZAZTESA-N 1 1 371.462 2.934 20 5 FFBDMO CCC(CC)[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1 ZINC000726586260 1020488942 /nfs/dbraw/zinc/48/89/42/1020488942.db2.gz VVHOETOPSUSILZ-UHFFFAOYSA-N 1 1 360.414 2.974 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931725076 1020564560 /nfs/dbraw/zinc/56/45/60/1020564560.db2.gz NNGIJRPYYMMTJF-XPKDYRNWSA-N 1 1 357.414 2.874 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000800858633 1020604504 /nfs/dbraw/zinc/60/45/04/1020604504.db2.gz AXXFEGWXKJDUDK-AWEZNQCLSA-N 1 1 354.414 2.824 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1Cc2ccccc2OC2(CCOCC2)C1 ZINC000932036802 1020681302 /nfs/dbraw/zinc/68/13/02/1020681302.db2.gz JAJRFBJXNABDCU-UHFFFAOYSA-N 1 1 355.394 2.934 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[N@H+]1Cc2ccccc2OC2(CCOCC2)C1 ZINC000932036802 1020681306 /nfs/dbraw/zinc/68/13/06/1020681306.db2.gz JAJRFBJXNABDCU-UHFFFAOYSA-N 1 1 355.394 2.934 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1COC(C)(C)C ZINC000932161986 1020728509 /nfs/dbraw/zinc/72/85/09/1020728509.db2.gz AKIIZXWTHFQSJH-CQSZACIVSA-N 1 1 365.430 2.821 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1COC(C)(C)C ZINC000932161986 1020728516 /nfs/dbraw/zinc/72/85/16/1020728516.db2.gz AKIIZXWTHFQSJH-CQSZACIVSA-N 1 1 365.430 2.821 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1CNC(=O)OC(C)(C)C ZINC000932709606 1020880928 /nfs/dbraw/zinc/88/09/28/1020880928.db2.gz JUGQOYSZLABFNR-KBPBESRZSA-N 1 1 364.446 2.973 20 5 FFBDMO CCN1C[C@@H](C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21 ZINC000749663472 1021018050 /nfs/dbraw/zinc/01/80/50/1021018050.db2.gz FUEGTQJNDFHKSF-IEBWSBKVSA-N 1 1 371.437 2.848 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000749805262 1021038718 /nfs/dbraw/zinc/03/87/18/1021038718.db2.gz AABQUUOSXMJYJZ-HNNXBMFYSA-N 1 1 365.430 2.915 20 5 FFBDMO CC[NH+](CC)CC1CCN(Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000749953375 1021162634 /nfs/dbraw/zinc/16/26/34/1021162634.db2.gz DGNLCQLZSFCHCN-UHFFFAOYSA-N 1 1 360.462 2.659 20 5 FFBDMO COc1ccc(C[N@@H+](CCCO)C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000934505742 1021265985 /nfs/dbraw/zinc/26/59/85/1021265985.db2.gz YVSGHPZTNUNMEK-IBGZPJMESA-N 1 1 360.410 2.521 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934844349 1021425936 /nfs/dbraw/zinc/42/59/36/1021425936.db2.gz YZIPSESVWNNVGW-CVEARBPZSA-N 1 1 361.442 2.696 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H]2CCCC3(CCC3)O2)CC1 ZINC001119686668 1022935950 /nfs/dbraw/zinc/93/59/50/1022935950.db2.gz SGXIAWGVSOZKDV-GOSISDBHSA-N 1 1 373.453 2.844 20 5 FFBDMO Cc1ccc(C[NH+]2CCC3(CCN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)CC2)c(C)c1 ZINC001040699908 1022954812 /nfs/dbraw/zinc/95/48/12/1022954812.db2.gz HLKJPBFKCFKKEZ-RTBURBONSA-N 1 1 371.481 2.783 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752796901 1023205574 /nfs/dbraw/zinc/20/55/74/1023205574.db2.gz MSTLHQHSGDQVIK-HOTGVXAUSA-N 1 1 374.441 2.543 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351113 1033114458 /nfs/dbraw/zinc/11/44/58/1033114458.db2.gz TZBSJMTUJHLVIZ-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829351113 1033114467 /nfs/dbraw/zinc/11/44/67/1033114467.db2.gz TZBSJMTUJHLVIZ-XOBRGWDASA-N 1 1 369.421 2.688 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@H]1C ZINC000754222795 1023442008 /nfs/dbraw/zinc/44/20/08/1023442008.db2.gz DSEZVTLXDRNNRM-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@H]1C ZINC000754222795 1023442013 /nfs/dbraw/zinc/44/20/13/1023442013.db2.gz DSEZVTLXDRNNRM-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000755835392 1023642553 /nfs/dbraw/zinc/64/25/53/1023642553.db2.gz YQWGSEWGNRSYRX-HOCLYGCPSA-N 1 1 372.425 2.879 20 5 FFBDMO Cn1cc([N+](=O)[O-])c(C(=O)OC[C@]2(C)CCCC[N@H+]2Cc2ccccc2)n1 ZINC000755908025 1023649239 /nfs/dbraw/zinc/64/92/39/1023649239.db2.gz FYGISANWOUFCNG-IBGZPJMESA-N 1 1 372.425 2.930 20 5 FFBDMO COc1cccc(C(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000193810884 1024689412 /nfs/dbraw/zinc/68/94/12/1024689412.db2.gz ZIBCGBOGQLCKGQ-MRXNPFEDSA-N 1 1 369.421 2.855 20 5 FFBDMO CC(C)CCC[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540885 1024883971 /nfs/dbraw/zinc/88/39/71/1024883971.db2.gz ZEUIKESBHAPZHW-IAGOWNOFSA-N 1 1 353.507 2.942 20 5 FFBDMO Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000195128592 1024946176 /nfs/dbraw/zinc/94/61/76/1024946176.db2.gz UZCFEDPWEBDYLT-INIZCTEOSA-N 1 1 358.398 2.727 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)NC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)CC1 ZINC000837136068 1025605024 /nfs/dbraw/zinc/60/50/24/1025605024.db2.gz XCRNKTWAOMBTBF-JQIJEIRASA-N 1 1 374.485 2.530 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000839101361 1026591085 /nfs/dbraw/zinc/59/10/85/1026591085.db2.gz WZJYWPXXVDUSKW-GUDVDZBRSA-N 1 1 370.405 2.517 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F ZINC000839635008 1026768463 /nfs/dbraw/zinc/76/84/63/1026768463.db2.gz FMAWLLVNTAXMMV-MAUKXSAKSA-N 1 1 373.384 2.870 20 5 FFBDMO CC1(C)CN(C(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000839781733 1026824793 /nfs/dbraw/zinc/82/47/93/1026824793.db2.gz ZFPCKVGIPJZGJJ-GUDVDZBRSA-N 1 1 371.481 2.801 20 5 FFBDMO Cc1nn(C[NH+]2CCC3(CC2)OCCc2ccccc23)c(C)c1[N+](=O)[O-] ZINC000840154693 1026988095 /nfs/dbraw/zinc/98/80/95/1026988095.db2.gz UURCFNDHQKYEQX-UHFFFAOYSA-N 1 1 356.426 2.930 20 5 FFBDMO C[N@@H+](C1CN(c2nc3ccccc3c(Cl)c2[N+](=O)[O-])C1)[C@H]1CCOC1 ZINC001158731477 1027116127 /nfs/dbraw/zinc/11/61/27/1027116127.db2.gz OWIZGRJVBPHOET-NSHDSACASA-N 1 1 362.817 2.706 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC[C@@H](CO)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001158920248 1027191748 /nfs/dbraw/zinc/19/17/48/1027191748.db2.gz YIAQITKFTOEPBY-FDMDGMSGSA-N 1 1 356.426 2.785 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)nn1 ZINC001160732620 1027840235 /nfs/dbraw/zinc/84/02/35/1027840235.db2.gz QYJMHNDMPCUOBY-FUHWJXTLSA-N 1 1 369.425 2.717 20 5 FFBDMO O=[N+]([O-])c1cnccc1-c1nc(-c2ccc(C[NH+]3CCOCC3)cc2)no1 ZINC001213035691 1028310766 /nfs/dbraw/zinc/31/07/66/1028310766.db2.gz BODGPSGOFYAXLV-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO Cc1cc(N2CCN(c3[nH+]cccc3N)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC001154782364 1028448445 /nfs/dbraw/zinc/44/84/45/1028448445.db2.gz LNPFGRLDSZSXHF-UHFFFAOYSA-N 1 1 364.409 2.755 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001163437660 1028927948 /nfs/dbraw/zinc/92/79/48/1028927948.db2.gz STRNQGIPMCXGNF-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO CN(CCCN(C)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CC[NH+](C)C ZINC001163437660 1028927960 /nfs/dbraw/zinc/92/79/60/1028927960.db2.gz STRNQGIPMCXGNF-UHFFFAOYSA-N 1 1 362.396 2.933 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cn3nc(C)c4cc([N+](=O)[O-])ccc43)CC2)n1 ZINC000781150660 1029021311 /nfs/dbraw/zinc/02/13/11/1029021311.db2.gz SCICMFZQBFQGMI-UHFFFAOYSA-N 1 1 370.413 2.956 20 5 FFBDMO CC[N@H+]1CCCN(c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])CC1 ZINC001163776355 1029058868 /nfs/dbraw/zinc/05/88/68/1029058868.db2.gz VIZDCUXCQXYQLB-UHFFFAOYSA-N 1 1 353.732 2.589 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@H]1C(C)(C)C ZINC001163930819 1029120759 /nfs/dbraw/zinc/12/07/59/1029120759.db2.gz WYCJPTMTXFZVCY-KRWDZBQOSA-N 1 1 371.441 2.787 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1 ZINC001156315424 1029141721 /nfs/dbraw/zinc/14/17/21/1029141721.db2.gz NXTNGQSYPIWZKE-KBAYOESNSA-N 1 1 354.410 2.551 20 5 FFBDMO O=[N+]([O-])c1cc(NCc2ccc(C[NH+]3CCOCC3)cc2)nc2[nH]ccc21 ZINC001156391910 1029178257 /nfs/dbraw/zinc/17/82/57/1029178257.db2.gz CEWDEHXIFMJEFA-UHFFFAOYSA-N 1 1 367.409 2.915 20 5 FFBDMO O=C(NCCC1(C[NH2+]CCCCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164494920 1029298105 /nfs/dbraw/zinc/29/81/05/1029298105.db2.gz YJUSWRRXCJRUPM-QZTJIDSGSA-N 1 1 359.470 2.551 20 5 FFBDMO COc1nc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)ccc1[N+](=O)[O-] ZINC001165090377 1029379671 /nfs/dbraw/zinc/37/96/71/1029379671.db2.gz YTJKYOBRZMZPII-WBVHZDCISA-N 1 1 354.410 2.709 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2cc([N+](=O)[O-])cc(Cl)n2)CC1 ZINC001165109345 1029396367 /nfs/dbraw/zinc/39/63/67/1029396367.db2.gz UIGUVDBWKGLHQT-CYBMUJFWSA-N 1 1 354.838 2.723 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[N@@H+](C(C)C)[C@H](C)C1 ZINC001165198701 1029442904 /nfs/dbraw/zinc/44/29/04/1029442904.db2.gz ARDKHXGTCSUEBV-LLVKDONJSA-N 1 1 370.837 2.739 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc([C@@]3(O)CC[N@@H+](Cc4ccccc4)C3)n2)c1 ZINC000782222796 1029616080 /nfs/dbraw/zinc/61/60/80/1029616080.db2.gz FSTBXWYPIVMHPW-LJQANCHMSA-N 1 1 366.377 2.738 20 5 FFBDMO COc1cc(C)nc(-n2ccc(C[NH2+]Cc3ccccc3)n2)c1[N+](=O)[O-] ZINC001157609710 1029629371 /nfs/dbraw/zinc/62/93/71/1029629371.db2.gz PBAUYABQQOZSSU-UHFFFAOYSA-N 1 1 353.382 2.782 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2ncc(F)cc2[N+](=O)[O-])c2ccccc12 ZINC001158235872 1029765950 /nfs/dbraw/zinc/76/59/50/1029765950.db2.gz FBBIEUBMOKDVTR-GOSISDBHSA-N 1 1 372.356 2.506 20 5 FFBDMO COc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001165202759 1029888216 /nfs/dbraw/zinc/88/82/16/1029888216.db2.gz OEJRAQUOLMZUNB-KGLIPLIRSA-N 1 1 371.441 2.801 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)Cn1cccn1 ZINC001142156517 1030100054 /nfs/dbraw/zinc/10/00/54/1030100054.db2.gz UGEIZDHCRGVMKU-UHFFFAOYSA-N 1 1 361.405 2.792 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1F ZINC000783910621 1030333740 /nfs/dbraw/zinc/33/37/40/1030333740.db2.gz IKPJYKMKZMMLLC-AWEZNQCLSA-N 1 1 364.373 2.614 20 5 FFBDMO C/C(=C/C(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784071839 1030452208 /nfs/dbraw/zinc/45/22/08/1030452208.db2.gz DLAXOVZQMWVKMT-ILDQDYJLSA-N 1 1 373.453 2.758 20 5 FFBDMO C[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)C[C@]1(O)CCc2ccccc21 ZINC000842626629 1030849140 /nfs/dbraw/zinc/84/91/40/1030849140.db2.gz WIVMVUGNXIVZAU-LJQANCHMSA-N 1 1 352.394 2.668 20 5 FFBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C(=O)N(C)C ZINC001143277566 1031382799 /nfs/dbraw/zinc/38/27/99/1031382799.db2.gz SSSIEBATJPSCGI-UHFFFAOYSA-N 1 1 350.422 2.789 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000843422465 1031397586 /nfs/dbraw/zinc/39/75/86/1031397586.db2.gz VPYKKIIYCDUVQD-FQEVSTJZSA-N 1 1 372.421 2.878 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)c2ncc([N+](=O)[O-])cc12 ZINC000799153843 1031669464 /nfs/dbraw/zinc/66/94/64/1031669464.db2.gz AXONWFPFLWTVEB-IUHNQTRMSA-N 1 1 373.457 2.867 20 5 FFBDMO CC(C)(C)[N@H+]1CCN[C@H](C(=O)Nc2cc3cccnc3c3ncccc23)C1 ZINC001218979910 1033441579 /nfs/dbraw/zinc/44/15/79/1033441579.db2.gz KZYABPZRYVMGQZ-KRWDZBQOSA-N 1 1 363.465 2.794 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@H]3CN(C(=O)C(F)(F)F)C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000831563769 1034127692 /nfs/dbraw/zinc/12/76/92/1034127692.db2.gz POSWZBWKXZNVDG-UONOGXRCSA-N 1 1 371.359 2.746 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685333 1036254504 /nfs/dbraw/zinc/25/45/04/1036254504.db2.gz GDLIYDQQSTUJQT-YOEHRIQHSA-N 1 1 373.409 2.672 20 5 FFBDMO Cc1[nH]c(=O)cc(O[C@@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c1[N+](=O)[O-] ZINC001228685333 1036254520 /nfs/dbraw/zinc/25/45/20/1036254520.db2.gz GDLIYDQQSTUJQT-YOEHRIQHSA-N 1 1 373.409 2.672 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)cc1O ZINC001228813352 1036339696 /nfs/dbraw/zinc/33/96/96/1036339696.db2.gz BFSINTIVOBZGBM-ITGUQSILSA-N 1 1 364.398 2.870 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)cc1O ZINC001228813352 1036339710 /nfs/dbraw/zinc/33/97/10/1036339710.db2.gz BFSINTIVOBZGBM-ITGUQSILSA-N 1 1 364.398 2.870 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3cnccc3[N+](=O)[O-])[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001228881427 1036382494 /nfs/dbraw/zinc/38/24/94/1036382494.db2.gz DTALPHYSTJHXRW-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3cnccc3[N+](=O)[O-])[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001228881427 1036382510 /nfs/dbraw/zinc/38/25/10/1036382510.db2.gz DTALPHYSTJHXRW-BMGDILEWSA-N 1 1 353.378 2.743 20 5 FFBDMO C[N@H+]1CCc2cc(O[C@H]3CCN(c4ccc([N+](=O)[O-])cn4)C3)ccc2C1 ZINC001228943396 1036421774 /nfs/dbraw/zinc/42/17/74/1036421774.db2.gz HBQPVURFQFRQPR-SFHVURJKSA-N 1 1 354.410 2.635 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(Br)cc([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001229142398 1036517675 /nfs/dbraw/zinc/51/76/75/1036517675.db2.gz AIXFSYVBMPSQOB-CUOATXAZSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cc(Br)cc([N+](=O)[O-])c3)[C@H]1CC(=O)C2 ZINC001229142398 1036517685 /nfs/dbraw/zinc/51/76/85/1036517685.db2.gz AIXFSYVBMPSQOB-CUOATXAZSA-N 1 1 355.188 2.540 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3c(C)cc(F)cc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001229200093 1036548837 /nfs/dbraw/zinc/54/88/37/1036548837.db2.gz CUVJDIIHPGWXFK-AYDFFVQHSA-N 1 1 352.362 2.588 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc2nc(OC3COC3)c3ccccc3c2c1 ZINC001229806945 1036911063 /nfs/dbraw/zinc/91/10/63/1036911063.db2.gz CUSOJSISUMJZJJ-UHFFFAOYSA-N 1 1 351.406 2.666 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001277849082 1036997580 /nfs/dbraw/zinc/99/75/80/1036997580.db2.gz INLZDARVKDPYQY-UPJWGTAASA-N 1 1 356.426 2.883 20 5 FFBDMO CCOC(=O)Cc1ccc([N+](=O)[O-])c(OC2CC[NH+](CCF)CC2)c1 ZINC001234409504 1037024712 /nfs/dbraw/zinc/02/47/12/1037024712.db2.gz BGXJMAOLFHVNFX-UHFFFAOYSA-N 1 1 354.378 2.513 20 5 FFBDMO Cc1ccc(Cc2nnc(CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258092018 1039165586 /nfs/dbraw/zinc/16/55/86/1039165586.db2.gz PXFKHZGOPQSVIF-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO Cc1ccc(Cc2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc1[N+](=O)[O-] ZINC001258092018 1039165607 /nfs/dbraw/zinc/16/56/07/1039165607.db2.gz PXFKHZGOPQSVIF-OKILXGFUSA-N 1 1 360.414 2.529 20 5 FFBDMO COc1cc(N2CCC([NH2+]C[C@@H]3CC[C@H](C)CN3)CC2)ccc1[N+](=O)[O-] ZINC001246111250 1039245628 /nfs/dbraw/zinc/24/56/28/1039245628.db2.gz IPBGZKHFIYZNTA-HOCLYGCPSA-N 1 1 362.474 2.550 20 5 FFBDMO COc1cc(N2CCC(NC[C@@H]3CC[C@H](C)C[NH2+]3)CC2)ccc1[N+](=O)[O-] ZINC001246111250 1039245636 /nfs/dbraw/zinc/24/56/36/1039245636.db2.gz IPBGZKHFIYZNTA-HOCLYGCPSA-N 1 1 362.474 2.550 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCN1 ZINC001246684052 1039437052 /nfs/dbraw/zinc/43/70/52/1039437052.db2.gz DFLHXHDJAXMUQG-KRWDZBQOSA-N 1 1 368.428 2.772 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCN1 ZINC001246684052 1039437054 /nfs/dbraw/zinc/43/70/54/1039437054.db2.gz DFLHXHDJAXMUQG-KRWDZBQOSA-N 1 1 368.428 2.772 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CCN[C@H](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001246686394 1039439640 /nfs/dbraw/zinc/43/96/40/1039439640.db2.gz MJBGMTSNZYCUBD-KRWDZBQOSA-N 1 1 362.474 2.502 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCN[C@H](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001246686394 1039439650 /nfs/dbraw/zinc/43/96/50/1039439650.db2.gz MJBGMTSNZYCUBD-KRWDZBQOSA-N 1 1 362.474 2.502 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254479956 1040745469 /nfs/dbraw/zinc/74/54/69/1040745469.db2.gz RPMPTXODVJQXAR-IBGZPJMESA-N 1 1 361.442 2.839 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(C(=O)c3ccco3)C[C@H]2C1 ZINC001254555573 1040795238 /nfs/dbraw/zinc/79/52/38/1040795238.db2.gz HQWUWMNBOACOIZ-OIISXLGYSA-N 1 1 369.421 2.823 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001254561857 1040800751 /nfs/dbraw/zinc/80/07/51/1040800751.db2.gz MXXGTEIHYXXHGI-AHRSYUTCSA-N 1 1 366.465 2.985 20 5 FFBDMO Cc1cc(C)nc(N2CC[NH+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC001254563550 1040803349 /nfs/dbraw/zinc/80/33/49/1040803349.db2.gz YJANZIXRSUEYLZ-INIZCTEOSA-N 1 1 355.442 2.755 20 5 FFBDMO CC(C)[N@H+]1CCOC[C@]2(CCCN([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823254 /nfs/dbraw/zinc/82/32/54/1040823254.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@]2(CCC[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823261 /nfs/dbraw/zinc/82/32/61/1040823261.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 1 1 373.497 2.885 20 5 FFBDMO CC(C)N1CCOC[C@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1 ZINC001254592713 1040823270 /nfs/dbraw/zinc/82/32/70/1040823270.db2.gz GAANOPWFXBAFGJ-LEWJYISDSA-N 1 1 373.497 2.885 20 5 FFBDMO CCn1cc2c(n1)C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@H]2COC ZINC001254599339 1040830391 /nfs/dbraw/zinc/83/03/91/1040830391.db2.gz YDQSJTNNKVBGDB-RDJZCZTQSA-N 1 1 356.426 2.524 20 5 FFBDMO CCn1cc2c(n1)C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C[C@H]2COC ZINC001254599339 1040830407 /nfs/dbraw/zinc/83/04/07/1040830407.db2.gz YDQSJTNNKVBGDB-RDJZCZTQSA-N 1 1 356.426 2.524 20 5 FFBDMO CCOC(=O)c1nc2c(s1)C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254607584 1040834761 /nfs/dbraw/zinc/83/47/61/1040834761.db2.gz LESKUDLNHKNACP-CQSZACIVSA-N 1 1 373.434 2.754 20 5 FFBDMO CCOC(=O)c1nc2c(s1)C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)CC2 ZINC001254607584 1040834770 /nfs/dbraw/zinc/83/47/70/1040834770.db2.gz LESKUDLNHKNACP-CQSZACIVSA-N 1 1 373.434 2.754 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21 ZINC001254610638 1040838892 /nfs/dbraw/zinc/83/88/92/1040838892.db2.gz LWUUXAVMBHRENC-UAGQMJEPSA-N 1 1 359.426 2.613 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21 ZINC001254610639 1040839311 /nfs/dbraw/zinc/83/93/11/1040839311.db2.gz LWUUXAVMBHRENC-USXIJHARSA-N 1 1 359.426 2.613 20 5 FFBDMO COc1ccnc(O[C@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)c1 ZINC001254610260 1040839735 /nfs/dbraw/zinc/83/97/35/1040839735.db2.gz ISFVKYTZZQJOTJ-AEFFLSMTSA-N 1 1 355.394 2.619 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3csc([N+](=O)[O-])c3)n2C)C1 ZINC001262850201 1041900371 /nfs/dbraw/zinc/90/03/71/1041900371.db2.gz NCEKWBIGCMPRRF-LBPRGKRZSA-N 1 1 364.475 2.620 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC001310159644 1043646020 /nfs/dbraw/zinc/64/60/20/1043646020.db2.gz KDEMUQZDUWNOPK-SNVBAGLBSA-N 1 1 358.345 2.660 20 5 FFBDMO CCC1([NH2+]Cc2cc(C)sc2C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281004237 1044792075 /nfs/dbraw/zinc/79/20/75/1044792075.db2.gz KZGWVNZTZUIQQY-HZPDHXFCSA-N 1 1 365.499 2.891 20 5 FFBDMO CCC1([NH2+]Cc2sccc2Cl)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281004880 1044793555 /nfs/dbraw/zinc/79/35/55/1044793555.db2.gz YLRQSNFVZCGWLA-DGCLKSJQSA-N 1 1 371.890 2.928 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)Cc1ccc(F)cc1 ZINC001318922807 1044940774 /nfs/dbraw/zinc/94/07/74/1044940774.db2.gz CPXWHDHZXQDVPB-UHFFFAOYSA-N 1 1 360.389 2.637 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2C(=O)OCCn2ccc([N+](=O)[O-])n2)c1 ZINC001319056483 1045006467 /nfs/dbraw/zinc/00/64/67/1045006467.db2.gz ORNJZFGMQDURTK-QGZVFWFLSA-N 1 1 372.425 2.698 20 5 FFBDMO Cc1cccc(C[N@H+]2CCCC[C@@H]2C(=O)OCCn2ccc([N+](=O)[O-])n2)c1 ZINC001319056483 1045006475 /nfs/dbraw/zinc/00/64/75/1045006475.db2.gz ORNJZFGMQDURTK-QGZVFWFLSA-N 1 1 372.425 2.698 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@@H+]1Cc1cccnc1 ZINC001318410082 1045293751 /nfs/dbraw/zinc/29/37/51/1045293751.db2.gz PJBLPJVEQNEUNY-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCC[N@H+]1Cc1cccnc1 ZINC001318410082 1045293755 /nfs/dbraw/zinc/29/37/55/1045293755.db2.gz PJBLPJVEQNEUNY-IBGZPJMESA-N 1 1 368.437 2.703 20 5 FFBDMO Cc1cc(C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)s1 ZINC001282294803 1045482986 /nfs/dbraw/zinc/48/29/86/1045482986.db2.gz GYJVCMJSECDNTM-HUUCEWRRSA-N 1 1 353.488 2.604 20 5 FFBDMO O=C(NC1(C[NH2+]Cc2ccc(Cl)cc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282607202 1045954080 /nfs/dbraw/zinc/95/40/80/1045954080.db2.gz LAMLDZXYSGOITA-HZPDHXFCSA-N 1 1 365.861 2.914 20 5 FFBDMO O=C(NC1(C[NH2+]C/C=C/c2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001282606940 1045954285 /nfs/dbraw/zinc/95/42/85/1045954285.db2.gz GWEXXPWSMHAPJS-CVRCPQJVSA-N 1 1 357.454 2.774 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@@H+](CC)C1 ZINC001325142178 1046389730 /nfs/dbraw/zinc/38/97/30/1046389730.db2.gz BDWQRNPTOVYUBF-CYBMUJFWSA-N 1 1 350.419 2.847 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC001332103700 1048248236 /nfs/dbraw/zinc/24/82/36/1048248236.db2.gz GDGBKUFNTYKRSD-MAZHCROVSA-N 1 1 371.359 2.960 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC001333391574 1048877456 /nfs/dbraw/zinc/87/74/56/1048877456.db2.gz OSIRJRUNMQPUFW-AWEZNQCLSA-N 1 1 371.441 2.970 20 5 FFBDMO C[N@@H+](CCc1nccc(C(F)(F)F)n1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001333452552 1048910363 /nfs/dbraw/zinc/91/03/63/1048910363.db2.gz LEFLFABJOZXGBI-CYBMUJFWSA-N 1 1 370.331 2.612 20 5 FFBDMO Cc1c(C(=O)OCCOc2ccc([N+](=O)[O-])cc2)cnn1-c1cc[nH+]cc1 ZINC001341774652 1050390892 /nfs/dbraw/zinc/39/08/92/1050390892.db2.gz CNGNEWBMCXWKHY-UHFFFAOYSA-N 1 1 368.349 2.720 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2ncnc3ccc([N+](=O)[O-])cc32)C1 ZINC001342117725 1050712977 /nfs/dbraw/zinc/71/29/77/1050712977.db2.gz DALMTXBAJOKORW-ZDUSSCGKSA-N 1 1 352.398 2.731 20 5 FFBDMO C[N@H+]1C[C@@]2(C)CN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC001301717922 1050966138 /nfs/dbraw/zinc/96/61/38/1050966138.db2.gz PITTYBBKOFHLEF-KDURUIRLSA-N 1 1 360.458 2.587 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)COc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001302725273 1051184626 /nfs/dbraw/zinc/18/46/26/1051184626.db2.gz RWIWFICDJPBEAV-QGZVFWFLSA-N 1 1 369.421 2.673 20 5 FFBDMO COc1c(O)ccc(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC001343020564 1051636742 /nfs/dbraw/zinc/63/67/42/1051636742.db2.gz NFNKAFXBWMYBBC-LJQANCHMSA-N 1 1 356.378 2.940 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c1[N+](=O)[O-] ZINC001343020564 1051636749 /nfs/dbraw/zinc/63/67/49/1051636749.db2.gz NFNKAFXBWMYBBC-LJQANCHMSA-N 1 1 356.378 2.940 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)C)n2)C1 ZINC001306919207 1052221229 /nfs/dbraw/zinc/22/12/29/1052221229.db2.gz ZONFNBSYEDQTAF-AWEZNQCLSA-N 1 1 352.435 2.546 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@@H]1O ZINC001307710063 1052340061 /nfs/dbraw/zinc/34/00/61/1052340061.db2.gz PNWJFUFGUWMLHP-RNCFNFMXSA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@@H]1O ZINC001307710063 1052340067 /nfs/dbraw/zinc/34/00/67/1052340067.db2.gz PNWJFUFGUWMLHP-RNCFNFMXSA-N 1 1 352.778 2.501 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@H]2CCO)o1 ZINC001307824405 1052354543 /nfs/dbraw/zinc/35/45/43/1052354543.db2.gz YSFACWSPZCFXPB-NSHDSACASA-N 1 1 352.778 2.645 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccc2c(c1)OC(F)(F)O2 ZINC001307880951 1052361031 /nfs/dbraw/zinc/36/10/31/1052361031.db2.gz COVWNZGZLRWEKI-UHFFFAOYSA-N 1 1 354.313 2.553 20 5 FFBDMO C[C@H](O)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307938735 1052369326 /nfs/dbraw/zinc/36/93/26/1052369326.db2.gz KYUDEKJPRBYPOQ-JOYOIKCWSA-N 1 1 352.778 2.643 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCC[C@H]2c2ncccn2)c([N+](=O)[O-])c1 ZINC001307946504 1052370795 /nfs/dbraw/zinc/37/07/95/1052370795.db2.gz NXOCOEPPJAZHNA-HNNXBMFYSA-N 1 1 371.397 2.559 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2c2ncccn2)c([N+](=O)[O-])c1 ZINC001307946504 1052370799 /nfs/dbraw/zinc/37/07/99/1052370799.db2.gz NXOCOEPPJAZHNA-HNNXBMFYSA-N 1 1 371.397 2.559 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C2CCCC2)[C@H](C)C1 ZINC001308080245 1052401063 /nfs/dbraw/zinc/40/10/63/1052401063.db2.gz VNXYWYLCQVJJQW-OAHLLOKOSA-N 1 1 360.458 2.790 20 5 FFBDMO COc1ccc(NC(=O)N2CCC[N@H+](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001345371080 1052408877 /nfs/dbraw/zinc/40/88/77/1052408877.db2.gz OEELMQUKCJJMEH-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO C[C@]12C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001308118867 1052411650 /nfs/dbraw/zinc/41/16/50/1052411650.db2.gz LIZGWTCLPXRESY-IHETXDGRSA-N 1 1 362.451 2.513 20 5 FFBDMO C[C@]12C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@H]1[C@H]1C=C[C@@H]2C1 ZINC001308118867 1052411653 /nfs/dbraw/zinc/41/16/53/1052411653.db2.gz LIZGWTCLPXRESY-IHETXDGRSA-N 1 1 362.451 2.513 20 5 FFBDMO CN1CCN(C(C)(C)C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC001308193963 1052429879 /nfs/dbraw/zinc/42/98/79/1052429879.db2.gz AANAOEAJVSBORO-UHFFFAOYSA-N 1 1 372.469 2.970 20 5 FFBDMO CC(C)C[C@@H](C)C[NH+]1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC001308653489 1052482421 /nfs/dbraw/zinc/48/24/21/1052482421.db2.gz CYOYQTDRLHVULG-OAHLLOKOSA-N 1 1 369.487 2.583 20 5 FFBDMO Cc1cc(S(=O)(=O)NCC[N@H+]2CCCC(C)(C)C2)c(C)cc1[N+](=O)[O-] ZINC001309444210 1052619698 /nfs/dbraw/zinc/61/96/98/1052619698.db2.gz CANJJQNUHNJPOD-UHFFFAOYSA-N 1 1 369.487 2.612 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)[C@H]2C1 ZINC001348312208 1054624997 /nfs/dbraw/zinc/62/49/97/1054624997.db2.gz VBRUWTNTGMZREC-RRQGHBQHSA-N 1 1 358.442 2.609 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC001338384693 1055466946 /nfs/dbraw/zinc/46/69/46/1055466946.db2.gz VCYCCWHAJJOTME-ZDUSSCGKSA-N 1 1 359.348 2.649 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](Cc2ccccc2)C[C@@H](C)C1 ZINC001356351819 1055467949 /nfs/dbraw/zinc/46/79/49/1055467949.db2.gz NFAVJXSMPDLNMD-HZPDHXFCSA-N 1 1 372.473 2.594 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCN(c2ncnc3c(Cl)cc([N+](=O)[O-])cc32)C1 ZINC001350473203 1055792291 /nfs/dbraw/zinc/79/22/91/1055792291.db2.gz AOKWWRNMDRMJCE-SNVBAGLBSA-N 1 1 358.789 2.919 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC001357702161 1055987786 /nfs/dbraw/zinc/98/77/86/1055987786.db2.gz RQHKDABPVJOJEV-QGZVFWFLSA-N 1 1 367.405 2.985 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC001351066286 1056066740 /nfs/dbraw/zinc/06/67/40/1056066740.db2.gz XWGZKNCMLDZVIG-YWXMQNBFSA-N 1 1 355.232 2.950 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC001351066286 1056066751 /nfs/dbraw/zinc/06/67/51/1056066751.db2.gz XWGZKNCMLDZVIG-YWXMQNBFSA-N 1 1 355.232 2.950 20 5 FFBDMO COc1ccc([C@@H]2CN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001339114084 1056106154 /nfs/dbraw/zinc/10/61/54/1056106154.db2.gz BUMNBIJEOIWRAJ-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C ZINC001339263508 1056268173 /nfs/dbraw/zinc/26/81/73/1056268173.db2.gz GTUHXCGXRPJCAE-CQSZACIVSA-N 1 1 367.471 2.547 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3csc([N+](=O)[O-])c3)n2C)[C@H](C)C1 ZINC001339521493 1056545047 /nfs/dbraw/zinc/54/50/47/1056545047.db2.gz LTBFBADJWVICDT-DGCLKSJQSA-N 1 1 364.475 2.618 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCCCC1 ZINC001544705070 1071680307 /nfs/dbraw/zinc/68/03/07/1071680307.db2.gz XDWUFMDGQSWYDV-QGZVFWFLSA-N 1 1 361.442 2.887 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC001544800353 1071694160 /nfs/dbraw/zinc/69/41/60/1071694160.db2.gz KTEXCKRFKHCWIP-ZDUSSCGKSA-N 1 1 366.437 2.746 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])cc(C)n3)C2)c1 ZINC001454307822 1059494708 /nfs/dbraw/zinc/49/47/08/1059494708.db2.gz CZWVEAGFQDIWFI-MRXNPFEDSA-N 1 1 354.410 2.611 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000848350290 1059836606 /nfs/dbraw/zinc/83/66/06/1059836606.db2.gz PKPHJIKXXXAMEX-PKOBYXMFSA-N 1 1 372.469 2.942 20 5 FFBDMO CC[N@H+]1CCC[C@H]1Cn1c(C)nnc1N(C)CCc1cccc([N+](=O)[O-])c1 ZINC001515855118 1059847416 /nfs/dbraw/zinc/84/74/16/1059847416.db2.gz SSPHJOQXHHVFLF-SFHVURJKSA-N 1 1 372.473 2.658 20 5 FFBDMO CNc1c(C(=O)N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)cccc1[N+](=O)[O-] ZINC001455864741 1059940852 /nfs/dbraw/zinc/94/08/52/1059940852.db2.gz HZYFFJJIWQCLRL-UHFFFAOYSA-N 1 1 357.414 2.996 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000848485530 1060131594 /nfs/dbraw/zinc/13/15/94/1060131594.db2.gz PHVVTIJODGEMOD-OALUTQOASA-N 1 1 373.453 2.759 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C12CCC2 ZINC000848489262 1060141605 /nfs/dbraw/zinc/14/16/05/1060141605.db2.gz RQIRPALYOGGQPJ-RCCFBDPRSA-N 1 1 373.453 2.758 20 5 FFBDMO CO[C@@H]1C[C@H]([N@@H+](C)CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C12CCC2 ZINC000848489259 1060141771 /nfs/dbraw/zinc/14/17/71/1060141771.db2.gz RQIRPALYOGGQPJ-FGTMMUONSA-N 1 1 373.453 2.758 20 5 FFBDMO CC(C)O[C@H]1CCC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489555 1060148342 /nfs/dbraw/zinc/14/83/42/1060148342.db2.gz NXFQMCCLLUIAKN-ROUUACIJSA-N 1 1 361.442 2.758 20 5 FFBDMO CC(C)O[C@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848489555 1060148353 /nfs/dbraw/zinc/14/83/53/1060148353.db2.gz NXFQMCCLLUIAKN-ROUUACIJSA-N 1 1 361.442 2.758 20 5 FFBDMO CSc1ccc(C(=O)OC[C@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001517120651 1060354232 /nfs/dbraw/zinc/35/42/32/1060354232.db2.gz CARUZYRFCFZMDE-CQSZACIVSA-N 1 1 366.439 2.727 20 5 FFBDMO Cc1cc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)cc(C)[nH+]1 ZINC001458570991 1060625907 /nfs/dbraw/zinc/62/59/07/1060625907.db2.gz MORRMNQVCXXXFG-UHFFFAOYSA-N 1 1 355.329 2.606 20 5 FFBDMO C[C@@H]1[C@@H](Nc2c3ccc(Br)cc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001458615572 1060634492 /nfs/dbraw/zinc/63/44/92/1060634492.db2.gz RWBAJUOLWPVNOH-SKDRFNHKSA-N 1 1 365.231 2.832 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cccc2c1OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC001460622872 1061037355 /nfs/dbraw/zinc/03/73/55/1061037355.db2.gz YJKKNGWFVQJOCN-MRXNPFEDSA-N 1 1 366.320 2.914 20 5 FFBDMO CC(C)(C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC001526620116 1061184245 /nfs/dbraw/zinc/18/42/45/1061184245.db2.gz GMTICYXATBKRMF-HNNXBMFYSA-N 1 1 362.426 2.669 20 5 FFBDMO C[C@](O)(C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])C(F)(F)F ZINC001461364987 1061302437 /nfs/dbraw/zinc/30/24/37/1061302437.db2.gz PUYCYZOGMDSVLJ-JTQLQIEISA-N 1 1 357.126 2.760 20 5 FFBDMO COc1c(O)ccc(CN2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001462220885 1061542341 /nfs/dbraw/zinc/54/23/41/1061542341.db2.gz ZVWFRIITXOAAEG-QGZVFWFLSA-N 1 1 371.437 2.668 20 5 FFBDMO COCCC[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001477223323 1061632529 /nfs/dbraw/zinc/63/25/29/1061632529.db2.gz WCZCQADVEIAQGM-UHFFFAOYSA-N 1 1 360.414 2.838 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1NC(=O)OC(C)(C)C ZINC000769901098 1061911412 /nfs/dbraw/zinc/91/14/12/1061911412.db2.gz RYDKZCYMCGOUMB-ZIAGYGMSSA-N 1 1 365.430 2.819 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC001478577881 1062054437 /nfs/dbraw/zinc/05/44/37/1062054437.db2.gz NYMPVHIHWSBBAX-UHFFFAOYSA-N 1 1 374.363 2.849 20 5 FFBDMO Cc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@H]1CC[N@H+](C2CC2)C1 ZINC001492781985 1062205979 /nfs/dbraw/zinc/20/59/79/1062205979.db2.gz SUFLVHPTPFYAKR-HNNXBMFYSA-N 1 1 370.457 2.615 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])c1cnn(-c2cc[nH+]cc2)c1 ZINC001435699597 1062543611 /nfs/dbraw/zinc/54/36/11/1062543611.db2.gz NOSPHEOVTPAEDT-UHFFFAOYSA-N 1 1 371.784 2.801 20 5 FFBDMO CCc1ccccc1C[NH2+]CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001495413584 1063492433 /nfs/dbraw/zinc/49/24/33/1063492433.db2.gz QOMRIJKFQAFRKV-RTBURBONSA-N 1 1 359.470 2.633 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001470054102 1064250209 /nfs/dbraw/zinc/25/02/09/1064250209.db2.gz WBUTXXVPGURFEM-LLVKDONJSA-N 1 1 374.363 2.897 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777722 1064448693 /nfs/dbraw/zinc/44/86/93/1064448693.db2.gz MANFZIOZHUQHMR-KUHUBIRLSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777722 1064448699 /nfs/dbraw/zinc/44/86/99/1064448699.db2.gz MANFZIOZHUQHMR-KUHUBIRLSA-N 1 1 369.421 2.941 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1cccc(Br)c1 ZINC001473118660 1065202480 /nfs/dbraw/zinc/20/24/80/1065202480.db2.gz PDWUZUCBVZTQRD-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-] ZINC001575969472 1078182627 /nfs/dbraw/zinc/18/26/27/1078182627.db2.gz KGCOSJRIBJAGFI-MXWKQRLJSA-N 1 1 365.463 2.615 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@H]2COC[C@H]2OC)cc1OC ZINC001473535433 1065281241 /nfs/dbraw/zinc/28/12/41/1065281241.db2.gz LNDCYSDTRLFXAP-XAYKYTGQSA-N 1 1 368.430 2.532 20 5 FFBDMO COC(=O)CC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001473767809 1065352299 /nfs/dbraw/zinc/35/22/99/1065352299.db2.gz NDQYNFRSGCODTP-KBPBESRZSA-N 1 1 363.414 2.587 20 5 FFBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC001473884957 1065405842 /nfs/dbraw/zinc/40/58/42/1065405842.db2.gz DLAPARMDZANZQX-UHFFFAOYSA-N 1 1 367.450 2.513 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC001474833839 1065620239 /nfs/dbraw/zinc/62/02/39/1065620239.db2.gz BNEJYJWYZVYDDX-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC001474833840 1065620449 /nfs/dbraw/zinc/62/04/49/1065620449.db2.gz BNEJYJWYZVYDDX-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1nc(NC(=O)[C@@H]([NH3+])c2ccccc2C(F)(F)F)ccc1[N+](=O)[O-] ZINC001579864260 1078701293 /nfs/dbraw/zinc/70/12/93/1078701293.db2.gz OFWZPSPXPXLLNX-ZDUSSCGKSA-N 1 1 354.288 2.956 20 5 FFBDMO O=C(Nc1cc2n(n1)CC[NH2+]C2)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001580761104 1078855624 /nfs/dbraw/zinc/85/56/24/1078855624.db2.gz IKRDXUMJFQYCGF-UHFFFAOYSA-N 1 1 352.354 2.692 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)NC[C@H]2CC[N@@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938749 1079406624 /nfs/dbraw/zinc/40/66/24/1079406624.db2.gz NWNLDZDCWCZDDH-DZGCQCFKSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@H](Nc1ccc(C(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938749 1079406628 /nfs/dbraw/zinc/40/66/28/1079406628.db2.gz NWNLDZDCWCZDDH-DZGCQCFKSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)NC[C@H]2CC[N@@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938751 1079406706 /nfs/dbraw/zinc/40/67/06/1079406706.db2.gz NWNLDZDCWCZDDH-UKRRQHHQSA-N 1 1 369.425 2.597 20 5 FFBDMO C[C@@H](Nc1ccc(C(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-])c1ccccn1 ZINC001584938751 1079406710 /nfs/dbraw/zinc/40/67/10/1079406710.db2.gz NWNLDZDCWCZDDH-UKRRQHHQSA-N 1 1 369.425 2.597 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC001557759609 1075885303 /nfs/dbraw/zinc/88/53/03/1075885303.db2.gz ASWCSHVGHXQJOF-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(NCCCCn3cc[nH+]c3C)c2c1 ZINC001559113961 1076126659 /nfs/dbraw/zinc/12/66/59/1076126659.db2.gz CPOGQAHVDVUYBM-UHFFFAOYSA-N 1 1 355.398 2.971 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC001560038211 1076215944 /nfs/dbraw/zinc/21/59/44/1076215944.db2.gz ITOZNVTZTSSVAX-QGZVFWFLSA-N 1 1 371.441 2.916 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1[N+](=O)[O-] ZINC001560865202 1076304662 /nfs/dbraw/zinc/30/46/62/1076304662.db2.gz SXVYKOYBZOHRPD-INIZCTEOSA-N 1 1 369.421 2.946 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001562575173 1076504781 /nfs/dbraw/zinc/50/47/81/1076504781.db2.gz FKEKIGSOTWLLGF-NSHDSACASA-N 1 1 371.235 2.963 20 5 FFBDMO CCOCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC001563395392 1076550378 /nfs/dbraw/zinc/55/03/78/1076550378.db2.gz AYZCMTSBGUTWOV-UHFFFAOYSA-N 1 1 372.425 2.934 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1 ZINC001566587354 1076969221 /nfs/dbraw/zinc/96/92/21/1076969221.db2.gz BXZKITJFBKLDPI-IAGOWNOFSA-N 1 1 365.861 2.784 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001566587354 1076969226 /nfs/dbraw/zinc/96/92/26/1076969226.db2.gz BXZKITJFBKLDPI-IAGOWNOFSA-N 1 1 365.861 2.784 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1 ZINC001566587354 1076969230 /nfs/dbraw/zinc/96/92/30/1076969230.db2.gz BXZKITJFBKLDPI-IAGOWNOFSA-N 1 1 365.861 2.784 20 5 FFBDMO O=C(c1ccnc(-c2ccccc2)c1[N+](=O)[O-])N1CC[NH+](C2CCC2)CC1 ZINC001585972801 1079520000 /nfs/dbraw/zinc/52/00/00/1079520000.db2.gz DOWBKSXLVXWFAH-UHFFFAOYSA-N 1 1 366.421 2.967 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1ccc([N+](=O)[O-])cc1N ZINC001586938698 1079708777 /nfs/dbraw/zinc/70/87/77/1079708777.db2.gz RDIUSPJTJBEUQT-INIZCTEOSA-N 1 1 368.437 2.771 20 5 FFBDMO C[C@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001590043548 1080969672 /nfs/dbraw/zinc/96/96/72/1080969672.db2.gz OTQAGNNWJNGXFB-SJKOYZFVSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-] ZINC001590164678 1081064004 /nfs/dbraw/zinc/06/40/04/1081064004.db2.gz GSTNLWMTUYNFGI-KCJUWKMLSA-N 1 1 356.308 2.548 20 5 FFBDMO CC(C)[N@H+](C)CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000444172767 514144508 /nfs/dbraw/zinc/14/45/08/514144508.db2.gz RWTKCLKLCDBMHJ-UHFFFAOYSA-N 1 1 370.258 2.520 20 5 FFBDMO CC(C)[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000444172767 514144512 /nfs/dbraw/zinc/14/45/12/514144512.db2.gz RWTKCLKLCDBMHJ-UHFFFAOYSA-N 1 1 370.258 2.520 20 5 FFBDMO C[C@H](CCO)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000093304653 250028105 /nfs/dbraw/zinc/02/81/05/250028105.db2.gz LNPISXWPWLVIBQ-OAHLLOKOSA-N 1 1 357.410 2.806 20 5 FFBDMO C[C@H](CCO)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000093304653 250028107 /nfs/dbraw/zinc/02/81/07/250028107.db2.gz LNPISXWPWLVIBQ-OAHLLOKOSA-N 1 1 357.410 2.806 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000173521258 251198349 /nfs/dbraw/zinc/19/83/49/251198349.db2.gz XQQALWDAKZBORE-IBGZPJMESA-N 1 1 367.449 2.818 20 5 FFBDMO O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)NCc1ccccc1[N+](=O)[O-] ZINC000175502142 251218310 /nfs/dbraw/zinc/21/83/10/251218310.db2.gz NXJGINHBWDIWOO-GOSISDBHSA-N 1 1 369.421 2.502 20 5 FFBDMO O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)NCc1ccccc1[N+](=O)[O-] ZINC000175502142 251218314 /nfs/dbraw/zinc/21/83/14/251218314.db2.gz NXJGINHBWDIWOO-GOSISDBHSA-N 1 1 369.421 2.502 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNCc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C1 ZINC000272441808 252039853 /nfs/dbraw/zinc/03/98/53/252039853.db2.gz OPTUVVRBJAMCQN-LBPRGKRZSA-N 1 1 373.400 2.679 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000272465991 252046569 /nfs/dbraw/zinc/04/65/69/252046569.db2.gz HPGXGZIUZJQBKJ-WFASDCNBSA-N 1 1 368.865 2.915 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000272934442 252168878 /nfs/dbraw/zinc/16/88/78/252168878.db2.gz LVQKKTJXKMYVFS-LBPRGKRZSA-N 1 1 352.387 2.858 20 5 FFBDMO C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)nc1 ZINC000273419817 252302833 /nfs/dbraw/zinc/30/28/33/252302833.db2.gz JCQLVXRCJJEQHF-NSHDSACASA-N 1 1 369.830 2.768 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000274160939 255841395 /nfs/dbraw/zinc/84/13/95/255841395.db2.gz AKIIVISDTOGSGF-RYQLBKOJSA-N 1 1 356.426 2.965 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000275484504 256014564 /nfs/dbraw/zinc/01/45/64/256014564.db2.gz ORLPVTQEKRJNFG-AWEZNQCLSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000275484504 256014567 /nfs/dbraw/zinc/01/45/67/256014567.db2.gz ORLPVTQEKRJNFG-AWEZNQCLSA-N 1 1 360.357 2.798 20 5 FFBDMO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)c1ccccc1 ZINC000276039570 256067963 /nfs/dbraw/zinc/06/79/63/256067963.db2.gz GFTKYVJLNRRTOG-INIZCTEOSA-N 1 1 363.439 2.713 20 5 FFBDMO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354374 256092501 /nfs/dbraw/zinc/09/25/01/256092501.db2.gz UXUBZKUKVUXJBM-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000276354374 256092502 /nfs/dbraw/zinc/09/25/02/256092502.db2.gz UXUBZKUKVUXJBM-QWHCGFSZSA-N 1 1 355.460 2.531 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)ccc1[N+](=O)[O-] ZINC000276894231 256139922 /nfs/dbraw/zinc/13/99/22/256139922.db2.gz KSKIMKVPWLCIDE-HNNXBMFYSA-N 1 1 350.415 2.969 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000278430112 256311905 /nfs/dbraw/zinc/31/19/05/256311905.db2.gz CYGFRFPWNGESIH-CZUORRHYSA-N 1 1 371.441 2.521 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000278591545 256328788 /nfs/dbraw/zinc/32/87/88/256328788.db2.gz ANSVCNKFULOMCQ-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000278591545 256328789 /nfs/dbraw/zinc/32/87/89/256328789.db2.gz ANSVCNKFULOMCQ-UHFFFAOYSA-N 1 1 364.446 2.786 20 5 FFBDMO C[C@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000279134979 256385575 /nfs/dbraw/zinc/38/55/75/256385575.db2.gz RHIIAZJICQPVQU-DNVCBOLYSA-N 1 1 360.502 2.790 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000278903133 256360354 /nfs/dbraw/zinc/36/03/54/256360354.db2.gz RVDRCUYQLFNNNO-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000281545016 256641231 /nfs/dbraw/zinc/64/12/31/256641231.db2.gz KPCZCDPNETZCJU-UHFFFAOYSA-N 1 1 360.414 2.726 20 5 FFBDMO CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](Cc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)[C@H]1[C@H]3C2 ZINC000286348318 257032421 /nfs/dbraw/zinc/03/24/21/257032421.db2.gz FJUJMJBFHZJIAG-UOYADTOYSA-N 1 1 356.382 2.500 20 5 FFBDMO CC(C)NC(=O)c1ccc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1 ZINC000286471668 257038852 /nfs/dbraw/zinc/03/88/52/257038852.db2.gz UGSQDVVKFLWGIV-XYPWUTKMSA-N 1 1 360.458 2.794 20 5 FFBDMO COCCN(C)c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000289325474 257274435 /nfs/dbraw/zinc/27/44/35/257274435.db2.gz GEKAEKHPINZIQA-UHFFFAOYSA-N 1 1 358.442 2.747 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@H]3C[N@H+]4CCC[C@H]4CO3)no2)c1 ZINC000289969636 257309247 /nfs/dbraw/zinc/30/92/47/257309247.db2.gz ZZAMAFLBWWOUBQ-XHDPSFHLSA-N 1 1 360.370 2.579 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccc(O)cc1 ZINC000296186324 257680554 /nfs/dbraw/zinc/68/05/54/257680554.db2.gz YCWPQXAHLSSKTQ-ZWKOTPCHSA-N 1 1 356.378 2.689 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000297711927 257854145 /nfs/dbraw/zinc/85/41/45/257854145.db2.gz NCQZDGJOIKIUTH-FZMZJTMJSA-N 1 1 353.394 2.545 20 5 FFBDMO Cc1ccc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000299195017 257972651 /nfs/dbraw/zinc/97/26/51/257972651.db2.gz MLHMHMCTCVKFCJ-YQQAZPJKSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@@H]1C[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000299641450 258012996 /nfs/dbraw/zinc/01/29/96/258012996.db2.gz NEDGJYLFARRQTI-YQQAZPJKSA-N 1 1 361.442 2.617 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2c(C)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000302679180 258107813 /nfs/dbraw/zinc/10/78/13/258107813.db2.gz OFDXPERMDOOSKR-UHFFFAOYSA-N 1 1 368.865 2.959 20 5 FFBDMO C[C@H]1CN(c2ccc(Br)cc2[N+](=O)[O-])C[C@@H]1[NH+]1CCOCC1 ZINC000301566536 258056293 /nfs/dbraw/zinc/05/62/93/258056293.db2.gz KRDCMEHMLNQANL-NHYWBVRUSA-N 1 1 370.247 2.514 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000301873849 258072185 /nfs/dbraw/zinc/07/21/85/258072185.db2.gz HZAVMJPFMIGKIX-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000301873849 258072186 /nfs/dbraw/zinc/07/21/86/258072186.db2.gz HZAVMJPFMIGKIX-OLZOCXBDSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000301884066 258072457 /nfs/dbraw/zinc/07/24/57/258072457.db2.gz LJRFXFMTTPJLRQ-HZSPNIEDSA-N 1 1 369.487 2.777 20 5 FFBDMO CC[C@H]1C[C@@H](C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCO1 ZINC000330785477 258170553 /nfs/dbraw/zinc/17/05/53/258170553.db2.gz UDSSDBAHKOGNFC-KBPBESRZSA-N 1 1 367.471 2.619 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000332525092 258233526 /nfs/dbraw/zinc/23/35/26/258233526.db2.gz ROIPDVWFJFFMAN-LBPRGKRZSA-N 1 1 355.341 2.507 20 5 FFBDMO O=C(c1ccc(OC(F)F)c([N+](=O)[O-])c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000332525092 258233527 /nfs/dbraw/zinc/23/35/27/258233527.db2.gz ROIPDVWFJFFMAN-LBPRGKRZSA-N 1 1 355.341 2.507 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[N@@H+](C)CC2)CC1 ZINC000097617734 132229939 /nfs/dbraw/zinc/22/99/39/132229939.db2.gz HBOFKQOIRXWCPO-UHFFFAOYSA-N 1 1 360.458 2.609 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000375104757 512164793 /nfs/dbraw/zinc/16/47/93/512164793.db2.gz HYDIVPQZVTZASM-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000369066012 512211048 /nfs/dbraw/zinc/21/10/48/512211048.db2.gz QJPSHVUMMTTWJB-UHFFFAOYSA-N 1 1 367.365 2.810 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC000366850903 512217540 /nfs/dbraw/zinc/21/75/40/512217540.db2.gz LJCIYOQQPVLYKB-IRXDYDNUSA-N 1 1 358.373 2.613 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC000366850903 512217542 /nfs/dbraw/zinc/21/75/42/512217542.db2.gz LJCIYOQQPVLYKB-IRXDYDNUSA-N 1 1 358.373 2.613 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000053550759 506401871 /nfs/dbraw/zinc/40/18/71/506401871.db2.gz RSVIBEFCSXLUEG-INIZCTEOSA-N 1 1 354.410 2.641 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000066042194 506414225 /nfs/dbraw/zinc/41/42/25/506414225.db2.gz OIRXGTDNVFQBPR-HNNXBMFYSA-N 1 1 358.442 2.930 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000054645410 506594736 /nfs/dbraw/zinc/59/47/36/506594736.db2.gz VPZYSMFTHDJLMS-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000054645410 506594746 /nfs/dbraw/zinc/59/47/46/506594746.db2.gz VPZYSMFTHDJLMS-LJQANCHMSA-N 1 1 368.437 2.836 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NCC[N@@H+](C)C3CC3)cc2[N+](=O)[O-])C1 ZINC000066924708 506696897 /nfs/dbraw/zinc/69/68/97/506696897.db2.gz MKINPQJPYYENHN-CQSZACIVSA-N 1 1 360.458 2.655 20 5 FFBDMO C[N@@H+](CCCNC(=O)COc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000009981723 506720275 /nfs/dbraw/zinc/72/02/75/506720275.db2.gz JVRAWUOTHQTAPC-UHFFFAOYSA-N 1 1 357.410 2.612 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1 ZINC000067542800 506918418 /nfs/dbraw/zinc/91/84/18/506918418.db2.gz LDKJDYKQCROFBB-UHFFFAOYSA-N 1 1 369.421 2.952 20 5 FFBDMO COc1ccc(CC(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000067907112 507048296 /nfs/dbraw/zinc/04/82/96/507048296.db2.gz UEFMTKSYHDXCSH-OAHLLOKOSA-N 1 1 363.458 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCCCC2)c([N+](=O)[O-])c1 ZINC000022344149 507289165 /nfs/dbraw/zinc/28/91/65/507289165.db2.gz FLWCHPHDUVPIKU-UHFFFAOYSA-N 1 1 364.402 2.950 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)COc2cccc([N+](=O)[O-])c2)cn1 ZINC000047275961 507300375 /nfs/dbraw/zinc/30/03/75/507300375.db2.gz MSQMZURKDJHAGD-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000068775367 507319137 /nfs/dbraw/zinc/31/91/37/507319137.db2.gz IIWSZYJTVFQSTI-CYBMUJFWSA-N 1 1 369.849 2.958 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000069006790 507378879 /nfs/dbraw/zinc/37/88/79/507378879.db2.gz CPJFMVVEMDSRLV-CQSZACIVSA-N 1 1 367.421 2.884 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000026321641 507577368 /nfs/dbraw/zinc/57/73/68/507577368.db2.gz OKYXSPWIYCTNAS-UHFFFAOYSA-N 1 1 371.393 2.842 20 5 FFBDMO CCOc1ccc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1 ZINC000026711954 507603822 /nfs/dbraw/zinc/60/38/22/507603822.db2.gz PDIYWEINBCXESH-QGZVFWFLSA-N 1 1 360.410 2.865 20 5 FFBDMO CC(=O)c1ccc(NC2CC[NH+](C3CCN(C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000050954594 507720537 /nfs/dbraw/zinc/72/05/37/507720537.db2.gz DNOAGMFYFDTLAO-UHFFFAOYSA-N 1 1 360.458 2.768 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000051475362 507772701 /nfs/dbraw/zinc/77/27/01/507772701.db2.gz CEXQUIFAIOHSLG-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCc2ccccc2C1 ZINC000106887307 507826227 /nfs/dbraw/zinc/82/62/27/507826227.db2.gz UKIVIZSTHHGYEG-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCc2ccccc2C1 ZINC000106887307 507826228 /nfs/dbraw/zinc/82/62/28/507826228.db2.gz UKIVIZSTHHGYEG-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO COc1ccccc1OCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665142 507840284 /nfs/dbraw/zinc/84/02/84/507840284.db2.gz MWIJTBIKICGVKO-AWEZNQCLSA-N 1 1 358.398 2.564 20 5 FFBDMO COc1cc(NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000089644756 507853206 /nfs/dbraw/zinc/85/32/06/507853206.db2.gz XBUAPUCIIBYBSQ-IRXDYDNUSA-N 1 1 357.410 2.651 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2C[C@@H](O)C[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000089644368 507853478 /nfs/dbraw/zinc/85/34/78/507853478.db2.gz MOLBNUYVIDEWEC-UKRRQHHQSA-N 1 1 362.817 2.691 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1C[C@](C)(OC)C1(C)C ZINC000072897866 507870464 /nfs/dbraw/zinc/87/04/64/507870464.db2.gz QEWWTXXQSOTRQH-QAPCUYQASA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1C[C@](C)(OC)C1(C)C ZINC000072897866 507870465 /nfs/dbraw/zinc/87/04/65/507870465.db2.gz QEWWTXXQSOTRQH-QAPCUYQASA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1C[C@@](C)(OC)C1(C)C ZINC000072897864 507870514 /nfs/dbraw/zinc/87/05/14/507870514.db2.gz QEWWTXXQSOTRQH-CRAIPNDOSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1C[C@@](C)(OC)C1(C)C ZINC000072897864 507870516 /nfs/dbraw/zinc/87/05/16/507870516.db2.gz QEWWTXXQSOTRQH-CRAIPNDOSA-N 1 1 365.430 2.677 20 5 FFBDMO CCSCC[C@H](C)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000072901855 507871804 /nfs/dbraw/zinc/87/18/04/507871804.db2.gz QIKSCFUOELHEOW-ZDUSSCGKSA-N 1 1 351.472 2.947 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072976366 507879423 /nfs/dbraw/zinc/87/94/23/507879423.db2.gz WPRFEYRYOMUZKU-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079803757 508002553 /nfs/dbraw/zinc/00/25/53/508002553.db2.gz LCFQDPHQPKFPIJ-SNVBAGLBSA-N 1 1 358.236 2.817 20 5 FFBDMO Cn1cnnc1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000091795857 508013578 /nfs/dbraw/zinc/01/35/78/508013578.db2.gz MRYCYEHALXUFCW-UHFFFAOYSA-N 1 1 367.356 2.704 20 5 FFBDMO O=[N+]([O-])c1cccc(CCNc2ncnc3c2cnn3-c2cc[nH+]cc2)c1 ZINC000092900118 508107811 /nfs/dbraw/zinc/10/78/11/508107811.db2.gz QAIYCECMMFJAAJ-UHFFFAOYSA-N 1 1 361.365 2.773 20 5 FFBDMO CCc1ccc([C@H]2CCCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000075765728 508133112 /nfs/dbraw/zinc/13/31/12/508133112.db2.gz LPWLQSAWIQDKDK-DOTOQJQBSA-N 1 1 362.430 2.925 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000081363826 508167597 /nfs/dbraw/zinc/16/75/97/508167597.db2.gz HYGJSYYWZOXSST-CYBMUJFWSA-N 1 1 353.850 2.981 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000076495658 508214241 /nfs/dbraw/zinc/21/42/41/508214241.db2.gz UQNGBZNOKMESGZ-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000076495658 508214243 /nfs/dbraw/zinc/21/42/43/508214243.db2.gz UQNGBZNOKMESGZ-MRXNPFEDSA-N 1 1 369.421 2.707 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000112978957 508236901 /nfs/dbraw/zinc/23/69/01/508236901.db2.gz ANFQVJZRNRGSLY-LJQANCHMSA-N 1 1 372.421 2.952 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000083248146 508242793 /nfs/dbraw/zinc/24/27/93/508242793.db2.gz IUUFJOUMLRXQQQ-QGZVFWFLSA-N 1 1 361.442 2.621 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000083248146 508242796 /nfs/dbraw/zinc/24/27/96/508242796.db2.gz IUUFJOUMLRXQQQ-QGZVFWFLSA-N 1 1 361.442 2.621 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114644909 508333495 /nfs/dbraw/zinc/33/34/95/508333495.db2.gz FGDKRWFKPCRJFG-QGZVFWFLSA-N 1 1 369.421 2.754 20 5 FFBDMO CCOC(=O)c1ccnc(NCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000133493772 508407038 /nfs/dbraw/zinc/40/70/38/508407038.db2.gz ULBHXRKILJFXEN-UHFFFAOYSA-N 1 1 350.419 2.843 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000115636832 508419248 /nfs/dbraw/zinc/41/92/48/508419248.db2.gz ZIDCWFXNYULGDZ-UHFFFAOYSA-N 1 1 370.837 2.559 20 5 FFBDMO O=C([C@H]1CCC[N@@H+](Cc2cccnc2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000116391751 508506395 /nfs/dbraw/zinc/50/63/95/508506395.db2.gz AKBUVSVXUNSICU-KRWDZBQOSA-N 1 1 366.421 2.791 20 5 FFBDMO CCC(=O)N1CC[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000134513195 508541575 /nfs/dbraw/zinc/54/15/75/508541575.db2.gz MEQTXKLBPKMGMN-ZDUSSCGKSA-N 1 1 360.439 2.819 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC[NH+]1CCOCC1 ZINC000157340681 508554586 /nfs/dbraw/zinc/55/45/86/508554586.db2.gz YJJODJPGXABMLN-CYBMUJFWSA-N 1 1 367.471 2.547 20 5 FFBDMO Cc1sc(S(=O)(=O)NC[C@@H](c2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000122737813 508580580 /nfs/dbraw/zinc/58/05/80/508580580.db2.gz BCIBWJRPUATWCI-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000128386802 508585414 /nfs/dbraw/zinc/58/54/14/508585414.db2.gz HHVHGTCDEPNXNS-QGZVFWFLSA-N 1 1 363.458 2.730 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000128386802 508585419 /nfs/dbraw/zinc/58/54/19/508585419.db2.gz HHVHGTCDEPNXNS-QGZVFWFLSA-N 1 1 363.458 2.730 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000117341318 508593686 /nfs/dbraw/zinc/59/36/86/508593686.db2.gz LOERFPSHDCWJEX-GOEBONIOSA-N 1 1 363.414 2.518 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C2CCOCC2)CC1 ZINC000153616728 508609200 /nfs/dbraw/zinc/60/92/00/508609200.db2.gz QUYWZYVPNLHOOD-UHFFFAOYSA-N 1 1 361.442 2.980 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000123422357 508683862 /nfs/dbraw/zinc/68/38/62/508683862.db2.gz MYSUNKDAEPTKJL-KBPBESRZSA-N 1 1 356.426 2.993 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002653 508696284 /nfs/dbraw/zinc/69/62/84/508696284.db2.gz MCSVMBMEFQLVLZ-MSOLQXFVSA-N 1 1 373.453 2.763 20 5 FFBDMO CCO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000154002653 508696286 /nfs/dbraw/zinc/69/62/86/508696286.db2.gz MCSVMBMEFQLVLZ-MSOLQXFVSA-N 1 1 373.453 2.763 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000118984669 508700883 /nfs/dbraw/zinc/70/08/83/508700883.db2.gz DGRNOBVFWSZPSM-CQSZACIVSA-N 1 1 360.357 2.940 20 5 FFBDMO CCCN(C(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000136798605 508717405 /nfs/dbraw/zinc/71/74/05/508717405.db2.gz MKKKNDFPEXODII-MRXNPFEDSA-N 1 1 371.441 2.835 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCc2ccccc2C1 ZINC000154254108 508746367 /nfs/dbraw/zinc/74/63/67/508746367.db2.gz LWDGOWXJDZAJPE-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000137432703 508756133 /nfs/dbraw/zinc/75/61/33/508756133.db2.gz YEOILEHXMYXTIN-WBVHZDCISA-N 1 1 368.437 2.786 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000123977414 508766216 /nfs/dbraw/zinc/76/62/16/508766216.db2.gz GICDPHFVCUAYNX-GHMZBOCLSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000123977640 508766302 /nfs/dbraw/zinc/76/63/02/508766302.db2.gz GICDPHFVCUAYNX-WDEREUQCSA-N 1 1 370.247 2.912 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129818894 508769604 /nfs/dbraw/zinc/76/96/04/508769604.db2.gz KIQGLILGSILGQY-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)C(=O)OC(C)C ZINC000129818894 508769608 /nfs/dbraw/zinc/76/96/08/508769608.db2.gz KIQGLILGSILGQY-CYBMUJFWSA-N 1 1 351.403 2.504 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)c1 ZINC000159114190 508794645 /nfs/dbraw/zinc/79/46/45/508794645.db2.gz OWZLPPXFLVIDPU-QUCCMNQESA-N 1 1 369.469 2.778 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](C)O)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000130830614 508852614 /nfs/dbraw/zinc/85/26/14/508852614.db2.gz CZAUKWQUJQIOFO-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000124593583 508855855 /nfs/dbraw/zinc/85/58/55/508855855.db2.gz BBINJBCAYJXJKZ-UHFFFAOYSA-N 1 1 369.347 2.632 20 5 FFBDMO CCC([NH3+])(CC)CNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000124759050 508879945 /nfs/dbraw/zinc/87/99/45/508879945.db2.gz WAZPIEZLXUYYBN-UHFFFAOYSA-N 1 1 370.258 2.697 20 5 FFBDMO Cc1ccc([C@H]2CSCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159831117 508897972 /nfs/dbraw/zinc/89/79/72/508897972.db2.gz JSBPYIVAPSJATJ-QGZVFWFLSA-N 1 1 359.451 2.855 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000119970919 508900449 /nfs/dbraw/zinc/90/04/49/508900449.db2.gz LAKNBZFUOFWMNE-KXBFYZLASA-N 1 1 353.422 2.774 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000120257079 508959817 /nfs/dbraw/zinc/95/98/17/508959817.db2.gz AIOASBYMSMLWDM-HNNXBMFYSA-N 1 1 369.487 2.550 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000155284875 508966335 /nfs/dbraw/zinc/96/63/35/508966335.db2.gz VATHLDJGPPGPSZ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000155284875 508966339 /nfs/dbraw/zinc/96/63/39/508966339.db2.gz VATHLDJGPPGPSZ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@H]2C[NH+]2CCOCC2)cc1C(F)(F)F ZINC000160404552 508982296 /nfs/dbraw/zinc/98/22/96/508982296.db2.gz ASDNWBVFMSDSPO-ZDUSSCGKSA-N 1 1 359.348 2.915 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCCCC1 ZINC000160655610 509015514 /nfs/dbraw/zinc/01/55/14/509015514.db2.gz LOXOQVDZBQMQJX-UHFFFAOYSA-N 1 1 358.442 2.999 20 5 FFBDMO CCN1CCN([C@@H](C)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000155573158 509029648 /nfs/dbraw/zinc/02/96/48/509029648.db2.gz PADGXTXDQNEGQA-LPHOPBHVSA-N 1 1 360.502 2.532 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)cc1SC ZINC000120649419 509038233 /nfs/dbraw/zinc/03/82/33/509038233.db2.gz NZLISILUGQDXEJ-AAEUAGOBSA-N 1 1 367.471 2.738 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000120919170 509089178 /nfs/dbraw/zinc/08/91/78/509089178.db2.gz HBMUIVKYJVSING-UKRRQHHQSA-N 1 1 369.487 2.562 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182355207 509191558 /nfs/dbraw/zinc/19/15/58/509191558.db2.gz WODZBKMTRURINW-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c1 ZINC000263862105 509192840 /nfs/dbraw/zinc/19/28/40/509192840.db2.gz XVIYAJCOAMMYSN-UHFFFAOYSA-N 1 1 373.457 2.566 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000247967433 509203674 /nfs/dbraw/zinc/20/36/74/509203674.db2.gz DXKWFRWNTVWYGX-HOCLYGCPSA-N 1 1 356.426 2.704 20 5 FFBDMO COCC[N@@H+](C)CCCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC000162559341 509251602 /nfs/dbraw/zinc/25/16/02/509251602.db2.gz FOUKABJVSPYYRG-UHFFFAOYSA-N 1 1 350.463 2.873 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cccc([N+](=O)[O-])c1Br ZINC000182658282 509354719 /nfs/dbraw/zinc/35/47/19/509354719.db2.gz AWTMCSFUBKLCAU-JTQLQIEISA-N 1 1 368.231 2.571 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000173071966 509378214 /nfs/dbraw/zinc/37/82/14/509378214.db2.gz DRANNEUEUOWPJR-SFHVURJKSA-N 1 1 363.458 2.770 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](C3OCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179366122 509402918 /nfs/dbraw/zinc/40/29/18/509402918.db2.gz OIZSKBOMNKEJEB-HNNXBMFYSA-N 1 1 372.425 2.580 20 5 FFBDMO O=C(NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1)c1ccccc1[N+](=O)[O-] ZINC000192210641 509404529 /nfs/dbraw/zinc/40/45/29/509404529.db2.gz JORRAPXWWDNUIR-KRWDZBQOSA-N 1 1 369.421 2.616 20 5 FFBDMO COc1ccnc(N2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182748418 509407021 /nfs/dbraw/zinc/40/70/21/509407021.db2.gz HQIFLEFIPJFKEZ-CQSZACIVSA-N 1 1 357.414 2.585 20 5 FFBDMO COc1ccc(CNC(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000264266498 509423742 /nfs/dbraw/zinc/42/37/42/509423742.db2.gz GFPLTOYMMXFMGG-OAHLLOKOSA-N 1 1 364.446 2.523 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)C2([NH+]3CCOCC3)CCCC2)cccc1[N+](=O)[O-] ZINC000173184554 509442756 /nfs/dbraw/zinc/44/27/56/509442756.db2.gz GOTMHIBELMOIEQ-OAHLLOKOSA-N 1 1 361.442 2.667 20 5 FFBDMO CCCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 ZINC000179611879 509536406 /nfs/dbraw/zinc/53/64/06/509536406.db2.gz YPIVKSNVZPAEID-BVBGJJFLSA-N 1 1 352.456 2.897 20 5 FFBDMO CCCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1 ZINC000179611879 509536408 /nfs/dbraw/zinc/53/64/08/509536408.db2.gz YPIVKSNVZPAEID-BVBGJJFLSA-N 1 1 352.456 2.897 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000248905164 509537484 /nfs/dbraw/zinc/53/74/84/509537484.db2.gz UULJPSMVWTWOMK-XJKSGUPXSA-N 1 1 355.394 2.551 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CC(C)(C)O)C[C@H]1C ZINC000189461097 509585958 /nfs/dbraw/zinc/58/59/58/509585958.db2.gz RTXUSDFWMYFXEY-OAHLLOKOSA-N 1 1 365.474 2.659 20 5 FFBDMO Cn1cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C(C)(C)C)n1 ZINC000179781027 509618900 /nfs/dbraw/zinc/61/89/00/509618900.db2.gz HLQFTBBXEFFNEW-UHFFFAOYSA-N 1 1 357.458 2.948 20 5 FFBDMO COc1cccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000192808004 509652726 /nfs/dbraw/zinc/65/27/26/509652726.db2.gz SIRDNWQOYDLZJU-XJKSGUPXSA-N 1 1 359.426 2.692 20 5 FFBDMO CCc1n[nH]c(C(=O)N(CC)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192898098 509689646 /nfs/dbraw/zinc/68/96/46/509689646.db2.gz WMXZOFLXGNHBIV-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192898098 509689653 /nfs/dbraw/zinc/68/96/53/509689653.db2.gz WMXZOFLXGNHBIV-OAHLLOKOSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@H](C[N@@H+](C)Cc2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000192904245 509693335 /nfs/dbraw/zinc/69/33/35/509693335.db2.gz ZIWXUWKQTWAGNV-MRXNPFEDSA-N 1 1 373.457 2.767 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186405702 509694511 /nfs/dbraw/zinc/69/45/11/509694511.db2.gz ZPLUNOBSTRSVEQ-SFHVURJKSA-N 1 1 359.382 2.820 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186405702 509694521 /nfs/dbraw/zinc/69/45/21/509694521.db2.gz ZPLUNOBSTRSVEQ-SFHVURJKSA-N 1 1 359.382 2.820 20 5 FFBDMO CC1(C2CC[NH+](Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CC2)OCCO1 ZINC000268079079 509745258 /nfs/dbraw/zinc/74/52/58/509745258.db2.gz FRUDYCNRJGHAGV-UHFFFAOYSA-N 1 1 374.397 2.620 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000180191149 509801621 /nfs/dbraw/zinc/80/16/21/509801621.db2.gz UROWKNUERUTDRR-CQSZACIVSA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000180191149 509801624 /nfs/dbraw/zinc/80/16/24/509801624.db2.gz UROWKNUERUTDRR-CQSZACIVSA-N 1 1 364.320 2.501 20 5 FFBDMO Cc1c(Br)cc(C(=O)N(C)CC[N@@H+](C)C2CC2)cc1[N+](=O)[O-] ZINC000186748222 509885686 /nfs/dbraw/zinc/88/56/86/509885686.db2.gz BJSIMPSYKXEUIX-UHFFFAOYSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1 ZINC000253544380 509891295 /nfs/dbraw/zinc/89/12/95/509891295.db2.gz IXYKFMQSHJIWOB-SJCJKPOMSA-N 1 1 372.425 2.651 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019709 509906858 /nfs/dbraw/zinc/90/68/58/509906858.db2.gz ACQRXGPNAJCHMI-MAUKXSAKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H]2C[C@@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019709 509906865 /nfs/dbraw/zinc/90/68/65/509906865.db2.gz ACQRXGPNAJCHMI-MAUKXSAKSA-N 1 1 365.430 2.677 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000177195634 509931109 /nfs/dbraw/zinc/93/11/09/509931109.db2.gz FYYSZQRVIJMAAW-WCQYABFASA-N 1 1 367.833 2.759 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437696 509933939 /nfs/dbraw/zinc/93/39/39/509933939.db2.gz RRAUKAZGKSQIFP-BBRMVZONSA-N 1 1 359.430 2.807 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)CC2 ZINC000245483681 509961238 /nfs/dbraw/zinc/96/12/38/509961238.db2.gz FYNMVUBPWWHCEZ-KYJSFNMBSA-N 1 1 360.458 2.869 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1ccccc1Cl ZINC000261680677 510024973 /nfs/dbraw/zinc/02/49/73/510024973.db2.gz BWHNYHRRSDAUIN-KRWDZBQOSA-N 1 1 374.828 2.833 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193833450 510091244 /nfs/dbraw/zinc/09/12/44/510091244.db2.gz OILKDZZDXHDXFB-GOSISDBHSA-N 1 1 353.422 2.776 20 5 FFBDMO C[C@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@H+]1CCC[C@H](C)C1 ZINC000245696779 510092676 /nfs/dbraw/zinc/09/26/76/510092676.db2.gz YIGWJUILVHYUKZ-UONOGXRCSA-N 1 1 358.442 2.855 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cc([N+](=O)[O-])c(C)s1 ZINC000261952567 510127456 /nfs/dbraw/zinc/12/74/56/510127456.db2.gz LQZQMNMAQKCLGN-AWEZNQCLSA-N 1 1 361.423 2.760 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000180830121 510134057 /nfs/dbraw/zinc/13/40/57/510134057.db2.gz FPHSIGFOUWABNC-MRXNPFEDSA-N 1 1 368.437 2.771 20 5 FFBDMO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000245779942 510142760 /nfs/dbraw/zinc/14/27/60/510142760.db2.gz ZWGOUKXEPLBBLX-GXTWGEPZSA-N 1 1 367.475 2.734 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)C1 ZINC000174526083 510160961 /nfs/dbraw/zinc/16/09/61/510160961.db2.gz ICNIFBROMZCDNS-KGLIPLIRSA-N 1 1 351.472 2.876 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000174526468 510161343 /nfs/dbraw/zinc/16/13/43/510161343.db2.gz ZDAKECIMNFYJNO-MRXNPFEDSA-N 1 1 374.485 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000194078930 510204736 /nfs/dbraw/zinc/20/47/36/510204736.db2.gz SNHQXWXIHBPPGF-DYVFJYSZSA-N 1 1 360.414 2.952 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000174692786 510253181 /nfs/dbraw/zinc/25/31/81/510253181.db2.gz JJEVMAIOYXHNMD-LJQANCHMSA-N 1 1 358.442 2.940 20 5 FFBDMO Cc1cc(NC(=O)C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)no1 ZINC000171615283 510254236 /nfs/dbraw/zinc/25/42/36/510254236.db2.gz ODGNOCXJAZTQDH-UHFFFAOYSA-N 1 1 362.361 2.881 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@@H]2CCCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000246072127 510276580 /nfs/dbraw/zinc/27/65/80/510276580.db2.gz CQXTYVFYLUJIET-NVXWUHKLSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@@H]2CCCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000246072127 510276586 /nfs/dbraw/zinc/27/65/86/510276586.db2.gz CQXTYVFYLUJIET-NVXWUHKLSA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@@H+]1CCS[C@H]2CCCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000246170380 510336175 /nfs/dbraw/zinc/33/61/75/510336175.db2.gz RTEGVVDQIVDMAI-SJORKVTESA-N 1 1 361.467 2.844 20 5 FFBDMO O=C(C[N@H+]1CCS[C@H]2CCCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000246170380 510336183 /nfs/dbraw/zinc/33/61/83/510336183.db2.gz RTEGVVDQIVDMAI-SJORKVTESA-N 1 1 361.467 2.844 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)[C@@H](C)C1 ZINC000266007674 510356138 /nfs/dbraw/zinc/35/61/38/510356138.db2.gz RPEBHYPAAMJZLQ-YOEHRIQHSA-N 1 1 358.442 2.738 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@@H+]3C[C@@H](O)C[C@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000187669256 510380140 /nfs/dbraw/zinc/38/01/40/510380140.db2.gz VPBIBLVAIPSIOT-HOTGVXAUSA-N 1 1 374.462 2.982 20 5 FFBDMO Cc1ccc(Sc2ccc(C[N@H+]3C[C@@H](O)C[C@H]3CO)cc2[N+](=O)[O-])cc1 ZINC000187669256 510380146 /nfs/dbraw/zinc/38/01/46/510380146.db2.gz VPBIBLVAIPSIOT-HOTGVXAUSA-N 1 1 374.462 2.982 20 5 FFBDMO COc1cc(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000266087569 510401574 /nfs/dbraw/zinc/40/15/74/510401574.db2.gz PIHKQAZBXSLQME-ZDUSSCGKSA-N 1 1 365.430 2.606 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000181429123 510404616 /nfs/dbraw/zinc/40/46/16/510404616.db2.gz FQLCXQZGVLRJNF-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000181429123 510404625 /nfs/dbraw/zinc/40/46/25/510404625.db2.gz FQLCXQZGVLRJNF-NHYWBVRUSA-N 1 1 355.822 2.670 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])cc1N1CCOC1=O ZINC000269441268 510408536 /nfs/dbraw/zinc/40/85/36/510408536.db2.gz BBNFYGJKPZNZSP-UHFFFAOYSA-N 1 1 359.386 2.583 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269496542 510435813 /nfs/dbraw/zinc/43/58/13/510435813.db2.gz KISFEUAFEIVELK-WMZOPIPTSA-N 1 1 372.469 2.796 20 5 FFBDMO CCOC(=O)c1ccnc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000246371092 510451970 /nfs/dbraw/zinc/45/19/70/510451970.db2.gz NZZAUIHXTMPWOB-BBRMVZONSA-N 1 1 374.441 2.620 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](CO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000269614237 510484707 /nfs/dbraw/zinc/48/47/07/510484707.db2.gz SDQYSDIPMGLKSV-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000172043609 510514268 /nfs/dbraw/zinc/51/42/68/510514268.db2.gz DODJAQDOKQXHKZ-CLJRNHLWSA-N 1 1 358.398 2.799 20 5 FFBDMO CC(C)[NH+]1CCC(N2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000269693242 510516013 /nfs/dbraw/zinc/51/60/13/510516013.db2.gz WPOCLRUDNUHMEU-UHFFFAOYSA-N 1 1 360.502 2.628 20 5 FFBDMO O=C1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@@H]2N1 ZINC000246568789 510561464 /nfs/dbraw/zinc/56/14/64/510561464.db2.gz KZAXKEFAPCTGGK-JKSUJKDBSA-N 1 1 370.409 2.535 20 5 FFBDMO O=C1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@@H]2N1 ZINC000246568789 510561467 /nfs/dbraw/zinc/56/14/67/510561467.db2.gz KZAXKEFAPCTGGK-JKSUJKDBSA-N 1 1 370.409 2.535 20 5 FFBDMO COc1ccc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cc1C ZINC000181746112 510571500 /nfs/dbraw/zinc/57/15/00/510571500.db2.gz JXVVNJZWVUODJO-INIZCTEOSA-N 1 1 360.410 2.784 20 5 FFBDMO COc1ccc(OCCN2CC[N@@H+](C)CC23CCCCC3)c([N+](=O)[O-])c1 ZINC000178401299 510584576 /nfs/dbraw/zinc/58/45/76/510584576.db2.gz IXZDOPVMNGYALI-UHFFFAOYSA-N 1 1 363.458 2.933 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000191337221 510611812 /nfs/dbraw/zinc/61/18/12/510611812.db2.gz DLEYWDZUBHWPCA-CQSZACIVSA-N 1 1 364.446 2.521 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C(C)C)[NH+]1CCOCC1 ZINC000191404104 510644619 /nfs/dbraw/zinc/64/46/19/510644619.db2.gz CACQELVMHHMADG-KRWDZBQOSA-N 1 1 364.446 2.690 20 5 FFBDMO C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266549321 510652697 /nfs/dbraw/zinc/65/26/97/510652697.db2.gz SVIGGZLYSGGMNA-NHYWBVRUSA-N 1 1 372.347 2.864 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000175485906 510661219 /nfs/dbraw/zinc/66/12/19/510661219.db2.gz VHTOIXULWLCRBU-CQSZACIVSA-N 1 1 371.393 2.695 20 5 FFBDMO CCS[C@H]1CC[C@H]([N@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931907 510665814 /nfs/dbraw/zinc/66/58/14/510665814.db2.gz PFQSUCAYYYMJLK-GJZGRUSLSA-N 1 1 372.512 2.975 20 5 FFBDMO CCS[C@H]1CC[C@H]([N@@H+](C)CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181931907 510665827 /nfs/dbraw/zinc/66/58/27/510665827.db2.gz PFQSUCAYYYMJLK-GJZGRUSLSA-N 1 1 372.512 2.975 20 5 FFBDMO C[N@@H+](CCNC(=O)NCc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000175583653 510684724 /nfs/dbraw/zinc/68/47/24/510684724.db2.gz HSCBFSWPYLLWNJ-UHFFFAOYSA-N 1 1 360.389 2.665 20 5 FFBDMO CCCn1ccnc1CCC[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000191510492 510696747 /nfs/dbraw/zinc/69/67/47/510696747.db2.gz QUXAEDJIEZEFLV-UHFFFAOYSA-N 1 1 359.430 2.704 20 5 FFBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000270346377 510770549 /nfs/dbraw/zinc/77/05/49/510770549.db2.gz OUDFUWBUHRXVJA-OAHLLOKOSA-N 1 1 354.414 2.614 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246965646 510772957 /nfs/dbraw/zinc/77/29/57/510772957.db2.gz YYJPGCHXYXKSNE-YJBOKZPZSA-N 1 1 363.458 2.770 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccnc(N3CCCC3)c2)c([N+](=O)[O-])cc1OC ZINC000263679141 510785854 /nfs/dbraw/zinc/78/58/54/510785854.db2.gz LYDVOTVCLKHHNM-UHFFFAOYSA-N 1 1 372.425 2.897 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C2OCCO2)C1 ZINC000263680956 510785915 /nfs/dbraw/zinc/78/59/15/510785915.db2.gz OTPIWDCVCMXZKF-JSGCOSHPSA-N 1 1 374.397 2.791 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000172583102 510804019 /nfs/dbraw/zinc/80/40/19/510804019.db2.gz NQIBBQVDGCGJLY-OAHLLOKOSA-N 1 1 360.458 2.872 20 5 FFBDMO CS[C@@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182223200 510821316 /nfs/dbraw/zinc/82/13/16/510821316.db2.gz QCGQEDRJRBZZKN-CQSZACIVSA-N 1 1 358.485 2.586 20 5 FFBDMO CS[C@@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000182223200 510821318 /nfs/dbraw/zinc/82/13/18/510821318.db2.gz QCGQEDRJRBZZKN-CQSZACIVSA-N 1 1 358.485 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000360306182 510894392 /nfs/dbraw/zinc/89/43/92/510894392.db2.gz SJSGKBYXROOYNU-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000360383914 510902062 /nfs/dbraw/zinc/90/20/62/510902062.db2.gz DRRUPHNWYCQNNO-MRXNPFEDSA-N 1 1 354.410 2.801 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC=C(c2ccnn2C)CC1 ZINC000285485515 510925942 /nfs/dbraw/zinc/92/59/42/510925942.db2.gz DDACFNPYPJUHIE-UHFFFAOYSA-N 1 1 369.425 2.755 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCC[N@@H+](C)Cc1ccco1 ZINC000285618101 510980408 /nfs/dbraw/zinc/98/04/08/510980408.db2.gz AJZZHNIMQUUOJK-UHFFFAOYSA-N 1 1 361.398 2.791 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC([C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-] ZINC000364657563 510999338 /nfs/dbraw/zinc/99/93/38/510999338.db2.gz MRCJOUJJCKBXDL-GOEBONIOSA-N 1 1 361.442 2.979 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC000361204182 511012935 /nfs/dbraw/zinc/01/29/35/511012935.db2.gz NCJBCYLTIILBQF-IEBWSBKVSA-N 1 1 357.385 2.838 20 5 FFBDMO CCOc1cc(C[N@H+]2CCC[C@H](CN3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282583712 511034630 /nfs/dbraw/zinc/03/46/30/511034630.db2.gz WFSYNLNBYUEIDV-QGZVFWFLSA-N 1 1 363.458 2.538 20 5 FFBDMO CCOc1cc(CN2CCC[C@H](C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000282583712 511034634 /nfs/dbraw/zinc/03/46/34/511034634.db2.gz WFSYNLNBYUEIDV-QGZVFWFLSA-N 1 1 363.458 2.538 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000282659659 511064665 /nfs/dbraw/zinc/06/46/65/511064665.db2.gz GFTHNEYVJFMFCM-QGZVFWFLSA-N 1 1 362.474 2.757 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)[C@H](C)C1 ZINC000279388514 511065326 /nfs/dbraw/zinc/06/53/26/511065326.db2.gz IOUVZFKQKOMXMU-IUODEOHRSA-N 1 1 366.437 2.602 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCC(C)(C)[N+](=O)[O-] ZINC000294567320 511106462 /nfs/dbraw/zinc/10/64/62/511106462.db2.gz JUDOKKZJVRGMKL-KRWDZBQOSA-N 1 1 362.474 2.730 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCC[C@H]1CO ZINC000289977369 511124802 /nfs/dbraw/zinc/12/48/02/511124802.db2.gz ZLYJMHXQUCKMMP-INIZCTEOSA-N 1 1 364.446 2.516 20 5 FFBDMO C[C@H]1CN(c2ncc([N+](=O)[O-])cc2Br)CC[N@@H+](C2CC2)C1 ZINC000294856976 511200317 /nfs/dbraw/zinc/20/03/17/511200317.db2.gz CSIHHYDGWQOCQL-SNVBAGLBSA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@H]1CN(c2ncc([N+](=O)[O-])cc2Br)CC[N@H+](C2CC2)C1 ZINC000294856976 511200321 /nfs/dbraw/zinc/20/03/21/511200321.db2.gz CSIHHYDGWQOCQL-SNVBAGLBSA-N 1 1 355.236 2.673 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818983 511227987 /nfs/dbraw/zinc/22/79/87/511227987.db2.gz QKAWNMMZTCDQOG-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000279818983 511227993 /nfs/dbraw/zinc/22/79/93/511227993.db2.gz QKAWNMMZTCDQOG-YPMHNXCESA-N 1 1 355.822 2.812 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000362792369 511239462 /nfs/dbraw/zinc/23/94/62/511239462.db2.gz QNBOJHFHBDTJGW-RDJZCZTQSA-N 1 1 358.442 2.896 20 5 FFBDMO Cc1nc(N2CCC[C@@H]([N@@H+](C)Cc3ccccn3)CC2)ncc1[N+](=O)[O-] ZINC000295044421 511262413 /nfs/dbraw/zinc/26/24/13/511262413.db2.gz OBUNIEMBBZLDLK-MRXNPFEDSA-N 1 1 356.430 2.579 20 5 FFBDMO C[NH+](C)[C@@H]1CCCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000295071891 511271786 /nfs/dbraw/zinc/27/17/86/511271786.db2.gz DAMFXRHUEIADLW-CQSZACIVSA-N 1 1 357.414 2.541 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccccc1[N+](=O)[O-] ZINC000271684683 511286886 /nfs/dbraw/zinc/28/68/86/511286886.db2.gz DEEUTQKBESUVMB-LBPRGKRZSA-N 1 1 370.365 2.743 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000365188057 511306034 /nfs/dbraw/zinc/30/60/34/511306034.db2.gz AOCIXCQLRWCVAW-WBVHZDCISA-N 1 1 373.453 2.969 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000295196424 511317240 /nfs/dbraw/zinc/31/72/40/511317240.db2.gz BGAZWLUQVAANCG-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@H](O)CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000295196424 511317244 /nfs/dbraw/zinc/31/72/44/511317244.db2.gz BGAZWLUQVAANCG-GFCCVEGCSA-N 1 1 355.822 2.670 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H](n4cccn4)C3)o2)c1 ZINC000291741897 511317805 /nfs/dbraw/zinc/31/78/05/511317805.db2.gz KBNQVWDBCCKHDQ-INIZCTEOSA-N 1 1 353.382 2.936 20 5 FFBDMO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295278613 511346227 /nfs/dbraw/zinc/34/62/27/511346227.db2.gz IIMVVQJILXNPBF-CJNGLKHVSA-N 1 1 369.425 2.684 20 5 FFBDMO CC(C)(C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1)C(N)=O ZINC000295605530 511458940 /nfs/dbraw/zinc/45/89/40/511458940.db2.gz NLFWQTDOZDTUAR-GFCCVEGCSA-N 1 1 360.414 2.850 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O ZINC000272267480 511485068 /nfs/dbraw/zinc/48/50/68/511485068.db2.gz AOUOGGRNOMSNKD-HOTGVXAUSA-N 1 1 350.415 2.690 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O ZINC000272267480 511485070 /nfs/dbraw/zinc/48/50/70/511485070.db2.gz AOUOGGRNOMSNKD-HOTGVXAUSA-N 1 1 350.415 2.690 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC000292209109 511506348 /nfs/dbraw/zinc/50/63/48/511506348.db2.gz HERMXQVOUBPJDV-INIZCTEOSA-N 1 1 353.806 2.567 20 5 FFBDMO Cc1cc(N2CC[C@]3(CC[N@H+](C)C3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000292225687 511512907 /nfs/dbraw/zinc/51/29/07/511512907.db2.gz IMSIZWPVKTUNHC-IBGZPJMESA-N 1 1 353.426 2.892 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000292300139 511543380 /nfs/dbraw/zinc/54/33/80/511543380.db2.gz MRZLQBOALJXTLI-GJZGRUSLSA-N 1 1 360.458 2.728 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000363562303 511629635 /nfs/dbraw/zinc/62/96/35/511629635.db2.gz LLLIARJLBOAOFQ-CHWSQXEVSA-N 1 1 373.413 2.533 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000292556912 511642050 /nfs/dbraw/zinc/64/20/50/511642050.db2.gz XRLQPALCEKWILU-SJLPKXTDSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccncc1 ZINC000292556912 511642053 /nfs/dbraw/zinc/64/20/53/511642053.db2.gz XRLQPALCEKWILU-SJLPKXTDSA-N 1 1 357.410 2.813 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)nc1 ZINC000274044777 511702948 /nfs/dbraw/zinc/70/29/48/511702948.db2.gz YDLIHYLRKMPFIM-AEFFLSMTSA-N 1 1 353.426 2.876 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000274160931 511738485 /nfs/dbraw/zinc/73/84/85/511738485.db2.gz AKIIVISDTOGSGF-BPQIPLTHSA-N 1 1 356.426 2.965 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000296450736 511748547 /nfs/dbraw/zinc/74/85/47/511748547.db2.gz IQIPVKGUXWYONM-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450736 511748553 /nfs/dbraw/zinc/74/85/53/511748553.db2.gz IQIPVKGUXWYONM-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000296450736 511748559 /nfs/dbraw/zinc/74/85/59/511748559.db2.gz IQIPVKGUXWYONM-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000363778445 511763054 /nfs/dbraw/zinc/76/30/54/511763054.db2.gz MYXAMROOEGVPDG-ZBFHGGJFSA-N 1 1 354.410 2.881 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312028943 511782803 /nfs/dbraw/zinc/78/28/03/511782803.db2.gz YJELIIFHCHARRM-OAHLLOKOSA-N 1 1 354.410 2.641 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@H](c2[nH+]ccn2C)C1 ZINC000366075463 511825259 /nfs/dbraw/zinc/82/52/59/511825259.db2.gz DMBYZIPGNVYGKF-JTQLQIEISA-N 1 1 364.789 2.762 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCN([C@@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000363898279 511837405 /nfs/dbraw/zinc/83/74/05/511837405.db2.gz ANJXSCBOKIDNEU-QGZVFWFLSA-N 1 1 374.485 2.570 20 5 FFBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](O)Cc1ccccc1 ZINC000293432331 511963310 /nfs/dbraw/zinc/96/33/10/511963310.db2.gz UKHMVNBBGZXKKN-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](O)Cc1ccccc1 ZINC000293432331 511963315 /nfs/dbraw/zinc/96/33/15/511963315.db2.gz UKHMVNBBGZXKKN-KRWDZBQOSA-N 1 1 368.393 2.680 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)C1=CC[N@@H+](C)CC1 ZINC000293532076 511999654 /nfs/dbraw/zinc/99/96/54/511999654.db2.gz RIKNHXCJEZNVPA-JTQLQIEISA-N 1 1 357.332 2.994 20 5 FFBDMO CCC(=O)c1ccc(N2CC[C@@H](N3CC[NH+](C)CC3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000366430488 512020026 /nfs/dbraw/zinc/02/00/26/512020026.db2.gz NMSOXBARGMXMJL-DOTOQJQBSA-N 1 1 374.485 2.650 20 5 FFBDMO COc1ccccc1COC[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285155763 512020311 /nfs/dbraw/zinc/02/03/11/512020311.db2.gz AETMCWGNSXKFTJ-SFHVURJKSA-N 1 1 374.437 2.655 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375758916 512490196 /nfs/dbraw/zinc/49/01/96/512490196.db2.gz BLZIZJVGBHGMDS-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375758916 512490201 /nfs/dbraw/zinc/49/02/01/512490201.db2.gz BLZIZJVGBHGMDS-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@H]1CC(C)C ZINC000411285976 512562897 /nfs/dbraw/zinc/56/28/97/512562897.db2.gz WFEBSIDEQKYMIG-OAHLLOKOSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH+]2CCC(c3cn[nH]c3)CC2)c([N+](=O)[O-])c1 ZINC000373992436 512609764 /nfs/dbraw/zinc/60/97/64/512609764.db2.gz LSXMTSLVJSVLFY-LBPRGKRZSA-N 1 1 373.413 2.533 20 5 FFBDMO C[NH+]1CCC2(CCCN(Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)C2)CC1 ZINC000374075380 512650617 /nfs/dbraw/zinc/65/06/17/512650617.db2.gz SPRGXTVPNYETQW-UHFFFAOYSA-N 1 1 371.441 2.953 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 ZINC000411536787 512679130 /nfs/dbraw/zinc/67/91/30/512679130.db2.gz HYPUDZBURBXUFW-CYBMUJFWSA-N 1 1 360.414 2.953 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000411681013 512755094 /nfs/dbraw/zinc/75/50/94/512755094.db2.gz VQHHDLBJNFAFON-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO COC[C@@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376370620 512789082 /nfs/dbraw/zinc/78/90/82/512789082.db2.gz RJSLPWOVFINBLA-ZIAGYGMSSA-N 1 1 365.430 2.679 20 5 FFBDMO COCC[C@H]1CCCC[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000376376630 512791698 /nfs/dbraw/zinc/79/16/98/512791698.db2.gz OZDJSSLAVCDWPL-OAHLLOKOSA-N 1 1 370.471 2.507 20 5 FFBDMO COCC[C@H]1CCCC[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000376376630 512791702 /nfs/dbraw/zinc/79/17/02/512791702.db2.gz OZDJSSLAVCDWPL-OAHLLOKOSA-N 1 1 370.471 2.507 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1 ZINC000376412351 512808751 /nfs/dbraw/zinc/80/87/51/512808751.db2.gz YMJMXJDRNVXCNX-XYPWUTKMSA-N 1 1 361.442 2.756 20 5 FFBDMO CCOC[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000411818102 512829135 /nfs/dbraw/zinc/82/91/35/512829135.db2.gz KHZXDLQYAPNIRX-AWEZNQCLSA-N 1 1 365.430 2.823 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](OCc2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000376517405 512854017 /nfs/dbraw/zinc/85/40/17/512854017.db2.gz JNNIWDWPKHTABY-GOSISDBHSA-N 1 1 370.409 2.610 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000411920929 512875198 /nfs/dbraw/zinc/87/51/98/512875198.db2.gz CUAIMRAAEPBEFY-YJBOKZPZSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C(CC[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411932530 512879518 /nfs/dbraw/zinc/87/95/18/512879518.db2.gz GAEJBUROQPVAKG-ZWKOTPCHSA-N 1 1 355.394 2.731 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H]2CCCCN12 ZINC000374591064 512906288 /nfs/dbraw/zinc/90/62/88/512906288.db2.gz FYAFROCLMZSBAP-CVEARBPZSA-N 1 1 372.450 2.961 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000412052712 512932718 /nfs/dbraw/zinc/93/27/18/512932718.db2.gz YHXWIMKBHPTTEV-UJDVCPFMSA-N 1 1 358.398 2.799 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC000412110895 512965495 /nfs/dbraw/zinc/96/54/95/512965495.db2.gz DZWMPAYWSASLAM-CYBMUJFWSA-N 1 1 367.421 2.666 20 5 FFBDMO COCC[C@H]1CCCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000368655872 513044214 /nfs/dbraw/zinc/04/42/14/513044214.db2.gz QEZGMIDBFFAJIW-OAHLLOKOSA-N 1 1 361.442 2.623 20 5 FFBDMO Cc1cccc(N2CCC(NC(=O)c3[nH]nc(C(C)C)c3[N+](=O)[O-])CC2)[nH+]1 ZINC000433744447 513139856 /nfs/dbraw/zinc/13/98/56/513139856.db2.gz KAPHBDZMVXRQGB-UHFFFAOYSA-N 1 1 372.429 2.544 20 5 FFBDMO Cc1nc(NCC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450401270 513178706 /nfs/dbraw/zinc/17/87/06/513178706.db2.gz HXUZEFSPXKPWHD-RHSMWYFYSA-N 1 1 355.442 2.828 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429024025 513260268 /nfs/dbraw/zinc/26/02/68/513260268.db2.gz GKGYHMQRHGBYCR-FRFSOERESA-N 1 1 360.458 2.504 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCOC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042784 513265921 /nfs/dbraw/zinc/26/59/21/513265921.db2.gz RHVSAQRLAWQYIA-HOCLYGCPSA-N 1 1 361.442 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCOC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042784 513265925 /nfs/dbraw/zinc/26/59/25/513265925.db2.gz RHVSAQRLAWQYIA-HOCLYGCPSA-N 1 1 361.442 2.979 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCOC[C@@H](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000429237044 513310938 /nfs/dbraw/zinc/31/09/38/513310938.db2.gz OBQNHYAMAWBIDV-HNNXBMFYSA-N 1 1 350.415 2.731 20 5 FFBDMO CC(C)([NH2+]CC(=O)NCCOc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429254405 513317748 /nfs/dbraw/zinc/31/77/48/513317748.db2.gz KSIYTCGNIABHEQ-UHFFFAOYSA-N 1 1 357.410 2.615 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@H]2CCCN(c3cccc(C)c3[N+](=O)[O-])C2)CC1 ZINC000450773504 513334633 /nfs/dbraw/zinc/33/46/33/513334633.db2.gz MPACXDFGTCFAQZ-GOSISDBHSA-N 1 1 374.485 2.674 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1CCCC[N@@H+]1C1CC1 ZINC000434762376 513421802 /nfs/dbraw/zinc/42/18/02/513421802.db2.gz BGCSMKJMIQVBRU-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000434762376 513421807 /nfs/dbraw/zinc/42/18/07/513421807.db2.gz BGCSMKJMIQVBRU-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cccc1[N+](=O)[O-] ZINC000441193831 513510478 /nfs/dbraw/zinc/51/04/78/513510478.db2.gz IAIWETVOMLRVAV-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO CCC[N@@H+](Cc1c(F)cccc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441279924 513528369 /nfs/dbraw/zinc/52/83/69/513528369.db2.gz PUMGUPKBNXFAMK-ZDUSSCGKSA-N 1 1 370.812 2.857 20 5 FFBDMO CCC[N@H+](Cc1c(F)cccc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441279924 513528375 /nfs/dbraw/zinc/52/83/75/513528375.db2.gz PUMGUPKBNXFAMK-ZDUSSCGKSA-N 1 1 370.812 2.857 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000447812628 513577597 /nfs/dbraw/zinc/57/75/97/513577597.db2.gz NBGOKBQQBZPWAQ-MRXNPFEDSA-N 1 1 362.474 2.713 20 5 FFBDMO CC(C)OC[C@H](CO)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425467146 513581685 /nfs/dbraw/zinc/58/16/85/513581685.db2.gz BIHFCZXPSHOZCX-ZDUSSCGKSA-N 1 1 361.236 2.575 20 5 FFBDMO CC(C)OC[C@H](CO)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425467146 513581691 /nfs/dbraw/zinc/58/16/91/513581691.db2.gz BIHFCZXPSHOZCX-ZDUSSCGKSA-N 1 1 361.236 2.575 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000430241017 513597917 /nfs/dbraw/zinc/59/79/17/513597917.db2.gz QBVOEUCDQYEKKC-CQSZACIVSA-N 1 1 363.458 2.978 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](n2ccnn2)C1 ZINC000425497124 513602625 /nfs/dbraw/zinc/60/26/25/513602625.db2.gz CAVNCQNJIDJHBW-WFASDCNBSA-N 1 1 369.385 2.634 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](n2ccnn2)C1 ZINC000425497124 513602634 /nfs/dbraw/zinc/60/26/34/513602634.db2.gz CAVNCQNJIDJHBW-WFASDCNBSA-N 1 1 369.385 2.634 20 5 FFBDMO COC(=O)c1cnc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000435601867 513633359 /nfs/dbraw/zinc/63/33/59/513633359.db2.gz RHNIDEQFOPYYAZ-HNNXBMFYSA-N 1 1 362.430 2.985 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C ZINC000448080292 513671280 /nfs/dbraw/zinc/67/12/80/513671280.db2.gz LXYDLAGVAIYIKR-OAHLLOKOSA-N 1 1 350.419 2.845 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000416462475 513784163 /nfs/dbraw/zinc/78/41/63/513784163.db2.gz QPQAACDWGBRDMG-CABCVRRESA-N 1 1 369.487 2.705 20 5 FFBDMO CN(C(=O)c1ccc(Br)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000430944330 513788298 /nfs/dbraw/zinc/78/82/98/513788298.db2.gz SQXIERZYGKQHRW-LBPRGKRZSA-N 1 1 368.231 2.666 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436255190 513808830 /nfs/dbraw/zinc/80/88/30/513808830.db2.gz WPXDTLLJZKRRAH-QGZVFWFLSA-N 1 1 361.442 2.887 20 5 FFBDMO CN(Cc1ccc([N+](=O)[O-])cc1F)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000425967163 513809483 /nfs/dbraw/zinc/80/94/83/513809483.db2.gz NLHSTTCPVSKRDM-HXUWFJFHSA-N 1 1 373.428 2.803 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000451545456 513823049 /nfs/dbraw/zinc/82/30/49/513823049.db2.gz RBCWNEFVYIAMFH-GUYCJALGSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOCC[N@@H+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@@H]1C ZINC000436385158 513842885 /nfs/dbraw/zinc/84/28/85/513842885.db2.gz FRVYPLIANGQXGI-NSHDSACASA-N 1 1 362.352 2.556 20 5 FFBDMO CCOCC[N@H+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])C[C@@H]1C ZINC000436385158 513842893 /nfs/dbraw/zinc/84/28/93/513842893.db2.gz FRVYPLIANGQXGI-NSHDSACASA-N 1 1 362.352 2.556 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000448695983 513850079 /nfs/dbraw/zinc/85/00/79/513850079.db2.gz CKYZXQHPJIUYHN-NEPJUHHUSA-N 1 1 353.394 2.735 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC[N@H+]1C ZINC000426209178 513872115 /nfs/dbraw/zinc/87/21/15/513872115.db2.gz HNBBBWYXCAPQAC-QMTHXVAHSA-N 1 1 374.363 2.896 20 5 FFBDMO NC(=O)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOc2ccccc21 ZINC000451711623 513931253 /nfs/dbraw/zinc/93/12/53/513931253.db2.gz MTIYNLYLKISBKW-GOSISDBHSA-N 1 1 369.421 2.839 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@H]4C3)o2)cc1 ZINC000451714596 513933416 /nfs/dbraw/zinc/93/34/16/513933416.db2.gz SIBCTDXKSSOTIX-IJEWVQPXSA-N 1 1 358.398 2.628 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](CO)CC(C)(C)C ZINC000451777275 513973526 /nfs/dbraw/zinc/97/35/26/513973526.db2.gz IFQPOYQLUNDYNV-AWEZNQCLSA-N 1 1 367.446 2.661 20 5 FFBDMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000451866891 514031097 /nfs/dbraw/zinc/03/10/97/514031097.db2.gz BUIAQHVMRMDJPE-CYBMUJFWSA-N 1 1 361.364 2.790 20 5 FFBDMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000451868841 514032642 /nfs/dbraw/zinc/03/26/42/514032642.db2.gz DZNRCHVHUUDGCH-CYBMUJFWSA-N 1 1 361.364 2.790 20 5 FFBDMO CCCN(CC[NH+]1CCCC1)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000451924846 514074398 /nfs/dbraw/zinc/07/43/98/514074398.db2.gz JQVTTYJDAYECCS-UHFFFAOYSA-N 1 1 371.441 2.933 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@]2(CCSC2)C1 ZINC000451964044 514098647 /nfs/dbraw/zinc/09/86/47/514098647.db2.gz INIZLDDUQJSHHO-RHSMWYFYSA-N 1 1 352.456 2.554 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C ZINC000444025922 514102982 /nfs/dbraw/zinc/10/29/82/514102982.db2.gz RVNOJVDCUXYVGB-QWHCGFSZSA-N 1 1 350.419 2.940 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000437289579 514132491 /nfs/dbraw/zinc/13/24/91/514132491.db2.gz QWAGYKHRRRGRRS-CYBMUJFWSA-N 1 1 357.332 2.922 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452055979 514166909 /nfs/dbraw/zinc/16/69/09/514166909.db2.gz VOFCRNHPMOPZJL-FCIKYMEBSA-N 1 1 359.426 2.910 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CNCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000432364138 514173519 /nfs/dbraw/zinc/17/35/19/514173519.db2.gz ZVEYYHWEVSDAOF-HNNXBMFYSA-N 1 1 351.447 2.584 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCC[N@H+]3CCCO)o2)cc1 ZINC000449390472 514190507 /nfs/dbraw/zinc/19/05/07/514190507.db2.gz WFDPOEKBVPIVRO-QGZVFWFLSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCC[N@@H+]3CCCO)o2)cc1 ZINC000449390472 514190516 /nfs/dbraw/zinc/19/05/16/514190516.db2.gz WFDPOEKBVPIVRO-QGZVFWFLSA-N 1 1 359.426 2.791 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000420592489 514194933 /nfs/dbraw/zinc/19/49/33/514194933.db2.gz ZSXPVXXYNMDFJL-MRXNPFEDSA-N 1 1 368.437 2.670 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000420621026 514203955 /nfs/dbraw/zinc/20/39/55/514203955.db2.gz FNPCXCDWNMPHLI-HNNXBMFYSA-N 1 1 354.410 2.628 20 5 FFBDMO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449460598 514219560 /nfs/dbraw/zinc/21/95/60/514219560.db2.gz ZIJRIHNHUCEEON-IBGZPJMESA-N 1 1 374.393 2.866 20 5 FFBDMO Cn1cc[nH+]c1C[C@@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664253 514287960 /nfs/dbraw/zinc/28/79/60/514287960.db2.gz QMHNXXKOSGBZPP-ZDUSSCGKSA-N 1 1 354.414 2.659 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444664252 514288083 /nfs/dbraw/zinc/28/80/83/514288083.db2.gz QMHNXXKOSGBZPP-CYBMUJFWSA-N 1 1 354.414 2.659 20 5 FFBDMO C[N@H+](Cc1cc(F)cc(F)c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000444692092 514294650 /nfs/dbraw/zinc/29/46/50/514294650.db2.gz KZKQWQYEVQCJPL-OAHLLOKOSA-N 1 1 352.337 2.745 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1cc2ccccc2c2cccnc12 ZINC000452378664 514321448 /nfs/dbraw/zinc/32/14/48/514321448.db2.gz XBQPUTYVTPBZKI-KRWDZBQOSA-N 1 1 363.461 2.965 20 5 FFBDMO C[C@H](CNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[N@H+]1CCCC[C@H]1C ZINC000444850050 514351277 /nfs/dbraw/zinc/35/12/77/514351277.db2.gz NXVSPXIIPWBEMQ-CHWSQXEVSA-N 1 1 374.445 2.533 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000420944451 514393420 /nfs/dbraw/zinc/39/34/20/514393420.db2.gz QVAOGTRLRVIJRA-WDEREUQCSA-N 1 1 360.357 2.655 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420948804 514396576 /nfs/dbraw/zinc/39/65/76/514396576.db2.gz OFFBVIJLQQBHDI-STQMWFEESA-N 1 1 362.348 2.999 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](O)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004366 514433693 /nfs/dbraw/zinc/43/36/93/514433693.db2.gz FSONQMKBAIZYGX-ZYHUDNBSSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](O)CC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421004366 514433699 /nfs/dbraw/zinc/43/36/99/514433699.db2.gz FSONQMKBAIZYGX-ZYHUDNBSSA-N 1 1 360.357 2.593 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CNCCO3)o2)c(Cl)c1 ZINC000415090646 514439026 /nfs/dbraw/zinc/43/90/26/514439026.db2.gz AWPLDPRVJDGTSV-ZDUSSCGKSA-N 1 1 351.790 2.586 20 5 FFBDMO O=C(c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000449969564 514447888 /nfs/dbraw/zinc/44/78/88/514447888.db2.gz RPQIBWFKHWITQN-AWEZNQCLSA-N 1 1 369.425 2.543 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000449983030 514452226 /nfs/dbraw/zinc/45/22/26/514452226.db2.gz YIPYMBFYOOVSBS-KRWDZBQOSA-N 1 1 373.453 2.938 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2cccc(F)c2)C2CCCC2)c1 ZINC000438875793 514455725 /nfs/dbraw/zinc/45/57/25/514455725.db2.gz KRNQFGVWPAIGNA-GOSISDBHSA-N 1 1 362.405 2.736 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1Br ZINC000445843993 514531362 /nfs/dbraw/zinc/53/13/62/514531362.db2.gz WQZHAFDWDUWWOM-UHFFFAOYSA-N 1 1 372.263 2.746 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000439484833 514563003 /nfs/dbraw/zinc/56/30/03/514563003.db2.gz FTFLJRHNYIJMST-KBXCAEBGSA-N 1 1 350.415 2.948 20 5 FFBDMO CCc1[nH]nc(C(=O)N(CC[NH+]2CCCCCC2)C2CCC2)c1[N+](=O)[O-] ZINC000488880664 514619640 /nfs/dbraw/zinc/61/96/40/514619640.db2.gz VCSQIECJDXNHBI-UHFFFAOYSA-N 1 1 363.462 2.751 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C[C@@H](C)C1 ZINC000453428738 514631868 /nfs/dbraw/zinc/63/18/68/514631868.db2.gz QMHSUGIWXHGTDG-GRDNDAEWSA-N 1 1 370.457 2.557 20 5 FFBDMO CS[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N1CCCC1 ZINC000484633169 514721086 /nfs/dbraw/zinc/72/10/86/514721086.db2.gz CRPBGFCFONKGCN-MSOLQXFVSA-N 1 1 365.499 2.875 20 5 FFBDMO CS[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N1CCCC1 ZINC000484633169 514721093 /nfs/dbraw/zinc/72/10/93/514721093.db2.gz CRPBGFCFONKGCN-MSOLQXFVSA-N 1 1 365.499 2.875 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000480054898 514824633 /nfs/dbraw/zinc/82/46/33/514824633.db2.gz QKIOZNPMAQCPHF-UHFFFAOYSA-N 1 1 369.425 2.638 20 5 FFBDMO C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000485407076 515028405 /nfs/dbraw/zinc/02/84/05/515028405.db2.gz MKLWUJFQHHYGCR-CQSZACIVSA-N 1 1 374.416 2.689 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)[C@@H](C)C1 ZINC000485418759 515033437 /nfs/dbraw/zinc/03/34/37/515033437.db2.gz VQTYRDPKGVYNPA-UONOGXRCSA-N 1 1 374.416 2.687 20 5 FFBDMO COc1ccc(C(=O)CC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000509258789 515096829 /nfs/dbraw/zinc/09/68/29/515096829.db2.gz ARKVNLVHJNJPES-UHFFFAOYSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1cc(CN2CCC(OCC[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000490097714 515103475 /nfs/dbraw/zinc/10/34/75/515103475.db2.gz BCPNMZWACXILQC-UHFFFAOYSA-N 1 1 363.458 2.680 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000456344629 515113461 /nfs/dbraw/zinc/11/34/61/515113461.db2.gz RRQSDDIRUROHFG-OAHLLOKOSA-N 1 1 369.421 2.895 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000456344629 515113471 /nfs/dbraw/zinc/11/34/71/515113471.db2.gz RRQSDDIRUROHFG-OAHLLOKOSA-N 1 1 369.421 2.895 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000490204009 515140708 /nfs/dbraw/zinc/14/07/08/515140708.db2.gz SKPSJCBKKVNGSV-HBUWYVDXSA-N 1 1 360.458 2.775 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000481039718 515184294 /nfs/dbraw/zinc/18/42/94/515184294.db2.gz OBDLGICHQJMMJN-GJZGRUSLSA-N 1 1 369.487 2.753 20 5 FFBDMO C[C@@H]1[C@@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CCC[N@H+]1C ZINC000462701956 515198816 /nfs/dbraw/zinc/19/88/16/515198816.db2.gz PEYSKMCVWKYGFH-ZBFHGGJFSA-N 1 1 356.426 2.885 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCC(F)(F)F)CC3)nc2c1 ZINC000481178117 515236383 /nfs/dbraw/zinc/23/63/83/515236383.db2.gz FWDCOTQFTUACJE-UHFFFAOYSA-N 1 1 357.336 2.936 20 5 FFBDMO CC(C)NS(=O)(=O)c1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000509609479 515255845 /nfs/dbraw/zinc/25/58/45/515255845.db2.gz QNMHWPRAEGTFJP-UHFFFAOYSA-N 1 1 363.439 2.571 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000476955704 515263032 /nfs/dbraw/zinc/26/30/32/515263032.db2.gz YLNKKQNORMHYRE-UHFFFAOYSA-N 1 1 361.442 2.768 20 5 FFBDMO COc1ccc(CNc2cccc(C[N@H+]3CC[C@@H](O)C3)c2)cc1[N+](=O)[O-] ZINC000462856904 515270266 /nfs/dbraw/zinc/27/02/66/515270266.db2.gz UMCNEOWVCUAISV-QGZVFWFLSA-N 1 1 357.410 2.782 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)cc([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000481388074 515311149 /nfs/dbraw/zinc/31/11/49/515311149.db2.gz CNZRFEKFJSZRIW-GJZGRUSLSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419501 515315597 /nfs/dbraw/zinc/31/55/97/515315597.db2.gz GDCFYXNUQKWXCG-HUUCEWRRSA-N 1 1 356.426 2.668 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])n1C ZINC000499419501 515315608 /nfs/dbraw/zinc/31/56/08/515315608.db2.gz GDCFYXNUQKWXCG-HUUCEWRRSA-N 1 1 356.426 2.668 20 5 FFBDMO C[N@@H+](CCOCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000504576309 515333669 /nfs/dbraw/zinc/33/36/69/515333669.db2.gz YVSKURADOSJDGV-UHFFFAOYSA-N 1 1 354.790 2.949 20 5 FFBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000463141451 515378637 /nfs/dbraw/zinc/37/86/37/515378637.db2.gz KECKTUYEISUNPG-OAHLLOKOSA-N 1 1 362.474 2.658 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000499879355 515490691 /nfs/dbraw/zinc/49/06/91/515490691.db2.gz RZFIRMGACYIUBD-DZGCQCFKSA-N 1 1 354.410 2.742 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCCC[N@@H+]1CCCC[C@H]1C ZINC000481961360 515528845 /nfs/dbraw/zinc/52/88/45/515528845.db2.gz YTMOWCYZHXJSQH-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000492629352 515548998 /nfs/dbraw/zinc/54/89/98/515548998.db2.gz JXUKVXGSCFBVIH-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO COc1cccc([C@H]2[C@@H](NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC[N@H+]2C2CC2)c1 ZINC000482047141 515558415 /nfs/dbraw/zinc/55/84/15/515558415.db2.gz WAZRZHZECOTURE-YJBOKZPZSA-N 1 1 370.409 2.639 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)cc1Cl ZINC000482057829 515559645 /nfs/dbraw/zinc/55/96/45/515559645.db2.gz YRCMACHSEISGOR-UHFFFAOYSA-N 1 1 350.762 2.663 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000492831432 515566092 /nfs/dbraw/zinc/56/60/92/515566092.db2.gz NVSOCSVKSPQONR-GDBMZVCRSA-N 1 1 359.426 2.579 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871919 515571371 /nfs/dbraw/zinc/57/13/71/515571371.db2.gz JYTYAIRHGOPEFE-CABCVRRESA-N 1 1 366.414 2.536 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492871919 515571379 /nfs/dbraw/zinc/57/13/79/515571379.db2.gz JYTYAIRHGOPEFE-CABCVRRESA-N 1 1 366.414 2.536 20 5 FFBDMO Cc1cc(N2CC[C@@H]3CC[N@H+](C)C[C@H]32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000486670463 515587890 /nfs/dbraw/zinc/58/78/90/515587890.db2.gz KLWVJWZQFLADNW-WMLDXEAASA-N 1 1 353.426 2.891 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505592546 515600351 /nfs/dbraw/zinc/60/03/51/515600351.db2.gz TUGKJRPHZSOTBQ-VXGBXAGGSA-N 1 1 373.400 2.772 20 5 FFBDMO Cn1cc(C(=O)NCC[N@H+]2CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000457079046 515633110 /nfs/dbraw/zinc/63/31/10/515633110.db2.gz RUMHTCKPUDOKGN-UHFFFAOYSA-N 1 1 371.441 2.600 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2nc3ccccc3cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000473515014 515642292 /nfs/dbraw/zinc/64/22/92/515642292.db2.gz UKXAYZFGKRGCEL-GASCZTMLSA-N 1 1 358.442 2.866 20 5 FFBDMO C[C@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc2c(s1)CCC2 ZINC000459628892 515706904 /nfs/dbraw/zinc/70/69/04/515706904.db2.gz FSRPAVUZJXUBGZ-NHYWBVRUSA-N 1 1 372.450 2.996 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000510904685 515708154 /nfs/dbraw/zinc/70/81/54/515708154.db2.gz ZMWZMSNUMVDKLQ-GFCCVEGCSA-N 1 1 359.348 2.875 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1[C@H]1C[C@H]1c1ccccc1 ZINC000478255362 515755294 /nfs/dbraw/zinc/75/52/94/515755294.db2.gz OICYGHRRVWAOSP-IEZWGBDMSA-N 1 1 369.396 2.981 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+](CCCOc2ccccc2)C2CCOCC2)c1 ZINC000464578113 515879742 /nfs/dbraw/zinc/87/97/42/515879742.db2.gz SZDUXBCDGXRMGI-UHFFFAOYSA-N 1 1 374.441 2.741 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1 ZINC000500856658 515883866 /nfs/dbraw/zinc/88/38/66/515883866.db2.gz ICQQNAQATCHATR-MRXNPFEDSA-N 1 1 363.462 2.570 20 5 FFBDMO C[N@@H+](CCN1CCN(c2cccc([N+](=O)[O-])c2)CC1)Cc1ccccc1 ZINC000511446617 515909552 /nfs/dbraw/zinc/90/95/52/515909552.db2.gz QBOKCAQZVDBGTB-UHFFFAOYSA-N 1 1 354.454 2.849 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCCOC2)O1 ZINC000483368865 516052453 /nfs/dbraw/zinc/05/24/53/516052453.db2.gz CLGLUPQRQLKDRO-QAPCUYQASA-N 1 1 350.415 2.634 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000465053433 516053567 /nfs/dbraw/zinc/05/35/67/516053567.db2.gz LRRDATUMDWYKNV-AWEZNQCLSA-N 1 1 360.458 2.877 20 5 FFBDMO CCc1cc(NC[C@@H]2CCC[N@@H+]2CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000507111894 516092916 /nfs/dbraw/zinc/09/29/16/516092916.db2.gz RUIIGSXRZURPMQ-KRWDZBQOSA-N 1 1 355.442 2.932 20 5 FFBDMO C[C@H](CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H]1C ZINC000501510801 516132118 /nfs/dbraw/zinc/13/21/18/516132118.db2.gz GENIVHUUFMKSFQ-HUUCEWRRSA-N 1 1 363.462 2.569 20 5 FFBDMO CC(C)C[C@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000470148969 516144516 /nfs/dbraw/zinc/14/45/16/516144516.db2.gz OJKRTSNVFQINCD-MRXNPFEDSA-N 1 1 368.409 2.602 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000470164354 516155994 /nfs/dbraw/zinc/15/59/94/516155994.db2.gz UGKTWDHUFSVFTD-AWEZNQCLSA-N 1 1 354.410 2.890 20 5 FFBDMO CC(C)c1ncc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000501867322 516249201 /nfs/dbraw/zinc/24/92/01/516249201.db2.gz ALLRCNIMPKZZEL-UHFFFAOYSA-N 1 1 357.414 2.969 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000512420958 516271826 /nfs/dbraw/zinc/27/18/26/516271826.db2.gz ORAWUNPIHFCYSA-LSDHHAIUSA-N 1 1 352.431 2.998 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000488715898 516292993 /nfs/dbraw/zinc/29/29/93/516292993.db2.gz BRBPHCLHAMHVMF-XEZPLFJOSA-N 1 1 357.414 2.811 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)C1 ZINC000497427999 516322123 /nfs/dbraw/zinc/32/21/23/516322123.db2.gz HRUCCMQVDSJMKU-QZTJIDSGSA-N 1 1 371.462 2.901 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000497532608 516325493 /nfs/dbraw/zinc/32/54/93/516325493.db2.gz KVSLPGIUFSFICB-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC000497532608 516325494 /nfs/dbraw/zinc/32/54/94/516325494.db2.gz KVSLPGIUFSFICB-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO O=C([C@@H]1CCC[N@@H+](Cc2cccnc2)C1)N1CCc2c1cccc2[N+](=O)[O-] ZINC000523134584 516395368 /nfs/dbraw/zinc/39/53/68/516395368.db2.gz QLVQMODVZNSQIA-MRXNPFEDSA-N 1 1 366.421 2.791 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000531388798 516445208 /nfs/dbraw/zinc/44/52/08/516445208.db2.gz CVOMBFKJRMAUAF-YOEHRIQHSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1[nH]nc(C(=O)Nc2nc(C[NH+]3CCCCCC3)cs2)c1[N+](=O)[O-] ZINC000523365849 516451930 /nfs/dbraw/zinc/45/19/30/516451930.db2.gz WPOCFKXHYRUKOZ-UHFFFAOYSA-N 1 1 364.431 2.711 20 5 FFBDMO CNC(=O)COc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000513100115 516473794 /nfs/dbraw/zinc/47/37/94/516473794.db2.gz GXGXIJVLEAOQIB-UHFFFAOYSA-N 1 1 363.801 2.663 20 5 FFBDMO Cc1nn(C(C)(C)C)c(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000535785899 516509127 /nfs/dbraw/zinc/50/91/27/516509127.db2.gz NXYFDIOPXGNTFJ-UHFFFAOYSA-N 1 1 372.473 2.880 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)CC1 ZINC000554613113 516544511 /nfs/dbraw/zinc/54/45/11/516544511.db2.gz ZGSGWUIDHXIAQE-UHFFFAOYSA-N 1 1 372.473 2.947 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000544047916 516557523 /nfs/dbraw/zinc/55/75/23/516557523.db2.gz SNTVBOPHMPAGNZ-UONOGXRCSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@H]1CC[C@]2(CC[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120678 516597525 /nfs/dbraw/zinc/59/75/25/516597525.db2.gz VYMCLPVTPJTHKJ-YOEHRIQHSA-N 1 1 352.456 2.881 20 5 FFBDMO C[C@H]1CC[C@]2(CC[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000544120678 516597536 /nfs/dbraw/zinc/59/75/36/516597536.db2.gz VYMCLPVTPJTHKJ-YOEHRIQHSA-N 1 1 352.456 2.881 20 5 FFBDMO CC[C@H](C(=O)OC)N1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000554869122 516672776 /nfs/dbraw/zinc/67/27/76/516672776.db2.gz PQBSOKWAXIDXEV-NKAIQICCSA-N 1 1 361.442 2.567 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000532169369 516837368 /nfs/dbraw/zinc/83/73/68/516837368.db2.gz NMNPOYBYQWVWLS-NVXWUHKLSA-N 1 1 362.430 2.668 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541064556 516853824 /nfs/dbraw/zinc/85/38/24/516853824.db2.gz KKWQIERATZCHMO-GXTWGEPZSA-N 1 1 369.849 2.611 20 5 FFBDMO Cc1ncc2c(n1)CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C2 ZINC000536642784 516868130 /nfs/dbraw/zinc/86/81/30/516868130.db2.gz SONDYSHZBPBMHU-UHFFFAOYSA-N 1 1 364.409 2.652 20 5 FFBDMO Cc1ncc2c(n1)CC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C2 ZINC000536642784 516868137 /nfs/dbraw/zinc/86/81/37/516868137.db2.gz SONDYSHZBPBMHU-UHFFFAOYSA-N 1 1 364.409 2.652 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000548294591 516878348 /nfs/dbraw/zinc/87/83/48/516878348.db2.gz OANDUJOLUDOXCH-LJQANCHMSA-N 1 1 356.426 2.718 20 5 FFBDMO Cc1ccsc1[C@@H](CO)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548298494 516882309 /nfs/dbraw/zinc/88/23/09/516882309.db2.gz FMUXOAQMVNKCOO-CQSZACIVSA-N 1 1 350.396 2.654 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@H](C)OC3(CCC3)C2)c([N+](=O)[O-])c1 ZINC000519149611 516901079 /nfs/dbraw/zinc/90/10/79/516901079.db2.gz FEDNAEIKTBSLNW-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO CCc1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](CC)CC)cc1 ZINC000562187189 516950114 /nfs/dbraw/zinc/95/01/14/516950114.db2.gz WRFUSKFLHHSWOR-OAHLLOKOSA-N 1 1 359.430 2.693 20 5 FFBDMO CC[C@H](C)[C@H]1C[N@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847115 516957789 /nfs/dbraw/zinc/95/77/89/516957789.db2.gz RWTLQNRVAJETRE-KBXCAEBGSA-N 1 1 370.457 2.825 20 5 FFBDMO CC[C@H](C)[C@H]1C[N@@H+](Cc2ccc(C)nc2)CCN1c1ncc([N+](=O)[O-])cn1 ZINC000544847115 516957802 /nfs/dbraw/zinc/95/78/02/516957802.db2.gz RWTLQNRVAJETRE-KBXCAEBGSA-N 1 1 370.457 2.825 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1 ZINC000532540498 517026367 /nfs/dbraw/zinc/02/63/67/517026367.db2.gz LIVYQMDORDVLQA-UHFFFAOYSA-N 1 1 374.485 2.536 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@@H+](C)C(C)(C)C1 ZINC000519543752 517037204 /nfs/dbraw/zinc/03/72/04/517037204.db2.gz HIIXASNHEHAPFC-LLVKDONJSA-N 1 1 354.838 2.601 20 5 FFBDMO C[C@H](NC(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454600 517045457 /nfs/dbraw/zinc/04/54/57/517045457.db2.gz JREOXJYWGZABQM-HNAYVOBHSA-N 1 1 369.421 2.673 20 5 FFBDMO C[C@H](NC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1)c1cccc([N+](=O)[O-])c1 ZINC000525454600 517045466 /nfs/dbraw/zinc/04/54/66/517045466.db2.gz JREOXJYWGZABQM-HNAYVOBHSA-N 1 1 369.421 2.673 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000545156863 517075004 /nfs/dbraw/zinc/07/50/04/517075004.db2.gz LANQZUMKDBRZQI-CYBMUJFWSA-N 1 1 351.422 2.858 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(C)[nH+]c(N2CCCC2)c1 ZINC000519671583 517114954 /nfs/dbraw/zinc/11/49/54/517114954.db2.gz CDLCNAGFDMPNRN-UHFFFAOYSA-N 1 1 370.409 2.837 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CN1[C@H]1C[C@@H]1c1ccccc1 ZINC000537315851 517141426 /nfs/dbraw/zinc/14/14/26/517141426.db2.gz YAJXXHYKKQTXOA-XHSDSOJGSA-N 1 1 357.435 2.903 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](CCCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000548761168 517195946 /nfs/dbraw/zinc/19/59/46/517195946.db2.gz LACALNCSLNLMCC-HZPDHXFCSA-N 1 1 362.474 2.881 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C1 ZINC000541815863 517229508 /nfs/dbraw/zinc/22/95/08/517229508.db2.gz BPJRFMLLNTZBEK-OAHLLOKOSA-N 1 1 369.487 2.564 20 5 FFBDMO COc1ccc2c(c1)C[C@@H](C)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]2C ZINC000541988929 517325771 /nfs/dbraw/zinc/32/57/71/517325771.db2.gz CSZAUZCPFQDNST-ZIAGYGMSSA-N 1 1 357.410 2.773 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000545830098 517383748 /nfs/dbraw/zinc/38/37/48/517383748.db2.gz QRKSQHVLJBCRKS-QWHCGFSZSA-N 1 1 351.422 2.953 20 5 FFBDMO Cc1ccc(CNC(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000549156884 517428509 /nfs/dbraw/zinc/42/85/09/517428509.db2.gz QECKHOYYEHIMSZ-UHFFFAOYSA-N 1 1 359.401 2.833 20 5 FFBDMO Cc1ccc(CNC(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000549156884 517428519 /nfs/dbraw/zinc/42/85/19/517428519.db2.gz QECKHOYYEHIMSZ-UHFFFAOYSA-N 1 1 359.401 2.833 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000515915050 517511885 /nfs/dbraw/zinc/51/18/85/517511885.db2.gz NTGLBXPOVQYNGM-AWEZNQCLSA-N 1 1 366.437 2.857 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000542716193 517701632 /nfs/dbraw/zinc/70/16/32/517701632.db2.gz CSFJDPDBINJOBB-CYBMUJFWSA-N 1 1 350.394 2.930 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](c2ccccc2F)C1 ZINC000549813503 517723063 /nfs/dbraw/zinc/72/30/63/517723063.db2.gz OZIGVOJUDQLXLP-LSDHHAIUSA-N 1 1 360.385 2.963 20 5 FFBDMO Cc1sc(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000556934407 517757116 /nfs/dbraw/zinc/75/71/16/517757116.db2.gz VJYORHAYZAQTAI-UHFFFAOYSA-N 1 1 362.455 2.954 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2CO)cc1OC ZINC000542916532 517813849 /nfs/dbraw/zinc/81/38/49/517813849.db2.gz XNVYETBKFRGALE-ZFWWWQNUSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2CO)cc1OC ZINC000542916532 517813857 /nfs/dbraw/zinc/81/38/57/517813857.db2.gz XNVYETBKFRGALE-ZFWWWQNUSA-N 1 1 352.431 2.985 20 5 FFBDMO C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](c2ccccc2)C1 ZINC000557163535 517894701 /nfs/dbraw/zinc/89/47/01/517894701.db2.gz VXWWFSDJARIGMZ-SFHVURJKSA-N 1 1 351.410 2.960 20 5 FFBDMO C[C@H](O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000516956453 517939965 /nfs/dbraw/zinc/93/99/65/517939965.db2.gz IBLDRXYKNNPJFR-HNNXBMFYSA-N 1 1 357.410 2.806 20 5 FFBDMO C[C@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)s1)c1cccc([N+](=O)[O-])c1 ZINC000557263287 517941163 /nfs/dbraw/zinc/94/11/63/517941163.db2.gz ZOECSZDWQKSNGJ-NSHDSACASA-N 1 1 369.468 2.757 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000543185954 517954316 /nfs/dbraw/zinc/95/43/16/517954316.db2.gz BKOBWQLZFRATCT-SJORKVTESA-N 1 1 372.421 2.735 20 5 FFBDMO Cc1cc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)ccc1[N+](=O)[O-] ZINC000560677975 517967380 /nfs/dbraw/zinc/96/73/80/517967380.db2.gz ADNDEVUAYOKRLL-KRWDZBQOSA-N 1 1 355.394 2.722 20 5 FFBDMO CCCc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](CC)C2)c1[N+](=O)[O-] ZINC000522064517 517974016 /nfs/dbraw/zinc/97/40/16/517974016.db2.gz KTWAFNJHRBYGEX-ZDUSSCGKSA-N 1 1 365.478 2.901 20 5 FFBDMO CCC[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000539422493 518041931 /nfs/dbraw/zinc/04/19/31/518041931.db2.gz PZDYQEXFMHQXCC-SFHVURJKSA-N 1 1 357.458 2.778 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557537029 518061852 /nfs/dbraw/zinc/06/18/52/518061852.db2.gz KXPRUUWQWLZFEQ-JKSUJKDBSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557537029 518061861 /nfs/dbraw/zinc/06/18/61/518061861.db2.gz KXPRUUWQWLZFEQ-JKSUJKDBSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1 ZINC000539502769 518079765 /nfs/dbraw/zinc/07/97/65/518079765.db2.gz VYMOUFKAFWQTIQ-HOTGVXAUSA-N 1 1 363.458 2.909 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035616 518131241 /nfs/dbraw/zinc/13/12/41/518131241.db2.gz BSUGGUWVLXMAMD-HUUCEWRRSA-N 1 1 354.410 2.725 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000535035616 518131246 /nfs/dbraw/zinc/13/12/46/518131246.db2.gz BSUGGUWVLXMAMD-HUUCEWRRSA-N 1 1 354.410 2.725 20 5 FFBDMO COc1ccc(Cc2nc([C@H]3C[N@@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843681 518146243 /nfs/dbraw/zinc/14/62/43/518146243.db2.gz URQFMDCJHMINDY-QAPCUYQASA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(Cc2nc([C@H]3C[N@H+]4CCC[C@@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843681 518146247 /nfs/dbraw/zinc/14/62/47/518146247.db2.gz URQFMDCJHMINDY-QAPCUYQASA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(Cc2nc([C@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843286 518146535 /nfs/dbraw/zinc/14/65/35/518146535.db2.gz URQFMDCJHMINDY-CRAIPNDOSA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(Cc2nc([C@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843286 518146541 /nfs/dbraw/zinc/14/65/41/518146541.db2.gz URQFMDCJHMINDY-CRAIPNDOSA-N 1 1 374.397 2.503 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000535294329 518173465 /nfs/dbraw/zinc/17/34/65/518173465.db2.gz NFKIONFUIYLOCM-IBGZPJMESA-N 1 1 366.421 2.849 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000535294329 518173466 /nfs/dbraw/zinc/17/34/66/518173466.db2.gz NFKIONFUIYLOCM-IBGZPJMESA-N 1 1 366.421 2.849 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2nccc(C(N)=O)c2[N+](=O)[O-])cc1 ZINC000572570730 518250726 /nfs/dbraw/zinc/25/07/26/518250726.db2.gz ZUSNDDWVQRTYPA-NSHDSACASA-N 1 1 366.381 2.756 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(CN3CCOCC3)cc1)C2 ZINC000564198358 518346207 /nfs/dbraw/zinc/34/62/07/518346207.db2.gz SDSHEYBVCABQPR-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(CN3CCOCC3)cc1)C2 ZINC000564198358 518346210 /nfs/dbraw/zinc/34/62/10/518346210.db2.gz SDSHEYBVCABQPR-UHFFFAOYSA-N 1 1 367.449 2.985 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000567158205 518380053 /nfs/dbraw/zinc/38/00/53/518380053.db2.gz NIWUAUQKKSBCCC-UHFFFAOYSA-N 1 1 373.457 2.744 20 5 FFBDMO CC[N@H+]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C2CC2)CC1 ZINC000570052093 518419587 /nfs/dbraw/zinc/41/95/87/518419587.db2.gz BAJXQCHPOFPMOT-UHFFFAOYSA-N 1 1 356.430 2.720 20 5 FFBDMO CN(C)c1ccccc1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000576143020 518448767 /nfs/dbraw/zinc/44/87/67/518448767.db2.gz HFHBCJNJDKBSCJ-QGZVFWFLSA-N 1 1 359.426 2.533 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000581856113 518469912 /nfs/dbraw/zinc/46/99/12/518469912.db2.gz CLKQURZDWUIURX-NWDGAFQWSA-N 1 1 357.838 2.860 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@H+]2Cc2cccc(Cl)c2)nc1 ZINC000564484109 518470144 /nfs/dbraw/zinc/47/01/44/518470144.db2.gz GGBMTCZIWAFSIX-HNNXBMFYSA-N 1 1 361.833 2.927 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc(CC[NH+]2CCOCC2)cc1 ZINC000570309109 518544634 /nfs/dbraw/zinc/54/46/34/518544634.db2.gz IERZIPQNFPKGFB-UHFFFAOYSA-N 1 1 359.430 2.738 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@H]21 ZINC000585767606 518590539 /nfs/dbraw/zinc/59/05/39/518590539.db2.gz LSACHTBDMXOVIG-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO C[C@@H](CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1 ZINC000570591084 518681338 /nfs/dbraw/zinc/68/13/38/518681338.db2.gz DQVRRWMYTQQORM-CVEARBPZSA-N 1 1 362.474 2.899 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000567771051 518703209 /nfs/dbraw/zinc/70/32/09/518703209.db2.gz OCRJMEHEABPQPG-DZGCQCFKSA-N 1 1 369.487 2.651 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)O1 ZINC000579674135 518793310 /nfs/dbraw/zinc/79/33/10/518793310.db2.gz JALAYFIFTSGFIH-VNHYZAJKSA-N 1 1 359.430 2.549 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000588883358 518857212 /nfs/dbraw/zinc/85/72/12/518857212.db2.gz QLOWSTVZKJWBSL-MRXNPFEDSA-N 1 1 370.453 2.957 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@@H+](Cc2ccccc2)C1 ZINC000589484934 519015270 /nfs/dbraw/zinc/01/52/70/519015270.db2.gz GFDCQFXTQMGVQK-KRWDZBQOSA-N 1 1 370.453 2.965 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC[N@H+](C3CCCC3)CC2)c1 ZINC000589498608 519018085 /nfs/dbraw/zinc/01/80/85/519018085.db2.gz BKGDIAWADSMCFS-UHFFFAOYSA-N 1 1 361.442 2.832 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000577393786 519059594 /nfs/dbraw/zinc/05/95/94/519059594.db2.gz YXRDAJFAJPKORF-IEBWSBKVSA-N 1 1 360.385 2.905 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000577393786 519059602 /nfs/dbraw/zinc/05/96/02/519059602.db2.gz YXRDAJFAJPKORF-IEBWSBKVSA-N 1 1 360.385 2.905 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000577446153 519080857 /nfs/dbraw/zinc/08/08/57/519080857.db2.gz GIJAIOMIQYFMHV-OKILXGFUSA-N 1 1 364.446 2.778 20 5 FFBDMO CCC[N@@H+](C)[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000574476840 519173453 /nfs/dbraw/zinc/17/34/53/519173453.db2.gz BNEVUNWMDKADFZ-CQSZACIVSA-N 1 1 365.821 2.784 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590229342 519178116 /nfs/dbraw/zinc/17/81/16/519178116.db2.gz GQSKORACIYRODI-LLVKDONJSA-N 1 1 357.332 2.828 20 5 FFBDMO CSc1ccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000590537709 519259106 /nfs/dbraw/zinc/25/91/06/519259106.db2.gz IOOURGHOERRGPV-CHWSQXEVSA-N 1 1 353.419 2.575 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNc1ccc(N)c([N+](=O)[O-])n1 ZINC000590571335 519270130 /nfs/dbraw/zinc/27/01/30/519270130.db2.gz AFKIZMFJHSLYMH-AWEZNQCLSA-N 1 1 355.442 2.980 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000571816638 519290963 /nfs/dbraw/zinc/29/09/63/519290963.db2.gz QZEQFKXOXGLACH-UHFFFAOYSA-N 1 1 367.409 2.510 20 5 FFBDMO CC[N@H+]1CC[C@H]2OCCN(Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)[C@H]2C1 ZINC000578086210 519411522 /nfs/dbraw/zinc/41/15/22/519411522.db2.gz NZNSITRUHDULTC-JKSUJKDBSA-N 1 1 373.375 2.909 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1 ZINC000569229157 519445558 /nfs/dbraw/zinc/44/55/58/519445558.db2.gz AKMXVIKVNSOWFT-DYVFJYSZSA-N 1 1 368.441 2.861 20 5 FFBDMO O=C1CCCN1[C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000591054546 519492933 /nfs/dbraw/zinc/49/29/33/519492933.db2.gz CETXEECNLUISDN-INIZCTEOSA-N 1 1 361.442 2.841 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CCCNC2=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591245206 519561282 /nfs/dbraw/zinc/56/12/82/519561282.db2.gz QXOUFMPPZNBYDT-RDTXWAMCSA-N 1 1 357.410 2.955 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000566638469 519589846 /nfs/dbraw/zinc/58/98/46/519589846.db2.gz JJGYDRCRBYWJMJ-ZDUSSCGKSA-N 1 1 363.414 2.708 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[NH+]1CCC(SC)CC1 ZINC000602920183 519972654 /nfs/dbraw/zinc/97/26/54/519972654.db2.gz MKWKSXDFPRZTRL-LLVKDONJSA-N 1 1 353.444 2.758 20 5 FFBDMO CC(C)N(C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000602962366 519994773 /nfs/dbraw/zinc/99/47/73/519994773.db2.gz JYVIZECFGYRMHR-IBGZPJMESA-N 1 1 363.458 2.572 20 5 FFBDMO CC(C)N(C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000602965670 519997496 /nfs/dbraw/zinc/99/74/96/519997496.db2.gz LBVDEMJUISNPKQ-FQEVSTJZSA-N 1 1 371.437 2.834 20 5 FFBDMO CC(C)(C)n1nnc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000594512568 520008351 /nfs/dbraw/zinc/00/83/51/520008351.db2.gz WFQPFENUWANJTO-DZGCQCFKSA-N 1 1 358.446 2.837 20 5 FFBDMO O=C(NC1CC1)c1ccc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594604473 520050160 /nfs/dbraw/zinc/05/01/60/520050160.db2.gz ZORZQZBNOXUCOE-NVXWUHKLSA-N 1 1 358.442 2.916 20 5 FFBDMO CN1C[C@H]([N@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1=O ZINC000600177725 520102850 /nfs/dbraw/zinc/10/28/50/520102850.db2.gz CIWCFJZKIIRWPJ-OAHLLOKOSA-N 1 1 360.439 2.771 20 5 FFBDMO CN1C[C@H]([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1=O ZINC000600177725 520102861 /nfs/dbraw/zinc/10/28/61/520102861.db2.gz CIWCFJZKIIRWPJ-OAHLLOKOSA-N 1 1 360.439 2.771 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597584048 520119394 /nfs/dbraw/zinc/11/93/94/520119394.db2.gz XDEXLKHBFNKQSG-GJZGRUSLSA-N 1 1 367.446 2.965 20 5 FFBDMO CCCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000592004879 520130142 /nfs/dbraw/zinc/13/01/42/520130142.db2.gz CAEAIWYSMICAEO-OAHLLOKOSA-N 1 1 368.865 2.916 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000597680598 520172405 /nfs/dbraw/zinc/17/24/05/520172405.db2.gz XENDZLIEJFFUSP-CYBMUJFWSA-N 1 1 373.409 2.666 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000600316262 520200953 /nfs/dbraw/zinc/20/09/53/520200953.db2.gz YPWGZRZLSYUUON-CYBMUJFWSA-N 1 1 369.849 2.865 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H](C(=O)NCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000592155560 520231319 /nfs/dbraw/zinc/23/13/19/520231319.db2.gz OYDKMAMPWPGLAC-QGZVFWFLSA-N 1 1 369.421 2.742 20 5 FFBDMO COc1cc(C[NH2+]C/C=C/CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000594973088 520236499 /nfs/dbraw/zinc/23/64/99/520236499.db2.gz CSDIHWYVLBBONK-AATRIKPKSA-N 1 1 358.394 2.821 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000603400384 520247332 /nfs/dbraw/zinc/24/73/32/520247332.db2.gz HDEXKNRYJMDOOL-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCS(=O)(=O)c1ccccc1 ZINC000595007148 520252998 /nfs/dbraw/zinc/25/29/98/520252998.db2.gz KCRZADZBWYQYBU-CYBMUJFWSA-N 1 1 364.423 2.728 20 5 FFBDMO O=C(C[N@@H+]1CCCc2sccc2C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000609323499 520277874 /nfs/dbraw/zinc/27/78/74/520277874.db2.gz YFFXKSPOGFHMOM-UHFFFAOYSA-N 1 1 357.435 2.994 20 5 FFBDMO O=C(C[N@H+]1CCCc2sccc2C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000609323499 520277880 /nfs/dbraw/zinc/27/78/80/520277880.db2.gz YFFXKSPOGFHMOM-UHFFFAOYSA-N 1 1 357.435 2.994 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000600470895 520278498 /nfs/dbraw/zinc/27/84/98/520278498.db2.gz JOBZAGAWPVBHOJ-MRXNPFEDSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1 ZINC000597859374 520286146 /nfs/dbraw/zinc/28/61/46/520286146.db2.gz CZLFZJHZQNEWAS-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000597860968 520289279 /nfs/dbraw/zinc/28/92/79/520289279.db2.gz QMCVPEPNWTVAEC-ZDUSSCGKSA-N 1 1 371.441 2.835 20 5 FFBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(S(N)(=O)=O)cc2F)cc1[N+](=O)[O-] ZINC000592365483 520352636 /nfs/dbraw/zinc/35/26/36/520352636.db2.gz SWOIDNIBPNGSHO-LLVKDONJSA-N 1 1 367.402 2.541 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000603834241 520371372 /nfs/dbraw/zinc/37/13/72/520371372.db2.gz NAJMODOOHAIZQX-HNNXBMFYSA-N 1 1 369.425 2.901 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000603834066 520371415 /nfs/dbraw/zinc/37/14/15/520371415.db2.gz GJNJDPRVQFCBFU-CQSZACIVSA-N 1 1 370.409 2.939 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000603834066 520371431 /nfs/dbraw/zinc/37/14/31/520371431.db2.gz GJNJDPRVQFCBFU-CQSZACIVSA-N 1 1 370.409 2.939 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@@H](c2ccsc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000609673956 520403364 /nfs/dbraw/zinc/40/33/64/520403364.db2.gz SFCMRNMFSHLRNA-HNNXBMFYSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492577 520416155 /nfs/dbraw/zinc/41/61/55/520416155.db2.gz AXYQFCXKWFQABD-BZUAXINKSA-N 1 1 360.458 2.633 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000604441931 520563323 /nfs/dbraw/zinc/56/33/23/520563323.db2.gz WZBDXEUICZNUIK-UHFFFAOYSA-N 1 1 359.430 2.664 20 5 FFBDMO CC(C)[N@H+](C)CC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000604441931 520563328 /nfs/dbraw/zinc/56/33/28/520563328.db2.gz WZBDXEUICZNUIK-UHFFFAOYSA-N 1 1 359.430 2.664 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000604441931 520563338 /nfs/dbraw/zinc/56/33/38/520563338.db2.gz WZBDXEUICZNUIK-UHFFFAOYSA-N 1 1 359.430 2.664 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000592881212 520631779 /nfs/dbraw/zinc/63/17/79/520631779.db2.gz LOIYMACHPPUBDB-QAPCUYQASA-N 1 1 357.385 2.809 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000592883086 520633483 /nfs/dbraw/zinc/63/34/83/520633483.db2.gz VUUPZGOSELEEGS-AEFFLSMTSA-N 1 1 353.422 2.978 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000595684229 520648142 /nfs/dbraw/zinc/64/81/42/520648142.db2.gz MENDSCJOIWAMEP-MRXNPFEDSA-N 1 1 373.409 2.828 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H]3CCC4(CCOCC4)[C@H]3O)c2c1 ZINC000601161860 520666809 /nfs/dbraw/zinc/66/68/09/520666809.db2.gz VKQXLQKELVJWLK-ACJLOTCBSA-N 1 1 357.410 2.545 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000610445706 520691080 /nfs/dbraw/zinc/69/10/80/520691080.db2.gz FGJYQWSHZOWKJA-OAHLLOKOSA-N 1 1 356.426 2.670 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1F ZINC000595754153 520699807 /nfs/dbraw/zinc/69/98/07/520699807.db2.gz VNQSEWIRIBXRDB-INIZCTEOSA-N 1 1 361.373 2.741 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000598557998 520703791 /nfs/dbraw/zinc/70/37/91/520703791.db2.gz BEJPQZMATHPFKE-ZYSHUDEJSA-N 1 1 357.454 2.937 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)O1 ZINC000610476288 520704911 /nfs/dbraw/zinc/70/49/11/520704911.db2.gz VASYXCZOHKUADB-JKIFEVAISA-N 1 1 351.422 2.808 20 5 FFBDMO COc1cccc([C@@]2(C)CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000595766909 520709378 /nfs/dbraw/zinc/70/93/78/520709378.db2.gz MTZSCOZJJDTUFZ-FQEVSTJZSA-N 1 1 369.421 2.866 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c2ccncc21 ZINC000610489252 520712331 /nfs/dbraw/zinc/71/23/31/520712331.db2.gz SNOBOYBTUWUBDX-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO COC(=O)c1ccnc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000598589281 520729785 /nfs/dbraw/zinc/72/97/85/520729785.db2.gz HQCRZAVVTBZFKD-HZSPNIEDSA-N 1 1 362.430 2.618 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900243 520804596 /nfs/dbraw/zinc/80/45/96/520804596.db2.gz BYWQFHGDNHUXNU-MRXNPFEDSA-N 1 1 360.458 2.553 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000593188303 520810258 /nfs/dbraw/zinc/81/02/58/520810258.db2.gz BXNMYMAESILWCW-GMTAPVOTSA-N 1 1 370.247 2.910 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000593188805 520812821 /nfs/dbraw/zinc/81/28/21/520812821.db2.gz QBULVCHSGGLTMK-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595910631 520815179 /nfs/dbraw/zinc/81/51/79/520815179.db2.gz WKANZBPEORTUCG-CMVHYPBASA-N 1 1 354.406 2.956 20 5 FFBDMO NC(=O)c1cc(N2CC[NH+](C/C=C\c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000596055093 520881637 /nfs/dbraw/zinc/88/16/37/520881637.db2.gz DKDHZASUMZJPLW-DAXSKMNVSA-N 1 1 366.421 2.529 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1F ZINC000598914387 520914061 /nfs/dbraw/zinc/91/40/61/520914061.db2.gz BYSMXULXGFQUFR-MRXNPFEDSA-N 1 1 374.372 2.921 20 5 FFBDMO CC1(C)CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1Cc1ccccc1 ZINC000596115249 520921087 /nfs/dbraw/zinc/92/10/87/520921087.db2.gz SAFNKGWJKOOIRG-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000593340551 520921567 /nfs/dbraw/zinc/92/15/67/520921567.db2.gz WPVWEXASGGOSBU-UHFFFAOYSA-N 1 1 363.458 2.901 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC000593340551 520921575 /nfs/dbraw/zinc/92/15/75/520921575.db2.gz WPVWEXASGGOSBU-UHFFFAOYSA-N 1 1 363.458 2.901 20 5 FFBDMO Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCCCC[N@@H+](Cc2ccccc2)C1 ZINC000601728163 520921503 /nfs/dbraw/zinc/92/15/03/520921503.db2.gz NSFWRGGTONMBIR-INIZCTEOSA-N 1 1 371.441 2.503 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000596146590 520938095 /nfs/dbraw/zinc/93/80/95/520938095.db2.gz DZGOGDMXEIPDJI-QGZVFWFLSA-N 1 1 368.437 2.795 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000596146589 520938292 /nfs/dbraw/zinc/93/82/92/520938292.db2.gz DZGOGDMXEIPDJI-KRWDZBQOSA-N 1 1 368.437 2.795 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598994718 520967092 /nfs/dbraw/zinc/96/70/92/520967092.db2.gz HSJMIJIPZNUGBX-KRWDZBQOSA-N 1 1 360.458 2.844 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000611087588 520977143 /nfs/dbraw/zinc/97/71/43/520977143.db2.gz WITGVUOWKPWRAV-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1C ZINC000611087588 520977146 /nfs/dbraw/zinc/97/71/46/520977146.db2.gz WITGVUOWKPWRAV-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596218886 520977318 /nfs/dbraw/zinc/97/73/18/520977318.db2.gz NGNUZEYLAQDVMC-GUYCJALGSA-N 1 1 354.410 2.626 20 5 FFBDMO COc1cc(N2CC[N@H+](CC(C)(C)O)[C@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596223137 520979005 /nfs/dbraw/zinc/97/90/05/520979005.db2.gz QASRSWZDBGJYNH-LLVKDONJSA-N 1 1 357.838 2.538 20 5 FFBDMO COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596223137 520979014 /nfs/dbraw/zinc/97/90/14/520979014.db2.gz QASRSWZDBGJYNH-LLVKDONJSA-N 1 1 357.838 2.538 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-] ZINC000596231013 520985421 /nfs/dbraw/zinc/98/54/21/520985421.db2.gz NIBFYVJTRUACDR-VIFPVBQESA-N 1 1 350.762 2.658 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000596242778 520989772 /nfs/dbraw/zinc/98/97/72/520989772.db2.gz YLDSKDXIOFCMCU-MRXNPFEDSA-N 1 1 353.806 2.567 20 5 FFBDMO Cc1cc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000593496676 521032969 /nfs/dbraw/zinc/03/29/69/521032969.db2.gz VRLFQICXLHGHHM-RBUKOAKNSA-N 1 1 368.437 2.778 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000601969469 521046514 /nfs/dbraw/zinc/04/65/14/521046514.db2.gz DWMAOAGNFYAJKZ-DOTOQJQBSA-N 1 1 352.337 2.774 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000593559782 521076317 /nfs/dbraw/zinc/07/63/17/521076317.db2.gz NMFMADGXWJCLPV-LPHOPBHVSA-N 1 1 357.385 2.838 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H]([N@@H+](C)CCc2ccccc2)C1 ZINC000596462803 521085180 /nfs/dbraw/zinc/08/51/80/521085180.db2.gz TUQFJJSHJNXGDQ-KRWDZBQOSA-N 1 1 357.458 2.873 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(Cn3cnnc3)CC2)c1 ZINC000593677129 521149016 /nfs/dbraw/zinc/14/90/16/521149016.db2.gz ZOMWOAIALZVYFM-UHFFFAOYSA-N 1 1 367.356 2.700 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1Cc1ccccc1)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000611484802 521181320 /nfs/dbraw/zinc/18/13/20/521181320.db2.gz MVFYFVGNAGOUTQ-LJQANCHMSA-N 1 1 366.421 2.539 20 5 FFBDMO COC[C@H]1CCC[N@@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000611518606 521198421 /nfs/dbraw/zinc/19/84/21/521198421.db2.gz PVWLBCJCEQCQDJ-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO COC[C@H]1CCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000611518606 521198428 /nfs/dbraw/zinc/19/84/28/521198428.db2.gz PVWLBCJCEQCQDJ-GFCCVEGCSA-N 1 1 360.357 2.858 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC1 ZINC000611525461 521203101 /nfs/dbraw/zinc/20/31/01/521203101.db2.gz DQDVVXVLEMOAGI-UHFFFAOYSA-N 1 1 350.463 2.618 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000611560789 521219794 /nfs/dbraw/zinc/21/97/94/521219794.db2.gz XHRDTQNPCKGQBE-YQVWRLOYSA-N 1 1 358.442 2.949 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553136 521293545 /nfs/dbraw/zinc/29/35/45/521293545.db2.gz OJAQTJDGUDBEQV-OLZOCXBDSA-N 1 1 351.428 2.512 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c([N+](=O)[O-])c1 ZINC000599553136 521293553 /nfs/dbraw/zinc/29/35/53/521293553.db2.gz OJAQTJDGUDBEQV-OLZOCXBDSA-N 1 1 351.428 2.512 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553348 521293763 /nfs/dbraw/zinc/29/37/63/521293763.db2.gz QBKGCCNMTPANKR-YUTCNCBUSA-N 1 1 365.455 2.900 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553348 521293775 /nfs/dbraw/zinc/29/37/75/521293775.db2.gz QBKGCCNMTPANKR-YUTCNCBUSA-N 1 1 365.455 2.900 20 5 FFBDMO O=C(CC[N@H+]1CCc2nc(C3CC3)ncc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000599619305 521337574 /nfs/dbraw/zinc/33/75/74/521337574.db2.gz GNXRXXBRZXJGKJ-UHFFFAOYSA-N 1 1 367.409 2.649 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602430597 521341949 /nfs/dbraw/zinc/34/19/49/521341949.db2.gz JLPQERBIWLYTCS-LBPRGKRZSA-N 1 1 359.348 2.962 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000599656835 521369674 /nfs/dbraw/zinc/36/96/74/521369674.db2.gz VPIMUCNSSPTQRZ-UMVBOHGHSA-N 1 1 366.389 2.906 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000599656835 521369676 /nfs/dbraw/zinc/36/96/76/521369676.db2.gz VPIMUCNSSPTQRZ-UMVBOHGHSA-N 1 1 366.389 2.906 20 5 FFBDMO CN(C)[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000602503312 521384948 /nfs/dbraw/zinc/38/49/48/521384948.db2.gz LURCQKWQMYZGRE-MRXNPFEDSA-N 1 1 354.410 2.999 20 5 FFBDMO CC(C)(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])S(C)(=O)=O ZINC000602565160 521413800 /nfs/dbraw/zinc/41/38/00/521413800.db2.gz ZVBSGQJPXOKUPW-UHFFFAOYSA-N 1 1 354.350 2.526 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000594198966 521464781 /nfs/dbraw/zinc/46/47/81/521464781.db2.gz WQICGJKXWJUHKM-UONOGXRCSA-N 1 1 369.368 2.943 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594204715 521469012 /nfs/dbraw/zinc/46/90/12/521469012.db2.gz XOKHXFBGRJYQLV-AEFFLSMTSA-N 1 1 369.425 2.527 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc([N+](=O)[O-])c2ccncc12 ZINC000599831962 521499440 /nfs/dbraw/zinc/49/94/40/521499440.db2.gz BTWMVJJMOUEUEV-QGZVFWFLSA-N 1 1 357.414 2.947 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)[C@H]2C1 ZINC000599832685 521501809 /nfs/dbraw/zinc/50/18/09/521501809.db2.gz IGUABJJKGAPLAH-PXAZEXFGSA-N 1 1 355.398 2.701 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000602783305 521528732 /nfs/dbraw/zinc/52/87/32/521528732.db2.gz OJYWCKPVCVCCKK-MCFWBGNESA-N 1 1 350.444 2.530 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594284292 521537019 /nfs/dbraw/zinc/53/70/19/521537019.db2.gz UXLCAVWDTNONJK-ZWKOTPCHSA-N 1 1 360.458 2.796 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)c([N+](=O)[O-])n1 ZINC000602809776 521545810 /nfs/dbraw/zinc/54/58/10/521545810.db2.gz DPIZGMJXPKEPIY-AWEZNQCLSA-N 1 1 354.414 2.590 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@](O)(C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597203914 521573027 /nfs/dbraw/zinc/57/30/27/521573027.db2.gz ANWGPEJWZWTFEK-LJQANCHMSA-N 1 1 356.426 2.732 20 5 FFBDMO Cc1ccc(NCCCNC(=O)NCc2cccc([N+](=O)[O-])c2C)[nH+]c1 ZINC000478755729 561174099 /nfs/dbraw/zinc/17/40/99/561174099.db2.gz SXZJUGHIAMMFLP-UHFFFAOYSA-N 1 1 357.414 2.908 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ncnc3cccc([N+](=O)[O-])c32)C[C@H](C)O1 ZINC000509057922 561783121 /nfs/dbraw/zinc/78/31/21/561783121.db2.gz QVMBDACKHACRCG-BETUJISGSA-N 1 1 359.430 2.838 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CCNc1nc(N2CCOCC2)cc[nH+]1 ZINC000611493843 554637957 /nfs/dbraw/zinc/63/79/57/554637957.db2.gz GYPDEZSTCHPMKG-UHFFFAOYSA-N 1 1 363.805 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)nc1 ZINC000512737893 561913823 /nfs/dbraw/zinc/91/38/23/561913823.db2.gz AGTNWZJARICTMX-UHFFFAOYSA-N 1 1 355.442 2.610 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1C[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164790786 721397130 /nfs/dbraw/zinc/39/71/30/721397130.db2.gz YFGVXCKIDQXABY-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1C[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2C1 ZINC001164790786 721397134 /nfs/dbraw/zinc/39/71/34/721397134.db2.gz YFGVXCKIDQXABY-PHIMTYICSA-N 1 1 365.846 2.668 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C[C@H](C)O1 ZINC000152997569 728770323 /nfs/dbraw/zinc/77/03/23/728770323.db2.gz FPKZAGGLBAXCKK-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO Cn1nccc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000856797452 730358407 /nfs/dbraw/zinc/35/84/07/730358407.db2.gz BNVBBBDAZGLOBW-QGZVFWFLSA-N 1 1 364.833 2.927 20 5 FFBDMO CCN(C(=O)c1cccc([N+](=O)[O-])c1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000857305354 730390254 /nfs/dbraw/zinc/39/02/54/730390254.db2.gz DIXAELGAPWHHAB-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccns2)c([N+](=O)[O-])c1 ZINC000860053966 730474440 /nfs/dbraw/zinc/47/44/40/730474440.db2.gz DZKKFVZFFATLTI-UWVGGRQHSA-N 1 1 350.400 2.738 20 5 FFBDMO CCCC[N@@H+](C)CCNS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1Cl ZINC000779893843 738494356 /nfs/dbraw/zinc/49/43/56/738494356.db2.gz WFDKFQSCOJMMOB-UHFFFAOYSA-N 1 1 363.867 2.567 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)NCCc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000868480605 731296640 /nfs/dbraw/zinc/29/66/40/731296640.db2.gz BKYOBZYYSPJTDA-HIFRSBDPSA-N 1 1 366.849 2.526 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(=O)NCC(F)(F)F ZINC000872027090 731722226 /nfs/dbraw/zinc/72/22/26/731722226.db2.gz HHDKHBUEGXBOCX-QMMMGPOBSA-N 1 1 351.350 2.646 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H](N1CCOCC1)C(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872071525 731726826 /nfs/dbraw/zinc/72/68/26/731726826.db2.gz QQKPBNKPKGSILT-ZWNOBZJWSA-N 1 1 365.327 2.648 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@@H+]1CCCO ZINC000872074961 731726885 /nfs/dbraw/zinc/72/68/85/731726885.db2.gz KZMFBUCGGWYIEK-HIFRSBDPSA-N 1 1 353.488 2.814 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@H+]1CCCO ZINC000872074961 731726889 /nfs/dbraw/zinc/72/68/89/731726889.db2.gz KZMFBUCGGWYIEK-HIFRSBDPSA-N 1 1 353.488 2.814 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@H]2CCC[N@H+]3C)ncc1[N+](=O)[O-] ZINC000872778396 731830136 /nfs/dbraw/zinc/83/01/36/731830136.db2.gz AEDHIYARZUMZJR-WDEREUQCSA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3[C@H]2CCC[N@@H+]3C)ncc1[N+](=O)[O-] ZINC000872778396 731830141 /nfs/dbraw/zinc/83/01/41/731830141.db2.gz AEDHIYARZUMZJR-WDEREUQCSA-N 1 1 355.236 2.734 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000780768252 738575002 /nfs/dbraw/zinc/57/50/02/738575002.db2.gz QJPKWDDLHWLWGH-HUUCEWRRSA-N 1 1 364.496 2.856 20 5 FFBDMO CC(C)S(=O)(=O)CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000877536436 732383246 /nfs/dbraw/zinc/38/32/46/732383246.db2.gz PRGIEERAFSEDEW-UHFFFAOYSA-N 1 1 354.350 2.526 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878336204 732516225 /nfs/dbraw/zinc/51/62/25/732516225.db2.gz UXEIFBFBNYIOGV-QWRGUYRKSA-N 1 1 365.821 2.823 20 5 FFBDMO C[C@](CO)([NH2+]Cc1ccnc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000879270871 732676470 /nfs/dbraw/zinc/67/64/70/732676470.db2.gz BNRUNGPFOXJAAV-OAHLLOKOSA-N 1 1 366.215 2.750 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000880005892 732817371 /nfs/dbraw/zinc/81/73/71/732817371.db2.gz DSSVFENLICQCFG-ZFWWWQNUSA-N 1 1 363.439 2.589 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](C(F)(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000880053155 732834150 /nfs/dbraw/zinc/83/41/50/732834150.db2.gz PHKXUYILCXUEGN-CYBMUJFWSA-N 1 1 361.320 2.577 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCN1 ZINC000880167136 732858897 /nfs/dbraw/zinc/85/88/97/732858897.db2.gz HOKXUIPLUCVHFZ-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CCN1 ZINC000880167136 732858901 /nfs/dbraw/zinc/85/89/01/732858901.db2.gz HOKXUIPLUCVHFZ-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000886141023 733753323 /nfs/dbraw/zinc/75/33/23/733753323.db2.gz VRQAQPGFISTSLC-AWEZNQCLSA-N 1 1 350.419 2.725 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](CNC(=O)OC(C)(C)C)C1CC1 ZINC000886141023 733753328 /nfs/dbraw/zinc/75/33/28/733753328.db2.gz VRQAQPGFISTSLC-AWEZNQCLSA-N 1 1 350.419 2.725 20 5 FFBDMO CN1C(=O)C[C@H]([NH2+]Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000886169821 733756722 /nfs/dbraw/zinc/75/67/22/733756722.db2.gz JKPFJJFCRCXUSY-GOEBONIOSA-N 1 1 360.801 2.705 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827069 733845185 /nfs/dbraw/zinc/84/51/85/733845185.db2.gz CROXUMUWUQGQMB-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCCO2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000886827069 733845188 /nfs/dbraw/zinc/84/51/88/733845188.db2.gz CROXUMUWUQGQMB-XHDPSFHLSA-N 1 1 353.806 2.688 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3c(Cl)n[nH]c3C3CC3)C2)nc1 ZINC000892078657 734512503 /nfs/dbraw/zinc/51/25/03/734512503.db2.gz PXMSGAAKLXGMNF-NSHDSACASA-N 1 1 362.821 2.930 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3c(Cl)n[nH]c3C3CC3)C2)nc1 ZINC000892078657 734512505 /nfs/dbraw/zinc/51/25/05/734512505.db2.gz PXMSGAAKLXGMNF-NSHDSACASA-N 1 1 362.821 2.930 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)s1 ZINC000895570236 735025537 /nfs/dbraw/zinc/02/55/37/735025537.db2.gz RPMCMYZRWRQWEZ-MNOVXSKESA-N 1 1 351.457 2.591 20 5 FFBDMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl ZINC000895888349 735070455 /nfs/dbraw/zinc/07/04/55/735070455.db2.gz SUTYLFQGBNMEHO-ZETCQYMHSA-N 1 1 350.177 2.865 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)ccc1C(F)(F)F ZINC000897221083 735207847 /nfs/dbraw/zinc/20/78/47/735207847.db2.gz GZOLSJIETOVTFN-UONOGXRCSA-N 1 1 359.348 2.649 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)[C@@H]2C1 ZINC000897826188 735280965 /nfs/dbraw/zinc/28/09/65/735280965.db2.gz VAUXOWMCXWLPML-GMSGAONNSA-N 1 1 362.188 2.817 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000749880935 735757871 /nfs/dbraw/zinc/75/78/71/735757871.db2.gz YHAHACKFRKVIQJ-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO CC(C)[N@@H+](C)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000755010100 736226304 /nfs/dbraw/zinc/22/63/04/736226304.db2.gz ZANUZBPJUJKMFB-UHFFFAOYSA-N 1 1 362.199 2.566 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](C2CCOCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000755057591 736229536 /nfs/dbraw/zinc/22/95/36/736229536.db2.gz SAONZESWXGPWIZ-CYBMUJFWSA-N 1 1 367.833 2.935 20 5 FFBDMO C[N@H+]1CC[C@](O)(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000762815749 736870209 /nfs/dbraw/zinc/87/02/09/736870209.db2.gz IHDBYMGQGJCWAE-LBPRGKRZSA-N 1 1 353.728 2.746 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CCCO1 ZINC000763787466 736968555 /nfs/dbraw/zinc/96/85/55/736968555.db2.gz VYELAGXMJJRSFY-LBPRGKRZSA-N 1 1 370.837 2.871 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000910285418 737052971 /nfs/dbraw/zinc/05/29/71/737052971.db2.gz YSZVSSPAUNPWOV-NSHDSACASA-N 1 1 357.357 2.753 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc4nsnc43)C2)nc1 ZINC000766894037 737272401 /nfs/dbraw/zinc/27/24/01/737272401.db2.gz IJEQJFJVGGILHJ-GFCCVEGCSA-N 1 1 356.411 2.681 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880867 738135344 /nfs/dbraw/zinc/13/53/44/738135344.db2.gz RNRDKVBNMJADKA-KBPBESRZSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880867 738135347 /nfs/dbraw/zinc/13/53/47/738135347.db2.gz RNRDKVBNMJADKA-KBPBESRZSA-N 1 1 356.806 2.791 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000778245025 738366475 /nfs/dbraw/zinc/36/64/75/738366475.db2.gz HGDBKGLQGDVMBJ-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000778245025 738366480 /nfs/dbraw/zinc/36/64/80/738366480.db2.gz HGDBKGLQGDVMBJ-ABAIWWIYSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000778245028 738366716 /nfs/dbraw/zinc/36/67/16/738366716.db2.gz HGDBKGLQGDVMBJ-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000778245028 738366720 /nfs/dbraw/zinc/36/67/20/738366720.db2.gz HGDBKGLQGDVMBJ-XHDPSFHLSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785727801 738991675 /nfs/dbraw/zinc/99/16/75/738991675.db2.gz JJSBUHAGSFYVKN-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000785727801 738991678 /nfs/dbraw/zinc/99/16/78/738991678.db2.gz JJSBUHAGSFYVKN-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3occc3Br)CC2)n1 ZINC000787287888 739123111 /nfs/dbraw/zinc/12/31/11/739123111.db2.gz BLYCACCDKFHZOD-UHFFFAOYSA-N 1 1 355.192 2.984 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000930882473 739177316 /nfs/dbraw/zinc/17/73/16/739177316.db2.gz LIWPNZKIHOQQQN-LSDHHAIUSA-N 1 1 350.444 2.605 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(CCC2)[C@H]1C1CC[NH+](CC[N+](=O)[O-])CC1 ZINC000931706723 739314333 /nfs/dbraw/zinc/31/43/33/739314333.db2.gz JKXHBEGOOBISQU-OAHLLOKOSA-N 1 1 353.463 2.765 20 5 FFBDMO CC(C)(C)OC[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932170550 739398095 /nfs/dbraw/zinc/39/80/95/739398095.db2.gz GKKRTJNQOVZRDE-LSDHHAIUSA-N 1 1 352.431 2.614 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436149 739453709 /nfs/dbraw/zinc/45/37/09/739453709.db2.gz HIGQREOSWFXADM-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436149 739453712 /nfs/dbraw/zinc/45/37/12/739453712.db2.gz HIGQREOSWFXADM-AAEUAGOBSA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436151 739453857 /nfs/dbraw/zinc/45/38/57/739453857.db2.gz HIGQREOSWFXADM-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO C[C@H](O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000790436151 739453860 /nfs/dbraw/zinc/45/38/60/739453860.db2.gz HIGQREOSWFXADM-WCQYABFASA-N 1 1 355.822 2.812 20 5 FFBDMO O=C(CC[N@H+]1CCOC[C@H]1CC1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000933209925 739583807 /nfs/dbraw/zinc/58/38/07/739583807.db2.gz RZJYEUBEHHMUTR-CQSZACIVSA-N 1 1 351.378 2.563 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@H]1C ZINC000933371257 739611605 /nfs/dbraw/zinc/61/16/05/739611605.db2.gz SKBDCAAALVHGIP-NXEZZACHSA-N 1 1 372.828 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CCCSC[C@@H]2C2CC2)cc1 ZINC000933914024 739703967 /nfs/dbraw/zinc/70/39/67/739703967.db2.gz GNGIWNVOYBXAKW-MRXNPFEDSA-N 1 1 370.496 2.586 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CCCSC[C@@H]2C2CC2)cc1 ZINC000933914024 739703972 /nfs/dbraw/zinc/70/39/72/739703972.db2.gz GNGIWNVOYBXAKW-MRXNPFEDSA-N 1 1 370.496 2.586 20 5 FFBDMO C[C@@H]1CSCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000934301607 739763225 /nfs/dbraw/zinc/76/32/25/739763225.db2.gz LIUNLRRSUXTBRE-GFCCVEGCSA-N 1 1 351.428 2.720 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](Cc2nccs2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000934334121 739767625 /nfs/dbraw/zinc/76/76/25/739767625.db2.gz BNECPXKYLOUNJH-CYBMUJFWSA-N 1 1 360.439 2.945 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000934392852 739780496 /nfs/dbraw/zinc/78/04/96/739780496.db2.gz CYLOKQWSEZAZSV-NWDGAFQWSA-N 1 1 351.834 2.922 20 5 FFBDMO CN(C)[S@](C)(=O)=NCC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000934761506 739834246 /nfs/dbraw/zinc/83/42/46/739834246.db2.gz ZBQXUHJLDVFUAX-RUZDIDTESA-N 1 1 372.466 2.520 20 5 FFBDMO CCOC(=O)/C(=C/c1ncc(C[NH+](C)C)s1)c1ccc([N+](=O)[O-])cn1 ZINC000794711266 739922921 /nfs/dbraw/zinc/92/29/21/739922921.db2.gz CBQBWUOGTDGDOJ-NTUHNPAUSA-N 1 1 362.411 2.612 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000796162022 740110037 /nfs/dbraw/zinc/11/00/37/740110037.db2.gz XLOJLPFCXLLKBZ-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000796162022 740110039 /nfs/dbraw/zinc/11/00/39/740110039.db2.gz XLOJLPFCXLLKBZ-AWEZNQCLSA-N 1 1 351.403 2.704 20 5 FFBDMO COC(=O)[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000796296389 740128411 /nfs/dbraw/zinc/12/84/11/740128411.db2.gz TUKZWRWTTIAXAC-CQSZACIVSA-N 1 1 362.304 2.531 20 5 FFBDMO COC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000796296389 740128413 /nfs/dbraw/zinc/12/84/13/740128413.db2.gz TUKZWRWTTIAXAC-CQSZACIVSA-N 1 1 362.304 2.531 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccc(Cl)cc1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963792292 740656186 /nfs/dbraw/zinc/65/61/86/740656186.db2.gz WEKXAIRBAYTWSG-YVXVDGILSA-N 1 1 363.845 2.522 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[NH+](C)C ZINC000803496161 740804404 /nfs/dbraw/zinc/80/44/04/740804404.db2.gz XOWFEBUHLMWUTH-IINYFYTJSA-N 1 1 371.821 2.705 20 5 FFBDMO CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000804407212 740869819 /nfs/dbraw/zinc/86/98/19/740869819.db2.gz RHYXFKKSWUXUKG-HNNXBMFYSA-N 1 1 354.838 2.603 20 5 FFBDMO Cn1cc[nH+]c1N1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809965305 741367523 /nfs/dbraw/zinc/36/75/23/741367523.db2.gz HFAPUOLIDGGZFP-UHFFFAOYSA-N 1 1 370.240 2.957 20 5 FFBDMO O=C(C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])NCc1ccco1 ZINC000811472802 741527148 /nfs/dbraw/zinc/52/71/48/741527148.db2.gz LDSLXHPUHIAYJP-UHFFFAOYSA-N 1 1 358.181 2.901 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)s1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001029964461 742824014 /nfs/dbraw/zinc/82/40/14/742824014.db2.gz JUNVDGGQOMTXPO-ZIAGYGMSSA-N 1 1 371.890 2.737 20 5 FFBDMO C[N@@H+](Cc1ccc(Cl)s1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964461 742824020 /nfs/dbraw/zinc/82/40/20/742824020.db2.gz JUNVDGGQOMTXPO-ZIAGYGMSSA-N 1 1 371.890 2.737 20 5 FFBDMO C[N@H+](Cc1ccc(Cl)s1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001029964461 742824029 /nfs/dbraw/zinc/82/40/29/742824029.db2.gz JUNVDGGQOMTXPO-ZIAGYGMSSA-N 1 1 371.890 2.737 20 5 FFBDMO Cc1cccc(Cl)c1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034645957 742928472 /nfs/dbraw/zinc/92/84/72/742928472.db2.gz XLMKRJJCCQHIJG-VMUDFCTBSA-N 1 1 365.861 2.831 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000838513045 746655563 /nfs/dbraw/zinc/65/55/63/746655563.db2.gz LOTPZULBDQGYPU-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839393238 746821304 /nfs/dbraw/zinc/82/13/04/746821304.db2.gz YNXOKGQWMPHNAN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839393238 746821311 /nfs/dbraw/zinc/82/13/11/746821311.db2.gz YNXOKGQWMPHNAN-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839417153 746825484 /nfs/dbraw/zinc/82/54/84/746825484.db2.gz YSRDSVKKBGCZKT-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839417153 746825486 /nfs/dbraw/zinc/82/54/86/746825486.db2.gz YSRDSVKKBGCZKT-NSHDSACASA-N 1 1 370.247 2.914 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498323 746840768 /nfs/dbraw/zinc/84/07/68/746840768.db2.gz SDRUMQMHTUHIIQ-GJZGRUSLSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839498323 746840775 /nfs/dbraw/zinc/84/07/75/746840775.db2.gz SDRUMQMHTUHIIQ-GJZGRUSLSA-N 1 1 355.822 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](NCCC[NH+]2CCOCC2)C(F)(F)F)c1F ZINC000839651432 746882315 /nfs/dbraw/zinc/88/23/15/746882315.db2.gz FOJPQYXGLLYPJE-AWEZNQCLSA-N 1 1 365.327 2.649 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000839796999 746924207 /nfs/dbraw/zinc/92/42/07/746924207.db2.gz GBKXCJGNEVWGAM-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COc1ccc(CC(=O)OC[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000842834082 747702217 /nfs/dbraw/zinc/70/22/17/747702217.db2.gz QZHJSKNCTGEYIO-HNNXBMFYSA-N 1 1 350.415 2.810 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000843433152 747836544 /nfs/dbraw/zinc/83/65/44/747836544.db2.gz VCHCAOUBMQJKAC-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000843433152 747836551 /nfs/dbraw/zinc/83/65/51/747836551.db2.gz VCHCAOUBMQJKAC-ZDUSSCGKSA-N 1 1 365.739 2.749 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000853240765 750036171 /nfs/dbraw/zinc/03/61/71/750036171.db2.gz FJDJOABGWCFMDB-GHMZBOCLSA-N 1 1 356.220 2.632 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000853240769 750036455 /nfs/dbraw/zinc/03/64/55/750036455.db2.gz FJDJOABGWCFMDB-QWRGUYRKSA-N 1 1 356.220 2.632 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)Nc2ccc([C@H](C)[NH+]3CCOCC3)cc2)n1 ZINC001125936482 971759876 /nfs/dbraw/zinc/75/98/76/971759876.db2.gz TWQKFRGJPKRYIG-AWEZNQCLSA-N 1 1 370.409 2.944 20 5 FFBDMO O=C1CN(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC001116021081 1032068256 /nfs/dbraw/zinc/06/82/56/1032068256.db2.gz DVHQUJRJOCXELA-CABCVRRESA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000134885671 960093514 /nfs/dbraw/zinc/09/35/14/960093514.db2.gz WMJVYVJVXGRZTG-NVXWUHKLSA-N 1 1 369.421 2.753 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]C1(c2ncccn2)CCC1 ZINC001175724239 1013544619 /nfs/dbraw/zinc/54/46/19/1013544619.db2.gz KFMLRXIKUGXZJD-UHFFFAOYSA-N 1 1 355.398 2.691 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](c2ncccn2)C1 ZINC001176524906 1013722087 /nfs/dbraw/zinc/72/20/87/1013722087.db2.gz VVIWNGRPXZNIKM-JSGCOSHPSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](c2ncccn2)C1 ZINC001176524906 1013722090 /nfs/dbraw/zinc/72/20/90/1013722090.db2.gz VVIWNGRPXZNIKM-JSGCOSHPSA-N 1 1 366.381 2.985 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@](O)(c3ccccc3)C2)c1[N+](=O)[O-] ZINC000895587013 970762576 /nfs/dbraw/zinc/76/25/76/970762576.db2.gz FJJYNPKXUHTJBM-LJQANCHMSA-N 1 1 358.394 2.793 20 5 FFBDMO C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313084856 972622705 /nfs/dbraw/zinc/62/27/05/972622705.db2.gz XHVWLXQZHIKJFD-ZBFHGGJFSA-N 1 1 368.437 2.817 20 5 FFBDMO Cc1ccc(CNC(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000876171044 1014157808 /nfs/dbraw/zinc/15/78/08/1014157808.db2.gz ISYHHRFAWHPXDA-QGZVFWFLSA-N 1 1 360.458 2.777 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC000985431011 974068423 /nfs/dbraw/zinc/06/84/23/974068423.db2.gz LNIAVMKRAIMBEI-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)c1ccc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985431011 974068430 /nfs/dbraw/zinc/06/84/30/974068430.db2.gz LNIAVMKRAIMBEI-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO CC(C)c1ccc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000985431011 974068437 /nfs/dbraw/zinc/06/84/37/974068437.db2.gz LNIAVMKRAIMBEI-RTBURBONSA-N 1 1 359.470 2.898 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1CCCCCC1)C2 ZINC000981763381 976763828 /nfs/dbraw/zinc/76/38/28/976763828.db2.gz HXOKWNJGUYEOEN-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CCC1CCCCCC1)C2 ZINC000981763381 976763833 /nfs/dbraw/zinc/76/38/33/976763833.db2.gz HXOKWNJGUYEOEN-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1CCCCCC1)C2 ZINC000981763381 976763843 /nfs/dbraw/zinc/76/38/43/976763843.db2.gz HXOKWNJGUYEOEN-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO Cn1cc(CN[C@@H]2Cc3ccccc3[C@H]2[NH3+])c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000904459796 980280909 /nfs/dbraw/zinc/28/09/09/980280909.db2.gz XDGXOPOBYNTDQQ-RTBURBONSA-N 1 1 363.421 2.710 20 5 FFBDMO O=C(CC[NH2+][C@H]1c2ccccc2OC[C@@H]1F)Nc1ccccc1[N+](=O)[O-] ZINC000905535555 980459062 /nfs/dbraw/zinc/45/90/62/980459062.db2.gz BIRKGLPPQHVPHZ-UGSOOPFHSA-N 1 1 359.357 2.985 20 5 FFBDMO COc1ccc(CNC2CC([NH3+])C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000906511224 980674090 /nfs/dbraw/zinc/67/40/90/980674090.db2.gz ZHUJXHQUZUTLCE-UHFFFAOYSA-N 1 1 357.410 2.762 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1cnn(CC3CCC3)c1)OCCO2 ZINC000897433222 980779781 /nfs/dbraw/zinc/77/97/81/980779781.db2.gz SGVAVDLFGBSMNM-UHFFFAOYSA-N 1 1 358.398 2.652 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(C2(O)CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000897528528 981551525 /nfs/dbraw/zinc/55/15/25/981551525.db2.gz KCZXRGUVUMXKAS-INIZCTEOSA-N 1 1 356.426 2.703 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910296444 981902476 /nfs/dbraw/zinc/90/24/76/981902476.db2.gz MXOPPDIBNKYPIX-OAHLLOKOSA-N 1 1 360.458 2.751 20 5 FFBDMO C[N@H+]1CCCN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 ZINC000046404462 984676165 /nfs/dbraw/zinc/67/61/65/984676165.db2.gz FYADUNYCRZTJPE-UHFFFAOYSA-N 1 1 354.410 2.989 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)c(N)c([N+](=O)[O-])c1 ZINC000171450735 985285306 /nfs/dbraw/zinc/28/53/06/985285306.db2.gz NGASCZJZGGDOEU-GFCCVEGCSA-N 1 1 374.466 2.724 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)c(N)c([N+](=O)[O-])c1 ZINC000171450735 985285315 /nfs/dbraw/zinc/28/53/15/985285315.db2.gz NGASCZJZGGDOEU-GFCCVEGCSA-N 1 1 374.466 2.724 20 5 FFBDMO C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(N2CCCCC2=O)cc1 ZINC000878631940 1015141745 /nfs/dbraw/zinc/14/17/45/1015141745.db2.gz BLQYXERNUJHQCW-ZDUSSCGKSA-N 1 1 357.414 2.696 20 5 FFBDMO CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(C)cc1 ZINC000173832159 986000397 /nfs/dbraw/zinc/00/03/97/986000397.db2.gz KZIKQXNLPOGQIC-IBGZPJMESA-N 1 1 371.437 2.922 20 5 FFBDMO CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(C)cc1 ZINC000173832159 986000406 /nfs/dbraw/zinc/00/04/06/986000406.db2.gz KZIKQXNLPOGQIC-IBGZPJMESA-N 1 1 371.437 2.922 20 5 FFBDMO Cc1cc(NCC2([NH+]3CCCC3)COC2)c([N+](=O)[O-])cc1Br ZINC001168448131 987232178 /nfs/dbraw/zinc/23/21/78/987232178.db2.gz PXYXUKKMESDCSY-UHFFFAOYSA-N 1 1 370.247 2.942 20 5 FFBDMO Cc1ccc2ccccc2c1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001002791033 987482843 /nfs/dbraw/zinc/48/28/43/987482843.db2.gz GULACDMOOQPNGG-UYAOXDASSA-N 1 1 367.449 2.894 20 5 FFBDMO Cc1ccc(N2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)[C@@H](C)C2)cc1C ZINC000761668489 987692783 /nfs/dbraw/zinc/69/27/83/987692783.db2.gz GATSUEVZTUZIAZ-KRWDZBQOSA-N 1 1 370.453 2.584 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879237281 1015428545 /nfs/dbraw/zinc/42/85/45/1015428545.db2.gz XHKFFQISXLCLNV-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879237281 1015428549 /nfs/dbraw/zinc/42/85/49/1015428549.db2.gz XHKFFQISXLCLNV-IBGZPJMESA-N 1 1 355.394 2.645 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153909727 989762853 /nfs/dbraw/zinc/76/28/53/989762853.db2.gz ZHDFYIVZRVYCAM-BEFAXECRSA-N 1 1 372.421 2.940 20 5 FFBDMO COc1ccc([C@@H]2CC[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000154554315 990293367 /nfs/dbraw/zinc/29/33/67/990293367.db2.gz LPVXGMWAQKOVSP-CQSZACIVSA-N 1 1 369.377 2.958 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C2)cc1 ZINC000154554315 990293379 /nfs/dbraw/zinc/29/33/79/990293379.db2.gz LPVXGMWAQKOVSP-CQSZACIVSA-N 1 1 369.377 2.958 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000920450979 990851018 /nfs/dbraw/zinc/85/10/18/990851018.db2.gz ICPUKRDUZAAMEI-OAHLLOKOSA-N 1 1 373.457 2.573 20 5 FFBDMO Cc1cc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)c(C)s1 ZINC001485451392 991944417 /nfs/dbraw/zinc/94/44/17/991944417.db2.gz MVYCNHDCJQRWBF-HZPDHXFCSA-N 1 1 365.499 2.939 20 5 FFBDMO Cc1c(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000072706089 993273341 /nfs/dbraw/zinc/27/33/41/993273341.db2.gz XMKBQXFJKKNOAC-LBPRGKRZSA-N 1 1 364.402 2.806 20 5 FFBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000880460805 1015841126 /nfs/dbraw/zinc/84/11/26/1015841126.db2.gz BZOXGCYZKKJBIP-QGZVFWFLSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC000880460805 1015841129 /nfs/dbraw/zinc/84/11/29/1015841129.db2.gz BZOXGCYZKKJBIP-QGZVFWFLSA-N 1 1 357.410 2.897 20 5 FFBDMO O=C(NC1CC1)OC[C@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000810037959 994683846 /nfs/dbraw/zinc/68/38/46/994683846.db2.gz YDDRFRZGLXGQFS-OAHLLOKOSA-N 1 1 363.414 2.717 20 5 FFBDMO CC(C)C[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001133396097 995498633 /nfs/dbraw/zinc/49/86/33/995498633.db2.gz QWPTWWQXPFQKNT-HZPDHXFCSA-N 1 1 353.850 2.579 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000813172178 995633875 /nfs/dbraw/zinc/63/38/75/995633875.db2.gz GWXKDSWOQOIWDN-KRWDZBQOSA-N 1 1 371.349 2.934 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000813172178 995633878 /nfs/dbraw/zinc/63/38/78/995633878.db2.gz GWXKDSWOQOIWDN-KRWDZBQOSA-N 1 1 371.349 2.934 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)c1 ZINC000825180239 997241545 /nfs/dbraw/zinc/24/15/45/997241545.db2.gz KKCMKIHYOSYGED-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[N@H+]1C[C@@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000844050220 997629758 /nfs/dbraw/zinc/62/97/58/997629758.db2.gz XVVPLXWFOZNHGR-PBHICJAKSA-N 1 1 357.385 2.809 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)[C@H](C)[NH+]2CCCCCC2)c1 ZINC000845124373 998389022 /nfs/dbraw/zinc/38/90/22/998389022.db2.gz RXHJPLWVIWJSPJ-ZDUSSCGKSA-N 1 1 364.398 2.689 20 5 FFBDMO C[C@@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000803855289 1016244868 /nfs/dbraw/zinc/24/48/68/1016244868.db2.gz FIFZPROCHFYMEO-HIFRSBDPSA-N 1 1 363.414 2.730 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000740758071 999681382 /nfs/dbraw/zinc/68/13/82/999681382.db2.gz OUWIGMPPTQQXKD-UHFFFAOYSA-N 1 1 363.418 2.749 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000741022662 999703688 /nfs/dbraw/zinc/70/36/88/999703688.db2.gz WAGRMAYQOFCJTC-MQYQWHSLSA-N 1 1 363.414 2.726 20 5 FFBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000742167915 999760411 /nfs/dbraw/zinc/76/04/11/999760411.db2.gz ZYMNIHKGONBTGU-AWEZNQCLSA-N 1 1 373.409 2.572 20 5 FFBDMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000742167915 999760414 /nfs/dbraw/zinc/76/04/14/999760414.db2.gz ZYMNIHKGONBTGU-AWEZNQCLSA-N 1 1 373.409 2.572 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000742419036 999773165 /nfs/dbraw/zinc/77/31/65/999773165.db2.gz PEFZUCPCUCJGLA-AWEZNQCLSA-N 1 1 366.418 2.614 20 5 FFBDMO CC[N@@H+](CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)[C@H](C)C(C)C ZINC000742557532 999778214 /nfs/dbraw/zinc/77/82/14/999778214.db2.gz ZNKFCASBQFTZHJ-FZKQIMNGSA-N 1 1 362.430 2.686 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000745085795 999891141 /nfs/dbraw/zinc/89/11/41/999891141.db2.gz GBWWCHVSAOIRRZ-XJKSGUPXSA-N 1 1 363.414 2.585 20 5 FFBDMO COc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169019013 1000017534 /nfs/dbraw/zinc/01/75/34/1000017534.db2.gz GBCSMECDRHFJBD-OXFYSEKESA-N 1 1 373.453 2.569 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(CC3CC3)nc21 ZINC001169021690 1000017565 /nfs/dbraw/zinc/01/75/65/1000017565.db2.gz PKYVTVNDSHDRPA-NJAFHUGGSA-N 1 1 362.474 2.674 20 5 FFBDMO COC(=O)[C@](C)([NH3+])Cc1cn(-c2cc(C)c([N+](=O)[O-])cn2)c2ccccc12 ZINC001169116232 1000022105 /nfs/dbraw/zinc/02/21/05/1000022105.db2.gz WGPFQCQZNYRRKF-LJQANCHMSA-N 1 1 368.393 2.675 20 5 FFBDMO CCC[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000767122668 1000100145 /nfs/dbraw/zinc/10/01/45/1000100145.db2.gz HVFPVNIGLGZRAR-RUJXFNLJSA-N 1 1 361.442 2.567 20 5 FFBDMO COc1ccccc1OCC[N@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000768823522 1000361187 /nfs/dbraw/zinc/36/11/87/1000361187.db2.gz NGWNAMGKFQENGQ-UHFFFAOYSA-N 1 1 374.393 2.885 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000768823522 1000361193 /nfs/dbraw/zinc/36/11/93/1000361193.db2.gz NGWNAMGKFQENGQ-UHFFFAOYSA-N 1 1 374.393 2.885 20 5 FFBDMO COC(=O)[C@]12C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]1CCCC2 ZINC000847016809 1000520421 /nfs/dbraw/zinc/52/04/21/1000520421.db2.gz GPFXICQGPXBFQU-CXAGYDPISA-N 1 1 363.370 2.668 20 5 FFBDMO CC(C)[N@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC1CCC1 ZINC000769927743 1000639896 /nfs/dbraw/zinc/63/98/96/1000639896.db2.gz NRFFYWZAPKBEOX-UHFFFAOYSA-N 1 1 374.485 2.754 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001146934743 1000792223 /nfs/dbraw/zinc/79/22/23/1000792223.db2.gz PCTHUVBRMCBZAE-RYUDHWBXSA-N 1 1 369.853 2.698 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001148387428 1001131197 /nfs/dbraw/zinc/13/11/97/1001131197.db2.gz CRGSMKCQTNVKAB-IFXJQAMLSA-N 1 1 368.437 2.817 20 5 FFBDMO CC[C@H]1CC[C@H](C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000772357146 1001361422 /nfs/dbraw/zinc/36/14/22/1001361422.db2.gz SPXNZDZWEBEADB-HOTGVXAUSA-N 1 1 360.458 2.506 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](Oc3ncccc3F)C2)cc1 ZINC000785841255 1001492228 /nfs/dbraw/zinc/49/22/28/1001492228.db2.gz QTPRTXSGJQCJGO-DOTOQJQBSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](Oc3ncccc3F)C2)cc1 ZINC000785841255 1001492229 /nfs/dbraw/zinc/49/22/29/1001492229.db2.gz QTPRTXSGJQCJGO-DOTOQJQBSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1cn(C[NH+]2CCC3(CCOCC3)CC2)nc1-c1ccncc1 ZINC000789528952 1002109208 /nfs/dbraw/zinc/10/92/08/1002109208.db2.gz FVWUBLZYVXNZRF-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO COc1c(O)ccc(C[NH2+]Cc2cc3c([nH]c2=O)CCCC3)c1[N+](=O)[O-] ZINC001183429677 1002271916 /nfs/dbraw/zinc/27/19/16/1002271916.db2.gz RUYHOEKUMHPPSW-UHFFFAOYSA-N 1 1 359.382 2.578 20 5 FFBDMO COCC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CC[C@H](C)C1 ZINC000790481340 1002389151 /nfs/dbraw/zinc/38/91/51/1002389151.db2.gz XLQFWMLJUBXTEO-GOEBONIOSA-N 1 1 359.430 2.948 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000791623345 1002748751 /nfs/dbraw/zinc/74/87/51/1002748751.db2.gz TVWBGHFXGLMKHU-SVFBPWRDSA-N 1 1 367.449 2.692 20 5 FFBDMO CCOC(=O)[C@H]1C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355046 1003123191 /nfs/dbraw/zinc/12/31/91/1003123191.db2.gz VJUYFCPGJUAIHZ-MLGOLLRUSA-N 1 1 368.455 2.515 20 5 FFBDMO CCOC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])CCS1 ZINC001170355046 1003123195 /nfs/dbraw/zinc/12/31/95/1003123195.db2.gz VJUYFCPGJUAIHZ-MLGOLLRUSA-N 1 1 368.455 2.515 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339907 1003130369 /nfs/dbraw/zinc/13/03/69/1003130369.db2.gz KRUIZILUKCRKDN-HUUCEWRRSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@@H]1Cn2ccnc2C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339907 1003130375 /nfs/dbraw/zinc/13/03/75/1003130375.db2.gz KRUIZILUKCRKDN-HUUCEWRRSA-N 1 1 374.441 2.509 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345852 1003131503 /nfs/dbraw/zinc/13/15/03/1003131503.db2.gz MZYFFZWUTCYGAL-FZKQIMNGSA-N 1 1 350.415 2.810 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@@H](C)C1 ZINC000804380256 1003642145 /nfs/dbraw/zinc/64/21/45/1003642145.db2.gz VMTGYQTWHCNUHF-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)[C@@H](C)C1 ZINC000804380256 1003642153 /nfs/dbraw/zinc/64/21/53/1003642153.db2.gz VMTGYQTWHCNUHF-HNNXBMFYSA-N 1 1 360.458 2.751 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(c3c[nH]cn3)CC2)o1 ZINC001191820523 1003968121 /nfs/dbraw/zinc/96/81/21/1003968121.db2.gz DYLIGCPHXASPMR-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO CCC1(CC)CNC(=O)[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Br ZINC001198105191 1004496515 /nfs/dbraw/zinc/49/65/15/1004496515.db2.gz VXQARRZWCULXBA-ZDUSSCGKSA-N 1 1 370.247 2.752 20 5 FFBDMO O=C(C[N@@H+]1CCCC[C@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685294 1004709719 /nfs/dbraw/zinc/70/97/19/1004709719.db2.gz IRRNZLKZUHUUEW-FUHWJXTLSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]1[C@H]1CCCO1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001198685294 1004709726 /nfs/dbraw/zinc/70/97/26/1004709726.db2.gz IRRNZLKZUHUUEW-FUHWJXTLSA-N 1 1 359.426 2.517 20 5 FFBDMO Cc1cnc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)s1 ZINC000775673957 1005067797 /nfs/dbraw/zinc/06/77/97/1005067797.db2.gz UIZFWJISJQKROU-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO Cc1cnc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)s1 ZINC000775673957 1005067802 /nfs/dbraw/zinc/06/78/02/1005067802.db2.gz UIZFWJISJQKROU-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO CC(=O)c1ccc2c(c1)CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000776592938 1006009325 /nfs/dbraw/zinc/00/93/25/1006009325.db2.gz DIRPAAJJFPDALI-FQEVSTJZSA-N 1 1 354.406 2.932 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNc3ccnc(F)c3[N+](=O)[O-])c2)CCO1 ZINC000881844997 1006241061 /nfs/dbraw/zinc/24/10/61/1006241061.db2.gz YABKHZKBNSCVBT-CYBMUJFWSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNc3ccnc(F)c3[N+](=O)[O-])c2)CCO1 ZINC000881844997 1006241070 /nfs/dbraw/zinc/24/10/70/1006241070.db2.gz YABKHZKBNSCVBT-CYBMUJFWSA-N 1 1 360.389 2.962 20 5 FFBDMO C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000747958773 1006354303 /nfs/dbraw/zinc/35/43/03/1006354303.db2.gz DCUPAQWZJPIDEX-UONOGXRCSA-N 1 1 367.450 2.559 20 5 FFBDMO C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C[C@@](C)(O)c1ccccc1 ZINC000853519054 1006425104 /nfs/dbraw/zinc/42/51/04/1006425104.db2.gz XSCWZRXHEXLNJU-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C[C@@](C)(O)c1ccccc1 ZINC000853519054 1006425112 /nfs/dbraw/zinc/42/51/12/1006425112.db2.gz XSCWZRXHEXLNJU-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC1)OCCCO2 ZINC000815155976 1006522466 /nfs/dbraw/zinc/52/24/66/1006522466.db2.gz PXCDCLJLFHCYMC-CYBMUJFWSA-N 1 1 374.397 2.935 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979960 1006585617 /nfs/dbraw/zinc/58/56/17/1006585617.db2.gz UNPWHQAFWPLAQZ-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(c3ncccc3[N+](=O)[O-])C2)O1 ZINC000882979960 1006585627 /nfs/dbraw/zinc/58/56/27/1006585627.db2.gz UNPWHQAFWPLAQZ-OXJNMPFZSA-N 1 1 368.437 2.860 20 5 FFBDMO COc1ccc([C@@H]2CCNC[C@@H]2[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000854225155 1006731421 /nfs/dbraw/zinc/73/14/21/1006731421.db2.gz XAASCLLCYOMGTK-FMEYXAORSA-N 1 1 370.453 2.982 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1CC1CC1 ZINC000883403047 1006779967 /nfs/dbraw/zinc/77/99/67/1006779967.db2.gz IVBNPVZCPBFPKW-CQSZACIVSA-N 1 1 372.450 2.819 20 5 FFBDMO CO[C@@H]1CCCC[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093071 1006898123 /nfs/dbraw/zinc/89/81/23/1006898123.db2.gz ZSVKEDRVXUFXFL-RCCFBDPRSA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@@H]1CCCC[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000816093071 1006898138 /nfs/dbraw/zinc/89/81/38/1006898138.db2.gz ZSVKEDRVXUFXFL-RCCFBDPRSA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@@H]1C[C@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000817288625 1007510088 /nfs/dbraw/zinc/51/00/88/1007510088.db2.gz JUFLLAHKEMXUEE-UKPHBRMFSA-N 1 1 364.442 2.928 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3cccnc3[N+](=O)[O-])C2)ccn1 ZINC000856536413 1007874496 /nfs/dbraw/zinc/87/44/96/1007874496.db2.gz SQDZVGAHVYHXCF-QGZVFWFLSA-N 1 1 371.441 2.883 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593318 1007902417 /nfs/dbraw/zinc/90/24/17/1007902417.db2.gz RASCHDVXESPKNW-MTCRFPMVSA-N 1 1 372.425 2.623 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593318 1007902421 /nfs/dbraw/zinc/90/24/21/1007902421.db2.gz RASCHDVXESPKNW-MTCRFPMVSA-N 1 1 372.425 2.623 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593316 1007903782 /nfs/dbraw/zinc/90/37/82/1007903782.db2.gz RASCHDVXESPKNW-MEQKGCOVSA-N 1 1 372.425 2.623 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000856593316 1007903787 /nfs/dbraw/zinc/90/37/87/1007903787.db2.gz RASCHDVXESPKNW-MEQKGCOVSA-N 1 1 372.425 2.623 20 5 FFBDMO C[C@@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000820308208 1008315332 /nfs/dbraw/zinc/31/53/32/1008315332.db2.gz HWEKCSXSEKNVOC-AWEZNQCLSA-N 1 1 363.433 2.999 20 5 FFBDMO CCOC(=O)c1cc(C(=O)OCC[C@@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1 ZINC000822043632 1008513418 /nfs/dbraw/zinc/51/34/18/1008513418.db2.gz KWHJLIAHSWQNKA-HNNXBMFYSA-N 1 1 364.398 2.803 20 5 FFBDMO O=C([C@H]1CC12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2)N1CCCCC1 ZINC000886102629 1008562634 /nfs/dbraw/zinc/56/26/34/1008562634.db2.gz LRSBQSGVXQKSPH-MRXNPFEDSA-N 1 1 358.442 2.604 20 5 FFBDMO O=[N+]([O-])c1ncccc1CN1CCC(c2cc(C3CC[NH2+]CC3)n[nH]2)CC1 ZINC000886841466 1008901998 /nfs/dbraw/zinc/90/19/98/1008901998.db2.gz MAULMKOSDBPXCY-UHFFFAOYSA-N 1 1 370.457 2.560 20 5 FFBDMO Cc1[nH]c(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001178441489 1008976066 /nfs/dbraw/zinc/97/60/66/1008976066.db2.gz HLZIXUDWHYXKQT-VIFPVBQESA-N 1 1 352.778 2.672 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598962 1009136841 /nfs/dbraw/zinc/13/68/41/1009136841.db2.gz PDCHTEKSBQQOFQ-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598962 1009136846 /nfs/dbraw/zinc/13/68/46/1009136846.db2.gz PDCHTEKSBQQOFQ-IBGZPJMESA-N 1 1 357.410 2.681 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823600176 1009137100 /nfs/dbraw/zinc/13/71/00/1009137100.db2.gz YWFHAFFTZCPFKK-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823600176 1009137106 /nfs/dbraw/zinc/13/71/06/1009137106.db2.gz YWFHAFFTZCPFKK-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000861353162 1009371017 /nfs/dbraw/zinc/37/10/17/1009371017.db2.gz MIMAULZURQFLHR-KDOFPFPSSA-N 1 1 366.414 2.648 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC000889164065 1009845547 /nfs/dbraw/zinc/84/55/47/1009845547.db2.gz XFSDFHNIPOHGDK-OCCSQVGLSA-N 1 1 356.426 2.885 20 5 FFBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635162 1010448577 /nfs/dbraw/zinc/44/85/77/1010448577.db2.gz UGBPWXYHRLXNRY-GJZGRUSLSA-N 1 1 363.414 2.986 20 5 FFBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794635162 1010448581 /nfs/dbraw/zinc/44/85/81/1010448581.db2.gz UGBPWXYHRLXNRY-GJZGRUSLSA-N 1 1 363.414 2.986 20 5 FFBDMO Cc1cc(C(=O)NCC[N@@H+]2CC=C(C(C)(C)C)CC2)c(N)c([N+](=O)[O-])c1 ZINC000773213885 1010511432 /nfs/dbraw/zinc/51/14/32/1010511432.db2.gz KANWALNRQPWEFE-UHFFFAOYSA-N 1 1 360.458 2.893 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2CCC[N@@H+](Cc3ccccc3)CC2)cc1F ZINC000865422354 1010782482 /nfs/dbraw/zinc/78/24/82/1010782482.db2.gz SLJMZYGWUOVDIO-UHFFFAOYSA-N 1 1 359.401 2.939 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC000865499488 1010800080 /nfs/dbraw/zinc/80/00/80/1010800080.db2.gz OUDLFIVNEDEKAC-OAHLLOKOSA-N 1 1 370.400 2.887 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865625647 1010829805 /nfs/dbraw/zinc/82/98/05/1010829805.db2.gz TVQBQBXFUZKJII-SCLBCKFNSA-N 1 1 367.409 2.827 20 5 FFBDMO C[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1ccnc1 ZINC000121643761 1011065661 /nfs/dbraw/zinc/06/56/61/1011065661.db2.gz DWCHIVFCZPOTDP-YOEHRIQHSA-N 1 1 367.413 2.590 20 5 FFBDMO CCN(Cc1ccc(OC)cc1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867949798 1011128894 /nfs/dbraw/zinc/12/88/94/1011128894.db2.gz JBARAVWRFQTTEX-LJQANCHMSA-N 1 1 357.410 2.826 20 5 FFBDMO C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867955882 1011130654 /nfs/dbraw/zinc/13/06/54/1011130654.db2.gz IQRIMIQCPVHSRT-DJKXOVBDSA-N 1 1 369.421 2.757 20 5 FFBDMO C[C@@H]1COc2ccccc2CN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867978998 1011137864 /nfs/dbraw/zinc/13/78/64/1011137864.db2.gz CHIZMZUTBCZBRF-YJYMSZOUSA-N 1 1 355.394 2.578 20 5 FFBDMO CCCCCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001274885271 1011717962 /nfs/dbraw/zinc/71/79/62/1011717962.db2.gz HIZUERMAGZWYFU-IAGOWNOFSA-N 1 1 351.491 2.937 20 5 FFBDMO CN1C[C@@]2(CC1=O)CCCC[N@H+]2[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908884 1012079060 /nfs/dbraw/zinc/07/90/60/1012079060.db2.gz OUPLGBACSOHGRD-XLIONFOSSA-N 1 1 357.454 2.929 20 5 FFBDMO CN1C[C@@]2(CC1=O)CCCC[N@H+]2[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908883 1012080074 /nfs/dbraw/zinc/08/00/74/1012080074.db2.gz OUPLGBACSOHGRD-PXNSSMCTSA-N 1 1 357.454 2.929 20 5 FFBDMO CN1C(=O)CC[C@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@H]21 ZINC001172912614 1012126391 /nfs/dbraw/zinc/12/63/91/1012126391.db2.gz KTESXICHUNMFKP-YQVWRLOYSA-N 1 1 357.454 2.785 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@H]4OCC[C@H]43)CC2)c(F)c1 ZINC001173010233 1012179255 /nfs/dbraw/zinc/17/92/55/1012179255.db2.gz OKHQXAAQDUGVFA-HZPDHXFCSA-N 1 1 353.369 2.705 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC[C@@H]1O ZINC001173009935 1012179751 /nfs/dbraw/zinc/17/97/51/1012179751.db2.gz KHCVIHFETVZBEJ-PXAZEXFGSA-N 1 1 369.412 2.935 20 5 FFBDMO C[N@@H+](CCN1CCCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015612 1012187388 /nfs/dbraw/zinc/18/73/88/1012187388.db2.gz UCOLJCLKHMYJBH-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO CN(CC[NH+]1CCCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015612 1012187396 /nfs/dbraw/zinc/18/73/96/1012187396.db2.gz UCOLJCLKHMYJBH-UHFFFAOYSA-N 1 1 368.428 2.869 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2C[C@H]3CC[C@@H](C2)N3C)c1F ZINC001173180578 1012323810 /nfs/dbraw/zinc/32/38/10/1012323810.db2.gz WWJZTVNGWUVQGB-FQUUOJAGSA-N 1 1 351.422 2.888 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CCC[N@H+]3CCC[C@@H]3C2)c1F ZINC001173190523 1012331349 /nfs/dbraw/zinc/33/13/49/1012331349.db2.gz UUFJUGKNZLRXQW-ZIAGYGMSSA-N 1 1 351.422 2.844 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192204 1012334049 /nfs/dbraw/zinc/33/40/49/1012334049.db2.gz JORSQPUQUBJAQI-CHWSQXEVSA-N 1 1 367.421 2.664 20 5 FFBDMO CCC(=O)N[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192204 1012334062 /nfs/dbraw/zinc/33/40/62/1012334062.db2.gz JORSQPUQUBJAQI-CHWSQXEVSA-N 1 1 367.421 2.664 20 5 FFBDMO COC(=O)[C@]1(C)CC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173192842 1012334878 /nfs/dbraw/zinc/33/48/78/1012334878.db2.gz KXQKNWDLSMGYKP-PIGZYNQJSA-N 1 1 354.378 2.559 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173198018 1012341828 /nfs/dbraw/zinc/34/18/28/1012341828.db2.gz XLHNYBCZBGNHFY-OLZOCXBDSA-N 1 1 368.405 2.949 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@H+](C)C(C)(C)C2)CC1 ZINC000773370802 1012408822 /nfs/dbraw/zinc/40/88/22/1012408822.db2.gz OUERAJKBMKSKAT-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC[N@@H+](C)C(C)(C)C2)CC1 ZINC000773370802 1012408834 /nfs/dbraw/zinc/40/88/34/1012408834.db2.gz OUERAJKBMKSKAT-UHFFFAOYSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2cccc(C(F)F)c2)CC1 ZINC001045437679 1019966307 /nfs/dbraw/zinc/96/63/07/1019966307.db2.gz YKZDIZVDEUNECP-HUUCEWRRSA-N 1 1 367.396 2.760 20 5 FFBDMO COc1ccc(C[NH+]2CCC(O)(Cc3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000930981938 1020266703 /nfs/dbraw/zinc/26/67/03/1020266703.db2.gz NQARVFDQFVFYCT-UHFFFAOYSA-N 1 1 357.410 2.568 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)cc1 ZINC001048525137 1020276120 /nfs/dbraw/zinc/27/61/20/1020276120.db2.gz MWEYUWYWPLIRPE-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525137 1020276128 /nfs/dbraw/zinc/27/61/28/1020276128.db2.gz MWEYUWYWPLIRPE-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO Cc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)cc1 ZINC001048525137 1020276130 /nfs/dbraw/zinc/27/61/30/1020276130.db2.gz MWEYUWYWPLIRPE-RHQZKXFESA-N 1 1 357.454 2.519 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931725075 1020564361 /nfs/dbraw/zinc/56/43/61/1020564361.db2.gz NNGIJRPYYMMTJF-BJJXKVORSA-N 1 1 357.414 2.874 20 5 FFBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@](C)(c2ccccn2)CC1=O ZINC000800866115 1020612039 /nfs/dbraw/zinc/61/20/39/1020612039.db2.gz SLWHZJIGMZODQI-HXUWFJFHSA-N 1 1 368.437 2.612 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@](C)(c2ccccn2)CC1=O ZINC000800866115 1020612043 /nfs/dbraw/zinc/61/20/43/1020612043.db2.gz SLWHZJIGMZODQI-HXUWFJFHSA-N 1 1 368.437 2.612 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CCNC(=O)OC(C)(C)C ZINC000931957017 1020646876 /nfs/dbraw/zinc/64/68/76/1020646876.db2.gz UAVRUJXNZYKTPU-ZIAGYGMSSA-N 1 1 364.446 2.973 20 5 FFBDMO COCCOc1ncccc1C[NH2+][C@@H](C)c1cc(OC)cc([N+](=O)[O-])c1 ZINC000903068805 1020661107 /nfs/dbraw/zinc/66/11/07/1020661107.db2.gz NBBFOGMOCZPQFM-ZDUSSCGKSA-N 1 1 361.398 2.874 20 5 FFBDMO CC(C)C[N@H+](Cc1ccccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000932450348 1020806613 /nfs/dbraw/zinc/80/66/13/1020806613.db2.gz ZOSDGTAYNHSLOA-QGZVFWFLSA-N 1 1 359.426 2.888 20 5 FFBDMO Cc1c(C[NH+]2CCN(c3cccc4[nH]c(=O)[nH]c43)CC2)cccc1[N+](=O)[O-] ZINC000932517529 1020824098 /nfs/dbraw/zinc/82/40/98/1020824098.db2.gz XRNOTBVSFADLOY-UHFFFAOYSA-N 1 1 367.409 2.807 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(O)(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000932818526 1020907488 /nfs/dbraw/zinc/90/74/88/1020907488.db2.gz VNINFWCUIRMLHG-AWEZNQCLSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNCCC[N@@H+]2CCc3ccccc3C2)c1 ZINC000749674212 1021018477 /nfs/dbraw/zinc/01/84/77/1021018477.db2.gz VWJNYDLLTDXOGR-HXUWFJFHSA-N 1 1 355.438 2.666 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)CNCCC[N@H+]2CCc3ccccc3C2)c1 ZINC000749674212 1021018480 /nfs/dbraw/zinc/01/84/80/1021018480.db2.gz VWJNYDLLTDXOGR-HXUWFJFHSA-N 1 1 355.438 2.666 20 5 FFBDMO CN(C(=O)C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000934844351 1021425712 /nfs/dbraw/zinc/42/57/12/1021425712.db2.gz YZIPSESVWNNVGW-HZPDHXFCSA-N 1 1 361.442 2.696 20 5 FFBDMO O=C(C[N@H+]1CCCC[C@H]([C@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000934841628 1021426400 /nfs/dbraw/zinc/42/64/00/1021426400.db2.gz NBCALIFUCPDXJQ-IRXDYDNUSA-N 1 1 373.453 2.623 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583765 1022135612 /nfs/dbraw/zinc/13/56/12/1022135612.db2.gz PILOHPWVRJAGJD-RISCZKNCSA-N 1 1 367.450 2.601 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000778583765 1022135616 /nfs/dbraw/zinc/13/56/16/1022135616.db2.gz PILOHPWVRJAGJD-RISCZKNCSA-N 1 1 367.450 2.601 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](C3CCOCC3)C2)nc1-c1ccncc1 ZINC000754784937 1023517588 /nfs/dbraw/zinc/51/75/88/1023517588.db2.gz RMFVOTSVFAPGQP-INIZCTEOSA-N 1 1 357.414 2.559 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2ncc([N+](=O)[O-])cc2Br)CC1 ZINC001121015497 1023570487 /nfs/dbraw/zinc/57/04/87/1023570487.db2.gz JUQVUGPBPTZSPU-UHFFFAOYSA-N 1 1 366.219 2.870 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@@H](C)[N@@H+](Cc2ccccc2)CC1 ZINC001121700856 1023934514 /nfs/dbraw/zinc/93/45/14/1023934514.db2.gz ZVSKEEFDUHQURK-CVEARBPZSA-N 1 1 372.473 2.737 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000758447841 1024121872 /nfs/dbraw/zinc/12/18/72/1024121872.db2.gz RVYOSHYCDJWSKA-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO C[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)[C@H](O)c1cccc(O)c1 ZINC001159589730 1027437543 /nfs/dbraw/zinc/43/75/43/1027437543.db2.gz SJCOKUXGFSXFCP-IBYYOGEZSA-N 1 1 358.398 2.762 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1[N+](=O)[O-] ZINC000093534359 1027754544 /nfs/dbraw/zinc/75/45/44/1027754544.db2.gz OGVARNWHSPWFTA-AWEZNQCLSA-N 1 1 357.370 2.893 20 5 FFBDMO Cc1nn(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1[N+](=O)[O-] ZINC000795710136 1027901940 /nfs/dbraw/zinc/90/19/40/1027901940.db2.gz KRMSYRJXDSGAMT-LJQANCHMSA-N 1 1 355.442 2.655 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@@H+]1Cc1ccccc1 ZINC001161749478 1028304397 /nfs/dbraw/zinc/30/43/97/1028304397.db2.gz SVBYASSDAAKDKO-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)CC[N@H+]1Cc1ccccc1 ZINC001161749478 1028304411 /nfs/dbraw/zinc/30/44/11/1028304411.db2.gz SVBYASSDAAKDKO-AWEZNQCLSA-N 1 1 354.410 2.524 20 5 FFBDMO CC/C=C/CC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001162809981 1028664791 /nfs/dbraw/zinc/66/47/91/1028664791.db2.gz AWPGCKPYDZXUOH-DUFJLWIISA-N 1 1 359.470 2.669 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC001162818762 1028669802 /nfs/dbraw/zinc/66/98/02/1028669802.db2.gz KGDJCZROAOGSNN-CQSZACIVSA-N 1 1 358.442 2.837 20 5 FFBDMO CC(C)[C@H]1CCC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000780497731 1028716534 /nfs/dbraw/zinc/71/65/34/1028716534.db2.gz MMSDLJTWPBEKNA-IFXJQAMLSA-N 1 1 374.441 2.687 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C[C@H]1C(C)(C)C ZINC001163929115 1029118800 /nfs/dbraw/zinc/11/88/00/1029118800.db2.gz GTUAINFAVYLUHU-AWEZNQCLSA-N 1 1 371.384 2.999 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC001156316650 1029141647 /nfs/dbraw/zinc/14/16/47/1029141647.db2.gz HIXCKAVUGPEHOW-UWWQBHOKSA-N 1 1 353.426 2.895 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(Cl)c(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490533 1029295437 /nfs/dbraw/zinc/29/54/37/1029295437.db2.gz LPNLTZWQNQBYDG-IUODEOHRSA-N 1 1 369.824 2.520 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1N(C)c1cc(N)c([N+](=O)[O-])cn1 ZINC001165183083 1029438847 /nfs/dbraw/zinc/43/88/47/1029438847.db2.gz PXKGATLLTAGDDP-KDOFPFPSSA-N 1 1 355.442 2.919 20 5 FFBDMO O=[N+]([O-])c1cc2c(Cl)ncnc2cc1NCC[NH+]1CCSCC1 ZINC001157043926 1029448989 /nfs/dbraw/zinc/44/89/89/1029448989.db2.gz YUQBSUKAUIFPIO-UHFFFAOYSA-N 1 1 353.835 2.652 20 5 FFBDMO O=C(NCCC[NH2+]C1c2ccccc2-c2ccccc21)[C@@H]1CC1[N+](=O)[O-] ZINC001157767847 1029658745 /nfs/dbraw/zinc/65/87/45/1029658745.db2.gz XRGWMFMLWNAFQU-QZTJIDSGSA-N 1 1 351.406 2.518 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@]2(CCCOC2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782506210 1029724705 /nfs/dbraw/zinc/72/47/05/1029724705.db2.gz CDBSSJJJGXRTSA-SFHVURJKSA-N 1 1 365.405 2.955 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ccc(O)cc2CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000782512104 1029727107 /nfs/dbraw/zinc/72/71/07/1029727107.db2.gz AQKBUGINSGSFCE-UHFFFAOYSA-N 1 1 373.384 2.869 20 5 FFBDMO C[C@@H]1C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)[C@@H]1c1ccccc1 ZINC000782860319 1029840096 /nfs/dbraw/zinc/84/00/96/1029840096.db2.gz FYPUMDGILVBQMZ-KSSFIOAISA-N 1 1 369.425 2.605 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000784031121 1030431561 /nfs/dbraw/zinc/43/15/61/1030431561.db2.gz JWIXJHQIAGMSJX-KUHUBIRLSA-N 1 1 374.441 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCOCC4(CCOCC4)C3)c2)cc1 ZINC000784045463 1030438657 /nfs/dbraw/zinc/43/86/57/1030438657.db2.gz WAFCAGQRXHSPKF-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCOCC4(CCOCC4)C3)c2)cc1 ZINC000784045463 1030438666 /nfs/dbraw/zinc/43/86/66/1030438666.db2.gz WAFCAGQRXHSPKF-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C[C@@](C)(O)c1ccccc1 ZINC000842628124 1030850722 /nfs/dbraw/zinc/85/07/22/1030850722.db2.gz VHCQXCKNKGFLIT-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C[C@@](C)(O)c1ccccc1 ZINC000842628124 1030850747 /nfs/dbraw/zinc/85/07/47/1030850747.db2.gz VHCQXCKNKGFLIT-LJQANCHMSA-N 1 1 367.409 2.650 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCCn2cc[nH+]c2C(C)C)c1 ZINC000798326634 1031365667 /nfs/dbraw/zinc/36/56/67/1031365667.db2.gz JWAJTPHXEZSLKI-UHFFFAOYSA-N 1 1 360.414 2.808 20 5 FFBDMO O=C(NCC1([NH2+]CCCc2ccsc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530588 1031786946 /nfs/dbraw/zinc/78/69/46/1031786946.db2.gz FZMUCCUTZBOBGH-HZPDHXFCSA-N 1 1 365.499 2.755 20 5 FFBDMO Cc1ccc(F)cc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1 ZINC001115530930 1031789229 /nfs/dbraw/zinc/78/92/29/1031789229.db2.gz ZJJWWHNHTWQTOI-IAGOWNOFSA-N 1 1 363.433 2.708 20 5 FFBDMO O=C(NCC1([NH2+]Cc2cccc(F)c2F)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530898 1031789817 /nfs/dbraw/zinc/78/98/17/1031789817.db2.gz XQVBEPQEJDHUER-UKRRQHHQSA-N 1 1 367.396 2.539 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3cc(Br)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001226789450 1034841254 /nfs/dbraw/zinc/84/12/54/1034841254.db2.gz RXFRYKIPHXMRCV-BHYNMZESSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3cc(Br)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001226789450 1034841262 /nfs/dbraw/zinc/84/12/62/1034841262.db2.gz RXFRYKIPHXMRCV-BHYNMZESSA-N 1 1 355.188 2.540 20 5 FFBDMO COCC(=O)N[C@@H]1CCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232228341 1035507973 /nfs/dbraw/zinc/50/79/73/1035507973.db2.gz PHIGUGIJXMUVAF-QGZVFWFLSA-N 1 1 364.449 2.510 20 5 FFBDMO Cc1nc(Cl)nc(O[C@@H]2CC[N@@H+]([C@@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227337913 1035510868 /nfs/dbraw/zinc/51/08/68/1035510868.db2.gz ICCFHJZUVCCBPX-NWDGAFQWSA-N 1 1 363.805 2.956 20 5 FFBDMO Cc1nc(Cl)nc(O[C@@H]2CC[N@H+]([C@@H](C)c3ccccn3)C2)c1[N+](=O)[O-] ZINC001227337913 1035510873 /nfs/dbraw/zinc/51/08/73/1035510873.db2.gz ICCFHJZUVCCBPX-NWDGAFQWSA-N 1 1 363.805 2.956 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3c(Cl)cccc3[N+](=O)[O-])C[C@H]1[N@H+]2C ZINC001227999865 1035863010 /nfs/dbraw/zinc/86/30/10/1035863010.db2.gz FSGVMMUMRPNMKW-UOVKNHIHSA-N 1 1 354.790 2.794 20 5 FFBDMO C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1 ZINC001228609222 1036204417 /nfs/dbraw/zinc/20/44/17/1036204417.db2.gz BCSTVEBQGBGEMV-DGCLKSJQSA-N 1 1 371.397 2.577 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1 ZINC001228609222 1036204434 /nfs/dbraw/zinc/20/44/34/1036204434.db2.gz BCSTVEBQGBGEMV-DGCLKSJQSA-N 1 1 371.397 2.577 20 5 FFBDMO Cc1[nH]c(=O)cc(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)c1[N+](=O)[O-] ZINC001228688083 1036257916 /nfs/dbraw/zinc/25/79/16/1036257916.db2.gz DLXOBDSWZCJJJA-MRXNPFEDSA-N 1 1 373.409 2.674 20 5 FFBDMO COC(=O)c1cc(Cl)cc([N+](=O)[O-])c1O[C@H]1CCc2[nH+]ccn2C1 ZINC001228967109 1036439355 /nfs/dbraw/zinc/43/93/55/1036439355.db2.gz MVBKMQNEPMNFGU-JTQLQIEISA-N 1 1 351.746 2.625 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380303 1036642755 /nfs/dbraw/zinc/64/27/55/1036642755.db2.gz KQMBGZJPRQSHCW-IUODEOHRSA-N 1 1 358.398 2.688 20 5 FFBDMO Cc1nc(O[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229380303 1036642759 /nfs/dbraw/zinc/64/27/59/1036642759.db2.gz KQMBGZJPRQSHCW-IUODEOHRSA-N 1 1 358.398 2.688 20 5 FFBDMO CC(C)CCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001277388149 1036680582 /nfs/dbraw/zinc/68/05/82/1036680582.db2.gz GWECXTLVUWEXQY-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)CCC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001277388149 1036680589 /nfs/dbraw/zinc/68/05/89/1036680589.db2.gz GWECXTLVUWEXQY-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)CCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001277388149 1036680594 /nfs/dbraw/zinc/68/05/94/1036680594.db2.gz GWECXTLVUWEXQY-QZTJIDSGSA-N 1 1 351.491 2.791 20 5 FFBDMO CO[C@@H]1CC[N@H+](CCOc2cc([N+](=O)[O-])c(C)cc2Br)C1 ZINC001230981602 1037426737 /nfs/dbraw/zinc/42/67/37/1037426737.db2.gz QXFVDOHXTUFRBC-LLVKDONJSA-N 1 1 359.220 2.765 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc([N+](=O)[O-])c(C)cc2Br)C1 ZINC001230981602 1037426743 /nfs/dbraw/zinc/42/67/43/1037426743.db2.gz QXFVDOHXTUFRBC-LLVKDONJSA-N 1 1 359.220 2.765 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC001208345695 1038235758 /nfs/dbraw/zinc/23/57/58/1038235758.db2.gz YGPXURCCNYRSCE-TZMCWYRMSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCO[C@@H](C(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256101624 1038387263 /nfs/dbraw/zinc/38/72/63/1038387263.db2.gz PTAUPCKVWZBOOQ-LJQANCHMSA-N 1 1 363.458 2.929 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346739 1038486044 /nfs/dbraw/zinc/48/60/44/1038486044.db2.gz KYXCKOTXOOSSSN-DOTOQJQBSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346739 1038486052 /nfs/dbraw/zinc/48/60/52/1038486052.db2.gz KYXCKOTXOOSSSN-DOTOQJQBSA-N 1 1 373.384 2.918 20 5 FFBDMO C[C@H]1C[NH+](CCc2nnc(/C=C/c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC001258012718 1039113000 /nfs/dbraw/zinc/11/30/00/1039113000.db2.gz RRNZNROOFLFESM-AGKLADILSA-N 1 1 358.398 2.800 20 5 FFBDMO CN(C)c1cccc(-c2noc([C@@H]([NH3+])Cc3ccccc3[N+](=O)[O-])n2)c1 ZINC001247665250 1039875751 /nfs/dbraw/zinc/87/57/51/1039875751.db2.gz DCDUGIGDEVGLOA-HNNXBMFYSA-N 1 1 353.382 2.953 20 5 FFBDMO COc1nc(C)ccc1-c1noc([C@@H]([NH3+])Cc2ccccc2[N+](=O)[O-])n1 ZINC001247672512 1039877412 /nfs/dbraw/zinc/87/74/12/1039877412.db2.gz KAVYUGKRFPAOMK-ZDUSSCGKSA-N 1 1 355.354 2.599 20 5 FFBDMO Cn1ncc2ccc(-c3noc([C@@H]([NH3+])Cc4ccc([N+](=O)[O-])cc4)n3)cc21 ZINC001248212328 1040173795 /nfs/dbraw/zinc/17/37/95/1040173795.db2.gz QESRBGLJKUOXLH-HNNXBMFYSA-N 1 1 364.365 2.774 20 5 FFBDMO Cc1ccc(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC001254240921 1040635178 /nfs/dbraw/zinc/63/51/78/1040635178.db2.gz MHWVRFHBGZKGDI-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO CCOC(=O)[C@@]12CCO[C@@H]1CC[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254551444 1040792307 /nfs/dbraw/zinc/79/23/07/1040792307.db2.gz BCJLPCKNZFSUFU-LSBZLQRGSA-N 1 1 362.426 2.570 20 5 FFBDMO CCOC(=O)c1cc2n(n1)CCC[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])C2 ZINC001254553059 1040794118 /nfs/dbraw/zinc/79/41/18/1040794118.db2.gz RFYUSGXPLYRJEV-CQSZACIVSA-N 1 1 372.425 2.805 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2cnn(C)c21 ZINC001254560672 1040796255 /nfs/dbraw/zinc/79/62/55/1040796255.db2.gz HAQHAFPOKAPWLS-PBHICJAKSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561516 1040799674 /nfs/dbraw/zinc/79/96/74/1040799674.db2.gz LVDIJLGIFAJAQV-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2ncn(C)c21 ZINC001254561516 1040799678 /nfs/dbraw/zinc/79/96/78/1040799678.db2.gz LVDIJLGIFAJAQV-ZBFHGGJFSA-N 1 1 358.442 2.895 20 5 FFBDMO COc1ccnc(O[C@H]2CCC[N@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254567332 1040805064 /nfs/dbraw/zinc/80/50/64/1040805064.db2.gz BPDGQZPBHQOSIN-ZBFHGGJFSA-N 1 1 372.425 2.868 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2cnn(CC)c21 ZINC001254594260 1040821565 /nfs/dbraw/zinc/82/15/65/1040821565.db2.gz CQTRVZGFUAQVAC-HKUYNNGSSA-N 1 1 370.453 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H](F)[C@](O)(C(F)(F)F)CC1)C2 ZINC001254593150 1040822983 /nfs/dbraw/zinc/82/29/83/1040822983.db2.gz JJDFGGVOJIHBJZ-KFWWJZLASA-N 1 1 362.323 2.789 20 5 FFBDMO CN1c2ccccc2[C@]2(CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)C1=O ZINC001254594667 1040823165 /nfs/dbraw/zinc/82/31/65/1040823165.db2.gz HADLFLYZPCGMGA-DYESRHJHSA-N 1 1 363.417 2.682 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(CCc3ccccc3)CC1)C2 ZINC001254600759 1040830115 /nfs/dbraw/zinc/83/01/15/1040830115.db2.gz RHPYQNNESWXRIU-NRFANRHFSA-N 1 1 351.450 2.922 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ccncc3[N+](=O)[O-])C2)ccn1 ZINC001261757824 1041401627 /nfs/dbraw/zinc/40/16/27/1041401627.db2.gz FMZLCFNBBSQBOA-QGZVFWFLSA-N 1 1 371.441 2.883 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CC[C@@H](c4nccs4)C3)n2)cc1 ZINC001262052686 1041532616 /nfs/dbraw/zinc/53/26/16/1041532616.db2.gz CUUYEFOBLWXPCQ-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](c4nccs4)C3)n2)cc1 ZINC001262052686 1041532620 /nfs/dbraw/zinc/53/26/20/1041532620.db2.gz CUUYEFOBLWXPCQ-CYBMUJFWSA-N 1 1 356.411 2.757 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC001263021036 1042039541 /nfs/dbraw/zinc/03/95/41/1042039541.db2.gz JIIGWJJKRLONOU-HNNXBMFYSA-N 1 1 364.494 2.728 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001538539485 1070449844 /nfs/dbraw/zinc/44/98/44/1070449844.db2.gz HPMCTZGEPGXKKT-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001538539485 1070449848 /nfs/dbraw/zinc/44/98/48/1070449848.db2.gz HPMCTZGEPGXKKT-QGZVFWFLSA-N 1 1 374.485 2.997 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[NH+](C(C)(C)C)CC1 ZINC001318661548 1044795954 /nfs/dbraw/zinc/79/59/54/1044795954.db2.gz NKWPKBZYXIROJN-UHFFFAOYSA-N 1 1 353.394 2.831 20 5 FFBDMO Cc1cccc(CCC[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001281490385 1044907061 /nfs/dbraw/zinc/90/70/61/1044907061.db2.gz XVUOBPRXOMEWOP-QZTJIDSGSA-N 1 1 359.470 2.564 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1csc2c1cccc2Cl ZINC001317448567 1045091685 /nfs/dbraw/zinc/09/16/85/1045091685.db2.gz WOPFCNMRSZIILF-TZMCWYRMSA-N 1 1 367.858 2.768 20 5 FFBDMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1csc2c1cccc2Cl ZINC001317448567 1045091697 /nfs/dbraw/zinc/09/16/97/1045091697.db2.gz WOPFCNMRSZIILF-TZMCWYRMSA-N 1 1 367.858 2.768 20 5 FFBDMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1csc2c1cccc2Cl ZINC001317448567 1045091710 /nfs/dbraw/zinc/09/17/10/1045091710.db2.gz WOPFCNMRSZIILF-TZMCWYRMSA-N 1 1 367.858 2.768 20 5 FFBDMO CC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC001319900172 1045298192 /nfs/dbraw/zinc/29/81/92/1045298192.db2.gz VLINGIQBGURGDK-UHFFFAOYSA-N 1 1 357.357 2.753 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1 ZINC001320888730 1045489040 /nfs/dbraw/zinc/48/90/40/1045489040.db2.gz KONJCEUDEWETMK-DOTOQJQBSA-N 1 1 374.437 2.906 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CCCC3(CC[NH2+]CC3)C2)cccc1[N+](=O)[O-] ZINC001327090260 1047185856 /nfs/dbraw/zinc/18/58/56/1047185856.db2.gz RWAANMYUPCXQRU-OAHLLOKOSA-N 1 1 360.458 2.696 20 5 FFBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CCC(C)(C)C1 ZINC001289680312 1047717507 /nfs/dbraw/zinc/71/75/07/1047717507.db2.gz ZXJCGXQOMXREOW-ZDUSSCGKSA-N 1 1 351.472 2.924 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC001329881159 1048947337 /nfs/dbraw/zinc/94/73/37/1048947337.db2.gz USXCPUABKYBFMA-YGRLFVJLSA-N 1 1 368.231 2.524 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC001334272300 1049343277 /nfs/dbraw/zinc/34/32/77/1049343277.db2.gz WFGHKEDCPJHASN-CYBMUJFWSA-N 1 1 374.416 2.972 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cccc1[N+](=O)[O-] ZINC001298367460 1050424733 /nfs/dbraw/zinc/42/47/33/1050424733.db2.gz WSHIIPNJGYRHFP-DZFIZOCASA-N 1 1 351.406 2.763 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC001303469448 1051360318 /nfs/dbraw/zinc/36/03/18/1051360318.db2.gz GNBVPDBNJFCECR-UHFFFAOYSA-N 1 1 350.806 2.756 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001306858377 1052202244 /nfs/dbraw/zinc/20/22/44/1052202244.db2.gz DOJLSHQNNGOVAS-CQSZACIVSA-N 1 1 358.442 2.504 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001306858377 1052202251 /nfs/dbraw/zinc/20/22/51/1052202251.db2.gz DOJLSHQNNGOVAS-CQSZACIVSA-N 1 1 358.442 2.504 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001307233917 1052273934 /nfs/dbraw/zinc/27/39/34/1052273934.db2.gz JYEJXKOQCVHRQU-GARJFASQSA-N 1 1 355.236 2.813 20 5 FFBDMO O=C(Nc1ccc(O)cc1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC001307574613 1052321706 /nfs/dbraw/zinc/32/17/06/1052321706.db2.gz QMUWOSNVHMILLX-UHFFFAOYSA-N 1 1 356.382 2.546 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001336603407 1054085558 /nfs/dbraw/zinc/08/55/58/1054085558.db2.gz YNJYHQHLORDXJD-OAHLLOKOSA-N 1 1 359.357 2.529 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176666 1055184393 /nfs/dbraw/zinc/18/43/93/1055184393.db2.gz BXVLQIZKDDWJTR-QCJMNHFRSA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176666 1055184401 /nfs/dbraw/zinc/18/44/01/1055184401.db2.gz BXVLQIZKDDWJTR-QCJMNHFRSA-N 1 1 361.442 2.612 20 5 FFBDMO CCn1c(Cc2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)C)CC1 ZINC001356378994 1055478650 /nfs/dbraw/zinc/47/86/50/1055478650.db2.gz PHNTYEFVDNFSSG-UHFFFAOYSA-N 1 1 372.473 2.718 20 5 FFBDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)OCCC[N+](=O)[O-])C1 ZINC000860921099 1056354012 /nfs/dbraw/zinc/35/40/12/1056354012.db2.gz NWRCVVXJPOKGMG-UHFFFAOYSA-N 1 1 359.426 2.618 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3csc([N+](=O)[O-])c3)n2C)[C@H](C)C1 ZINC001339521497 1056544704 /nfs/dbraw/zinc/54/47/04/1056544704.db2.gz LTBFBADJWVICDT-YPMHNXCESA-N 1 1 364.475 2.618 20 5 FFBDMO O=C(Nc1c[nH+]ccc1Nc1ccccc1)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001452704943 1059281402 /nfs/dbraw/zinc/28/14/02/1059281402.db2.gz QJGQSLRGQCOJOO-UHFFFAOYSA-N 1 1 358.745 2.784 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C(C)C)[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC001454899637 1059641603 /nfs/dbraw/zinc/64/16/03/1059641603.db2.gz KTNUDDFWFFEMSN-RKVPGOIHSA-N 1 1 363.458 2.653 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc(C(F)(F)F)cc3[N+](=O)[O-])[C@H]2C1 ZINC001355171864 1059954216 /nfs/dbraw/zinc/95/42/16/1059954216.db2.gz PQAVPINKEJSZLQ-TVYUQYBPSA-N 1 1 357.332 2.684 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1C1CCOCC1 ZINC000848484344 1060123481 /nfs/dbraw/zinc/12/34/81/1060123481.db2.gz ZAQKVUIIKRBZNG-RTBURBONSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000848487803 1060138746 /nfs/dbraw/zinc/13/87/46/1060138746.db2.gz XLFLJOFZAUPGIC-AEFFLSMTSA-N 1 1 366.421 2.753 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000848487803 1060138760 /nfs/dbraw/zinc/13/87/60/1060138760.db2.gz XLFLJOFZAUPGIC-AEFFLSMTSA-N 1 1 366.421 2.753 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848488838 1060143807 /nfs/dbraw/zinc/14/38/07/1060143807.db2.gz NANDQKXQZMQDQS-SFHVURJKSA-N 1 1 358.398 2.691 20 5 FFBDMO Cc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CCC[N@H+](C)C(C)C ZINC001511778679 1060404156 /nfs/dbraw/zinc/40/41/56/1060404156.db2.gz JJUWSZDTJLOQIE-UHFFFAOYSA-N 1 1 360.462 2.861 20 5 FFBDMO CC[N@@H+](CCn1c(C)nnc1N(C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC001547579162 1071974018 /nfs/dbraw/zinc/97/40/18/1071974018.db2.gz IRQSOJADZOZMPB-UHFFFAOYSA-N 1 1 360.462 2.861 20 5 FFBDMO C[C@H]1[C@@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227612 1060924687 /nfs/dbraw/zinc/92/46/87/1060924687.db2.gz RJIFMRAXXULWKV-WDEREUQCSA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@H]1[C@@H](CO)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460227612 1060924699 /nfs/dbraw/zinc/92/46/99/1060924699.db2.gz RJIFMRAXXULWKV-WDEREUQCSA-N 1 1 366.805 2.891 20 5 FFBDMO C[C@@H]1CC[C@H](O)C[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460691101 1061065045 /nfs/dbraw/zinc/06/50/45/1061065045.db2.gz CXIYUUSQVBJPOD-KOLCDFICSA-N 1 1 352.778 2.643 20 5 FFBDMO C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001460691101 1061065031 /nfs/dbraw/zinc/06/50/31/1061065031.db2.gz CXIYUUSQVBJPOD-KOLCDFICSA-N 1 1 352.778 2.643 20 5 FFBDMO Cc1csc(C[C@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)n1 ZINC001460796704 1061106079 /nfs/dbraw/zinc/10/60/79/1061106079.db2.gz UEEPBGYZGMHUBK-CYBMUJFWSA-N 1 1 374.466 2.913 20 5 FFBDMO C[C@@H](Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1)[N@@H+](C)C1CC1 ZINC001360536355 1061980218 /nfs/dbraw/zinc/98/02/18/1061980218.db2.gz MBLLYSGTTBZRHQ-ZDUSSCGKSA-N 1 1 370.457 2.935 20 5 FFBDMO Cc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1C ZINC001492781762 1062206297 /nfs/dbraw/zinc/20/62/97/1062206297.db2.gz KGLHCNLZMAFDOC-CQSZACIVSA-N 1 1 358.446 2.615 20 5 FFBDMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001435496877 1062497962 /nfs/dbraw/zinc/49/79/62/1062497962.db2.gz AUJCFNWNEUGNFO-UHFFFAOYSA-N 1 1 363.377 2.980 20 5 FFBDMO CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC001524992777 1063087873 /nfs/dbraw/zinc/08/78/73/1063087873.db2.gz FFFOSXRYFKTYDJ-HNNXBMFYSA-N 1 1 364.494 2.727 20 5 FFBDMO Cn1c2ccccc2c(NCC[N@H+]2CCCC(C)(C)C2)c([N+](=O)[O-])c1=O ZINC001472770289 1065142711 /nfs/dbraw/zinc/14/27/11/1065142711.db2.gz HETCQQYEBDCFJQ-UHFFFAOYSA-N 1 1 358.442 2.981 20 5 FFBDMO CCC(=O)Nc1cccc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])c1 ZINC001473936989 1065424080 /nfs/dbraw/zinc/42/40/80/1065424080.db2.gz OJMLNCLSUVTUTN-UHFFFAOYSA-N 1 1 359.382 2.947 20 5 FFBDMO CCN(C(C)=O)c1nc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC001473982090 1065432727 /nfs/dbraw/zinc/43/27/27/1065432727.db2.gz ZHAZSFFWNZLAFF-UHFFFAOYSA-N 1 1 364.427 2.593 20 5 FFBDMO COC(=O)c1cc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])c[nH]1 ZINC001474247883 1065476807 /nfs/dbraw/zinc/47/68/07/1065476807.db2.gz GEEUDCNVJZKQCJ-UHFFFAOYSA-N 1 1 368.187 2.762 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC001474833837 1065620950 /nfs/dbraw/zinc/62/09/50/1065620950.db2.gz BNEJYJWYZVYDDX-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1ccc2[nH]c(NC(=O)[C@](C)([NH3+])c3cccc([N+](=O)[O-])c3)cc2c1 ZINC001579241812 1078598989 /nfs/dbraw/zinc/59/89/89/1078598989.db2.gz GKCRUMKMNMDDDQ-GOSISDBHSA-N 1 1 354.366 2.897 20 5 FFBDMO C[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC001557279795 1075832929 /nfs/dbraw/zinc/83/29/29/1075832929.db2.gz FKQQGOPOUCIQFB-QGZVFWFLSA-N 1 1 362.474 2.976 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC001559255624 1076140142 /nfs/dbraw/zinc/14/01/42/1076140142.db2.gz YBYQXLDZMSUXFL-GDBMZVCRSA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@@H]1CCC(C)(C)[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559904137 1076200440 /nfs/dbraw/zinc/20/04/40/1076200440.db2.gz ZGQJCWTZSKUMEM-OAHLLOKOSA-N 1 1 360.458 2.506 20 5 FFBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(CC(F)(F)F)C1 ZINC001560034661 1076214689 /nfs/dbraw/zinc/21/46/89/1076214689.db2.gz ZSMCBAVHWLAVFU-AWEZNQCLSA-N 1 1 361.364 2.932 20 5 FFBDMO Cc1ccc(C[N@H+](C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001560071541 1076221498 /nfs/dbraw/zinc/22/14/98/1076221498.db2.gz JHILORPENZPPOI-OAHLLOKOSA-N 1 1 367.446 2.563 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1CN1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 ZINC001560201776 1076245777 /nfs/dbraw/zinc/24/57/77/1076245777.db2.gz XEZCDEGLLLPDRJ-STQMWFEESA-N 1 1 358.211 2.585 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1CN1CC[N@H+]2C[C@@H](F)C[C@H]2C1 ZINC001560201776 1076245780 /nfs/dbraw/zinc/24/57/80/1076245780.db2.gz XEZCDEGLLLPDRJ-STQMWFEESA-N 1 1 358.211 2.585 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](Nc2ncccn2)C1 ZINC001560205399 1076246644 /nfs/dbraw/zinc/24/66/44/1076246644.db2.gz ABQYHWQCWZBTAV-OAHLLOKOSA-N 1 1 357.414 2.858 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Nc2ncccn2)C1 ZINC001560205399 1076246646 /nfs/dbraw/zinc/24/66/46/1076246646.db2.gz ABQYHWQCWZBTAV-OAHLLOKOSA-N 1 1 357.414 2.858 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001560231535 1076252324 /nfs/dbraw/zinc/25/23/24/1076252324.db2.gz VOTVAXITULAFLJ-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@]1(CO)c1ccccc1 ZINC001560231535 1076252327 /nfs/dbraw/zinc/25/23/27/1076252327.db2.gz VOTVAXITULAFLJ-HXUWFJFHSA-N 1 1 369.421 2.825 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055475 1079728827 /nfs/dbraw/zinc/72/88/27/1079728827.db2.gz RQAPGHDYCLIYBK-PBHICJAKSA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001587055475 1079728831 /nfs/dbraw/zinc/72/88/31/1079728831.db2.gz RQAPGHDYCLIYBK-PBHICJAKSA-N 1 1 369.421 2.798 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)C1 ZINC001590259429 1081128616 /nfs/dbraw/zinc/12/86/16/1081128616.db2.gz KOFWTMFQPFCMJV-CYBMUJFWSA-N 1 1 359.434 2.699 20 5 FFBDMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000101908646 250092427 /nfs/dbraw/zinc/09/24/27/250092427.db2.gz KUIWGHRYBSFUQA-MRXNPFEDSA-N 1 1 363.458 2.848 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3CCN(CC(F)F)CC3)o2)c1 ZINC000104679859 250181611 /nfs/dbraw/zinc/18/16/11/250181611.db2.gz IBQTXWWCQUOGBK-UHFFFAOYSA-N 1 1 366.368 2.675 20 5 FFBDMO C[C@H]1SCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H]1C ZINC000118419494 250384759 /nfs/dbraw/zinc/38/47/59/250384759.db2.gz BQEWRORZHSFFTD-VXGBXAGGSA-N 1 1 351.428 2.719 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008947 251037407 /nfs/dbraw/zinc/03/74/07/251037407.db2.gz MYQHJKAQTKZQEM-LRDDRELGSA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008947 251037411 /nfs/dbraw/zinc/03/74/11/251037411.db2.gz MYQHJKAQTKZQEM-LRDDRELGSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@H](O)C[C@@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262603 251119116 /nfs/dbraw/zinc/11/91/16/251119116.db2.gz YJZGQSCPYWGRFP-SRVKXCTJSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262603 251119119 /nfs/dbraw/zinc/11/91/19/251119119.db2.gz YJZGQSCPYWGRFP-SRVKXCTJSA-N 1 1 355.822 2.811 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153334796 251125879 /nfs/dbraw/zinc/12/58/79/251125879.db2.gz MUWAPVRAXUHACS-WBVHZDCISA-N 1 1 373.453 2.839 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000181086015 251240923 /nfs/dbraw/zinc/24/09/23/251240923.db2.gz UPOVRTQZTBAWEP-HNNXBMFYSA-N 1 1 354.410 2.571 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCn1ccnc1 ZINC000181108609 251242311 /nfs/dbraw/zinc/24/23/11/251242311.db2.gz CVYSTDMVSJDVBM-LBPRGKRZSA-N 1 1 365.821 2.794 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272310181 252006268 /nfs/dbraw/zinc/00/62/68/252006268.db2.gz IEGRNBKNMPZHMF-CYBMUJFWSA-N 1 1 355.385 2.781 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CCO)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272549571 252065908 /nfs/dbraw/zinc/06/59/08/252065908.db2.gz QYMVDTVZBROJEV-KRWDZBQOSA-N 1 1 358.442 2.950 20 5 FFBDMO Cc1cc(-c2noc([C@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)ccc1F ZINC000273257199 252265441 /nfs/dbraw/zinc/26/54/41/252265441.db2.gz BJQUASJHGRZICP-NSHDSACASA-N 1 1 360.349 2.640 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000057778260 221094135 /nfs/dbraw/zinc/09/41/35/221094135.db2.gz PXNXCSOCPJEONE-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO CC(C)(CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000276816045 256133397 /nfs/dbraw/zinc/13/33/97/256133397.db2.gz MVQLEILKKPIYHD-UHFFFAOYSA-N 1 1 361.489 2.594 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000277074545 256158649 /nfs/dbraw/zinc/15/86/49/256158649.db2.gz TTYVTEFDPBGFLY-YJBOKZPZSA-N 1 1 372.469 2.751 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000278326676 256300297 /nfs/dbraw/zinc/30/02/97/256300297.db2.gz ARULQZLWYIDGCN-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@@H+]1CCc2ccccc2C1 ZINC000279780257 256450708 /nfs/dbraw/zinc/45/07/08/256450708.db2.gz UGOSBMKZWYWODK-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CCc2ccccc2C1 ZINC000279780257 256450709 /nfs/dbraw/zinc/45/07/09/256450709.db2.gz UGOSBMKZWYWODK-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@](C)(O)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000279854682 256457496 /nfs/dbraw/zinc/45/74/96/256457496.db2.gz BFNJCFZBFBYOQQ-MRXNPFEDSA-N 1 1 360.357 2.942 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2ncnc3sc([N+](=O)[O-])cc32)CCCO1 ZINC000287686117 257102475 /nfs/dbraw/zinc/10/24/75/257102475.db2.gz JRRCFMVFCUODKI-LLVKDONJSA-N 1 1 351.432 2.512 20 5 FFBDMO CN(C(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])nc1 ZINC000288737658 257222109 /nfs/dbraw/zinc/22/21/09/257222109.db2.gz HCHZJDRACNPWTM-INIZCTEOSA-N 1 1 354.410 2.865 20 5 FFBDMO O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)Nc1cccc([N+](=O)[O-])c1Cl ZINC000289683969 257293916 /nfs/dbraw/zinc/29/39/16/257293916.db2.gz NMVOTNXEQRCZAA-GFCCVEGCSA-N 1 1 370.837 2.607 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)c1 ZINC000289785869 257299474 /nfs/dbraw/zinc/29/94/74/257299474.db2.gz HLCZZDNPEOSZAW-MRXNPFEDSA-N 1 1 357.414 2.684 20 5 FFBDMO Cc1cc(CNC(=O)Nc2ccncc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000290230879 257321509 /nfs/dbraw/zinc/32/15/09/257321509.db2.gz UOHSAFDEVVDATC-UHFFFAOYSA-N 1 1 356.386 2.615 20 5 FFBDMO Cc1nc(N2CCC[N@@H+](CCCc3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000294786137 257602738 /nfs/dbraw/zinc/60/27/38/257602738.db2.gz AZXQUYRAHZFAKD-UHFFFAOYSA-N 1 1 355.442 2.838 20 5 FFBDMO Cc1c(CO)cc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301120795 258026663 /nfs/dbraw/zinc/02/66/63/258026663.db2.gz SMDAVRFULWOKMB-NEPJUHHUSA-N 1 1 366.418 2.836 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](Cc2ccncc2)C2CC2)c([N+](=O)[O-])c1 ZINC000299530743 258002752 /nfs/dbraw/zinc/00/27/52/258002752.db2.gz DSBJEKDTBIWZTM-UHFFFAOYSA-N 1 1 370.409 2.992 20 5 FFBDMO CC[C@@H]1CN(c2cc(C)nc3c2cccc3[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000302022642 258083137 /nfs/dbraw/zinc/08/31/37/258083137.db2.gz ORBSVYMQNHZYLG-LSDHHAIUSA-N 1 1 358.442 2.733 20 5 FFBDMO Nc1nc(N[C@@H]2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ncc1[N+](=O)[O-] ZINC000302200699 258094810 /nfs/dbraw/zinc/09/48/10/258094810.db2.gz ZDZNDCPBRWHGEL-BZUAXINKSA-N 1 1 368.441 2.680 20 5 FFBDMO C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000302499713 258104025 /nfs/dbraw/zinc/10/40/25/258104025.db2.gz CKESUNQWEXYVJK-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1cc(N(C)CCN2C[C@@H](C)O[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302865892 258113020 /nfs/dbraw/zinc/11/30/20/258113020.db2.gz UQBVVMTXNVNJIG-GASCZTMLSA-N 1 1 358.442 2.997 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Br ZINC000317144153 258116041 /nfs/dbraw/zinc/11/60/41/258116041.db2.gz FOMPHKXUCMFDCN-WDEREUQCSA-N 1 1 368.231 2.714 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000301442943 258050124 /nfs/dbraw/zinc/05/01/24/258050124.db2.gz YMGHCJWBMPVVIO-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000330580230 258166033 /nfs/dbraw/zinc/16/60/33/258166033.db2.gz TWLABGZOQYYSDH-UHFFFAOYSA-N 1 1 359.373 2.731 20 5 FFBDMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@H+]1C ZINC000330785528 258170649 /nfs/dbraw/zinc/17/06/49/258170649.db2.gz LQLUADWDEAODKH-PHIMTYICSA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C ZINC000330785528 258170650 /nfs/dbraw/zinc/17/06/50/258170650.db2.gz LQLUADWDEAODKH-PHIMTYICSA-N 1 1 357.863 2.891 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(Br)cc1[N+](=O)[O-] ZINC000332228241 258219967 /nfs/dbraw/zinc/21/99/67/258219967.db2.gz CQYPJFWXOBIUPW-CHWSQXEVSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000332474808 258231731 /nfs/dbraw/zinc/23/17/31/258231731.db2.gz KZQJCBUARLCRDO-TZMCWYRMSA-N 1 1 366.849 2.745 20 5 FFBDMO C[C@@H](CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@@H]1C ZINC000032737681 506287706 /nfs/dbraw/zinc/28/77/06/506287706.db2.gz GBNRWGPDGBDBFG-GJZGRUSLSA-N 1 1 371.441 2.773 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000065536705 506319279 /nfs/dbraw/zinc/31/92/79/506319279.db2.gz RVBXBSAZOUOMMX-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cn3ccc([N+](=O)[O-])n3)cc2)C1 ZINC000053191143 506330189 /nfs/dbraw/zinc/33/01/89/506330189.db2.gz BLDOQYVQWJCUPD-CQSZACIVSA-N 1 1 357.414 2.662 20 5 FFBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1 ZINC000054012122 506477133 /nfs/dbraw/zinc/47/71/33/506477133.db2.gz DTRBOLXQDIHIFD-UHFFFAOYSA-N 1 1 368.397 2.798 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000054352474 506541071 /nfs/dbraw/zinc/54/10/71/506541071.db2.gz QWMUABQJUGHSDT-UHFFFAOYSA-N 1 1 357.414 2.520 20 5 FFBDMO Cc1noc([C@@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000054676248 506600385 /nfs/dbraw/zinc/60/03/85/506600385.db2.gz LJHWIHFIAKILAH-CQSZACIVSA-N 1 1 373.413 2.803 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000067299064 506821102 /nfs/dbraw/zinc/82/11/02/506821102.db2.gz SNDOWXVADNKYPV-INIZCTEOSA-N 1 1 359.382 2.763 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000055903749 506881866 /nfs/dbraw/zinc/88/18/66/506881866.db2.gz DMPYZMVPPBQXIY-INIZCTEOSA-N 1 1 361.442 2.602 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000067542928 506919099 /nfs/dbraw/zinc/91/90/99/506919099.db2.gz FPDMXDKMVLRALM-UHFFFAOYSA-N 1 1 369.421 2.604 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000045623019 506993243 /nfs/dbraw/zinc/99/32/43/506993243.db2.gz CMGKPFBSNGMCCD-HNNXBMFYSA-N 1 1 368.437 2.841 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCOc1ccc(F)cc1 ZINC000015101416 507020364 /nfs/dbraw/zinc/02/03/64/507020364.db2.gz XMBPCRVHPNKXFL-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCOc1ccc(F)cc1 ZINC000015101416 507020367 /nfs/dbraw/zinc/02/03/67/507020367.db2.gz XMBPCRVHPNKXFL-UHFFFAOYSA-N 1 1 361.373 2.992 20 5 FFBDMO CC(C)OCCCNC(=O)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056493861 507028843 /nfs/dbraw/zinc/02/88/43/507028843.db2.gz GADZWYMEJSHKCS-UHFFFAOYSA-N 1 1 369.487 2.800 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541869 507179784 /nfs/dbraw/zinc/17/97/84/507179784.db2.gz NECITENCGJJRNC-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000019541869 507179793 /nfs/dbraw/zinc/17/97/93/507179793.db2.gz NECITENCGJJRNC-GFCCVEGCSA-N 1 1 357.366 2.783 20 5 FFBDMO COc1ccc(C(=O)Nc2cccnc2-n2cc[nH+]c2C)cc1[N+](=O)[O-] ZINC000057218356 507209637 /nfs/dbraw/zinc/20/96/37/507209637.db2.gz XWEUCTWYKLWKBD-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H](c2cccs2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000047031714 507252967 /nfs/dbraw/zinc/25/29/67/507252967.db2.gz AWAZVMKSQVFYAB-AWEZNQCLSA-N 1 1 369.468 2.546 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000025402693 507496495 /nfs/dbraw/zinc/49/64/95/507496495.db2.gz XEZHKUSYRUCQCR-INIZCTEOSA-N 1 1 369.421 2.879 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000027334994 507647565 /nfs/dbraw/zinc/64/75/65/507647565.db2.gz ICDGTCZCCHJBEG-HNNXBMFYSA-N 1 1 359.382 2.763 20 5 FFBDMO O=C(C[N@H+](CCO)C1CCCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000071079900 507692265 /nfs/dbraw/zinc/69/22/65/507692265.db2.gz AAJWHEHDSIJYBB-UHFFFAOYSA-N 1 1 355.822 2.814 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000051469038 507771989 /nfs/dbraw/zinc/77/19/89/507771989.db2.gz PEPSUCAPSJYGHO-GFCCVEGCSA-N 1 1 360.439 2.790 20 5 FFBDMO C[C@@H](C(=O)N(C)c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665300 507840256 /nfs/dbraw/zinc/84/02/56/507840256.db2.gz ARZVMLDUYWHVNQ-GJZGRUSLSA-N 1 1 369.425 2.528 20 5 FFBDMO C[C@@H](C(=O)N(C)c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072665300 507840258 /nfs/dbraw/zinc/84/02/58/507840258.db2.gz ARZVMLDUYWHVNQ-GJZGRUSLSA-N 1 1 369.425 2.528 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(S(C)(=O)=O)c(F)c1 ZINC000089512472 507844147 /nfs/dbraw/zinc/84/41/47/507844147.db2.gz FSVVJCJSTFAERT-LLVKDONJSA-N 1 1 352.387 2.988 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000089619530 507850810 /nfs/dbraw/zinc/85/08/10/507850810.db2.gz ZPAOEMCYBUDYOS-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(Cn4ccnn4)CC3)co2)cc1 ZINC000089934874 507887674 /nfs/dbraw/zinc/88/76/74/507887674.db2.gz PYDLQBCPRZQJMI-UHFFFAOYSA-N 1 1 368.397 2.754 20 5 FFBDMO CC(C)(C)C[N@@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000109747360 507984298 /nfs/dbraw/zinc/98/42/98/507984298.db2.gz YVGRCCFCZSATEV-UHFFFAOYSA-N 1 1 357.838 2.917 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079683592 507990374 /nfs/dbraw/zinc/99/03/74/507990374.db2.gz FRJSJHXYWLZTHN-SNVBAGLBSA-N 1 1 357.332 2.828 20 5 FFBDMO O=C1NC[C@@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000091864160 508020505 /nfs/dbraw/zinc/02/05/05/508020505.db2.gz SKBNPUVKJCYSPF-CQSZACIVSA-N 1 1 358.423 2.533 20 5 FFBDMO O=C1NC[C@@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CCN12 ZINC000091864160 508020507 /nfs/dbraw/zinc/02/05/07/508020507.db2.gz SKBNPUVKJCYSPF-CQSZACIVSA-N 1 1 358.423 2.533 20 5 FFBDMO C[C@@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000110351919 508023359 /nfs/dbraw/zinc/02/33/59/508023359.db2.gz PBBBQAADORGCAA-HNNXBMFYSA-N 1 1 357.410 2.610 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000075108501 508083076 /nfs/dbraw/zinc/08/30/76/508083076.db2.gz YMEDEDXDBFPUOK-QGZVFWFLSA-N 1 1 360.458 2.701 20 5 FFBDMO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CCC2 ZINC000111311414 508088679 /nfs/dbraw/zinc/08/86/79/508088679.db2.gz XACVAXQPJYVDAF-AWEZNQCLSA-N 1 1 360.439 2.968 20 5 FFBDMO Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CCC2 ZINC000111311414 508088682 /nfs/dbraw/zinc/08/86/82/508088682.db2.gz XACVAXQPJYVDAF-AWEZNQCLSA-N 1 1 360.439 2.968 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000075450795 508107970 /nfs/dbraw/zinc/10/79/70/508107970.db2.gz XHBNAKCCJYATGH-UHFFFAOYSA-N 1 1 354.410 2.595 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000075748515 508132387 /nfs/dbraw/zinc/13/23/87/508132387.db2.gz XDTRIYZMYGWOTC-AWEZNQCLSA-N 1 1 354.410 2.577 20 5 FFBDMO O=C(NCC1(C[NH+]2CCOCC2)CCCCC1)c1csc([N+](=O)[O-])c1 ZINC000081666662 508203404 /nfs/dbraw/zinc/20/34/04/508203404.db2.gz DPKBIQYPRSHJJR-UHFFFAOYSA-N 1 1 367.471 2.669 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000112918655 508233544 /nfs/dbraw/zinc/23/35/44/508233544.db2.gz AKFJBLUEJQCUQW-UHFFFAOYSA-N 1 1 363.458 2.944 20 5 FFBDMO CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170226 508239043 /nfs/dbraw/zinc/23/90/43/508239043.db2.gz QYXUWSYZVQNWOA-ZDUSSCGKSA-N 1 1 360.414 2.720 20 5 FFBDMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083170226 508239047 /nfs/dbraw/zinc/23/90/47/508239047.db2.gz QYXUWSYZVQNWOA-ZDUSSCGKSA-N 1 1 360.414 2.720 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)Cc2ccc(OC)c(C)c2)c([N+](=O)[O-])c1 ZINC000103145211 508299095 /nfs/dbraw/zinc/29/90/95/508299095.db2.gz NFRSXVYDEKSTGX-UHFFFAOYSA-N 1 1 373.409 2.991 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)Cc2ccc(OC)c(C)c2)c([N+](=O)[O-])c1 ZINC000103145211 508299098 /nfs/dbraw/zinc/29/90/98/508299098.db2.gz NFRSXVYDEKSTGX-UHFFFAOYSA-N 1 1 373.409 2.991 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000114644911 508333558 /nfs/dbraw/zinc/33/35/58/508333558.db2.gz FGDKRWFKPCRJFG-KRWDZBQOSA-N 1 1 369.421 2.754 20 5 FFBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)NC(C)(C)C ZINC000104663387 508340388 /nfs/dbraw/zinc/34/03/88/508340388.db2.gz SVKYMGGMTNUTKQ-UHFFFAOYSA-N 1 1 360.414 2.639 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)NC(C)(C)C ZINC000104663387 508340389 /nfs/dbraw/zinc/34/03/89/508340389.db2.gz SVKYMGGMTNUTKQ-UHFFFAOYSA-N 1 1 360.414 2.639 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H](C)C1 ZINC000115273315 508380563 /nfs/dbraw/zinc/38/05/63/508380563.db2.gz GQPBEQCVSDLOQQ-CHWSQXEVSA-N 1 1 355.460 2.523 20 5 FFBDMO CCC[C@@H]1CN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000121795104 508420478 /nfs/dbraw/zinc/42/04/78/508420478.db2.gz MBRJACAAXVOYHZ-MRXNPFEDSA-N 1 1 351.447 2.536 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CSc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000127335273 508434056 /nfs/dbraw/zinc/43/40/56/508434056.db2.gz SNTVBOPHMPAGNZ-KGLIPLIRSA-N 1 1 351.472 2.876 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000133734222 508441213 /nfs/dbraw/zinc/44/12/13/508441213.db2.gz OYUQRJPWLZMUCQ-HZPDHXFCSA-N 1 1 360.458 2.654 20 5 FFBDMO COCCC[N@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000116007504 508462157 /nfs/dbraw/zinc/46/21/57/508462157.db2.gz NRUZSUGJUPNEGC-UHFFFAOYSA-N 1 1 364.427 2.625 20 5 FFBDMO COCCC[N@@H+](C)CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000116007504 508462159 /nfs/dbraw/zinc/46/21/59/508462159.db2.gz NRUZSUGJUPNEGC-UHFFFAOYSA-N 1 1 364.427 2.625 20 5 FFBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](CC(C)C)[NH+]1CCOCC1 ZINC000156751571 508471863 /nfs/dbraw/zinc/47/18/63/508471863.db2.gz NKTYDWVCFVYABE-QGZVFWFLSA-N 1 1 351.447 2.900 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1O ZINC000156820545 508482227 /nfs/dbraw/zinc/48/22/27/508482227.db2.gz YHHNSXFPQOFQRG-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1O ZINC000156820545 508482231 /nfs/dbraw/zinc/48/22/31/508482231.db2.gz YHHNSXFPQOFQRG-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000116280170 508493642 /nfs/dbraw/zinc/49/36/42/508493642.db2.gz FJNXTCWAGPZEBN-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000116280170 508493646 /nfs/dbraw/zinc/49/36/46/508493646.db2.gz FJNXTCWAGPZEBN-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000116280170 508493649 /nfs/dbraw/zinc/49/36/49/508493649.db2.gz FJNXTCWAGPZEBN-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@H](C)O1 ZINC000128727687 508635303 /nfs/dbraw/zinc/63/53/03/508635303.db2.gz FWZXESUWEIKOQK-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@@H+]1CCOC ZINC000128759516 508639438 /nfs/dbraw/zinc/63/94/38/508639438.db2.gz CLHHUERKIOWHBQ-OAHLLOKOSA-N 1 1 369.849 2.821 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000128759516 508639442 /nfs/dbraw/zinc/63/94/42/508639442.db2.gz CLHHUERKIOWHBQ-OAHLLOKOSA-N 1 1 369.849 2.821 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000153898322 508673160 /nfs/dbraw/zinc/67/31/60/508673160.db2.gz QWEJTTXHBFTWSO-CJNGLKHVSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000153898322 508673163 /nfs/dbraw/zinc/67/31/63/508673163.db2.gz QWEJTTXHBFTWSO-CJNGLKHVSA-N 1 1 351.472 2.874 20 5 FFBDMO CC[N@H+]1CCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000118826169 508679719 /nfs/dbraw/zinc/67/97/19/508679719.db2.gz YLZPGSXBRQMGRP-LBPRGKRZSA-N 1 1 354.838 2.603 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000153937898 508681101 /nfs/dbraw/zinc/68/11/01/508681101.db2.gz FCQCBNLWFDTSHT-CRAIPNDOSA-N 1 1 372.469 2.872 20 5 FFBDMO O=c1[nH]c2ccccc2cc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866989 508688624 /nfs/dbraw/zinc/68/86/24/508688624.db2.gz QZBYQPNDDNEYND-HNNXBMFYSA-N 1 1 365.393 2.518 20 5 FFBDMO CCc1[nH+]ccn1CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000158495243 508713082 /nfs/dbraw/zinc/71/30/82/508713082.db2.gz FOAQVDVABIRFPL-UHFFFAOYSA-N 1 1 353.176 2.755 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1Cc1ccccc1 ZINC000137495499 508758687 /nfs/dbraw/zinc/75/86/87/508758687.db2.gz MRNWPIYBWQNBGX-UKRRQHHQSA-N 1 1 354.410 2.570 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000124188208 508794778 /nfs/dbraw/zinc/79/47/78/508794778.db2.gz HEOHYKIAKFFWAO-CMPLNLGQSA-N 1 1 370.247 2.912 20 5 FFBDMO O=[N+]([O-])c1ccn(CCN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)n1 ZINC000159234038 508811789 /nfs/dbraw/zinc/81/17/89/508811789.db2.gz XWUABLDAYAZESK-OALUTQOASA-N 1 1 369.469 2.778 20 5 FFBDMO CCOc1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000159702255 508877337 /nfs/dbraw/zinc/87/73/37/508877337.db2.gz QXVGRGKPMWFGAS-SFHVURJKSA-N 1 1 357.410 2.992 20 5 FFBDMO CCC(CC)(CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccc1 ZINC000154950182 508889873 /nfs/dbraw/zinc/88/98/73/508889873.db2.gz BIMUOGNSWPAISK-ZDUSSCGKSA-N 1 1 359.430 2.957 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C ZINC000155470045 509007408 /nfs/dbraw/zinc/00/74/08/509007408.db2.gz SYUKFCDLXIRBJB-GRYCIOLGSA-N 1 1 355.822 2.567 20 5 FFBDMO Cc1cccc(NCCNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)[nH+]1 ZINC000156286206 509155196 /nfs/dbraw/zinc/15/51/96/509155196.db2.gz XJAAEPRNQCCTIU-UHFFFAOYSA-N 1 1 351.366 2.688 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182355188 509191255 /nfs/dbraw/zinc/19/12/55/509191255.db2.gz WODZBKMTRURINW-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000162465905 509231050 /nfs/dbraw/zinc/23/10/50/509231050.db2.gz PAIUGWZMRQKLHI-OKILXGFUSA-N 1 1 350.419 2.524 20 5 FFBDMO O=C(CN1CCC[C@@H](c2[nH]cc[nH+]2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000266901289 509247360 /nfs/dbraw/zinc/24/73/60/509247360.db2.gz GOUYMIGUCKAIIK-LLVKDONJSA-N 1 1 363.805 2.789 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000179137071 509280822 /nfs/dbraw/zinc/28/08/22/509280822.db2.gz PBPFDDWLBMIDCI-ROUUACIJSA-N 1 1 354.410 2.839 20 5 FFBDMO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000182525349 509284140 /nfs/dbraw/zinc/28/41/40/509284140.db2.gz SYQOHXWNFYJNOA-LLVKDONJSA-N 1 1 356.382 2.503 20 5 FFBDMO CC(C)c1ccnc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000185858138 509390189 /nfs/dbraw/zinc/39/01/89/509390189.db2.gz NTKWEQMYAJZPMP-UHFFFAOYSA-N 1 1 371.441 2.709 20 5 FFBDMO C[N@H+](CCc1ccc(Br)cc1)CCn1ccc([N+](=O)[O-])n1 ZINC000176235573 509394430 /nfs/dbraw/zinc/39/44/30/509394430.db2.gz TXWKDZYXFFRRDJ-UHFFFAOYSA-N 1 1 353.220 2.728 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000185948274 509442639 /nfs/dbraw/zinc/44/26/39/509442639.db2.gz GCQYBJXYJDXULF-BPUTZDHNSA-N 1 1 364.446 2.766 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000185948274 509442648 /nfs/dbraw/zinc/44/26/48/509442648.db2.gz GCQYBJXYJDXULF-BPUTZDHNSA-N 1 1 364.446 2.766 20 5 FFBDMO COCCOc1ccc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000179590397 509526727 /nfs/dbraw/zinc/52/67/27/509526727.db2.gz OSCJOKGZQSQZIN-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])c([O-])c1 ZINC000248905162 509537524 /nfs/dbraw/zinc/53/75/24/509537524.db2.gz UULJPSMVWTWOMK-CZUORRHYSA-N 1 1 355.394 2.551 20 5 FFBDMO C[C@H]1C[NH+](C(C)(C)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000264661638 509630838 /nfs/dbraw/zinc/63/08/38/509630838.db2.gz SHKWKEKJURDRNM-RYUDHWBXSA-N 1 1 369.849 2.866 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179939575 509683498 /nfs/dbraw/zinc/68/34/98/509683498.db2.gz DWHVELHPNCYESK-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179939575 509683508 /nfs/dbraw/zinc/68/35/08/509683508.db2.gz DWHVELHPNCYESK-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180170782 509791827 /nfs/dbraw/zinc/79/18/27/509791827.db2.gz UZUJYEKQINDYBV-WCQYABFASA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1SC ZINC000268171627 509794532 /nfs/dbraw/zinc/79/45/32/509794532.db2.gz FBNBPGSMWDDZRT-GWCFXTLKSA-N 1 1 365.455 2.538 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000176987408 509800618 /nfs/dbraw/zinc/80/06/18/509800618.db2.gz YICOBIHVYMFHOO-NSHDSACASA-N 1 1 370.247 2.962 20 5 FFBDMO COCC[N@@H+]1CC[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000264985390 509810209 /nfs/dbraw/zinc/81/02/09/509810209.db2.gz VLNOGQRGMUTFJQ-AWEZNQCLSA-N 1 1 362.455 2.529 20 5 FFBDMO COCC[N@H+]1CC[C@H](NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000264985390 509810212 /nfs/dbraw/zinc/81/02/12/509810212.db2.gz VLNOGQRGMUTFJQ-AWEZNQCLSA-N 1 1 362.455 2.529 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](c4nnc5n4CCC5)C3)nc2c1 ZINC000177078198 509857731 /nfs/dbraw/zinc/85/77/31/509857731.db2.gz ASRCIVIKHCYQAV-GFCCVEGCSA-N 1 1 368.397 2.653 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](c4nnc5n4CCC5)C3)nc2c1 ZINC000177078198 509857739 /nfs/dbraw/zinc/85/77/39/509857739.db2.gz ASRCIVIKHCYQAV-GFCCVEGCSA-N 1 1 368.397 2.653 20 5 FFBDMO C[C@H](CNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[N@H+]1CCC[C@@H](C)C1 ZINC000253542022 509889326 /nfs/dbraw/zinc/88/93/26/509889326.db2.gz MWKCHWVNIGDFBR-CHWSQXEVSA-N 1 1 372.425 2.699 20 5 FFBDMO O=C1OCC[C@@]12CCC[N@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186752639 509889576 /nfs/dbraw/zinc/88/95/76/509889576.db2.gz IFTYIEYRNBDZPU-SFHVURJKSA-N 1 1 357.366 2.574 20 5 FFBDMO O=C1OCC[C@@]12CCC[N@@H+]2CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000186752639 509889582 /nfs/dbraw/zinc/88/95/82/509889582.db2.gz IFTYIEYRNBDZPU-SFHVURJKSA-N 1 1 357.366 2.574 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000177138855 509895439 /nfs/dbraw/zinc/89/54/39/509895439.db2.gz DWXKROFEJHXYPI-CMPLNLGQSA-N 1 1 370.356 2.897 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000177144766 509899941 /nfs/dbraw/zinc/89/99/41/509899941.db2.gz QOJICPSGNNCOFI-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000177144766 509899949 /nfs/dbraw/zinc/89/99/49/509899949.db2.gz QOJICPSGNNCOFI-NSHDSACASA-N 1 1 363.414 2.972 20 5 FFBDMO Cc1nnc([C@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)[nH]1 ZINC000268417390 509916220 /nfs/dbraw/zinc/91/62/20/509916220.db2.gz BYJYEALDACWMGT-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000268417390 509916229 /nfs/dbraw/zinc/91/62/29/509916229.db2.gz BYJYEALDACWMGT-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1n[nH]c([C@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n1 ZINC000268417390 509916236 /nfs/dbraw/zinc/91/62/36/509916236.db2.gz BYJYEALDACWMGT-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n[nH]1 ZINC000268417390 509916242 /nfs/dbraw/zinc/91/62/42/509916242.db2.gz BYJYEALDACWMGT-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO Cc1nc([C@H]2CCC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)n[nH]1 ZINC000268417390 509916248 /nfs/dbraw/zinc/91/62/48/509916248.db2.gz BYJYEALDACWMGT-AWEZNQCLSA-N 1 1 372.429 2.538 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C[N@H+]1C1CC1 ZINC000177172934 509917511 /nfs/dbraw/zinc/91/75/11/509917511.db2.gz YAQPJSDDWLWLIS-UWVGGRQHSA-N 1 1 368.231 2.712 20 5 FFBDMO Cc1cc(=O)n2nc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)sc2n1 ZINC000193507217 509944387 /nfs/dbraw/zinc/94/43/87/509944387.db2.gz FGRDOZGIVCRUSM-UHFFFAOYSA-N 1 1 373.438 2.778 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C1CC[NH+](Cc2nccn2C)CC1 ZINC000193722509 510036494 /nfs/dbraw/zinc/03/64/94/510036494.db2.gz AXPFPECFJJJLQC-UHFFFAOYSA-N 1 1 371.441 2.796 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193784509 510067883 /nfs/dbraw/zinc/06/78/83/510067883.db2.gz CUWIXLUBOVGEIP-MRXNPFEDSA-N 1 1 354.410 2.550 20 5 FFBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000174346980 510070679 /nfs/dbraw/zinc/07/06/79/510070679.db2.gz PAHTYBFDNHQLLF-UKPHBRMFSA-N 1 1 354.472 2.941 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000184177150 510176273 /nfs/dbraw/zinc/17/62/73/510176273.db2.gz DPRNJAVHLQNCNQ-UHFFFAOYSA-N 1 1 369.487 2.669 20 5 FFBDMO CC[N@@H+](C)[C@H](C(=O)NCc1cc([N+](=O)[O-])ccc1OC)c1ccccc1 ZINC000171479079 510186541 /nfs/dbraw/zinc/18/65/41/510186541.db2.gz CKTJNJVFJDFSFV-SFHVURJKSA-N 1 1 357.410 2.913 20 5 FFBDMO O=C(C[N@H+](C[C@H]1CCCO1)[C@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000245888891 510188713 /nfs/dbraw/zinc/18/87/13/510188713.db2.gz OFIRMPVLTWCFDQ-UONOGXRCSA-N 1 1 365.455 2.520 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCCO1)[C@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000245888891 510188718 /nfs/dbraw/zinc/18/87/18/510188718.db2.gz OFIRMPVLTWCFDQ-UONOGXRCSA-N 1 1 365.455 2.520 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@H]2CCCC[C@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000245920053 510207506 /nfs/dbraw/zinc/20/75/06/510207506.db2.gz GWYQKHAXGFFSRA-CRAIPNDOSA-N 1 1 358.442 2.978 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCS[C@H]4COCC[C@H]43)co2)cc1 ZINC000245920611 510207717 /nfs/dbraw/zinc/20/77/17/510207717.db2.gz SMCKWUFUDGNRKU-CVEARBPZSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@H]4COCC[C@H]43)co2)cc1 ZINC000245920611 510207726 /nfs/dbraw/zinc/20/77/26/510207726.db2.gz SMCKWUFUDGNRKU-CVEARBPZSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000174721330 510269199 /nfs/dbraw/zinc/26/91/99/510269199.db2.gz MVZOVJDKHONBLT-JKSUJKDBSA-N 1 1 350.806 2.643 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccccc2NCc2csc([N+](=O)[O-])c2)CC1 ZINC000187518366 510311559 /nfs/dbraw/zinc/31/15/59/510311559.db2.gz BTXGURQXUKRRIR-UHFFFAOYSA-N 1 1 374.466 2.933 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2CN2CCCC2)cccc1[N+](=O)[O-] ZINC000171708309 510323338 /nfs/dbraw/zinc/32/33/38/510323338.db2.gz GXAMVTZEIWTCDE-MRXNPFEDSA-N 1 1 360.458 2.792 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2CN2CCCC2)cccc1[N+](=O)[O-] ZINC000171708309 510323345 /nfs/dbraw/zinc/32/33/45/510323345.db2.gz GXAMVTZEIWTCDE-MRXNPFEDSA-N 1 1 360.458 2.792 20 5 FFBDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000184453399 510331430 /nfs/dbraw/zinc/33/14/30/510331430.db2.gz LOFKRJIEKNSBLV-YOEHRIQHSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3ccc([N+](=O)[O-])cc3C)CC2)nc(C)[nH+]1 ZINC000174880844 510363051 /nfs/dbraw/zinc/36/30/51/510363051.db2.gz ZNCHVUCXSUDSLZ-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000269453550 510414512 /nfs/dbraw/zinc/41/45/12/510414512.db2.gz GPTPDBXYTJCBLT-ZFWWWQNUSA-N 1 1 371.441 2.834 20 5 FFBDMO O=C(C[NH2+]C1(c2nccs2)CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000175009469 510433707 /nfs/dbraw/zinc/43/37/07/510433707.db2.gz AHEIAYTZXKSITK-UHFFFAOYSA-N 1 1 372.450 3.000 20 5 FFBDMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000175017726 510439533 /nfs/dbraw/zinc/43/95/33/510439533.db2.gz INPLEWFYGKULQB-UKRRQHHQSA-N 1 1 351.834 2.876 20 5 FFBDMO CCc1nc([C@@H](C)[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000184672055 510452959 /nfs/dbraw/zinc/45/29/59/510452959.db2.gz CITMZBWIAAJVEE-YPMHNXCESA-N 1 1 351.428 2.704 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266298927 510504885 /nfs/dbraw/zinc/50/48/85/510504885.db2.gz KNZKPXSRJATNRI-PWSUYJOCSA-N 1 1 357.332 2.922 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000194765188 510517644 /nfs/dbraw/zinc/51/76/44/510517644.db2.gz CYKRBRSLSKJDKL-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO COc1cc(C[NH+]2[C@@H](C)CC(O)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000191138380 510520939 /nfs/dbraw/zinc/52/09/39/510520939.db2.gz FRNYQYVOZAYHED-UWVGGRQHSA-N 1 1 360.357 2.939 20 5 FFBDMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000188009190 510546731 /nfs/dbraw/zinc/54/67/31/510546731.db2.gz QUNZQBPLYFRETG-BDJLRTHQSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)(C)C(=O)NCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000172119423 510553583 /nfs/dbraw/zinc/55/35/83/510553583.db2.gz QXOGOPMVJOJROF-UHFFFAOYSA-N 1 1 362.455 2.970 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000194927190 510594890 /nfs/dbraw/zinc/59/48/90/510594890.db2.gz PWACOEKXJVXMIV-MAUKXSAKSA-N 1 1 352.431 2.616 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000178563913 510664518 /nfs/dbraw/zinc/66/45/18/510664518.db2.gz CHSMWWFRFNXGFL-QGZVFWFLSA-N 1 1 358.394 2.704 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000178563913 510664521 /nfs/dbraw/zinc/66/45/21/510664521.db2.gz CHSMWWFRFNXGFL-QGZVFWFLSA-N 1 1 358.394 2.704 20 5 FFBDMO COC[C@H](Cc1ccccc1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191497522 510689849 /nfs/dbraw/zinc/68/98/49/510689849.db2.gz KIZDCFPROURHRS-IBGZPJMESA-N 1 1 371.437 2.747 20 5 FFBDMO COC[C@H](Cc1ccccc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000191497522 510689855 /nfs/dbraw/zinc/68/98/55/510689855.db2.gz KIZDCFPROURHRS-IBGZPJMESA-N 1 1 371.437 2.747 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000191631162 510760303 /nfs/dbraw/zinc/76/03/03/510760303.db2.gz KUDNIARICWDJDE-HNNXBMFYSA-N 1 1 371.441 2.548 20 5 FFBDMO CC(C)C[C@@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000191640029 510766500 /nfs/dbraw/zinc/76/65/00/510766500.db2.gz IJXXDFIIHACXOU-GOSISDBHSA-N 1 1 350.415 2.834 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000195342088 510794355 /nfs/dbraw/zinc/79/43/55/510794355.db2.gz INDIITBBNSEIKY-UHFFFAOYSA-N 1 1 361.421 2.971 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000182206539 510814420 /nfs/dbraw/zinc/81/44/20/510814420.db2.gz KKHSEBDEYDQSSC-ROUUACIJSA-N 1 1 371.437 2.911 20 5 FFBDMO COC[C@](C)(CCO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000175847973 510822458 /nfs/dbraw/zinc/82/24/58/510822458.db2.gz UGGOYJBHMZSLCY-INIZCTEOSA-N 1 1 351.428 2.595 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1 ZINC000247078828 510828133 /nfs/dbraw/zinc/82/81/33/510828133.db2.gz QSLYPOMPHPUGCX-MAUKXSAKSA-N 1 1 365.474 2.830 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000247167336 510847929 /nfs/dbraw/zinc/84/79/29/510847929.db2.gz AQQSGDRHZLQPAI-GXFFZTMASA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000247182371 510849345 /nfs/dbraw/zinc/84/93/45/510849345.db2.gz BEMANMQPGXHJIF-IINYFYTJSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000247220607 510852809 /nfs/dbraw/zinc/85/28/09/510852809.db2.gz MHGPJHSWEVKVNP-YPMHNXCESA-N 1 1 371.384 2.873 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@H]1c1ccccc1 ZINC000270607715 510922710 /nfs/dbraw/zinc/92/27/10/510922710.db2.gz DWFFNIBEBHYFFG-VQIMIIECSA-N 1 1 373.384 2.674 20 5 FFBDMO CC(=O)c1cccc(OC[C@@H](O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000282341357 510938455 /nfs/dbraw/zinc/93/84/55/510938455.db2.gz BWNDEVRHRYYSPQ-IBGZPJMESA-N 1 1 372.421 2.712 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)[N@H+]1C ZINC000294068121 510945331 /nfs/dbraw/zinc/94/53/31/510945331.db2.gz VNUKAASSCAWCLT-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)[N@@H+]1C ZINC000294068121 510945338 /nfs/dbraw/zinc/94/53/38/510945338.db2.gz VNUKAASSCAWCLT-TXEJJXNPSA-N 1 1 360.439 2.883 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1 ZINC000282478868 510993330 /nfs/dbraw/zinc/99/33/30/510993330.db2.gz LMFNXSRCCSLQGD-PBHICJAKSA-N 1 1 353.438 2.961 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)[C@@H](C)C1 ZINC000279388533 511065832 /nfs/dbraw/zinc/06/58/32/511065832.db2.gz IOUVZFKQKOMXMU-WFASDCNBSA-N 1 1 366.437 2.602 20 5 FFBDMO COc1cc(CNCC[N@H+]2CC=CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000279657389 511165159 /nfs/dbraw/zinc/16/51/59/511165159.db2.gz FVRSYKVDTWHGSP-UHFFFAOYSA-N 1 1 371.384 2.599 20 5 FFBDMO COc1cc(CNCC[N@@H+]2CC=CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000279657389 511165163 /nfs/dbraw/zinc/16/51/63/511165163.db2.gz FVRSYKVDTWHGSP-UHFFFAOYSA-N 1 1 371.384 2.599 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCn3cccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000298086184 511170155 /nfs/dbraw/zinc/17/01/55/511170155.db2.gz KPSXRUAZJDXQHF-ZDUSSCGKSA-N 1 1 358.398 2.810 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1SC ZINC000362958216 511279323 /nfs/dbraw/zinc/27/93/23/511279323.db2.gz PDPLYUNKRPDHQR-NWDGAFQWSA-N 1 1 365.455 2.682 20 5 FFBDMO COC(=O)[C@@H]1CCO[C@H]1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000298429360 511281331 /nfs/dbraw/zinc/28/13/31/511281331.db2.gz YGYNOMOQNQAWIA-WBVHZDCISA-N 1 1 366.389 2.524 20 5 FFBDMO COc1ccc([C@H](CO)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000283224163 511284740 /nfs/dbraw/zinc/28/47/40/511284740.db2.gz IDHKAZLUZNHRIA-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000280010374 511303034 /nfs/dbraw/zinc/30/30/34/511303034.db2.gz LTQROVLWROUWRX-UHFFFAOYSA-N 1 1 365.821 2.844 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])cc1F ZINC000295163294 511305646 /nfs/dbraw/zinc/30/56/46/511305646.db2.gz DJHGTIXOMRRASZ-ZDUSSCGKSA-N 1 1 367.421 2.840 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c([N+](=O)[O-])c1 ZINC000298555490 511327465 /nfs/dbraw/zinc/32/74/65/511327465.db2.gz OQJISBREAKFBJG-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@H]2c2cc[nH]n2)c([N+](=O)[O-])c1 ZINC000298555490 511327469 /nfs/dbraw/zinc/32/74/69/511327469.db2.gz OQJISBREAKFBJG-INIZCTEOSA-N 1 1 373.413 2.882 20 5 FFBDMO C[C@@H]1CN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC000295283127 511347494 /nfs/dbraw/zinc/34/74/94/511347494.db2.gz HXJQAJWEVLXRAU-NSHDSACASA-N 1 1 369.824 2.873 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000363097938 511352763 /nfs/dbraw/zinc/35/27/63/511352763.db2.gz RUKYGYOJSYWCCH-HZPDHXFCSA-N 1 1 358.442 2.552 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCC[C@](C)(OC)CC1 ZINC000280250679 511391580 /nfs/dbraw/zinc/39/15/80/511391580.db2.gz BMGCQFQEQHZNGD-UGSOOPFHSA-N 1 1 365.430 2.821 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000291945517 511401543 /nfs/dbraw/zinc/40/15/43/511401543.db2.gz PYUVLBSXAIHDND-AEFFLSMTSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 ZINC000291945517 511401545 /nfs/dbraw/zinc/40/15/45/511401545.db2.gz PYUVLBSXAIHDND-AEFFLSMTSA-N 1 1 357.410 2.813 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000272258737 511482833 /nfs/dbraw/zinc/48/28/33/511482833.db2.gz MMANXTPZYACIRC-CABCVRRESA-N 1 1 360.458 2.785 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC[N@H+](C2CCC2)C1 ZINC000292173566 511493022 /nfs/dbraw/zinc/49/30/22/511493022.db2.gz DXBCGQDBIFSGNG-AWEZNQCLSA-N 1 1 374.441 2.862 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC000292209116 511506242 /nfs/dbraw/zinc/50/62/42/511506242.db2.gz HERMXQVOUBPJDV-MRXNPFEDSA-N 1 1 353.806 2.567 20 5 FFBDMO Cc1c(C(=O)N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000299205760 511551569 /nfs/dbraw/zinc/55/15/69/511551569.db2.gz ZUUAVECJBOJYSN-OFQRWUPVSA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000365633339 511570966 /nfs/dbraw/zinc/57/09/66/511570966.db2.gz VHESNDUSEWTSCE-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000292404054 511585147 /nfs/dbraw/zinc/58/51/47/511585147.db2.gz TZXFJGRHCBTETJ-HUUCEWRRSA-N 1 1 360.458 2.728 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000365738130 511629706 /nfs/dbraw/zinc/62/97/06/511629706.db2.gz GSIQZPFMMMFERD-IAGOWNOFSA-N 1 1 366.421 2.584 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000363561412 511630000 /nfs/dbraw/zinc/63/00/00/511630000.db2.gz YZDUZENNIFBOLH-GJZGRUSLSA-N 1 1 371.441 2.528 20 5 FFBDMO CCOC(=O)[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000273966708 511672892 /nfs/dbraw/zinc/67/28/92/511672892.db2.gz HCXQCTZMZLWEHU-UTUOFQBUSA-N 1 1 362.386 2.883 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318229 511682194 /nfs/dbraw/zinc/68/21/94/511682194.db2.gz AXCHPEWEMUIPBT-WBVHZDCISA-N 1 1 363.414 2.575 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318229 511682200 /nfs/dbraw/zinc/68/22/00/511682200.db2.gz AXCHPEWEMUIPBT-WBVHZDCISA-N 1 1 363.414 2.575 20 5 FFBDMO CC[NH+]1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000302792168 511715659 /nfs/dbraw/zinc/71/56/59/511715659.db2.gz KHQXYIASVGVXDH-UHFFFAOYSA-N 1 1 374.363 2.580 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](O)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000296402811 511729732 /nfs/dbraw/zinc/72/97/32/511729732.db2.gz UWDSOQCCWLTOCI-GWCFXTLKSA-N 1 1 360.357 2.593 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](O)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000296402811 511729737 /nfs/dbraw/zinc/72/97/37/511729737.db2.gz UWDSOQCCWLTOCI-GWCFXTLKSA-N 1 1 360.357 2.593 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)ccc1Cl ZINC000281182154 511750978 /nfs/dbraw/zinc/75/09/78/511750978.db2.gz CFWUFGPJIWNOTL-UHFFFAOYSA-N 1 1 351.794 2.535 20 5 FFBDMO C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313072431 511787504 /nfs/dbraw/zinc/78/75/04/511787504.db2.gz VPYPMRJWGUBJNJ-GOEBONIOSA-N 1 1 368.437 2.817 20 5 FFBDMO NC(=O)c1cccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000296634299 511830834 /nfs/dbraw/zinc/83/08/34/511830834.db2.gz HXJAIUAXDOFYRZ-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000293094081 511837846 /nfs/dbraw/zinc/83/78/46/511837846.db2.gz TUNDGJSFLXEOEG-LJQANCHMSA-N 1 1 360.458 2.655 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000363937942 511861966 /nfs/dbraw/zinc/86/19/66/511861966.db2.gz MBFDZUJDXOUODW-CVEARBPZSA-N 1 1 372.469 2.942 20 5 FFBDMO C[N@H+]1CCN(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1(C)C ZINC000281670327 511926408 /nfs/dbraw/zinc/92/64/08/511926408.db2.gz PNMNTMMWTJJGRC-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO CN1CC[N@H+](CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1(C)C ZINC000281670327 511926410 /nfs/dbraw/zinc/92/64/10/511926410.db2.gz PNMNTMMWTJJGRC-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO CN1CC[N@@H+](CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1(C)C ZINC000281670327 511926415 /nfs/dbraw/zinc/92/64/15/511926415.db2.gz PNMNTMMWTJJGRC-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO CCc1nocc1C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000293369358 511939818 /nfs/dbraw/zinc/93/98/18/511939818.db2.gz JCIWKEDHPIELRU-UHFFFAOYSA-N 1 1 350.350 2.745 20 5 FFBDMO COc1ccc(NC(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000296904783 511944575 /nfs/dbraw/zinc/94/45/75/511944575.db2.gz SGYYRQWJRKMPFV-ZDUSSCGKSA-N 1 1 362.430 2.942 20 5 FFBDMO Cc1csc(C[N@@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)n1 ZINC000274841004 511959733 /nfs/dbraw/zinc/95/97/33/511959733.db2.gz OMOLWKNTJCVQRL-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO Cc1csc(C[N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)n1 ZINC000274841004 511959743 /nfs/dbraw/zinc/95/97/43/511959743.db2.gz OMOLWKNTJCVQRL-UHFFFAOYSA-N 1 1 372.454 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000297042678 511997174 /nfs/dbraw/zinc/99/71/74/511997174.db2.gz XINYSGHIUFKYOF-ZDUSSCGKSA-N 1 1 362.430 2.942 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+](C(C)C)CC1 ZINC000282067514 512064481 /nfs/dbraw/zinc/06/44/81/512064481.db2.gz WMKMCLUIVADBCN-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000282134756 512085639 /nfs/dbraw/zinc/08/56/39/512085639.db2.gz AEVHXPFQEHDKIW-GFCCVEGCSA-N 1 1 374.363 2.557 20 5 FFBDMO Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)c1ccc([N+](=O)[O-])cn1 ZINC000369556222 512477019 /nfs/dbraw/zinc/47/70/19/512477019.db2.gz KCAXEJVISHCLRE-CRAIPNDOSA-N 1 1 352.394 2.746 20 5 FFBDMO Cn1cc([C@H](O)C[C@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000374258060 512733270 /nfs/dbraw/zinc/73/32/70/512733270.db2.gz ULOBHHVIHUHGCP-JNTLCICBSA-N 1 1 356.426 2.930 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158782 512739041 /nfs/dbraw/zinc/73/90/41/512739041.db2.gz YYIMTECVGBDOMQ-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158782 512739044 /nfs/dbraw/zinc/73/90/44/512739044.db2.gz YYIMTECVGBDOMQ-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158783 512739679 /nfs/dbraw/zinc/73/96/79/512739679.db2.gz YYIMTECVGBDOMQ-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000372158783 512739683 /nfs/dbraw/zinc/73/96/83/512739683.db2.gz YYIMTECVGBDOMQ-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO CCOC(=O)C1(COC)CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000370166119 512798692 /nfs/dbraw/zinc/79/86/92/512798692.db2.gz XPPYRSOYKMDHFB-UHFFFAOYSA-N 1 1 354.378 2.526 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC000411784744 512810254 /nfs/dbraw/zinc/81/02/54/512810254.db2.gz AJXLOKZSAOWGCQ-CYBMUJFWSA-N 1 1 367.446 2.661 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CC[C@H](O)C[C@@H]4C3)o2)c1 ZINC000412051298 512932839 /nfs/dbraw/zinc/93/28/39/512932839.db2.gz WGYXRCQMSXUIHN-UXLLHSPISA-N 1 1 357.410 2.885 20 5 FFBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000376714931 512955120 /nfs/dbraw/zinc/95/51/20/512955120.db2.gz HVVXTDXWLHSOPL-GFCCVEGCSA-N 1 1 360.439 2.925 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000368497908 512974417 /nfs/dbraw/zinc/97/44/17/512974417.db2.gz CEMLXTZLIMUYCZ-UHFFFAOYSA-N 1 1 358.398 2.872 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408001219 512981722 /nfs/dbraw/zinc/98/17/22/512981722.db2.gz OAIWXKNJHFIJJJ-NXEZZACHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)C[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075214 512994333 /nfs/dbraw/zinc/99/43/33/512994333.db2.gz YJUPZGBGZZHJJX-BZUAXINKSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)C[C@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075214 512994337 /nfs/dbraw/zinc/99/43/37/512994337.db2.gz YJUPZGBGZZHJJX-BZUAXINKSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000368602574 513021350 /nfs/dbraw/zinc/02/13/50/513021350.db2.gz KCCKKCXWPMYAQS-HXUWFJFHSA-N 1 1 366.421 2.728 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374865747 513045372 /nfs/dbraw/zinc/04/53/72/513045372.db2.gz SMBUCWNPFOYTFH-RHSMWYFYSA-N 1 1 368.437 2.939 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@H]2C1 ZINC000374918558 513072463 /nfs/dbraw/zinc/07/24/63/513072463.db2.gz SJQHOKSZOQACML-WBMJQRKESA-N 1 1 372.450 2.885 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000445882842 513138016 /nfs/dbraw/zinc/13/80/16/513138016.db2.gz ARCLBQHASRDIHD-GJZGRUSLSA-N 1 1 360.458 2.783 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCC[C@@H](C)C1 ZINC000445887808 513139009 /nfs/dbraw/zinc/13/90/09/513139009.db2.gz UTXNTDQZZXHQOK-HUUCEWRRSA-N 1 1 360.458 2.783 20 5 FFBDMO Cc1nc(NCC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000450401271 513178267 /nfs/dbraw/zinc/17/82/67/513178267.db2.gz HXUZEFSPXKPWHD-WMLDXEAASA-N 1 1 355.442 2.828 20 5 FFBDMO Cc1ccc([C@H](C)NC(=O)N2CC[NH2+]C[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000417859826 513243395 /nfs/dbraw/zinc/24/33/95/513243395.db2.gz XBIDJXLJGKOGEW-KSSFIOAISA-N 1 1 369.425 2.715 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCOC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042785 513266882 /nfs/dbraw/zinc/26/68/82/513266882.db2.gz RHVSAQRLAWQYIA-ZBFHGGJFSA-N 1 1 361.442 2.979 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCOC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000429042785 513266884 /nfs/dbraw/zinc/26/68/84/513266884.db2.gz RHVSAQRLAWQYIA-ZBFHGGJFSA-N 1 1 361.442 2.979 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000415634570 513356550 /nfs/dbraw/zinc/35/65/50/513356550.db2.gz SXAHQXZAUYHLGJ-INIZCTEOSA-N 1 1 374.372 2.921 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2c(F)cccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000434622383 513370683 /nfs/dbraw/zinc/37/06/83/513370683.db2.gz DHFIJHIGIDUCTP-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2c(F)cccc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000434622383 513370684 /nfs/dbraw/zinc/37/06/84/513370684.db2.gz DHFIJHIGIDUCTP-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(c3ncc([N+](=O)[O-])cc3F)CC2)cc1 ZINC000413034271 513397054 /nfs/dbraw/zinc/39/70/54/513397054.db2.gz MFYHRSHSRBYIGC-UHFFFAOYSA-N 1 1 360.389 2.850 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000421793523 513431667 /nfs/dbraw/zinc/43/16/67/513431667.db2.gz WOMSQTAQRZTXIJ-UHFFFAOYSA-N 1 1 363.458 2.642 20 5 FFBDMO CC(C)[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C[C@@H]1CCC(=O)N1 ZINC000425485956 513592321 /nfs/dbraw/zinc/59/23/21/513592321.db2.gz XCIOOUXWYNEEQH-ZDUSSCGKSA-N 1 1 370.247 2.846 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1 ZINC000451311865 513669988 /nfs/dbraw/zinc/66/99/88/513669988.db2.gz ZHNTWAOGJUNOOE-PEYYIBSZSA-N 1 1 374.359 2.975 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451340594 513686670 /nfs/dbraw/zinc/68/66/70/513686670.db2.gz JVXPUFXOVAKAGL-CXHZTBPHSA-N 1 1 361.442 2.937 20 5 FFBDMO O=C1[C@H]([N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)CCN1c1cccc([N+](=O)[O-])c1 ZINC000451343681 513690088 /nfs/dbraw/zinc/69/00/88/513690088.db2.gz OSIQADPCXAQWBR-MKXGPGLRSA-N 1 1 373.453 2.716 20 5 FFBDMO COc1c(C)c[nH+]c(CN(C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000451375891 513709380 /nfs/dbraw/zinc/70/93/80/513709380.db2.gz NHIZOKCPULXFAS-UHFFFAOYSA-N 1 1 372.425 2.994 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000451428946 513746174 /nfs/dbraw/zinc/74/61/74/513746174.db2.gz WVRSOEDPENAZCP-ZZCKCESHSA-N 1 1 361.442 2.856 20 5 FFBDMO COc1cc(CN2CCC([C@@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000430935360 513785345 /nfs/dbraw/zinc/78/53/45/513785345.db2.gz PSFOOMAPZWFJCE-SNVBAGLBSA-N 1 1 359.373 2.764 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562212 513834849 /nfs/dbraw/zinc/83/48/49/513834849.db2.gz IXEDDWXVNDLWNG-BLLLJJGKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562212 513834853 /nfs/dbraw/zinc/83/48/53/513834853.db2.gz IXEDDWXVNDLWNG-BLLLJJGKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000448782568 513896105 /nfs/dbraw/zinc/89/61/05/513896105.db2.gz DZBKIESEVRJTKY-FRRDWIJNSA-N 1 1 367.421 2.839 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431495428 513911513 /nfs/dbraw/zinc/91/15/13/513911513.db2.gz JHIWEFPKLPDWEY-YMTOWFKASA-N 1 1 368.231 2.570 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000426785133 514040545 /nfs/dbraw/zinc/04/05/45/514040545.db2.gz ONHKAOJZXGBMFQ-LBPRGKRZSA-N 1 1 357.838 2.862 20 5 FFBDMO COc1ccc(CSCC(=O)N[C@@H](C)C[N@@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000426797057 514044729 /nfs/dbraw/zinc/04/47/29/514044729.db2.gz FBEHTYGOILUWCS-ZDUSSCGKSA-N 1 1 369.487 2.682 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@]2(CCSC2)C1 ZINC000451964042 514098663 /nfs/dbraw/zinc/09/86/63/514098663.db2.gz INIZLDDUQJSHHO-PBHICJAKSA-N 1 1 352.456 2.554 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1c1ccccc1 ZINC000452010796 514134611 /nfs/dbraw/zinc/13/46/11/514134611.db2.gz WFOCZKRHYOJPJL-MSOLQXFVSA-N 1 1 370.405 2.992 20 5 FFBDMO COc1cc(C[NH+]2CCC(c3ccncn3)CC2)c([N+](=O)[O-])cc1OC ZINC000414470199 514137937 /nfs/dbraw/zinc/13/79/37/514137937.db2.gz LGTJNLDWISSBBN-UHFFFAOYSA-N 1 1 358.398 2.782 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000437345551 514145704 /nfs/dbraw/zinc/14/57/04/514145704.db2.gz LEJYLWNQWNBMQR-YMTOWFKASA-N 1 1 357.332 2.826 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3ccnc4c3cccc4[N+](=O)[O-])CC2)CCO1 ZINC000432315795 514156069 /nfs/dbraw/zinc/15/60/69/514156069.db2.gz SKGMZRBYOBXFMB-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO O=[N+]([O-])c1cccc2c(NC[C@]3([NH+]4CCOCC4)CCSC3)ccnc21 ZINC000432340573 514165666 /nfs/dbraw/zinc/16/56/66/514165666.db2.gz NANRNASGQWPYDO-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+][C@@H](C)C(=O)NC(C)C)o2)c([N+](=O)[O-])c1 ZINC000414542909 514170700 /nfs/dbraw/zinc/17/07/00/514170700.db2.gz LZGBKQMHQHENCZ-LBPRGKRZSA-N 1 1 361.398 2.866 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CNCCC[N@H+]1CCCO[C@H](C)C1 ZINC000432364139 514173234 /nfs/dbraw/zinc/17/32/34/514173234.db2.gz ZVEYYHWEVSDAOF-OAHLLOKOSA-N 1 1 351.447 2.584 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414554335 514176340 /nfs/dbraw/zinc/17/63/40/514176340.db2.gz GWHSLUBYCJOHEN-INIZCTEOSA-N 1 1 358.341 2.971 20 5 FFBDMO COC(=O)[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000414554335 514176346 /nfs/dbraw/zinc/17/63/46/514176346.db2.gz GWHSLUBYCJOHEN-INIZCTEOSA-N 1 1 358.341 2.971 20 5 FFBDMO Cc1cccc(NCCNc2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])[nH+]1 ZINC000427400051 514205325 /nfs/dbraw/zinc/20/53/25/514205325.db2.gz RLMVVBXRNRWOOB-UHFFFAOYSA-N 1 1 357.414 2.960 20 5 FFBDMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000449427519 514206771 /nfs/dbraw/zinc/20/67/71/514206771.db2.gz SLWGINYTKIQFPD-YPMHNXCESA-N 1 1 374.384 2.840 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@H](C3CC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000449542636 514246941 /nfs/dbraw/zinc/24/69/41/514246941.db2.gz QUYKEFHRFITTCE-DNVCBOLYSA-N 1 1 360.410 2.767 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CCCO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000449792021 514353308 /nfs/dbraw/zinc/35/33/08/514353308.db2.gz RBIBBGHNEQKKQW-GFCCVEGCSA-N 1 1 374.384 2.842 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CNCCO2)ccc1Oc1ccc(F)cc1 ZINC000415095371 514439969 /nfs/dbraw/zinc/43/99/69/514439969.db2.gz MJQSLJCNJGPCSF-MRXNPFEDSA-N 1 1 361.373 2.604 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCC[N@@H+](Cc3ccccc3)C2)n1 ZINC000445574998 514494644 /nfs/dbraw/zinc/49/46/44/514494644.db2.gz NZMYZXSUBKTQDT-AWEZNQCLSA-N 1 1 368.397 2.758 20 5 FFBDMO C[C@@H]1C[NH+](Cc2ccccc2NCc2c([N+](=O)[O-])ncn2C)C[C@@H](C)O1 ZINC000470524958 514513999 /nfs/dbraw/zinc/51/39/99/514513999.db2.gz BREFCOLHTZESTD-ZIAGYGMSSA-N 1 1 359.430 2.550 20 5 FFBDMO COC(=O)Cc1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000450218474 514547887 /nfs/dbraw/zinc/54/78/87/514547887.db2.gz XVGHWJZQHVZVGW-KRWDZBQOSA-N 1 1 369.421 2.997 20 5 FFBDMO COc1ccc2c(c1)ncc([N+](=O)[O-])c2NCCc1cn2c([nH+]1)CCCC2 ZINC000450248378 514564311 /nfs/dbraw/zinc/56/43/11/514564311.db2.gz ROXOEHGSBHCORF-UHFFFAOYSA-N 1 1 367.409 2.761 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000458227436 514643794 /nfs/dbraw/zinc/64/37/94/514643794.db2.gz UECDUAWCRXQCMG-ZDUSSCGKSA-N 1 1 351.422 2.860 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000461608268 514662738 /nfs/dbraw/zinc/66/27/38/514662738.db2.gz LDVKVEUHWALXTP-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO COc1ccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)c1OC ZINC000453583470 514701533 /nfs/dbraw/zinc/70/15/33/514701533.db2.gz YJZBZVIGEJXUMX-UHFFFAOYSA-N 1 1 372.425 2.638 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470976960 514702964 /nfs/dbraw/zinc/70/29/64/514702964.db2.gz MIZFRBOZLUOBJE-ZBFHGGJFSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)ccc1[N+](=O)[O-] ZINC000471058818 514735113 /nfs/dbraw/zinc/73/51/13/514735113.db2.gz GPHDLCKQNQTDLW-IRXDYDNUSA-N 1 1 356.426 2.593 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CC[C@@H](C)C1 ZINC000484890436 514832313 /nfs/dbraw/zinc/83/23/13/514832313.db2.gz FJMQPTAUFUPJGB-ZBFHGGJFSA-N 1 1 361.442 2.621 20 5 FFBDMO COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1scnc1C ZINC000489435725 514846632 /nfs/dbraw/zinc/84/66/32/514846632.db2.gz JTTUOYODYVHHCP-UHFFFAOYSA-N 1 1 351.428 2.887 20 5 FFBDMO CC[NH+](CC)[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)CC(C)C ZINC000498454867 514912914 /nfs/dbraw/zinc/91/29/14/514912914.db2.gz PBORHHPYOVIQBA-CQSZACIVSA-N 1 1 361.446 2.957 20 5 FFBDMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)N1CCCc2ccccc21 ZINC000503212490 514961518 /nfs/dbraw/zinc/96/15/18/514961518.db2.gz POZGDJNQNDFXAD-UHFFFAOYSA-N 1 1 366.421 2.717 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480515375 514984611 /nfs/dbraw/zinc/98/46/11/514984611.db2.gz XLXNQZUIIIBDJW-INIZCTEOSA-N 1 1 368.437 2.888 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)n1C ZINC000485397767 515023243 /nfs/dbraw/zinc/02/32/43/515023243.db2.gz CAHRZXBRQOYCLL-UHFFFAOYSA-N 1 1 370.388 2.629 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485411681 515029715 /nfs/dbraw/zinc/02/97/15/515029715.db2.gz IQCOMYGVSHPYKQ-INIZCTEOSA-N 1 1 374.416 2.741 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000498705634 515031992 /nfs/dbraw/zinc/03/19/92/515031992.db2.gz ITAIVZWCIDWYJH-CVEARBPZSA-N 1 1 374.485 2.997 20 5 FFBDMO CCOC(=O)[C@]1(COC)CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000467552533 515045667 /nfs/dbraw/zinc/04/56/67/515045667.db2.gz XIGFDYLJVCRVGS-GOSISDBHSA-N 1 1 350.415 2.695 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3CCC[C@H]3OC(F)F)n2)c1 ZINC000503526871 515071461 /nfs/dbraw/zinc/07/14/61/515071461.db2.gz SKNUARHZPWUHQX-VXGBXAGGSA-N 1 1 354.313 2.895 20 5 FFBDMO CC[N@@H+](CCNc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1)C1CC1 ZINC000462486290 515078891 /nfs/dbraw/zinc/07/88/91/515078891.db2.gz ARXOVWJGBZHQLJ-UHFFFAOYSA-N 1 1 356.426 2.887 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000480985838 515161967 /nfs/dbraw/zinc/16/19/67/515161967.db2.gz WEWGXMOYPHHDIX-ZFWWWQNUSA-N 1 1 369.487 2.705 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000481009011 515171366 /nfs/dbraw/zinc/17/13/66/515171366.db2.gz FRIGKNOAGPTEJA-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-n3c[nH+]c(C)c3C)cc2)n1 ZINC000462759772 515226821 /nfs/dbraw/zinc/22/68/21/515226821.db2.gz IAVQTLOXZTWTHJ-UHFFFAOYSA-N 1 1 354.370 2.866 20 5 FFBDMO CNc1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000462781606 515242699 /nfs/dbraw/zinc/24/26/99/515242699.db2.gz YWCUOZMBVPHEBY-CZUORRHYSA-N 1 1 358.442 2.725 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000509591629 515247931 /nfs/dbraw/zinc/24/79/31/515247931.db2.gz JXVBXULEXCNTCU-VHSXEESVSA-N 1 1 370.247 2.830 20 5 FFBDMO Cc1c(Br)cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000509591629 515247924 /nfs/dbraw/zinc/24/79/24/515247924.db2.gz JXVBXULEXCNTCU-VHSXEESVSA-N 1 1 370.247 2.830 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485903449 515248274 /nfs/dbraw/zinc/24/82/74/515248274.db2.gz DXTULWNTUKHQEW-RYUDHWBXSA-N 1 1 355.385 2.652 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486033026 515304912 /nfs/dbraw/zinc/30/49/12/515304912.db2.gz ZOVDQCNVCMOBJM-GFCCVEGCSA-N 1 1 355.385 2.652 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000468488422 515381900 /nfs/dbraw/zinc/38/19/00/515381900.db2.gz PLZANJGXQHHRAU-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468702397 515478409 /nfs/dbraw/zinc/47/84/09/515478409.db2.gz ARPKIUZQFUVYOA-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO O=C([C@H]1CCCc2[nH+]ccn21)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000486490725 515507529 /nfs/dbraw/zinc/50/75/29/515507529.db2.gz UJIOLSXJVPIWCM-RHSMWYFYSA-N 1 1 358.423 2.943 20 5 FFBDMO C[C@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000473155604 515517505 /nfs/dbraw/zinc/51/75/05/515517505.db2.gz AZMPEDLFUVRISX-XPTSAGLGSA-N 1 1 369.830 2.960 20 5 FFBDMO O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456998026 515574083 /nfs/dbraw/zinc/57/40/83/515574083.db2.gz RJDADNVAJSBNEM-INIZCTEOSA-N 1 1 355.394 2.537 20 5 FFBDMO COC(=O)[C@H]([N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528602 515621614 /nfs/dbraw/zinc/62/16/14/515621614.db2.gz ZNCZPOIXCQANBM-WBVHZDCISA-N 1 1 362.426 2.885 20 5 FFBDMO COC(=O)[C@H]([N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528602 515621622 /nfs/dbraw/zinc/62/16/22/515621622.db2.gz ZNCZPOIXCQANBM-WBVHZDCISA-N 1 1 362.426 2.885 20 5 FFBDMO COc1ccc(OCC[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000510684420 515635247 /nfs/dbraw/zinc/63/52/47/515635247.db2.gz SVHNRSUAFFZGIE-UHFFFAOYSA-N 1 1 356.382 2.991 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000510684420 515635257 /nfs/dbraw/zinc/63/52/57/515635257.db2.gz SVHNRSUAFFZGIE-UHFFFAOYSA-N 1 1 356.382 2.991 20 5 FFBDMO O=C(NC1CC[NH+](Cc2ccccc2)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505747592 515654766 /nfs/dbraw/zinc/65/47/66/515654766.db2.gz MEWQIUISLZPIBW-UHFFFAOYSA-N 1 1 355.394 2.695 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)cc1OC ZINC000457126157 515672229 /nfs/dbraw/zinc/67/22/29/515672229.db2.gz QWVMSBPRLXUMKT-CYBMUJFWSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1nc2c(s1)CCC2 ZINC000459628894 515706429 /nfs/dbraw/zinc/70/64/29/515706429.db2.gz FSRPAVUZJXUBGZ-XHDPSFHLSA-N 1 1 372.450 2.996 20 5 FFBDMO COc1ccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000494006102 515710451 /nfs/dbraw/zinc/71/04/51/515710451.db2.gz GEEPOXXILYVORV-RHSMWYFYSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nc2c(s1)CCC2 ZINC000459640001 515715318 /nfs/dbraw/zinc/71/53/18/515715318.db2.gz WONKOLGAKVMKHY-NSHDSACASA-N 1 1 372.450 2.780 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000494068632 515723855 /nfs/dbraw/zinc/72/38/55/515723855.db2.gz JAFNWAUNPSJCKU-PBHICJAKSA-N 1 1 369.421 2.996 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1CCOc1ccccc1 ZINC000478226688 515744509 /nfs/dbraw/zinc/74/45/09/515744509.db2.gz IVNDYIXYRGYPIB-HNNXBMFYSA-N 1 1 373.384 2.503 20 5 FFBDMO COc1ccccc1N1CC[C@H]([N@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O ZINC000511074139 515766578 /nfs/dbraw/zinc/76/65/78/515766578.db2.gz SVKRWDOISXGEBE-SFHVURJKSA-N 1 1 369.421 2.883 20 5 FFBDMO COc1ccccc1N1CC[C@H]([N@@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O ZINC000511074139 515766583 /nfs/dbraw/zinc/76/65/83/515766583.db2.gz SVKRWDOISXGEBE-SFHVURJKSA-N 1 1 369.421 2.883 20 5 FFBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CCSCC1 ZINC000506492315 515897722 /nfs/dbraw/zinc/89/77/22/515897722.db2.gz CZWJJLPBJXLSHC-UHFFFAOYSA-N 1 1 369.512 2.876 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CO)ncc1[N+](=O)[O-] ZINC000474152235 515907169 /nfs/dbraw/zinc/90/71/69/515907169.db2.gz TZWLQGASRSYUCW-SJORKVTESA-N 1 1 356.426 2.593 20 5 FFBDMO C[C@@H](CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1 ZINC000511471399 515916134 /nfs/dbraw/zinc/91/61/34/515916134.db2.gz AORYDJHUBHUQQH-CVEARBPZSA-N 1 1 362.474 2.899 20 5 FFBDMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)o1 ZINC000483184466 515971657 /nfs/dbraw/zinc/97/16/57/515971657.db2.gz XFMXFXOPNFIHRB-UHFFFAOYSA-N 1 1 361.398 2.628 20 5 FFBDMO CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1 ZINC000483189282 515976717 /nfs/dbraw/zinc/97/67/17/515976717.db2.gz BZNQRSFOCSWOCA-SFHVURJKSA-N 1 1 350.415 2.634 20 5 FFBDMO C[N@H+](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCSC1 ZINC000501288809 516046260 /nfs/dbraw/zinc/04/62/60/516046260.db2.gz ITKZCKSBYSMWFD-NSHDSACASA-N 1 1 374.260 2.733 20 5 FFBDMO C[N@@H+](CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CCSC1 ZINC000501288809 516046266 /nfs/dbraw/zinc/04/62/66/516046266.db2.gz ITKZCKSBYSMWFD-NSHDSACASA-N 1 1 374.260 2.733 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCCOC2)O1 ZINC000483368861 516052126 /nfs/dbraw/zinc/05/21/26/516052126.db2.gz CLGLUPQRQLKDRO-CRAIPNDOSA-N 1 1 350.415 2.634 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[C@@H]1C ZINC000487959910 516052938 /nfs/dbraw/zinc/05/29/38/516052938.db2.gz SJHNMFFPFCZGFS-YOEHRIQHSA-N 1 1 361.442 2.621 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487971572 516060319 /nfs/dbraw/zinc/06/03/19/516060319.db2.gz WXXFYTUHOHTORK-UHFFFAOYSA-N 1 1 356.854 2.822 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000470007119 516078807 /nfs/dbraw/zinc/07/88/07/516078807.db2.gz ARRMNEODRJVJJM-KOLCDFICSA-N 1 1 374.340 2.588 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])[C@@H]1C ZINC000470007119 516078814 /nfs/dbraw/zinc/07/88/14/516078814.db2.gz ARRMNEODRJVJJM-KOLCDFICSA-N 1 1 374.340 2.588 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CC)C[C@H]1CC ZINC000455357508 516144283 /nfs/dbraw/zinc/14/42/83/516144283.db2.gz KPUYWMKKGCDZDN-CYBMUJFWSA-N 1 1 350.419 2.942 20 5 FFBDMO O=C([C@H]1CCC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000470290659 516195762 /nfs/dbraw/zinc/19/57/62/516195762.db2.gz WFJWPLQUCVKIMU-GOSISDBHSA-N 1 1 359.426 2.591 20 5 FFBDMO Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CCO2 ZINC000512279938 516221633 /nfs/dbraw/zinc/22/16/33/516221633.db2.gz VHGJAKCUPQLZDH-MRXNPFEDSA-N 1 1 358.394 2.538 20 5 FFBDMO Cc1ccc2c(c1)C[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CCO2 ZINC000512279938 516221637 /nfs/dbraw/zinc/22/16/37/516221637.db2.gz VHGJAKCUPQLZDH-MRXNPFEDSA-N 1 1 358.394 2.538 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000488475660 516234668 /nfs/dbraw/zinc/23/46/68/516234668.db2.gz JRGBBCHHLSPYIU-HOCLYGCPSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1cc(OCC(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000484147700 516305730 /nfs/dbraw/zinc/30/57/30/516305730.db2.gz QISFBYHKQOEYKN-OAHLLOKOSA-N 1 1 363.458 2.910 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000535383502 516334285 /nfs/dbraw/zinc/33/42/85/516334285.db2.gz CJWIJJGCCGTMPC-UKRRQHHQSA-N 1 1 358.442 2.950 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](COC(F)F)C1 ZINC000512822156 516374082 /nfs/dbraw/zinc/37/40/82/516374082.db2.gz FMOOSQJKISBABA-LBPRGKRZSA-N 1 1 357.357 2.793 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1 ZINC000561153614 516411487 /nfs/dbraw/zinc/41/14/87/516411487.db2.gz FPRUCWBJWZQGDK-DZGCQCFKSA-N 1 1 354.410 2.941 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NCC[NH+]2CCN(c3ccccc3)CC2)n1 ZINC000543792660 516432025 /nfs/dbraw/zinc/43/20/25/516432025.db2.gz SZFDDMCSVHEFGK-UHFFFAOYSA-N 1 1 355.442 2.841 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[N@H+]2CCC[C@H](C)C2)n1 ZINC000561182967 516434998 /nfs/dbraw/zinc/43/49/98/516434998.db2.gz CVFCURIVAZTMHK-LBPRGKRZSA-N 1 1 350.419 2.699 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000543859739 516464426 /nfs/dbraw/zinc/46/44/26/516464426.db2.gz WEOZYXRIKIJYGM-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COC(=O)c1ccccc1OCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000543859739 516464434 /nfs/dbraw/zinc/46/44/34/516464434.db2.gz WEOZYXRIKIJYGM-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000517922372 516494298 /nfs/dbraw/zinc/49/42/98/516494298.db2.gz HYQHIGFRUPAPPE-HNNXBMFYSA-N 1 1 359.357 2.529 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1)C1CCCCC1 ZINC000547733546 516525970 /nfs/dbraw/zinc/52/59/70/516525970.db2.gz PZDFZGDXBPJSRR-UHFFFAOYSA-N 1 1 374.485 2.898 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000518052914 516534873 /nfs/dbraw/zinc/53/48/73/516534873.db2.gz OGBBNAZXXIVQLI-INIZCTEOSA-N 1 1 359.430 2.711 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000544190704 516635131 /nfs/dbraw/zinc/63/51/31/516635131.db2.gz SCSLHRMJTLAERV-ZDUSSCGKSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2O)c([N+](=O)[O-])c1 ZINC000544190704 516635140 /nfs/dbraw/zinc/63/51/40/516635140.db2.gz SCSLHRMJTLAERV-ZDUSSCGKSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C ZINC000544298837 516686821 /nfs/dbraw/zinc/68/68/21/516686821.db2.gz GSDGHAAOEQYZJH-ZIAGYGMSSA-N 1 1 364.446 2.666 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000524485595 516734848 /nfs/dbraw/zinc/73/48/48/516734848.db2.gz XESJJWIULRGPPB-TXEJJXNPSA-N 1 1 366.437 2.802 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000524617634 516769498 /nfs/dbraw/zinc/76/94/98/516769498.db2.gz BPSSAQRVMOCSSG-GJZGRUSLSA-N 1 1 371.441 2.725 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)[NH+](C)C ZINC000524681135 516787852 /nfs/dbraw/zinc/78/78/52/516787852.db2.gz XJSGCPMFKOEJSN-MRXNPFEDSA-N 1 1 361.373 2.775 20 5 FFBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1COC[C@H]1O ZINC000561961003 516849116 /nfs/dbraw/zinc/84/91/16/516849116.db2.gz BDWWCCBPWUOZQV-HUUCEWRRSA-N 1 1 352.774 2.700 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000524879800 516856860 /nfs/dbraw/zinc/85/68/60/516856860.db2.gz UGVOEKONXGITFT-HOCLYGCPSA-N 1 1 371.441 2.725 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000525053986 516903502 /nfs/dbraw/zinc/90/35/02/516903502.db2.gz TUMQXMIUMCTRDE-JSGCOSHPSA-N 1 1 365.430 2.557 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cc([N+](=O)[O-])cn1C ZINC000525385267 517023736 /nfs/dbraw/zinc/02/37/36/517023736.db2.gz SLPUPTWZJHSQSH-HNNXBMFYSA-N 1 1 356.426 2.670 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1 ZINC000541393672 517029820 /nfs/dbraw/zinc/02/98/20/517029820.db2.gz MBEDYKOVRURWSJ-NSHDSACASA-N 1 1 355.847 2.693 20 5 FFBDMO NC(=O)C[N@@H+]1CCc2ccc(N[C@H]3CCc4c3cccc4[N+](=O)[O-])cc2C1 ZINC000519620277 517083231 /nfs/dbraw/zinc/08/32/31/517083231.db2.gz YSGNWMFXJAVNHU-SFHVURJKSA-N 1 1 366.421 2.538 20 5 FFBDMO NC(=O)C[N@H+]1CCc2ccc(N[C@H]3CCc4c3cccc4[N+](=O)[O-])cc2C1 ZINC000519620277 517083236 /nfs/dbraw/zinc/08/32/36/517083236.db2.gz YSGNWMFXJAVNHU-SFHVURJKSA-N 1 1 366.421 2.538 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000541576012 517120029 /nfs/dbraw/zinc/12/00/29/517120029.db2.gz QAYXSRZTWLSKSP-LLVKDONJSA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N(C)[C@@H]2CC[N@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000541576012 517120038 /nfs/dbraw/zinc/12/00/38/517120038.db2.gz QAYXSRZTWLSKSP-LLVKDONJSA-N 1 1 355.236 2.734 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000532900623 517192323 /nfs/dbraw/zinc/19/23/23/517192323.db2.gz JKDNAZAJLHQXNX-LLVKDONJSA-N 1 1 370.247 2.817 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C ZINC000532988299 517239983 /nfs/dbraw/zinc/23/99/83/517239983.db2.gz ACCDSAPUAUPOAG-OLZOCXBDSA-N 1 1 368.865 2.991 20 5 FFBDMO CC(C)(O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCOCC1 ZINC000537635794 517274088 /nfs/dbraw/zinc/27/40/88/517274088.db2.gz VXISIYKSQDXSKX-UHFFFAOYSA-N 1 1 374.384 2.948 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)n1 ZINC000541935114 517299305 /nfs/dbraw/zinc/29/93/05/517299305.db2.gz GOVPMIPYVVCHEP-CALCHBBNSA-N 1 1 361.490 2.601 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294723 517387687 /nfs/dbraw/zinc/38/76/87/517387687.db2.gz CUCHQRBMBQNDPW-DLBZAZTESA-N 1 1 361.442 2.619 20 5 FFBDMO CCO[C@@H]1C[C@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000533294723 517387696 /nfs/dbraw/zinc/38/76/96/517387696.db2.gz CUCHQRBMBQNDPW-DLBZAZTESA-N 1 1 361.442 2.619 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000533312692 517401314 /nfs/dbraw/zinc/40/13/14/517401314.db2.gz NQNRUCONUIBKRL-YOEHRIQHSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@H]1Cc2ccccc2C[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000533438255 517464446 /nfs/dbraw/zinc/46/44/46/517464446.db2.gz KUOVKNVPEKSNLL-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO C[C@H]1Cc2ccccc2C[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000533438255 517464454 /nfs/dbraw/zinc/46/44/54/517464454.db2.gz KUOVKNVPEKSNLL-AWEZNQCLSA-N 1 1 351.406 2.931 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000538262762 517529345 /nfs/dbraw/zinc/52/93/45/517529345.db2.gz HZWLVNFSFVNEPQ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000538262762 517529352 /nfs/dbraw/zinc/52/93/52/517529352.db2.gz HZWLVNFSFVNEPQ-FSZRXZPDSA-N 1 1 363.458 2.906 20 5 FFBDMO CC(C)(C)[C@H]1CCC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000527284012 517615268 /nfs/dbraw/zinc/61/52/68/517615268.db2.gz VFHQADJVHYJKGF-XJKSGUPXSA-N 1 1 359.426 2.985 20 5 FFBDMO C[C@H]1C[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000553446418 517718663 /nfs/dbraw/zinc/71/86/63/517718663.db2.gz FQIIDKXWSVQGCJ-DZGCQCFKSA-N 1 1 354.410 2.769 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000553446420 517719008 /nfs/dbraw/zinc/71/90/08/517719008.db2.gz FQIIDKXWSVQGCJ-UKRRQHHQSA-N 1 1 354.410 2.769 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538791496 517782794 /nfs/dbraw/zinc/78/27/94/517782794.db2.gz ADRPXEZOQUWHEJ-MAUKXSAKSA-N 1 1 356.426 2.996 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CCO)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000560528536 517873642 /nfs/dbraw/zinc/87/36/42/517873642.db2.gz HNSXWSJKKAVXLV-KRWDZBQOSA-N 1 1 358.442 2.950 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553768739 517892961 /nfs/dbraw/zinc/89/29/61/517892961.db2.gz SZTYJEMKCCNRTC-DVOMOZLQSA-N 1 1 361.442 2.714 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000553785598 517904022 /nfs/dbraw/zinc/90/40/22/517904022.db2.gz GXIBDXRTQQWTOC-PMUMKWKESA-N 1 1 372.469 2.971 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])cc2OC(F)F)C1 ZINC000546895716 517911965 /nfs/dbraw/zinc/91/19/65/517911965.db2.gz IMBOIIFSFXWOBK-CYBMUJFWSA-N 1 1 359.373 2.965 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534541956 517933416 /nfs/dbraw/zinc/93/34/16/517933416.db2.gz OHBRVTCBMCASLH-INIZCTEOSA-N 1 1 355.394 2.910 20 5 FFBDMO CCOc1ccc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000534541956 517933423 /nfs/dbraw/zinc/93/34/23/517933423.db2.gz OHBRVTCBMCASLH-INIZCTEOSA-N 1 1 355.394 2.910 20 5 FFBDMO C[C@H](CO)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000553907372 517963899 /nfs/dbraw/zinc/96/38/99/517963899.db2.gz ZWZSXVWQIZVQHJ-LLVKDONJSA-N 1 1 355.822 2.812 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000560836011 518054963 /nfs/dbraw/zinc/05/49/63/518054963.db2.gz KULBMKRRFXSTNW-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000560836011 518054971 /nfs/dbraw/zinc/05/49/71/518054971.db2.gz KULBMKRRFXSTNW-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])cn1C ZINC000547421413 518130210 /nfs/dbraw/zinc/13/02/10/518130210.db2.gz DXXOWBCDIGGVOL-KRWDZBQOSA-N 1 1 358.442 2.820 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000535274569 518172565 /nfs/dbraw/zinc/17/25/65/518172565.db2.gz GDVNNKNXQNMFHB-QGZVFWFLSA-N 1 1 357.435 2.990 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000535274569 518172566 /nfs/dbraw/zinc/17/25/66/518172566.db2.gz GDVNNKNXQNMFHB-QGZVFWFLSA-N 1 1 357.435 2.990 20 5 FFBDMO COC(=O)[C@H]([C@@H](C)O)[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000569627600 518210966 /nfs/dbraw/zinc/21/09/66/518210966.db2.gz SGWHORNOADMBSK-BEFAXECRSA-N 1 1 372.421 2.562 20 5 FFBDMO COC(=O)[C@H]([C@@H](C)O)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000569627600 518210969 /nfs/dbraw/zinc/21/09/69/518210969.db2.gz SGWHORNOADMBSK-BEFAXECRSA-N 1 1 372.421 2.562 20 5 FFBDMO O=[N+]([O-])c1ccccc1N1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000584357221 518300586 /nfs/dbraw/zinc/30/05/86/518300586.db2.gz XHAOQOFVXXVHEW-LJQANCHMSA-N 1 1 366.465 2.991 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000572807681 518369239 /nfs/dbraw/zinc/36/92/39/518369239.db2.gz DOLROZRNBLPMFF-JTQLQIEISA-N 1 1 358.236 2.816 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000584547549 518393624 /nfs/dbraw/zinc/39/36/24/518393624.db2.gz HGLQJOMBIQMINR-XWCIJXRUSA-N 1 1 367.396 2.604 20 5 FFBDMO CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCOC(C)(C)C1 ZINC000573142701 518524539 /nfs/dbraw/zinc/52/45/39/518524539.db2.gz HGFJWUSNYGVJAS-INIZCTEOSA-N 1 1 361.442 2.763 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023202 518550734 /nfs/dbraw/zinc/55/07/34/518550734.db2.gz WQYDAQXKEKSYCX-DGCLKSJQSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000582023202 518550743 /nfs/dbraw/zinc/55/07/43/518550743.db2.gz WQYDAQXKEKSYCX-DGCLKSJQSA-N 1 1 355.822 2.568 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNCC(=O)NCC[NH+]1CCCCCC1 ZINC000564718953 518580364 /nfs/dbraw/zinc/58/03/64/518580364.db2.gz UJBDMZMDCLXXSX-LGMDPLHJSA-N 1 1 374.485 2.580 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000579376483 518651367 /nfs/dbraw/zinc/65/13/67/518651367.db2.gz SPDCCAOKOPDTNM-CTNGQTDRSA-N 1 1 367.449 2.809 20 5 FFBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1 ZINC000579376483 518651371 /nfs/dbraw/zinc/65/13/71/518651371.db2.gz SPDCCAOKOPDTNM-CTNGQTDRSA-N 1 1 367.449 2.809 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C[N@H+]1C1CC1 ZINC000582311530 518692875 /nfs/dbraw/zinc/69/28/75/518692875.db2.gz PCEAFIZSXZNNDI-OLZOCXBDSA-N 1 1 364.421 2.608 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H](C)CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000582327862 518697179 /nfs/dbraw/zinc/69/71/79/518697179.db2.gz AXWSVLISSCNEQK-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)CO)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000582327862 518697184 /nfs/dbraw/zinc/69/71/84/518697184.db2.gz AXWSVLISSCNEQK-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000573633609 518759857 /nfs/dbraw/zinc/75/98/57/518759857.db2.gz MFEREMLEOWIZLC-LLVKDONJSA-N 1 1 374.363 2.755 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000582572394 518818193 /nfs/dbraw/zinc/81/81/93/518818193.db2.gz LXGFBLJUOYRTLD-UHFFFAOYSA-N 1 1 361.442 2.942 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000582807917 518932083 /nfs/dbraw/zinc/93/20/83/518932083.db2.gz MGJINXAHSZODNP-BZNIZROVSA-N 1 1 355.385 2.604 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)OC2(CCC2)C1 ZINC000579948488 518934214 /nfs/dbraw/zinc/93/42/14/518934214.db2.gz HMOPAJVLQCWSAF-CYBMUJFWSA-N 1 1 363.414 2.575 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](Cc2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000589202587 518949484 /nfs/dbraw/zinc/94/94/84/518949484.db2.gz KPWXREGSJOFRNX-UHFFFAOYSA-N 1 1 371.393 2.706 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](Cc2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000589202587 518949491 /nfs/dbraw/zinc/94/94/91/518949491.db2.gz KPWXREGSJOFRNX-UHFFFAOYSA-N 1 1 371.393 2.706 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](CCO)c2ccccc2)c1 ZINC000589499795 519020454 /nfs/dbraw/zinc/02/04/54/519020454.db2.gz CYFDNVUDOJNODA-KRWDZBQOSA-N 1 1 358.394 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](CCO)c2ccccc2)c1 ZINC000589499795 519020460 /nfs/dbraw/zinc/02/04/60/519020460.db2.gz CYFDNVUDOJNODA-KRWDZBQOSA-N 1 1 358.394 2.937 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H]2COC[C@H]2OC)cc1OC ZINC000580309203 519110796 /nfs/dbraw/zinc/11/07/96/519110796.db2.gz LNDCYSDTRLFXAP-WPKBUWHJSA-N 1 1 368.430 2.532 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000590554534 519264572 /nfs/dbraw/zinc/26/45/72/519264572.db2.gz DIVUWCUSCLGKCP-GFCCVEGCSA-N 1 1 367.833 2.574 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1F ZINC000590685970 519316703 /nfs/dbraw/zinc/31/67/03/519316703.db2.gz MRABCTFAFULCAM-OAHLLOKOSA-N 1 1 359.357 2.659 20 5 FFBDMO COc1cc(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1F ZINC000590685970 519316710 /nfs/dbraw/zinc/31/67/10/519316710.db2.gz MRABCTFAFULCAM-OAHLLOKOSA-N 1 1 359.357 2.659 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@@H]2CCCNC2=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591245205 519560963 /nfs/dbraw/zinc/56/09/63/519560963.db2.gz QXOUFMPPZNBYDT-KSSFIOAISA-N 1 1 357.410 2.955 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000591510766 519933927 /nfs/dbraw/zinc/93/39/27/519933927.db2.gz JISDUFZCNFUMHH-IRXDYDNUSA-N 1 1 361.442 2.585 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594419217 519954329 /nfs/dbraw/zinc/95/43/29/519954329.db2.gz PIKLCMFPNBITGP-IAGOWNOFSA-N 1 1 359.426 2.691 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599999205 519993943 /nfs/dbraw/zinc/99/39/43/519993943.db2.gz MODAPRLJJDCVEO-NSHDSACASA-N 1 1 370.247 2.912 20 5 FFBDMO CN(C)CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000591742773 520019237 /nfs/dbraw/zinc/01/92/37/520019237.db2.gz DTIDRCMANPDTIC-MRXNPFEDSA-N 1 1 350.463 2.879 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H]3CCC(=O)N(C)C3)o2)c([N+](=O)[O-])c1 ZINC000600178258 520103433 /nfs/dbraw/zinc/10/34/33/520103433.db2.gz JOFYFVMGMHTNSD-CYBMUJFWSA-N 1 1 373.409 2.916 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594853964 520190678 /nfs/dbraw/zinc/19/06/78/520190678.db2.gz BQEZYWSLQKOGPS-CQSZACIVSA-N 1 1 367.471 2.589 20 5 FFBDMO CC1(C)CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609193362 520227475 /nfs/dbraw/zinc/22/74/75/520227475.db2.gz CJBFQYAKSFKBKC-UHFFFAOYSA-N 1 1 368.437 2.795 20 5 FFBDMO COc1cc(C[NH2+]Cc2c(C3CCC3)cnn2C)c([N+](=O)[O-])cc1OC ZINC000594982905 520241908 /nfs/dbraw/zinc/24/19/08/520241908.db2.gz ILRIWYFHVJUXQA-UHFFFAOYSA-N 1 1 360.414 2.903 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000603400535 520247103 /nfs/dbraw/zinc/24/71/03/520247103.db2.gz HWLONMRBLITKDZ-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000603403887 520249099 /nfs/dbraw/zinc/24/90/99/520249099.db2.gz WNHGIWSITJOZAR-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)nc1 ZINC000595004919 520252880 /nfs/dbraw/zinc/25/28/80/520252880.db2.gz UGRXELZODYFVNP-AWEZNQCLSA-N 1 1 372.425 2.686 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C(C)C)N1CCN(C)CC1 ZINC000595007482 520254104 /nfs/dbraw/zinc/25/41/04/520254104.db2.gz OEVJQLGTRDBTIL-YJBOKZPZSA-N 1 1 364.490 2.526 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C\c1nc([C@@H]2C[N@@H+]3CCC[C@@H]3CO2)no1 ZINC000612981961 520255908 /nfs/dbraw/zinc/25/59/08/520255908.db2.gz GXXHGJCBVZQWNY-CWNOIDMWSA-N 1 1 360.345 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C\c1nc([C@@H]2C[N@H+]3CCC[C@@H]3CO2)no1 ZINC000612981961 520255914 /nfs/dbraw/zinc/25/59/14/520255914.db2.gz GXXHGJCBVZQWNY-CWNOIDMWSA-N 1 1 360.345 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C/c1nc([C@@H]2C[N@@H+]3CCC[C@H]3CO2)no1 ZINC000612981976 520256063 /nfs/dbraw/zinc/25/60/63/520256063.db2.gz GXXHGJCBVZQWNY-VZFYUFDISA-N 1 1 360.345 2.823 20 5 FFBDMO O=[N+]([O-])c1cc(F)ccc1/C=C/c1nc([C@@H]2C[N@H+]3CCC[C@H]3CO2)no1 ZINC000612981976 520256071 /nfs/dbraw/zinc/25/60/71/520256071.db2.gz GXXHGJCBVZQWNY-VZFYUFDISA-N 1 1 360.345 2.823 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)C(=O)N(C)C ZINC000595015382 520256863 /nfs/dbraw/zinc/25/68/63/520256863.db2.gz DEXNOHVNCOFEHD-KSSFIOAISA-N 1 1 371.437 2.954 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000595048853 520270347 /nfs/dbraw/zinc/27/03/47/520270347.db2.gz RQAZIEOAYOASLM-HUUCEWRRSA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000597859792 520286110 /nfs/dbraw/zinc/28/61/10/520286110.db2.gz YEHGDCGCULPVAX-LLVKDONJSA-N 1 1 370.247 2.960 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000609506492 520336197 /nfs/dbraw/zinc/33/61/97/520336197.db2.gz BHLMZTDIMFNVHX-ALOPSCKCSA-N 1 1 368.437 2.859 20 5 FFBDMO CCOc1cc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000617194781 520376928 /nfs/dbraw/zinc/37/69/28/520376928.db2.gz OLQDVQUCSJMFBJ-QGZVFWFLSA-N 1 1 363.458 2.680 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000603983592 520422492 /nfs/dbraw/zinc/42/24/92/520422492.db2.gz ZJULWDFLJVDNPK-OKILXGFUSA-N 1 1 369.487 2.550 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1 ZINC000598195963 520487356 /nfs/dbraw/zinc/48/73/56/520487356.db2.gz XUNDMHQNEUMEFI-MRXNPFEDSA-N 1 1 368.437 2.566 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595467541 520491023 /nfs/dbraw/zinc/49/10/23/520491023.db2.gz HPUYAJITRGFUHJ-INIZCTEOSA-N 1 1 360.458 2.844 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)C[C@H](C)O1 ZINC000609975673 520494264 /nfs/dbraw/zinc/49/42/64/520494264.db2.gz NVHWFTBMNHAOHL-OKILXGFUSA-N 1 1 372.425 2.795 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(NC(=O)c3cc([N+](=O)[O-])cn3C)c2)C[C@H](C)O1 ZINC000609975673 520494270 /nfs/dbraw/zinc/49/42/70/520494270.db2.gz NVHWFTBMNHAOHL-OKILXGFUSA-N 1 1 372.425 2.795 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609984190 520495980 /nfs/dbraw/zinc/49/59/80/520495980.db2.gz QSZCKIZXORNEOA-WFASDCNBSA-N 1 1 369.849 2.814 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC23CCOCC3)cn1 ZINC000595513503 520521516 /nfs/dbraw/zinc/52/15/16/520521516.db2.gz FUQLUGUUBBNIRK-KRWDZBQOSA-N 1 1 374.416 2.864 20 5 FFBDMO COc1cccc(SCC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 ZINC000595522422 520527961 /nfs/dbraw/zinc/52/79/61/520527961.db2.gz BORAJPPSWLQWLF-UHFFFAOYSA-N 1 1 374.466 2.913 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C[C@H]1C ZINC000610125932 520551139 /nfs/dbraw/zinc/55/11/39/520551139.db2.gz ZCPQSERXIKGIHJ-GDBMZVCRSA-N 1 1 358.442 2.881 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000592883108 520633685 /nfs/dbraw/zinc/63/36/85/520633685.db2.gz WUGFBWYYBQIUAP-MSOLQXFVSA-N 1 1 353.422 2.978 20 5 FFBDMO C[C@H]1COC2(CCC2)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000595682273 520644705 /nfs/dbraw/zinc/64/47/05/520644705.db2.gz QBYGWKMOMAOPJO-ZDUSSCGKSA-N 1 1 361.398 2.536 20 5 FFBDMO CCO[C@@H]1C[C@H](O)C12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601119434 520645822 /nfs/dbraw/zinc/64/58/22/520645822.db2.gz RRMYESFWHOPERH-ZWKOTPCHSA-N 1 1 357.410 2.899 20 5 FFBDMO Cc1cc(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)nc(N2CCCC2)n1 ZINC000601167816 520670497 /nfs/dbraw/zinc/67/04/97/520670497.db2.gz FRSYPECEFXZZKO-UHFFFAOYSA-N 1 1 364.409 2.876 20 5 FFBDMO Cn1ccnc1[C@H]1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000601172933 520671994 /nfs/dbraw/zinc/67/19/94/520671994.db2.gz LRKWYSDGWYVSST-YVEFUNNKSA-N 1 1 353.382 2.631 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](CCO)c2ccc(OC)cc2)c1 ZINC000593018987 520687548 /nfs/dbraw/zinc/68/75/48/520687548.db2.gz HLJTVPRYMWCMDU-KRWDZBQOSA-N 1 1 374.393 2.603 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749752 520697885 /nfs/dbraw/zinc/69/78/85/520697885.db2.gz HHMNZYNYWNEOBZ-QGZVFWFLSA-N 1 1 372.368 2.942 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@]3(O)C[C@H]3C2)cc1OC ZINC000595759514 520704552 /nfs/dbraw/zinc/70/45/52/520704552.db2.gz WDOXDPVTFGWVMT-ZUEVXXBESA-N 1 1 364.442 2.985 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(O)C[C@H]3C2)cc1OC ZINC000595759514 520704560 /nfs/dbraw/zinc/70/45/60/520704560.db2.gz WDOXDPVTFGWVMT-ZUEVXXBESA-N 1 1 364.442 2.985 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)CC[C@@H]21 ZINC000601334226 520746201 /nfs/dbraw/zinc/74/62/01/520746201.db2.gz ZGEFKMFZJJSQQB-QAPCUYQASA-N 1 1 357.454 2.959 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000595825994 520749614 /nfs/dbraw/zinc/74/96/14/520749614.db2.gz ISXBZKSCJCCYFA-ROUUACIJSA-N 1 1 371.437 2.545 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593118344 520757304 /nfs/dbraw/zinc/75/73/04/520757304.db2.gz QLCQWFUDLZQEON-OAHLLOKOSA-N 1 1 353.325 2.624 20 5 FFBDMO COc1cc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])ccc1OC(F)F ZINC000610782695 520840969 /nfs/dbraw/zinc/84/09/69/520840969.db2.gz MDFYUQAAWVENBF-UHFFFAOYSA-N 1 1 370.356 2.842 20 5 FFBDMO COc1cc(NCCC[N@H+]2CCCN(C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596101030 520913220 /nfs/dbraw/zinc/91/32/20/520913220.db2.gz HTTGCIMALOUQKO-UHFFFAOYSA-N 1 1 356.854 2.696 20 5 FFBDMO COc1cc(NCCCN2CCC[N@H+](C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596101030 520913222 /nfs/dbraw/zinc/91/32/22/520913222.db2.gz HTTGCIMALOUQKO-UHFFFAOYSA-N 1 1 356.854 2.696 20 5 FFBDMO COc1cc(NCCCN2CCC[N@@H+](C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596101030 520913226 /nfs/dbraw/zinc/91/32/26/520913226.db2.gz HTTGCIMALOUQKO-UHFFFAOYSA-N 1 1 356.854 2.696 20 5 FFBDMO CCN1CC[NH+]([C@H]2CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)CC1 ZINC000596124919 520926705 /nfs/dbraw/zinc/92/67/05/520926705.db2.gz ZXNIABFNSLGWOP-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[NH+](C3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000596125528 520927228 /nfs/dbraw/zinc/92/72/28/520927228.db2.gz AWXVZZKTEKXGQU-UHFFFAOYSA-N 1 1 353.806 2.709 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000611087590 520977189 /nfs/dbraw/zinc/97/71/89/520977189.db2.gz WITGVUOWKPWRAV-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000611087590 520977196 /nfs/dbraw/zinc/97/71/96/520977196.db2.gz WITGVUOWKPWRAV-LBPRGKRZSA-N 1 1 360.439 2.885 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000618296967 520987671 /nfs/dbraw/zinc/98/76/71/520987671.db2.gz SNXJOGMTRPUATH-GFCCVEGCSA-N 1 1 360.414 2.882 20 5 FFBDMO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000618296967 520987680 /nfs/dbraw/zinc/98/76/80/520987680.db2.gz SNXJOGMTRPUATH-GFCCVEGCSA-N 1 1 360.414 2.882 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593454412 521001980 /nfs/dbraw/zinc/00/19/80/521001980.db2.gz HGDLQYZCCYBQCQ-UHFFFAOYSA-N 1 1 371.441 2.546 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1 ZINC000596306818 521020345 /nfs/dbraw/zinc/02/03/45/521020345.db2.gz IMDQOHBRKVCCEQ-LBPRGKRZSA-N 1 1 355.460 2.531 20 5 FFBDMO C[N@H+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)[C@H](Cc2ccccc2)C1 ZINC000593503892 521036864 /nfs/dbraw/zinc/03/68/64/521036864.db2.gz MFHPXVYTGFJWRZ-CQSZACIVSA-N 1 1 369.450 2.963 20 5 FFBDMO Cc1cn2c([nH+]1)C[C@@H](c1nc(CCNc3ccccc3[N+](=O)[O-])no1)CC2 ZINC000599129544 521045071 /nfs/dbraw/zinc/04/50/71/521045071.db2.gz DIXYBRBCQKNZIU-ZDUSSCGKSA-N 1 1 368.397 2.867 20 5 FFBDMO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611261386 521064649 /nfs/dbraw/zinc/06/46/49/521064649.db2.gz ZXVONRPSDOGTFN-AWEZNQCLSA-N 1 1 358.394 2.749 20 5 FFBDMO C[C@H](O)C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000611261386 521064657 /nfs/dbraw/zinc/06/46/57/521064657.db2.gz ZXVONRPSDOGTFN-AWEZNQCLSA-N 1 1 358.394 2.749 20 5 FFBDMO C[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC12CCC2 ZINC000611303373 521090850 /nfs/dbraw/zinc/09/08/50/521090850.db2.gz LIGMGMWEUKRZBT-LBPRGKRZSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC12CCC2 ZINC000611303373 521090861 /nfs/dbraw/zinc/09/08/61/521090861.db2.gz LIGMGMWEUKRZBT-LBPRGKRZSA-N 1 1 361.398 2.774 20 5 FFBDMO O=C([C@@H]1CC[N@H+]1C1CCCC1)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000602108982 521146674 /nfs/dbraw/zinc/14/66/74/521146674.db2.gz WVHMOLFZICZBQV-IBGZPJMESA-N 1 1 373.453 2.982 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](N[C@H]2CCC[N@@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712892 521169572 /nfs/dbraw/zinc/16/95/72/521169572.db2.gz QQIIJHZOXVHRKO-ZFWWWQNUSA-N 1 1 361.364 2.635 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](N[C@H]2CCC[N@H+](CCCO)C2)C(F)(F)F)cc1 ZINC000593712892 521169574 /nfs/dbraw/zinc/16/95/74/521169574.db2.gz QQIIJHZOXVHRKO-ZFWWWQNUSA-N 1 1 361.364 2.635 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccccc1)C1(CO)CCCC1 ZINC000599432059 521219773 /nfs/dbraw/zinc/21/97/73/521219773.db2.gz ZVXRLYHHGPILIW-UHFFFAOYSA-N 1 1 371.437 2.564 20 5 FFBDMO Cc1ccc(CNC(=O)COc2ccccc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000611572176 521226490 /nfs/dbraw/zinc/22/64/90/521226490.db2.gz KHKUQYWWZMVUMA-UHFFFAOYSA-N 1 1 370.409 2.594 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](CO)C2)cc1OC ZINC000611662661 521270070 /nfs/dbraw/zinc/27/00/70/521270070.db2.gz XJPMGWDYAIQZKG-KBPBESRZSA-N 1 1 352.431 2.843 20 5 FFBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](CO)C2)cc1OC ZINC000611662661 521270075 /nfs/dbraw/zinc/27/00/75/521270075.db2.gz XJPMGWDYAIQZKG-KBPBESRZSA-N 1 1 352.431 2.843 20 5 FFBDMO C[NH+](C)C[C@H](NCCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)c(Cl)c1 ZINC000599626406 521340403 /nfs/dbraw/zinc/34/04/03/521340403.db2.gz FYMLTPUBNHKTIH-AWEZNQCLSA-N 1 1 372.256 2.991 20 5 FFBDMO CC1(C)[C@@H](c2ccc(F)cc2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599623937 521340422 /nfs/dbraw/zinc/34/04/22/521340422.db2.gz XEPDZYWLHDQZSA-DLBZAZTESA-N 1 1 362.405 2.559 20 5 FFBDMO CC1(C)[C@H](c2ccc(F)cc2)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599623939 521340686 /nfs/dbraw/zinc/34/06/86/521340686.db2.gz XEPDZYWLHDQZSA-IRXDYDNUSA-N 1 1 362.405 2.559 20 5 FFBDMO COC(=O)c1csc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000602476191 521366875 /nfs/dbraw/zinc/36/68/75/521366875.db2.gz WDXLQPBJLXAMRA-GFCCVEGCSA-N 1 1 362.411 2.524 20 5 FFBDMO COC(=O)c1csc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000602476191 521366884 /nfs/dbraw/zinc/36/68/84/521366884.db2.gz WDXLQPBJLXAMRA-GFCCVEGCSA-N 1 1 362.411 2.524 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[N@H+](C)CCC[NH+](C)C ZINC000596912974 521375373 /nfs/dbraw/zinc/37/53/73/521375373.db2.gz PZUGLSTWYSSLCS-AWEZNQCLSA-N 1 1 365.478 2.551 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[N@@H+](C)CCC[NH+](C)C ZINC000596912974 521375380 /nfs/dbraw/zinc/37/53/80/521375380.db2.gz PZUGLSTWYSSLCS-AWEZNQCLSA-N 1 1 365.478 2.551 20 5 FFBDMO COC(=O)[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000599668591 521381619 /nfs/dbraw/zinc/38/16/19/521381619.db2.gz LQFVFFFJAARYOZ-MRXNPFEDSA-N 1 1 356.378 2.746 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000599668591 521381628 /nfs/dbraw/zinc/38/16/28/521381628.db2.gz LQFVFFFJAARYOZ-MRXNPFEDSA-N 1 1 356.378 2.746 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594100868 521405166 /nfs/dbraw/zinc/40/51/66/521405166.db2.gz TUASBGNGQTYHAY-KFWWJZLASA-N 1 1 364.446 2.831 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594100868 521405172 /nfs/dbraw/zinc/40/51/72/521405172.db2.gz TUASBGNGQTYHAY-KFWWJZLASA-N 1 1 364.446 2.831 20 5 FFBDMO CC[C@H](C)NC(=O)[C@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602585280 521424334 /nfs/dbraw/zinc/42/43/34/521424334.db2.gz COIXJGVOZAZJEE-YUMQZZPRSA-N 1 1 364.265 2.812 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000599715532 521424799 /nfs/dbraw/zinc/42/47/99/521424799.db2.gz ZMSFHHVMWNWBIE-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000599715532 521424812 /nfs/dbraw/zinc/42/48/12/521424812.db2.gz ZMSFHHVMWNWBIE-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CN(C)CC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCCC1 ZINC000602615478 521437389 /nfs/dbraw/zinc/43/73/89/521437389.db2.gz HYNDAJXXHWTXKK-UHFFFAOYSA-N 1 1 361.490 2.670 20 5 FFBDMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594198649 521464660 /nfs/dbraw/zinc/46/46/60/521464660.db2.gz UGOKFLHPTHOFOL-JKSUJKDBSA-N 1 1 353.369 2.549 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594200367 521466768 /nfs/dbraw/zinc/46/67/68/521466768.db2.gz LADIVLITZKLPOF-SJLPKXTDSA-N 1 1 369.425 2.527 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000599779968 521467726 /nfs/dbraw/zinc/46/77/26/521467726.db2.gz QMXAUWBKYYPVSL-KRWDZBQOSA-N 1 1 370.409 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H]2CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000599779968 521467732 /nfs/dbraw/zinc/46/77/32/521467732.db2.gz QMXAUWBKYYPVSL-KRWDZBQOSA-N 1 1 370.409 2.999 20 5 FFBDMO Nc1c(NC(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc(Cl)cc1[N+](=O)[O-] ZINC000599800293 521481972 /nfs/dbraw/zinc/48/19/72/521481972.db2.gz HHCNXHIKNSETFY-GFCCVEGCSA-N 1 1 367.837 2.969 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC[N@H+]1C ZINC000599835226 521503382 /nfs/dbraw/zinc/50/33/82/521503382.db2.gz KMODUVPAMWJKDI-QGZVFWFLSA-N 1 1 357.414 2.947 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000602830740 521559179 /nfs/dbraw/zinc/55/91/79/521559179.db2.gz WIVJARVGNOQKNS-LSDHHAIUSA-N 1 1 362.455 2.600 20 5 FFBDMO O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000612286014 521560610 /nfs/dbraw/zinc/56/06/10/521560610.db2.gz URCBRCZYDQLGIN-ZDUSSCGKSA-N 1 1 369.874 2.941 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+](C)C[C@H]3COCCO3)o2)c([N+](=O)[O-])c1 ZINC000597204896 521572417 /nfs/dbraw/zinc/57/24/17/521572417.db2.gz GWUPICAOPWHELN-HNNXBMFYSA-N 1 1 362.382 2.711 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+]([C@@H]3CCOC3)CC2)nc1-c1ccc(F)cc1 ZINC000619527381 521753168 /nfs/dbraw/zinc/75/31/68/521753168.db2.gz SLDVNSSGPRFAAT-MRXNPFEDSA-N 1 1 372.400 2.707 20 5 FFBDMO Cc1nc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000471619881 561008961 /nfs/dbraw/zinc/00/89/61/561008961.db2.gz HJFTXCSOOKCPEK-UHFFFAOYSA-N 1 1 369.469 2.918 20 5 FFBDMO COc1cc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)ncc1[N+](=O)[O-] ZINC001164857950 720950758 /nfs/dbraw/zinc/95/07/58/720950758.db2.gz ILMOAZKBUHHEAR-CYBMUJFWSA-N 1 1 374.445 2.616 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CC[N@H+]2C[C@@H](Oc3cccc(F)c3)C[C@H]2C1 ZINC001164897261 721511646 /nfs/dbraw/zinc/51/16/46/721511646.db2.gz FNQHHVCHYADCEU-WMZOPIPTSA-N 1 1 372.400 2.779 20 5 FFBDMO Cc1cnc(N2CC[N@H+]3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001164901705 721512544 /nfs/dbraw/zinc/51/25/44/721512544.db2.gz YDLPQNDFWUKPEQ-RDJZCZTQSA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000746670295 735503635 /nfs/dbraw/zinc/50/36/35/735503635.db2.gz FNSAMKPFASDTGY-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000746670295 735503636 /nfs/dbraw/zinc/50/36/36/735503636.db2.gz FNSAMKPFASDTGY-MRXNPFEDSA-N 1 1 353.850 2.935 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000122341025 728646462 /nfs/dbraw/zinc/64/64/62/728646462.db2.gz UBSTZROGEKUZLD-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000122341025 728646464 /nfs/dbraw/zinc/64/64/64/728646464.db2.gz UBSTZROGEKUZLD-AWEZNQCLSA-N 1 1 351.834 2.986 20 5 FFBDMO CC[N@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000134026816 728728379 /nfs/dbraw/zinc/72/83/79/728728379.db2.gz JAWTUTHDWUQCAX-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO CC[N@@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000134026816 728728380 /nfs/dbraw/zinc/72/83/80/728728380.db2.gz JAWTUTHDWUQCAX-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(S(N)(=O)=O)cc1 ZINC000192728406 729457558 /nfs/dbraw/zinc/45/75/58/729457558.db2.gz SMYVFCYZROTMIT-JTQLQIEISA-N 1 1 369.830 2.746 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)c3ccc(Cl)cc3)C2)nc1 ZINC000245441995 729570025 /nfs/dbraw/zinc/57/00/25/729570025.db2.gz HSMKHPHUIUAFNR-GDBMZVCRSA-N 1 1 362.817 2.863 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000252668603 729624801 /nfs/dbraw/zinc/62/48/01/729624801.db2.gz YCAFIDOFSBCMIU-RYUDHWBXSA-N 1 1 356.220 2.632 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000856799417 730358385 /nfs/dbraw/zinc/35/83/85/730358385.db2.gz DLPIRKGVQMVEEQ-KRWDZBQOSA-N 1 1 364.833 2.927 20 5 FFBDMO CC1(C)CC[C@@H](CO)[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000856803221 730358848 /nfs/dbraw/zinc/35/88/48/730358848.db2.gz BGPNGQFPDKALRU-ZDUSSCGKSA-N 1 1 353.394 2.545 20 5 FFBDMO O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861985633 730658745 /nfs/dbraw/zinc/65/87/45/730658745.db2.gz ZLDFQXFQUMYDJS-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO Cc1nn(CCC(=O)O[C@@H](C)C[C@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000870789665 731558469 /nfs/dbraw/zinc/55/84/69/731558469.db2.gz IVBKYGQYYIZNSY-SWLSCSKDSA-N 1 1 352.435 2.604 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C ZINC000874844039 732107053 /nfs/dbraw/zinc/10/70/53/732107053.db2.gz QEYQNNZFQBFQID-YUTCNCBUSA-N 1 1 367.833 2.711 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C ZINC000874844035 732107149 /nfs/dbraw/zinc/10/71/49/732107149.db2.gz QEYQNNZFQBFQID-IACUBPJLSA-N 1 1 367.833 2.711 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc(Br)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000877742372 732422462 /nfs/dbraw/zinc/42/24/62/732422462.db2.gz DABYVQCXJPUQLD-OCCSQVGLSA-N 1 1 354.248 2.883 20 5 FFBDMO CONC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000879926440 732804112 /nfs/dbraw/zinc/80/41/12/732804112.db2.gz RVWXXWOQARKONN-UHFFFAOYSA-N 1 1 361.320 2.503 20 5 FFBDMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000782031405 738681730 /nfs/dbraw/zinc/68/17/30/738681730.db2.gz HLGRLJASVIBDBQ-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000886069232 733745300 /nfs/dbraw/zinc/74/53/00/733745300.db2.gz DGGWTARDVAOJHE-TZMCWYRMSA-N 1 1 350.419 2.725 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C ZINC000886069232 733745304 /nfs/dbraw/zinc/74/53/04/733745304.db2.gz DGGWTARDVAOJHE-TZMCWYRMSA-N 1 1 350.419 2.725 20 5 FFBDMO CCOc1cc(NC(=O)N2CCC[N@H+](C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000888834403 734103800 /nfs/dbraw/zinc/10/38/00/734103800.db2.gz IIOKODVWAJHZLO-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928081582 738817304 /nfs/dbraw/zinc/81/73/04/738817304.db2.gz PJZUASSJQXAGGM-UKRRQHHQSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc(Cl)c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928081582 738817308 /nfs/dbraw/zinc/81/73/08/738817308.db2.gz PJZUASSJQXAGGM-UKRRQHHQSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)cc1Cl ZINC000928081283 738817358 /nfs/dbraw/zinc/81/73/58/738817358.db2.gz RMDPXSJXZXNBBR-UKRRQHHQSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cc1Cl ZINC000928081283 738817360 /nfs/dbraw/zinc/81/73/60/738817360.db2.gz RMDPXSJXZXNBBR-UKRRQHHQSA-N 1 1 369.874 2.866 20 5 FFBDMO C[C@@H]1CCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000783920753 738849157 /nfs/dbraw/zinc/84/91/57/738849157.db2.gz OJSVAZVDCJKTSZ-SNVBAGLBSA-N 1 1 356.220 2.571 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1[N+](=O)[O-] ZINC000894699875 734902633 /nfs/dbraw/zinc/90/26/33/734902633.db2.gz LQEGBWJLNCSPAL-RRFJBIMHSA-N 1 1 350.415 2.825 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000735890828 734965246 /nfs/dbraw/zinc/96/52/46/734965246.db2.gz LNKGHAJFEHBGAU-OAHLLOKOSA-N 1 1 356.806 2.762 20 5 FFBDMO Cc1ccc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1Br ZINC000895246306 734980484 /nfs/dbraw/zinc/98/04/84/734980484.db2.gz MWCVBCVQPKMANI-AAEUAGOBSA-N 1 1 371.279 2.712 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(Cn3nc(C)c([N+](=O)[O-])c3C)CC2)s1 ZINC000738274059 735027136 /nfs/dbraw/zinc/02/71/36/735027136.db2.gz QHWHVJQAYYTPJV-UHFFFAOYSA-N 1 1 363.487 2.807 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000901105965 735744920 /nfs/dbraw/zinc/74/49/20/735744920.db2.gz WZITTXZVFBIVMU-GWCFXTLKSA-N 1 1 355.797 2.944 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000901105966 735744952 /nfs/dbraw/zinc/74/49/52/735744952.db2.gz WZITTXZVFBIVMU-GXFFZTMASA-N 1 1 355.797 2.944 20 5 FFBDMO C[C@]12CSC[C@H]1C[N@@H+](CN1CC[C@H](c3ccc([N+](=O)[O-])cc3)C1=O)C2 ZINC000902674932 735980265 /nfs/dbraw/zinc/98/02/65/735980265.db2.gz LGARUVRGKKFZQQ-KYJSFNMBSA-N 1 1 361.467 2.553 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000752936716 736024680 /nfs/dbraw/zinc/02/46/80/736024680.db2.gz ZUUGAVVRERVHCO-LBPRGKRZSA-N 1 1 354.426 2.650 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000753027238 736032329 /nfs/dbraw/zinc/03/23/29/736032329.db2.gz ZUUGAVVRERVHCO-GFCCVEGCSA-N 1 1 354.426 2.650 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000763977327 736983326 /nfs/dbraw/zinc/98/33/26/736983326.db2.gz IANQIAVNAKHSMS-RHSMWYFYSA-N 1 1 350.415 2.598 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000770381700 737620534 /nfs/dbraw/zinc/62/05/34/737620534.db2.gz PGCJSBRWPKNLNN-ZDUSSCGKSA-N 1 1 370.247 2.658 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(F)c([N+](=O)[O-])c2)C[C@H]1C ZINC000771762310 737753493 /nfs/dbraw/zinc/75/34/93/737753493.db2.gz OCSOSCYBOWEZPE-CHWSQXEVSA-N 1 1 373.450 2.536 20 5 FFBDMO Cc1c(C(=O)OCC[C@@H]2CCCC[N@@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000919227915 737845689 /nfs/dbraw/zinc/84/56/89/737845689.db2.gz SLSYHWOGLGAMGQ-LBPRGKRZSA-N 1 1 351.359 2.843 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CC[C@@H](C(F)(F)F)O3)C2)nc1 ZINC000929986948 739045664 /nfs/dbraw/zinc/04/56/64/739045664.db2.gz IDLZNCHOFBODIA-RTXFEEFZSA-N 1 1 360.336 2.586 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@H]1C ZINC000787238115 739117349 /nfs/dbraw/zinc/11/73/49/739117349.db2.gz ITSRSBZRTNAZQA-ONGXEEELSA-N 1 1 351.384 2.713 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=S)[C@H]1C ZINC000787238115 739117351 /nfs/dbraw/zinc/11/73/51/739117351.db2.gz ITSRSBZRTNAZQA-ONGXEEELSA-N 1 1 351.384 2.713 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(CN2CCC([N@H+]3CCCOCC3)CC2)c(F)c1 ZINC000931287894 739238725 /nfs/dbraw/zinc/23/87/25/739238725.db2.gz WKOINURVRAIEQU-UHFFFAOYSA-N 1 1 355.385 2.560 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H](C)O1 ZINC000788477194 739248408 /nfs/dbraw/zinc/24/84/08/739248408.db2.gz VCPCLEALYNAYQH-FMKPAKJESA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H](C)O1 ZINC000788477194 739248413 /nfs/dbraw/zinc/24/84/13/739248413.db2.gz VCPCLEALYNAYQH-FMKPAKJESA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2 ZINC000931724390 739317874 /nfs/dbraw/zinc/31/78/74/739317874.db2.gz AOWLJYGAVQQNRH-SCRDCRAPSA-N 1 1 366.849 2.744 20 5 FFBDMO C[C@]1(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)COC(=O)N1 ZINC000932097310 739386568 /nfs/dbraw/zinc/38/65/68/739386568.db2.gz AOOKFCALFZOSQY-MRXNPFEDSA-N 1 1 353.806 2.959 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(S(=O)(=O)N(C)C)s1)c1ccc([N+](=O)[O-])cc1 ZINC000932178745 739399186 /nfs/dbraw/zinc/39/91/86/739399186.db2.gz RXLMRBYDJFNPOS-LLVKDONJSA-N 1 1 369.468 2.757 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000790694262 739485357 /nfs/dbraw/zinc/48/53/57/739485357.db2.gz VWNAZDIRHSVXRT-LBPRGKRZSA-N 1 1 357.813 2.920 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)s1 ZINC000932669810 739489528 /nfs/dbraw/zinc/48/95/28/739489528.db2.gz RWYCZODQYZQQFG-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO COC(=O)c1cnc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)s1 ZINC000932669810 739489530 /nfs/dbraw/zinc/48/95/30/739489530.db2.gz RWYCZODQYZQQFG-NSHDSACASA-N 1 1 365.386 2.967 20 5 FFBDMO C[C@@H](C(=O)OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000791930083 739617535 /nfs/dbraw/zinc/61/75/35/739617535.db2.gz KEAGSTRFHGXCRN-TUAOUCFPSA-N 1 1 351.359 2.808 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334721 739767827 /nfs/dbraw/zinc/76/78/27/739767827.db2.gz FSIZCLPIOXMAJD-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334721 739767829 /nfs/dbraw/zinc/76/78/29/739767829.db2.gz FSIZCLPIOXMAJD-QWHCGFSZSA-N 1 1 360.439 2.943 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCC[C@H]1C ZINC000793459920 739783801 /nfs/dbraw/zinc/78/38/01/739783801.db2.gz FUOBPNFPWPJELZ-SNVBAGLBSA-N 1 1 370.247 2.880 20 5 FFBDMO CN(C)[S@@](C)(=O)=NCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000934752313 739832526 /nfs/dbraw/zinc/83/25/26/739832526.db2.gz NWVHKTHKVNSEIL-VWLOTQADSA-N 1 1 372.466 2.520 20 5 FFBDMO C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CC(F)(F)F ZINC000934797513 739845598 /nfs/dbraw/zinc/84/55/98/739845598.db2.gz UCBDDDLBJUGYTC-BETUJISGSA-N 1 1 361.364 2.931 20 5 FFBDMO C[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CC(F)(F)F ZINC000934797513 739845602 /nfs/dbraw/zinc/84/56/02/739845602.db2.gz UCBDDDLBJUGYTC-BETUJISGSA-N 1 1 361.364 2.931 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000934951154 739871049 /nfs/dbraw/zinc/87/10/49/739871049.db2.gz NNUXRNIYRCPGHQ-JOYOIKCWSA-N 1 1 370.812 2.526 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H](N2CCOCC2)C(F)(F)F)c1 ZINC000796517348 740149385 /nfs/dbraw/zinc/14/93/85/740149385.db2.gz WFFSGUJJRGXGNG-CYBMUJFWSA-N 1 1 367.755 2.601 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801554915 740630114 /nfs/dbraw/zinc/63/01/14/740630114.db2.gz AKASMGLHXUOPQK-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CC1(Cl)Cl ZINC000813170357 741684649 /nfs/dbraw/zinc/68/46/49/741684649.db2.gz CKEMYPGKEDEJPL-QWHCGFSZSA-N 1 1 359.209 2.906 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@H]1CC1(Cl)Cl ZINC000813170357 741684652 /nfs/dbraw/zinc/68/46/52/741684652.db2.gz CKEMYPGKEDEJPL-QWHCGFSZSA-N 1 1 359.209 2.906 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001000671398 742093605 /nfs/dbraw/zinc/09/36/05/742093605.db2.gz UQERIOUSXFOTHK-IAGOWNOFSA-N 1 1 363.845 2.562 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2sccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643375 742927187 /nfs/dbraw/zinc/92/71/87/742927187.db2.gz NGWLECOPASLWDP-PRULPYPASA-N 1 1 357.863 2.584 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034644628 742928550 /nfs/dbraw/zinc/92/85/50/742928550.db2.gz JOKARKYDYWGFKR-QBPKDAKJSA-N 1 1 365.861 2.565 20 5 FFBDMO C[N@H+]1CC[C@H](CC(=O)N[C@@H](c2cccc([N+](=O)[O-])c2F)C(F)(F)F)C1 ZINC000823593502 742942492 /nfs/dbraw/zinc/94/24/92/742942492.db2.gz AJJUJGDKKLMHSZ-OTYXRUKQSA-N 1 1 363.311 2.795 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@H]1CCC[N@@H+]1CCCO ZINC000824564068 743106292 /nfs/dbraw/zinc/10/62/92/743106292.db2.gz HFFLCSBIOHXKQU-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCCN1CCCO ZINC000824564068 743106296 /nfs/dbraw/zinc/10/62/96/743106296.db2.gz HFFLCSBIOHXKQU-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC[C@@H]21 ZINC000827247189 743541660 /nfs/dbraw/zinc/54/16/60/743541660.db2.gz VKLGSWYNABMJFB-GWCFXTLKSA-N 1 1 357.332 2.780 20 5 FFBDMO O=C(NCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)C(F)(F)F ZINC000831538728 745544096 /nfs/dbraw/zinc/54/40/96/745544096.db2.gz HBZWYTFEIJQEMD-CYBMUJFWSA-N 1 1 359.348 2.843 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1F ZINC000834476311 745846210 /nfs/dbraw/zinc/84/62/10/745846210.db2.gz VASFYIIARIGPBT-LBPRGKRZSA-N 1 1 353.369 2.928 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000839106004 746775937 /nfs/dbraw/zinc/77/59/37/746775937.db2.gz ZGIAADXVXYTMFI-YJBOKZPZSA-N 1 1 350.415 2.682 20 5 FFBDMO C[C@@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000839193658 746799157 /nfs/dbraw/zinc/79/91/57/746799157.db2.gz UTOPNICWQMKRNZ-NSHDSACASA-N 1 1 353.375 2.913 20 5 FFBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)OC(C)(C)C ZINC000839193658 746799160 /nfs/dbraw/zinc/79/91/60/746799160.db2.gz UTOPNICWQMKRNZ-NSHDSACASA-N 1 1 353.375 2.913 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCOC1)C1CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839464143 746832514 /nfs/dbraw/zinc/83/25/14/746832514.db2.gz BQNZZQPVZYWFOI-LLVKDONJSA-N 1 1 353.806 2.688 20 5 FFBDMO COC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)[C@@H]1CCCO1 ZINC000839589578 746865050 /nfs/dbraw/zinc/86/50/50/746865050.db2.gz HWELQJXWZBIQRZ-AAEUAGOBSA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000839665305 746885227 /nfs/dbraw/zinc/88/52/27/746885227.db2.gz LQSDTJFYCBGPLY-CZXHOFHRSA-N 1 1 367.833 2.668 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000839665305 746885232 /nfs/dbraw/zinc/88/52/32/746885232.db2.gz LQSDTJFYCBGPLY-CZXHOFHRSA-N 1 1 367.833 2.668 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2csc([N+](=O)[O-])c2)ccc1C[NH+](C)C ZINC000840953226 747241210 /nfs/dbraw/zinc/24/12/10/747241210.db2.gz JUNMOUSTHMOECI-UHFFFAOYSA-N 1 1 355.441 2.827 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C[C@@H](C)O1 ZINC000843981749 747944842 /nfs/dbraw/zinc/94/48/42/747944842.db2.gz SNTQARSWTLMQND-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847140899 748629207 /nfs/dbraw/zinc/62/92/07/748629207.db2.gz DSWBYZLUPXXQBY-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847140899 748629209 /nfs/dbraw/zinc/62/92/09/748629209.db2.gz DSWBYZLUPXXQBY-SDDRHHMPSA-N 1 1 370.837 2.867 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848490622 748940024 /nfs/dbraw/zinc/94/00/24/748940024.db2.gz QAHFZGYLBWFKRG-WMLDXEAASA-N 1 1 363.483 2.943 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC[C@@H]([NH+]4CCOCC4)CC3)sc2c1 ZINC000848793792 749007592 /nfs/dbraw/zinc/00/75/92/749007592.db2.gz MTUAYIGCLHIHFJ-CYBMUJFWSA-N 1 1 362.455 2.896 20 5 FFBDMO CC(C)[N@@H+](CCn1cnc(Br)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000851734936 749655208 /nfs/dbraw/zinc/65/52/08/749655208.db2.gz BJRBIWIEXPHIKB-UHFFFAOYSA-N 1 1 368.235 2.859 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422559 749856645 /nfs/dbraw/zinc/85/66/45/749856645.db2.gz FLELHZMGHJSVSH-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H](CO)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852422559 749856647 /nfs/dbraw/zinc/85/66/47/749856647.db2.gz FLELHZMGHJSVSH-BXUZGUMPSA-N 1 1 355.822 2.670 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])CC2)C1 ZINC000853341739 750050652 /nfs/dbraw/zinc/05/06/52/750050652.db2.gz VLFAEEIFHKWDFW-AWEZNQCLSA-N 1 1 354.401 2.749 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)O1 ZINC000486447152 854561293 /nfs/dbraw/zinc/56/12/93/854561293.db2.gz DYTBKXRCCYGVQR-BETUJISGSA-N 1 1 361.402 2.556 20 5 FFBDMO C[C@@H]1C[N@H+](CCCNc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H](C)O1 ZINC000486447152 854561296 /nfs/dbraw/zinc/56/12/96/854561296.db2.gz DYTBKXRCCYGVQR-BETUJISGSA-N 1 1 361.402 2.556 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC001167100785 960045315 /nfs/dbraw/zinc/04/53/15/960045315.db2.gz MPCKFLBUHSYMMH-CQSZACIVSA-N 1 1 356.382 2.551 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC001167100785 960045323 /nfs/dbraw/zinc/04/53/23/960045323.db2.gz MPCKFLBUHSYMMH-CQSZACIVSA-N 1 1 356.382 2.551 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872274723 1013195247 /nfs/dbraw/zinc/19/52/47/1013195247.db2.gz APKZNZULFQRJTK-FUHWJXTLSA-N 1 1 364.442 2.758 20 5 FFBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226867 962758095 /nfs/dbraw/zinc/75/80/95/962758095.db2.gz CDSMSRAZFPCNML-LIRRHRJNSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226867 962758109 /nfs/dbraw/zinc/75/81/09/962758109.db2.gz CDSMSRAZFPCNML-LIRRHRJNSA-N 1 1 369.421 2.882 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@H]([C@@H]2CCCO2)C1 ZINC000933189408 963692303 /nfs/dbraw/zinc/69/23/03/963692303.db2.gz ZORYBQCMVDNQAQ-NJAFHUGGSA-N 1 1 362.426 2.836 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)[C@H]([C@@H]2CCCO2)C1 ZINC000933189408 963692306 /nfs/dbraw/zinc/69/23/06/963692306.db2.gz ZORYBQCMVDNQAQ-NJAFHUGGSA-N 1 1 362.426 2.836 20 5 FFBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)CN(C)C(=O)OC(C)(C)C ZINC001175390979 1013468136 /nfs/dbraw/zinc/46/81/36/1013468136.db2.gz UPWAULQUHBCLGL-KGLIPLIRSA-N 1 1 367.446 2.815 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(OC[C@@H]4CCCCO4)CC3)c2c1 ZINC000176208460 965619444 /nfs/dbraw/zinc/61/94/44/965619444.db2.gz XXXXWMURAZXICR-SFHVURJKSA-N 1 1 374.441 2.952 20 5 FFBDMO COc1c(O)ccc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000892043369 965875567 /nfs/dbraw/zinc/87/55/67/965875567.db2.gz WXTQCRGRKLWYPO-MRXNPFEDSA-N 1 1 358.394 2.791 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c1[N+](=O)[O-] ZINC000892043369 965875579 /nfs/dbraw/zinc/87/55/79/965875579.db2.gz WXTQCRGRKLWYPO-MRXNPFEDSA-N 1 1 358.394 2.791 20 5 FFBDMO CC(C)(C)[C@H]1CCC[N@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000729475142 965877577 /nfs/dbraw/zinc/87/75/77/965877577.db2.gz QRNXUKZPAYNKDI-GOSISDBHSA-N 1 1 374.485 2.754 20 5 FFBDMO Cc1c(OC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000728469812 966187730 /nfs/dbraw/zinc/18/77/30/966187730.db2.gz WUCAEAVDPNUHSK-LJQANCHMSA-N 1 1 369.421 2.797 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)cc1F ZINC000895186122 968216833 /nfs/dbraw/zinc/21/68/33/968216833.db2.gz HRZWJEBPPRYPIZ-QWHZDKJVSA-N 1 1 357.385 2.769 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000874845397 1013916198 /nfs/dbraw/zinc/91/61/98/1013916198.db2.gz GGJZLLIUHJJPMO-SJLPKXTDSA-N 1 1 372.469 2.506 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000313084851 972644261 /nfs/dbraw/zinc/64/42/61/972644261.db2.gz XHVWLXQZHIKJFD-GOEBONIOSA-N 1 1 368.437 2.817 20 5 FFBDMO C[C@H](CNC(=O)N1CC[C@]2(C1)CCC[N@@H+](C)C2)c1ccccc1[N+](=O)[O-] ZINC000897059247 973205473 /nfs/dbraw/zinc/20/54/73/973205473.db2.gz BGQIRQMUGXXNFE-DNVCBOLYSA-N 1 1 360.458 2.826 20 5 FFBDMO CC(C)(C)N1CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000876947505 1014429795 /nfs/dbraw/zinc/42/97/95/1014429795.db2.gz BGULNMSOLLTMCM-UHFFFAOYSA-N 1 1 361.490 2.811 20 5 FFBDMO CN(C)[C@H]1CC[N@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CO)cc2)C1 ZINC000906173115 980590452 /nfs/dbraw/zinc/59/04/52/980590452.db2.gz YNTVVWPAXXOKLB-IBGZPJMESA-N 1 1 355.438 2.890 20 5 FFBDMO CN(C)[C@H]1CC[N@@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CO)cc2)C1 ZINC000906173115 980590456 /nfs/dbraw/zinc/59/04/56/980590456.db2.gz YNTVVWPAXXOKLB-IBGZPJMESA-N 1 1 355.438 2.890 20 5 FFBDMO Nc1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc2ccccc2c1[N+](=O)[O-] ZINC000907789950 981294594 /nfs/dbraw/zinc/29/45/94/981294594.db2.gz MPKOVUJBALDRFU-HOTGVXAUSA-N 1 1 372.400 2.589 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(C2(O)CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000897529013 981555077 /nfs/dbraw/zinc/55/50/77/981555077.db2.gz SFVRIFMURFSTKW-MRXNPFEDSA-N 1 1 356.426 2.703 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000910289558 981888656 /nfs/dbraw/zinc/88/86/56/981888656.db2.gz TWYFILHYWXZBLS-AWEZNQCLSA-N 1 1 371.441 2.552 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC[C@H]21 ZINC000878198463 1014910766 /nfs/dbraw/zinc/91/07/66/1014910766.db2.gz WWELDKVQOINJIB-DZGCQCFKSA-N 1 1 357.414 2.561 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 ZINC000878286177 1014966813 /nfs/dbraw/zinc/96/68/13/1014966813.db2.gz KIVJQCXFWCXKHH-IAGOWNOFSA-N 1 1 362.405 2.827 20 5 FFBDMO C[N@H+](CCOCc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151403830 984282339 /nfs/dbraw/zinc/28/23/39/984282339.db2.gz SGQIMXNSLJQMHH-UHFFFAOYSA-N 1 1 367.409 2.959 20 5 FFBDMO C[N@@H+](CCOCc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000151403830 984282344 /nfs/dbraw/zinc/28/23/44/984282344.db2.gz SGQIMXNSLJQMHH-UHFFFAOYSA-N 1 1 367.409 2.959 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000057778232 984518873 /nfs/dbraw/zinc/51/88/73/984518873.db2.gz DYHZSRBXCCTVIA-SFHVURJKSA-N 1 1 372.400 2.661 20 5 FFBDMO Cc1nn(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000765071413 984953738 /nfs/dbraw/zinc/95/37/38/984953738.db2.gz WHIMASPBCVPTBN-QGZVFWFLSA-N 1 1 374.441 2.870 20 5 FFBDMO CN(CC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)c1ccccc1 ZINC000172902742 985711292 /nfs/dbraw/zinc/71/12/92/985711292.db2.gz APKSDMRHHIDSMN-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CN(CC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)c1ccccc1 ZINC000172902742 985711299 /nfs/dbraw/zinc/71/12/99/985711299.db2.gz APKSDMRHHIDSMN-UHFFFAOYSA-N 1 1 366.425 2.879 20 5 FFBDMO CC(C)c1ccccc1C[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000997770922 985733170 /nfs/dbraw/zinc/73/31/70/985733170.db2.gz BTWZTYLTFBVQMC-RTBURBONSA-N 1 1 359.470 2.803 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCN1C1CCOCC1 ZINC000451552145 987440996 /nfs/dbraw/zinc/44/09/96/987440996.db2.gz VSWOYOLTRWQJAF-VQIMIIECSA-N 1 1 373.453 2.554 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000125454609 988959313 /nfs/dbraw/zinc/95/93/13/988959313.db2.gz UPDXLIPHSNYIAF-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1C(=O)OC(C)C ZINC000125454609 988959318 /nfs/dbraw/zinc/95/93/18/988959318.db2.gz UPDXLIPHSNYIAF-INIZCTEOSA-N 1 1 363.414 2.648 20 5 FFBDMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CN1 ZINC000125844202 989015864 /nfs/dbraw/zinc/01/58/64/989015864.db2.gz ZASXSHDYHKKIPJ-PBHICJAKSA-N 1 1 370.409 2.740 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2cc3ccccc3o2)CC1 ZINC001005377314 989742669 /nfs/dbraw/zinc/74/26/69/989742669.db2.gz ATGALXQWTRPDOJ-IAGOWNOFSA-N 1 1 357.410 2.521 20 5 FFBDMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000033321440 990213126 /nfs/dbraw/zinc/21/31/26/990213126.db2.gz HTIQHFZBHHKVPJ-FLIBITNWSA-N 1 1 351.406 2.952 20 5 FFBDMO CC1CCC([N@@H+](C)CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000917456319 990222901 /nfs/dbraw/zinc/22/29/01/990222901.db2.gz OMQIIRXEMOGQTB-XBMPDCEQSA-N 1 1 374.441 2.830 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000130516510 990225714 /nfs/dbraw/zinc/22/57/14/990225714.db2.gz YRCXORSBJYTFAU-OAHLLOKOSA-N 1 1 360.458 2.799 20 5 FFBDMO Cc1ccccc1C[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001034817123 990276758 /nfs/dbraw/zinc/27/67/58/990276758.db2.gz YXISOIGKZKWLOC-RTBURBONSA-N 1 1 353.422 2.566 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373105463 990717044 /nfs/dbraw/zinc/71/70/44/990717044.db2.gz YHCHDCTWFNWBKQ-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000373105463 990717047 /nfs/dbraw/zinc/71/70/47/990717047.db2.gz YHCHDCTWFNWBKQ-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000068084590 991331245 /nfs/dbraw/zinc/33/12/45/991331245.db2.gz XHWFCKSHZXPAKH-RYUDHWBXSA-N 1 1 364.402 2.662 20 5 FFBDMO Cc1csc([C@H]2CC[N@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000880009108 1015730852 /nfs/dbraw/zinc/73/08/52/1015730852.db2.gz ZWWRKPBOWHEHGM-AWEZNQCLSA-N 1 1 372.450 2.738 20 5 FFBDMO Cc1csc([C@H]2CC[N@@H+](CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)C2)n1 ZINC000880009108 1015730858 /nfs/dbraw/zinc/73/08/58/1015730858.db2.gz ZWWRKPBOWHEHGM-AWEZNQCLSA-N 1 1 372.450 2.738 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000809688249 994580023 /nfs/dbraw/zinc/58/00/23/994580023.db2.gz FVPIAKBLVBHTKL-UHFFFAOYSA-N 1 1 373.365 2.949 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000809688249 994580033 /nfs/dbraw/zinc/58/00/33/994580033.db2.gz FVPIAKBLVBHTKL-UHFFFAOYSA-N 1 1 373.365 2.949 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000810621017 994844004 /nfs/dbraw/zinc/84/40/04/994844004.db2.gz FAMXGRCEFYETKN-GFCCVEGCSA-N 1 1 355.354 2.531 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)OCc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000811448658 995149997 /nfs/dbraw/zinc/14/99/97/995149997.db2.gz XQZPRHYOJHWSJN-QGZVFWFLSA-N 1 1 365.361 2.992 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(O)(c3ccccc3)CC2)c1 ZINC000811490300 995157386 /nfs/dbraw/zinc/15/73/86/995157386.db2.gz OFTAFNAYHGQBER-UHFFFAOYSA-N 1 1 370.405 2.865 20 5 FFBDMO CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812853531 995556009 /nfs/dbraw/zinc/55/60/09/995556009.db2.gz RMXSKMQXOFANBL-ZAAXVRCTSA-N 1 1 374.437 2.779 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F)[N@H+]1CCCC[C@@H]1C ZINC000825460552 997386511 /nfs/dbraw/zinc/38/65/11/997386511.db2.gz AHPAKNJVZGSREG-STQMWFEESA-N 1 1 366.437 2.793 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000844428571 997899910 /nfs/dbraw/zinc/89/99/10/997899910.db2.gz WZJYWPXXVDUSKW-OTWHNJEPSA-N 1 1 370.405 2.517 20 5 FFBDMO O=C1CC2(CCCC2)N1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000844699582 998105126 /nfs/dbraw/zinc/10/51/26/998105126.db2.gz NRDFVDLCTQFDSV-UHFFFAOYSA-N 1 1 359.426 2.941 20 5 FFBDMO CCCCCC[N@@H+](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000731871551 998312411 /nfs/dbraw/zinc/31/24/11/998312411.db2.gz IFNTVDFDZWQSEC-UHFFFAOYSA-N 1 1 362.474 2.756 20 5 FFBDMO CC[C@H]1CCC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000738252817 999623278 /nfs/dbraw/zinc/62/32/78/999623278.db2.gz CANVAJFKXRALLR-LIRRHRJNSA-N 1 1 374.441 2.831 20 5 FFBDMO C[C@H]1CCCCC[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000738227505 999623355 /nfs/dbraw/zinc/62/33/55/999623355.db2.gz WJRVSIPOHKONQV-UGSOOPFHSA-N 1 1 360.414 2.584 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[NH+]3CCC(OCC4CC4)CC3)n2)c1 ZINC000743405952 999818287 /nfs/dbraw/zinc/81/82/87/999818287.db2.gz AZLUNLSDYRCZCA-UHFFFAOYSA-N 1 1 357.414 2.702 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000743717536 999829854 /nfs/dbraw/zinc/82/98/54/999829854.db2.gz HEFJDWOMXPYZKB-CQSZACIVSA-N 1 1 364.402 2.758 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000744798053 999876322 /nfs/dbraw/zinc/87/63/22/999876322.db2.gz FPTKPZOMHQICHL-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO C[N@@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@H](c2ccccc2)C1 ZINC000745753164 999929171 /nfs/dbraw/zinc/92/91/71/999929171.db2.gz HZWOPYJFXZGQJI-SFHVURJKSA-N 1 1 373.384 2.628 20 5 FFBDMO C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@H](c2ccccc2)C1 ZINC000745753164 999929173 /nfs/dbraw/zinc/92/91/73/999929173.db2.gz HZWOPYJFXZGQJI-SFHVURJKSA-N 1 1 373.384 2.628 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1 ZINC000746390668 999985263 /nfs/dbraw/zinc/98/52/63/999985263.db2.gz BIYNZVKPKYPYQO-CQSZACIVSA-N 1 1 358.442 2.648 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)C[C@H]1C ZINC000766558002 1000013078 /nfs/dbraw/zinc/01/30/78/1000013078.db2.gz YEFJWXFUIXNQFO-GHMZBOCLSA-N 1 1 364.402 2.675 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@]12CCC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169011026 1000015184 /nfs/dbraw/zinc/01/51/84/1000015184.db2.gz HJVQLCGPXUFKPK-VKJFTORMSA-N 1 1 353.463 2.907 20 5 FFBDMO CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169037962 1000016756 /nfs/dbraw/zinc/01/67/56/1000016756.db2.gz ULJUQMQQOIPVBR-JLSDUUJJSA-N 1 1 359.470 2.773 20 5 FFBDMO O=C1Nc2ccccc2CN1[C@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1 ZINC001169051367 1000018830 /nfs/dbraw/zinc/01/88/30/1000018830.db2.gz DNPVAYOLAKCQJJ-PVAVHDDUSA-N 1 1 358.442 2.944 20 5 FFBDMO CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000772948833 1000412294 /nfs/dbraw/zinc/41/22/94/1000412294.db2.gz QQBLLZPXIHIGDU-UHFFFAOYSA-N 1 1 359.382 2.517 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)CC1 ZINC000769146521 1000446972 /nfs/dbraw/zinc/44/69/72/1000446972.db2.gz SKIQUBCOGKGSQS-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)CC1 ZINC000769146521 1000446974 /nfs/dbraw/zinc/44/69/74/1000446974.db2.gz SKIQUBCOGKGSQS-JKSUJKDBSA-N 1 1 374.485 2.996 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2cccc3ccccc32)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000672917 1016420393 /nfs/dbraw/zinc/42/03/93/1016420393.db2.gz BWKSUHPYPHBSFA-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO O=C(NCC1=CC[N@H+](Cc2cccc3ccccc32)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000672917 1016420398 /nfs/dbraw/zinc/42/03/98/1016420398.db2.gz BWKSUHPYPHBSFA-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2cccc3ccccc32)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000672917 1016420402 /nfs/dbraw/zinc/42/04/02/1016420402.db2.gz BWKSUHPYPHBSFA-WOJBJXKFSA-N 1 1 365.433 2.753 20 5 FFBDMO C[C@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000770671271 1000872074 /nfs/dbraw/zinc/87/20/74/1000872074.db2.gz QGAKMKYXIVNYFF-AWEZNQCLSA-N 1 1 372.425 2.833 20 5 FFBDMO C[C@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC12CCC2 ZINC000770671271 1000872077 /nfs/dbraw/zinc/87/20/77/1000872077.db2.gz QGAKMKYXIVNYFF-AWEZNQCLSA-N 1 1 372.425 2.833 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)c([N+](=O)[O-])c1 ZINC001147330727 1000872480 /nfs/dbraw/zinc/87/24/80/1000872480.db2.gz CJAOBOIGJWJMTN-WBVHZDCISA-N 1 1 360.458 2.838 20 5 FFBDMO O=C1OCCN1[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000826995068 1016548757 /nfs/dbraw/zinc/54/87/57/1016548757.db2.gz QMKCNYXQOPISTF-CYBMUJFWSA-N 1 1 357.366 2.881 20 5 FFBDMO Cc1c[nH+]ccc1OC1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1 ZINC000774730769 1002528674 /nfs/dbraw/zinc/52/86/74/1002528674.db2.gz HGLCCKXTAZIWSF-UHFFFAOYSA-N 1 1 353.382 2.994 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791208344 1002618073 /nfs/dbraw/zinc/61/80/73/1002618073.db2.gz HIPICOKYZPVVDL-OLZOCXBDSA-N 1 1 366.437 2.650 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000792189272 1002939584 /nfs/dbraw/zinc/93/95/84/1002939584.db2.gz KTZHKENIFUSOEV-INIZCTEOSA-N 1 1 363.458 2.658 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+](C)Cc2nnc3ccccn32)c([N+](=O)[O-])c1 ZINC001170336161 1003118146 /nfs/dbraw/zinc/11/81/46/1003118146.db2.gz VAONSZJKQPXWJB-ZDUSSCGKSA-N 1 1 355.398 2.709 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+](C)Cc2nnc3ccccn32)c([N+](=O)[O-])c1 ZINC001170336161 1003118150 /nfs/dbraw/zinc/11/81/50/1003118150.db2.gz VAONSZJKQPXWJB-ZDUSSCGKSA-N 1 1 355.398 2.709 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCN(C)c3ncccc3C2)c([N+](=O)[O-])c1 ZINC001170340107 1003130234 /nfs/dbraw/zinc/13/02/34/1003130234.db2.gz DMNZJLRLKSUDAF-CQSZACIVSA-N 1 1 356.426 2.881 20 5 FFBDMO COC(=O)[C@@H]1CCC[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])[C@@H]1C ZINC001170345208 1003132298 /nfs/dbraw/zinc/13/22/98/1003132298.db2.gz HYRTVJQDWWWGBM-XJKCOSOUSA-N 1 1 350.415 2.808 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](Oc3cnccn3)C2)c([N+](=O)[O-])c1 ZINC001170351242 1003136759 /nfs/dbraw/zinc/13/67/59/1003136759.db2.gz BQLDCTXCJDZQON-YOEHRIQHSA-N 1 1 372.425 2.868 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N(C)CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)c2c1 ZINC001186352377 1003284701 /nfs/dbraw/zinc/28/47/01/1003284701.db2.gz YKDYNOFPKHLUJT-OKILXGFUSA-N 1 1 374.441 2.697 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N(C)CC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)c2c1 ZINC001186352377 1003284710 /nfs/dbraw/zinc/28/47/10/1003284710.db2.gz YKDYNOFPKHLUJT-OKILXGFUSA-N 1 1 374.441 2.697 20 5 FFBDMO O=C1N(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000793748395 1003489994 /nfs/dbraw/zinc/48/99/94/1003489994.db2.gz XYVLYMCXKDLEHH-INIZCTEOSA-N 1 1 374.441 2.543 20 5 FFBDMO O=C1N(C[N@H+]2CCOC[C@@H](C3CCC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000793748395 1003489997 /nfs/dbraw/zinc/48/99/97/1003489997.db2.gz XYVLYMCXKDLEHH-INIZCTEOSA-N 1 1 374.441 2.543 20 5 FFBDMO CCC1(CC)CNC(=O)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Br ZINC001198105187 1004497158 /nfs/dbraw/zinc/49/71/58/1004497158.db2.gz VXQARRZWCULXBA-CYBMUJFWSA-N 1 1 370.247 2.752 20 5 FFBDMO C[N@H+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1(C)C ZINC001198584053 1004684060 /nfs/dbraw/zinc/68/40/60/1004684060.db2.gz REIMDMZOZYEPAU-UHFFFAOYSA-N 1 1 358.345 2.754 20 5 FFBDMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001194731789 1004796067 /nfs/dbraw/zinc/79/60/67/1004796067.db2.gz GBLJOGATABMJPT-ZWNOBZJWSA-N 1 1 366.805 2.891 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000101905878 1004951071 /nfs/dbraw/zinc/95/10/71/1004951071.db2.gz QDNDLNDVYMFKLR-CQSZACIVSA-N 1 1 359.430 2.530 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000101905878 1004951073 /nfs/dbraw/zinc/95/10/73/1004951073.db2.gz QDNDLNDVYMFKLR-CQSZACIVSA-N 1 1 359.430 2.530 20 5 FFBDMO CCc1c[nH]c(=O)c(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000851035424 1005858103 /nfs/dbraw/zinc/85/81/03/1005858103.db2.gz LUSSIWYXPMMPFF-INIZCTEOSA-N 1 1 371.393 2.689 20 5 FFBDMO CCc1c[nH]c(=O)c(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000851035424 1005858104 /nfs/dbraw/zinc/85/81/04/1005858104.db2.gz LUSSIWYXPMMPFF-INIZCTEOSA-N 1 1 371.393 2.689 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591192 1005985568 /nfs/dbraw/zinc/98/55/68/1005985568.db2.gz HLOSTYMWISFEJB-HOTGVXAUSA-N 1 1 365.430 2.569 20 5 FFBDMO CC[N@@H+]1CC[C@@H]1CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000882492020 1006412197 /nfs/dbraw/zinc/41/21/97/1006412197.db2.gz PAMWXLBQXQVQPR-CYBMUJFWSA-N 1 1 371.387 2.784 20 5 FFBDMO CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 ZINC000882492020 1006412209 /nfs/dbraw/zinc/41/22/09/1006412209.db2.gz PAMWXLBQXQVQPR-CYBMUJFWSA-N 1 1 371.387 2.784 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)nc1-c1ccccn1 ZINC000853517490 1006422651 /nfs/dbraw/zinc/42/26/51/1006422651.db2.gz VEVMZJRHZJRNFH-KYJSFNMBSA-N 1 1 371.441 2.826 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)C1 ZINC000805570444 1006485228 /nfs/dbraw/zinc/48/52/28/1006485228.db2.gz YROGLGWUAUTDOP-AWEZNQCLSA-N 1 1 361.398 2.590 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H](O)c3cc4ccccc4o3)CC2)cn1 ZINC000815010605 1006490101 /nfs/dbraw/zinc/49/01/01/1006490101.db2.gz WENXZYROGUNUAS-MRXNPFEDSA-N 1 1 368.393 2.592 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H]3CCC4(CCOCC4)CO3)c2c1 ZINC000882785428 1006505429 /nfs/dbraw/zinc/50/54/29/1006505429.db2.gz JFWMPRDUUXHROA-HNNXBMFYSA-N 1 1 357.410 2.953 20 5 FFBDMO Cc1c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000855160110 1007139161 /nfs/dbraw/zinc/13/91/61/1007139161.db2.gz NVYZIEUGKIQPAU-GFCCVEGCSA-N 1 1 364.402 2.662 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000855286566 1007245515 /nfs/dbraw/zinc/24/55/15/1007245515.db2.gz TVWCPWRUHMMUEN-LLVKDONJSA-N 1 1 357.813 2.919 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)[C@H]1CC[N@@H+](CC)C1 ZINC000855490185 1007366108 /nfs/dbraw/zinc/36/61/08/1007366108.db2.gz FBDQIAJPNOWEAZ-ZDUSSCGKSA-N 1 1 364.402 2.676 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)CN(C)C(=O)OC(C)(C)C ZINC000818165187 1007874975 /nfs/dbraw/zinc/87/49/75/1007874975.db2.gz QITKQRYFMXIDFF-BBRMVZONSA-N 1 1 367.446 2.815 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@H](C)[N@H+]1C ZINC000818626063 1007955851 /nfs/dbraw/zinc/95/58/51/1007955851.db2.gz FZCHLDZHPYRVCX-GASCZTMLSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C[C@H](C)[N@@H+]1C ZINC000818626063 1007955858 /nfs/dbraw/zinc/95/58/58/1007955858.db2.gz FZCHLDZHPYRVCX-GASCZTMLSA-N 1 1 360.458 2.750 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000821673284 1008484533 /nfs/dbraw/zinc/48/45/33/1008484533.db2.gz VYOGOVPBMMPMRL-UHFFFAOYSA-N 1 1 370.344 2.633 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@@H+]2Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886200558 1008601585 /nfs/dbraw/zinc/60/15/85/1008601585.db2.gz RDCYOLCQTJWSHE-UHFFFAOYSA-N 1 1 362.430 2.965 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886200558 1008601590 /nfs/dbraw/zinc/60/15/90/1008601590.db2.gz RDCYOLCQTJWSHE-UHFFFAOYSA-N 1 1 362.430 2.965 20 5 FFBDMO Cc1ccccc1[C@H](CO)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000886436000 1008682191 /nfs/dbraw/zinc/68/21/91/1008682191.db2.gz OFARSJZYPDNQIN-SFHVURJKSA-N 1 1 357.410 2.897 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCN(c3cccc4[nH]ccc43)CC2)c1 ZINC000859832994 1008687662 /nfs/dbraw/zinc/68/76/62/1008687662.db2.gz MFVNFWCGIXZKEP-HXUWFJFHSA-N 1 1 366.421 2.932 20 5 FFBDMO COc1cc(Cc2noc([C@H]3C[C@@H](C)CC[NH2+]3)n2)c([N+](=O)[O-])c(OC)c1 ZINC000823147151 1008920328 /nfs/dbraw/zinc/92/03/28/1008920328.db2.gz WRRHSOVUIBCHIA-GXFFZTMASA-N 1 1 362.386 2.646 20 5 FFBDMO CCn1cc(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C)n1 ZINC000860779933 1009149835 /nfs/dbraw/zinc/14/98/35/1009149835.db2.gz AZNQDLWUEHNKMA-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO CCn1cc(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c(C)n1 ZINC000860779933 1009149840 /nfs/dbraw/zinc/14/98/40/1009149840.db2.gz AZNQDLWUEHNKMA-INIZCTEOSA-N 1 1 358.398 2.551 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000861984536 1009647621 /nfs/dbraw/zinc/64/76/21/1009647621.db2.gz GUEYPPLSBAZSRU-FOCLMDBBSA-N 1 1 373.453 2.711 20 5 FFBDMO O=C1CN(C[N@H+]2CCCC3(CC3)CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000863331233 1010178796 /nfs/dbraw/zinc/17/87/96/1010178796.db2.gz IRBUOXWOWICSDC-UHFFFAOYSA-N 1 1 358.398 2.587 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000864676266 1010553465 /nfs/dbraw/zinc/55/34/65/1010553465.db2.gz IZJJDQZMIQVVDQ-QGZVFWFLSA-N 1 1 357.385 2.792 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000864676266 1010553469 /nfs/dbraw/zinc/55/34/69/1010553469.db2.gz IZJJDQZMIQVVDQ-QGZVFWFLSA-N 1 1 357.385 2.792 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866260620 1010964578 /nfs/dbraw/zinc/96/45/78/1010964578.db2.gz WCSFAAGORKIDIJ-HZPDHXFCSA-N 1 1 366.481 2.528 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000870124254 1012170483 /nfs/dbraw/zinc/17/04/83/1012170483.db2.gz YJQNUYSWROWAIF-CQSZACIVSA-N 1 1 354.410 2.696 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC[C@@H](CO)C3)CC2)c(F)c1 ZINC001173011412 1012181143 /nfs/dbraw/zinc/18/11/43/1012181143.db2.gz BPQDSJQZABUIIX-GFCCVEGCSA-N 1 1 355.385 2.546 20 5 FFBDMO CN1CCC[C@@H]([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173011689 1012182031 /nfs/dbraw/zinc/18/20/31/1012182031.db2.gz JNEJZLQUFMAQKP-CYBMUJFWSA-N 1 1 368.428 2.916 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3C)CC[NH2+]2)cc1 ZINC000870138955 1012183740 /nfs/dbraw/zinc/18/37/40/1012183740.db2.gz QEFVXPBUGRGBFC-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CC[C@H]4OCC[C@@H]4C3)CC2)c(F)c1 ZINC001173015436 1012187573 /nfs/dbraw/zinc/18/75/73/1012187573.db2.gz QCNRIJFFDAAGMO-SJKOYZFVSA-N 1 1 367.396 2.953 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+](C)[C@@H]2CCCN(C(C)=O)C2)c1F ZINC001173191465 1012332958 /nfs/dbraw/zinc/33/29/58/1012332958.db2.gz FKBXUVGSJHVORN-TZMCWYRMSA-N 1 1 367.421 2.616 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCc3c(=O)[nH]ccc3C2)c1F ZINC001173192180 1012335033 /nfs/dbraw/zinc/33/50/33/1012335033.db2.gz JIVUQNGTQPARCC-LLVKDONJSA-N 1 1 361.373 2.832 20 5 FFBDMO CC[N@@H+](CCn1ccnc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173192152 1012335557 /nfs/dbraw/zinc/33/55/57/1012335557.db2.gz IXTZMXLWYSKHCJ-CYBMUJFWSA-N 1 1 350.394 2.892 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)N2CCCC2)C1 ZINC001173238495 1012385260 /nfs/dbraw/zinc/38/52/60/1012385260.db2.gz TXPAJMXWWWPRSH-DOTOQJQBSA-N 1 1 360.458 2.796 20 5 FFBDMO O=C(c1cc2ccccc2c2cccnc12)N1CC(C[NH+]2CCOCC2)C1 ZINC000647805783 1012591084 /nfs/dbraw/zinc/59/10/84/1012591084.db2.gz DJAXRLGGFMFGCY-UHFFFAOYSA-N 1 1 361.445 2.792 20 5 FFBDMO C[C@]([NH3+])(C(=O)N1CCC[C@H]([C@@H]2CCCCO2)C1)c1cccc([N+](=O)[O-])c1 ZINC000870955492 1012649361 /nfs/dbraw/zinc/64/93/61/1012649361.db2.gz YLTRSEMUOHINBG-UCLAIMLFSA-N 1 1 361.442 2.576 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)cc1OC ZINC000871150577 1012750395 /nfs/dbraw/zinc/75/03/95/1012750395.db2.gz PMFRCCFIYMFYLB-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+][C@@H]1C[C@H]2OC(C)(C)O[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000927058351 1018339683 /nfs/dbraw/zinc/33/96/83/1018339683.db2.gz ZQOIQVNCKSVHAH-LLLHUVSDSA-N 1 1 372.425 2.690 20 5 FFBDMO CC(C)N1CC[NH+](CCCC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000901329900 1018970246 /nfs/dbraw/zinc/97/02/46/1018970246.db2.gz NNQWYEMNSHQRIY-INIZCTEOSA-N 1 1 362.474 2.578 20 5 FFBDMO O=C1OCC[C@@H]1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000828807699 1032847688 /nfs/dbraw/zinc/84/76/88/1032847688.db2.gz PXOYYCUQBCHNDH-XIRDDKMYSA-N 1 1 362.426 2.654 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccc(C(F)F)cc2)CC1 ZINC001045437312 1019965605 /nfs/dbraw/zinc/96/56/05/1019965605.db2.gz NCZLYWPKDVCVSB-HUUCEWRRSA-N 1 1 367.396 2.760 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(O[C@H]4CCOC4)CC3)c2)c1 ZINC000777963424 1020353610 /nfs/dbraw/zinc/35/36/10/1020353610.db2.gz LHMIUCMBGROCFY-IBGZPJMESA-N 1 1 372.425 2.686 20 5 FFBDMO O=C([C@@H]1CC[C@@H]2CCCC[N@H+]21)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000900880326 1020696969 /nfs/dbraw/zinc/69/69/69/1020696969.db2.gz HMIUTHGGCCPKSK-KXBFYZLASA-N 1 1 373.453 2.982 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932144529 1020722481 /nfs/dbraw/zinc/72/24/81/1020722481.db2.gz USHQUBXBQDCFHF-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@H](C2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000933081573 1020953941 /nfs/dbraw/zinc/95/39/41/1020953941.db2.gz LHJJYCRDKZEZIM-INIZCTEOSA-N 1 1 361.442 2.696 20 5 FFBDMO C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCN1C(=O)OC(C)(C)C ZINC000933468066 1021017856 /nfs/dbraw/zinc/01/78/56/1021017856.db2.gz QBKRQZHXFJPANS-JKSUJKDBSA-N 1 1 365.430 2.569 20 5 FFBDMO CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000750116627 1021380169 /nfs/dbraw/zinc/38/01/69/1021380169.db2.gz SLYPZRRFECAFDV-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000750116627 1021380185 /nfs/dbraw/zinc/38/01/85/1021380185.db2.gz SLYPZRRFECAFDV-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000750116627 1021380202 /nfs/dbraw/zinc/38/02/02/1021380202.db2.gz SLYPZRRFECAFDV-UXHICEINSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC000934838192 1021422282 /nfs/dbraw/zinc/42/22/82/1021422282.db2.gz IZMORKOSZXDOPO-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000934899294 1021454104 /nfs/dbraw/zinc/45/41/04/1021454104.db2.gz PIDWIRKOKVVXJC-UHFFFAOYSA-N 1 1 372.450 2.983 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21 ZINC000778806506 1022391728 /nfs/dbraw/zinc/39/17/28/1022391728.db2.gz QRPSYJMMRQEDJW-UHFFFAOYSA-N 1 1 370.365 2.991 20 5 FFBDMO O=C(NCCCCC[NH+]1CCNCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC001122195727 1023106094 /nfs/dbraw/zinc/10/60/94/1023106094.db2.gz YDYKRARQEVCVDO-UHFFFAOYSA-N 1 1 370.453 2.553 20 5 FFBDMO O=C1N(C[NH+]2CCc3ccccc3CC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752791416 1023205247 /nfs/dbraw/zinc/20/52/47/1023205247.db2.gz FGLPSJHPPSKMFQ-UHFFFAOYSA-N 1 1 366.421 2.895 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000755220032 1023579575 /nfs/dbraw/zinc/57/95/75/1023579575.db2.gz NWCKUDIRBCRMDT-UHFFFAOYSA-N 1 1 365.393 2.733 20 5 FFBDMO CCC[C@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000757612862 1023836552 /nfs/dbraw/zinc/83/65/52/1023836552.db2.gz WHNPRYGZLMHZNF-AWEZNQCLSA-N 1 1 360.414 2.833 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000192829784 1024285451 /nfs/dbraw/zinc/28/54/51/1024285451.db2.gz JFQHYUSZLNYSCH-RDJZCZTQSA-N 1 1 355.394 2.779 20 5 FFBDMO Cc1nn(C)c2ncc(C[NH+]3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc12 ZINC000193587594 1024585390 /nfs/dbraw/zinc/58/53/90/1024585390.db2.gz SBBJDLXCCLLNMX-UHFFFAOYSA-N 1 1 366.425 2.507 20 5 FFBDMO C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000246334511 1026024575 /nfs/dbraw/zinc/02/45/75/1026024575.db2.gz TUPNRGCUVIFZGM-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1=O ZINC000246334511 1026024595 /nfs/dbraw/zinc/02/45/95/1026024595.db2.gz TUPNRGCUVIFZGM-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO C[C@@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000839646350 1026772688 /nfs/dbraw/zinc/77/26/88/1026772688.db2.gz IGNVDPJUTZBBEK-UZLBHIALSA-N 1 1 355.438 2.835 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001141698900 1026832187 /nfs/dbraw/zinc/83/21/87/1026832187.db2.gz XPEQZOJWDRVOER-VIFPVBQESA-N 1 1 360.817 2.820 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCCC[C@@H]3[C@@H]3CCC[C@H]3O)n2)cc1 ZINC000840117681 1026964783 /nfs/dbraw/zinc/96/47/83/1026964783.db2.gz WCVCOESDWYUQCK-RCCFBDPRSA-N 1 1 371.441 2.826 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000840141758 1026981638 /nfs/dbraw/zinc/98/16/38/1026981638.db2.gz RXESDQZACNVNBU-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NCCNC(=O)Nc2ccccc2)ncc1[N+](=O)[O-] ZINC001158517002 1027050673 /nfs/dbraw/zinc/05/06/73/1027050673.db2.gz KKYJKYUFYGBGPC-DHZHZOJOSA-N 1 1 370.413 2.756 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1c1ncc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001158522868 1027052280 /nfs/dbraw/zinc/05/22/80/1027052280.db2.gz AXTLKXFJIPZBKG-ZIAGYGMSSA-N 1 1 371.397 2.997 20 5 FFBDMO COc1ccccc1C1(Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)COC1 ZINC001161274957 1028108138 /nfs/dbraw/zinc/10/81/38/1028108138.db2.gz WFCOXWFCZWGEDO-CMDGGOBGSA-N 1 1 370.409 2.868 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](Cc1ccccc1)CC2 ZINC000957547385 1028324037 /nfs/dbraw/zinc/32/40/37/1028324037.db2.gz DYXCWIFZDHKKCD-QZTJIDSGSA-N 1 1 357.454 2.556 20 5 FFBDMO O=[N+]([O-])c1ccc2ncc(N3CCC[N@@H+](Cc4ccncc4)CC3)nc2c1 ZINC001163826700 1029077469 /nfs/dbraw/zinc/07/74/69/1029077469.db2.gz IEIIVRQGTJSHRR-UHFFFAOYSA-N 1 1 364.409 2.645 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cccc3ccccc32)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490228 1029296377 /nfs/dbraw/zinc/29/63/77/1029296377.db2.gz DSESRDFKUUVSRT-RTBURBONSA-N 1 1 367.449 2.881 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2ccc(F)c(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164491048 1029297565 /nfs/dbraw/zinc/29/75/65/1029297565.db2.gz YOKKXYVKDVGMBO-IUODEOHRSA-N 1 1 369.824 2.520 20 5 FFBDMO COc1cc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001165086709 1029375682 /nfs/dbraw/zinc/37/56/82/1029375682.db2.gz OBMGJZQUKRTGPO-NVXWUHKLSA-N 1 1 354.410 2.709 20 5 FFBDMO O=[N+]([O-])c1cnc2cccc(NCc3ccc(C[NH+]4CCOCC4)cc3)n21 ZINC001165413100 1029971936 /nfs/dbraw/zinc/97/19/36/1029971936.db2.gz KNHSJFRAHWWFRD-UHFFFAOYSA-N 1 1 367.409 2.687 20 5 FFBDMO Cc1nn(C[N@H+](C)C[C@]2(O)CCc3ccccc32)c2cc([N+](=O)[O-])ccc12 ZINC000842626741 1030850450 /nfs/dbraw/zinc/85/04/50/1030850450.db2.gz XPGYWLWZCZXPDY-HXUWFJFHSA-N 1 1 366.421 2.976 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000831698866 1034219616 /nfs/dbraw/zinc/21/96/16/1034219616.db2.gz BTGIAKXNIANHSB-QZTJIDSGSA-N 1 1 361.442 2.542 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226165520 1034554528 /nfs/dbraw/zinc/55/45/28/1034554528.db2.gz LLWMESBQOZWIPA-LIRRHRJNSA-N 1 1 369.421 2.983 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])c(F)cc3Cl)C[C@H]1[N@H+]2C ZINC001226198565 1034568819 /nfs/dbraw/zinc/56/88/19/1034568819.db2.gz NOPMRGGQWBZFGU-ITIFCUTMSA-N 1 1 372.780 2.933 20 5 FFBDMO COc1cc(O[C@H]2CCC[N@H+]([C@@H](C)c3ccccn3)C2)ncc1[N+](=O)[O-] ZINC001226579771 1034744714 /nfs/dbraw/zinc/74/47/14/1034744714.db2.gz USSPUCPGHXOVEC-KBPBESRZSA-N 1 1 358.398 2.998 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(F)c(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227285728 1035495645 /nfs/dbraw/zinc/49/56/45/1035495645.db2.gz FSPGNIXLKASMHZ-HOCOFYGGSA-N 1 1 373.178 2.679 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@@H](Oc3cc(F)c(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001227285728 1035495647 /nfs/dbraw/zinc/49/56/47/1035495647.db2.gz FSPGNIXLKASMHZ-HOCOFYGGSA-N 1 1 373.178 2.679 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc(F)c(Br)cc2[N+](=O)[O-])C1 ZINC001227284923 1035495795 /nfs/dbraw/zinc/49/57/95/1035495795.db2.gz RPIVPAJUSDGZCL-SECBINFHSA-N 1 1 363.183 2.596 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])CCCO1 ZINC000835081653 1035520951 /nfs/dbraw/zinc/52/09/51/1035520951.db2.gz AYDYUPZMHTWYRZ-OAHLLOKOSA-N 1 1 365.430 2.710 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCCO1 ZINC000835081653 1035520957 /nfs/dbraw/zinc/52/09/57/1035520957.db2.gz AYDYUPZMHTWYRZ-OAHLLOKOSA-N 1 1 365.430 2.710 20 5 FFBDMO CC[N@H+]1CC[C@@H](Oc2cc(OC)cc3oc4c(O)ccc(O)c4c(=O)c23)C1 ZINC001227647227 1035655193 /nfs/dbraw/zinc/65/51/93/1035655193.db2.gz XDPVWVLPQLBFKO-LLVKDONJSA-N 1 1 371.389 2.839 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[n-]1 ZINC001228240615 1036009209 /nfs/dbraw/zinc/00/92/09/1036009209.db2.gz RHMMMERVYQWFOF-OAHLLOKOSA-N 1 1 366.377 2.897 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@@H]2CC[N@H+](Cc3ccccc3)C2)[nH]1 ZINC001228240615 1036009224 /nfs/dbraw/zinc/00/92/24/1036009224.db2.gz RHMMMERVYQWFOF-OAHLLOKOSA-N 1 1 366.377 2.897 20 5 FFBDMO O=c1nc2cc([N+](=O)[O-])ccc2c(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)[nH]1 ZINC001228240615 1036009246 /nfs/dbraw/zinc/00/92/46/1036009246.db2.gz RHMMMERVYQWFOF-OAHLLOKOSA-N 1 1 366.377 2.897 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC001229455652 1036686346 /nfs/dbraw/zinc/68/63/46/1036686346.db2.gz KXPCFAAUCYWHRA-XYJFISCASA-N 1 1 355.394 2.518 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001277849081 1036996269 /nfs/dbraw/zinc/99/62/69/1036996269.db2.gz INLZDARVKDPYQY-JHJVBQTASA-N 1 1 356.426 2.883 20 5 FFBDMO O=[N+]([O-])c1nc(Cl)ccc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001230879421 1037392043 /nfs/dbraw/zinc/39/20/43/1037392043.db2.gz OQLMKWWUBVASOS-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1nc(Cl)ccc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001230879421 1037392061 /nfs/dbraw/zinc/39/20/61/1037392061.db2.gz OQLMKWWUBVASOS-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO Cc1nc(OC2CC[NH+](CCF)CC2)c([N+](=O)[O-])cc1Br ZINC001231121029 1037479811 /nfs/dbraw/zinc/47/98/11/1037479811.db2.gz DQWXNVXVMKYUBV-UHFFFAOYSA-N 1 1 362.199 2.873 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3CC[C@@H](O)[C@@H](C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256092913 1038376813 /nfs/dbraw/zinc/37/68/13/1038376813.db2.gz BAVBIQLQVUHDCF-KBXCAEBGSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H]4CN(C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100861 1038384337 /nfs/dbraw/zinc/38/43/37/1038384337.db2.gz RHHGCIFOZYNJAW-BEFAXECRSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@H]4C[N@H+](C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100861 1038384351 /nfs/dbraw/zinc/38/43/51/1038384351.db2.gz RHHGCIFOZYNJAW-BEFAXECRSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@H]4C[N@@H+](C)C[C@@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100861 1038384362 /nfs/dbraw/zinc/38/43/62/1038384362.db2.gz RHHGCIFOZYNJAW-BEFAXECRSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC([N@@H+]3C[C@@H](C)N(C)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100488 1038384390 /nfs/dbraw/zinc/38/43/90/1038384390.db2.gz JHWRMDUBWQIWSG-GASCZTMLSA-N 1 1 362.474 2.597 20 5 FFBDMO COc1ccc(-c2nc3ccc(N4CC[NH+](C)CC4)cc3[nH]2)cc1[N+](=O)[O-] ZINC001250915365 1038809410 /nfs/dbraw/zinc/80/94/10/1038809410.db2.gz XBEYSDZDMOPALI-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO NC[C@@]1(F)CCCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580954 1039403530 /nfs/dbraw/zinc/40/35/30/1039403530.db2.gz ONNHHEDISNWTOC-SFHVURJKSA-N 1 1 350.438 2.717 20 5 FFBDMO [NH3+]C[C@@]1(F)CCCCN(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001246580954 1039403537 /nfs/dbraw/zinc/40/35/37/1039403537.db2.gz ONNHHEDISNWTOC-SFHVURJKSA-N 1 1 350.438 2.717 20 5 FFBDMO CC[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@H]1CCCNC1 ZINC001246854256 1039504310 /nfs/dbraw/zinc/50/43/10/1039504310.db2.gz NYRLCXQBVHUEKY-CQSZACIVSA-N 1 1 368.428 2.916 20 5 FFBDMO CC[N@@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)[C@@H]1CCCNC1 ZINC001246854256 1039504320 /nfs/dbraw/zinc/50/43/20/1039504320.db2.gz NYRLCXQBVHUEKY-CQSZACIVSA-N 1 1 368.428 2.916 20 5 FFBDMO COc1ccc(OC)c(-c2noc([C@H]([NH3+])Cc3cccc([N+](=O)[O-])c3)n2)c1 ZINC001248209824 1040173896 /nfs/dbraw/zinc/17/38/96/1040173896.db2.gz YVHDANFAYXNBQN-OAHLLOKOSA-N 1 1 370.365 2.905 20 5 FFBDMO COc1ccc(OC)c(-c2noc([C@@H]([NH3+])Cc3ccc([N+](=O)[O-])cc3)n2)c1 ZINC001248210282 1040174710 /nfs/dbraw/zinc/17/47/10/1040174710.db2.gz OAFZDKYKZKEFRK-HNNXBMFYSA-N 1 1 370.365 2.905 20 5 FFBDMO [NH3+][C@@]1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)CCCc2ccccc21 ZINC001248248051 1040192063 /nfs/dbraw/zinc/19/20/63/1040192063.db2.gz PZPUWZFJXQZKGQ-KRWDZBQOSA-N 1 1 355.329 2.718 20 5 FFBDMO Cc1cc(O)cc(C)c1C[C@H]([NH3+])c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1 ZINC001249303637 1040673565 /nfs/dbraw/zinc/67/35/65/1040673565.db2.gz FFICYLVSWIXDMT-ZDUSSCGKSA-N 1 1 373.344 2.744 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@](O)(C(F)(F)F)C3)CC2)cc1 ZINC001254475070 1040741449 /nfs/dbraw/zinc/74/14/49/1040741449.db2.gz ZOUBKVXTMCDPKG-OAHLLOKOSA-N 1 1 359.348 2.563 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)OC(C)(C)C ZINC001254551515 1040795183 /nfs/dbraw/zinc/79/51/83/1040795183.db2.gz CMZMNSIBRJEHRP-UTXMOHQDSA-N 1 1 361.442 2.981 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(NC(=O)C(F)(F)F)CC1 ZINC001254560264 1040796003 /nfs/dbraw/zinc/79/60/03/1040796003.db2.gz QUFGMNLUFVKXGO-LLVKDONJSA-N 1 1 359.348 2.669 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254562121 1040799234 /nfs/dbraw/zinc/79/92/34/1040799234.db2.gz JRNMPSYYLSUULN-CYBMUJFWSA-N 1 1 372.425 2.710 20 5 FFBDMO CC(C)NC(=O)c1noc2c1C[N@H+]([C@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254562121 1040799250 /nfs/dbraw/zinc/79/92/50/1040799250.db2.gz JRNMPSYYLSUULN-CYBMUJFWSA-N 1 1 372.425 2.710 20 5 FFBDMO COc1ccc(CC[N@@H+](C[C@@H](C)O)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001254599665 1040829698 /nfs/dbraw/zinc/82/96/98/1040829698.db2.gz OGTNVLYBAYRZBI-FOIQADDNSA-N 1 1 370.449 2.996 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(c3ncccc3Cl)CC1)C2 ZINC001254602628 1040831636 /nfs/dbraw/zinc/83/16/36/1040831636.db2.gz HDRVJUWNXHKYBG-INIZCTEOSA-N 1 1 358.829 2.933 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H](c2ccccc2)C1 ZINC001261810330 1041428819 /nfs/dbraw/zinc/42/88/19/1041428819.db2.gz YICCASSGAZOPJE-MOPGFXCFSA-N 1 1 351.406 2.782 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC001538310444 1070402931 /nfs/dbraw/zinc/40/29/31/1070402931.db2.gz XFJKHECIGPPOHS-LBPRGKRZSA-N 1 1 353.394 2.545 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c([N+](=O)[O-])cc1F ZINC001538310444 1070402934 /nfs/dbraw/zinc/40/29/34/1070402934.db2.gz XFJKHECIGPPOHS-LBPRGKRZSA-N 1 1 353.394 2.545 20 5 FFBDMO c1nn(CC[NH+]2CCOCC2)cc1-c1ccnc2c1ccc1cccnc12 ZINC001240544731 1044381240 /nfs/dbraw/zinc/38/12/40/1044381240.db2.gz CPPXLDULZQTGSJ-UHFFFAOYSA-N 1 1 359.433 2.979 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001318659359 1044794007 /nfs/dbraw/zinc/79/40/07/1044794007.db2.gz JMSHPRSDFSQCHG-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001318659359 1044794019 /nfs/dbraw/zinc/79/40/19/1044794019.db2.gz JMSHPRSDFSQCHG-LJQANCHMSA-N 1 1 368.437 2.703 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486399 1045170190 /nfs/dbraw/zinc/17/01/90/1045170190.db2.gz KLKXXXRBUIYVHV-YJBOKZPZSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC001319486399 1045170194 /nfs/dbraw/zinc/17/01/94/1045170194.db2.gz KLKXXXRBUIYVHV-YJBOKZPZSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703779 1045246958 /nfs/dbraw/zinc/24/69/58/1045246958.db2.gz DCYIXODJUVTEPJ-QAPCUYQASA-N 1 1 372.400 2.800 20 5 FFBDMO Cc1cc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c(N)c([N+](=O)[O-])c1 ZINC001319703779 1045246968 /nfs/dbraw/zinc/24/69/68/1045246968.db2.gz DCYIXODJUVTEPJ-QAPCUYQASA-N 1 1 372.400 2.800 20 5 FFBDMO CN(CC(C)(C)C[NH2+]CCc1ccc(Cl)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001282295174 1045483568 /nfs/dbraw/zinc/48/35/68/1045483568.db2.gz RCNPWIXVUHPPQQ-HZPDHXFCSA-N 1 1 367.877 2.622 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]1C ZINC001320950262 1045500477 /nfs/dbraw/zinc/50/04/77/1045500477.db2.gz DUGVGSKMSCVQSU-BXKDBHETSA-N 1 1 357.204 2.741 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)[C@@H]1C ZINC001320950262 1045500482 /nfs/dbraw/zinc/50/04/82/1045500482.db2.gz DUGVGSKMSCVQSU-BXKDBHETSA-N 1 1 357.204 2.741 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001324649505 1046146046 /nfs/dbraw/zinc/14/60/46/1046146046.db2.gz DHTROHVSGVVUHR-NSHDSACASA-N 1 1 371.235 2.963 20 5 FFBDMO CC(C)n1cnnc1[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001324939951 1046297610 /nfs/dbraw/zinc/29/76/10/1046297610.db2.gz BURRXQQOQIEMFK-DOTOQJQBSA-N 1 1 359.430 2.680 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001325785039 1046638831 /nfs/dbraw/zinc/63/88/31/1046638831.db2.gz ACCWSIVDFREIIG-NSHDSACASA-N 1 1 357.204 2.885 20 5 FFBDMO COC(=O)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001325785039 1046638835 /nfs/dbraw/zinc/63/88/35/1046638835.db2.gz ACCWSIVDFREIIG-NSHDSACASA-N 1 1 357.204 2.885 20 5 FFBDMO CCC1([NH2+]CC2CCC3(CC3)CC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001327448359 1047899279 /nfs/dbraw/zinc/89/92/79/1047899279.db2.gz ADDHRUZHERPTNW-IAGOWNOFSA-N 1 1 363.502 2.983 20 5 FFBDMO C[N@@H+](CCc1nccc(C(F)(F)F)n1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001333452556 1048911115 /nfs/dbraw/zinc/91/11/15/1048911115.db2.gz LEFLFABJOZXGBI-ZDUSSCGKSA-N 1 1 370.331 2.612 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C1 ZINC001331278950 1049547009 /nfs/dbraw/zinc/54/70/09/1049547009.db2.gz BBGVRPVLDXMJAR-SNVBAGLBSA-N 1 1 374.210 2.711 20 5 FFBDMO Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038237 1050634917 /nfs/dbraw/zinc/63/49/17/1050634917.db2.gz VDHMPWVIGQCOMJ-AWEZNQCLSA-N 1 1 372.425 2.554 20 5 FFBDMO Cc1nnc(N(C)CCc2ccccc2[N+](=O)[O-])n1C[C@@H](C)[N@@H+](C)C1CC1 ZINC001304796818 1051703699 /nfs/dbraw/zinc/70/36/99/1051703699.db2.gz IOPMYLQJFLOTGW-CQSZACIVSA-N 1 1 372.473 2.656 20 5 FFBDMO C[C@H](c1nnc(N(C)C[C@@H]2CCCC[N@H+]2Cc2ccccc2)n1C)[N+](=O)[O-] ZINC001341360216 1051718810 /nfs/dbraw/zinc/71/88/10/1051718810.db2.gz OLBRMCXTUFOWKT-WBVHZDCISA-N 1 1 372.473 2.644 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@H+](C)C[C@H]1c1ccccc1 ZINC001306918215 1052221453 /nfs/dbraw/zinc/22/14/53/1052221453.db2.gz OOXIBDSORSLBGY-LBPRGKRZSA-N 1 1 369.347 2.840 20 5 FFBDMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@H]1c1ccccc1 ZINC001306918215 1052221463 /nfs/dbraw/zinc/22/14/63/1052221463.db2.gz OOXIBDSORSLBGY-LBPRGKRZSA-N 1 1 369.347 2.840 20 5 FFBDMO Cc1ccc(NCCNc2ncc([N+](=O)[O-])cc2Br)[nH+]c1 ZINC001307217554 1052270068 /nfs/dbraw/zinc/27/00/68/1052270068.db2.gz IKRWXOZLFAPKJY-UHFFFAOYSA-N 1 1 352.192 2.980 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC001307929413 1052367565 /nfs/dbraw/zinc/36/75/65/1052367565.db2.gz YHXWIMKBHPTTEV-OEYIWLLWSA-N 1 1 358.398 2.799 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC(c3c[nH+]cn3C)CC2)cccc1[N+](=O)[O-] ZINC001308167802 1052423178 /nfs/dbraw/zinc/42/31/78/1052423178.db2.gz JLUKXQKPMBQWCQ-AWEZNQCLSA-N 1 1 371.441 2.843 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[NH2+]Cc2c(F)cc(Br)cc2F)c1 ZINC001308316451 1052445480 /nfs/dbraw/zinc/44/54/80/1052445480.db2.gz OENVPPLAVFHYKF-UHFFFAOYSA-N 1 1 361.146 2.622 20 5 FFBDMO CC(C)(CNc1ncnc2c(Cl)cc([N+](=O)[O-])cc12)[NH+]1CCOCC1 ZINC001347049442 1053572147 /nfs/dbraw/zinc/57/21/47/1053572147.db2.gz LZROUXPZNQPBBI-UHFFFAOYSA-N 1 1 365.821 2.714 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC001336744017 1054186708 /nfs/dbraw/zinc/18/67/08/1054186708.db2.gz CGEYIBJPISZKDL-SNVBAGLBSA-N 1 1 374.210 2.711 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1Br ZINC001348443988 1054698484 /nfs/dbraw/zinc/69/84/84/1054698484.db2.gz ZOHNXSUFHXGRHM-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO O=[N+]([O-])c1cccc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1Br ZINC001348443988 1054698490 /nfs/dbraw/zinc/69/84/90/1054698490.db2.gz ZOHNXSUFHXGRHM-ODOQXGPZSA-N 1 1 355.232 2.950 20 5 FFBDMO O=C(c1cc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-])N1CCCC1 ZINC001337735676 1054978836 /nfs/dbraw/zinc/97/88/36/1054978836.db2.gz XLQNDDPGLYQQBM-SJLPKXTDSA-N 1 1 358.442 2.870 20 5 FFBDMO Cc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000847253265 1055321119 /nfs/dbraw/zinc/32/11/19/1055321119.db2.gz ABGUWEGCRWYPIG-HUUCEWRRSA-N 1 1 362.386 2.558 20 5 FFBDMO Cc1cc(NC(=O)[C@H]2CCC[N@@H+]2C(C)C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001349584728 1055353342 /nfs/dbraw/zinc/35/33/42/1055353342.db2.gz FEAZTQSDASEBCB-MRXNPFEDSA-N 1 1 357.414 2.900 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1 ZINC001339235567 1056234212 /nfs/dbraw/zinc/23/42/12/1056234212.db2.gz WAKQCNJRQSGVKM-PBHICJAKSA-N 1 1 370.457 2.712 20 5 FFBDMO CCN(c1nnc(C[N+](=O)[O-])n1CC)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC001339454019 1056468645 /nfs/dbraw/zinc/46/86/45/1056468645.db2.gz FYQHAQQLYLLUFW-RDJZCZTQSA-N 1 1 372.473 2.737 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CC[N@H+](C)C[C@@H]1c1cnn(C)c1 ZINC000849597329 1056938525 /nfs/dbraw/zinc/93/85/25/1056938525.db2.gz SFOVPIGLQNCLQH-JKSUJKDBSA-N 1 1 371.441 2.619 20 5 FFBDMO C[N@H+]1CCC[C@H](CNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001443768458 1058242219 /nfs/dbraw/zinc/24/22/19/1058242219.db2.gz CTMRTIYWOWMQJV-CQSZACIVSA-N 1 1 354.410 2.728 20 5 FFBDMO C[N@@H+]1C[C@H](O)C[C@@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874958 1058252603 /nfs/dbraw/zinc/25/26/03/1058252603.db2.gz QMLXMYFLTHJZLS-BEFAXECRSA-N 1 1 371.393 2.781 20 5 FFBDMO C[N@H+]1C[C@H](O)C[C@@]1(C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC001443874958 1058252616 /nfs/dbraw/zinc/25/26/16/1058252616.db2.gz QMLXMYFLTHJZLS-BEFAXECRSA-N 1 1 371.393 2.781 20 5 FFBDMO Cc1cccc(C(=O)N2CC3(C2)C[NH+](Cc2ccccc2)C3)c1[N+](=O)[O-] ZINC001454692856 1059610448 /nfs/dbraw/zinc/61/04/48/1059610448.db2.gz NPZMFYKNEXYMPS-UHFFFAOYSA-N 1 1 351.406 2.861 20 5 FFBDMO Cc1[nH]c(CNC(=O)c2cc([N+](=O)[O-])cc(Br)c2C)c(C)[nH+]1 ZINC001456040303 1059994507 /nfs/dbraw/zinc/99/45/07/1059994507.db2.gz DLWYEQNLNGHGDD-UHFFFAOYSA-N 1 1 367.203 2.936 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000848485388 1060126061 /nfs/dbraw/zinc/12/60/61/1060126061.db2.gz ZEPPZTISUKZNTK-MJGOQNOKSA-N 1 1 373.453 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CCOCC3(CCOCC3)C2)c1 ZINC000848485078 1060129038 /nfs/dbraw/zinc/12/90/38/1060129038.db2.gz URFJQWWCAKCIDL-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CCOCC3(CCOCC3)C2)c1 ZINC000848485078 1060129050 /nfs/dbraw/zinc/12/90/50/1060129050.db2.gz URFJQWWCAKCIDL-UHFFFAOYSA-N 1 1 372.425 2.545 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000848486857 1060133393 /nfs/dbraw/zinc/13/33/93/1060133393.db2.gz KRLHJAPDDWYVSP-QGZVFWFLSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1 ZINC000848486857 1060133404 /nfs/dbraw/zinc/13/34/04/1060133404.db2.gz KRLHJAPDDWYVSP-QGZVFWFLSA-N 1 1 365.393 2.964 20 5 FFBDMO CO[C@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488114 1060135676 /nfs/dbraw/zinc/13/56/76/1060135676.db2.gz GIRWRFGDTGPHFP-IRXDYDNUSA-N 1 1 361.442 2.615 20 5 FFBDMO CO[C@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000848488114 1060135685 /nfs/dbraw/zinc/13/56/85/1060135685.db2.gz GIRWRFGDTGPHFP-IRXDYDNUSA-N 1 1 361.442 2.615 20 5 FFBDMO COCCO[C@@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848487893 1060135970 /nfs/dbraw/zinc/13/59/70/1060135970.db2.gz ZWKLXKMSMZXQOE-MRXNPFEDSA-N 1 1 360.414 2.543 20 5 FFBDMO COCCO[C@@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848487893 1060135976 /nfs/dbraw/zinc/13/59/76/1060135976.db2.gz ZWKLXKMSMZXQOE-MRXNPFEDSA-N 1 1 360.414 2.543 20 5 FFBDMO Cc1ccc([C@@H](C)NC(=O)[C@@H]2[NH2+]CCOc3ccccc32)cc1[N+](=O)[O-] ZINC001521402544 1060577114 /nfs/dbraw/zinc/57/71/14/1060577114.db2.gz STWOGSFLDUMBFU-FZKQIMNGSA-N 1 1 355.394 2.804 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001521536975 1060946127 /nfs/dbraw/zinc/94/61/27/1060946127.db2.gz HYXPSAORKYGXII-QGZVFWFLSA-N 1 1 357.385 2.969 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001521536975 1060946151 /nfs/dbraw/zinc/94/61/51/1060946151.db2.gz HYXPSAORKYGXII-QGZVFWFLSA-N 1 1 357.385 2.969 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(Cl)cc1S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C ZINC001475273973 1061030654 /nfs/dbraw/zinc/03/06/54/1061030654.db2.gz PQOCSCLHIPJGKS-LLVKDONJSA-N 1 1 363.867 2.564 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC001460716835 1061075649 /nfs/dbraw/zinc/07/56/49/1061075649.db2.gz IHOHPPHUSHAZPD-GFCCVEGCSA-N 1 1 354.378 2.908 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC001460716835 1061075665 /nfs/dbraw/zinc/07/56/65/1061075665.db2.gz IHOHPPHUSHAZPD-GFCCVEGCSA-N 1 1 354.378 2.908 20 5 FFBDMO CC(C)[N@H+]1CCCN(c2nnc(-c3c[nH]c([N+](=O)[O-])c3)n2CC2CC2)CC1 ZINC001527290925 1061460102 /nfs/dbraw/zinc/46/01/02/1061460102.db2.gz OMKKNNLOAPKSAI-UHFFFAOYSA-N 1 1 373.461 2.512 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3cc(C)cc([N+](=O)[O-])c3)CC2)c1 ZINC001477212719 1061628589 /nfs/dbraw/zinc/62/85/89/1061628589.db2.gz JHDCOSITSIBVJU-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CO1 ZINC001462630637 1061698954 /nfs/dbraw/zinc/69/89/54/1061698954.db2.gz FPSCTQJCVATWNQ-GFCCVEGCSA-N 1 1 357.794 2.889 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)cc1Cl ZINC001462637393 1061700962 /nfs/dbraw/zinc/70/09/62/1061700962.db2.gz UKWIKIBUMBWOLM-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)cc1Cl ZINC001462637393 1061700978 /nfs/dbraw/zinc/70/09/78/1061700978.db2.gz UKWIKIBUMBWOLM-CALCHBBNSA-N 1 1 354.834 2.595 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001528151326 1061776992 /nfs/dbraw/zinc/77/69/92/1061776992.db2.gz AQFKBSTXNSIMIA-CGTJXYLNSA-N 1 1 360.458 2.855 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000775578155 1062135005 /nfs/dbraw/zinc/13/50/05/1062135005.db2.gz SOKCQYPQDYHZMY-LLVKDONJSA-N 1 1 374.353 2.801 20 5 FFBDMO C[C@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[N@H+]1CCCC[C@@H]1C ZINC001441491713 1063445585 /nfs/dbraw/zinc/44/55/85/1063445585.db2.gz HACSXYXWKJUTBJ-VHSXEESVSA-N 1 1 372.828 2.962 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C1 ZINC001467081789 1063632195 /nfs/dbraw/zinc/63/21/95/1063632195.db2.gz MOMABAATODYELX-SNVBAGLBSA-N 1 1 355.826 2.684 20 5 FFBDMO CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001472036070 1064902134 /nfs/dbraw/zinc/90/21/34/1064902134.db2.gz RBLAQVHVJUBQIK-SNVBAGLBSA-N 1 1 372.828 2.772 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001472036070 1064902144 /nfs/dbraw/zinc/90/21/44/1064902144.db2.gz RBLAQVHVJUBQIK-SNVBAGLBSA-N 1 1 372.828 2.772 20 5 FFBDMO C[C@]([NH3+])(C(=O)Nc1cc(C(F)(F)F)ccn1)c1cccc([N+](=O)[O-])c1 ZINC001576085163 1078194026 /nfs/dbraw/zinc/19/40/26/1078194026.db2.gz JDPXTARPXOOFKL-CQSZACIVSA-N 1 1 354.288 2.821 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC4(CC3)C[C@H](O)CCO4)co2)cc1 ZINC001473820766 1065377089 /nfs/dbraw/zinc/37/70/89/1065377089.db2.gz FSASHVKHTGTMNM-QGZVFWFLSA-N 1 1 373.409 2.756 20 5 FFBDMO Cc1ccnc(N)c1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001474685972 1065578440 /nfs/dbraw/zinc/57/84/40/1065578440.db2.gz IGASOTAKZOBIKJ-UHFFFAOYSA-N 1 1 351.204 2.933 20 5 FFBDMO COc1c(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC001579134536 1078573248 /nfs/dbraw/zinc/57/32/48/1078573248.db2.gz FUPVDRAJSGGLEV-MRXNPFEDSA-N 1 1 359.357 2.529 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[NH2+]Cc3ccc(F)cc32)c1 ZINC001579242720 1078598975 /nfs/dbraw/zinc/59/89/75/1078598975.db2.gz ZOQJDFZBPHSAKD-LLVKDONJSA-N 1 1 359.357 2.881 20 5 FFBDMO COc1ccc2[nH]c(NC(=O)[C@@](C)([NH3+])c3cccc([N+](=O)[O-])c3)cc2c1 ZINC001579241813 1078599423 /nfs/dbraw/zinc/59/94/23/1078599423.db2.gz GKCRUMKMNMDDDQ-SFHVURJKSA-N 1 1 354.366 2.897 20 5 FFBDMO C[N@@H+](CCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-])C1CCCC1 ZINC001559100213 1076125502 /nfs/dbraw/zinc/12/55/02/1076125502.db2.gz IAVCWUBIKDWONS-UHFFFAOYSA-N 1 1 359.386 2.759 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(c3c4cc([N+](=O)[O-])ccc4ncc3[N+](=O)[O-])CC[C@H]21 ZINC001559259890 1076140823 /nfs/dbraw/zinc/14/08/23/1076140823.db2.gz PXGCUOFWFBYLTH-IAQYHMDHSA-N 1 1 357.370 2.582 20 5 FFBDMO C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Br)cc1F ZINC001560048275 1076216549 /nfs/dbraw/zinc/21/65/49/1076216549.db2.gz KCEJSFARFNTOPD-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Br)cc1F ZINC001560048275 1076216550 /nfs/dbraw/zinc/21/65/50/1076216550.db2.gz KCEJSFARFNTOPD-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO O=C1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCCCCCN1 ZINC001560057256 1076219194 /nfs/dbraw/zinc/21/91/94/1076219194.db2.gz LTUWSUFJPGRMAX-UHFFFAOYSA-N 1 1 373.413 2.527 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC001560116639 1076230505 /nfs/dbraw/zinc/23/05/05/1076230505.db2.gz FRPZEOZSICESOT-GFCCVEGCSA-N 1 1 351.359 2.668 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC001560736067 1076295035 /nfs/dbraw/zinc/29/50/35/1076295035.db2.gz GAQJCHCNANGZKR-RHSMWYFYSA-N 1 1 371.437 2.919 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC001560736067 1076295037 /nfs/dbraw/zinc/29/50/37/1076295037.db2.gz GAQJCHCNANGZKR-RHSMWYFYSA-N 1 1 371.437 2.919 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1N)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001587795165 1079865780 /nfs/dbraw/zinc/86/57/80/1079865780.db2.gz VVCFUCXBCDCULQ-KRWDZBQOSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCCCNc2c(-c3nn[nH]n3)cccc2[N+](=O)[O-])C1 ZINC001590259597 1081128553 /nfs/dbraw/zinc/12/85/53/1081128553.db2.gz LJFADHBLXFYPRM-ZDUSSCGKSA-N 1 1 359.434 2.699 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H](N4CCCC4)C3)o2)c1 ZINC000104685475 250182766 /nfs/dbraw/zinc/18/27/66/250182766.db2.gz NQZWORHQQOJNPC-QGZVFWFLSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H](N4CCCC4)C3)o2)c1 ZINC000104685475 250182770 /nfs/dbraw/zinc/18/27/70/250182770.db2.gz NQZWORHQQOJNPC-QGZVFWFLSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OC[C@@H]4CCOC4)CC3)nc2c1 ZINC000131673855 251008956 /nfs/dbraw/zinc/00/89/56/251008956.db2.gz BMTHOZJFMSPINF-CYBMUJFWSA-N 1 1 361.398 2.754 20 5 FFBDMO COC(=O)c1cc(N2CCN(c3cc(C)cc[nH+]3)CC2)cc(C)c1[N+](=O)[O-] ZINC000152999591 251090787 /nfs/dbraw/zinc/09/07/87/251090787.db2.gz OTQIQFKYIJVNOJ-UHFFFAOYSA-N 1 1 370.409 2.720 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCSC3(CCOCC3)C2)cc1 ZINC000186836613 251273155 /nfs/dbraw/zinc/27/31/55/251273155.db2.gz KRJQTMFJEZDHMU-UHFFFAOYSA-N 1 1 352.456 2.962 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398033 251345737 /nfs/dbraw/zinc/34/57/37/251345737.db2.gz FHHSJYSHPAQTLG-UONOGXRCSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398033 251345741 /nfs/dbraw/zinc/34/57/41/251345741.db2.gz FHHSJYSHPAQTLG-UONOGXRCSA-N 1 1 357.414 2.833 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])cc2)C1 ZINC000270726924 251615022 /nfs/dbraw/zinc/61/50/22/251615022.db2.gz BKVKIVYQZLPGTO-CYBMUJFWSA-N 1 1 357.414 2.813 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272422522 252034424 /nfs/dbraw/zinc/03/44/24/252034424.db2.gz XSCRXAHGLQKULX-UHFFFAOYSA-N 1 1 352.341 2.788 20 5 FFBDMO Cc1cnccc1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000272510277 252055777 /nfs/dbraw/zinc/05/57/77/252055777.db2.gz ITRZCMHPXOVAAG-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO C[C@@H]1C[C@@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1 ZINC000272568327 252069859 /nfs/dbraw/zinc/06/98/59/252069859.db2.gz VJARECJRWDPNJW-SIIHOXLZSA-N 1 1 355.442 2.633 20 5 FFBDMO C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1 ZINC000273025628 252195316 /nfs/dbraw/zinc/19/53/16/252195316.db2.gz UJSJKOUAVUMRLI-CQSZACIVSA-N 1 1 358.442 2.575 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000278399524 256308306 /nfs/dbraw/zinc/30/83/06/256308306.db2.gz QXYQNXZWIATQDV-UHFFFAOYSA-N 1 1 371.393 2.990 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279068072 256377576 /nfs/dbraw/zinc/37/75/76/256377576.db2.gz AFDVCQPSQOVAFL-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000279068072 256377578 /nfs/dbraw/zinc/37/75/78/256377578.db2.gz AFDVCQPSQOVAFL-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO COC(=O)c1cc(C)nc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000286128373 257021715 /nfs/dbraw/zinc/02/17/15/257021715.db2.gz HEGXLIJKCVKZAG-CJNGLKHVSA-N 1 1 374.441 2.538 20 5 FFBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000286377257 257034129 /nfs/dbraw/zinc/03/41/29/257034129.db2.gz IFRJUFMMXBJZSK-CQSZACIVSA-N 1 1 373.413 2.526 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288735461 257222345 /nfs/dbraw/zinc/22/23/45/257222345.db2.gz FIIVCZQHMGBQJV-RCBQFDQVSA-N 1 1 365.430 2.616 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000288735461 257222347 /nfs/dbraw/zinc/22/23/47/257222347.db2.gz FIIVCZQHMGBQJV-RCBQFDQVSA-N 1 1 365.430 2.616 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H](C)C1 ZINC000289387343 257278103 /nfs/dbraw/zinc/27/81/03/257278103.db2.gz OXIBOPVNCOAJOQ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)[C@@H](C)C1 ZINC000289387343 257278104 /nfs/dbraw/zinc/27/81/04/257278104.db2.gz OXIBOPVNCOAJOQ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(-c2nc([C@H]3C[N@H+]4CCC[C@@H]4CO3)no2)c1 ZINC000289969624 257309098 /nfs/dbraw/zinc/30/90/98/257309098.db2.gz ZZAMAFLBWWOUBQ-IAQYHMDHSA-N 1 1 360.370 2.579 20 5 FFBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@@H]1[C@H]1CCCO1 ZINC000289969465 257309273 /nfs/dbraw/zinc/30/92/73/257309273.db2.gz XELNISAFCGOFOM-NVXWUHKLSA-N 1 1 365.405 2.952 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCC[C@@H]1CO ZINC000289579742 257288253 /nfs/dbraw/zinc/28/82/53/257288253.db2.gz INOSPYIGTCHVQQ-QGZVFWFLSA-N 1 1 373.457 2.688 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000291247138 257393596 /nfs/dbraw/zinc/39/35/96/257393596.db2.gz LPOKMWWBBGNKND-SFHVURJKSA-N 1 1 357.366 2.639 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)C12CCCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000292747213 257514453 /nfs/dbraw/zinc/51/44/53/257514453.db2.gz NOTKRUCOAIOBRD-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)C12CCCC2)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000292747213 257514454 /nfs/dbraw/zinc/51/44/54/257514454.db2.gz NOTKRUCOAIOBRD-AWEZNQCLSA-N 1 1 353.806 2.566 20 5 FFBDMO C[NH+](C)CCC1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)CC1 ZINC000294866019 257605996 /nfs/dbraw/zinc/60/59/96/257605996.db2.gz BJYXLHPSXAYTTE-UHFFFAOYSA-N 1 1 371.441 2.789 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCC[N@@H+](C)CCN(C)C ZINC000297466492 257835767 /nfs/dbraw/zinc/83/57/67/257835767.db2.gz QSKHYLRDCZAZJE-UHFFFAOYSA-N 1 1 365.478 2.504 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCN(C)CC[NH+](C)C ZINC000297466492 257835768 /nfs/dbraw/zinc/83/57/68/257835768.db2.gz QSKHYLRDCZAZJE-UHFFFAOYSA-N 1 1 365.478 2.504 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ccc(Br)cc1[N+](=O)[O-] ZINC000301160059 258029793 /nfs/dbraw/zinc/02/97/93/258029793.db2.gz OWJLRWZUJCSCLN-LBPRGKRZSA-N 1 1 358.236 2.880 20 5 FFBDMO Cc1ccnc(NCc2ccc(C[NH+]3CCN(C)CC3)cc2)c1[N+](=O)[O-] ZINC000301309251 258041785 /nfs/dbraw/zinc/04/17/85/258041785.db2.gz XISUWKOFKANIQG-UHFFFAOYSA-N 1 1 355.442 2.658 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1N(C)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000302481393 258103246 /nfs/dbraw/zinc/10/32/46/258103246.db2.gz WMKNQOGKNCMUMZ-HXUWFJFHSA-N 1 1 355.438 2.976 20 5 FFBDMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665259 258107452 /nfs/dbraw/zinc/10/74/52/258107452.db2.gz PWNCDVJNGNVZRJ-MJBXVCDLSA-N 1 1 369.487 2.777 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302665259 258107453 /nfs/dbraw/zinc/10/74/53/258107453.db2.gz PWNCDVJNGNVZRJ-MJBXVCDLSA-N 1 1 369.487 2.777 20 5 FFBDMO COC1CC[NH+](CCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000301507813 258053020 /nfs/dbraw/zinc/05/30/20/258053020.db2.gz AHTDTRBJOCKOBW-UHFFFAOYSA-N 1 1 358.236 2.880 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](CCNc1ccc([N+](=O)[O-])c(C)n1)CC2 ZINC000301673530 258062042 /nfs/dbraw/zinc/06/20/42/258062042.db2.gz ZYBIHCNGTHZKOO-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](CCNc1ccc([N+](=O)[O-])c(C)n1)CC2 ZINC000301673530 258062043 /nfs/dbraw/zinc/06/20/43/258062043.db2.gz ZYBIHCNGTHZKOO-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NCCc3[nH+]ccn3Cc3ccccc3)nn21 ZINC000301920677 258075486 /nfs/dbraw/zinc/07/54/86/258075486.db2.gz KOHVPBJPNXWOPR-UHFFFAOYSA-N 1 1 363.381 2.537 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1Cc1ccccc1 ZINC000301975103 258079235 /nfs/dbraw/zinc/07/92/35/258079235.db2.gz VRNZXIZBMRZTPX-UKRRQHHQSA-N 1 1 352.398 2.712 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc2ncc([N+](=O)[O-])n2n1 ZINC000302012228 258081519 /nfs/dbraw/zinc/08/15/19/258081519.db2.gz WUYJVVKFCZPNTM-INIZCTEOSA-N 1 1 366.425 2.596 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(Cc3csc([N+](=O)[O-])c3)CC2)C[C@H](C)O1 ZINC000330427432 258163801 /nfs/dbraw/zinc/16/38/01/258163801.db2.gz KLCXZVCISANDLQ-OKILXGFUSA-N 1 1 353.488 2.978 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000330783052 258170448 /nfs/dbraw/zinc/17/04/48/258170448.db2.gz HRWUWZBYUGSXLM-ZYHUDNBSSA-N 1 1 357.357 2.751 20 5 FFBDMO Cc1c(CNC(=O)[C@H](C(C)C)[NH+]2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000331121797 258177715 /nfs/dbraw/zinc/17/77/15/258177715.db2.gz NDCWZDUMALLZAT-DEYYWGMASA-N 1 1 363.458 2.653 20 5 FFBDMO CC1CC[NH+](C[C@H]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)CC1 ZINC000331393984 258184537 /nfs/dbraw/zinc/18/45/37/258184537.db2.gz BJMQXZWZVBICJK-OAHLLOKOSA-N 1 1 361.442 2.885 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC000332117495 258214580 /nfs/dbraw/zinc/21/45/80/258214580.db2.gz HVEGDVCXORUCLB-BBWFWOEESA-N 1 1 374.485 2.895 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402834 258229178 /nfs/dbraw/zinc/22/91/78/258229178.db2.gz VBBGYJYVYLCBIO-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3C[C@@H](C)[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])CC1 ZINC000332402834 258229179 /nfs/dbraw/zinc/22/91/79/258229179.db2.gz VBBGYJYVYLCBIO-CVEARBPZSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@H]1C[N@H+]2CCCC[C@H]2CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000332465400 258231493 /nfs/dbraw/zinc/23/14/93/258231493.db2.gz ISJOMPUJCRECGY-JSGCOSHPSA-N 1 1 366.849 2.745 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000373056024 512150903 /nfs/dbraw/zinc/15/09/03/512150903.db2.gz GWYWOGMHZXHPEM-JTQLQIEISA-N 1 1 366.219 2.870 20 5 FFBDMO CCc1n[nH]c(C(=O)N2CC[N@@H+](Cc3ccccc3)CC[C@@H]2C)c1[N+](=O)[O-] ZINC000373068273 512155882 /nfs/dbraw/zinc/15/58/82/512155882.db2.gz FEGRBZVMEYUVQO-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CC[N@H+](Cc3ccccc3)CC[C@@H]2C)c1[N+](=O)[O-] ZINC000373068273 512155886 /nfs/dbraw/zinc/15/58/86/512155886.db2.gz FEGRBZVMEYUVQO-AWEZNQCLSA-N 1 1 371.441 2.617 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000174523586 510158287 /nfs/dbraw/zinc/15/82/87/510158287.db2.gz XSIVNGODARBHHZ-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000064995480 506247861 /nfs/dbraw/zinc/24/78/61/506247861.db2.gz SKXQGIPMWDDVTL-CVEARBPZSA-N 1 1 363.458 2.990 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000032428485 506251737 /nfs/dbraw/zinc/25/17/37/506251737.db2.gz RDHSQPXHLYWKDM-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO CNc1ccc(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000032428485 506251743 /nfs/dbraw/zinc/25/17/43/506251743.db2.gz RDHSQPXHLYWKDM-GFCCVEGCSA-N 1 1 374.466 2.875 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)c(Cl)c1 ZINC000369089801 512223062 /nfs/dbraw/zinc/22/30/62/512223062.db2.gz BKZBSIKKGKOWDF-OAHLLOKOSA-N 1 1 350.806 2.917 20 5 FFBDMO Cc1n[nH]cc1C1CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000375349944 512280761 /nfs/dbraw/zinc/28/07/61/512280761.db2.gz RFRLKMATSSEKFM-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000054776328 506617805 /nfs/dbraw/zinc/61/78/05/506617805.db2.gz UOXPNJMIYGIYJX-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000008124227 506623821 /nfs/dbraw/zinc/62/38/21/506623821.db2.gz JCNNPQMPMBITFI-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO COC(=O)[C@H]1CCC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000066834574 506656261 /nfs/dbraw/zinc/65/62/61/506656261.db2.gz HKNKYNWBEQBXBS-YPMHNXCESA-N 1 1 360.370 2.591 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000066834574 506656266 /nfs/dbraw/zinc/65/62/66/506656266.db2.gz HKNKYNWBEQBXBS-YPMHNXCESA-N 1 1 360.370 2.591 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000055023020 506660320 /nfs/dbraw/zinc/66/03/20/506660320.db2.gz KLFCOGMIDGHQPW-UHFFFAOYSA-N 1 1 361.373 2.856 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000055023020 506660325 /nfs/dbraw/zinc/66/03/25/506660325.db2.gz KLFCOGMIDGHQPW-UHFFFAOYSA-N 1 1 361.373 2.856 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043147308 506709118 /nfs/dbraw/zinc/70/91/18/506709118.db2.gz RCHCGGHGEPEBAE-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc(NC(=O)NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000043147308 506709120 /nfs/dbraw/zinc/70/91/20/506709120.db2.gz RCHCGGHGEPEBAE-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000043149516 506709255 /nfs/dbraw/zinc/70/92/55/506709255.db2.gz PLUROWDBGPXVNL-ZIAGYGMSSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1nn(C)cc1[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000367050037 512314586 /nfs/dbraw/zinc/31/45/86/512314586.db2.gz LMJQVZIUMHCSJR-MRXNPFEDSA-N 1 1 357.414 2.802 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000067922871 507053843 /nfs/dbraw/zinc/05/38/43/507053843.db2.gz XEFMULXKWXHXTE-MRXNPFEDSA-N 1 1 363.458 2.917 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCc2cccs2)CC1 ZINC000056740785 507081623 /nfs/dbraw/zinc/08/16/23/507081623.db2.gz ARTOKSRHWZFEKD-UHFFFAOYSA-N 1 1 374.466 2.726 20 5 FFBDMO C[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[N@H+]1CCC[C@H](C)C1 ZINC000068203010 507147337 /nfs/dbraw/zinc/14/73/37/507147337.db2.gz SHXOTTZEGUEUEF-GJZGRUSLSA-N 1 1 358.442 2.786 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835982 507205626 /nfs/dbraw/zinc/20/56/26/507205626.db2.gz CCKCFCBLMDYVTQ-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO CCOc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000046835982 507205630 /nfs/dbraw/zinc/20/56/30/507205630.db2.gz CCKCFCBLMDYVTQ-MRXNPFEDSA-N 1 1 360.410 2.865 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)[NH+](C)C ZINC000023713804 507367311 /nfs/dbraw/zinc/36/73/11/507367311.db2.gz QSWSFPFSDLKWAQ-QGZVFWFLSA-N 1 1 357.410 2.565 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000069035390 507386225 /nfs/dbraw/zinc/38/62/25/507386225.db2.gz SKKFCLXXZLMTQP-HNNXBMFYSA-N 1 1 371.441 2.631 20 5 FFBDMO CNc1ccc(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000025631977 507516665 /nfs/dbraw/zinc/51/66/65/507516665.db2.gz CYDBIUVONSJBPL-AWEZNQCLSA-N 1 1 368.437 2.813 20 5 FFBDMO COc1cccc(C[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000027347528 507649246 /nfs/dbraw/zinc/64/92/46/507649246.db2.gz VCKRNIMASLWFSA-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO COc1cccc(C[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000027347528 507649251 /nfs/dbraw/zinc/64/92/51/507649251.db2.gz VCKRNIMASLWFSA-UHFFFAOYSA-N 1 1 355.394 2.625 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000050025576 507652308 /nfs/dbraw/zinc/65/23/08/507652308.db2.gz XRLFZMZFYRHJDP-LJQANCHMSA-N 1 1 368.437 2.788 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000051469039 507771773 /nfs/dbraw/zinc/77/17/73/507771773.db2.gz PEPSUCAPSJYGHO-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@]2([NH+]3CCOCC3)CCSC2)c2ccncc21 ZINC000029625929 507784960 /nfs/dbraw/zinc/78/49/60/507784960.db2.gz CPPXPTSPHIMLOG-GOSISDBHSA-N 1 1 374.466 2.763 20 5 FFBDMO C[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000089306327 507828572 /nfs/dbraw/zinc/82/85/72/507828572.db2.gz SYBSBHIGMLBCQA-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO C[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000089306327 507828575 /nfs/dbraw/zinc/82/85/75/507828575.db2.gz SYBSBHIGMLBCQA-HNNXBMFYSA-N 1 1 353.422 2.700 20 5 FFBDMO CC[NH+](CC)C[C@@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000072823348 507858099 /nfs/dbraw/zinc/85/80/99/507858099.db2.gz OGKRAVCVCIMUAU-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089888566 507879002 /nfs/dbraw/zinc/87/90/02/507879002.db2.gz YOOAQRYYRQABIS-AWEZNQCLSA-N 1 1 358.398 2.598 20 5 FFBDMO CC(=O)NC[C@@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089888566 507879005 /nfs/dbraw/zinc/87/90/05/507879005.db2.gz YOOAQRYYRQABIS-AWEZNQCLSA-N 1 1 358.398 2.598 20 5 FFBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCC(CO)CC1 ZINC000089924597 507884448 /nfs/dbraw/zinc/88/44/48/507884448.db2.gz LNJMSNPSUQCAPJ-UHFFFAOYSA-N 1 1 355.822 2.670 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000089925250 507884847 /nfs/dbraw/zinc/88/48/47/507884847.db2.gz NLAKHGLFUDBUTG-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCCC[C@@H]2C[NH+]2CCOCC2)c2ccncc21 ZINC000078619312 507890149 /nfs/dbraw/zinc/89/01/49/507890149.db2.gz SCEOKEOTXVFHAT-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000090093189 507908451 /nfs/dbraw/zinc/90/84/51/507908451.db2.gz ZTGGWEIIJMACRE-UHFFFAOYSA-N 1 1 370.453 2.940 20 5 FFBDMO CC(C)[NH+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000079777864 508000501 /nfs/dbraw/zinc/00/05/01/508000501.db2.gz VMPYZUANZCFUQB-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO Cn1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092043074 508037064 /nfs/dbraw/zinc/03/70/64/508037064.db2.gz XPECEGDJMIGYJN-VQIMIIECSA-N 1 1 369.469 2.911 20 5 FFBDMO CC[C@H](c1ccncc1)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000092224519 508052533 /nfs/dbraw/zinc/05/25/33/508052533.db2.gz NVIOTNRVTYZPLA-QGZVFWFLSA-N 1 1 354.410 2.962 20 5 FFBDMO CC[C@H](c1ccncc1)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000092224519 508052535 /nfs/dbraw/zinc/05/25/35/508052535.db2.gz NVIOTNRVTYZPLA-QGZVFWFLSA-N 1 1 354.410 2.962 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000080374829 508068746 /nfs/dbraw/zinc/06/87/46/508068746.db2.gz YUVZLZMTLKBIKN-UHFFFAOYSA-N 1 1 371.441 2.910 20 5 FFBDMO COc1ccc(C[N@@H+](CCO)CCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000111322541 508090231 /nfs/dbraw/zinc/09/02/31/508090231.db2.gz CPZMKYJPTFVLEK-UHFFFAOYSA-N 1 1 360.410 2.649 20 5 FFBDMO CN(C(=O)[C@@H]1C[N@H+](C(C)(C)C)C[C@H]1C(F)(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000410803957 512378855 /nfs/dbraw/zinc/37/88/55/512378855.db2.gz BRNWEKKSCCWYFZ-VXGBXAGGSA-N 1 1 374.363 2.861 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000080960259 508118035 /nfs/dbraw/zinc/11/80/35/508118035.db2.gz KMNMWNZZBNVSGB-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO COc1cc(C(=O)N2CC[C@H]([N@@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000081124425 508140361 /nfs/dbraw/zinc/14/03/61/508140361.db2.gz PTBCXXATMIGGGL-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2cc(Br)cc([N+](=O)[O-])c2)cc[nH+]1 ZINC000112496152 508190329 /nfs/dbraw/zinc/19/03/29/508190329.db2.gz QQRXYNHOGJDOQS-UHFFFAOYSA-N 1 1 372.200 2.862 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000076494728 508214099 /nfs/dbraw/zinc/21/40/99/508214099.db2.gz BBLUETVNVYODQD-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000076494728 508214103 /nfs/dbraw/zinc/21/41/03/508214103.db2.gz BBLUETVNVYODQD-MRXNPFEDSA-N 1 1 353.422 2.870 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)/C=C/c2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000083043588 508234772 /nfs/dbraw/zinc/23/47/72/508234772.db2.gz MKCLJIMBECHRSI-WTBPUQPLSA-N 1 1 361.442 2.614 20 5 FFBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])c(N)n3)cc2)C1 ZINC000076750667 508250907 /nfs/dbraw/zinc/25/09/07/508250907.db2.gz XXHSBDXOLBNEGY-CYBMUJFWSA-N 1 1 356.430 2.811 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@@H+](Cc2ccccc2)C[C@H](O)c2ccco2)c1 ZINC000084135370 508266762 /nfs/dbraw/zinc/26/67/62/508266762.db2.gz OMXZSIPASAAJBS-KRWDZBQOSA-N 1 1 356.382 2.620 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H](C)O1 ZINC000085457041 508309914 /nfs/dbraw/zinc/30/99/14/508309914.db2.gz UEJPLLPHWAYBDS-OKILXGFUSA-N 1 1 374.441 2.695 20 5 FFBDMO C[C@@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCCC[C@H]1C ZINC000087037216 508333726 /nfs/dbraw/zinc/33/37/26/508333726.db2.gz FAHIPHXKPPWZOB-CABCVRRESA-N 1 1 360.458 2.925 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+][C@H]3CCN(C(C)C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000114774767 508345967 /nfs/dbraw/zinc/34/59/67/508345967.db2.gz QCPJBMJUVKPIDX-INIZCTEOSA-N 1 1 373.409 2.962 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156413477 508417212 /nfs/dbraw/zinc/41/72/12/508417212.db2.gz XTBUISOICGAPIQ-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000156413477 508417215 /nfs/dbraw/zinc/41/72/15/508417215.db2.gz XTBUISOICGAPIQ-KEYYUXOJSA-N 1 1 357.414 2.701 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000127403545 508445524 /nfs/dbraw/zinc/44/55/24/508445524.db2.gz UMINFJOXXGJHLY-UHFFFAOYSA-N 1 1 368.437 2.985 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC000134134900 508497923 /nfs/dbraw/zinc/49/79/23/508497923.db2.gz VDDQBDAWTZFCLV-OAHLLOKOSA-N 1 1 360.458 2.640 20 5 FFBDMO Cc1ccc(S(=O)(=O)C[C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000152732542 508504660 /nfs/dbraw/zinc/50/46/60/508504660.db2.gz UWQFAWAXWXDFOY-GFCCVEGCSA-N 1 1 354.453 2.917 20 5 FFBDMO C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)(F)F ZINC000127886021 508516419 /nfs/dbraw/zinc/51/64/19/508516419.db2.gz TUUAGYFVBYQDHO-ZDUSSCGKSA-N 1 1 361.364 2.932 20 5 FFBDMO C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CC(F)(F)F ZINC000127886021 508516424 /nfs/dbraw/zinc/51/64/24/508516424.db2.gz TUUAGYFVBYQDHO-ZDUSSCGKSA-N 1 1 361.364 2.932 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000157119846 508525697 /nfs/dbraw/zinc/52/56/97/508525697.db2.gz LRPCHFGOGCROIL-QAPCUYQASA-N 1 1 360.458 2.730 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)Nc1ccc2c(c1)OCO2 ZINC000153063337 508544243 /nfs/dbraw/zinc/54/42/43/508544243.db2.gz DGPHHXKECHPEOO-UHFFFAOYSA-N 1 1 369.377 2.710 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116746449 508554084 /nfs/dbraw/zinc/55/40/84/508554084.db2.gz ZXVMXQUTOHFZBK-GFCCVEGCSA-N 1 1 357.838 2.864 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841527 508683382 /nfs/dbraw/zinc/68/33/82/508683382.db2.gz PVZGBFMRTKXPRU-ZIAGYGMSSA-N 1 1 359.430 2.979 20 5 FFBDMO Cn1cc([C@H](O)C[C@@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000371454787 512411348 /nfs/dbraw/zinc/41/13/48/512411348.db2.gz BDYRCVCGEJAXLU-PKOBYXMFSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000119106161 508727325 /nfs/dbraw/zinc/72/73/25/508727325.db2.gz VZXKUNSUMFBUGB-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](CN2CCOCC2)C1 ZINC000119106161 508727327 /nfs/dbraw/zinc/72/73/27/508727327.db2.gz VZXKUNSUMFBUGB-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)Nc1c[nH+]ccc1-n1cc(C)cn1 ZINC000123765758 508736106 /nfs/dbraw/zinc/73/61/06/508736106.db2.gz VGWJAEQFSSUTAS-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000119387371 508786096 /nfs/dbraw/zinc/78/60/96/508786096.db2.gz MHXNIKNIZXSJBL-CYBMUJFWSA-N 1 1 373.409 2.811 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1)[NH+](C)C ZINC000159085687 508790623 /nfs/dbraw/zinc/79/06/23/508790623.db2.gz MMDXOFCPGQHIEI-MRXNPFEDSA-N 1 1 373.409 2.645 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F ZINC000119701523 508846706 /nfs/dbraw/zinc/84/67/06/508846706.db2.gz OBVFGPVNMNDHLX-UGSOOPFHSA-N 1 1 357.385 2.984 20 5 FFBDMO Cc1nccn1CCC[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000130854013 508856439 /nfs/dbraw/zinc/85/64/39/508856439.db2.gz KTCAFIFHZBTVIR-UHFFFAOYSA-N 1 1 359.430 2.759 20 5 FFBDMO C[C@@]1(CNC(=O)c2c(N)cccc2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1 ZINC000154829839 508864759 /nfs/dbraw/zinc/86/47/59/508864759.db2.gz UEVCYVVGOYZDLU-FQEVSTJZSA-N 1 1 368.437 2.962 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000124701246 508871464 /nfs/dbraw/zinc/87/14/64/508871464.db2.gz MQYHVYIEADFQKS-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)sc2C1 ZINC000124701246 508871467 /nfs/dbraw/zinc/87/14/67/508871467.db2.gz MQYHVYIEADFQKS-UHFFFAOYSA-N 1 1 364.402 2.750 20 5 FFBDMO CC(C)[N@H+](CCc1nccs1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000159795607 508891787 /nfs/dbraw/zinc/89/17/87/508891787.db2.gz DSFCANFCJHWHOK-UHFFFAOYSA-N 1 1 362.455 2.967 20 5 FFBDMO CC(C)[N@@H+](CCc1nccs1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000159795607 508891792 /nfs/dbraw/zinc/89/17/92/508891792.db2.gz DSFCANFCJHWHOK-UHFFFAOYSA-N 1 1 362.455 2.967 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1C[C@@H](C)O ZINC000119959357 508897833 /nfs/dbraw/zinc/89/78/33/508897833.db2.gz KWSVXHNLLKJAKJ-CABCVRRESA-N 1 1 364.446 2.521 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C2 ZINC000131389888 508924931 /nfs/dbraw/zinc/92/49/31/508924931.db2.gz NSHCXTSNLVRQLG-QWHCGFSZSA-N 1 1 357.332 2.922 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155449575 509003658 /nfs/dbraw/zinc/00/36/58/509003658.db2.gz SDOWGENASWGSCC-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155449575 509003662 /nfs/dbraw/zinc/00/36/62/509003662.db2.gz SDOWGENASWGSCC-ABAIWWIYSA-N 1 1 353.806 2.688 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000151516118 509034582 /nfs/dbraw/zinc/03/45/82/509034582.db2.gz XKJMIWFHBAWFNF-UHFFFAOYSA-N 1 1 355.398 2.961 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000120657883 509040009 /nfs/dbraw/zinc/04/00/09/509040009.db2.gz FSVCBBZGPPYXPH-KRWDZBQOSA-N 1 1 360.458 2.701 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120734179 509054554 /nfs/dbraw/zinc/05/45/54/509054554.db2.gz WIABWWZCEXOVNE-CQSZACIVSA-N 1 1 358.442 2.753 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCOCC1 ZINC000155729737 509060381 /nfs/dbraw/zinc/06/03/81/509060381.db2.gz OQVWQTWUOAVYNA-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000371497891 512434890 /nfs/dbraw/zinc/43/48/90/512434890.db2.gz SDODSVYUOXLPGD-LBPRGKRZSA-N 1 1 355.341 2.507 20 5 FFBDMO CC(C)C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCCc2cccnc21 ZINC000126854063 509138465 /nfs/dbraw/zinc/13/84/65/509138465.db2.gz WAMBOEGQVRLGSA-QZTJIDSGSA-N 1 1 373.457 2.583 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](c2nncn2C2CC2)C1 ZINC000156197335 509143315 /nfs/dbraw/zinc/14/33/15/509143315.db2.gz NLLUOUYLPCAUPZ-AWEZNQCLSA-N 1 1 357.414 2.780 20 5 FFBDMO COc1cc(C[NH+]2CCC(O)CC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000162254715 509182737 /nfs/dbraw/zinc/18/27/37/509182737.db2.gz LVMBGBIOMYFBEK-UHFFFAOYSA-N 1 1 364.320 2.501 20 5 FFBDMO C[C@@H](c1ccsc1)[NH+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000185497507 509207355 /nfs/dbraw/zinc/20/73/55/509207355.db2.gz MGKGLZGKJKENPA-ZDUSSCGKSA-N 1 1 374.466 2.634 20 5 FFBDMO Cc1cc(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)cc([N+](=O)[O-])c1 ZINC000172749117 509210714 /nfs/dbraw/zinc/21/07/14/509210714.db2.gz PTXCCJZNLCTUJR-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248055183 509226447 /nfs/dbraw/zinc/22/64/47/509226447.db2.gz OHISILKNUUWCOI-PKOBYXMFSA-N 1 1 355.394 2.535 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nc(-c4cccc([N+](=O)[O-])c4)no3)CC[C@H]21 ZINC000248163836 509251063 /nfs/dbraw/zinc/25/10/63/509251063.db2.gz SPPLINHUNNJSBU-GOEBONIOSA-N 1 1 357.414 2.561 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)[C@H](C)C1 ZINC000191987337 509280312 /nfs/dbraw/zinc/28/03/12/509280312.db2.gz LYCWYXDUBRLMPV-CABCVRRESA-N 1 1 369.487 2.562 20 5 FFBDMO CC[N@@H+](CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000182626318 509340619 /nfs/dbraw/zinc/34/06/19/509340619.db2.gz HKIVKCOWIUHWCP-UHFFFAOYSA-N 1 1 357.863 2.941 20 5 FFBDMO C[C@@H](NCC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000185766473 509346300 /nfs/dbraw/zinc/34/63/00/509346300.db2.gz QYARXUCIYQMNAB-CVEARBPZSA-N 1 1 374.485 2.800 20 5 FFBDMO CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000179419101 509433517 /nfs/dbraw/zinc/43/35/17/509433517.db2.gz KZHDDAHWWHYJKJ-KRWDZBQOSA-N 1 1 363.461 2.917 20 5 FFBDMO C[C@@H]1C[C@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000267428320 509475896 /nfs/dbraw/zinc/47/58/96/509475896.db2.gz CCYFAPWRIXRXOA-ZYHUDNBSSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Nc1ccncc1[N+](=O)[O-] ZINC000248907112 509538762 /nfs/dbraw/zinc/53/87/62/509538762.db2.gz UXUJMHVITOZJOA-XJKSGUPXSA-N 1 1 355.398 2.632 20 5 FFBDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000192650891 509582520 /nfs/dbraw/zinc/58/25/20/509582520.db2.gz HBSRGPPIRKXNGE-NSHDSACASA-N 1 1 359.382 2.562 20 5 FFBDMO COc1cc(C[NH+]2CCC([C@H](C)O)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180058490 509730122 /nfs/dbraw/zinc/73/01/22/509730122.db2.gz LRICMYLHJTXMAR-NSHDSACASA-N 1 1 374.384 2.840 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000180139818 509773130 /nfs/dbraw/zinc/77/31/30/509773130.db2.gz AXLFVZDXEIDHHF-BEFAXECRSA-N 1 1 355.394 2.535 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000249903474 509778736 /nfs/dbraw/zinc/77/87/36/509778736.db2.gz UFZISRMOIQPULF-SJLPKXTDSA-N 1 1 372.421 2.833 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCc2ccccc2[C@H]1CO ZINC000268148579 509782174 /nfs/dbraw/zinc/78/21/74/509782174.db2.gz RCDNBDRGJCQDNL-LJQANCHMSA-N 1 1 369.421 2.824 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180241963 509829141 /nfs/dbraw/zinc/82/91/41/509829141.db2.gz RFOLQGDYBHZUEL-NSHDSACASA-N 1 1 360.357 2.716 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000186691410 509855551 /nfs/dbraw/zinc/85/55/51/509855551.db2.gz GPQZKRDPGASXKE-ZDUSSCGKSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000252735504 509859715 /nfs/dbraw/zinc/85/97/15/509859715.db2.gz MYSUNKDAEPTKJL-UONOGXRCSA-N 1 1 356.426 2.993 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C(C)(C)C)n1 ZINC000180345060 509878135 /nfs/dbraw/zinc/87/81/35/509878135.db2.gz HJLHQSCJPGMCRJ-AWEZNQCLSA-N 1 1 358.446 2.707 20 5 FFBDMO COc1cc[nH+]c(N2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000255474677 509925364 /nfs/dbraw/zinc/92/53/64/509925364.db2.gz MEZGZCQXSBCJCK-XQRVVYSFSA-N 1 1 354.410 2.834 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCCOC1 ZINC000174142373 509967500 /nfs/dbraw/zinc/96/75/00/509967500.db2.gz YZLQZYWBUYMXHB-NEPJUHHUSA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@@H]1CCCOC1 ZINC000174150276 509970608 /nfs/dbraw/zinc/97/06/08/509970608.db2.gz APCCRGCVCAKUSD-RYUDHWBXSA-N 1 1 355.822 2.934 20 5 FFBDMO COc1cc(C[NH+]2CCC(C)(CO)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000186955952 509971122 /nfs/dbraw/zinc/97/11/22/509971122.db2.gz WTLTWGUHTZWCAL-UHFFFAOYSA-N 1 1 360.357 2.799 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177290269 509980721 /nfs/dbraw/zinc/98/07/21/509980721.db2.gz SCUYMGZERTZINW-NSHDSACASA-N 1 1 370.247 2.771 20 5 FFBDMO C[C@@H](C(=O)NC1CCCC1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174242723 510020812 /nfs/dbraw/zinc/02/08/12/510020812.db2.gz MYCGSEKWZKGKKU-AWEZNQCLSA-N 1 1 361.442 2.885 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000265443712 510056943 /nfs/dbraw/zinc/05/69/43/510056943.db2.gz AGUFLYAOXWNGMB-STQMWFEESA-N 1 1 368.865 2.849 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)Nc1ccncc1[N+](=O)[O-] ZINC000193874821 510109995 /nfs/dbraw/zinc/10/99/95/510109995.db2.gz NVGZTFVBZWGRBW-HNNXBMFYSA-N 1 1 355.398 2.633 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCSC[C@@H](C)C1 ZINC000190415564 510117736 /nfs/dbraw/zinc/11/77/36/510117736.db2.gz SAIYHWDWRQGPRL-RYUDHWBXSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000190415564 510117744 /nfs/dbraw/zinc/11/77/44/510117744.db2.gz SAIYHWDWRQGPRL-RYUDHWBXSA-N 1 1 353.444 2.615 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc(C)cc([N+](=O)[O-])c1 ZINC000261942550 510123775 /nfs/dbraw/zinc/12/37/75/510123775.db2.gz KRRLTYBWWJDJBX-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)cc1F ZINC000193925389 510130577 /nfs/dbraw/zinc/13/05/77/510130577.db2.gz ZNHKZYUJGWLUOE-UHFFFAOYSA-N 1 1 369.356 2.861 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c([N+](=O)[O-])cc1F ZINC000184233283 510208386 /nfs/dbraw/zinc/20/83/86/510208386.db2.gz KBJKCBZGVVEIHW-HNNXBMFYSA-N 1 1 368.405 2.903 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2c2ncc([N+](=O)[O-])cc2Br)C1 ZINC000269091042 510231251 /nfs/dbraw/zinc/23/12/51/510231251.db2.gz LAHYQIPGLPIXIU-MFKMUULPSA-N 1 1 355.236 2.673 20 5 FFBDMO CC(C)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000265820445 510247004 /nfs/dbraw/zinc/24/70/04/510247004.db2.gz RBWGMDVTKONANO-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)NCc1ccccc1[N+](=O)[O-] ZINC000181284332 510338600 /nfs/dbraw/zinc/33/86/00/510338600.db2.gz FRGCPOPAQUYIFF-OAHLLOKOSA-N 1 1 356.426 2.915 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N2CCC[N@@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000269405255 510388730 /nfs/dbraw/zinc/38/87/30/510388730.db2.gz UKOAQEPVBOICOK-UHFFFAOYSA-N 1 1 371.441 2.789 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000269496523 510435003 /nfs/dbraw/zinc/43/50/03/510435003.db2.gz KISFEUAFEIVELK-FUHWJXTLSA-N 1 1 372.469 2.796 20 5 FFBDMO COc1cc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])c1OC ZINC000266168454 510443520 /nfs/dbraw/zinc/44/35/20/510443520.db2.gz QERWCIHNWHUXKG-CQSZACIVSA-N 1 1 365.430 2.558 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000175125654 510494375 /nfs/dbraw/zinc/49/43/75/510494375.db2.gz GHFJFBRPSCZLOU-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO C[N@@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000181611273 510500248 /nfs/dbraw/zinc/50/02/48/510500248.db2.gz QDARGCFCHXITTK-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO C[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000181611273 510500257 /nfs/dbraw/zinc/50/02/57/510500257.db2.gz QDARGCFCHXITTK-SFHVURJKSA-N 1 1 354.410 2.522 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246598967 510576634 /nfs/dbraw/zinc/57/66/34/510576634.db2.gz ABURXHSMVUAFAU-CHWSQXEVSA-N 1 1 350.419 2.699 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000181847629 510624573 /nfs/dbraw/zinc/62/45/73/510624573.db2.gz AIKDKQZNPGVTLY-LBPRGKRZSA-N 1 1 357.863 2.941 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000181908987 510655299 /nfs/dbraw/zinc/65/52/99/510655299.db2.gz LOBMBIPCASHXEM-KRWDZBQOSA-N 1 1 374.462 2.933 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000181908987 510655303 /nfs/dbraw/zinc/65/53/03/510655303.db2.gz LOBMBIPCASHXEM-KRWDZBQOSA-N 1 1 374.462 2.933 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000185194466 510740742 /nfs/dbraw/zinc/74/07/42/510740742.db2.gz RVNSPJURMKDTEG-LBPRGKRZSA-N 1 1 361.377 2.665 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CC1 ZINC000263779984 510837924 /nfs/dbraw/zinc/83/79/24/510837924.db2.gz VHPARLQKVGODDP-UHFFFAOYSA-N 1 1 363.461 2.755 20 5 FFBDMO COCCC[N@@H+](C)CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000172669559 510840798 /nfs/dbraw/zinc/84/07/98/510840798.db2.gz FJIYKMHIINMOMK-UHFFFAOYSA-N 1 1 351.428 2.508 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000247554932 510865471 /nfs/dbraw/zinc/86/54/71/510865471.db2.gz ZCGNFKRNIRLLIY-STQMWFEESA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)C2)C1 ZINC000293918370 510899051 /nfs/dbraw/zinc/89/90/51/510899051.db2.gz IHERPCIZHLPBGO-IBGZPJMESA-N 1 1 354.410 2.701 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286515346 511027559 /nfs/dbraw/zinc/02/75/59/511027559.db2.gz NACHZEYTDQXRCR-WFASDCNBSA-N 1 1 362.348 2.856 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000297711934 511043135 /nfs/dbraw/zinc/04/31/35/511043135.db2.gz NCQZDGJOIKIUTH-SMDDNHRTSA-N 1 1 353.394 2.545 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC2)cc1 ZINC000294417303 511058479 /nfs/dbraw/zinc/05/84/79/511058479.db2.gz LNHBPKUYGZTQCJ-UHFFFAOYSA-N 1 1 363.458 2.565 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000298055907 511159764 /nfs/dbraw/zinc/15/97/64/511159764.db2.gz JJLNBYSFBHDSQS-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO CN(CCCN(C)C(=O)Nc1cccc([N+](=O)[O-])c1Cl)CC[NH+](C)C ZINC000298055907 511159767 /nfs/dbraw/zinc/15/97/67/511159767.db2.gz JJLNBYSFBHDSQS-UHFFFAOYSA-N 1 1 371.869 2.595 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1)C(F)(F)F ZINC000291633617 511275821 /nfs/dbraw/zinc/27/58/21/511275821.db2.gz SPYMBJBMXGZFFJ-WXJAXGNASA-N 1 1 371.359 2.999 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000365188056 511306611 /nfs/dbraw/zinc/30/66/11/511306611.db2.gz AOCIXCQLRWCVAW-RDJZCZTQSA-N 1 1 373.453 2.969 20 5 FFBDMO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295387612 511386521 /nfs/dbraw/zinc/38/65/21/511386521.db2.gz RECPLVVOMDHWME-ACJLOTCBSA-N 1 1 369.425 2.684 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)CC[C@H]21 ZINC000295429920 511402382 /nfs/dbraw/zinc/40/23/82/511402382.db2.gz MKPKVBNNMBXCLC-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@H]21 ZINC000295429920 511402391 /nfs/dbraw/zinc/40/23/91/511402391.db2.gz MKPKVBNNMBXCLC-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@H]21 ZINC000295429920 511402395 /nfs/dbraw/zinc/40/23/95/511402395.db2.gz MKPKVBNNMBXCLC-KBXCAEBGSA-N 1 1 369.425 2.541 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)c1[N+](=O)[O-] ZINC000283694337 511464988 /nfs/dbraw/zinc/46/49/88/511464988.db2.gz XJXRRODGHYKCPF-OAHLLOKOSA-N 1 1 371.441 2.657 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4ccccn4)CC3)nc2c1 ZINC000299379059 511614368 /nfs/dbraw/zinc/61/43/68/511614368.db2.gz QSBQXAAXOKYDKP-UHFFFAOYSA-N 1 1 366.425 2.621 20 5 FFBDMO CN(CC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccccc1 ZINC000303329886 511735362 /nfs/dbraw/zinc/73/53/62/511735362.db2.gz BMBOLIAZOHTVJG-LJQANCHMSA-N 1 1 368.437 2.768 20 5 FFBDMO CNc1c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312486250 511784393 /nfs/dbraw/zinc/78/43/93/511784393.db2.gz JJYZMJKFCKGZDB-INIZCTEOSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000293184518 511873192 /nfs/dbraw/zinc/87/31/92/511873192.db2.gz PVSMCQGOIMXBLZ-DYVFJYSZSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000293184518 511873196 /nfs/dbraw/zinc/87/31/96/511873196.db2.gz PVSMCQGOIMXBLZ-DYVFJYSZSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1cc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c([N+](=O)[O-])cc1C ZINC000327690744 511880405 /nfs/dbraw/zinc/88/04/05/511880405.db2.gz JIODGCVBNTXDEI-KRWDZBQOSA-N 1 1 350.463 2.596 20 5 FFBDMO C[C@H](NCC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000296745670 511880613 /nfs/dbraw/zinc/88/06/13/511880613.db2.gz PFYWMXXDMOESPP-KXBFYZLASA-N 1 1 370.453 2.665 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000363999553 511897686 /nfs/dbraw/zinc/89/76/86/511897686.db2.gz ZGXKSRKCXJMQOT-GFCCVEGCSA-N 1 1 355.797 2.627 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000274646492 511899181 /nfs/dbraw/zinc/89/91/81/511899181.db2.gz MDQRCOKIPPWULW-UHFFFAOYSA-N 1 1 358.320 2.997 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886367 511912419 /nfs/dbraw/zinc/91/24/19/511912419.db2.gz TZFNTOPNDAFDDW-ZFWWWQNUSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886367 511912424 /nfs/dbraw/zinc/91/24/24/511912424.db2.gz TZFNTOPNDAFDDW-ZFWWWQNUSA-N 1 1 353.806 2.830 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000281880855 511999122 /nfs/dbraw/zinc/99/91/22/511999122.db2.gz GFDHKYZXBQTVLU-STQMWFEESA-N 1 1 350.419 2.940 20 5 FFBDMO C[C@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000293708137 512057648 /nfs/dbraw/zinc/05/76/48/512057648.db2.gz NZVHJNVARJKCFR-OAHLLOKOSA-N 1 1 361.442 2.697 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](c2n[nH]cc2NC(C)=O)C1 ZINC000366605893 512101202 /nfs/dbraw/zinc/10/12/02/512101202.db2.gz DTLYXLFDOQBFTQ-AWEZNQCLSA-N 1 1 373.413 2.665 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2n[nH]cc2NC(C)=O)C1 ZINC000366605893 512101204 /nfs/dbraw/zinc/10/12/04/512101204.db2.gz DTLYXLFDOQBFTQ-AWEZNQCLSA-N 1 1 373.413 2.665 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCOC[C@H]3[C@@H]3CCCO3)o2)c1 ZINC000367571802 512563963 /nfs/dbraw/zinc/56/39/63/512563963.db2.gz BZGBAPJVVIFROO-IRXDYDNUSA-N 1 1 373.409 2.672 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCOC[C@H]3[C@@H]3CCCO3)o2)c1 ZINC000367571802 512563968 /nfs/dbraw/zinc/56/39/68/512563968.db2.gz BZGBAPJVVIFROO-IRXDYDNUSA-N 1 1 373.409 2.672 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000367827845 512679160 /nfs/dbraw/zinc/67/91/60/512679160.db2.gz YXACJFFLBZAOAT-INIZCTEOSA-N 1 1 351.366 2.842 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1 ZINC000367827845 512679163 /nfs/dbraw/zinc/67/91/63/512679163.db2.gz YXACJFFLBZAOAT-INIZCTEOSA-N 1 1 351.366 2.842 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1F ZINC000411606230 512714834 /nfs/dbraw/zinc/71/48/34/512714834.db2.gz QPIDEKGZICAASE-QWHCGFSZSA-N 1 1 367.421 2.522 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cn(C)nc2C)c([N+](=O)[O-])c1 ZINC000370405504 512915366 /nfs/dbraw/zinc/91/53/66/512915366.db2.gz JSZJRKRKDMCSJX-MRXNPFEDSA-N 1 1 360.414 2.861 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000412059483 512936582 /nfs/dbraw/zinc/93/65/82/512936582.db2.gz CMANAABZGOXUGT-GOSISDBHSA-N 1 1 363.414 2.507 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000412074664 512945171 /nfs/dbraw/zinc/94/51/71/512945171.db2.gz IOZDLDAEMQODJV-VXGBXAGGSA-N 1 1 374.384 2.840 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000439693477 513165505 /nfs/dbraw/zinc/16/55/05/513165505.db2.gz SUACFPDALWBNGS-ZDUSSCGKSA-N 1 1 351.451 2.682 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000433957458 513198946 /nfs/dbraw/zinc/19/89/46/513198946.db2.gz AVCVCZUFTGMHLM-GOSISDBHSA-N 1 1 358.442 2.679 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412702390 513235713 /nfs/dbraw/zinc/23/57/13/513235713.db2.gz WBUFDIAHKHJSMB-CQSZACIVSA-N 1 1 354.410 2.645 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000412702390 513235717 /nfs/dbraw/zinc/23/57/17/513235717.db2.gz WBUFDIAHKHJSMB-CQSZACIVSA-N 1 1 354.410 2.645 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007863 513250255 /nfs/dbraw/zinc/25/02/55/513250255.db2.gz WLHRVSOBMCJBBC-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@@H]1N1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007863 513250261 /nfs/dbraw/zinc/25/02/61/513250261.db2.gz WLHRVSOBMCJBBC-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@H]1C[C@@H]1N1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000429007863 513250269 /nfs/dbraw/zinc/25/02/69/513250269.db2.gz WLHRVSOBMCJBBC-VKJFTORMSA-N 1 1 360.458 2.586 20 5 FFBDMO CC(C)([NH2+]CC(=O)NCCc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000429263044 513320204 /nfs/dbraw/zinc/32/02/04/513320204.db2.gz HZZBHJYWDHDSBP-UHFFFAOYSA-N 1 1 359.401 2.918 20 5 FFBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000434445805 513324866 /nfs/dbraw/zinc/32/48/66/513324866.db2.gz QELGHFFAGWEHSW-MRXNPFEDSA-N 1 1 358.442 2.916 20 5 FFBDMO CCOc1ccc(OCC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000440497877 513335679 /nfs/dbraw/zinc/33/56/79/513335679.db2.gz WHLOURURHVPGEX-OAHLLOKOSA-N 1 1 372.425 2.954 20 5 FFBDMO CC(=O)N1CCC[N@@H+](C[C@H]2CCCN(c3ccc([N+](=O)[O-])c(C)c3)C2)CC1 ZINC000450777151 513336279 /nfs/dbraw/zinc/33/62/79/513336279.db2.gz RWHNXASQKBLYOJ-GOSISDBHSA-N 1 1 374.485 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCOCCOc3ccccc3)C2)nc1 ZINC000440505134 513337432 /nfs/dbraw/zinc/33/74/32/513337432.db2.gz YFWCFIPMPYGCQO-MRXNPFEDSA-N 1 1 372.425 2.572 20 5 FFBDMO Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000450832795 513359901 /nfs/dbraw/zinc/35/99/01/513359901.db2.gz WVCKJFDMXCPNBO-ZXFUBFMLSA-N 1 1 353.426 2.819 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C2CCC2)C[C@H](C)C1 ZINC000429396310 513365498 /nfs/dbraw/zinc/36/54/98/513365498.db2.gz FNXSSBVNQBSATL-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@@H+](C)CC12CCCCC2 ZINC000447130848 513403022 /nfs/dbraw/zinc/40/30/22/513403022.db2.gz YDSJZXXTQKOFQB-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000447130848 513403024 /nfs/dbraw/zinc/40/30/24/513403024.db2.gz YDSJZXXTQKOFQB-UHFFFAOYSA-N 1 1 367.471 2.542 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)o2)cc1 ZINC000441205329 513513418 /nfs/dbraw/zinc/51/34/18/513513418.db2.gz OGZIFMWTPNFVLU-CABCVRRESA-N 1 1 358.398 2.893 20 5 FFBDMO COc1ccccc1[C@H]([NH3+])C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-] ZINC000429993662 513522189 /nfs/dbraw/zinc/52/21/89/513522189.db2.gz UFQIUDUDTPOCID-SFHVURJKSA-N 1 1 372.425 2.530 20 5 FFBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441276562 513526922 /nfs/dbraw/zinc/52/69/22/513526922.db2.gz KLSHLTGQLWKRBZ-XHDPSFHLSA-N 1 1 372.347 2.864 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000425477456 513587694 /nfs/dbraw/zinc/58/76/94/513587694.db2.gz OCTMZXSUWYWSFP-AWEZNQCLSA-N 1 1 352.435 2.768 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279258 513609595 /nfs/dbraw/zinc/60/95/95/513609595.db2.gz SODXYYMSIBFDDX-QWQRMKEZSA-N 1 1 350.415 2.762 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279258 513609601 /nfs/dbraw/zinc/60/96/01/513609601.db2.gz SODXYYMSIBFDDX-QWQRMKEZSA-N 1 1 350.415 2.762 20 5 FFBDMO CN(C(=O)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000430298354 513615702 /nfs/dbraw/zinc/61/57/02/513615702.db2.gz GSHXGFFGRMRXQA-INIZCTEOSA-N 1 1 369.421 2.959 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282851 513650125 /nfs/dbraw/zinc/65/01/25/513650125.db2.gz MDGWHMCHYJQVFP-VQIMIIECSA-N 1 1 360.385 2.903 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)ccc1[N+](=O)[O-] ZINC000451282851 513650129 /nfs/dbraw/zinc/65/01/29/513650129.db2.gz MDGWHMCHYJQVFP-VQIMIIECSA-N 1 1 360.385 2.903 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451342296 513687933 /nfs/dbraw/zinc/68/79/33/513687933.db2.gz MKJQLUNJDGLUNP-NXHRZFHOSA-N 1 1 361.442 2.857 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000419007411 513714853 /nfs/dbraw/zinc/71/48/53/513714853.db2.gz RMTYSHRCJLIIKA-HUUCEWRRSA-N 1 1 356.426 2.548 20 5 FFBDMO COc1cc(CN2CCC[C@@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000442926738 513817030 /nfs/dbraw/zinc/81/70/30/513817030.db2.gz ZYUMTMIUVGOBCH-LBPRGKRZSA-N 1 1 373.400 2.808 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C ZINC000451552580 513828963 /nfs/dbraw/zinc/82/89/63/513828963.db2.gz YWVCWUMXJCMTQA-XJKSGUPXSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@H]1C[N@@H+](CCCNc2ncc(Br)cc2[N+](=O)[O-])CCCO1 ZINC000431420227 513894588 /nfs/dbraw/zinc/89/45/88/513894588.db2.gz HBVWELSHPDSNHF-NSHDSACASA-N 1 1 373.251 2.665 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448780391 513894740 /nfs/dbraw/zinc/89/47/40/513894740.db2.gz JTEABVRVSHWLKH-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000448780392 513894863 /nfs/dbraw/zinc/89/48/63/513894863.db2.gz JTEABVRVSHWLKH-GJZGRUSLSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000443444983 513972599 /nfs/dbraw/zinc/97/25/99/513972599.db2.gz QFGIGPSBYPUVAF-CYBMUJFWSA-N 1 1 372.416 2.882 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](c1ccccc1OC)[NH+](C)C ZINC000426872978 514063837 /nfs/dbraw/zinc/06/38/37/514063837.db2.gz CIDNMZHKNMHLEO-INIZCTEOSA-N 1 1 373.409 2.645 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2OCC[C@H]2[NH3+])CC1 ZINC000420340237 514101410 /nfs/dbraw/zinc/10/14/10/514101410.db2.gz TWLPMSRSQQGOEZ-MJGOQNOKSA-N 1 1 363.458 2.710 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000452005156 514129161 /nfs/dbraw/zinc/12/91/61/514129161.db2.gz LQKWGCLBVUYQAA-DLBZAZTESA-N 1 1 370.405 2.862 20 5 FFBDMO CC[C@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000420612916 514199690 /nfs/dbraw/zinc/19/96/90/514199690.db2.gz QHDTXTZWMSTRBI-INIZCTEOSA-N 1 1 368.437 2.795 20 5 FFBDMO Cn1cc[nH+]c1CC1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444621010 514275742 /nfs/dbraw/zinc/27/57/42/514275742.db2.gz ATAMDKIKYUDLFC-UHFFFAOYSA-N 1 1 354.414 2.659 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000437987923 514283725 /nfs/dbraw/zinc/28/37/25/514283725.db2.gz RMXSVURGFNEJAY-DYVFJYSZSA-N 1 1 358.442 2.752 20 5 FFBDMO CCC[C@]1(CO)CCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000444778506 514329703 /nfs/dbraw/zinc/32/97/03/514329703.db2.gz WBIPYBNMTJODEJ-GOSISDBHSA-N 1 1 363.414 2.520 20 5 FFBDMO COc1cc(CN(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000421002741 514432057 /nfs/dbraw/zinc/43/20/57/514432057.db2.gz MPZHKYJFKYRTKG-GFCCVEGCSA-N 1 1 359.373 2.731 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000415132447 514459054 /nfs/dbraw/zinc/45/90/54/514459054.db2.gz UGJKMBHYPBPFJM-HKUYNNGSSA-N 1 1 363.458 2.712 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000439104815 514493840 /nfs/dbraw/zinc/49/38/40/514493840.db2.gz FQZIDWOUTGQTGR-UHFFFAOYSA-N 1 1 364.446 2.725 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3nccc4c3cccc4[N+](=O)[O-])CC2)CCO1 ZINC000450262627 514570821 /nfs/dbraw/zinc/57/08/21/514570821.db2.gz TXFAAPIBUHNOTE-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO C[N@H+]1CCC[C@H](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000458222273 514640591 /nfs/dbraw/zinc/64/05/91/514640591.db2.gz QLNRQVCUHCXMCR-LLVKDONJSA-N 1 1 357.357 2.658 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000458228501 514646700 /nfs/dbraw/zinc/64/67/00/514646700.db2.gz UUFNAKDONMNJMI-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@@H](C(=O)c1c[nH]c2ncccc12)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000489004469 514668843 /nfs/dbraw/zinc/66/88/43/514668843.db2.gz DHFXOOJIEKKUFP-LBPRGKRZSA-N 1 1 368.397 2.576 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)Cc2ccccc2OC)cc1[N+](=O)[O-] ZINC000475572629 514717630 /nfs/dbraw/zinc/71/76/30/514717630.db2.gz PVXGJCMIUZQBNN-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2ccccc2OC)cc1[N+](=O)[O-] ZINC000475572629 514717635 /nfs/dbraw/zinc/71/76/35/514717635.db2.gz PVXGJCMIUZQBNN-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO COCC[C@@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)c1ccco1 ZINC000502653625 514728633 /nfs/dbraw/zinc/72/86/33/514728633.db2.gz MNXCNBVTVKXZLG-HZPDHXFCSA-N 1 1 359.382 2.661 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000502713329 514750093 /nfs/dbraw/zinc/75/00/93/514750093.db2.gz WFPMSVSATRXKMV-OAHLLOKOSA-N 1 1 369.487 2.836 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000471344162 514844558 /nfs/dbraw/zinc/84/45/58/514844558.db2.gz WGZQDJUOBZJNJD-UHFFFAOYSA-N 1 1 365.393 2.858 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2ccc(C(N)=O)cc2)CC1 ZINC000485555543 515087473 /nfs/dbraw/zinc/08/74/73/515087473.db2.gz XSEGOPZKGLJOAF-OAHLLOKOSA-N 1 1 368.437 2.885 20 5 FFBDMO C[C@@H](NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849782 515145907 /nfs/dbraw/zinc/14/59/07/515145907.db2.gz IRKZSXCAQWFDJD-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO C[C@@H]([NH2+]C[C@@]1(O)CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000467849782 515145916 /nfs/dbraw/zinc/14/59/16/515145916.db2.gz IRKZSXCAQWFDJD-UZLBHIALSA-N 1 1 355.438 2.882 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 ZINC000509528478 515219259 /nfs/dbraw/zinc/21/92/59/515219259.db2.gz QPFZAXDJFCVSPR-HNNXBMFYSA-N 1 1 356.430 2.510 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000472325695 515225768 /nfs/dbraw/zinc/22/57/68/515225768.db2.gz LFVDMJHCAFZGLY-GOSISDBHSA-N 1 1 371.437 2.773 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000485903447 515249169 /nfs/dbraw/zinc/24/91/69/515249169.db2.gz DXTULWNTUKHQEW-NEPJUHHUSA-N 1 1 355.385 2.652 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000509793321 515326908 /nfs/dbraw/zinc/32/69/08/515326908.db2.gz HTXYOWCEJMTAPE-CQSZACIVSA-N 1 1 369.487 2.692 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CCOCCO)cc1[N+](=O)[O-] ZINC000504574284 515330950 /nfs/dbraw/zinc/33/09/50/515330950.db2.gz BMHKHBJNDYURJY-UHFFFAOYSA-N 1 1 359.426 2.803 20 5 FFBDMO COc1ccccc1[C@@H]1CC[C@@H](C)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000510258613 515487633 /nfs/dbraw/zinc/48/76/33/515487633.db2.gz ZXOFNIBEKBOKLL-HFTRVMKXSA-N 1 1 374.441 2.634 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486509360 515516913 /nfs/dbraw/zinc/51/69/13/515516913.db2.gz BOWHFPKIHZAPPO-CYBMUJFWSA-N 1 1 367.396 2.606 20 5 FFBDMO CC(C)[NH+]1CC(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000473222700 515542226 /nfs/dbraw/zinc/54/22/26/515542226.db2.gz LEOOXAWIBJJHQD-UHFFFAOYSA-N 1 1 374.363 2.624 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505467460 515545339 /nfs/dbraw/zinc/54/53/39/515545339.db2.gz GAWTZZMXZZYUBC-IBGZPJMESA-N 1 1 353.422 2.873 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3ccc(OC)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000505498552 515558739 /nfs/dbraw/zinc/55/87/39/515558739.db2.gz LMZUDYWLUXJUSY-QGZVFWFLSA-N 1 1 369.421 2.953 20 5 FFBDMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456982217 515563163 /nfs/dbraw/zinc/56/31/63/515563163.db2.gz GMXHLEUKHPXUSJ-SFHVURJKSA-N 1 1 364.405 2.723 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000456984897 515565251 /nfs/dbraw/zinc/56/52/51/515565251.db2.gz IIKZCHVDYRWVKU-KRWDZBQOSA-N 1 1 369.421 2.845 20 5 FFBDMO CCC[C@H]1CN(Cc2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1CCOC ZINC000492835971 515568332 /nfs/dbraw/zinc/56/83/32/515568332.db2.gz UJIMFDUCVUHQNR-INIZCTEOSA-N 1 1 351.447 2.536 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000505569326 515588560 /nfs/dbraw/zinc/58/85/60/515588560.db2.gz UCMVHPLOLCDEDJ-SMDDNHRTSA-N 1 1 374.384 2.840 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454612309 515608436 /nfs/dbraw/zinc/60/84/36/515608436.db2.gz SBFFSROQUSZAHV-DOTOQJQBSA-N 1 1 372.469 2.968 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454612315 515609090 /nfs/dbraw/zinc/60/90/90/515609090.db2.gz SBFFSROQUSZAHV-RDJZCZTQSA-N 1 1 372.469 2.968 20 5 FFBDMO Cc1cc(C)c(S(=O)(=O)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000493442882 515633245 /nfs/dbraw/zinc/63/32/45/515633245.db2.gz PTAYUSBRBXGFGD-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(S(C)(=O)=O)ccc1F ZINC000500366035 515679519 /nfs/dbraw/zinc/67/95/19/515679519.db2.gz HYMDMUIIBVYABE-UHFFFAOYSA-N 1 1 352.387 2.736 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000486962632 515700404 /nfs/dbraw/zinc/70/04/04/515700404.db2.gz GTHQIDKWQARGOS-GJZGRUSLSA-N 1 1 366.849 2.717 20 5 FFBDMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000510887563 515703251 /nfs/dbraw/zinc/70/32/51/515703251.db2.gz KRUGGGWHKCNAOG-CYBMUJFWSA-N 1 1 359.348 2.875 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCC2 ZINC000459640047 515713896 /nfs/dbraw/zinc/71/38/96/515713896.db2.gz WZSZRAKPUIBKJU-LLVKDONJSA-N 1 1 360.439 2.854 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000494045865 515717876 /nfs/dbraw/zinc/71/78/76/515717876.db2.gz CNRPIDYKQMBXLO-BEFAXECRSA-N 1 1 369.421 2.753 20 5 FFBDMO O=C(NCC1CC[NH+](Cc2ccccc2)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000505935052 515728507 /nfs/dbraw/zinc/72/85/07/515728507.db2.gz HLBGQSOOPPQKHW-UHFFFAOYSA-N 1 1 369.421 2.942 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1CCOc1ccccc1 ZINC000478226692 515744281 /nfs/dbraw/zinc/74/42/81/515744281.db2.gz IVNDYIXYRGYPIB-OAHLLOKOSA-N 1 1 373.384 2.503 20 5 FFBDMO COc1ccccc1[C@@H](C)NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511064543 515763007 /nfs/dbraw/zinc/76/30/07/515763007.db2.gz KYDFKEOYAWGPFV-OAHLLOKOSA-N 1 1 371.437 2.955 20 5 FFBDMO COc1ccccc1[C@@H](C)NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511064543 515763013 /nfs/dbraw/zinc/76/30/13/515763013.db2.gz KYDFKEOYAWGPFV-OAHLLOKOSA-N 1 1 371.437 2.955 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676368 515766063 /nfs/dbraw/zinc/76/60/63/515766063.db2.gz JJCXKYOHQNLQCR-KGLIPLIRSA-N 1 1 373.457 2.988 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482676368 515766067 /nfs/dbraw/zinc/76/60/67/515766067.db2.gz JJCXKYOHQNLQCR-KGLIPLIRSA-N 1 1 373.457 2.988 20 5 FFBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)COc1cccc2[nH]ccc21 ZINC000511095867 515778299 /nfs/dbraw/zinc/77/82/99/515778299.db2.gz XVEVWADXYLVDEF-INIZCTEOSA-N 1 1 369.421 2.990 20 5 FFBDMO CN1C(=O)C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@H]1c1ccc(F)c(F)c1 ZINC000482734461 515786898 /nfs/dbraw/zinc/78/68/98/515786898.db2.gz PVLITDIARYOVNY-CZUORRHYSA-N 1 1 367.377 2.996 20 5 FFBDMO C[C@H](C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000459808453 515821538 /nfs/dbraw/zinc/82/15/38/515821538.db2.gz OWISYXUYBKGMAO-CHWSQXEVSA-N 1 1 365.430 2.831 20 5 FFBDMO Cc1ccc(S(=O)(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000511216595 515831513 /nfs/dbraw/zinc/83/15/13/515831513.db2.gz MPDNDDHQPGPPLQ-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO COc1cc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1F ZINC000464687956 515923943 /nfs/dbraw/zinc/92/39/43/515923943.db2.gz GPCKAPQOFUREBB-CQSZACIVSA-N 1 1 351.422 2.906 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000494696289 515930658 /nfs/dbraw/zinc/93/06/58/515930658.db2.gz GPMBCBWWIJXOCD-LBPRGKRZSA-N 1 1 371.384 2.574 20 5 FFBDMO COc1cc(CN[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000494696289 515930663 /nfs/dbraw/zinc/93/06/63/515930663.db2.gz GPMBCBWWIJXOCD-LBPRGKRZSA-N 1 1 371.384 2.574 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1 ZINC000501102727 515981384 /nfs/dbraw/zinc/98/13/84/515981384.db2.gz XWCKXDSNMPFUIC-UHFFFAOYSA-N 1 1 371.235 2.915 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000469995791 516067277 /nfs/dbraw/zinc/06/72/77/516067277.db2.gz FUGALENZDMSWKT-JTNHKYCSSA-N 1 1 360.370 2.589 20 5 FFBDMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000469996611 516069407 /nfs/dbraw/zinc/06/94/07/516069407.db2.gz PBASSNOBLMKARE-JSGCOSHPSA-N 1 1 362.348 2.997 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000470131170 516134374 /nfs/dbraw/zinc/13/43/74/516134374.db2.gz FSCHRMJYMOIHEC-XCRHUMRWSA-N 1 1 355.394 2.941 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCSC[C@@H]3CCO)o2)c1 ZINC000470205167 516172787 /nfs/dbraw/zinc/17/27/87/516172787.db2.gz COFJJLHGFFWQCG-HNNXBMFYSA-N 1 1 363.439 2.592 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000483701151 516177933 /nfs/dbraw/zinc/17/79/33/516177933.db2.gz LVYKUQAMVXBMSM-ZFWWWQNUSA-N 1 1 364.446 2.618 20 5 FFBDMO COc1ccccc1[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)[NH+](C)C ZINC000460811548 516254793 /nfs/dbraw/zinc/25/47/93/516254793.db2.gz HNHBLMJXKAHDIN-QGZVFWFLSA-N 1 1 357.410 2.565 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Br)C[C@@H](C)C1 ZINC000488713935 516291877 /nfs/dbraw/zinc/29/18/77/516291877.db2.gz MJTOOYAYMUBKKG-MJVIPROJSA-N 1 1 369.263 2.919 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000461040371 516309614 /nfs/dbraw/zinc/30/96/14/516309614.db2.gz DOLROZRNBLPMFF-SNVBAGLBSA-N 1 1 358.236 2.816 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000517536752 516354619 /nfs/dbraw/zinc/35/46/19/516354619.db2.gz PLYAZYKZAGPPLJ-KRWDZBQOSA-N 1 1 369.849 2.917 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000517536752 516354628 /nfs/dbraw/zinc/35/46/28/516354628.db2.gz PLYAZYKZAGPPLJ-KRWDZBQOSA-N 1 1 369.849 2.917 20 5 FFBDMO O=c1[nH]c(NC[C@H]2CCC[N@H+]2C2CCCCC2)nc2ccc([N+](=O)[O-])cc21 ZINC000557670466 516372296 /nfs/dbraw/zinc/37/22/96/516372296.db2.gz BFXYSCNBADDXFY-OAHLLOKOSA-N 1 1 371.441 2.875 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1 ZINC000513095472 516469786 /nfs/dbraw/zinc/46/97/86/516469786.db2.gz KJTHZUVIWVOETQ-GRYCIOLGSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1 ZINC000513095472 516469794 /nfs/dbraw/zinc/46/97/94/516469794.db2.gz KJTHZUVIWVOETQ-GRYCIOLGSA-N 1 1 355.822 2.567 20 5 FFBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544072356 516568472 /nfs/dbraw/zinc/56/84/72/516568472.db2.gz VCPAIHQGOYAHRG-JCGIZDLHSA-N 1 1 366.458 2.860 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC([N@@H+](C)Cc3ccccc3)C2)c1 ZINC000561419298 516573035 /nfs/dbraw/zinc/57/30/35/516573035.db2.gz DZMQIADYPOZLDJ-UHFFFAOYSA-N 1 1 355.394 2.702 20 5 FFBDMO CCc1ccc([C@@H]2CCC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000513400944 516606603 /nfs/dbraw/zinc/60/66/03/516606603.db2.gz IGAWCINNALTFLK-IEBWSBKVSA-N 1 1 358.442 2.594 20 5 FFBDMO COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000536262822 516700477 /nfs/dbraw/zinc/70/04/77/516700477.db2.gz JGHNCNIQONLFBD-OXJNMPFZSA-N 1 1 369.421 2.708 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)Nc2c[nH+]ccc2-n2cccn2)c1 ZINC000554969318 516726242 /nfs/dbraw/zinc/72/62/42/516726242.db2.gz KIDBERJGMTVRHW-UHFFFAOYSA-N 1 1 353.338 2.827 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000518680823 516740392 /nfs/dbraw/zinc/74/03/92/516740392.db2.gz YEZLAJLIKFAWGR-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)c3ccc([N+](=O)[O-])cc3)c2)CCO1 ZINC000518680823 516740402 /nfs/dbraw/zinc/74/04/02/516740402.db2.gz YEZLAJLIKFAWGR-OAHLLOKOSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000561746994 516746392 /nfs/dbraw/zinc/74/63/92/516746392.db2.gz QTPOWGAQKYPWDL-FRQCXROJSA-N 1 1 374.485 2.976 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCN3CCCc4ccccc43)C2)nc1 ZINC000536425928 516759685 /nfs/dbraw/zinc/75/96/85/516759685.db2.gz IEZSMBVHIVHXBV-KRWDZBQOSA-N 1 1 367.453 2.929 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000524617636 516770106 /nfs/dbraw/zinc/77/01/06/516770106.db2.gz BPSSAQRVMOCSSG-LSDHHAIUSA-N 1 1 371.441 2.725 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000518808661 516783353 /nfs/dbraw/zinc/78/33/53/516783353.db2.gz TWQKUYLTRUXYKG-HNNXBMFYSA-N 1 1 363.458 2.990 20 5 FFBDMO CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000524716443 516800599 /nfs/dbraw/zinc/80/05/99/516800599.db2.gz LNGZGFYVSYLQMS-KRWDZBQOSA-N 1 1 370.453 2.918 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC000561880200 516811967 /nfs/dbraw/zinc/81/19/67/516811967.db2.gz BLHNBNIXQVVOEZ-CQSZACIVSA-N 1 1 366.437 2.714 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000541013665 516829638 /nfs/dbraw/zinc/82/96/38/516829638.db2.gz DZBHRRHHJJXCTH-NSHDSACASA-N 1 1 357.357 2.656 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600039 516846835 /nfs/dbraw/zinc/84/68/35/516846835.db2.gz RNCCGJIGANFBLN-JKSUJKDBSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000536600039 516846843 /nfs/dbraw/zinc/84/68/43/516846843.db2.gz RNCCGJIGANFBLN-JKSUJKDBSA-N 1 1 363.461 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]2CN2CCOCC2)c1 ZINC000555376946 516904939 /nfs/dbraw/zinc/90/49/39/516904939.db2.gz GWQMHGGYWJMCQV-HNNXBMFYSA-N 1 1 373.375 2.910 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2CN2CCOCC2)c1 ZINC000555376946 516904947 /nfs/dbraw/zinc/90/49/47/516904947.db2.gz GWQMHGGYWJMCQV-HNNXBMFYSA-N 1 1 373.375 2.910 20 5 FFBDMO O=C(NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000558734665 516917668 /nfs/dbraw/zinc/91/76/68/516917668.db2.gz DLRPVSNUDKPIPA-AWEZNQCLSA-N 1 1 363.805 2.538 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+](Cc1ccccn1)C1CC1 ZINC000536783992 516933803 /nfs/dbraw/zinc/93/38/03/516933803.db2.gz LQFHHQFIGSPVNX-UHFFFAOYSA-N 1 1 368.393 2.952 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1 ZINC000555469443 516937324 /nfs/dbraw/zinc/93/73/24/516937324.db2.gz MVSSOTSPSALCGR-NSHDSACASA-N 1 1 358.236 2.782 20 5 FFBDMO COC(=O)c1ccc([C@@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046602 517018787 /nfs/dbraw/zinc/01/87/87/517018787.db2.gz WNMAEGFKFSBUJU-NEPJUHHUSA-N 1 1 360.370 2.617 20 5 FFBDMO COC(=O)c1ccc([C@@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1 ZINC000537046602 517018792 /nfs/dbraw/zinc/01/87/92/517018792.db2.gz WNMAEGFKFSBUJU-NEPJUHHUSA-N 1 1 360.370 2.617 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000545150962 517069625 /nfs/dbraw/zinc/06/96/25/517069625.db2.gz GILQLNSHMYIXHU-UHFFFAOYSA-N 1 1 366.849 2.742 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000545173197 517084611 /nfs/dbraw/zinc/08/46/11/517084611.db2.gz UFCBDLGPUGFTIP-UHFFFAOYSA-N 1 1 368.231 2.739 20 5 FFBDMO CCc1ccc([C@H]([NH2+]CCNC(=O)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545491 517106546 /nfs/dbraw/zinc/10/65/46/517106546.db2.gz IARIKNJJMIAJMG-GOSISDBHSA-N 1 1 357.410 2.955 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000532823013 517158526 /nfs/dbraw/zinc/15/85/26/517158526.db2.gz GRJYXBTZRAXQON-ZDUSSCGKSA-N 1 1 353.378 2.884 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1C(=O)c2ccccc2C1=O ZINC000532823013 517158536 /nfs/dbraw/zinc/15/85/36/517158536.db2.gz GRJYXBTZRAXQON-ZDUSSCGKSA-N 1 1 353.378 2.884 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000562598198 517223008 /nfs/dbraw/zinc/22/30/08/517223008.db2.gz SNSXHOQSHIKYFO-SFHVURJKSA-N 1 1 350.415 2.885 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000537613115 517257128 /nfs/dbraw/zinc/25/71/28/517257128.db2.gz CKSUWZGMGVUAPM-HOCLYGCPSA-N 1 1 356.426 2.574 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H](C)C[NH+]2CCN(c3ccccn3)CC2)n1 ZINC000541932283 517299280 /nfs/dbraw/zinc/29/92/80/517299280.db2.gz OCDPKUMTPIEFEC-MRXNPFEDSA-N 1 1 370.457 2.624 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1 ZINC000520254719 517320552 /nfs/dbraw/zinc/32/05/52/517320552.db2.gz LKQODJOSSFNDBG-GASCZTMLSA-N 1 1 364.446 2.536 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000515555759 517404680 /nfs/dbraw/zinc/40/46/80/517404680.db2.gz BMJFCEJAENPIPI-CYBMUJFWSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000515666956 517442488 /nfs/dbraw/zinc/44/24/88/517442488.db2.gz CUWBHUACFXPTAS-OAHLLOKOSA-N 1 1 371.441 2.701 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000515666956 517442497 /nfs/dbraw/zinc/44/24/97/517442497.db2.gz CUWBHUACFXPTAS-OAHLLOKOSA-N 1 1 371.441 2.701 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000562854490 517459241 /nfs/dbraw/zinc/45/92/41/517459241.db2.gz XMJQGQQZBUFSPJ-MAUKXSAKSA-N 1 1 357.458 2.739 20 5 FFBDMO C[N@H+]1CCC[C@@H](CNC(=O)N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000556565021 517494310 /nfs/dbraw/zinc/49/43/10/517494310.db2.gz XSSYAYKWDJHIJV-RDJZCZTQSA-N 1 1 360.458 2.826 20 5 FFBDMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000520755642 517499990 /nfs/dbraw/zinc/49/99/90/517499990.db2.gz UAHTXRAQRJYLFW-CHWSQXEVSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000520755641 517500422 /nfs/dbraw/zinc/50/04/22/517500422.db2.gz UAHTXRAQRJYLFW-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000520755641 517500426 /nfs/dbraw/zinc/50/04/26/517500426.db2.gz UAHTXRAQRJYLFW-BETUJISGSA-N 1 1 355.460 2.673 20 5 FFBDMO Cn1c2ccccc2nc1[C@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000533524181 517505354 /nfs/dbraw/zinc/50/53/54/517505354.db2.gz GGSUAUDEUMOXSV-MRXNPFEDSA-N 1 1 354.414 2.905 20 5 FFBDMO Cn1c2ccccc2nc1[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000533524181 517505366 /nfs/dbraw/zinc/50/53/66/517505366.db2.gz GGSUAUDEUMOXSV-MRXNPFEDSA-N 1 1 354.414 2.905 20 5 FFBDMO O=C(NC[C@@H]([NH2+]Cc1ccccc1)c1ccco1)c1ccc([N+](=O)[O-])cn1 ZINC000553212856 517579590 /nfs/dbraw/zinc/57/95/90/517579590.db2.gz YQEDEFPFXROMDL-QGZVFWFLSA-N 1 1 366.377 2.844 20 5 FFBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000549907964 517772504 /nfs/dbraw/zinc/77/25/04/517772504.db2.gz SSWLKEYAWBEIRJ-FMSOUQGNSA-N 1 1 367.449 2.617 20 5 FFBDMO O=[N+]([O-])c1ccccc1/C=C\CNC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000549907964 517772511 /nfs/dbraw/zinc/77/25/11/517772511.db2.gz SSWLKEYAWBEIRJ-FMSOUQGNSA-N 1 1 367.449 2.617 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)n1 ZINC000542865472 517788513 /nfs/dbraw/zinc/78/85/13/517788513.db2.gz ICQMSEWEQUFNEW-MSOLQXFVSA-N 1 1 370.453 2.902 20 5 FFBDMO C[C@H]1CCC[N@@H+](C(C)(C)CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000521769822 517850269 /nfs/dbraw/zinc/85/02/69/517850269.db2.gz DEHOPSBDGQFOBW-LBPRGKRZSA-N 1 1 373.450 2.523 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000521769822 517850281 /nfs/dbraw/zinc/85/02/81/517850281.db2.gz DEHOPSBDGQFOBW-LBPRGKRZSA-N 1 1 373.450 2.523 20 5 FFBDMO C[C@@H]1COc2ccccc2C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543188371 517956016 /nfs/dbraw/zinc/95/60/16/517956016.db2.gz YWZRDLKIFJWYCW-GDBMZVCRSA-N 1 1 358.394 2.618 20 5 FFBDMO COc1ccc(NC(=O)NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000539380983 518017613 /nfs/dbraw/zinc/01/76/13/518017613.db2.gz ASTDULHVDXZPBS-LBPRGKRZSA-N 1 1 372.381 2.602 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000522180998 518020987 /nfs/dbraw/zinc/02/09/87/518020987.db2.gz BMYXTGMVZVJGMN-GOSISDBHSA-N 1 1 368.437 2.561 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000563650312 518045128 /nfs/dbraw/zinc/04/51/28/518045128.db2.gz NCRVYNCWXAKVIZ-BUXKBTBVSA-N 1 1 372.377 2.758 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1 ZINC000554113722 518065426 /nfs/dbraw/zinc/06/54/26/518065426.db2.gz UZBZMQFNSPGZBU-HBUWYVDXSA-N 1 1 361.442 2.796 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000522386957 518095369 /nfs/dbraw/zinc/09/53/69/518095369.db2.gz QKRGINYGRBIKTN-OLZOCXBDSA-N 1 1 369.849 2.816 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2ccc(NCc3csc([N+](=O)[O-])c3)cc2)CC1 ZINC000539670961 518135055 /nfs/dbraw/zinc/13/50/55/518135055.db2.gz WISFVQIXRMPNCT-UHFFFAOYSA-N 1 1 374.466 2.933 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CNC[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000543613949 518153511 /nfs/dbraw/zinc/15/35/11/518153511.db2.gz QMIUNWVHGRPHPX-HXUWFJFHSA-N 1 1 355.438 2.630 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC000543613949 518153518 /nfs/dbraw/zinc/15/35/18/518153518.db2.gz QMIUNWVHGRPHPX-HXUWFJFHSA-N 1 1 355.438 2.630 20 5 FFBDMO C[N@H+]1CCN(CCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1(C)C ZINC000564091574 518303671 /nfs/dbraw/zinc/30/36/71/518303671.db2.gz WRSIDBOSJIYDCZ-HNNXBMFYSA-N 1 1 374.407 2.814 20 5 FFBDMO CN(C(=O)c1cccc2c(=O)c3ccccc3[nH]c12)[C@H]1CC[N@H+](C2CC2)C1 ZINC000581527847 518329110 /nfs/dbraw/zinc/32/91/10/518329110.db2.gz ONFGZPVDYGQBSK-HNNXBMFYSA-N 1 1 361.445 2.990 20 5 FFBDMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202510 518348927 /nfs/dbraw/zinc/34/89/27/518348927.db2.gz MLBMUEXAGLNOCP-XHSDSOJGSA-N 1 1 362.474 2.879 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000564202510 518348933 /nfs/dbraw/zinc/34/89/33/518348933.db2.gz MLBMUEXAGLNOCP-XHSDSOJGSA-N 1 1 362.474 2.879 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2(C)C)cn1 ZINC000575999718 518381683 /nfs/dbraw/zinc/38/16/83/518381683.db2.gz LMTKPAQQDQATOW-KRWDZBQOSA-N 1 1 371.441 2.783 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000564507890 518479106 /nfs/dbraw/zinc/47/91/06/518479106.db2.gz ZZENGHKDTAGBIY-HNNXBMFYSA-N 1 1 350.463 2.945 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000576426138 518586617 /nfs/dbraw/zinc/58/66/17/518586617.db2.gz AQGYTXSVRIRHOO-MRXNPFEDSA-N 1 1 370.453 2.668 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](C/C=C\c2ccccc2)CC1 ZINC000570476728 518625528 /nfs/dbraw/zinc/62/55/28/518625528.db2.gz SSWQYEXZAXELSR-YFHOEESVSA-N 1 1 355.442 2.955 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000570653550 518713483 /nfs/dbraw/zinc/71/34/83/518713483.db2.gz ZALFDOCXMKLFSU-JKSUJKDBSA-N 1 1 357.410 2.651 20 5 FFBDMO CN(c1nnc(-c2ccc([N+](=O)[O-])cc2)n1C1CC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000565128458 518801683 /nfs/dbraw/zinc/80/16/83/518801683.db2.gz VWGJFAIJHFGMSY-KRWDZBQOSA-N 1 1 368.441 2.861 20 5 FFBDMO C[C@@H](C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000576915293 518823891 /nfs/dbraw/zinc/82/38/91/518823891.db2.gz LWRNHPQRALITKB-MJBXVCDLSA-N 1 1 358.442 2.996 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582621434 518842191 /nfs/dbraw/zinc/84/21/91/518842191.db2.gz MYEYNGZINFASTA-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582621434 518842197 /nfs/dbraw/zinc/84/21/97/518842197.db2.gz MYEYNGZINFASTA-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO CCOCC[N@@H+](C)Cc1cc(I)cc([N+](=O)[O-])c1 ZINC000565331069 518900589 /nfs/dbraw/zinc/90/05/89/518900589.db2.gz DPQUAYUEPYWHJO-UHFFFAOYSA-N 1 1 364.183 2.668 20 5 FFBDMO CC(C)[N@H+](C)C[C@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000565394333 518931671 /nfs/dbraw/zinc/93/16/71/518931671.db2.gz FYRXZCRTJMUUKX-HNNXBMFYSA-N 1 1 362.474 2.656 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000565631711 519053211 /nfs/dbraw/zinc/05/32/11/519053211.db2.gz TXLRPHPRVPJITL-CQSZACIVSA-N 1 1 359.430 2.631 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cc1[N+](=O)[O-] ZINC000577389889 519056544 /nfs/dbraw/zinc/05/65/44/519056544.db2.gz BXWSELGHVYGDNJ-CZUORRHYSA-N 1 1 369.487 2.508 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000565778049 519127655 /nfs/dbraw/zinc/12/76/55/519127655.db2.gz NRWMANNDXLCVAH-YOEHRIQHSA-N 1 1 368.437 2.817 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000590014365 519130167 /nfs/dbraw/zinc/13/01/67/519130167.db2.gz BSRIDNIQDJWCMW-YVEFUNNKSA-N 1 1 367.833 2.570 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000590022594 519131539 /nfs/dbraw/zinc/13/15/39/519131539.db2.gz JQGAVMNDUCXALR-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO CC(C)(CO)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccnc1 ZINC000590374713 519208576 /nfs/dbraw/zinc/20/85/76/519208576.db2.gz CFLLAIJNVLEAAY-SFHVURJKSA-N 1 1 373.409 2.706 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000590456712 519238470 /nfs/dbraw/zinc/23/84/70/519238470.db2.gz GLTOGPWGMNMRGS-RLFYNMQTSA-N 1 1 360.458 2.586 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000583460059 519259055 /nfs/dbraw/zinc/25/90/55/519259055.db2.gz JHLGMAWYWBWPAR-INIZCTEOSA-N 1 1 363.801 2.818 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H](C)C(=O)OC(C)(C)C)c1 ZINC000590972784 519464361 /nfs/dbraw/zinc/46/43/61/519464361.db2.gz PWFXDZHOJMOUSP-GFCCVEGCSA-N 1 1 366.414 2.791 20 5 FFBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F)C1CC1 ZINC000566481330 519515614 /nfs/dbraw/zinc/51/56/14/519515614.db2.gz CUBLGIBCEASRIA-UHFFFAOYSA-N 1 1 366.437 2.857 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCc1cnccn1)[C@H]1CC[C@H](O)CC1 ZINC000602852121 519924290 /nfs/dbraw/zinc/92/42/90/519924290.db2.gz CMFKDNSCTLEGJR-IYARVYRRSA-N 1 1 356.426 2.733 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C(C)(C)C)C1 ZINC000602873539 519940070 /nfs/dbraw/zinc/94/00/70/519940070.db2.gz KSEOBZREIDZUQL-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)[C@H](C(C)(C)C)C1 ZINC000602873539 519940072 /nfs/dbraw/zinc/94/00/72/519940072.db2.gz KSEOBZREIDZUQL-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)[C@H](C(C)(C)C)C1 ZINC000602873539 519940083 /nfs/dbraw/zinc/94/00/83/519940083.db2.gz KSEOBZREIDZUQL-KRWDZBQOSA-N 1 1 362.474 2.894 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(F)c1N1CCOCC1 ZINC000594546559 520019718 /nfs/dbraw/zinc/01/97/18/520019718.db2.gz QXCBIEZVVQGJOM-KGLIPLIRSA-N 1 1 364.421 2.609 20 5 FFBDMO Cc1[nH]c2nc[nH+]c(N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1C ZINC000591925784 520090645 /nfs/dbraw/zinc/09/06/45/520090645.db2.gz PJYYDVOHGFDMKL-GFCCVEGCSA-N 1 1 353.386 2.569 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000597606071 520132459 /nfs/dbraw/zinc/13/24/59/520132459.db2.gz UGJOWSRXPGSRPW-GXTWGEPZSA-N 1 1 369.849 2.958 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000600313847 520200502 /nfs/dbraw/zinc/20/05/02/520200502.db2.gz KOHVRHUSWXJNKC-NSHDSACASA-N 1 1 370.247 2.819 20 5 FFBDMO C[C@]1(Cc2ccccc2F)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000592143988 520221775 /nfs/dbraw/zinc/22/17/75/520221775.db2.gz WJGGJAHANKUNMU-LJQANCHMSA-N 1 1 359.401 2.993 20 5 FFBDMO O=C(NCc1ccccc1)[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000592155205 520231532 /nfs/dbraw/zinc/23/15/32/520231532.db2.gz MSZVLKUBBIJBGZ-KRWDZBQOSA-N 1 1 369.421 2.612 20 5 FFBDMO C[N@@H+]1CCN(Cc2ccccc2)[C@H](CNCc2cccc([N+](=O)[O-])c2)C1 ZINC000594995028 520248317 /nfs/dbraw/zinc/24/83/17/520248317.db2.gz NBKVUGYDWYGVDZ-HXUWFJFHSA-N 1 1 354.454 2.501 20 5 FFBDMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNCc2cccc([N+](=O)[O-])c2)C1 ZINC000594995028 520248325 /nfs/dbraw/zinc/24/83/25/520248325.db2.gz NBKVUGYDWYGVDZ-HXUWFJFHSA-N 1 1 354.454 2.501 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000592183119 520249604 /nfs/dbraw/zinc/24/96/04/520249604.db2.gz CYFWGPRXDQOUMT-XHDPSFHLSA-N 1 1 359.348 2.965 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000595049801 520270955 /nfs/dbraw/zinc/27/09/55/520270955.db2.gz OTESUQYCRXTNJU-IRXDYDNUSA-N 1 1 357.458 2.880 20 5 FFBDMO C[NH+](C)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000600469386 520279624 /nfs/dbraw/zinc/27/96/24/520279624.db2.gz AKVHSJGNXWSACE-LLVKDONJSA-N 1 1 372.212 2.657 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000597853498 520282243 /nfs/dbraw/zinc/28/22/43/520282243.db2.gz BDVOGGDRINHQKZ-CQSZACIVSA-N 1 1 371.441 2.631 20 5 FFBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(N)=O)cs1 ZINC000595082866 520286318 /nfs/dbraw/zinc/28/63/18/520286318.db2.gz QLAGLGNVNUTYNE-SNVBAGLBSA-N 1 1 366.468 2.811 20 5 FFBDMO CCN(C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597944075 520342898 /nfs/dbraw/zinc/34/28/98/520342898.db2.gz BXIXLWMPDLXIKQ-WBVHZDCISA-N 1 1 374.485 2.997 20 5 FFBDMO CCN(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597946615 520346190 /nfs/dbraw/zinc/34/61/90/520346190.db2.gz QPKKVLYJOVBYPM-OAHLLOKOSA-N 1 1 354.410 2.823 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3CC3)C2)nc1OCc1ccccc1 ZINC000613179954 520371919 /nfs/dbraw/zinc/37/19/19/520371919.db2.gz BXMLANCJUOXPTF-QGZVFWFLSA-N 1 1 368.437 2.887 20 5 FFBDMO O=[N+]([O-])c1ncccc1NCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000603852390 520377976 /nfs/dbraw/zinc/37/79/76/520377976.db2.gz WSGJXKIIEUJNAA-UHFFFAOYSA-N 1 1 355.442 2.610 20 5 FFBDMO C[N@@H+](Cc1ccc2nc(NC(=O)c3c[nH]nc3[N+](=O)[O-])sc2c1)C1CC1 ZINC000598028012 520384588 /nfs/dbraw/zinc/38/45/88/520384588.db2.gz LTHFPHDFWDLRHN-UHFFFAOYSA-N 1 1 372.410 2.774 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000595294921 520392766 /nfs/dbraw/zinc/39/27/66/520392766.db2.gz UPZMZDSDCGQORJ-CPUCHLNUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000595294921 520392774 /nfs/dbraw/zinc/39/27/74/520392774.db2.gz UPZMZDSDCGQORJ-CPUCHLNUSA-N 1 1 351.422 2.808 20 5 FFBDMO Cc1c(NC(=O)CCN2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cccc1[N+](=O)[O-] ZINC000592478843 520407365 /nfs/dbraw/zinc/40/73/65/520407365.db2.gz KBSYNKOONYQHQZ-NVXWUHKLSA-N 1 1 360.458 2.696 20 5 FFBDMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000592528490 520441900 /nfs/dbraw/zinc/44/19/00/520441900.db2.gz SAROHBWPPXYCGT-DRDHIDPGSA-N 1 1 357.332 2.608 20 5 FFBDMO Cc1noc(C[NH2+][C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c1[N+](=O)[O-] ZINC000595476757 520494737 /nfs/dbraw/zinc/49/47/37/520494737.db2.gz OVPYGNUVNWALDH-XJKSGUPXSA-N 1 1 352.341 2.704 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595572301 520561015 /nfs/dbraw/zinc/56/10/15/520561015.db2.gz DTTDQRUPWALJKU-IBGZPJMESA-N 1 1 368.437 2.711 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000595576540 520565143 /nfs/dbraw/zinc/56/51/43/520565143.db2.gz ZQOBAENQJMWICJ-KRWDZBQOSA-N 1 1 360.458 2.559 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000610222452 520588614 /nfs/dbraw/zinc/58/86/14/520588614.db2.gz QPSGRBLXJMBBOT-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO CNc1c(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000592881705 520631982 /nfs/dbraw/zinc/63/19/82/520631982.db2.gz NGOHUBZJABGWAS-WBVHZDCISA-N 1 1 368.437 2.712 20 5 FFBDMO CC(=O)N1C[C@@H]2CCC[C@@H](Nc3cc[nH+]c4ccc([N+](=O)[O-])cc34)[C@H]2C1 ZINC000601166779 520669129 /nfs/dbraw/zinc/66/91/29/520669129.db2.gz SEEDZUWDRQNZRM-QANKJYHBSA-N 1 1 354.410 2.624 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000610476246 520704557 /nfs/dbraw/zinc/70/45/57/520704557.db2.gz MZTJGLVFRZVSKW-SFHVURJKSA-N 1 1 363.458 2.680 20 5 FFBDMO COc1cc(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc([N+](=O)[O-])c1C ZINC000598559359 520704907 /nfs/dbraw/zinc/70/49/07/520704907.db2.gz GFKCGYMGXCDWOK-OAHLLOKOSA-N 1 1 361.442 2.764 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCCCO2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595789782 520726856 /nfs/dbraw/zinc/72/68/56/520726856.db2.gz OHLNPJXXKVBKFV-VQIMIIECSA-N 1 1 373.453 2.765 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H](C)[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000598585922 520728713 /nfs/dbraw/zinc/72/87/13/520728713.db2.gz BKXJHXKSRDFYBG-CYBMUJFWSA-N 1 1 370.409 2.635 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593089376 520736726 /nfs/dbraw/zinc/73/67/26/520736726.db2.gz RZZLLTPQVZPYCR-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593089376 520736733 /nfs/dbraw/zinc/73/67/33/520736733.db2.gz RZZLLTPQVZPYCR-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1 ZINC000593089376 520736739 /nfs/dbraw/zinc/73/67/39/520736739.db2.gz RZZLLTPQVZPYCR-SFHVURJKSA-N 1 1 355.438 2.832 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)OCC12CCC2 ZINC000593091109 520738597 /nfs/dbraw/zinc/73/85/97/520738597.db2.gz FMULLHOPJWJQKD-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2C[C@H](C)OCC23CCC3)c([N+](=O)[O-])c1 ZINC000593093475 520741696 /nfs/dbraw/zinc/74/16/96/520741696.db2.gz UECGDFSAGFLOAY-ZDUSSCGKSA-N 1 1 363.414 2.575 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc(O)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595846220 520762150 /nfs/dbraw/zinc/76/21/50/520762150.db2.gz XLKRBXKDAUBDLK-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc(O)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595846220 520762159 /nfs/dbraw/zinc/76/21/59/520762159.db2.gz XLKRBXKDAUBDLK-UHFFFAOYSA-N 1 1 357.366 2.524 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593123880 520763819 /nfs/dbraw/zinc/76/38/19/520763819.db2.gz FTYJRTDNNKZLJT-FHWLQOOXSA-N 1 1 369.421 2.751 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000593187556 520810986 /nfs/dbraw/zinc/81/09/86/520810986.db2.gz LSZIVBFEAFPINF-OAGGEKHMSA-N 1 1 374.485 2.751 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000593204083 520824475 /nfs/dbraw/zinc/82/44/75/520824475.db2.gz SIPOMLDZCJMFLA-UHFFFAOYSA-N 1 1 359.373 2.904 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CCOCC3(CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000614222777 520856182 /nfs/dbraw/zinc/85/61/82/520856182.db2.gz AFCNIMCHCRCUJU-KRWDZBQOSA-N 1 1 359.426 2.593 20 5 FFBDMO O=C1[C@@H]([N@H+]2CCOCC3(CCCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000614222777 520856187 /nfs/dbraw/zinc/85/61/87/520856187.db2.gz AFCNIMCHCRCUJU-KRWDZBQOSA-N 1 1 359.426 2.593 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859770 520876612 /nfs/dbraw/zinc/87/66/12/520876612.db2.gz LYYOSSQMQVVDAD-LBPRGKRZSA-N 1 1 353.419 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+](C)CCOC(C)(C)C)c([N+](=O)[O-])c1 ZINC000610859770 520876609 /nfs/dbraw/zinc/87/66/09/520876609.db2.gz LYYOSSQMQVVDAD-LBPRGKRZSA-N 1 1 353.419 2.677 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000610920992 520905797 /nfs/dbraw/zinc/90/57/97/520905797.db2.gz KHIFYBCAPBFQSF-UHFFFAOYSA-N 1 1 368.397 2.865 20 5 FFBDMO C[C@]1(NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@@H+](Cc2ccccc2)C1 ZINC000593342469 520924112 /nfs/dbraw/zinc/92/41/12/520924112.db2.gz PJBOFHMWKGCYMT-FQEVSTJZSA-N 1 1 369.421 2.754 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1N1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000596151393 520939670 /nfs/dbraw/zinc/93/96/70/520939670.db2.gz JRZVFWBNALEBOD-GFCCVEGCSA-N 1 1 370.247 2.516 20 5 FFBDMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598975446 520954088 /nfs/dbraw/zinc/95/40/88/520954088.db2.gz ILGUCCZAGAGZNC-GOSISDBHSA-N 1 1 360.458 2.844 20 5 FFBDMO Cc1cc(N2CC(CN3CC[NH+](C)CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000599109160 521035670 /nfs/dbraw/zinc/03/56/70/521035670.db2.gz QCYZVDKOBYAXGN-UHFFFAOYSA-N 1 1 372.391 2.606 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CC[N@@H+]1Cc1ccc(OC)cc1 ZINC000599141181 521051143 /nfs/dbraw/zinc/05/11/43/521051143.db2.gz ZBZMRFKBXMWCSM-OAHLLOKOSA-N 1 1 359.430 2.815 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1Cc1ccc(OC)cc1 ZINC000599141181 521051154 /nfs/dbraw/zinc/05/11/54/521051154.db2.gz ZBZMRFKBXMWCSM-OAHLLOKOSA-N 1 1 359.430 2.815 20 5 FFBDMO COc1cccc([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000596424576 521065325 /nfs/dbraw/zinc/06/53/25/521065325.db2.gz SJRVMQXYIWWAMZ-MRXNPFEDSA-N 1 1 357.410 2.782 20 5 FFBDMO CC(C)c1ccc(CN2CCN([C@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270999 521071523 /nfs/dbraw/zinc/07/15/23/521071523.db2.gz YYBHFCAGPFLOJH-SFHVURJKSA-N 1 1 360.502 2.930 20 5 FFBDMO CS(=O)(=O)c1ccc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596479008 521092424 /nfs/dbraw/zinc/09/24/24/521092424.db2.gz RNAGXONTKHYTRW-CYBMUJFWSA-N 1 1 367.471 2.817 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000611350874 521115616 /nfs/dbraw/zinc/11/56/16/521115616.db2.gz VQTGZPUSWHXJPI-CVEARBPZSA-N 1 1 373.453 2.623 20 5 FFBDMO C[C@@H](NC(=O)NCC[NH+]1Cc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000611372776 521125558 /nfs/dbraw/zinc/12/55/58/521125558.db2.gz MUQMLRWGWUBTSN-CQSZACIVSA-N 1 1 354.410 2.971 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])ccc1OCCO ZINC000611383888 521128615 /nfs/dbraw/zinc/12/86/15/521128615.db2.gz GYUWKDOJRVYGSV-GFCCVEGCSA-N 1 1 364.373 2.964 20 5 FFBDMO CN1CCN(C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000611408973 521141068 /nfs/dbraw/zinc/14/10/68/521141068.db2.gz JTTLBMGMJUTADF-OAQYLSRUSA-N 1 1 368.481 2.716 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](CCO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000611518693 521198152 /nfs/dbraw/zinc/19/81/52/521198152.db2.gz DLXQCWVIWXOZAT-GFCCVEGCSA-N 1 1 374.384 2.842 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O ZINC000611526050 521203516 /nfs/dbraw/zinc/20/35/16/521203516.db2.gz FLPSVEIIURSWLD-ZFWWWQNUSA-N 1 1 350.415 2.595 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O ZINC000611526050 521203524 /nfs/dbraw/zinc/20/35/24/521203524.db2.gz FLPSVEIIURSWLD-ZFWWWQNUSA-N 1 1 350.415 2.595 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000599516340 521273464 /nfs/dbraw/zinc/27/34/64/521273464.db2.gz REKWDILMESMYQJ-AWEZNQCLSA-N 1 1 363.364 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(NCCC[N@H+]3CCc4ccccc4C3)c2c1 ZINC000611703605 521289231 /nfs/dbraw/zinc/28/92/31/521289231.db2.gz VWWWQRRXNCHYBD-UHFFFAOYSA-N 1 1 363.421 2.820 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000599576162 521308676 /nfs/dbraw/zinc/30/86/76/521308676.db2.gz KFDHMAMJDJGIBN-NXEZZACHSA-N 1 1 356.220 2.570 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596827631 521313335 /nfs/dbraw/zinc/31/33/35/521313335.db2.gz FPCPOTDAFKHVDN-AWEZNQCLSA-N 1 1 362.430 2.847 20 5 FFBDMO CC1(C)[C@@H](c2cccc(F)c2)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000599629782 521343460 /nfs/dbraw/zinc/34/34/60/521343460.db2.gz MHPFWEWUHGKZAV-IAGOWNOFSA-N 1 1 362.405 2.559 20 5 FFBDMO CCC(CC)[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000599658158 521370941 /nfs/dbraw/zinc/37/09/41/521370941.db2.gz PERAZNYEDBDUAA-CYBMUJFWSA-N 1 1 367.475 2.853 20 5 FFBDMO Cc1cc(NC(=O)NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594082025 521395071 /nfs/dbraw/zinc/39/50/71/521395071.db2.gz XXDQNRPKLILAEN-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc(NC(=O)NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594082025 521395079 /nfs/dbraw/zinc/39/50/79/521395079.db2.gz XXDQNRPKLILAEN-MELADBBJSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594095523 521400405 /nfs/dbraw/zinc/40/04/05/521400405.db2.gz XPDZSYJUOUSVOM-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594095523 521400411 /nfs/dbraw/zinc/40/04/11/521400411.db2.gz XPDZSYJUOUSVOM-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc(C)nc(N2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000611941372 521403824 /nfs/dbraw/zinc/40/38/24/521403824.db2.gz VMPXMQHDTCQRCT-UHFFFAOYSA-N 1 1 371.441 2.593 20 5 FFBDMO COC1CCN(C(C)(C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602548137 521406657 /nfs/dbraw/zinc/40/66/57/521406657.db2.gz QCWORAUBVGIXCO-UHFFFAOYSA-N 1 1 362.430 2.715 20 5 FFBDMO COC(=O)C1C[C@H](C)[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000599693759 521407433 /nfs/dbraw/zinc/40/74/33/521407433.db2.gz GCYLYDYJJBJKOZ-RYUDHWBXSA-N 1 1 374.397 2.807 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000599706238 521417064 /nfs/dbraw/zinc/41/70/64/521417064.db2.gz JSKHEVPSZNMEGL-CLLJXQQHSA-N 1 1 364.398 2.623 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1 ZINC000599706238 521417065 /nfs/dbraw/zinc/41/70/65/521417065.db2.gz JSKHEVPSZNMEGL-CLLJXQQHSA-N 1 1 364.398 2.623 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000599711022 521419282 /nfs/dbraw/zinc/41/92/82/521419282.db2.gz TZARDPBBGUKEDX-DABQJJPHSA-N 1 1 374.397 2.807 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000599711022 521419294 /nfs/dbraw/zinc/41/92/94/521419294.db2.gz TZARDPBBGUKEDX-DABQJJPHSA-N 1 1 374.397 2.807 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1 ZINC000612031649 521447079 /nfs/dbraw/zinc/44/70/79/521447079.db2.gz OOCPLDIECPXBIX-GOSISDBHSA-N 1 1 366.421 2.951 20 5 FFBDMO CCC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])[C@@H](C)CC(=O)Nc1ccccc1 ZINC000602654524 521461374 /nfs/dbraw/zinc/46/13/74/521461374.db2.gz VEOFWPDDOUCNPM-AWEZNQCLSA-N 1 1 359.430 2.958 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594204716 521469586 /nfs/dbraw/zinc/46/95/86/521469586.db2.gz XOKHXFBGRJYQLV-FUHWJXTLSA-N 1 1 369.425 2.527 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000602779974 521528051 /nfs/dbraw/zinc/52/80/51/521528051.db2.gz NVMKNFKUMAKVPE-SFHVURJKSA-N 1 1 372.404 2.694 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](c1cnn(C)c1)c1cccc(F)c1 ZINC000602779974 521528058 /nfs/dbraw/zinc/52/80/58/521528058.db2.gz NVMKNFKUMAKVPE-SFHVURJKSA-N 1 1 372.404 2.694 20 5 FFBDMO Cn1cc(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)c([N+](=O)[O-])n1 ZINC000602828841 521557580 /nfs/dbraw/zinc/55/75/80/521557580.db2.gz VHEXWMDQNMJSRC-ZDUSSCGKSA-N 1 1 366.219 2.727 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000602844494 521565106 /nfs/dbraw/zinc/56/51/06/521565106.db2.gz VBYCSUWJEXWYCG-GOSISDBHSA-N 1 1 356.426 2.953 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@H]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000619863436 521908994 /nfs/dbraw/zinc/90/89/94/521908994.db2.gz FUDKKTIACPVLER-LPHOPBHVSA-N 1 1 374.441 2.625 20 5 FFBDMO COc1cc(C)c(C[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000024803248 536568588 /nfs/dbraw/zinc/56/85/88/536568588.db2.gz UJULNFUKRYJWFT-UHFFFAOYSA-N 1 1 373.409 2.651 20 5 FFBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC ZINC000024803248 536568597 /nfs/dbraw/zinc/56/85/97/536568597.db2.gz UJULNFUKRYJWFT-UHFFFAOYSA-N 1 1 373.409 2.651 20 5 FFBDMO C[C@@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC000485396629 561318386 /nfs/dbraw/zinc/31/83/86/561318386.db2.gz XMROFSWLRPXXMK-AWEZNQCLSA-N 1 1 373.432 2.844 20 5 FFBDMO CN1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)CC1 ZINC000485403099 561318493 /nfs/dbraw/zinc/31/84/93/561318493.db2.gz JEEWPUFMZMJKNG-UHFFFAOYSA-N 1 1 373.432 2.845 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473517944 561051762 /nfs/dbraw/zinc/05/17/62/561051762.db2.gz CIFKNWHXESOXLR-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO C[C@@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000736027063 598676050 /nfs/dbraw/zinc/67/60/50/598676050.db2.gz WNHUJVOSJQGDBX-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO C[N@@H+](CC=Cc1ccccc1[N+](=O)[O-])Cc1ccc(-c2nn[nH]n2)cc1 ZINC000825914778 608524363 /nfs/dbraw/zinc/52/43/63/608524363.db2.gz NUSVAEYUBKCCET-GQCTYLIASA-N 1 1 350.382 2.920 20 5 FFBDMO Cc1nc(Cl)nc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1[N+](=O)[O-] ZINC001164725138 720331765 /nfs/dbraw/zinc/33/17/65/720331765.db2.gz LVLHYICCHOSDSM-KBPBESRZSA-N 1 1 374.832 2.595 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[C@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727969 720334717 /nfs/dbraw/zinc/33/47/17/720334717.db2.gz VBYBQTGYGFJGHJ-GJZGRUSLSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[C@@H]2[C@@H]1CC[N@H+]2Cc1cccnc1 ZINC001164727319 720349085 /nfs/dbraw/zinc/34/90/85/720349085.db2.gz SUNFDVAHRDOQTI-KGLIPLIRSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCC3(CC[N@@H+](Cc4cccnc4)C3)CC2)n1 ZINC001164952005 722014660 /nfs/dbraw/zinc/01/46/60/722014660.db2.gz FSHMAZLSWDBONC-UHFFFAOYSA-N 1 1 353.426 2.877 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000159144740 728901564 /nfs/dbraw/zinc/90/15/64/728901564.db2.gz ZQHUTIDDTCVHAQ-VHSXEESVSA-N 1 1 356.220 2.570 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000744411603 735352978 /nfs/dbraw/zinc/35/29/78/735352978.db2.gz PZIFWICWHPMFOV-CQSZACIVSA-N 1 1 368.865 2.993 20 5 FFBDMO CC[N@@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000042137079 727953778 /nfs/dbraw/zinc/95/37/78/727953778.db2.gz AVRSEKXXAPJNGN-VMPITWQZSA-N 1 1 358.423 2.503 20 5 FFBDMO CC[N@H+]1CCc2nc(NC(=O)C=Cc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000042137079 727953783 /nfs/dbraw/zinc/95/37/83/727953783.db2.gz AVRSEKXXAPJNGN-VMPITWQZSA-N 1 1 358.423 2.503 20 5 FFBDMO Cc1cc(NS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])cc[nH+]1 ZINC000096487894 728481126 /nfs/dbraw/zinc/48/11/26/728481126.db2.gz IRTHUEDECQODDF-UHFFFAOYSA-N 1 1 372.200 2.862 20 5 FFBDMO C[N@H+](CCO)[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000126625027 728704318 /nfs/dbraw/zinc/70/43/18/728704318.db2.gz PCWJPVVVSAIFLR-MRXNPFEDSA-N 1 1 363.801 2.852 20 5 FFBDMO C[N@@H+](CCO)[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000126625027 728704319 /nfs/dbraw/zinc/70/43/19/728704319.db2.gz PCWJPVVVSAIFLR-MRXNPFEDSA-N 1 1 363.801 2.852 20 5 FFBDMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000127269794 728705877 /nfs/dbraw/zinc/70/58/77/728705877.db2.gz YHUALRLNKFAUBD-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000858292936 730421937 /nfs/dbraw/zinc/42/19/37/730421937.db2.gz OHRYEJKXRUDVKH-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)ON=C(N)[C@H]1C[N@H+](C(C)C)CCO1 ZINC000779651029 738474627 /nfs/dbraw/zinc/47/46/27/738474627.db2.gz BTSWGFDUOHBACY-CZUORRHYSA-N 1 1 350.419 2.572 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)ON=C(N)[C@H]1C[N@@H+](C(C)C)CCO1 ZINC000779651029 738474628 /nfs/dbraw/zinc/47/46/28/738474628.db2.gz BTSWGFDUOHBACY-CZUORRHYSA-N 1 1 350.419 2.572 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000863295259 730764852 /nfs/dbraw/zinc/76/48/52/730764852.db2.gz XIDKYSIKYGFDTF-IKGGRYGDSA-N 1 1 361.467 2.838 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@]3(CCOC3)C2)o1 ZINC000878185144 732495318 /nfs/dbraw/zinc/49/53/18/732495318.db2.gz FGSKWXNNIATWFI-MRXNPFEDSA-N 1 1 364.789 2.911 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419274 732699774 /nfs/dbraw/zinc/69/97/74/732699774.db2.gz LCELFTSNRKJPLC-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419274 732699777 /nfs/dbraw/zinc/69/97/77/732699777.db2.gz LCELFTSNRKJPLC-INWMFGNUSA-N 1 1 367.833 2.812 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000879561706 732723631 /nfs/dbraw/zinc/72/36/31/732723631.db2.gz SLWYFZSPQIARIF-QWHCGFSZSA-N 1 1 365.455 2.617 20 5 FFBDMO CCOc1cc(NC(=O)NCC[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000888831788 734103362 /nfs/dbraw/zinc/10/33/62/734103362.db2.gz PJTQVCNWQILEFM-ZDUSSCGKSA-N 1 1 350.419 2.847 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082301 738817318 /nfs/dbraw/zinc/81/73/18/738817318.db2.gz QOVRSANIHALXBJ-YPMHNXCESA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1Cl ZINC000928082301 738817324 /nfs/dbraw/zinc/81/73/24/738817324.db2.gz QOVRSANIHALXBJ-YPMHNXCESA-N 1 1 355.847 2.558 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)cc1Cl ZINC000928081281 738817505 /nfs/dbraw/zinc/81/75/05/738817505.db2.gz RMDPXSJXZXNBBR-DZGCQCFKSA-N 1 1 369.874 2.866 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cc1Cl ZINC000928081281 738817510 /nfs/dbraw/zinc/81/75/10/738817510.db2.gz RMDPXSJXZXNBBR-DZGCQCFKSA-N 1 1 369.874 2.866 20 5 FFBDMO CSc1ccc(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928104551 738825544 /nfs/dbraw/zinc/82/55/44/738825544.db2.gz VZUWCALUWWYBQW-TZMCWYRMSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cc1[N+](=O)[O-] ZINC000928104551 738825548 /nfs/dbraw/zinc/82/55/48/738825548.db2.gz VZUWCALUWWYBQW-TZMCWYRMSA-N 1 1 367.496 2.626 20 5 FFBDMO O=[N+]([O-])c1cc2c(ncnc2N[C@H]2CCC[N@H+]3CCSC[C@H]23)s1 ZINC000895570238 735025723 /nfs/dbraw/zinc/02/57/23/735025723.db2.gz RPMCMYZRWRQWEZ-WDEREUQCSA-N 1 1 351.457 2.591 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000739437334 735051644 /nfs/dbraw/zinc/05/16/44/735051644.db2.gz MJXKHTOALNHBRD-KRWDZBQOSA-N 1 1 364.515 2.866 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[NH+](C2CCC2)CC1 ZINC000740868560 735093843 /nfs/dbraw/zinc/09/38/43/735093843.db2.gz NAPLUBYLPBSTFO-UHFFFAOYSA-N 1 1 351.378 2.585 20 5 FFBDMO C[N@H+]1CCCN(C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)CC1 ZINC000899936552 735570989 /nfs/dbraw/zinc/57/09/89/735570989.db2.gz ZOYHPYKQCCZVRS-UHFFFAOYSA-N 1 1 350.177 2.818 20 5 FFBDMO CC[N@H+]1CCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000754389009 736154988 /nfs/dbraw/zinc/15/49/88/736154988.db2.gz XOPULNIVZMGOGF-VXGBXAGGSA-N 1 1 354.838 2.601 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000756963375 736377978 /nfs/dbraw/zinc/37/79/78/736377978.db2.gz AAUIDXZMBFKDKH-GFCCVEGCSA-N 1 1 354.838 2.779 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000907793134 736668082 /nfs/dbraw/zinc/66/80/82/736668082.db2.gz JSJZNTLAPYNPAF-CVEARBPZSA-N 1 1 369.824 2.826 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2Br)CC1 ZINC000760866306 736675699 /nfs/dbraw/zinc/67/56/99/736675699.db2.gz KGSWCVFNHIRWRD-UHFFFAOYSA-N 1 1 368.231 2.739 20 5 FFBDMO O=C(N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000764300360 737009915 /nfs/dbraw/zinc/00/99/15/737009915.db2.gz ZHWHFZHKNCGCRR-HUUCEWRRSA-N 1 1 367.833 2.621 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000910285417 737053066 /nfs/dbraw/zinc/05/30/66/737053066.db2.gz YSZVSSPAUNPWOV-LLVKDONJSA-N 1 1 357.357 2.753 20 5 FFBDMO Cc1sc(C(=O)N2CCC(C[N@H+](CCO)C(C)C)CC2)cc1[N+](=O)[O-] ZINC000910857819 737140297 /nfs/dbraw/zinc/14/02/97/737140297.db2.gz XBRKQQKMYCMMHN-UHFFFAOYSA-N 1 1 369.487 2.520 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1)CC2 ZINC000913384791 737396522 /nfs/dbraw/zinc/39/65/22/737396522.db2.gz GCPQZTIASCTPID-NSHDSACASA-N 1 1 366.780 2.771 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000916022619 737672624 /nfs/dbraw/zinc/67/26/24/737672624.db2.gz MFPZNPOMVCACAO-NSHDSACASA-N 1 1 357.867 2.524 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000771940514 737768248 /nfs/dbraw/zinc/76/82/48/737768248.db2.gz ULQDZTUCWOKACJ-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000771940514 737768252 /nfs/dbraw/zinc/76/82/52/737768252.db2.gz ULQDZTUCWOKACJ-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880870 738135195 /nfs/dbraw/zinc/13/51/95/738135195.db2.gz RNRDKVBNMJADKA-ZIAGYGMSSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775880870 738135198 /nfs/dbraw/zinc/13/51/98/738135198.db2.gz RNRDKVBNMJADKA-ZIAGYGMSSA-N 1 1 356.806 2.791 20 5 FFBDMO C[C@H](NC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1 ZINC000922643840 738178639 /nfs/dbraw/zinc/17/86/39/738178639.db2.gz BVYCFPQPSSROPY-APHBMKBZSA-N 1 1 364.471 2.535 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000923276694 738265243 /nfs/dbraw/zinc/26/52/43/738265243.db2.gz HIPXVVFFZZURRI-QWHCGFSZSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000923284678 738266473 /nfs/dbraw/zinc/26/64/73/738266473.db2.gz RKLVPWMACUJEKE-CMPLNLGQSA-N 1 1 368.231 2.666 20 5 FFBDMO COc1cc(CN2CC[C@H](C[NH3+])[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000923501770 738292758 /nfs/dbraw/zinc/29/27/58/738292758.db2.gz VHNXNQQJDDPSSP-WDEREUQCSA-N 1 1 359.373 2.622 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N[C@@H]2CCn3cc[nH+]c3C2)cc1Cl ZINC000777801634 738321446 /nfs/dbraw/zinc/32/14/46/738321446.db2.gz JCEHCKPHWXFNQK-SECBINFHSA-N 1 1 350.762 2.658 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCS[C@H]4COCC[C@H]43)c2)c1 ZINC000777963200 738335759 /nfs/dbraw/zinc/33/57/59/738335759.db2.gz IDFGLOMOXRFWEV-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3CCS[C@H]4COCC[C@H]43)c2)c1 ZINC000777963200 738335762 /nfs/dbraw/zinc/33/57/62/738335762.db2.gz IDFGLOMOXRFWEV-SJORKVTESA-N 1 1 360.439 2.622 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000785741173 738994343 /nfs/dbraw/zinc/99/43/43/738994343.db2.gz FOWHIDKLNPVCCQ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000785741173 738994345 /nfs/dbraw/zinc/99/43/45/738994345.db2.gz FOWHIDKLNPVCCQ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C[C@H]2C1 ZINC000930769774 739160212 /nfs/dbraw/zinc/16/02/12/739160212.db2.gz ORMWJCBOEXGTSZ-AOOOYVTPSA-N 1 1 358.320 2.639 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018155 739374049 /nfs/dbraw/zinc/37/40/49/739374049.db2.gz AXWNSWKTTRVRIC-HWPZZCPQSA-N 1 1 355.341 2.584 20 5 FFBDMO C[C@@]1([C@@H]2CCC[N@@H+](Cc3c(F)cc([N+](=O)[O-])cc3F)C2)COC(=O)N1 ZINC000932018155 739374052 /nfs/dbraw/zinc/37/40/52/739374052.db2.gz AXWNSWKTTRVRIC-HWPZZCPQSA-N 1 1 355.341 2.584 20 5 FFBDMO CO[C@@H]1CC[C@@H]1[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107650 739731777 /nfs/dbraw/zinc/73/17/77/739731777.db2.gz XNXTVPSKQHRMDC-WCQYABFASA-N 1 1 352.778 2.907 20 5 FFBDMO CO[C@@H]1CC[C@@H]1[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000934107650 739731780 /nfs/dbraw/zinc/73/17/80/739731780.db2.gz XNXTVPSKQHRMDC-WCQYABFASA-N 1 1 352.778 2.907 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000934392850 739780479 /nfs/dbraw/zinc/78/04/79/739780479.db2.gz CYLOKQWSEZAZSV-NEPJUHHUSA-N 1 1 351.834 2.922 20 5 FFBDMO CC(C)C[N@@H+](C)CN1Cc2cc(Br)c([N+](=O)[O-])cc2C1=O ZINC000795411609 740017891 /nfs/dbraw/zinc/01/78/91/740017891.db2.gz AFUFIIBOSZVZQX-UHFFFAOYSA-N 1 1 356.220 2.858 20 5 FFBDMO CN(C)C(=O)OC[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000796548518 740152165 /nfs/dbraw/zinc/15/21/65/740152165.db2.gz NIDAUGKSAYPPHU-HNNXBMFYSA-N 1 1 351.403 2.526 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](Cc1ccsc1)CC2 ZINC000957547363 740545466 /nfs/dbraw/zinc/54/54/66/740545466.db2.gz CZVVIAORSXNAKG-HZPDHXFCSA-N 1 1 363.483 2.618 20 5 FFBDMO COC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965029 741367490 /nfs/dbraw/zinc/36/74/90/741367490.db2.gz XVGUMENCUAWBBA-CQSZACIVSA-N 1 1 365.213 2.959 20 5 FFBDMO COc1cc(COC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000810704896 741442934 /nfs/dbraw/zinc/44/29/34/741442934.db2.gz WWWSGPLBEVBAQY-QGZVFWFLSA-N 1 1 354.378 2.859 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000811583844 741540536 /nfs/dbraw/zinc/54/05/36/741540536.db2.gz CCFLGXJAMHRYBF-NSHDSACASA-N 1 1 352.391 2.662 20 5 FFBDMO O=C(COc1ccsc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171278 741684537 /nfs/dbraw/zinc/68/45/37/741684537.db2.gz HXVVZRAOWDSOPU-HNNXBMFYSA-N 1 1 362.407 2.853 20 5 FFBDMO O=C(COc1ccsc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171278 741684538 /nfs/dbraw/zinc/68/45/38/741684538.db2.gz HXVVZRAOWDSOPU-HNNXBMFYSA-N 1 1 362.407 2.853 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000815315357 741924464 /nfs/dbraw/zinc/92/44/64/741924464.db2.gz CDNQEAHYHBYXQQ-HNNXBMFYSA-N 1 1 355.822 2.934 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000815315357 741924466 /nfs/dbraw/zinc/92/44/66/741924466.db2.gz CDNQEAHYHBYXQQ-HNNXBMFYSA-N 1 1 355.822 2.934 20 5 FFBDMO CC1(C)CCC(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC000997771377 742024734 /nfs/dbraw/zinc/02/47/34/742024734.db2.gz GVHLDVHMTLKENX-IAGOWNOFSA-N 1 1 351.491 2.696 20 5 FFBDMO Cc1cc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)cs1 ZINC001000155525 742077891 /nfs/dbraw/zinc/07/78/91/742077891.db2.gz SGHORZUKUOPVLM-HZPDHXFCSA-N 1 1 363.483 2.583 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000818972177 742317712 /nfs/dbraw/zinc/31/77/12/742317712.db2.gz TUQRNICFYIVJRP-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000818972177 742317719 /nfs/dbraw/zinc/31/77/19/742317719.db2.gz TUQRNICFYIVJRP-SNVBAGLBSA-N 1 1 374.210 2.663 20 5 FFBDMO CC[C@@](C)(C(=O)OC)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000823503512 742928638 /nfs/dbraw/zinc/92/86/38/742928638.db2.gz UGGZPJWUNDKVDP-WMZOPIPTSA-N 1 1 350.415 2.682 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)CC[C@H]21 ZINC000827296193 743549801 /nfs/dbraw/zinc/54/98/01/743549801.db2.gz CUGGXENDNKZWTD-QMTHXVAHSA-N 1 1 357.332 2.780 20 5 FFBDMO CCn1cc([C@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cn1 ZINC000832310217 745675856 /nfs/dbraw/zinc/67/58/56/745675856.db2.gz PCFHWAPYYZIHPV-JTQLQIEISA-N 1 1 351.794 2.754 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1Cl ZINC000836271702 746179125 /nfs/dbraw/zinc/17/91/25/746179125.db2.gz NMVHKAMYUIIZHU-BETUJISGSA-N 1 1 369.849 2.786 20 5 FFBDMO CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000837436459 746445382 /nfs/dbraw/zinc/44/53/82/746445382.db2.gz BEFKYOSOKPPSMY-CYBMUJFWSA-N 1 1 351.359 2.923 20 5 FFBDMO CC[N@@H+](CC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)C1CC1 ZINC000839864378 746946260 /nfs/dbraw/zinc/94/62/60/746946260.db2.gz RVFAKHZZXRPXPX-AWEZNQCLSA-N 1 1 363.311 2.938 20 5 FFBDMO COCC[N@@H+]1CCN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000844950031 748143702 /nfs/dbraw/zinc/14/37/02/748143702.db2.gz ZIRPHOGNUKMSMQ-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO COCC[N@H+]1CCN(C(=O)c2cc(Cl)c(C)cc2[N+](=O)[O-])C(C)(C)C1 ZINC000844950031 748143704 /nfs/dbraw/zinc/14/37/04/748143704.db2.gz ZIRPHOGNUKMSMQ-UHFFFAOYSA-N 1 1 369.849 2.739 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)OC[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC000845818495 748331026 /nfs/dbraw/zinc/33/10/26/748331026.db2.gz USWKFRKBZCUDOB-OLZOCXBDSA-N 1 1 368.455 2.830 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000847256366 748663159 /nfs/dbraw/zinc/66/31/59/748663159.db2.gz PQAUIAJXFKYYSM-CABCVRRESA-N 1 1 353.369 2.820 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1 ZINC000848768313 749003552 /nfs/dbraw/zinc/00/35/52/749003552.db2.gz XXSRFKQEFDZTCV-DTWKUNHWSA-N 1 1 365.739 2.522 20 5 FFBDMO Cc1noc(C[N@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000851864787 749709735 /nfs/dbraw/zinc/70/97/35/749709735.db2.gz KFRCJVSNRLBBPI-JQWIXIFHSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2C[C@H](CNC(=O)OC(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000851864787 749709739 /nfs/dbraw/zinc/70/97/39/749709739.db2.gz KFRCJVSNRLBBPI-JQWIXIFHSA-N 1 1 354.407 2.626 20 5 FFBDMO COC(CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1)OC ZINC000852204098 749801403 /nfs/dbraw/zinc/80/14/03/749801403.db2.gz KMRIHPKWIXIYDE-WKILWMFISA-N 1 1 352.431 2.709 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+](CCN2CCOCC2)CC2CC2)c1 ZINC000852634689 749910517 /nfs/dbraw/zinc/91/05/17/749910517.db2.gz AHADMNJJVQPHKV-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+](CCN2CCOCC2)CC2CC2)c1 ZINC000852634689 749910520 /nfs/dbraw/zinc/91/05/20/749910520.db2.gz AHADMNJJVQPHKV-UHFFFAOYSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000852707356 749930377 /nfs/dbraw/zinc/93/03/77/749930377.db2.gz GSDTVRMQQOCIRE-AWEZNQCLSA-N 1 1 374.268 2.933 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000852715377 749930974 /nfs/dbraw/zinc/93/09/74/749930974.db2.gz KOSHWTKGFSSTGH-UHFFFAOYSA-N 1 1 356.854 2.897 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)c1F ZINC000854735303 750361339 /nfs/dbraw/zinc/36/13/39/750361339.db2.gz NARIDLIPUIBSHP-QGZVFWFLSA-N 1 1 353.369 2.739 20 5 FFBDMO C[N@H+]1CC[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000895842501 970992925 /nfs/dbraw/zinc/99/29/25/970992925.db2.gz GKQFZQFDKGXGPL-OALUTQOASA-N 1 1 353.422 2.947 20 5 FFBDMO CN(C(=O)CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000134896523 960100664 /nfs/dbraw/zinc/10/06/64/960100664.db2.gz WNZXZSBSQSZGGJ-BEFAXECRSA-N 1 1 372.469 2.506 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000825624449 1013257729 /nfs/dbraw/zinc/25/77/29/1013257729.db2.gz MOUDSUDXLCRDTJ-UHFFFAOYSA-N 1 1 366.437 2.746 20 5 FFBDMO COc1ccc(C)cc1C[NH+]1CCN(Cn2nc(C)c([N+](=O)[O-])c2C)CC1 ZINC000023854193 963956747 /nfs/dbraw/zinc/95/67/47/963956747.db2.gz CDBLCAVMQNGJGJ-UHFFFAOYSA-N 1 1 373.457 2.500 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(CN2CC[NH+](Cc3ccc(O)cc3)CC2)c(F)c1 ZINC001175533386 1013501565 /nfs/dbraw/zinc/50/15/65/1013501565.db2.gz VYSVXIRNDSQGRY-UHFFFAOYSA-N 1 1 363.364 2.896 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(OCCOC(C)C)CC2)c1[N+](=O)[O-] ZINC000894773252 965675837 /nfs/dbraw/zinc/67/58/37/965675837.db2.gz RBBUGYKGKABUGW-UHFFFAOYSA-N 1 1 368.430 2.715 20 5 FFBDMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000895005297 967151016 /nfs/dbraw/zinc/15/10/16/967151016.db2.gz WYXWEVQTOQVBML-LQOHYYORSA-N 1 1 351.406 2.737 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@]1(CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC001176958881 1013812692 /nfs/dbraw/zinc/81/26/92/1013812692.db2.gz JPJHULZDZGBROR-HXUWFJFHSA-N 1 1 369.421 2.541 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@]1(CO)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC001176958881 1013812699 /nfs/dbraw/zinc/81/26/99/1013812699.db2.gz JPJHULZDZGBROR-HXUWFJFHSA-N 1 1 369.421 2.541 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000311580635 970061185 /nfs/dbraw/zinc/06/11/85/970061185.db2.gz CPVXRIBCPNKFHJ-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311580635 970061192 /nfs/dbraw/zinc/06/11/92/970061192.db2.gz CPVXRIBCPNKFHJ-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000311580635 970061201 /nfs/dbraw/zinc/06/12/01/970061201.db2.gz CPVXRIBCPNKFHJ-XLIONFOSSA-N 1 1 355.438 2.740 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(CC(=O)OCC)cc2[N+](=O)[O-])C1 ZINC000825791132 1014026479 /nfs/dbraw/zinc/02/64/79/1014026479.db2.gz ZWAMYQMFRIPQDI-INIZCTEOSA-N 1 1 363.458 2.869 20 5 FFBDMO C[C@H](CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1ccccc1[N+](=O)[O-] ZINC000897058133 973203514 /nfs/dbraw/zinc/20/35/14/973203514.db2.gz MHJQQQRKPIDAGX-JZWPEALZSA-N 1 1 360.458 2.965 20 5 FFBDMO C[C@@H](CNC(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000897064523 973215674 /nfs/dbraw/zinc/21/56/74/973215674.db2.gz YZWKKIVIQPHWLT-CABCVRRESA-N 1 1 360.458 2.824 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825827643 1014092375 /nfs/dbraw/zinc/09/23/75/1014092375.db2.gz WZOYLLWBUYIQMR-PBHICJAKSA-N 1 1 363.458 2.645 20 5 FFBDMO CC(C)(C)Oc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-] ZINC000897221810 973461166 /nfs/dbraw/zinc/46/11/66/973461166.db2.gz OWVNAUDDDQJVKT-JKSUJKDBSA-N 1 1 363.458 2.808 20 5 FFBDMO CC(C)(C)CCC[NH2+]C[C@H]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001271764301 974308151 /nfs/dbraw/zinc/30/81/51/974308151.db2.gz KQDWFBGEHYGHKC-QBPKDAKJSA-N 1 1 353.507 2.990 20 5 FFBDMO COC(=O)c1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1C ZINC001167778995 974334168 /nfs/dbraw/zinc/33/41/68/974334168.db2.gz NRDYZFKLOQPBLX-OAHLLOKOSA-N 1 1 370.409 2.771 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000825887745 1014306288 /nfs/dbraw/zinc/30/62/88/1014306288.db2.gz QTZQNKUJBGKYPH-GOSISDBHSA-N 1 1 363.458 2.599 20 5 FFBDMO CCCCNC(=O)C1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1 ZINC000042095120 976745429 /nfs/dbraw/zinc/74/54/29/976745429.db2.gz LSLLGXFJSHMHDY-UHFFFAOYSA-N 1 1 359.430 2.530 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC000899199339 977009978 /nfs/dbraw/zinc/00/99/78/977009978.db2.gz HDNQCHXQMVLBMW-HOTGVXAUSA-N 1 1 354.410 2.639 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1=CCCCC1)C2 ZINC000982279009 977376258 /nfs/dbraw/zinc/37/62/58/977376258.db2.gz XTGMHPSJPMZXNM-LFGUQSLTSA-N 1 1 361.486 2.713 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CCC1=CCCCC1)C2 ZINC000982279009 977376263 /nfs/dbraw/zinc/37/62/63/977376263.db2.gz XTGMHPSJPMZXNM-LFGUQSLTSA-N 1 1 361.486 2.713 20 5 FFBDMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1=CCCCC1)C2 ZINC000982279009 977376268 /nfs/dbraw/zinc/37/62/68/977376268.db2.gz XTGMHPSJPMZXNM-LFGUQSLTSA-N 1 1 361.486 2.713 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000905715997 980496173 /nfs/dbraw/zinc/49/61/73/980496173.db2.gz NHLBCRXCQPZRBY-CQSZACIVSA-N 1 1 354.414 2.824 20 5 FFBDMO CO[C@H]1C[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877686908 1014678526 /nfs/dbraw/zinc/67/85/26/1014678526.db2.gz ATCVMPLETVOBRQ-OALUTQOASA-N 1 1 368.437 2.642 20 5 FFBDMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC000908249041 981399761 /nfs/dbraw/zinc/39/97/61/981399761.db2.gz JVEDGUKYRDHJTM-KSSFIOAISA-N 1 1 356.426 2.752 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3c([N+](=O)[O-])c1N)C2 ZINC000897877068 982542155 /nfs/dbraw/zinc/54/21/55/982542155.db2.gz SXUBKCCIKZVNHR-FQEVSTJZSA-N 1 1 368.437 2.888 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCC[N@H+](C)CC2)cc1 ZINC000046403977 984675522 /nfs/dbraw/zinc/67/55/22/984675522.db2.gz DLYZGVVQLLAABA-UHFFFAOYSA-N 1 1 369.425 2.692 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765055868 984947959 /nfs/dbraw/zinc/94/79/59/984947959.db2.gz PYDSQYZBTMVBRQ-AWEZNQCLSA-N 1 1 354.414 2.509 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765084592 984956401 /nfs/dbraw/zinc/95/64/01/984956401.db2.gz WEDJSFZCPNKNSV-UGSOOPFHSA-N 1 1 354.414 2.990 20 5 FFBDMO Cc1nn(C[NH+]2CCC(N3CCCCC3=O)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000765079286 984959232 /nfs/dbraw/zinc/95/92/32/984959232.db2.gz QIDHTKSKXFDLNG-UHFFFAOYSA-N 1 1 371.441 2.687 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547055 985877611 /nfs/dbraw/zinc/87/76/11/985877611.db2.gz VDODDESSZBNWOG-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1(C)C ZINC000173547055 985877617 /nfs/dbraw/zinc/87/76/17/985877617.db2.gz VDODDESSZBNWOG-CRAIPNDOSA-N 1 1 359.430 2.946 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CC[NH+](CCCCCO)CC2)cc1[N+](=O)[O-] ZINC000913692781 986839298 /nfs/dbraw/zinc/83/92/98/986839298.db2.gz AUNKUDRKKBYQIC-UHFFFAOYSA-N 1 1 363.458 2.639 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373094097 990715345 /nfs/dbraw/zinc/71/53/45/990715345.db2.gz FFXQIIPFJBEYRY-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000373094097 990715348 /nfs/dbraw/zinc/71/53/48/990715348.db2.gz FFXQIIPFJBEYRY-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO O=C(NCC1C[NH+](Cc2ccc(-c3ccccc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001031660524 990855147 /nfs/dbraw/zinc/85/51/47/990855147.db2.gz JWWIYGTVJBRWIP-WOJBJXKFSA-N 1 1 365.433 2.567 20 5 FFBDMO CC(C)c1ccc(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC000940107850 991933648 /nfs/dbraw/zinc/93/36/48/991933648.db2.gz QZIKGKPDTPYCBU-QZTJIDSGSA-N 1 1 359.470 2.946 20 5 FFBDMO CC1([NH2+]Cc2ccc(C3CC3)cc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000940107685 991933694 /nfs/dbraw/zinc/93/36/94/991933694.db2.gz OMOYYHRTSHNRIA-QZTJIDSGSA-N 1 1 357.454 2.700 20 5 FFBDMO O=C(N[C@H]1C[C@H](C[NH2+]CCc2ccc3ccccc3c2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001485683418 991991049 /nfs/dbraw/zinc/99/10/49/991991049.db2.gz QDLMINZNAQQCQO-HUYLIWGRSA-N 1 1 367.449 2.532 20 5 FFBDMO Cc1noc(CN2C[C@@H]3C[N@@H+](Cc4ccccc4)C[C@]3(C)C2)c1[N+](=O)[O-] ZINC000880023236 1015735015 /nfs/dbraw/zinc/73/50/15/1015735015.db2.gz VAFQUAXBZNUJJC-QFBILLFUSA-N 1 1 356.426 2.845 20 5 FFBDMO O=C1[C@H]([NH+]2CCC3(CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880455602 1015838945 /nfs/dbraw/zinc/83/89/45/1015838945.db2.gz BNMPMTNEERKPMF-QGZVFWFLSA-N 1 1 359.426 2.735 20 5 FFBDMO O=C(/C=C/c1cccnc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172017 995632247 /nfs/dbraw/zinc/63/22/47/995632247.db2.gz ZPWDHNSHCJJUKE-DKFQHHCZSA-N 1 1 353.378 2.821 20 5 FFBDMO O=C(/C=C/c1cccnc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172017 995632252 /nfs/dbraw/zinc/63/22/52/995632252.db2.gz ZPWDHNSHCJJUKE-DKFQHHCZSA-N 1 1 353.378 2.821 20 5 FFBDMO O=C(CCc1ccncc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172910 995633782 /nfs/dbraw/zinc/63/37/82/995633782.db2.gz SSGURMCSAUWEPB-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(CCc1ccncc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172910 995633785 /nfs/dbraw/zinc/63/37/85/995633785.db2.gz SSGURMCSAUWEPB-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO C[NH+]1CCN([C@H](C(=O)OCc2ccc([N+](=O)[O-])cc2)c2ccccc2)CC1 ZINC000727747500 995940474 /nfs/dbraw/zinc/94/04/74/995940474.db2.gz XRLYJYUBAIREBZ-IBGZPJMESA-N 1 1 369.421 2.627 20 5 FFBDMO CN(C)c1cc(F)c(C(=O)N2CCC(c3cnc[nH]3)CC2)cc1[N+](=O)[O-] ZINC000826733296 1016042511 /nfs/dbraw/zinc/04/25/11/1016042511.db2.gz GRSZNGNZTUDZEZ-UHFFFAOYSA-N 1 1 361.377 2.543 20 5 FFBDMO COc1c(C(=O)N2CC[NH2+][C@H](c3ccccc3C)C2)cccc1[N+](=O)[O-] ZINC000825163281 997253789 /nfs/dbraw/zinc/25/37/89/997253789.db2.gz VPVBCGDUPIZGMI-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000825389874 997333525 /nfs/dbraw/zinc/33/35/25/997333525.db2.gz VZPUTLMCUBYERC-DKSSEZFCSA-N 1 1 369.421 2.580 20 5 FFBDMO Cc1cc(N2CCC[C@@H](OC(=O)Cc3ccccc3[N+](=O)[O-])C2)nc(C)[nH+]1 ZINC000731299180 997798456 /nfs/dbraw/zinc/79/84/56/997798456.db2.gz KRRXIDIHTGLJFM-MRXNPFEDSA-N 1 1 370.409 2.756 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC[NH+](C2CCC2)CC1 ZINC000733276682 998945959 /nfs/dbraw/zinc/94/59/59/998945959.db2.gz VEWMSYNGRBTEDN-UHFFFAOYSA-N 1 1 358.442 2.505 20 5 FFBDMO Cc1c(NC(=O)CCN2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074356 /nfs/dbraw/zinc/07/43/56/999074356.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@]3(C)CN(C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074360 /nfs/dbraw/zinc/07/43/60/999074360.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@]3(C)CN(C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000823755628 999074363 /nfs/dbraw/zinc/07/43/63/999074363.db2.gz UZBUEFWPCLERTO-KDURUIRLSA-N 1 1 360.458 2.505 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)[NH+]1[C@H](C)CC[C@H]1C ZINC000741022165 999703514 /nfs/dbraw/zinc/70/35/14/999703514.db2.gz QKPLKQSGJOBHKD-MCIONIFRSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741024154 999704270 /nfs/dbraw/zinc/70/42/70/999704270.db2.gz RCXHVFNRGVRNSB-JHJVBQTASA-N 1 1 374.397 2.949 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1 ZINC000742423415 999773488 /nfs/dbraw/zinc/77/34/88/999773488.db2.gz PQVOWLLCHCYXKD-AWEZNQCLSA-N 1 1 353.382 2.842 20 5 FFBDMO O=C(Nc1ccccn1)[C@@H]1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000742588506 999779090 /nfs/dbraw/zinc/77/90/90/999779090.db2.gz PPOZAZQRAPQUFC-OAHLLOKOSA-N 1 1 370.409 2.719 20 5 FFBDMO CC(C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000745088436 999891525 /nfs/dbraw/zinc/89/15/25/999891525.db2.gz NXKKTJTZQPYTIJ-BBRMVZONSA-N 1 1 363.414 2.585 20 5 FFBDMO C[NH+](C)CC(=O)Nc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000745179236 999898277 /nfs/dbraw/zinc/89/82/77/999898277.db2.gz VNLJINQOXQVSSN-UHFFFAOYSA-N 1 1 373.438 2.904 20 5 FFBDMO CC(C)(C)OC(=O)N1C[C@@H]2C[N@@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CC[C@@H]2C1 ZINC001169010583 1000015444 /nfs/dbraw/zinc/01/54/44/1000015444.db2.gz DVBRXITVXODCRJ-FZKCQIBNSA-N 1 1 353.463 2.621 20 5 FFBDMO CC(C)(C)OC(=O)N1CC2(C1)CCC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169035901 1000016548 /nfs/dbraw/zinc/01/65/48/1000016548.db2.gz MFILNIGVFBKUHA-LSDHHAIUSA-N 1 1 353.463 2.765 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCO[C@H]3[C@H](OCC4CCCC4)CC[C@@H]32)C1 ZINC001169025140 1000018071 /nfs/dbraw/zinc/01/80/71/1000018071.db2.gz XUGAKPVNMMPPLI-ZWJWXYIHSA-N 1 1 352.475 2.870 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117231 1000100353 /nfs/dbraw/zinc/10/03/53/1000100353.db2.gz CDSCAIKMLPAHND-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1ccc(N)c([N+](=O)[O-])c1 ZINC000767117231 1000100355 /nfs/dbraw/zinc/10/03/55/1000100355.db2.gz CDSCAIKMLPAHND-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000768501262 1000268173 /nfs/dbraw/zinc/26/81/73/1000268173.db2.gz HTUWXCSYZJYUMM-LPHOPBHVSA-N 1 1 355.442 2.832 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2cc3ccccc3s2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001000676254 1016423021 /nfs/dbraw/zinc/42/30/21/1016423021.db2.gz ZTTXLNRXZIKVCE-IAGOWNOFSA-N 1 1 371.462 2.815 20 5 FFBDMO O=C(NCC1=CC[N@H+](Cc2cc3ccccc3s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000676254 1016423032 /nfs/dbraw/zinc/42/30/32/1016423032.db2.gz ZTTXLNRXZIKVCE-IAGOWNOFSA-N 1 1 371.462 2.815 20 5 FFBDMO O=C(NCC1=CC[N@@H+](Cc2cc3ccccc3s2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000676254 1016423037 /nfs/dbraw/zinc/42/30/37/1016423037.db2.gz ZTTXLNRXZIKVCE-IAGOWNOFSA-N 1 1 371.462 2.815 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@H](F)C1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170513 1000838419 /nfs/dbraw/zinc/83/84/19/1000838419.db2.gz AKSHHPVAFBACPF-BBRMVZONSA-N 1 1 353.419 2.603 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](F)C1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC001147170513 1000838427 /nfs/dbraw/zinc/83/84/27/1000838427.db2.gz AKSHHPVAFBACPF-BBRMVZONSA-N 1 1 353.419 2.603 20 5 FFBDMO Cc1ccc(NCCCNC(=O)[C@H]2CC[C@H]3CCCC[N@H+]32)c([N+](=O)[O-])c1 ZINC001147330725 1000872729 /nfs/dbraw/zinc/87/27/29/1000872729.db2.gz CJAOBOIGJWJMTN-NVXWUHKLSA-N 1 1 360.458 2.838 20 5 FFBDMO CN(CC(=O)OC[C@H]1CCC[N@H+]1Cc1ccco1)c1ccccc1[N+](=O)[O-] ZINC000772691002 1001635588 /nfs/dbraw/zinc/63/55/88/1001635588.db2.gz NGPFMGZVZSJGKJ-OAHLLOKOSA-N 1 1 373.409 2.832 20 5 FFBDMO Cc1nccn1CCC[N@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000746628466 1001655770 /nfs/dbraw/zinc/65/57/70/1001655770.db2.gz VHWVDKRGMODDPO-UHFFFAOYSA-N 1 1 354.414 2.943 20 5 FFBDMO O=C1OCCN1[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000826995182 1016552769 /nfs/dbraw/zinc/55/27/69/1016552769.db2.gz QZFDUSQVZWIPGP-OAHLLOKOSA-N 1 1 357.366 2.881 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000791060779 1002566191 /nfs/dbraw/zinc/56/61/91/1002566191.db2.gz MTJXKMFKLVGGNM-HNNXBMFYSA-N 1 1 364.402 2.662 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000791217973 1002610054 /nfs/dbraw/zinc/61/00/54/1002610054.db2.gz HATCDIYBYXBQSM-CYBMUJFWSA-N 1 1 366.437 2.794 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC001184729861 1002708343 /nfs/dbraw/zinc/70/83/43/1002708343.db2.gz POAIJCYJMVPKOD-OKILXGFUSA-N 1 1 365.430 2.601 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(Cc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC001170336514 1003119557 /nfs/dbraw/zinc/11/95/57/1003119557.db2.gz YJLYBSDTHWBHKC-INIZCTEOSA-N 1 1 370.453 2.747 20 5 FFBDMO COc1ccc(C[C@H](C)[NH+]2CCN(c3ncccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170356261 1003122543 /nfs/dbraw/zinc/12/25/43/1003122543.db2.gz ZXCXPLIHEVQHDY-AWEZNQCLSA-N 1 1 374.416 2.891 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339905 1003129646 /nfs/dbraw/zinc/12/96/46/1003129646.db2.gz KRUIZILUKCRKDN-CABCVRRESA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@H]1Cn2ccnc2C[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170339905 1003129651 /nfs/dbraw/zinc/12/96/51/1003129651.db2.gz KRUIZILUKCRKDN-CABCVRRESA-N 1 1 374.441 2.509 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCC[C@]3(CCCC(=O)N3)C2)c([N+](=O)[O-])c1 ZINC001170341083 1003129673 /nfs/dbraw/zinc/12/96/73/1003129673.db2.gz NEEDQVBKEIKCFU-IFXJQAMLSA-N 1 1 361.442 2.669 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])C[C@@H]2C1 ZINC000793924248 1003526852 /nfs/dbraw/zinc/52/68/52/1003526852.db2.gz CPTPBFUSYSBBQP-CVEARBPZSA-N 1 1 366.421 2.681 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1N1CC[NH+](Cc2ccc3c(c2)OCCO3)CC1 ZINC000747203851 1003754455 /nfs/dbraw/zinc/75/44/55/1003754455.db2.gz NGKFQLMOFFRKPI-UHFFFAOYSA-N 1 1 369.421 2.997 20 5 FFBDMO C[C@@](CO)([NH2+]CC(=O)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC001196909322 1004010582 /nfs/dbraw/zinc/01/05/82/1004010582.db2.gz URBBFPIYXCVOPG-KRWDZBQOSA-N 1 1 363.801 2.684 20 5 FFBDMO CCN1CCN([C@@H](C)C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001199257772 1004887946 /nfs/dbraw/zinc/88/79/46/1004887946.db2.gz HTUKHOZRJXEHLU-INIZCTEOSA-N 1 1 372.469 2.970 20 5 FFBDMO C[N@@H+](Cc1cccc(F)c1)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001050245067 1016928556 /nfs/dbraw/zinc/92/85/56/1016928556.db2.gz YGSXNWKXEFIWCW-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO C[N@H+](Cc1cccc(F)c1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245067 1016928565 /nfs/dbraw/zinc/92/85/65/1016928565.db2.gz YGSXNWKXEFIWCW-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO C[N@@H+](Cc1cccc(F)c1)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001050245067 1016928581 /nfs/dbraw/zinc/92/85/81/1016928581.db2.gz YGSXNWKXEFIWCW-RTBURBONSA-N 1 1 371.412 2.739 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]CC2CCC3(CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326267 1016970839 /nfs/dbraw/zinc/97/08/39/1016970839.db2.gz VJDXNUFLEOZAHF-VDHUWJSZSA-N 1 1 363.502 2.887 20 5 FFBDMO CC(C)(CO)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccnc1 ZINC000852092292 1005940994 /nfs/dbraw/zinc/94/09/94/1005940994.db2.gz OYZHUIKEYGKZQV-MRXNPFEDSA-N 1 1 360.370 2.747 20 5 FFBDMO CC[N@H+](Cc1ccc(C(=O)N(C)C)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582085 1005963209 /nfs/dbraw/zinc/96/32/09/1005963209.db2.gz PSMSVJYIQAHBMF-LJQANCHMSA-N 1 1 371.437 2.852 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000776594196 1006009880 /nfs/dbraw/zinc/00/98/80/1006009880.db2.gz YIVGBAOCERKHGZ-PMACEKPBSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)cc1 ZINC000776594196 1006009890 /nfs/dbraw/zinc/00/98/90/1006009890.db2.gz YIVGBAOCERKHGZ-PMACEKPBSA-N 1 1 354.406 2.802 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000813824386 1006046132 /nfs/dbraw/zinc/04/61/32/1006046132.db2.gz YCAFVTAHLDVJSP-SJKOYZFVSA-N 1 1 372.400 2.709 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cc([N+](=O)[O-])c(-c4ccccn4)n3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000853516008 1006422983 /nfs/dbraw/zinc/42/29/83/1006422983.db2.gz IJBQGRQAYSLGJS-QZNHQWIBSA-N 1 1 351.410 2.955 20 5 FFBDMO CC1(C)CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2Br)C1 ZINC001134811375 1006487610 /nfs/dbraw/zinc/48/76/10/1006487610.db2.gz VHVAMZFJAGONST-UHFFFAOYSA-N 1 1 370.247 2.819 20 5 FFBDMO Cc1cc(C(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000111631323 1006545240 /nfs/dbraw/zinc/54/52/40/1006545240.db2.gz BQHBKYRPYICCOK-CQSZACIVSA-N 1 1 356.426 2.736 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162889 1032163423 /nfs/dbraw/zinc/16/34/23/1032163423.db2.gz YZXHORPIWLIYLZ-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001116162889 1032163430 /nfs/dbraw/zinc/16/34/30/1032163430.db2.gz YZXHORPIWLIYLZ-CZUORRHYSA-N 1 1 363.414 2.730 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])OCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000817179094 1007457759 /nfs/dbraw/zinc/45/77/59/1007457759.db2.gz VUHAOCOHAFGZPE-UHFFFAOYSA-N 1 1 370.405 2.713 20 5 FFBDMO CC(C)c1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000885882247 1007819073 /nfs/dbraw/zinc/81/90/73/1007819073.db2.gz GKJYTANMRNAWKJ-INIZCTEOSA-N 1 1 361.442 2.701 20 5 FFBDMO Cc1nn(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)c(C)c1[N+](=O)[O-] ZINC000819897943 1008245513 /nfs/dbraw/zinc/24/55/13/1008245513.db2.gz WLLWNXHTXULOEF-ZWKOTPCHSA-N 1 1 355.442 2.572 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccc(N(C)C(C)=O)cc2)c([N+](=O)[O-])cc1O ZINC000858251361 1008333721 /nfs/dbraw/zinc/33/37/21/1008333721.db2.gz VUNQLFBLPLKHLN-UHFFFAOYSA-N 1 1 359.382 2.582 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](c3ncccn3)C2)c1 ZINC000886690604 1008824745 /nfs/dbraw/zinc/82/47/45/1008824745.db2.gz YUFDGIPFLDSHOU-AWEZNQCLSA-N 1 1 356.382 2.551 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](c3ncccn3)C2)c1 ZINC000886690604 1008824756 /nfs/dbraw/zinc/82/47/56/1008824756.db2.gz YUFDGIPFLDSHOU-AWEZNQCLSA-N 1 1 356.382 2.551 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1cccc(Cl)c1)[C@@H]1CC1[N+](=O)[O-] ZINC001178458585 1008994654 /nfs/dbraw/zinc/99/46/54/1008994654.db2.gz MYWWRYOGJGQYHS-HZPDHXFCSA-N 1 1 353.850 2.771 20 5 FFBDMO C[N@@H+](C[C@](C)(O)c1ccccc1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000823597794 1009135063 /nfs/dbraw/zinc/13/50/63/1009135063.db2.gz BLPUHQYQSWCAFB-QUCCMNQESA-N 1 1 369.421 2.540 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598052 1009135505 /nfs/dbraw/zinc/13/55/05/1009135505.db2.gz FFLKCIIOPQWKMJ-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598052 1009135514 /nfs/dbraw/zinc/13/55/14/1009135514.db2.gz FFLKCIIOPQWKMJ-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC000823938774 1009287322 /nfs/dbraw/zinc/28/73/22/1009287322.db2.gz NSEVPMYSAPNSBL-CYBMUJFWSA-N 1 1 357.414 2.819 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cccc1[N+](=O)[O-] ZINC000118866639 1009788177 /nfs/dbraw/zinc/78/81/77/1009788177.db2.gz PNXPFUCWXVTPPS-AWEZNQCLSA-N 1 1 357.370 2.893 20 5 FFBDMO CC(C)CC[C@H]([NH3+])c1nc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)no1 ZINC000863675781 1010284675 /nfs/dbraw/zinc/28/46/75/1010284675.db2.gz YRILWCNDLSBBHA-LBPRGKRZSA-N 1 1 357.374 2.662 20 5 FFBDMO C[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)[C@@H]1CCC(C)(C)C1 ZINC000794683252 1010469763 /nfs/dbraw/zinc/46/97/63/1010469763.db2.gz CQYDBBZIQYTKJW-OAHLLOKOSA-N 1 1 360.414 2.831 20 5 FFBDMO O=C1NCCN1Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000865815494 1010868276 /nfs/dbraw/zinc/86/82/76/1010868276.db2.gz BBXRRZHSKBBSFP-UHFFFAOYSA-N 1 1 358.373 2.549 20 5 FFBDMO O=[N+]([O-])c1cc(CO)c(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1F ZINC000865889745 1010882876 /nfs/dbraw/zinc/88/28/76/1010882876.db2.gz OSGDXAVQHUZNBW-MGPUTAFESA-N 1 1 371.412 2.937 20 5 FFBDMO Cn1nccc1[C@H](O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000865961665 1010896541 /nfs/dbraw/zinc/89/65/41/1010896541.db2.gz VBHRJDWFGFEEQY-LJQANCHMSA-N 1 1 367.409 2.827 20 5 FFBDMO CC(C)[C@H](C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])N1CCN(C)CC1 ZINC000866226181 1010955707 /nfs/dbraw/zinc/95/57/07/1010955707.db2.gz HCLLTTOKXJVHMZ-BEFAXECRSA-N 1 1 366.481 2.527 20 5 FFBDMO COc1ccc([C@@H]2CCN(C(=O)[C@@](C)([NH3+])c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000867954430 1011130681 /nfs/dbraw/zinc/13/06/81/1011130681.db2.gz MWGJIBRIUDSKGH-QRWLVFNGSA-N 1 1 369.421 2.793 20 5 FFBDMO COc1ccc(CCCN(C)C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1 ZINC000867954397 1011130823 /nfs/dbraw/zinc/13/08/23/1011130823.db2.gz MROGNEKWCFSRPA-HXUWFJFHSA-N 1 1 371.437 2.869 20 5 FFBDMO Cc1ccc(CNC(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000869055864 1011589539 /nfs/dbraw/zinc/58/95/39/1011589539.db2.gz XPMLSFBZPRIFTM-KRWDZBQOSA-N 1 1 360.458 2.824 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000869306180 1011718981 /nfs/dbraw/zinc/71/89/81/1011718981.db2.gz FHXMMKXJKQXYQM-INIZCTEOSA-N 1 1 357.385 2.667 20 5 FFBDMO CCC(=O)c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1 ZINC000795074022 1011756328 /nfs/dbraw/zinc/75/63/28/1011756328.db2.gz IBJCHQMHPXEJBC-MRXNPFEDSA-N 1 1 361.442 2.879 20 5 FFBDMO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907655 1012079430 /nfs/dbraw/zinc/07/94/30/1012079430.db2.gz LERMWRGDNSGUHN-GFBDMGBSSA-N 1 1 369.465 2.929 20 5 FFBDMO CN1C[C@]2(CC1=O)CCCC[N@H+]2[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908886 1012081362 /nfs/dbraw/zinc/08/13/62/1012081362.db2.gz OUPLGBACSOHGRD-YLJYHZDGSA-N 1 1 357.454 2.929 20 5 FFBDMO O=C1CCC[C@@]2(CCC[N@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C2)N1 ZINC001172910547 1012122616 /nfs/dbraw/zinc/12/26/16/1012122616.db2.gz YWRLWKLMWMCXQE-PXNSSMCTSA-N 1 1 357.454 2.977 20 5 FFBDMO CCOC(=O)C1=C(O)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172911666 1012126478 /nfs/dbraw/zinc/12/64/78/1012126478.db2.gz UUKMKJCXNPSPBS-FUHWJXTLSA-N 1 1 374.437 2.686 20 5 FFBDMO COC(=O)[C@@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(C)C ZINC001173011399 1012181754 /nfs/dbraw/zinc/18/17/54/1012181754.db2.gz CKMFODCGZQQUGA-HNNXBMFYSA-N 1 1 371.384 2.629 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870140714 1012189774 /nfs/dbraw/zinc/18/97/74/1012189774.db2.gz KRFIFYAUOHCAGH-QGZVFWFLSA-N 1 1 359.357 2.529 20 5 FFBDMO CC1(C)COCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017661 1012190068 /nfs/dbraw/zinc/19/00/68/1012190068.db2.gz IPXPDUZOXQYKND-UHFFFAOYSA-N 1 1 355.385 2.953 20 5 FFBDMO CC(C)OC1C[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173020515 1012192115 /nfs/dbraw/zinc/19/21/15/1012192115.db2.gz UKDOBIXYYKZQOF-UHFFFAOYSA-N 1 1 355.385 2.951 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ncc(Cl)cn2)c1F ZINC001173189737 1012333131 /nfs/dbraw/zinc/33/31/31/1012333131.db2.gz QHYQHVZKQRACCO-SECBINFHSA-N 1 1 354.769 2.907 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H]3CCCC(=O)[C@@H]3C2)c1F ZINC001173194674 1012339020 /nfs/dbraw/zinc/33/90/20/1012339020.db2.gz YBLREOFAKGAITN-SGMGOOAPSA-N 1 1 350.390 2.975 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](NC(=O)c2cccnc2)C1 ZINC001173238503 1012386912 /nfs/dbraw/zinc/38/69/12/1012386912.db2.gz UFPWXCKJPPUMOU-CRAIPNDOSA-N 1 1 368.437 2.815 20 5 FFBDMO CC(=O)Oc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1 ZINC000123222822 1012487719 /nfs/dbraw/zinc/48/77/19/1012487719.db2.gz NFOSAZJNMCPSBU-OAHLLOKOSA-N 1 1 356.382 2.602 20 5 FFBDMO O=C(OC1CC(n2cc([N+](=O)[O-])cn2)C1)[C@@H]1CCC[N@@H+]1Cc1ccccc1 ZINC000870828380 1012582450 /nfs/dbraw/zinc/58/24/50/1012582450.db2.gz PSRJTPYELSLHBP-VJFUWPCTSA-N 1 1 370.409 2.703 20 5 FFBDMO O=C(OC1CC(n2cc([N+](=O)[O-])cn2)C1)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000870828380 1012582462 /nfs/dbraw/zinc/58/24/62/1012582462.db2.gz PSRJTPYELSLHBP-VJFUWPCTSA-N 1 1 370.409 2.703 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000748344525 1017113443 /nfs/dbraw/zinc/11/34/43/1017113443.db2.gz CJMUTIYQXCQNBY-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000748344525 1017113446 /nfs/dbraw/zinc/11/34/46/1017113446.db2.gz CJMUTIYQXCQNBY-OAHLLOKOSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H](NC(=O)N(C)C[C@H]1CCc2[nH+]ccn2C1)c1ccc([N+](=O)[O-])cc1 ZINC000925244813 1017676762 /nfs/dbraw/zinc/67/67/62/1017676762.db2.gz YXDAZWXOXCHNFR-ZIAGYGMSSA-N 1 1 357.414 2.756 20 5 FFBDMO COCC[C@H]1CCN(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288650 1020055536 /nfs/dbraw/zinc/05/55/36/1020055536.db2.gz FDNPTEYBCLQZIB-IAGOWNOFSA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[C@H]1CCN(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288650 1020055548 /nfs/dbraw/zinc/05/55/48/1020055548.db2.gz FDNPTEYBCLQZIB-IAGOWNOFSA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[C@H]1CCN(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288656 1020055653 /nfs/dbraw/zinc/05/56/53/1020055653.db2.gz FDNPTEYBCLQZIB-SJORKVTESA-N 1 1 361.442 2.617 20 5 FFBDMO COCC[C@H]1CCN(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O ZINC000902288656 1020055667 /nfs/dbraw/zinc/05/56/67/1020055667.db2.gz FDNPTEYBCLQZIB-SJORKVTESA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1nn(C[NH+]2CCC(N3CCCOC3=O)CC2)c2ccc([N+](=O)[O-])cc12 ZINC000902594983 1020325313 /nfs/dbraw/zinc/32/53/13/1020325313.db2.gz XZVQTDHTKWIWKO-UHFFFAOYSA-N 1 1 373.413 2.517 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2c[nH]c3ncccc23)C1 ZINC000931373480 1020443107 /nfs/dbraw/zinc/44/31/07/1020443107.db2.gz ZZBULEURNUDEAP-AWEZNQCLSA-N 1 1 354.414 2.856 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1 ZINC000931796556 1020590467 /nfs/dbraw/zinc/59/04/67/1020590467.db2.gz OGJOOOAFSOUKSC-AZUAARDMSA-N 1 1 364.405 2.999 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCc3nc[nH]c3[C@H]2c2ccccc2)cc1 ZINC000931796556 1020590475 /nfs/dbraw/zinc/59/04/75/1020590475.db2.gz OGJOOOAFSOUKSC-AZUAARDMSA-N 1 1 364.405 2.999 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000932142644 1020721786 /nfs/dbraw/zinc/72/17/86/1020721786.db2.gz GZSVSJVSWWGODQ-CYBMUJFWSA-N 1 1 357.414 2.535 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](C2CCOCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000933082651 1020955547 /nfs/dbraw/zinc/95/55/47/1020955547.db2.gz YCOCKRFBKYZBLO-KRWDZBQOSA-N 1 1 373.453 2.623 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]([C@H]2CCCO2)C1 ZINC000933183228 1020974299 /nfs/dbraw/zinc/97/42/99/1020974299.db2.gz OCGPNSNNMJPLQT-XOKHGSTOSA-N 1 1 366.389 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]([C@H]2CCCO2)C1 ZINC000933183228 1020974303 /nfs/dbraw/zinc/97/43/03/1020974303.db2.gz OCGPNSNNMJPLQT-XOKHGSTOSA-N 1 1 366.389 2.667 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000749951955 1021161386 /nfs/dbraw/zinc/16/13/86/1021161386.db2.gz RGTVWBBXHFJARA-UHFFFAOYSA-N 1 1 355.398 2.789 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001116331450 1021168558 /nfs/dbraw/zinc/16/85/58/1021168558.db2.gz QDWCLFVZAMLKFT-SCLBCKFNSA-N 1 1 358.442 2.725 20 5 FFBDMO C[N@@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001116374423 1021183575 /nfs/dbraw/zinc/18/35/75/1021183575.db2.gz IGKNBNNCJNJSMR-PKOBYXMFSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(F)cc1 ZINC001116374423 1021183580 /nfs/dbraw/zinc/18/35/80/1021183580.db2.gz IGKNBNNCJNJSMR-PKOBYXMFSA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1cn(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c(=O)n1-c1ccccc1[N+](=O)[O-] ZINC000749978705 1021186114 /nfs/dbraw/zinc/18/61/14/1021186114.db2.gz VWJMBMUDSLJUHS-IYBDPMFKSA-N 1 1 356.426 2.935 20 5 FFBDMO COc1ccc([C@@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)nc1 ZINC000934344949 1021203341 /nfs/dbraw/zinc/20/33/41/1021203341.db2.gz IFFOIBUUSGZDKV-KXBFYZLASA-N 1 1 373.409 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@@H](Cc4ccccc4)[C@H](O)C3)nc2c1 ZINC000934436800 1021241169 /nfs/dbraw/zinc/24/11/69/1021241169.db2.gz CDJLAIOZDDVCCB-RHSMWYFYSA-N 1 1 353.378 2.771 20 5 FFBDMO O=c1oc2cc(O)ccc2c2oc3cc(O[C@@H]4C[NH2+]CCOC4)ccc3c21 ZINC001218041941 1032967521 /nfs/dbraw/zinc/96/75/21/1032967521.db2.gz JNFKNYIIGGOLSU-CYBMUJFWSA-N 1 1 367.357 2.765 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[NH+](C(C)(C)C)CC1 ZINC001116844751 1021449752 /nfs/dbraw/zinc/44/97/52/1021449752.db2.gz VFELAACYQCOPBX-UHFFFAOYSA-N 1 1 355.822 2.955 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829349783 1033114084 /nfs/dbraw/zinc/11/40/84/1033114084.db2.gz IRHNVVMNVDRYHS-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@]1(O)CCc2ccccc21 ZINC000829349783 1033114092 /nfs/dbraw/zinc/11/40/92/1033114092.db2.gz IRHNVVMNVDRYHS-FQEVSTJZSA-N 1 1 369.421 2.608 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H]2Cn2cnc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000755794480 1023637547 /nfs/dbraw/zinc/63/75/47/1023637547.db2.gz UAQLQAMHGBNCBB-HNNXBMFYSA-N 1 1 354.414 2.880 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)c(C)c1[N+](=O)[O-] ZINC000755794480 1023637551 /nfs/dbraw/zinc/63/75/51/1023637551.db2.gz UAQLQAMHGBNCBB-HNNXBMFYSA-N 1 1 354.414 2.880 20 5 FFBDMO CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000756611831 1023734828 /nfs/dbraw/zinc/73/48/28/1023734828.db2.gz SXSBHCVENZAGLZ-INIZCTEOSA-N 1 1 365.430 2.569 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC000756611831 1023734831 /nfs/dbraw/zinc/73/48/31/1023734831.db2.gz SXSBHCVENZAGLZ-INIZCTEOSA-N 1 1 365.430 2.569 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1F ZINC000829456331 1033160167 /nfs/dbraw/zinc/16/01/67/1033160167.db2.gz UQERKIQPQJFXEG-CYBMUJFWSA-N 1 1 367.396 2.985 20 5 FFBDMO CC/C=C/CC[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001101540552 1024884474 /nfs/dbraw/zinc/88/44/74/1024884474.db2.gz JIWIKDGPJIMKEM-SDKBWNRFSA-N 1 1 351.491 2.862 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)c1 ZINC000246202584 1025871426 /nfs/dbraw/zinc/87/14/26/1025871426.db2.gz BEFQZYZZWWFTNH-PMACEKPBSA-N 1 1 356.422 2.962 20 5 FFBDMO Cc1[nH+]ccn1CCCCOC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000838100834 1026208591 /nfs/dbraw/zinc/20/85/91/1026208591.db2.gz GUYDWMVAUBMYPH-UHFFFAOYSA-N 1 1 369.381 2.923 20 5 FFBDMO O=C1[C@H]2CCC[C@@H]2CN1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000840014459 1026912706 /nfs/dbraw/zinc/91/27/06/1026912706.db2.gz IFWLOOMINMDDQY-KDOFPFPSSA-N 1 1 359.426 2.654 20 5 FFBDMO COC[C@@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840126712 1026969604 /nfs/dbraw/zinc/96/96/04/1026969604.db2.gz QMUDIFVLOJUKMI-APWZRJJASA-N 1 1 361.442 2.617 20 5 FFBDMO COC[C@@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840126712 1026969610 /nfs/dbraw/zinc/96/96/10/1026969610.db2.gz QMUDIFVLOJUKMI-APWZRJJASA-N 1 1 361.442 2.617 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+]1Cc1ccccc1 ZINC000840522016 1027103105 /nfs/dbraw/zinc/10/31/05/1027103105.db2.gz LOLVTHRXLKWDRD-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1Cc1ccccc1 ZINC000840522016 1027103110 /nfs/dbraw/zinc/10/31/10/1027103110.db2.gz LOLVTHRXLKWDRD-CYBMUJFWSA-N 1 1 372.400 2.663 20 5 FFBDMO O=[N+]([O-])c1cc(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)ccn1 ZINC001213025689 1027807152 /nfs/dbraw/zinc/80/71/52/1027807152.db2.gz NRKAPTOTDWJGSX-UHFFFAOYSA-N 1 1 367.365 2.539 20 5 FFBDMO O=C1CN(C[NH+]2CCC3(CCC3)CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000795720534 1028005900 /nfs/dbraw/zinc/00/59/00/1028005900.db2.gz UGMGWIZZJITBJX-UHFFFAOYSA-N 1 1 358.398 2.587 20 5 FFBDMO Cc1nc(Cl)c([N+](=O)[O-])c(NC2CC[NH+](CC(=O)C(C)(C)C)CC2)n1 ZINC001161118877 1028020377 /nfs/dbraw/zinc/02/03/77/1028020377.db2.gz PDYYLWIGHLRCLH-UHFFFAOYSA-N 1 1 369.853 2.838 20 5 FFBDMO Nc1ccc2n(-c3cc[nH+]c(N4CCOCC4)c3)c3ccccc3cc-2c1=O ZINC001212997103 1028640574 /nfs/dbraw/zinc/64/05/74/1028640574.db2.gz URALYYLSNNBMFT-UHFFFAOYSA-N 1 1 372.428 2.909 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H]2CC[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC001163371323 1028907653 /nfs/dbraw/zinc/90/76/53/1028907653.db2.gz ONXQOCOZUPGKEB-OCCSQVGLSA-N 1 1 350.419 2.697 20 5 FFBDMO Cc1nc(N2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@@]3(C)C2)ncc1[N+](=O)[O-] ZINC001164084074 1029167966 /nfs/dbraw/zinc/16/79/66/1029167966.db2.gz CLPDSTRJKCYLNI-APWZRJJASA-N 1 1 353.426 2.652 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1F ZINC001164486908 1029295086 /nfs/dbraw/zinc/29/50/86/1029295086.db2.gz SLRVCGFQLLCNQW-ARFHVFGLSA-N 1 1 372.400 2.690 20 5 FFBDMO Cc1ccc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC001164494252 1029297451 /nfs/dbraw/zinc/29/74/51/1029297451.db2.gz BBBNPXCLRHCBCS-GDBMZVCRSA-N 1 1 365.861 2.690 20 5 FFBDMO CC[N@@H+]([C@@H]1CCOC1)C1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1 ZINC001165113229 1029400194 /nfs/dbraw/zinc/40/01/94/1029400194.db2.gz PKPWBAHSYZZCOM-OAHLLOKOSA-N 1 1 371.441 2.618 20 5 FFBDMO COc1cc(C)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)n1 ZINC000781895576 1029459339 /nfs/dbraw/zinc/45/93/39/1029459339.db2.gz VPUAELIBCPABDK-UHFFFAOYSA-N 1 1 356.426 2.937 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@H](Cc3ccncc3)C2)nc1-c1ccncc1 ZINC000782292006 1029644451 /nfs/dbraw/zinc/64/44/51/1029644451.db2.gz UKHYBTLJRIEMJE-MRXNPFEDSA-N 1 1 364.409 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CC[C@@H](Cc4ccncc4)C3)n2)cc1 ZINC000782293097 1029645578 /nfs/dbraw/zinc/64/55/78/1029645578.db2.gz XEUHRJVIVZVRNJ-INIZCTEOSA-N 1 1 364.409 2.770 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3ccc(-c4ccc([N+](=O)[O-])cc4)nn3)C[C@H]2C1 ZINC001157690380 1029646722 /nfs/dbraw/zinc/64/67/22/1029646722.db2.gz DKLYQICQJAATFE-IYBDPMFKSA-N 1 1 353.426 2.830 20 5 FFBDMO C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC001165200068 1029887636 /nfs/dbraw/zinc/88/76/36/1029887636.db2.gz AXTLKXFJIPZBKG-KGLIPLIRSA-N 1 1 371.397 2.997 20 5 FFBDMO Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1C[C@H](C)[N@H+](Cc2ccccc2)C[C@H]1C ZINC001165202301 1029888286 /nfs/dbraw/zinc/88/82/86/1029888286.db2.gz MHVVUUQMGARVTF-LSDHHAIUSA-N 1 1 356.426 2.636 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001142221483 1030181107 /nfs/dbraw/zinc/18/11/07/1030181107.db2.gz FGGBLTJMDFYMNU-KGLIPLIRSA-N 1 1 371.441 2.835 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1nc3ccccc3cc1[N+](=O)[O-])CC2 ZINC001166033290 1030213560 /nfs/dbraw/zinc/21/35/60/1030213560.db2.gz SZECGSLUMONQOK-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO COc1cc(C[NH2+]Cc2cc3c([nH]c2=O)CCCC3)c([N+](=O)[O-])cc1O ZINC001203427978 1030693306 /nfs/dbraw/zinc/69/33/06/1030693306.db2.gz JGHSLIOSWYEQSR-UHFFFAOYSA-N 1 1 359.382 2.578 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)CCN1c1ccccc1[N+](=O)[O-] ZINC000842620101 1030835755 /nfs/dbraw/zinc/83/57/55/1030835755.db2.gz YRTATGJDMZCBII-HZPDHXFCSA-N 1 1 374.441 2.685 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOC1CCOCC1 ZINC001203793884 1030896196 /nfs/dbraw/zinc/89/61/96/1030896196.db2.gz OQNYMAGITPHPII-UHFFFAOYSA-N 1 1 359.220 2.643 20 5 FFBDMO C[C@@]1(CNc2ccc3ncc([N+](=O)[O-])n3n2)CC[N@@H+](Cc2ccccc2)C1 ZINC000798400800 1031392286 /nfs/dbraw/zinc/39/22/86/1031392286.db2.gz DDQPCCUMGBANHA-IBGZPJMESA-N 1 1 366.425 2.962 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000843475039 1031419473 /nfs/dbraw/zinc/41/94/73/1031419473.db2.gz WPAXNALIPHXOEH-YFWYWMRJSA-N 1 1 367.405 2.790 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195195 1031692388 /nfs/dbraw/zinc/69/23/88/1031692388.db2.gz WRJASIOZGTZHPS-KGLIPLIRSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195195 1031692394 /nfs/dbraw/zinc/69/23/94/1031692394.db2.gz WRJASIOZGTZHPS-KGLIPLIRSA-N 1 1 370.409 2.815 20 5 FFBDMO CCOc1cc(NC(=O)NCc2c[nH+]c3n2CCCC3)ccc1[N+](=O)[O-] ZINC001219317693 1033597547 /nfs/dbraw/zinc/59/75/47/1033597547.db2.gz JSTJEVWBPOGEPD-UHFFFAOYSA-N 1 1 359.386 2.848 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001220409124 1034155939 /nfs/dbraw/zinc/15/59/39/1034155939.db2.gz ABQPNTYMEOMVGF-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC001220409124 1034155948 /nfs/dbraw/zinc/15/59/48/1034155948.db2.gz ABQPNTYMEOMVGF-OKILXGFUSA-N 1 1 364.446 2.913 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001226164046 1034553985 /nfs/dbraw/zinc/55/39/85/1034553985.db2.gz GFXBNOKTICKHIF-MRXNPFEDSA-N 1 1 355.394 2.737 20 5 FFBDMO C[C@H](c1ccccn1)[N@H+]1CCC[C@@H](Oc2ncc([N+](=O)[O-])c3nc[nH]c32)C1 ZINC001227692262 1035675529 /nfs/dbraw/zinc/67/55/29/1035675529.db2.gz VQNJGUXVZNIZBF-CHWSQXEVSA-N 1 1 368.397 2.866 20 5 FFBDMO O=[N+]([O-])c1cnc(O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c2[nH]cnc21 ZINC001227693135 1035677955 /nfs/dbraw/zinc/67/79/55/1035677955.db2.gz LWDSNJCECCRTHS-AWEZNQCLSA-N 1 1 353.382 2.910 20 5 FFBDMO O=[N+]([O-])c1c[nH]c(O[C@H]2CCC[N@H+](Cc3ccccc3)C2)c2ncnc1-2 ZINC001227693135 1035677961 /nfs/dbraw/zinc/67/79/61/1035677961.db2.gz LWDSNJCECCRTHS-AWEZNQCLSA-N 1 1 353.382 2.910 20 5 FFBDMO O=[N+]([O-])c1c[nH]c(O[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c2ncnc1-2 ZINC001227693135 1035677969 /nfs/dbraw/zinc/67/79/69/1035677969.db2.gz LWDSNJCECCRTHS-AWEZNQCLSA-N 1 1 353.382 2.910 20 5 FFBDMO Cc1cc2nc3nc(=O)[n-]c(O[C@H]4C[C@H]5CC[C@@H](C4)[N@@H+]5C)c3nc2cc1C ZINC001228687435 1036256853 /nfs/dbraw/zinc/25/68/53/1036256853.db2.gz WNWHYIVETNLIBD-WDNDVIMCSA-N 1 1 365.437 2.899 20 5 FFBDMO Cc1ccc(CNC(=O)NCC[N@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001229726989 1036851827 /nfs/dbraw/zinc/85/18/27/1036851827.db2.gz PNQHJVNDOZWCNV-UHFFFAOYSA-N 1 1 374.416 2.974 20 5 FFBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3n[nH]cc3NC(C)=O)C2)cc1[N+](=O)[O-] ZINC000501713421 1037055184 /nfs/dbraw/zinc/05/51/84/1037055184.db2.gz IGLBOHVEGUONEQ-CQSZACIVSA-N 1 1 373.413 2.665 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001230316387 1037217255 /nfs/dbraw/zinc/21/72/55/1037217255.db2.gz VYLVJUNTHOWDHK-OAHLLOKOSA-N 1 1 373.365 2.783 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001230316387 1037217257 /nfs/dbraw/zinc/21/72/57/1037217257.db2.gz VYLVJUNTHOWDHK-OAHLLOKOSA-N 1 1 373.365 2.783 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001234881089 1037222596 /nfs/dbraw/zinc/22/25/96/1037222596.db2.gz LWWJWORCRLFULJ-MRXNPFEDSA-N 1 1 373.409 2.668 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1O[C@H]1C[NH+]2CCC1CC2 ZINC001231236693 1037508622 /nfs/dbraw/zinc/50/86/22/1037508622.db2.gz OZVWNIRDXGKGHI-LBPRGKRZSA-N 1 1 361.276 2.995 20 5 FFBDMO COc1cc(N2CCC(N3CC[NH+](C4CCC4)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093357 1038380453 /nfs/dbraw/zinc/38/04/53/1038380453.db2.gz KNUDBFHEVCEDTF-UHFFFAOYSA-N 1 1 374.485 2.742 20 5 FFBDMO COC(=O)c1c(-c2nc3ccc(C[NH+](C)C)cc3[nH]2)cccc1[N+](=O)[O-] ZINC001251307247 1039060528 /nfs/dbraw/zinc/06/05/28/1039060528.db2.gz OHMIJIURVXPIJN-UHFFFAOYSA-N 1 1 354.366 2.986 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC001258012635 1039110749 /nfs/dbraw/zinc/11/07/49/1039110749.db2.gz QVHVKBAJTVNXAZ-CSEUZHBESA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(/C=C/c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC001258012635 1039110760 /nfs/dbraw/zinc/11/07/60/1039110760.db2.gz QVHVKBAJTVNXAZ-CSEUZHBESA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H]1C[NH+](CCc2nnc([C@H]3N=Nc4ccc([N+](=O)[O-])cc43)o2)C[C@@H](C)O1 ZINC001258090117 1039163889 /nfs/dbraw/zinc/16/38/89/1039163889.db2.gz CSNOMFQBRDQYNQ-UVWXRNBGSA-N 1 1 372.385 2.816 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC[C@@H]1CSCC[N@H+]1Cc1ccccc1 ZINC001258133893 1039211063 /nfs/dbraw/zinc/21/10/63/1039211063.db2.gz LVBPWNBVSKJPPU-MRXNPFEDSA-N 1 1 358.467 2.750 20 5 FFBDMO COC(=O)c1cccc(-c2nc3ccc(C[NH+](C)C)cc3[nH]2)c1[N+](=O)[O-] ZINC001251638969 1039220373 /nfs/dbraw/zinc/22/03/73/1039220373.db2.gz TYNKBVWUTLHQJS-UHFFFAOYSA-N 1 1 354.366 2.986 20 5 FFBDMO COc1cc(N2CCC([N@H+]3C[C@H](C)CC[C@H]3CN)CC2)ccc1[N+](=O)[O-] ZINC001246555913 1039395771 /nfs/dbraw/zinc/39/57/71/1039395771.db2.gz INGQHGQDNATJBQ-PBHICJAKSA-N 1 1 362.474 2.631 20 5 FFBDMO COc1cc(N2CCC(N3C[C@H](C)CC[C@H]3C[NH3+])CC2)ccc1[N+](=O)[O-] ZINC001246555913 1039395782 /nfs/dbraw/zinc/39/57/82/1039395782.db2.gz INGQHGQDNATJBQ-PBHICJAKSA-N 1 1 362.474 2.631 20 5 FFBDMO Cc1c(C(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cnn1-c1cc[nH+]cc1 ZINC001537558530 1070208973 /nfs/dbraw/zinc/20/89/73/1070208973.db2.gz FDLPJZNUJMRLPT-GFCCVEGCSA-N 1 1 351.366 2.975 20 5 FFBDMO CC[C@H]1CNCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246805164 1039487089 /nfs/dbraw/zinc/48/70/89/1039487089.db2.gz RGGJKODJIFCPBA-LBPRGKRZSA-N 1 1 354.401 2.526 20 5 FFBDMO CC[C@H]1CNCC[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001246805164 1039487096 /nfs/dbraw/zinc/48/70/96/1039487096.db2.gz RGGJKODJIFCPBA-LBPRGKRZSA-N 1 1 354.401 2.526 20 5 FFBDMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667816 1070230775 /nfs/dbraw/zinc/23/07/75/1070230775.db2.gz LXOYHGJUYJAFKR-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001537667816 1070230788 /nfs/dbraw/zinc/23/07/88/1070230788.db2.gz LXOYHGJUYJAFKR-KGLIPLIRSA-N 1 1 355.847 2.558 20 5 FFBDMO [NH3+][C@@H](Cc1ccccc1[N+](=O)[O-])c1nc(-c2cccn3ccnc23)no1 ZINC001247671332 1039876954 /nfs/dbraw/zinc/87/69/54/1039876954.db2.gz AEJLYUHNTOOHFI-ZDUSSCGKSA-N 1 1 350.338 2.535 20 5 FFBDMO O=C1C[NH2+]CCN1Cc1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001247712986 1039908443 /nfs/dbraw/zinc/90/84/43/1039908443.db2.gz IGVMIGCWWWJVGG-UHFFFAOYSA-N 1 1 358.401 2.975 20 5 FFBDMO C[N@H+](Cc1nnc2ccccn21)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254474690 1040740468 /nfs/dbraw/zinc/74/04/68/1040740468.db2.gz SUZLXHCRUNIQCH-UHFFFAOYSA-N 1 1 366.425 2.738 20 5 FFBDMO C[N@@H+](Cc1nnc2ccccn21)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001254474690 1040740476 /nfs/dbraw/zinc/74/04/76/1040740476.db2.gz SUZLXHCRUNIQCH-UHFFFAOYSA-N 1 1 366.425 2.738 20 5 FFBDMO Cc1noc([C@@H]2CC[C@@H]3[C@@H](CC[N@H+]3[C@H]3Cc4ccc([N+](=O)[O-])cc4C3)O2)n1 ZINC001254595247 1040825296 /nfs/dbraw/zinc/82/52/96/1040825296.db2.gz HRULBHDSMMAXQC-MLHJIOFPSA-N 1 1 370.409 2.748 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598342 1040827420 /nfs/dbraw/zinc/82/74/20/1040827420.db2.gz WLDKFGGMFXDYAH-SJLPKXTDSA-N 1 1 370.453 2.914 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)Cc2c1cnn2CC ZINC001254598342 1040827424 /nfs/dbraw/zinc/82/74/24/1040827424.db2.gz WLDKFGGMFXDYAH-SJLPKXTDSA-N 1 1 370.453 2.914 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@]3(C[C@H](OCC4CC4)CO3)C1)C2 ZINC001254599922 1040829823 /nfs/dbraw/zinc/82/98/23/1040829823.db2.gz MVANZBUKBBWDBR-AABGKKOBSA-N 1 1 358.438 2.722 20 5 FFBDMO CCC[NH+](CCC)CCN1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254602501 1040832413 /nfs/dbraw/zinc/83/24/13/1040832413.db2.gz FZURHIMKULZOGR-NRFANRHFSA-N 1 1 374.529 2.802 20 5 FFBDMO Cc1cccc(N2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254607278 1040833971 /nfs/dbraw/zinc/83/39/71/1040833971.db2.gz KQCFLOJIRZOFRD-LJQANCHMSA-N 1 1 352.438 2.978 20 5 FFBDMO O=C1c2ccccc2CN1[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254611029 1040839056 /nfs/dbraw/zinc/83/90/56/1040839056.db2.gz ONIOULCSNNIAIB-RBUKOAKNSA-N 1 1 363.417 2.792 20 5 FFBDMO CC(C)(C)n1c[nH+]cc1[C@H]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1 ZINC001262723015 1041816573 /nfs/dbraw/zinc/81/65/73/1041816573.db2.gz BSCSSCRRRADZRU-ZDUSSCGKSA-N 1 1 369.429 2.973 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)c4cc(F)c(F)cc4[N+](=O)[O-])C[C@]2(C1)CCCC3 ZINC001262822089 1041877833 /nfs/dbraw/zinc/87/78/33/1041877833.db2.gz MFGSDINMPSIKRO-HDICACEKSA-N 1 1 365.380 2.821 20 5 FFBDMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(-c2ccccc2)cc1 ZINC001265842684 1042882065 /nfs/dbraw/zinc/88/20/65/1042882065.db2.gz FSZXXFPVVDEFDY-WOJBJXKFSA-N 1 1 367.449 2.957 20 5 FFBDMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(-c2ccccc2)cc1 ZINC001265842684 1042882066 /nfs/dbraw/zinc/88/20/66/1042882066.db2.gz FSZXXFPVVDEFDY-WOJBJXKFSA-N 1 1 367.449 2.957 20 5 FFBDMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(-c2ccccc2)cc1 ZINC001265842684 1042882071 /nfs/dbraw/zinc/88/20/71/1042882071.db2.gz FSZXXFPVVDEFDY-WOJBJXKFSA-N 1 1 367.449 2.957 20 5 FFBDMO CN1CC[NH+](C(C)(C)CNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC001318185370 1045237361 /nfs/dbraw/zinc/23/73/61/1045237361.db2.gz SJZFPOGJCNPKCG-UHFFFAOYSA-N 1 1 371.279 2.795 20 5 FFBDMO C[N@@H+](Cc1ccc(C(N)=O)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC001318255382 1045254885 /nfs/dbraw/zinc/25/48/85/1045254885.db2.gz BXOOERSPBIMUQX-UHFFFAOYSA-N 1 1 365.393 2.647 20 5 FFBDMO C[N@H+](Cc1ccc(C(N)=O)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC001318255382 1045254891 /nfs/dbraw/zinc/25/48/91/1045254891.db2.gz BXOOERSPBIMUQX-UHFFFAOYSA-N 1 1 365.393 2.647 20 5 FFBDMO Cc1c(-c2nc(Cc3ccc([N+](=O)[O-])cn3)no2)cnn1-c1cc[nH+]cc1 ZINC001320499042 1045419746 /nfs/dbraw/zinc/41/97/46/1045419746.db2.gz KEAQLILMYVVXOU-UHFFFAOYSA-N 1 1 363.337 2.520 20 5 FFBDMO CCOc1cc(COC(=O)c2ccn(-c3cc[nH+]cc3)n2)ccc1[N+](=O)[O-] ZINC001320812636 1045473269 /nfs/dbraw/zinc/47/32/69/1045473269.db2.gz QGBRXBNXOWBSRK-UHFFFAOYSA-N 1 1 368.349 2.931 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)/C=C/c4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3 ZINC001540270186 1070812446 /nfs/dbraw/zinc/81/24/46/1070812446.db2.gz DJTQPWJIUNCKOW-FMNOIEFDSA-N 1 1 355.438 2.942 20 5 FFBDMO CCC1([NH2+]Cc2cc(C)ccc2C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001327448712 1047900091 /nfs/dbraw/zinc/90/00/91/1047900091.db2.gz GMVIWKQNVGXAJK-QZTJIDSGSA-N 1 1 359.470 2.829 20 5 FFBDMO COc1ccc(CC[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC001331534131 1047988536 /nfs/dbraw/zinc/98/85/36/1047988536.db2.gz SJTKJZKXWOKRFA-SFHVURJKSA-N 1 1 367.409 2.654 20 5 FFBDMO C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001332718784 1048525476 /nfs/dbraw/zinc/52/54/76/1048525476.db2.gz USSKWYINLXSSGM-YVEFUNNKSA-N 1 1 366.801 2.826 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@](O)(c4ccccc4)C3)nc2c1 ZINC001328958245 1048533479 /nfs/dbraw/zinc/53/34/79/1048533479.db2.gz YBYZIDQSMMHKCS-LJQANCHMSA-N 1 1 352.394 2.955 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@](O)(c4ccccc4)C3)nc2c1 ZINC001328958245 1048533489 /nfs/dbraw/zinc/53/34/89/1048533489.db2.gz YBYZIDQSMMHKCS-LJQANCHMSA-N 1 1 352.394 2.955 20 5 FFBDMO Cc1cccc(NC[C@@H]2CCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001329555895 1048773580 /nfs/dbraw/zinc/77/35/80/1048773580.db2.gz MTCQIGIGIBTMBF-KRWDZBQOSA-N 1 1 354.410 2.944 20 5 FFBDMO C[C@@H]([NH2+]CCN1C(=O)COc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC001329644783 1048826363 /nfs/dbraw/zinc/82/63/63/1048826363.db2.gz YADQWYORHUUHAC-GFCCVEGCSA-N 1 1 359.357 2.810 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC)CC1 ZINC001340879807 1051212600 /nfs/dbraw/zinc/21/26/00/1051212600.db2.gz YVTIXUXVBGZUDJ-AWEZNQCLSA-N 1 1 352.483 2.584 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC001306818465 1052192245 /nfs/dbraw/zinc/19/22/45/1052192245.db2.gz DJVJJHPRZQNMPX-HKUYNNGSSA-N 1 1 369.421 2.913 20 5 FFBDMO Cc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])cc1C(F)(F)F ZINC001307227610 1052271894 /nfs/dbraw/zinc/27/18/94/1052271894.db2.gz IVTJVYWUTSJWBV-UONOGXRCSA-N 1 1 373.375 2.957 20 5 FFBDMO Cc1c(CNC(=O)[C@@H]2CCCC[N@@H+]2Cc2ccncc2)cccc1[N+](=O)[O-] ZINC001343559708 1052307168 /nfs/dbraw/zinc/30/71/68/1052307168.db2.gz KSVBWAXNNXSNLP-IBGZPJMESA-N 1 1 368.437 2.969 20 5 FFBDMO Cc1c(CNC(=O)[C@@H]2CCCC[N@H+]2Cc2ccncc2)cccc1[N+](=O)[O-] ZINC001343559708 1052307174 /nfs/dbraw/zinc/30/71/74/1052307174.db2.gz KSVBWAXNNXSNLP-IBGZPJMESA-N 1 1 368.437 2.969 20 5 FFBDMO CC(C)(C)[C@H](CO)[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001307679922 1052334421 /nfs/dbraw/zinc/33/44/21/1052334421.db2.gz OUNLEIXGQAZEPU-LBPRGKRZSA-N 1 1 354.794 2.795 20 5 FFBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001307748386 1052344399 /nfs/dbraw/zinc/34/43/99/1052344399.db2.gz ORGJUKLHIMCHGV-ZDUSSCGKSA-N 1 1 373.413 2.526 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c1 ZINC001309102756 1052554939 /nfs/dbraw/zinc/55/49/39/1052554939.db2.gz KKQDHOGKBJVPSA-UHFFFAOYSA-N 1 1 369.487 2.754 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c(C(F)(F)F)c1 ZINC001335565342 1053439017 /nfs/dbraw/zinc/43/90/17/1053439017.db2.gz HYZISUMGJLTTMR-LSDHHAIUSA-N 1 1 359.348 2.649 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c(C(F)(F)F)c1 ZINC001335565336 1053439316 /nfs/dbraw/zinc/43/93/16/1053439316.db2.gz HYZISUMGJLTTMR-CABCVRRESA-N 1 1 359.348 2.649 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348234066 1054563761 /nfs/dbraw/zinc/56/37/61/1054563761.db2.gz HXBKELQCFZILDD-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC001348234066 1054563773 /nfs/dbraw/zinc/56/37/73/1054563773.db2.gz HXBKELQCFZILDD-YWZLYKJASA-N 1 1 369.421 2.905 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC1 ZINC001337458425 1054768240 /nfs/dbraw/zinc/76/82/40/1054768240.db2.gz LTLSDDNGOPQZGN-UHFFFAOYSA-N 1 1 369.425 2.605 20 5 FFBDMO COc1ccc(NC(=O)c2cnn(-c3cc[nH+]cc3)c2C)cc1[N+](=O)[O-] ZINC001337578221 1054862039 /nfs/dbraw/zinc/86/20/39/1054862039.db2.gz SCTXWFSIHZVHNT-UHFFFAOYSA-N 1 1 353.338 2.745 20 5 FFBDMO O=C(c1cc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-])N1CCCC1 ZINC001337735670 1054979480 /nfs/dbraw/zinc/97/94/80/1054979480.db2.gz XLQNDDPGLYQQBM-AEFFLSMTSA-N 1 1 358.442 2.870 20 5 FFBDMO Cn1c[nH+]cc1C1CCN(c2nnc(-c3csc([N+](=O)[O-])c3)n2C)CC1 ZINC001337911978 1055098895 /nfs/dbraw/zinc/09/88/95/1055098895.db2.gz MIROFHAYGONFAG-UHFFFAOYSA-N 1 1 373.442 2.569 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCC[NH+]1CC=CC1 ZINC001339286056 1056290892 /nfs/dbraw/zinc/29/08/92/1056290892.db2.gz FNQFTLAAALTAMW-UHFFFAOYSA-N 1 1 352.263 2.928 20 5 FFBDMO CC[N@@H+](Cc1ccc(C(=O)OCc2cn(C)nc2[N+](=O)[O-])cc1)C(C)C ZINC000847784862 1056618795 /nfs/dbraw/zinc/61/87/95/1056618795.db2.gz BGVDTILPBCJTOV-UHFFFAOYSA-N 1 1 360.414 2.916 20 5 FFBDMO CCn1c(-c2cc(C)cc([N+](=O)[O-])c2)nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC001339653791 1056680530 /nfs/dbraw/zinc/68/05/30/1056680530.db2.gz OVKYOZOWNKJVRV-YOEHRIQHSA-N 1 1 370.457 2.712 20 5 FFBDMO CCn1c(-c2cc(C)cc([N+](=O)[O-])c2)nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1 ZINC001339653790 1056680883 /nfs/dbraw/zinc/68/08/83/1056680883.db2.gz OVKYOZOWNKJVRV-WMLDXEAASA-N 1 1 370.457 2.712 20 5 FFBDMO Cc1ccc(NCCCNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)[nH+]c1 ZINC001445087300 1058369081 /nfs/dbraw/zinc/36/90/81/1058369081.db2.gz HBLJDBVOUFKSTG-UHFFFAOYSA-N 1 1 363.805 2.766 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC001518643021 1058448918 /nfs/dbraw/zinc/44/89/18/1058448918.db2.gz PFGIARDXZYANQE-HOCLYGCPSA-N 1 1 354.410 2.864 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOC[C@H]1CCCO1 ZINC001200602122 1058749467 /nfs/dbraw/zinc/74/94/67/1058749467.db2.gz VSHDWGNVFRNXRM-LLVKDONJSA-N 1 1 359.220 2.643 20 5 FFBDMO CC(C)[N@H+]1CCCN(c2nnc([C@@H](C)[N+](=O)[O-])n2Cc2ccccc2)CC1 ZINC001354296898 1058822833 /nfs/dbraw/zinc/82/28/33/1058822833.db2.gz JCKQYPQKBFOZNI-MRXNPFEDSA-N 1 1 372.473 2.585 20 5 FFBDMO CCC1([NH2+]Cc2ccccc2Cl)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001502494926 1058864514 /nfs/dbraw/zinc/86/45/14/1058864514.db2.gz SXYBCRKFRVXBFY-GDBMZVCRSA-N 1 1 365.861 2.866 20 5 FFBDMO C[N@@H+](CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccccc1 ZINC001354674695 1059349370 /nfs/dbraw/zinc/34/93/70/1059349370.db2.gz JHSAZNDOUBPTIM-WOJBJXKFSA-N 1 1 367.449 2.812 20 5 FFBDMO C[N@H+](CCN(Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1 ZINC001354674695 1059349395 /nfs/dbraw/zinc/34/93/95/1059349395.db2.gz JHSAZNDOUBPTIM-WOJBJXKFSA-N 1 1 367.449 2.812 20 5 FFBDMO C[N@@H+](CCN(Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1 ZINC001354674695 1059349419 /nfs/dbraw/zinc/34/94/19/1059349419.db2.gz JHSAZNDOUBPTIM-WOJBJXKFSA-N 1 1 367.449 2.812 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC001454489373 1059548133 /nfs/dbraw/zinc/54/81/33/1059548133.db2.gz AKSAQMCLZGVEDY-CQSZACIVSA-N 1 1 354.410 2.696 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC/C=C/c1ccccc1)C2 ZINC001506862104 1059575530 /nfs/dbraw/zinc/57/55/30/1059575530.db2.gz JKBNJPWGJCVZBJ-SAKPZHGXSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CC/C=C/c1ccccc1)C2 ZINC001506862104 1059575554 /nfs/dbraw/zinc/57/55/54/1059575554.db2.gz JKBNJPWGJCVZBJ-SAKPZHGXSA-N 1 1 369.465 2.680 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC/C=C/c1ccccc1)C2 ZINC001506862104 1059575577 /nfs/dbraw/zinc/57/55/77/1059575577.db2.gz JKBNJPWGJCVZBJ-SAKPZHGXSA-N 1 1 369.465 2.680 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)cc(F)cc1[N+](=O)[O-] ZINC001454872720 1059635533 /nfs/dbraw/zinc/63/55/33/1059635533.db2.gz DJWBUXDYKSESMV-AWEZNQCLSA-N 1 1 364.421 2.843 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](Cc3ccccc3)CCOCC2)c(F)c1 ZINC001472888653 1059666959 /nfs/dbraw/zinc/66/69/59/1059666959.db2.gz KXVXQJZYSNIWMA-UHFFFAOYSA-N 1 1 374.416 2.858 20 5 FFBDMO CCCC[N@@H+](C)CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)OC ZINC001547003349 1071901261 /nfs/dbraw/zinc/90/12/61/1071901261.db2.gz USGOOXAQBVKMKN-UHFFFAOYSA-N 1 1 362.434 2.583 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1 ZINC000848477120 1060098672 /nfs/dbraw/zinc/09/86/72/1060098672.db2.gz OWMOZIFWKPPOJM-CYBMUJFWSA-N 1 1 358.398 2.689 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848478907 1060106361 /nfs/dbraw/zinc/10/63/61/1060106361.db2.gz OLBKVWSTNFFWAH-CRAIPNDOSA-N 1 1 361.442 2.617 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848483145 1060121159 /nfs/dbraw/zinc/12/11/59/1060121159.db2.gz YUPQNXYUUYPKQJ-QAPCUYQASA-N 1 1 355.442 2.832 20 5 FFBDMO CC1([C@@H]2CCC[N@@H+](Cn3cc(-c4ccccc4[N+](=O)[O-])cn3)C2)OCCO1 ZINC000848484456 1060128720 /nfs/dbraw/zinc/12/87/20/1060128720.db2.gz LGJMKVSUQZSCTM-MRXNPFEDSA-N 1 1 372.425 2.891 20 5 FFBDMO C[C@H]1CN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC[N@H+](C2CC2)C1 ZINC001458407525 1060585445 /nfs/dbraw/zinc/58/54/45/1060585445.db2.gz ODVLATVKELANFT-GFCCVEGCSA-N 1 1 371.397 2.972 20 5 FFBDMO CC(C)Oc1nc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC001458594253 1060630082 /nfs/dbraw/zinc/63/00/82/1060630082.db2.gz MBFRLEAUJPTARW-JSGCOSHPSA-N 1 1 352.460 2.769 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@@H]2C[C@H](O)C23CCC3)o1 ZINC001460424370 1060989394 /nfs/dbraw/zinc/98/93/94/1060989394.db2.gz AFNDCRBKXPKBGC-OLZOCXBDSA-N 1 1 364.789 2.691 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCc1ccc2c(c1)OCO2 ZINC001460787890 1061102523 /nfs/dbraw/zinc/10/25/23/1061102523.db2.gz KKFYLFSCRYKBHU-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCc1ccc2c(c1)OCO2 ZINC001460787890 1061102528 /nfs/dbraw/zinc/10/25/28/1061102528.db2.gz KKFYLFSCRYKBHU-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO C[C@@](O)(C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])C(F)(F)F ZINC001461364988 1061302253 /nfs/dbraw/zinc/30/22/53/1061302253.db2.gz PUYCYZOGMDSVLJ-SNVBAGLBSA-N 1 1 357.126 2.760 20 5 FFBDMO C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC001462928592 1061849782 /nfs/dbraw/zinc/84/97/82/1061849782.db2.gz WBKACIRLCNPVSY-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC001462928592 1061849794 /nfs/dbraw/zinc/84/97/94/1061849794.db2.gz WBKACIRLCNPVSY-MRXNPFEDSA-N 1 1 354.410 2.641 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC001478377655 1061991983 /nfs/dbraw/zinc/99/19/83/1061991983.db2.gz MIYKYLAHPZCWFK-KRWDZBQOSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC001478377655 1061991998 /nfs/dbraw/zinc/99/19/98/1061991998.db2.gz MIYKYLAHPZCWFK-KRWDZBQOSA-N 1 1 354.410 2.889 20 5 FFBDMO CCc1ccc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC001463526935 1062146743 /nfs/dbraw/zinc/14/67/43/1062146743.db2.gz KGCQKRZQBMKAIF-KBPBESRZSA-N 1 1 369.487 2.556 20 5 FFBDMO Cc1ccc(NCCNC(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])[nH+]c1 ZINC001479404369 1062346288 /nfs/dbraw/zinc/34/62/88/1062346288.db2.gz DLUPJHAROFNVRH-UHFFFAOYSA-N 1 1 357.414 2.945 20 5 FFBDMO Cc1cccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001470711036 1064421476 /nfs/dbraw/zinc/42/14/76/1064421476.db2.gz JOWRZBRWIGQHOH-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001472495930 1065082153 /nfs/dbraw/zinc/08/21/53/1065082153.db2.gz FMTSEJOVXMEGDO-SFHVURJKSA-N 1 1 374.485 2.504 20 5 FFBDMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC001472849574 1065157663 /nfs/dbraw/zinc/15/76/63/1065157663.db2.gz HKGGVIAYIUBDOA-HNNXBMFYSA-N 1 1 356.426 2.914 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC001472864432 1065161938 /nfs/dbraw/zinc/16/19/38/1065161938.db2.gz OEQQFHFWUNCIBR-UHFFFAOYSA-N 1 1 356.854 2.970 20 5 FFBDMO CCOC(=O)CC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])CC1CC1 ZINC001473132547 1065204625 /nfs/dbraw/zinc/20/46/25/1065204625.db2.gz BILIXUSACHAWBI-UHFFFAOYSA-N 1 1 364.398 2.547 20 5 FFBDMO COC(=O)C[C@](C)([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(OC)c1 ZINC001473521066 1065278711 /nfs/dbraw/zinc/27/87/11/1065278711.db2.gz KACPSIKVGCDZRX-SFHVURJKSA-N 1 1 359.382 2.567 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H](C)[C@H]1O ZINC001473631396 1065302705 /nfs/dbraw/zinc/30/27/05/1065302705.db2.gz RTAHSEYSQGDHHU-RTUWITSCSA-N 1 1 366.805 2.747 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H](C)[C@H]1O ZINC001473631396 1065302716 /nfs/dbraw/zinc/30/27/16/1065302716.db2.gz RTAHSEYSQGDHHU-RTUWITSCSA-N 1 1 366.805 2.747 20 5 FFBDMO C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C1CCCC1 ZINC001473798677 1065367194 /nfs/dbraw/zinc/36/71/94/1065367194.db2.gz VNMVBOCOEQPSBI-OAHLLOKOSA-N 1 1 360.458 2.506 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H](c2ncccn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC001473804700 1065370861 /nfs/dbraw/zinc/37/08/61/1065370861.db2.gz IOAPOTKQUYJWTG-ZDUSSCGKSA-N 1 1 373.388 2.732 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ncccc2C)c([N+](=O)[O-])c1 ZINC001473879662 1065401888 /nfs/dbraw/zinc/40/18/88/1065401888.db2.gz SWKQULHVTPPQBB-CHWSQXEVSA-N 1 1 358.398 2.985 20 5 FFBDMO NC(=O)c1ccc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC001474247909 1065478316 /nfs/dbraw/zinc/47/83/16/1065478316.db2.gz HCMWIGZJVZCHDH-UHFFFAOYSA-N 1 1 364.199 2.746 20 5 FFBDMO COC(=O)[C@H](C)Oc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC001474391394 1065509763 /nfs/dbraw/zinc/50/97/63/1065509763.db2.gz KCOFZXBIXDJXEU-ZDUSSCGKSA-N 1 1 374.393 2.834 20 5 FFBDMO Cc1cc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c2c(n1)CCCC2 ZINC001474564996 1065552159 /nfs/dbraw/zinc/55/21/59/1065552159.db2.gz OLVSHPLOXRUPBB-UHFFFAOYSA-N 1 1 367.453 2.894 20 5 FFBDMO CCCCOc1ccc(NC(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cn1 ZINC001577471097 1078365041 /nfs/dbraw/zinc/36/50/41/1078365041.db2.gz NUQDOJMYXQBFPV-GOSISDBHSA-N 1 1 358.398 2.981 20 5 FFBDMO C[N@@H+](CCCNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])C1CCCCC1 ZINC001579128783 1078573362 /nfs/dbraw/zinc/57/33/62/1078573362.db2.gz ZWULEHOOZHRLQA-UHFFFAOYSA-N 1 1 359.434 2.841 20 5 FFBDMO COc1cccc(C[C@@H]([NH3+])C(=O)OCc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC001579273802 1078607793 /nfs/dbraw/zinc/60/77/93/1078607793.db2.gz BTHJONWXJGPRDQ-QGZVFWFLSA-N 1 1 358.394 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2C2CCCCCC2)c(-c2nn[nH]n2)c1 ZINC001582804393 1079110448 /nfs/dbraw/zinc/11/04/48/1079110448.db2.gz RSIGOQGUARNNSC-OAHLLOKOSA-N 1 1 371.445 2.984 20 5 FFBDMO Nc1c(Cl)cc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC001583145777 1079170801 /nfs/dbraw/zinc/17/08/01/1079170801.db2.gz UCQJEYMCEKGFPA-OLZOCXBDSA-N 1 1 352.822 2.577 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001585555519 1079475057 /nfs/dbraw/zinc/47/50/57/1079475057.db2.gz MULJEIJCCBKNJP-QUCCMNQESA-N 1 1 365.433 2.870 20 5 FFBDMO CC(C)[C@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC001558210158 1075961319 /nfs/dbraw/zinc/96/13/19/1075961319.db2.gz HZWLVNFSFVNEPQ-ZXFNITATSA-N 1 1 363.458 2.906 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC001558290982 1075973046 /nfs/dbraw/zinc/97/30/46/1075973046.db2.gz HYQBKGAONGBKGM-UHFFFAOYSA-N 1 1 354.769 2.505 20 5 FFBDMO Cc1c(Br)c(N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)ncc1[N+](=O)[O-] ZINC001559250540 1076139785 /nfs/dbraw/zinc/13/97/85/1076139785.db2.gz ZVEXHPSDNHFDGA-GASCZTMLSA-N 1 1 369.263 2.839 20 5 FFBDMO C[C@H]1C[N@@H+](CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(C)(C)C1 ZINC001559675385 1076182057 /nfs/dbraw/zinc/18/20/57/1076182057.db2.gz HPDIIEULWPZAJR-MRXNPFEDSA-N 1 1 374.485 2.611 20 5 FFBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001559751935 1076187996 /nfs/dbraw/zinc/18/79/96/1076187996.db2.gz OVYXPFHFHOPEAB-APWZRJJASA-N 1 1 374.485 2.754 20 5 FFBDMO CCOC(=O)N1CC[C@@H]([NH2+]Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC001560444924 1076273844 /nfs/dbraw/zinc/27/38/44/1076273844.db2.gz HEJHDXOMFWRKRP-SNVBAGLBSA-N 1 1 372.219 2.678 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c(C)c1[N+](=O)[O-] ZINC001561474840 1076382114 /nfs/dbraw/zinc/38/21/14/1076382114.db2.gz RJGUOXSUSZBAOM-JSGCOSHPSA-N 1 1 369.487 2.610 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC001562575172 1076504666 /nfs/dbraw/zinc/50/46/66/1076504666.db2.gz FKEKIGSOTWLLGF-LLVKDONJSA-N 1 1 371.235 2.963 20 5 FFBDMO Cc1c(CNC(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)cccc1[N+](=O)[O-] ZINC001564555348 1076644075 /nfs/dbraw/zinc/64/40/75/1076644075.db2.gz QXPTUNDJMKMQQA-GOSISDBHSA-N 1 1 354.410 2.889 20 5 FFBDMO Cc1c(CNC(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)cccc1[N+](=O)[O-] ZINC001564555348 1076644078 /nfs/dbraw/zinc/64/40/78/1076644078.db2.gz QXPTUNDJMKMQQA-GOSISDBHSA-N 1 1 354.410 2.889 20 5 FFBDMO CC/C=C\CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1 ZINC001570078410 1077181372 /nfs/dbraw/zinc/18/13/72/1077181372.db2.gz WPGVKAJJTMOKKB-IFEVLTCRSA-N 1 1 357.454 2.682 20 5 FFBDMO CC/C=C\CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001570078410 1077181375 /nfs/dbraw/zinc/18/13/75/1077181375.db2.gz WPGVKAJJTMOKKB-IFEVLTCRSA-N 1 1 357.454 2.682 20 5 FFBDMO CC/C=C\CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1 ZINC001570078410 1077181378 /nfs/dbraw/zinc/18/13/78/1077181378.db2.gz WPGVKAJJTMOKKB-IFEVLTCRSA-N 1 1 357.454 2.682 20 5 FFBDMO CCC1([NH2+]Cc2ccc(C)c(F)c2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001570255283 1077193309 /nfs/dbraw/zinc/19/33/09/1077193309.db2.gz XLSBCZQTPJNJHU-NVXWUHKLSA-N 1 1 363.433 2.660 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001586353333 1079609013 /nfs/dbraw/zinc/60/90/13/1079609013.db2.gz FEWGCADQAJBMNC-HNNXBMFYSA-N 1 1 361.785 2.741 20 5 FFBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590166171 1081064853 /nfs/dbraw/zinc/06/48/53/1081064853.db2.gz VTLCRCUSEVJLBZ-LDYMZIIASA-N 1 1 356.308 2.548 20 5 FFBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226636 1081106897 /nfs/dbraw/zinc/10/68/97/1081106897.db2.gz RCWCTTZJTFYAEY-JOYOIKCWSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226636 1081106901 /nfs/dbraw/zinc/10/69/01/1081106901.db2.gz RCWCTTZJTFYAEY-JOYOIKCWSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC001590260599 1081128969 /nfs/dbraw/zinc/12/89/69/1081128969.db2.gz QBTRVLAWZPFVOQ-VHSXEESVSA-N 1 1 351.436 2.511 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C ZINC001590260599 1081128972 /nfs/dbraw/zinc/12/89/72/1081128972.db2.gz QBTRVLAWZPFVOQ-VHSXEESVSA-N 1 1 351.436 2.511 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000375011258 512118915 /nfs/dbraw/zinc/11/89/15/512118915.db2.gz FBYVFGUUSKILAC-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000375011258 512118909 /nfs/dbraw/zinc/11/89/09/512118909.db2.gz FBYVFGUUSKILAC-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864235 250295917 /nfs/dbraw/zinc/29/59/17/250295917.db2.gz JOIYYSNVQCIDBB-CMPLNLGQSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@H+]2CCCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])cc1OC(F)F ZINC000106864235 250295919 /nfs/dbraw/zinc/29/59/19/250295919.db2.gz JOIYYSNVQCIDBB-CMPLNLGQSA-N 1 1 360.357 2.940 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC(C3OCCO3)CC2)c1 ZINC000130125973 250884421 /nfs/dbraw/zinc/88/44/21/250884421.db2.gz YSXHIBHKGHCGHF-UHFFFAOYSA-N 1 1 358.341 2.781 20 5 FFBDMO CC(C)Oc1cc(C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2CC2)ccn1 ZINC000131658878 251009586 /nfs/dbraw/zinc/00/95/86/251009586.db2.gz NYEYXLOQHSATHZ-UHFFFAOYSA-N 1 1 372.425 2.603 20 5 FFBDMO CC(C)Oc1cc(C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2CC2)ccn1 ZINC000131658878 251009590 /nfs/dbraw/zinc/00/95/90/251009590.db2.gz NYEYXLOQHSATHZ-UHFFFAOYSA-N 1 1 372.425 2.603 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3nc(C)no3)C2)c([N+](=O)[O-])c1 ZINC000173562707 251207922 /nfs/dbraw/zinc/20/79/22/251207922.db2.gz WSUIVFRVDDHVLO-ZDUSSCGKSA-N 1 1 362.386 2.553 20 5 FFBDMO COCC[N@H+](C)[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000267386425 251341401 /nfs/dbraw/zinc/34/14/01/251341401.db2.gz BQBZLZIKTWVZTH-LLVKDONJSA-N 1 1 364.427 2.624 20 5 FFBDMO COCC[N@@H+](C)[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000267386425 251341404 /nfs/dbraw/zinc/34/14/04/251341404.db2.gz BQBZLZIKTWVZTH-LLVKDONJSA-N 1 1 364.427 2.624 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(c2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000268789360 251383860 /nfs/dbraw/zinc/38/38/60/251383860.db2.gz FXYUMADHSGHXMY-LLVKDONJSA-N 1 1 355.822 2.813 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000272524636 252059601 /nfs/dbraw/zinc/05/96/01/252059601.db2.gz LWWMBWKVONSHPY-SCTDSRPQSA-N 1 1 358.442 2.949 20 5 FFBDMO Cc1cc(C[C@@H](C)[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000272586847 252073879 /nfs/dbraw/zinc/07/38/79/252073879.db2.gz ZHNFVBHJJFSIHO-SJKOYZFVSA-N 1 1 354.414 2.670 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CC[C@H](COc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000272588421 252074453 /nfs/dbraw/zinc/07/44/53/252074453.db2.gz PDXFAQYIHXTSPN-AWEZNQCLSA-N 1 1 355.394 2.595 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000273055989 252203209 /nfs/dbraw/zinc/20/32/09/252203209.db2.gz RUNRSVFKWCJLLH-UZLBHIALSA-N 1 1 372.421 2.580 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000273055988 252203847 /nfs/dbraw/zinc/20/38/47/252203847.db2.gz RUNRSVFKWCJLLH-OXQOHEQNSA-N 1 1 372.421 2.580 20 5 FFBDMO COc1cc(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)ccc1[N+](=O)[O-] ZINC000273225650 252256676 /nfs/dbraw/zinc/25/66/76/252256676.db2.gz RBFYQLURNCLYMU-KRWDZBQOSA-N 1 1 357.410 2.782 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276884861 256139571 /nfs/dbraw/zinc/13/95/71/256139571.db2.gz FJVCKZHFGQDPHA-LLVKDONJSA-N 1 1 367.365 2.865 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276884861 256139572 /nfs/dbraw/zinc/13/95/72/256139572.db2.gz FJVCKZHFGQDPHA-LLVKDONJSA-N 1 1 367.365 2.865 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C(C)(C)C1 ZINC000277403874 256194776 /nfs/dbraw/zinc/19/47/76/256194776.db2.gz FGQAMKIQCDXCQB-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C(C)(C)C1 ZINC000277403874 256194777 /nfs/dbraw/zinc/19/47/77/256194777.db2.gz FGQAMKIQCDXCQB-UHFFFAOYSA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@H](c1cccnc1)[NH+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000278513250 256321030 /nfs/dbraw/zinc/32/10/30/256321030.db2.gz RONKCAXLKHMNMC-ZDUSSCGKSA-N 1 1 352.398 2.749 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(Oc3ncccc3F)CC2)c1 ZINC000278266167 256293199 /nfs/dbraw/zinc/29/31/99/256293199.db2.gz IUBWDQQCFYKQGS-KRWDZBQOSA-N 1 1 361.373 2.706 20 5 FFBDMO C[C@@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)CN1CCN(C)CC1 ZINC000279134982 256385595 /nfs/dbraw/zinc/38/55/95/256385595.db2.gz RHIIAZJICQPVQU-HNAYVOBHSA-N 1 1 360.502 2.790 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](CC(F)(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000278861867 256355115 /nfs/dbraw/zinc/35/51/15/256355115.db2.gz SBPJDTDPRKVQRS-LLVKDONJSA-N 1 1 357.332 2.758 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](CC(F)(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000278861867 256355117 /nfs/dbraw/zinc/35/51/17/256355117.db2.gz SBPJDTDPRKVQRS-LLVKDONJSA-N 1 1 357.332 2.758 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H](CC(F)(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000278861877 256355510 /nfs/dbraw/zinc/35/55/10/256355510.db2.gz SBPJDTDPRKVQRS-NSHDSACASA-N 1 1 357.332 2.758 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H](CC(F)(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000278861877 256355512 /nfs/dbraw/zinc/35/55/12/256355512.db2.gz SBPJDTDPRKVQRS-NSHDSACASA-N 1 1 357.332 2.758 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000279039888 256375043 /nfs/dbraw/zinc/37/50/43/256375043.db2.gz ADMKHVLUIDGCMW-LLVKDONJSA-N 1 1 357.813 2.730 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000279313143 256404608 /nfs/dbraw/zinc/40/46/08/256404608.db2.gz OPCMKOMCYNLNJT-OTYXRUKQSA-N 1 1 355.797 2.529 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCCCC[C@@H]2C[C@H](C)O)c([N+](=O)[O-])c1 ZINC000285942690 257012469 /nfs/dbraw/zinc/01/24/69/257012469.db2.gz MFEDGTZHQDNFEK-UONOGXRCSA-N 1 1 365.430 2.557 20 5 FFBDMO Cc1noc([C@H]2CCC[N@@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000286157861 257023033 /nfs/dbraw/zinc/02/30/33/257023033.db2.gz PSFOZIJIRKPYMP-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO Cc1noc([C@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1 ZINC000286157861 257023034 /nfs/dbraw/zinc/02/30/34/257023034.db2.gz PSFOZIJIRKPYMP-OAHLLOKOSA-N 1 1 359.386 2.760 20 5 FFBDMO CN(c1c(Br)cncc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286423686 257036335 /nfs/dbraw/zinc/03/63/35/257036335.db2.gz QAABTJDNUQJAHF-ZACCUICWSA-N 1 1 355.236 2.814 20 5 FFBDMO CC(C)c1[nH]nc(C(=O)N(C)CCC[N@@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000286735456 257052318 /nfs/dbraw/zinc/05/23/18/257052318.db2.gz RWMKQXFMWLCFSC-UHFFFAOYSA-N 1 1 363.418 2.628 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)N(C)CCC[N@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000286735456 257052319 /nfs/dbraw/zinc/05/23/19/257052319.db2.gz RWMKQXFMWLCFSC-UHFFFAOYSA-N 1 1 363.418 2.628 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000288473330 257193112 /nfs/dbraw/zinc/19/31/12/257193112.db2.gz QOODKOUZPWECSB-IBGZPJMESA-N 1 1 354.410 2.661 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000289346540 257275624 /nfs/dbraw/zinc/27/56/24/257275624.db2.gz MNSBGCTWCYPPMI-DLBZAZTESA-N 1 1 357.410 2.609 20 5 FFBDMO O=C([C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1)N1CCCC1 ZINC000290397748 257329758 /nfs/dbraw/zinc/32/97/58/257329758.db2.gz JFSDBQITUMBADI-LBPRGKRZSA-N 1 1 369.368 2.641 20 5 FFBDMO O=C([C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1)N1CCCC1 ZINC000290397748 257329759 /nfs/dbraw/zinc/32/97/59/257329759.db2.gz JFSDBQITUMBADI-LBPRGKRZSA-N 1 1 369.368 2.641 20 5 FFBDMO COCc1ccccc1CNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000292162981 257465888 /nfs/dbraw/zinc/46/58/88/257465888.db2.gz OVUMGDRJQKJMQZ-UHFFFAOYSA-N 1 1 371.437 2.882 20 5 FFBDMO C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000292335053 257484156 /nfs/dbraw/zinc/48/41/56/257484156.db2.gz OWOIUVVQPBUNIG-HNNXBMFYSA-N 1 1 360.458 2.730 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000294620719 257595497 /nfs/dbraw/zinc/59/54/97/257595497.db2.gz XTOMBEVXNDPZID-ZDUSSCGKSA-N 1 1 358.398 2.515 20 5 FFBDMO COC(=O)Cc1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])c1 ZINC000297354284 257821637 /nfs/dbraw/zinc/82/16/37/257821637.db2.gz BRYJFFCKROFKSX-DOTOQJQBSA-N 1 1 373.453 2.763 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCC[C@@H]2C[C@@H](C)O)c([N+](=O)[O-])c1 ZINC000298356581 257905278 /nfs/dbraw/zinc/90/52/78/257905278.db2.gz CCRAWWXNKPEJGG-ZIAGYGMSSA-N 1 1 365.430 2.557 20 5 FFBDMO C[N@H+]1CCC[C@H](N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C1 ZINC000301277923 258039461 /nfs/dbraw/zinc/03/94/61/258039461.db2.gz JFVJFQHBHROUEM-AWEZNQCLSA-N 1 1 372.391 2.830 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@H+]1CC(C)(C)O ZINC000302517669 258104516 /nfs/dbraw/zinc/10/45/16/258104516.db2.gz WAMZHCUPSCWCJD-HNNXBMFYSA-N 1 1 370.453 2.938 20 5 FFBDMO COC(=O)c1cnc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000302772843 258110145 /nfs/dbraw/zinc/11/01/45/258110145.db2.gz NOBVUFNJDONXBR-XJKSGUPXSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H]1C[N@H+](CC2CCN(c3ncc(Cl)cc3[N+](=O)[O-])CC2)C[C@H](C)O1 ZINC000301754796 258066294 /nfs/dbraw/zinc/06/62/94/258066294.db2.gz WXSZVJGTLROLQS-BETUJISGSA-N 1 1 368.865 2.969 20 5 FFBDMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1C ZINC000330844692 258171798 /nfs/dbraw/zinc/17/17/98/258171798.db2.gz WRUQJJAWFWBKKL-MNOVXSKESA-N 1 1 357.863 2.891 20 5 FFBDMO C[C@@H]1CN(C(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C ZINC000330844692 258171799 /nfs/dbraw/zinc/17/17/99/258171799.db2.gz WRUQJJAWFWBKKL-MNOVXSKESA-N 1 1 357.863 2.891 20 5 FFBDMO CC(C)(C)[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1 ZINC000332044276 258211309 /nfs/dbraw/zinc/21/13/09/258211309.db2.gz LKBCAWQONJYVDC-MRXNPFEDSA-N 1 1 363.414 2.640 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000332295276 258223592 /nfs/dbraw/zinc/22/35/92/258223592.db2.gz LYSFUHOOKXORCL-OLZOCXBDSA-N 1 1 369.368 2.753 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)N[C@@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000409846853 512154351 /nfs/dbraw/zinc/15/43/51/512154351.db2.gz UZVNPMVPOBKLHE-CZUORRHYSA-N 1 1 355.394 2.885 20 5 FFBDMO COc1ccc(C(=O)NCCC[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000032398975 506248369 /nfs/dbraw/zinc/24/83/69/506248369.db2.gz WDMKBPKWAPZYDU-UHFFFAOYSA-N 1 1 369.421 2.782 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000052842946 506261663 /nfs/dbraw/zinc/26/16/63/506261663.db2.gz KWHPXEZZFFAJTD-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cnc(C)s1 ZINC000053145795 506320164 /nfs/dbraw/zinc/32/01/64/506320164.db2.gz NNQMYDFJIPUUKS-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO C[N@H+](CCc1ccc(F)cc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000065595740 506331278 /nfs/dbraw/zinc/33/12/78/506331278.db2.gz WQBCRQPSXLJSKX-UHFFFAOYSA-N 1 1 357.385 2.798 20 5 FFBDMO C[N@@H+](CCc1ccc(F)cc1)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000065595740 506331282 /nfs/dbraw/zinc/33/12/82/506331282.db2.gz WQBCRQPSXLJSKX-UHFFFAOYSA-N 1 1 357.385 2.798 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[NH+](Cc2ccccc2)CC1 ZINC000003537818 506341035 /nfs/dbraw/zinc/34/10/35/506341035.db2.gz XJPITPVCDOQXCO-UHFFFAOYSA-N 1 1 368.437 2.660 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)Cc1ccc([N+](=O)[O-])cc1 ZINC000065740135 506355274 /nfs/dbraw/zinc/35/52/74/506355274.db2.gz LLILOYMEMHNYLX-UHFFFAOYSA-N 1 1 350.378 2.948 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1SC ZINC000368971031 512162971 /nfs/dbraw/zinc/16/29/71/512162971.db2.gz YSXUKZUSMLIWEH-GFCCVEGCSA-N 1 1 365.455 2.636 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000375153277 512186066 /nfs/dbraw/zinc/18/60/66/512186066.db2.gz OVDUGUNBEKCTON-HNNXBMFYSA-N 1 1 370.409 2.502 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000375153277 512186068 /nfs/dbraw/zinc/18/60/68/512186068.db2.gz OVDUGUNBEKCTON-HNNXBMFYSA-N 1 1 370.409 2.502 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000053515218 506396043 /nfs/dbraw/zinc/39/60/43/506396043.db2.gz XOFSENCWEFDEOW-CQSZACIVSA-N 1 1 371.441 2.600 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1 ZINC000041315142 506505323 /nfs/dbraw/zinc/50/53/23/506505323.db2.gz XYNXVOIABIDLHT-UHFFFAOYSA-N 1 1 368.437 2.955 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CCc2sccc2C1 ZINC000054220534 506515984 /nfs/dbraw/zinc/51/59/84/506515984.db2.gz BEECZGGXMDZMLX-UHFFFAOYSA-N 1 1 374.466 2.633 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NCC[N@H+]1CCc2sccc2C1 ZINC000054220534 506515989 /nfs/dbraw/zinc/51/59/89/506515989.db2.gz BEECZGGXMDZMLX-UHFFFAOYSA-N 1 1 374.466 2.633 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2scnc2C)c([N+](=O)[O-])c1 ZINC000066565192 506557991 /nfs/dbraw/zinc/55/79/91/506557991.db2.gz XFBCACWUWAPJCF-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000041903365 506566362 /nfs/dbraw/zinc/56/63/62/506566362.db2.gz QNHBPUBXJAUXKR-INIZCTEOSA-N 1 1 358.398 2.848 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2ccccc2)CC1 ZINC000011563969 506781079 /nfs/dbraw/zinc/78/10/79/506781079.db2.gz GLUWXVVJYGZIEH-UHFFFAOYSA-N 1 1 368.437 2.741 20 5 FFBDMO C[N@@H+](CCCNC(=O)NCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000067536273 506914418 /nfs/dbraw/zinc/91/44/18/506914418.db2.gz JQGXRQKUGSMCIS-UHFFFAOYSA-N 1 1 356.426 2.916 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000369260153 512314460 /nfs/dbraw/zinc/31/44/60/512314460.db2.gz SRKUNMOOSRNELI-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000369260153 512314462 /nfs/dbraw/zinc/31/44/62/512314462.db2.gz SRKUNMOOSRNELI-KBPBESRZSA-N 1 1 357.414 2.535 20 5 FFBDMO COc1ccc(CC(=O)N(C)CC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000067914735 507050371 /nfs/dbraw/zinc/05/03/71/507050371.db2.gz DHGDQLYGLVRCEU-UHFFFAOYSA-N 1 1 363.458 2.869 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000046054378 507068539 /nfs/dbraw/zinc/06/85/39/507068539.db2.gz GSDFEBJRHIZCKF-UHFFFAOYSA-N 1 1 355.394 2.737 20 5 FFBDMO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1OC ZINC000046054032 507069437 /nfs/dbraw/zinc/06/94/37/507069437.db2.gz BNWLVUUVYCQXBK-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1OC ZINC000046054032 507069441 /nfs/dbraw/zinc/06/94/41/507069441.db2.gz BNWLVUUVYCQXBK-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO Cc1c(C[N@@H+](C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000057843601 507340594 /nfs/dbraw/zinc/34/05/94/507340594.db2.gz SHSLSWGJUWNVTK-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO Cc1c(C[N@H+](C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cccc1[N+](=O)[O-] ZINC000057843601 507340599 /nfs/dbraw/zinc/34/05/99/507340599.db2.gz SHSLSWGJUWNVTK-CYBMUJFWSA-N 1 1 363.439 2.744 20 5 FFBDMO COc1cc(C(=O)NCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1OC ZINC000068902438 507355745 /nfs/dbraw/zinc/35/57/45/507355745.db2.gz SXSYMKDOKQMORZ-UHFFFAOYSA-N 1 1 365.430 2.606 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)Cc1ccccc1 ZINC000048245570 507488180 /nfs/dbraw/zinc/48/81/80/507488180.db2.gz HEBGXRFCIVAQKV-UHFFFAOYSA-N 1 1 360.389 2.568 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])o2)C[C@H](C)O1 ZINC000048361432 507508609 /nfs/dbraw/zinc/50/86/09/507508609.db2.gz HVUUHXCJMVUAHQ-OKILXGFUSA-N 1 1 373.409 2.727 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2CNC(=O)c2ccc([N+](=O)[O-])o2)C[C@H](C)O1 ZINC000048361432 507508616 /nfs/dbraw/zinc/50/86/16/507508616.db2.gz HVUUHXCJMVUAHQ-OKILXGFUSA-N 1 1 373.409 2.727 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NCC(C)(C)[N@H+]1CCc2ccccc2C1 ZINC000025898568 507541337 /nfs/dbraw/zinc/54/13/37/507541337.db2.gz WIFFPWCSEVGXON-UHFFFAOYSA-N 1 1 356.426 2.500 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000026227866 507570919 /nfs/dbraw/zinc/57/09/19/507570919.db2.gz QJEDUOFBNZGEEQ-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO CCc1ccc(C[N@H+](C)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000061021078 507592305 /nfs/dbraw/zinc/59/23/05/507592305.db2.gz QJLJIJCASZOCAY-GOSISDBHSA-N 1 1 367.405 2.921 20 5 FFBDMO CCc1ccc(C[N@@H+](C)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000061021078 507592311 /nfs/dbraw/zinc/59/23/11/507592311.db2.gz QJLJIJCASZOCAY-GOSISDBHSA-N 1 1 367.405 2.921 20 5 FFBDMO COC(=O)CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000063513425 507739955 /nfs/dbraw/zinc/73/99/55/507739955.db2.gz WYUZWJPEGKUMKW-UHFFFAOYSA-N 1 1 371.821 2.708 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000051469041 507772337 /nfs/dbraw/zinc/77/23/37/507772337.db2.gz UKYXLSCBQHDDEJ-LBPRGKRZSA-N 1 1 360.439 2.790 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000029622295 507784822 /nfs/dbraw/zinc/78/48/22/507784822.db2.gz GXIOXWMIGADGKJ-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 ZINC000052193010 507802186 /nfs/dbraw/zinc/80/21/86/507802186.db2.gz BOCCESUQOFOMCD-UHFFFAOYSA-N 1 1 371.441 2.766 20 5 FFBDMO O=C(C[N@@H+](C[C@@H]1CCCO1)C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000072716163 507845616 /nfs/dbraw/zinc/84/56/16/507845616.db2.gz ICAVUGSGQBFACZ-SFHVURJKSA-N 1 1 373.453 2.908 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)NCCc3cccc([N+](=O)[O-])c3)CC2)[nH+]c1 ZINC000089835253 507872591 /nfs/dbraw/zinc/87/25/91/507872591.db2.gz UKWQTEUNXFNCJW-UHFFFAOYSA-N 1 1 368.437 2.874 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986909 507881503 /nfs/dbraw/zinc/88/15/03/507881503.db2.gz SLNLQIGKHUEVJJ-KDOFPFPSSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000072986909 507881507 /nfs/dbraw/zinc/88/15/07/507881507.db2.gz SLNLQIGKHUEVJJ-KDOFPFPSSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090548800 507926884 /nfs/dbraw/zinc/92/68/84/507926884.db2.gz JHAHLRBDEBUFDO-VCBZYWHSSA-N 1 1 357.410 2.607 20 5 FFBDMO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090548800 507926885 /nfs/dbraw/zinc/92/68/85/507926885.db2.gz JHAHLRBDEBUFDO-VCBZYWHSSA-N 1 1 357.410 2.607 20 5 FFBDMO Cc1cnn([C@H]2CCC[N@@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000109133067 507941967 /nfs/dbraw/zinc/94/19/67/507941967.db2.gz SLFVEHYIYHQQNS-ZWKOTPCHSA-N 1 1 369.425 2.542 20 5 FFBDMO Cc1cnn([C@H]2CCC[N@H+]([C@@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000109133067 507941969 /nfs/dbraw/zinc/94/19/69/507941969.db2.gz SLFVEHYIYHQQNS-ZWKOTPCHSA-N 1 1 369.425 2.542 20 5 FFBDMO C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)C1CCN(c3ccccc3[N+](=O)[O-])CC1)C2 ZINC000073996347 507975249 /nfs/dbraw/zinc/97/52/49/507975249.db2.gz VLWCVTJHTHZNBS-DLBZAZTESA-N 1 1 372.469 2.506 20 5 FFBDMO O=C(c1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000091480028 507988754 /nfs/dbraw/zinc/98/87/54/507988754.db2.gz SQGNSFZYJYDAGM-AWEZNQCLSA-N 1 1 369.425 2.938 20 5 FFBDMO C[C@H](c1ccccn1)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000091702505 508003616 /nfs/dbraw/zinc/00/36/16/508003616.db2.gz KYJGDKPDYGWLPW-CYBMUJFWSA-N 1 1 356.382 2.981 20 5 FFBDMO C[C@@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000110355875 508022708 /nfs/dbraw/zinc/02/27/08/508022708.db2.gz XIDINPGXSRMMMQ-HNNXBMFYSA-N 1 1 357.410 2.610 20 5 FFBDMO COCCOc1ccccc1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000092048076 508037859 /nfs/dbraw/zinc/03/78/59/508037859.db2.gz CBQGEBVZYBBJNE-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000076495663 508214163 /nfs/dbraw/zinc/21/41/63/508214163.db2.gz UQNGBZNOKMESGZ-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000076495663 508214166 /nfs/dbraw/zinc/21/41/66/508214166.db2.gz UQNGBZNOKMESGZ-INIZCTEOSA-N 1 1 369.421 2.707 20 5 FFBDMO O=C(NCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccco1 ZINC000113317142 508260747 /nfs/dbraw/zinc/26/07/47/508260747.db2.gz FIIRUKSCDGGJKN-UHFFFAOYSA-N 1 1 372.406 2.831 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCOCC1CC1 ZINC000088599976 508378425 /nfs/dbraw/zinc/37/84/25/508378425.db2.gz QECQMLWWSGRHCV-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCOCC1CC1 ZINC000088599976 508378427 /nfs/dbraw/zinc/37/84/27/508378427.db2.gz QECQMLWWSGRHCV-NSHDSACASA-N 1 1 355.822 2.934 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)[C@H](C)C1 ZINC000115273313 508380404 /nfs/dbraw/zinc/38/04/04/508380404.db2.gz GQPBEQCVSDLOQQ-OLZOCXBDSA-N 1 1 355.460 2.523 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](C)C1 ZINC000115275026 508380409 /nfs/dbraw/zinc/38/04/09/508380409.db2.gz UMNYCBWUIJQIEU-CXAGYDPISA-N 1 1 367.421 2.601 20 5 FFBDMO CCOC(=O)c1ccnc(N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000077932964 508393406 /nfs/dbraw/zinc/39/34/06/508393406.db2.gz JKNIMFFTAQNWCI-QWHCGFSZSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1OC ZINC000133827956 508455246 /nfs/dbraw/zinc/45/52/46/508455246.db2.gz ZNJTVBWLZIKJHO-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO COc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1O ZINC000156847073 508486446 /nfs/dbraw/zinc/48/64/46/508486446.db2.gz RXJMRNMFWRPPFC-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1O ZINC000156847073 508486447 /nfs/dbraw/zinc/48/64/47/508486447.db2.gz RXJMRNMFWRPPFC-LBPRGKRZSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCc2ccccc2CC1 ZINC000116299446 508495834 /nfs/dbraw/zinc/49/58/34/508495834.db2.gz BSPGSMGAPXXPQF-UHFFFAOYSA-N 1 1 355.394 2.643 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152762760 508510733 /nfs/dbraw/zinc/51/07/33/508510733.db2.gz WDSUYDGGPVRIJM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000152762760 508510738 /nfs/dbraw/zinc/51/07/38/508510738.db2.gz WDSUYDGGPVRIJM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000153410496 508580658 /nfs/dbraw/zinc/58/06/58/508580658.db2.gz PGAASCZHSOQAEH-WCQYABFASA-N 1 1 355.822 2.568 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000157709489 508600709 /nfs/dbraw/zinc/60/07/09/508600709.db2.gz MWBBTOCVUNKOAR-HNNXBMFYSA-N 1 1 371.441 2.775 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000122946645 508611844 /nfs/dbraw/zinc/61/18/44/508611844.db2.gz SAQNOUSMISBFCF-GXTWGEPZSA-N 1 1 369.849 2.958 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153656924 508619245 /nfs/dbraw/zinc/61/92/45/508619245.db2.gz GTTHDIDRQMQNTJ-OKILXGFUSA-N 1 1 367.881 2.638 20 5 FFBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000157905970 508630644 /nfs/dbraw/zinc/63/06/44/508630644.db2.gz UUTGSMSWNJTCHF-CQSZACIVSA-N 1 1 356.426 2.851 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000157906126 508630685 /nfs/dbraw/zinc/63/06/85/508630685.db2.gz UUTGSMSWNJTCHF-AWEZNQCLSA-N 1 1 356.426 2.851 20 5 FFBDMO CN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@@H]1CCC[N@@H+](C)C1 ZINC000153751316 508642292 /nfs/dbraw/zinc/64/22/92/508642292.db2.gz YSWKXSOLLNGEMU-LLVKDONJSA-N 1 1 356.220 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1SC ZINC000123206918 508651945 /nfs/dbraw/zinc/65/19/45/508651945.db2.gz SLUFCUOHQUGOLZ-NWDGAFQWSA-N 1 1 367.471 2.880 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136125736 508672476 /nfs/dbraw/zinc/67/24/76/508672476.db2.gz XEJOJWALQGQFDZ-OAHLLOKOSA-N 1 1 358.442 2.951 20 5 FFBDMO COc1cc(C(=O)NC[C@@H](C)[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000153934373 508680220 /nfs/dbraw/zinc/68/02/20/508680220.db2.gz NUINZWWGNJDQLP-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137527527 508759182 /nfs/dbraw/zinc/75/91/82/508759182.db2.gz AGYDHZJKODIEMD-MAUKXSAKSA-N 1 1 353.422 2.917 20 5 FFBDMO C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123943066 508761014 /nfs/dbraw/zinc/76/10/14/508761014.db2.gz WMKQORYTWWGCSF-WCQYABFASA-N 1 1 354.838 2.601 20 5 FFBDMO CSCC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000138256285 508770432 /nfs/dbraw/zinc/77/04/32/508770432.db2.gz ROYZNMDLVIYDGA-UHFFFAOYSA-N 1 1 362.249 2.591 20 5 FFBDMO CSCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000138256285 508770437 /nfs/dbraw/zinc/77/04/37/508770437.db2.gz ROYZNMDLVIYDGA-UHFFFAOYSA-N 1 1 362.249 2.591 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000139940133 508798250 /nfs/dbraw/zinc/79/82/50/508798250.db2.gz NAMXVAZLCAUTKH-DOMZBBRYSA-N 1 1 366.849 2.603 20 5 FFBDMO CC[C@H](c1ccncc1)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130223826 508805900 /nfs/dbraw/zinc/80/59/00/508805900.db2.gz XCRYZYBLWNRYFR-QGZVFWFLSA-N 1 1 354.410 2.962 20 5 FFBDMO CC[C@H](c1ccncc1)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000130223826 508805903 /nfs/dbraw/zinc/80/59/03/508805903.db2.gz XCRYZYBLWNRYFR-QGZVFWFLSA-N 1 1 354.410 2.962 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCn1ccnc1 ZINC000124359658 508820336 /nfs/dbraw/zinc/82/03/36/508820336.db2.gz YWKIIQYESOWNAC-ZDUSSCGKSA-N 1 1 356.386 2.924 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159452090 508843996 /nfs/dbraw/zinc/84/39/96/508843996.db2.gz LBXJJXJFPFEYRV-PGUXBMHVSA-N 1 1 355.822 2.668 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)[NH+]1CCOCC1 ZINC000119840378 508873677 /nfs/dbraw/zinc/87/36/77/508873677.db2.gz UWTCDNMHFNCIMY-HNNXBMFYSA-N 1 1 374.441 2.553 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1 ZINC000159807723 508893446 /nfs/dbraw/zinc/89/34/46/508893446.db2.gz NZPIPUZTBNMKGB-GOSISDBHSA-N 1 1 359.426 2.533 20 5 FFBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)c1 ZINC000159850838 508900152 /nfs/dbraw/zinc/90/01/52/508900152.db2.gz WKIYBHGPKZGTKZ-SFHVURJKSA-N 1 1 356.426 2.660 20 5 FFBDMO CCc1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000155302611 508972118 /nfs/dbraw/zinc/97/21/18/508972118.db2.gz CSSNCXLAQBVVQE-GOSISDBHSA-N 1 1 356.422 2.955 20 5 FFBDMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000155526892 509020020 /nfs/dbraw/zinc/02/00/20/509020020.db2.gz QPSCETIOLMNWTA-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000155526892 509020021 /nfs/dbraw/zinc/02/00/21/509020021.db2.gz QPSCETIOLMNWTA-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000155540833 509022093 /nfs/dbraw/zinc/02/20/93/509022093.db2.gz BUAWCHMKOYZQTH-HZPDHXFCSA-N 1 1 363.461 2.706 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000371497890 512434939 /nfs/dbraw/zinc/43/49/39/512434939.db2.gz SDODSVYUOXLPGD-GFCCVEGCSA-N 1 1 355.341 2.507 20 5 FFBDMO Cn1cc(N2CC[NH+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)cn1 ZINC000126097327 509062769 /nfs/dbraw/zinc/06/27/69/509062769.db2.gz AVFJCBAFWDZZND-UHFFFAOYSA-N 1 1 367.409 2.911 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)NC(C)(C)C[N@@H+](C)Cc1ccccc1 ZINC000133222051 509134509 /nfs/dbraw/zinc/13/45/09/509134509.db2.gz CAAVQRQWABMPAD-UHFFFAOYSA-N 1 1 373.457 2.517 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[N@H+]1C1CC1 ZINC000182350695 509190027 /nfs/dbraw/zinc/19/00/27/509190027.db2.gz AGTQNNUJVALKDH-NXEZZACHSA-N 1 1 355.341 2.551 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000191831137 509201740 /nfs/dbraw/zinc/20/17/40/509201740.db2.gz QPNIVJNVDXWCPE-XUJVJEKNSA-N 1 1 374.397 2.837 20 5 FFBDMO COC(=O)[C@H]1CC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000191831137 509201748 /nfs/dbraw/zinc/20/17/48/509201748.db2.gz QPNIVJNVDXWCPE-XUJVJEKNSA-N 1 1 374.397 2.837 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000247961970 509202125 /nfs/dbraw/zinc/20/21/25/509202125.db2.gz GJEJBNOHHNBZGN-CZUORRHYSA-N 1 1 351.834 2.733 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)NCC2(N3CCCCC3)CC[NH+](C)CC2)c1 ZINC000172748847 509210457 /nfs/dbraw/zinc/21/04/57/509210457.db2.gz JLEVSYDJWFKUGQ-UHFFFAOYSA-N 1 1 374.485 2.583 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2c([N+](=O)[O-])cnn2C)cc1 ZINC000162388272 509214028 /nfs/dbraw/zinc/21/40/28/509214028.db2.gz MFMPWWYRYWMIES-ZDUSSCGKSA-N 1 1 357.414 2.955 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CC[NH+](CCOCC(F)(F)C(F)F)CC2)c1 ZINC000188737810 509239717 /nfs/dbraw/zinc/23/97/17/509239717.db2.gz RDDLWEOADCWRJA-UHFFFAOYSA-N 1 1 365.327 2.634 20 5 FFBDMO Cc1c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000172832816 509262660 /nfs/dbraw/zinc/26/26/60/509262660.db2.gz RTPNCYUHZBEHHT-CYBMUJFWSA-N 1 1 364.402 2.758 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000179115318 509271188 /nfs/dbraw/zinc/27/11/88/509271188.db2.gz IBMBRSMXNJWZTA-MSOLQXFVSA-N 1 1 354.410 2.839 20 5 FFBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C12CCC2 ZINC000248457201 509329489 /nfs/dbraw/zinc/32/94/89/509329489.db2.gz MEMCCIZYMURHED-ZTFGCOKTSA-N 1 1 364.442 2.614 20 5 FFBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650052 509350550 /nfs/dbraw/zinc/35/05/50/509350550.db2.gz XXNOLVSIKLBXSV-YPMHNXCESA-N 1 1 374.384 2.983 20 5 FFBDMO COc1cc(C[N@H+]2[C@H](C)CCC[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000182650052 509350557 /nfs/dbraw/zinc/35/05/57/509350557.db2.gz XXNOLVSIKLBXSV-YPMHNXCESA-N 1 1 374.384 2.983 20 5 FFBDMO C[C@H](c1ccccc1Cl)N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000176203850 509377039 /nfs/dbraw/zinc/37/70/39/509377039.db2.gz ZCNPFXFQQSQICC-CQSZACIVSA-N 1 1 363.849 2.824 20 5 FFBDMO O=C1[C@H]([NH+]2CCC([C@@H]3CCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000189163638 509444417 /nfs/dbraw/zinc/44/44/17/509444417.db2.gz RCJVGPMQKGMJJV-MSOLQXFVSA-N 1 1 359.426 2.591 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000267428317 509476250 /nfs/dbraw/zinc/47/62/50/509476250.db2.gz CCYFAPWRIXRXOA-CMPLNLGQSA-N 1 1 370.247 2.912 20 5 FFBDMO O=C(c1ccc(Br)cc1[N+](=O)[O-])N1CC[NH+](C2CCC2)CC1 ZINC000267494837 509517233 /nfs/dbraw/zinc/51/72/33/509517233.db2.gz XYLREQSEUUMREW-UHFFFAOYSA-N 1 1 368.231 2.668 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccnc(N2CCN(C)CC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173326282 509534499 /nfs/dbraw/zinc/53/44/99/509534499.db2.gz UTDCLJFZDLJGFK-OAHLLOKOSA-N 1 1 355.442 2.592 20 5 FFBDMO CC1(C)CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@@H+]1Cc1ccccc1 ZINC000176510187 509551281 /nfs/dbraw/zinc/55/12/81/509551281.db2.gz NVPBKXXVURFAEJ-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC1(C)CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1Cc1ccccc1 ZINC000176510187 509551285 /nfs/dbraw/zinc/55/12/85/509551285.db2.gz NVPBKXXVURFAEJ-UHFFFAOYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC(=O)N1CC[NH+](Cc2cccc(NCc3ccc([N+](=O)[O-])cc3)c2)CC1 ZINC000189514525 509612814 /nfs/dbraw/zinc/61/28/14/509612814.db2.gz OXMRRUWFYUIIDX-UHFFFAOYSA-N 1 1 368.437 2.871 20 5 FFBDMO Nc1c(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000176706390 509651441 /nfs/dbraw/zinc/65/14/41/509651441.db2.gz YJWPKLKWSKVAFI-OAHLLOKOSA-N 1 1 354.410 2.571 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000267937883 509678739 /nfs/dbraw/zinc/67/87/39/509678739.db2.gz NFKQBSKKCSVRKH-JTQLQIEISA-N 1 1 374.210 2.711 20 5 FFBDMO CC[C@]1(CO)CCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000189671769 509694379 /nfs/dbraw/zinc/69/43/79/509694379.db2.gz HRBXXVJMOALGAP-QGZVFWFLSA-N 1 1 374.384 2.984 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000249686845 509734185 /nfs/dbraw/zinc/73/41/85/509734185.db2.gz JCTBIILOVMSSRH-UONOGXRCSA-N 1 1 364.446 2.523 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)Nc3cccc([N+](=O)[O-])c3)CC2)nc(C)[nH+]1 ZINC000176896435 509751145 /nfs/dbraw/zinc/75/11/45/509751145.db2.gz ZPUXFMDGSOMNTK-UHFFFAOYSA-N 1 1 370.413 2.792 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000268108150 509760251 /nfs/dbraw/zinc/76/02/51/509760251.db2.gz GDBGPBFXHSNRHW-IAQYHMDHSA-N 1 1 354.838 2.730 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@@H]2C[NH+]2C[C@H](C)O[C@@H](C)C2)cc([N+](=O)[O-])c1 ZINC000250116058 509788437 /nfs/dbraw/zinc/78/84/37/509788437.db2.gz PIQFZROUNDJUOJ-YQQAZPJKSA-N 1 1 361.442 2.617 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cc1SC ZINC000268171640 509794064 /nfs/dbraw/zinc/79/40/64/509794064.db2.gz FBNBPGSMWDDZRT-ZWNOBZJWSA-N 1 1 365.455 2.538 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000193164816 509802647 /nfs/dbraw/zinc/80/26/47/509802647.db2.gz HTCIUUGXPLAFLV-MRXNPFEDSA-N 1 1 354.410 2.693 20 5 FFBDMO COC(=O)[C@@H]1CCCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906602 509842384 /nfs/dbraw/zinc/84/23/84/509842384.db2.gz YZMZWSZTCAEGPN-HNNXBMFYSA-N 1 1 359.382 2.820 20 5 FFBDMO COC(=O)[C@@H]1CCCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906602 509842386 /nfs/dbraw/zinc/84/23/86/509842386.db2.gz YZMZWSZTCAEGPN-HNNXBMFYSA-N 1 1 359.382 2.820 20 5 FFBDMO O=C(C[N@H+](CCc1ccccc1)[C@H]1CCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000177141744 509898190 /nfs/dbraw/zinc/89/81/90/509898190.db2.gz NYSRLWWCCOUBPM-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(C[N@@H+](CCc1ccccc1)[C@H]1CCOC1)Nc1ccccc1[N+](=O)[O-] ZINC000177141744 509898197 /nfs/dbraw/zinc/89/81/97/509898197.db2.gz NYSRLWWCCOUBPM-KRWDZBQOSA-N 1 1 369.421 2.867 20 5 FFBDMO CC[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@H]1c1ccccc1 ZINC000245437374 509932627 /nfs/dbraw/zinc/93/26/27/509932627.db2.gz RMABLHTUTRQBLT-AYOQOUSVSA-N 1 1 358.442 2.668 20 5 FFBDMO C[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1 ZINC000180465095 509937156 /nfs/dbraw/zinc/93/71/56/509937156.db2.gz HCRZXFQSOQIXQZ-UTKZUKDTSA-N 1 1 368.481 2.910 20 5 FFBDMO Cc1cc(NC(=O)NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000193584341 509975994 /nfs/dbraw/zinc/97/59/94/509975994.db2.gz XAXORVKZAROZCN-ZIAGYGMSSA-N 1 1 364.446 2.913 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000245537498 509989414 /nfs/dbraw/zinc/98/94/14/509989414.db2.gz ZTAXNAQGPNYNKP-UXHICEINSA-N 1 1 354.406 2.802 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCO[C@@]3(CCc4ccccc43)C2)c1 ZINC000245537498 509989415 /nfs/dbraw/zinc/98/94/15/509989415.db2.gz ZTAXNAQGPNYNKP-UXHICEINSA-N 1 1 354.406 2.802 20 5 FFBDMO COc1cccc2c1CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000193728660 510039912 /nfs/dbraw/zinc/03/99/12/510039912.db2.gz KEGZDPOLGWSUNS-UHFFFAOYSA-N 1 1 369.421 2.667 20 5 FFBDMO COc1cccc2c1CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000193728660 510039917 /nfs/dbraw/zinc/03/99/17/510039917.db2.gz KEGZDPOLGWSUNS-UHFFFAOYSA-N 1 1 369.421 2.667 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193760793 510054521 /nfs/dbraw/zinc/05/45/21/510054521.db2.gz ICBFZTJXGKTFNZ-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO Cc1ccc(CN(C)C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000190315010 510059415 /nfs/dbraw/zinc/05/94/15/510059415.db2.gz NVNMLFOJDSPQFH-NRFANRHFSA-N 1 1 369.465 2.972 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])c4cccnc34)CC[C@H]21 ZINC000245706202 510099199 /nfs/dbraw/zinc/09/91/99/510099199.db2.gz DHWCIFDAUQDTRA-CZUORRHYSA-N 1 1 354.410 2.699 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[NH2+]C[C@H]2c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000261906323 510110573 /nfs/dbraw/zinc/11/05/73/510110573.db2.gz GZYWHBKLSRCPQO-KRWDZBQOSA-N 1 1 373.384 2.919 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1 ZINC000193894570 510118323 /nfs/dbraw/zinc/11/83/23/510118323.db2.gz FQIPKMRJFYBGQX-GASCZTMLSA-N 1 1 369.487 2.631 20 5 FFBDMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000261945801 510125700 /nfs/dbraw/zinc/12/57/00/510125700.db2.gz LBUCXXYBYRUTFJ-GOSISDBHSA-N 1 1 357.385 2.840 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000194012230 510174957 /nfs/dbraw/zinc/17/49/57/510174957.db2.gz BNDYHLOHNUOOHO-GASCZTMLSA-N 1 1 364.446 2.785 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000194012230 510174964 /nfs/dbraw/zinc/17/49/64/510174964.db2.gz BNDYHLOHNUOOHO-GASCZTMLSA-N 1 1 364.446 2.785 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1C ZINC000262096068 510176218 /nfs/dbraw/zinc/17/62/18/510176218.db2.gz YXLKVZMUORRYCU-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1 ZINC000194019955 510178551 /nfs/dbraw/zinc/17/85/51/510178551.db2.gz LYWSHBOHKIOZEV-INIZCTEOSA-N 1 1 372.425 2.582 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@@H]3CCC[N@H+]3Cc3ccccc32)cc1 ZINC000180949236 510201956 /nfs/dbraw/zinc/20/19/56/510201956.db2.gz JCLBFPLRPTUWQI-INIZCTEOSA-N 1 1 373.434 2.768 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cc1Br ZINC000265757253 510212685 /nfs/dbraw/zinc/21/26/85/510212685.db2.gz JHWQPNODCMDALK-KGLIPLIRSA-N 1 1 368.231 2.714 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[N@H+]4CCCC[C@@H]4C3)o2)c1 ZINC000177760914 510237613 /nfs/dbraw/zinc/23/76/13/510237613.db2.gz AFMIMZFAGGRQBC-QGZVFWFLSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCN4CCCC[C@@H]4C3)o2)c1 ZINC000177760914 510237618 /nfs/dbraw/zinc/23/76/18/510237618.db2.gz AFMIMZFAGGRQBC-QGZVFWFLSA-N 1 1 356.426 2.962 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCN4CCCC[C@@H]4C3)o2)c1 ZINC000177760914 510237625 /nfs/dbraw/zinc/23/76/25/510237625.db2.gz AFMIMZFAGGRQBC-QGZVFWFLSA-N 1 1 356.426 2.962 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](Cc3nccn3C)C2)c([N+](=O)[O-])cc1F ZINC000184289098 510242374 /nfs/dbraw/zinc/24/23/74/510242374.db2.gz NJANADIQNMNMSX-CYBMUJFWSA-N 1 1 362.405 2.931 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000174819435 510327446 /nfs/dbraw/zinc/32/74/46/510327446.db2.gz ISMQWZOOEWKVPE-LSDHHAIUSA-N 1 1 371.224 2.688 20 5 FFBDMO CCCc1n[nH]c(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000171804028 510380609 /nfs/dbraw/zinc/38/06/09/510380609.db2.gz QXPVVIQJXAACQC-UHFFFAOYSA-N 1 1 351.451 2.607 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)CC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000171804028 510380616 /nfs/dbraw/zinc/38/06/16/510380616.db2.gz QXPVVIQJXAACQC-UHFFFAOYSA-N 1 1 351.451 2.607 20 5 FFBDMO CCCc1[nH]nc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000171804028 510380622 /nfs/dbraw/zinc/38/06/22/510380622.db2.gz QXPVVIQJXAACQC-UHFFFAOYSA-N 1 1 351.451 2.607 20 5 FFBDMO COc1cc(C[N@H+]2[C@@H](CO)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000181404079 510392428 /nfs/dbraw/zinc/39/24/28/510392428.db2.gz RYTZDVKFBDRKQO-CMPLNLGQSA-N 1 1 360.357 2.940 20 5 FFBDMO COc1cc(C[N@@H+]2[C@@H](CO)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000181404079 510392434 /nfs/dbraw/zinc/39/24/34/510392434.db2.gz RYTZDVKFBDRKQO-CMPLNLGQSA-N 1 1 360.357 2.940 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246270940 510400508 /nfs/dbraw/zinc/40/05/08/510400508.db2.gz AEJMGEZJPBMYLI-KXBFYZLASA-N 1 1 372.469 2.790 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1 ZINC000246371639 510451835 /nfs/dbraw/zinc/45/18/35/510451835.db2.gz LWVUMMULJBMCBS-LSDHHAIUSA-N 1 1 360.458 2.904 20 5 FFBDMO O=C(CC[N@@H+]1CCO[C@@H](Cc2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000181534102 510459517 /nfs/dbraw/zinc/45/95/17/510459517.db2.gz ARRVEHHCYXTNDL-IBGZPJMESA-N 1 1 369.421 2.867 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@@H](Cc2ccccc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000181534102 510459522 /nfs/dbraw/zinc/45/95/22/510459522.db2.gz ARRVEHHCYXTNDL-IBGZPJMESA-N 1 1 369.421 2.867 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3C)CC2)nc(C)[nH+]1 ZINC000178181211 510473955 /nfs/dbraw/zinc/47/39/55/510473955.db2.gz RTQKOBVIZRJHLW-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO C[C@@H](CCN1CC[NH+](C)CC1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000184828240 510535481 /nfs/dbraw/zinc/53/54/81/510535481.db2.gz SNWIGLQBPDTSIX-LBPRGKRZSA-N 1 1 358.389 2.634 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000269808564 510555112 /nfs/dbraw/zinc/55/51/12/510555112.db2.gz GLQCKADEOKWMAK-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2Cc2ccccc2Cl)c1 ZINC000246661864 510607077 /nfs/dbraw/zinc/60/70/77/510607077.db2.gz FHTFXGAUYDKNHJ-GDBMZVCRSA-N 1 1 364.833 2.513 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000188212525 510650511 /nfs/dbraw/zinc/65/05/11/510650511.db2.gz YKUFYTGHFCDMSL-KRWDZBQOSA-N 1 1 368.437 2.914 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)[C@@H](C)C1 ZINC000246787329 510674580 /nfs/dbraw/zinc/67/45/80/510674580.db2.gz MJGLHZHQYKHUHG-GXTWGEPZSA-N 1 1 369.487 2.832 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000246818016 510691553 /nfs/dbraw/zinc/69/15/53/510691553.db2.gz SDOWGENASWGSCC-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000246818016 510691557 /nfs/dbraw/zinc/69/15/57/510691557.db2.gz SDOWGENASWGSCC-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](CCO)c1ccccc1 ZINC000266627511 510695664 /nfs/dbraw/zinc/69/56/64/510695664.db2.gz OIEGHTSRJDDXBF-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC000266627511 510695667 /nfs/dbraw/zinc/69/56/67/510695667.db2.gz OIEGHTSRJDDXBF-KRWDZBQOSA-N 1 1 373.409 2.597 20 5 FFBDMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000246880039 510724478 /nfs/dbraw/zinc/72/44/78/510724478.db2.gz FVOMDHJWBZCQQZ-HOTGVXAUSA-N 1 1 358.442 2.868 20 5 FFBDMO C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1ccccc1 ZINC000270235553 510727725 /nfs/dbraw/zinc/72/77/25/510727725.db2.gz BEGHVEQKPREZPX-MOPGFXCFSA-N 1 1 369.421 2.996 20 5 FFBDMO C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1ccccc1 ZINC000270235553 510727727 /nfs/dbraw/zinc/72/77/27/510727727.db2.gz BEGHVEQKPREZPX-MOPGFXCFSA-N 1 1 369.421 2.996 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000246944444 510761953 /nfs/dbraw/zinc/76/19/53/510761953.db2.gz CBMLPFOHMIGJCE-CKEIUWERSA-N 1 1 357.414 2.701 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@H]2CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000247008505 510796074 /nfs/dbraw/zinc/79/60/74/510796074.db2.gz FRRPTJMWCHDFIZ-YOEHRIQHSA-N 1 1 356.426 2.961 20 5 FFBDMO C[N@H+](CCCc1ccccc1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182211277 510815837 /nfs/dbraw/zinc/81/58/37/510815837.db2.gz NUTCNJDDTLFEPK-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO C[N@@H+](CCCc1ccccc1)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000182211277 510815841 /nfs/dbraw/zinc/81/58/41/510815841.db2.gz NUTCNJDDTLFEPK-UHFFFAOYSA-N 1 1 362.451 2.933 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000297711923 511043114 /nfs/dbraw/zinc/04/31/14/511043114.db2.gz NCQZDGJOIKIUTH-BXUZGUMPSA-N 1 1 353.394 2.545 20 5 FFBDMO CC(C)[N@H+]1CCCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000271008223 511054146 /nfs/dbraw/zinc/05/41/46/511054146.db2.gz OHHUEVWVMTWMPE-UHFFFAOYSA-N 1 1 357.458 2.911 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)Cc1ccncc1 ZINC000271019192 511058022 /nfs/dbraw/zinc/05/80/22/511058022.db2.gz NRMXKHGXDNBJIN-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H]2CCCC[C@H]21 ZINC000297802748 511072496 /nfs/dbraw/zinc/07/24/96/511072496.db2.gz HYUZMUFZFQQSIT-CVEARBPZSA-N 1 1 363.414 2.575 20 5 FFBDMO COc1ccc(OCC[N@H+]2CC[C@H](C3CCOCC3)C2)c([N+](=O)[O-])c1 ZINC000361940038 511105942 /nfs/dbraw/zinc/10/59/42/511105942.db2.gz AMUAXIQOPNCQBL-HNNXBMFYSA-N 1 1 350.415 2.731 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294593250 511113990 /nfs/dbraw/zinc/11/39/90/511113990.db2.gz QSJUATDPTCRGAM-SNVBAGLBSA-N 1 1 357.332 2.828 20 5 FFBDMO CC(C)(CCC(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1)[N+](=O)[O-] ZINC000294677708 511140666 /nfs/dbraw/zinc/14/06/66/511140666.db2.gz JNLRGMHOFIOSTF-UHFFFAOYSA-N 1 1 359.470 2.871 20 5 FFBDMO O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000279646832 511159618 /nfs/dbraw/zinc/15/96/18/511159618.db2.gz WHVBSBYIGJTGCG-JTQLQIEISA-N 1 1 355.797 2.530 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CCN([C@@H]2CCC[C@@H]2O)CC1)C1CC1 ZINC000271454075 511210607 /nfs/dbraw/zinc/21/06/07/511210607.db2.gz FAVGCHHYVXISQP-TYPHKJRUSA-N 1 1 373.497 2.883 20 5 FFBDMO Cn1cc([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)CC23CCOCC3)cn1 ZINC000295108538 511284708 /nfs/dbraw/zinc/28/47/08/511284708.db2.gz IEDSCLMWRWKCJN-INIZCTEOSA-N 1 1 374.416 2.864 20 5 FFBDMO COc1ccc([C@@H](CO)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000283224159 511284802 /nfs/dbraw/zinc/28/48/02/511284802.db2.gz IDHKAZLUZNHRIA-GOSISDBHSA-N 1 1 373.409 2.597 20 5 FFBDMO O=C(CC[N@@H+]1CCC[C@H]1CN1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000283224290 511284912 /nfs/dbraw/zinc/28/49/12/511284912.db2.gz IELDAVJMGCFLES-INIZCTEOSA-N 1 1 360.458 2.874 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1CN1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000283224290 511284916 /nfs/dbraw/zinc/28/49/16/511284916.db2.gz IELDAVJMGCFLES-INIZCTEOSA-N 1 1 360.458 2.874 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3ccncn3)CC2)cccc1[N+](=O)[O-] ZINC000298541364 511322151 /nfs/dbraw/zinc/32/21/51/511322151.db2.gz XMMBNMUKFZVUQP-CQSZACIVSA-N 1 1 369.425 2.900 20 5 FFBDMO C[C@H]1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000292062259 511450647 /nfs/dbraw/zinc/45/06/47/511450647.db2.gz WSLYUOXICPTSGL-OAHLLOKOSA-N 1 1 360.458 2.653 20 5 FFBDMO C[C@H]1C[C@@H](c2cccnc2)[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587676 511546070 /nfs/dbraw/zinc/54/60/70/511546070.db2.gz QWYPPTKQJXNJKX-LIRRHRJNSA-N 1 1 366.421 2.962 20 5 FFBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1 ZINC000365587676 511546072 /nfs/dbraw/zinc/54/60/72/511546072.db2.gz QWYPPTKQJXNJKX-LIRRHRJNSA-N 1 1 366.421 2.962 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCCO)CC(C)(C)C ZINC000299389586 511618007 /nfs/dbraw/zinc/61/80/07/511618007.db2.gz UALSBIGDWPRWEG-UHFFFAOYSA-N 1 1 367.446 2.663 20 5 FFBDMO COc1cc(C[NH2+]Cc2cc(C)nn2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000284417804 511715249 /nfs/dbraw/zinc/71/52/49/511715249.db2.gz QZTKBAOWKOICAO-UHFFFAOYSA-N 1 1 370.356 2.579 20 5 FFBDMO CC(C)(O)C[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000303265196 511732357 /nfs/dbraw/zinc/73/23/57/511732357.db2.gz BIDITVWTHBNBFJ-UHFFFAOYSA-N 1 1 363.461 2.917 20 5 FFBDMO CC[N@@H+]1CCO[C@@H](CNc2c([N+](=O)[O-])c(C)nn2C)[C@@H]1c1ccccc1 ZINC000284602168 511788983 /nfs/dbraw/zinc/78/89/83/511788983.db2.gz LASYBOVXDGLKFF-RDJZCZTQSA-N 1 1 359.430 2.511 20 5 FFBDMO CC[N@H+]1CCO[C@@H](CNc2c([N+](=O)[O-])c(C)nn2C)[C@@H]1c1ccccc1 ZINC000284602168 511788986 /nfs/dbraw/zinc/78/89/86/511788986.db2.gz LASYBOVXDGLKFF-RDJZCZTQSA-N 1 1 359.430 2.511 20 5 FFBDMO C[C@@]12CCC[N@@H+]1C[C@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388264 511799186 /nfs/dbraw/zinc/79/91/86/511799186.db2.gz KOPBTYOSAQJPCY-QAPCUYQASA-N 1 1 373.413 2.558 20 5 FFBDMO C[C@@]12CCC[N@H+]1C[C@H](c1noc(CCNc3ccccc3[N+](=O)[O-])n1)OC2 ZINC000350388264 511799190 /nfs/dbraw/zinc/79/91/90/511799190.db2.gz KOPBTYOSAQJPCY-QAPCUYQASA-N 1 1 373.413 2.558 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110226 511843624 /nfs/dbraw/zinc/84/36/24/511843624.db2.gz QVNHGZZAQBRWQN-HNAYVOBHSA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@](CO)(C(C)C)C2)cccc1[N+](=O)[O-] ZINC000293110226 511843632 /nfs/dbraw/zinc/84/36/32/511843632.db2.gz QVNHGZZAQBRWQN-HNAYVOBHSA-N 1 1 363.458 2.961 20 5 FFBDMO CCOc1cc(C[NH2+][C@@]2(CO)CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000281589526 511901136 /nfs/dbraw/zinc/90/11/36/511901136.db2.gz DWZMYEGTTHWHMS-LJQANCHMSA-N 1 1 358.394 2.753 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)N2CC[N@H+](C3CC3)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000296801112 511903287 /nfs/dbraw/zinc/90/32/87/511903287.db2.gz UECRVMFMPWIILU-DZGCQCFKSA-N 1 1 360.458 2.646 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875402 511972799 /nfs/dbraw/zinc/97/27/99/511972799.db2.gz XIUYKPQCHWLSHB-DLBZAZTESA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875402 511972804 /nfs/dbraw/zinc/97/28/04/511972804.db2.gz XIUYKPQCHWLSHB-DLBZAZTESA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000274875402 511972806 /nfs/dbraw/zinc/97/28/06/511972806.db2.gz XIUYKPQCHWLSHB-DLBZAZTESA-N 1 1 365.474 2.700 20 5 FFBDMO COCCc1ccc(OC[C@@H](O)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000293525516 511997841 /nfs/dbraw/zinc/99/78/41/511997841.db2.gz PBFBLIAUGGUGLR-SFHVURJKSA-N 1 1 374.437 2.655 20 5 FFBDMO COCCc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000293525516 511997846 /nfs/dbraw/zinc/99/78/46/511997846.db2.gz PBFBLIAUGGUGLR-SFHVURJKSA-N 1 1 374.437 2.655 20 5 FFBDMO C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)C2)C1 ZINC000293605352 512024665 /nfs/dbraw/zinc/02/46/65/512024665.db2.gz CHQPPDYUJNTJLA-OAHLLOKOSA-N 1 1 368.231 2.525 20 5 FFBDMO COc1ccc([C@H](CO)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000411270856 512554875 /nfs/dbraw/zinc/55/48/75/512554875.db2.gz QFEMXPNBQZAEPK-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](Cc4c([N+](=O)[O-])ncn4C)C3)nc2c1 ZINC000367618544 512586496 /nfs/dbraw/zinc/58/64/96/512586496.db2.gz PSXYMKVULYNTER-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2[nH]c([C@H]3CCC[N@H+](Cc4c([N+](=O)[O-])ncn4C)C3)nc2c1 ZINC000367618544 512586499 /nfs/dbraw/zinc/58/64/99/512586499.db2.gz PSXYMKVULYNTER-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](Cc4c([N+](=O)[O-])ncn4C)C3)[nH]c2c1 ZINC000367618544 512586505 /nfs/dbraw/zinc/58/65/05/512586505.db2.gz PSXYMKVULYNTER-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO Cc1ccc2nc([C@H]3CCC[N@H+](Cc4c([N+](=O)[O-])ncn4C)C3)[nH]c2c1 ZINC000367618544 512586508 /nfs/dbraw/zinc/58/65/08/512586508.db2.gz PSXYMKVULYNTER-ZDUSSCGKSA-N 1 1 354.414 2.893 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4c[nH]cn4)CC3)n2)c1 ZINC000374197802 512704172 /nfs/dbraw/zinc/70/41/72/512704172.db2.gz FQAMCLMOIYVXTI-UHFFFAOYSA-N 1 1 354.370 2.748 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cccc1[N+](=O)[O-] ZINC000370012962 512728404 /nfs/dbraw/zinc/72/84/04/512728404.db2.gz UKXSPVFPJHDPGS-HNNXBMFYSA-N 1 1 371.441 2.530 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)C1 ZINC000374301613 512753753 /nfs/dbraw/zinc/75/37/53/512753753.db2.gz KKVJQGDKDAHADR-OALUTQOASA-N 1 1 353.422 2.741 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@H]1CCO ZINC000411706576 512770762 /nfs/dbraw/zinc/77/07/62/512770762.db2.gz XRISDWQHKPBDLC-AWEZNQCLSA-N 1 1 365.430 2.559 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(N2CC[C@@H](c3[nH+]ccn3C)C2)cc1Cl ZINC000374354476 512785927 /nfs/dbraw/zinc/78/59/27/512785927.db2.gz UKWSSELWIFFHKY-SNVBAGLBSA-N 1 1 364.789 2.762 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000372296350 512801689 /nfs/dbraw/zinc/80/16/89/512801689.db2.gz VTQSXQUOHZOZCB-INIZCTEOSA-N 1 1 355.394 2.667 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000372296350 512801694 /nfs/dbraw/zinc/80/16/94/512801694.db2.gz VTQSXQUOHZOZCB-INIZCTEOSA-N 1 1 355.394 2.667 20 5 FFBDMO Nc1c(C(=O)NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000379688637 512871925 /nfs/dbraw/zinc/87/19/25/512871925.db2.gz ZLCOWPNXOOLBAG-INIZCTEOSA-N 1 1 368.437 2.962 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2cccc([N+](=O)[O-])c2N)CCC1 ZINC000386688805 512889743 /nfs/dbraw/zinc/88/97/43/512889743.db2.gz JYMRJPJGGQCMRL-UHFFFAOYSA-N 1 1 368.437 2.962 20 5 FFBDMO C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000374797699 513009151 /nfs/dbraw/zinc/00/91/51/513009151.db2.gz FUSIWKIWWUYVAW-ZBFHGGJFSA-N 1 1 368.437 2.817 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1F ZINC000412299953 513029647 /nfs/dbraw/zinc/02/96/47/513029647.db2.gz HTOJCYNREKGXAT-OAHLLOKOSA-N 1 1 367.421 2.522 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374882759 513053582 /nfs/dbraw/zinc/05/35/82/513053582.db2.gz WJNMBIZUULHQTH-ZDUSSCGKSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000374882759 513053586 /nfs/dbraw/zinc/05/35/86/513053586.db2.gz WJNMBIZUULHQTH-ZDUSSCGKSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000433827976 513160809 /nfs/dbraw/zinc/16/08/09/513160809.db2.gz GBRJACGOVIEGEB-ZDUSSCGKSA-N 1 1 351.451 2.826 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000428816448 513201691 /nfs/dbraw/zinc/20/16/91/513201691.db2.gz ILTBPZBCWDTLNU-HXUWFJFHSA-N 1 1 370.405 2.920 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000412700460 513231554 /nfs/dbraw/zinc/23/15/54/513231554.db2.gz QTBAPBKRNDJZJE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000412700460 513231565 /nfs/dbraw/zinc/23/15/65/513231565.db2.gz QTBAPBKRNDJZJE-HNNXBMFYSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429001790 513248770 /nfs/dbraw/zinc/24/87/70/513248770.db2.gz WZHFBRAJVKXBPV-ATNYBXOESA-N 1 1 360.458 2.584 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000450571277 513256553 /nfs/dbraw/zinc/25/65/53/513256553.db2.gz RMVYLTXGCBZZED-CYBMUJFWSA-N 1 1 353.369 2.788 20 5 FFBDMO Cc1cc(NC[C@@H]2CCC[N@H+]2CCCO)c(Br)cc1[N+](=O)[O-] ZINC000450601660 513268832 /nfs/dbraw/zinc/26/88/32/513268832.db2.gz ZCGCTCWFAMQPAP-LBPRGKRZSA-N 1 1 372.263 2.924 20 5 FFBDMO C[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc2O1 ZINC000429183465 513300953 /nfs/dbraw/zinc/30/09/53/513300953.db2.gz FLNWKIHXRKQASK-WMLDXEAASA-N 1 1 358.394 2.618 20 5 FFBDMO CC[N@H+]1CC[C@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000412867288 513312870 /nfs/dbraw/zinc/31/28/70/513312870.db2.gz ALUAHHBANHCSJD-LBPRGKRZSA-N 1 1 353.397 2.644 20 5 FFBDMO CC[N@H+]1CC[C@@H](NC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)C1 ZINC000412867285 513313305 /nfs/dbraw/zinc/31/33/05/513313305.db2.gz ALUAHHBANHCSJD-GFCCVEGCSA-N 1 1 353.397 2.644 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000450718026 513315140 /nfs/dbraw/zinc/31/51/40/513315140.db2.gz RZLCQIQDICOYJT-UHFFFAOYSA-N 1 1 370.409 2.926 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C[N@H+]1CCO ZINC000418105907 513373950 /nfs/dbraw/zinc/37/39/50/513373950.db2.gz BQIBKYGTTIABNK-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)CN1CCO ZINC000418105907 513373953 /nfs/dbraw/zinc/37/39/53/513373953.db2.gz BQIBKYGTTIABNK-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)CN1CCO ZINC000418105907 513373955 /nfs/dbraw/zinc/37/39/55/513373955.db2.gz BQIBKYGTTIABNK-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000421708132 513381192 /nfs/dbraw/zinc/38/11/92/513381192.db2.gz ZFRPSHPTCFBISW-MRXNPFEDSA-N 1 1 363.461 2.707 20 5 FFBDMO C[N@H+](CCCNC(=O)C1CCC1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000429556881 513409760 /nfs/dbraw/zinc/40/97/60/513409760.db2.gz ZFJGGZMWNOTZOL-UHFFFAOYSA-N 1 1 372.425 2.988 20 5 FFBDMO C[N@@H+](CCCNC(=O)C1CCC1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000429556881 513409764 /nfs/dbraw/zinc/40/97/64/513409764.db2.gz ZFJGGZMWNOTZOL-UHFFFAOYSA-N 1 1 372.425 2.988 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)n2)cc1 ZINC000441198870 513509298 /nfs/dbraw/zinc/50/92/98/513509298.db2.gz CKNMIHOWRKERCW-LSDHHAIUSA-N 1 1 358.398 2.893 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H](C)c1ccccc1OC ZINC000441289770 513531384 /nfs/dbraw/zinc/53/13/84/513531384.db2.gz VHFJHCXESKTZDD-GDBMZVCRSA-N 1 1 362.430 2.634 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000430238730 513595187 /nfs/dbraw/zinc/59/51/87/513595187.db2.gz ISAJPPKPWMSVQW-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000430238730 513595196 /nfs/dbraw/zinc/59/51/96/513595196.db2.gz ISAJPPKPWMSVQW-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1C[C@@H](c2ccccc2)[C@](F)(CO)C1 ZINC000451262355 513633757 /nfs/dbraw/zinc/63/37/57/513633757.db2.gz KPUZLDQXQCMKHP-QFBILLFUSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@@H](c2ccccc2)[C@](F)(CO)C1 ZINC000451262355 513633765 /nfs/dbraw/zinc/63/37/65/513633765.db2.gz KPUZLDQXQCMKHP-QFBILLFUSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1S(=O)(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000435628578 513644492 /nfs/dbraw/zinc/64/44/92/513644492.db2.gz VEYSNTCPJZMRMN-OAHLLOKOSA-N 1 1 367.471 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451277126 513645464 /nfs/dbraw/zinc/64/54/64/513645464.db2.gz ZZRKPGASKGVHQI-RTBURBONSA-N 1 1 360.385 2.774 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1 ZINC000451277126 513645471 /nfs/dbraw/zinc/64/54/71/513645471.db2.gz ZZRKPGASKGVHQI-RTBURBONSA-N 1 1 360.385 2.774 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000451298221 513660582 /nfs/dbraw/zinc/66/05/82/513660582.db2.gz VSHXRUJEBKWYDO-QGZVFWFLSA-N 1 1 371.441 2.631 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC000430662862 513715584 /nfs/dbraw/zinc/71/55/84/513715584.db2.gz KSFDTVUAOZOSFK-GOEBONIOSA-N 1 1 356.426 2.716 20 5 FFBDMO CN(C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1)C(C)(C)C[NH+]1CCCC1 ZINC000416333082 513716521 /nfs/dbraw/zinc/71/65/21/513716521.db2.gz JYAKAJKWGSQTPW-UHFFFAOYSA-N 1 1 371.441 2.931 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451414733 513733688 /nfs/dbraw/zinc/73/36/88/513733688.db2.gz IVTUBVANNDYIPN-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3[C@H]3CCC[C@H]3O)o2)cc1 ZINC000451413368 513734474 /nfs/dbraw/zinc/73/44/74/513734474.db2.gz GYWMJTHVVZRYPU-BZUAXINKSA-N 1 1 358.398 2.770 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418068 513737938 /nfs/dbraw/zinc/73/79/38/513737938.db2.gz LYKKDFWSQUACCP-WQVCFCJDSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418068 513737947 /nfs/dbraw/zinc/73/79/47/513737947.db2.gz LYKKDFWSQUACCP-WQVCFCJDSA-N 1 1 367.833 2.812 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451540409 513819078 /nfs/dbraw/zinc/81/90/78/513819078.db2.gz KWARWSLLMSQAOD-CJNGLKHVSA-N 1 1 365.430 2.679 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C ZINC000451552579 513828911 /nfs/dbraw/zinc/82/89/11/513828911.db2.gz YWVCWUMXJCMTQA-CZUORRHYSA-N 1 1 365.430 2.679 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562220 513834704 /nfs/dbraw/zinc/83/47/04/513834704.db2.gz IXEDDWXVNDLWNG-WBMJQRKESA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](OC)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000451562220 513834709 /nfs/dbraw/zinc/83/47/09/513834709.db2.gz IXEDDWXVNDLWNG-WBMJQRKESA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000451566721 513837515 /nfs/dbraw/zinc/83/75/15/513837515.db2.gz OURZFUABTVMZFQ-BLLLJJGKSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](OC)C(C)(C)C1 ZINC000451566721 513837523 /nfs/dbraw/zinc/83/75/23/513837523.db2.gz OURZFUABTVMZFQ-BLLLJJGKSA-N 1 1 365.430 2.677 20 5 FFBDMO O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[NH+](C2CCC2)CC1 ZINC000448983828 514007340 /nfs/dbraw/zinc/00/73/40/514007340.db2.gz PILPMYNHSOQSDC-UHFFFAOYSA-N 1 1 357.332 2.924 20 5 FFBDMO O=C(NCC[N@@H+]1CC=CCC1)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000431921750 514040797 /nfs/dbraw/zinc/04/07/97/514040797.db2.gz CWWBOPVMNVEAGD-UHFFFAOYSA-N 1 1 356.329 2.580 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000451963699 514098567 /nfs/dbraw/zinc/09/85/67/514098567.db2.gz IURGVNBELQKNLI-DOTOQJQBSA-N 1 1 352.456 2.554 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCCN1CCC([NH3+])CC1 ZINC000433136481 514395502 /nfs/dbraw/zinc/39/55/02/514395502.db2.gz LXOQCADGAZZERB-UHFFFAOYSA-N 1 1 362.474 2.535 20 5 FFBDMO C[C@H]1CC2(CN1Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)CC[NH2+]CC2 ZINC000424283769 514447249 /nfs/dbraw/zinc/44/72/49/514447249.db2.gz BZQZSBFUZHLKIU-ZDUSSCGKSA-N 1 1 357.414 2.609 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C[C@@H]1C ZINC000449971135 514447827 /nfs/dbraw/zinc/44/78/27/514447827.db2.gz JSYSWFMKGGLGER-GOEBONIOSA-N 1 1 371.441 2.725 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000449973935 514448743 /nfs/dbraw/zinc/44/87/43/514448743.db2.gz SYSMDXLAEWFQEE-ZBFHGGJFSA-N 1 1 361.442 2.889 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)C1 ZINC000449986022 514453721 /nfs/dbraw/zinc/45/37/21/514453721.db2.gz FVZPVMXTMZJLGW-OAHLLOKOSA-N 1 1 371.441 2.584 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](C)C[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462004 514480013 /nfs/dbraw/zinc/48/00/13/514480013.db2.gz PNVASOYCUOYZHE-PXAZEXFGSA-N 1 1 373.409 2.949 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@H](C)C[C@H]3C(N)=O)o2)c([N+](=O)[O-])c1 ZINC000428462004 514480017 /nfs/dbraw/zinc/48/00/17/514480017.db2.gz PNVASOYCUOYZHE-PXAZEXFGSA-N 1 1 373.409 2.949 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3nccc4cc([N+](=O)[O-])ccc43)CC2)CCO1 ZINC000450260385 514569100 /nfs/dbraw/zinc/56/91/00/514569100.db2.gz JLWCLXRWGQWVKS-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO CCCC[N@@H+](C)CC1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)CC1 ZINC000455641525 514654009 /nfs/dbraw/zinc/65/40/09/514654009.db2.gz QHKOGUAZNDPXJS-UHFFFAOYSA-N 1 1 363.462 2.616 20 5 FFBDMO Cc1cc(NCC[N@@H+]2CCC[C@@H](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489173400 514737565 /nfs/dbraw/zinc/73/75/65/514737565.db2.gz GKRWWRXAHHBGMH-CQSZACIVSA-N 1 1 355.442 2.926 20 5 FFBDMO Cc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489179376 514741136 /nfs/dbraw/zinc/74/11/36/514741136.db2.gz ZAEKPCMZZXICNV-NVXWUHKLSA-N 1 1 353.426 2.821 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000479937364 514783392 /nfs/dbraw/zinc/78/33/92/514783392.db2.gz CKDXNMBDWSRFLI-STQMWFEESA-N 1 1 369.849 2.816 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000471272441 514821539 /nfs/dbraw/zinc/82/15/39/514821539.db2.gz KAAZQAJZNGMMIU-INIZCTEOSA-N 1 1 371.412 2.915 20 5 FFBDMO CCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502954786 514857121 /nfs/dbraw/zinc/85/71/21/514857121.db2.gz HYWUNDRSVXUBIF-CQSZACIVSA-N 1 1 359.430 2.958 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000508776020 514890762 /nfs/dbraw/zinc/89/07/62/514890762.db2.gz WRTQEDKRWLTJSM-XQQFMLRXSA-N 1 1 359.430 2.567 20 5 FFBDMO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000508776020 514890773 /nfs/dbraw/zinc/89/07/73/514890773.db2.gz WRTQEDKRWLTJSM-XQQFMLRXSA-N 1 1 359.430 2.567 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000508776020 514890783 /nfs/dbraw/zinc/89/07/83/514890783.db2.gz WRTQEDKRWLTJSM-XQQFMLRXSA-N 1 1 359.430 2.567 20 5 FFBDMO CNc1nc(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)ccc1[N+](=O)[O-] ZINC000456000544 514896333 /nfs/dbraw/zinc/89/63/33/514896333.db2.gz SWDGGMAHYGMUDZ-UHFFFAOYSA-N 1 1 369.425 2.921 20 5 FFBDMO CC(C)[N@@H+](C)CCCNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000480368550 514935121 /nfs/dbraw/zinc/93/51/21/514935121.db2.gz SBCKGBYGPPFAFF-UHFFFAOYSA-N 1 1 359.430 2.702 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3CCC[C@H]3OC(F)F)o2)cc1 ZINC000503404211 515022385 /nfs/dbraw/zinc/02/23/85/515022385.db2.gz XJUSCRLSNGFYJX-VXGBXAGGSA-N 1 1 354.313 2.895 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@H](C)[NH+]1CCOCC1 ZINC000485419490 515033618 /nfs/dbraw/zinc/03/36/18/515033618.db2.gz TZOWTUUBEIWACY-KBPBESRZSA-N 1 1 374.416 2.739 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)[C@H](C)C1 ZINC000485418758 515033747 /nfs/dbraw/zinc/03/37/47/515033747.db2.gz VQTYRDPKGVYNPA-KGLIPLIRSA-N 1 1 374.416 2.687 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000509354592 515139454 /nfs/dbraw/zinc/13/94/54/515139454.db2.gz KTCNFVBSCLQRKL-QGZVFWFLSA-N 1 1 356.426 2.953 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1OC(F)F)N1CC[NH+](C2CCC2)CC1 ZINC000485694601 515146131 /nfs/dbraw/zinc/14/61/31/515146131.db2.gz VUVMVESJEIFBMS-UHFFFAOYSA-N 1 1 355.341 2.507 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cc(F)cc(Cl)c2)cc1 ZINC000485705969 515152907 /nfs/dbraw/zinc/15/29/07/515152907.db2.gz ABZCAOWFETXDFZ-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+](CCO)CC2CCCCC2)c2c(c1)COCO2 ZINC000485734545 515164845 /nfs/dbraw/zinc/16/48/45/515164845.db2.gz QFNDNZXSSURGTA-UHFFFAOYSA-N 1 1 350.415 2.836 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000472460607 515277191 /nfs/dbraw/zinc/27/71/91/515277191.db2.gz DSOFNTWOFDWORE-DOTOQJQBSA-N 1 1 374.485 2.894 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681677 515287754 /nfs/dbraw/zinc/28/77/54/515287754.db2.gz NFBXQLQUAACKGV-HOTGVXAUSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 ZINC000509681677 515287761 /nfs/dbraw/zinc/28/77/61/515287761.db2.gz NFBXQLQUAACKGV-HOTGVXAUSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@@H](C)C[N@@H+]1C ZINC000509681676 515288166 /nfs/dbraw/zinc/28/81/66/515288166.db2.gz NFBXQLQUAACKGV-CVEARBPZSA-N 1 1 363.461 2.706 20 5 FFBDMO C[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)[C@@H](C)C[N@H+]1C ZINC000509681676 515288171 /nfs/dbraw/zinc/28/81/71/515288171.db2.gz NFBXQLQUAACKGV-CVEARBPZSA-N 1 1 363.461 2.706 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@]1(c2ccccc2)CCCCC1=O ZINC000472595505 515330845 /nfs/dbraw/zinc/33/08/45/515330845.db2.gz HTNXEHPJAACSKY-HXUWFJFHSA-N 1 1 369.421 2.727 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@]1(c2ccccc2)CCCCC1=O ZINC000472595505 515330852 /nfs/dbraw/zinc/33/08/52/515330852.db2.gz HTNXEHPJAACSKY-HXUWFJFHSA-N 1 1 369.421 2.727 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176089 515386152 /nfs/dbraw/zinc/38/61/52/515386152.db2.gz KHDFVUKWMNMOQI-FZKQIMNGSA-N 1 1 355.394 2.551 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176089 515386162 /nfs/dbraw/zinc/38/61/62/515386162.db2.gz KHDFVUKWMNMOQI-FZKQIMNGSA-N 1 1 355.394 2.551 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000499724386 515428681 /nfs/dbraw/zinc/42/86/81/515428681.db2.gz RLDXMNBQZNKADM-INIZCTEOSA-N 1 1 371.441 2.775 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713378 515435225 /nfs/dbraw/zinc/43/52/25/515435225.db2.gz CHGBPTXREABMAM-KBPBESRZSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713378 515435231 /nfs/dbraw/zinc/43/52/31/515435231.db2.gz CHGBPTXREABMAM-KBPBESRZSA-N 1 1 356.806 2.791 20 5 FFBDMO C[C@@H](C[NH+]1CCCCCC1)Nc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000468747128 515500312 /nfs/dbraw/zinc/50/03/12/515500312.db2.gz JCWOKYBFZNVLMX-ZDUSSCGKSA-N 1 1 355.460 2.675 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@](CO)(c4ccccc4)C3)nc2c1 ZINC000463453860 515507042 /nfs/dbraw/zinc/50/70/42/515507042.db2.gz MCHKBCQOWOLLMK-LJQANCHMSA-N 1 1 352.394 2.607 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@](CO)(c4ccccc4)C3)nc2c1 ZINC000463453860 515507049 /nfs/dbraw/zinc/50/70/49/515507049.db2.gz MCHKBCQOWOLLMK-LJQANCHMSA-N 1 1 352.394 2.607 20 5 FFBDMO O=C([C@H]1CCCc2[nH+]ccn21)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000486490724 515507679 /nfs/dbraw/zinc/50/76/79/515507679.db2.gz UJIOLSXJVPIWCM-PBHICJAKSA-N 1 1 358.423 2.943 20 5 FFBDMO C[N@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000477704998 515562002 /nfs/dbraw/zinc/56/20/02/515562002.db2.gz RMTBPMZOCPTTFO-UHFFFAOYSA-N 1 1 357.410 2.941 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000477704998 515562010 /nfs/dbraw/zinc/56/20/10/515562010.db2.gz RMTBPMZOCPTTFO-UHFFFAOYSA-N 1 1 357.410 2.941 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456990247 515568817 /nfs/dbraw/zinc/56/88/17/515568817.db2.gz LQSYZVFMBUQXLZ-KRWDZBQOSA-N 1 1 354.410 2.570 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457009398 515582263 /nfs/dbraw/zinc/58/22/63/515582263.db2.gz DAHSCZFFPZZVFQ-LJQANCHMSA-N 1 1 364.405 2.792 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])cc1OCC(F)F ZINC000505569323 515588394 /nfs/dbraw/zinc/58/83/94/515588394.db2.gz UCMVHPLOLCDEDJ-BXUZGUMPSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc([N+](=O)[O-])c1C ZINC000457029943 515594473 /nfs/dbraw/zinc/59/44/73/515594473.db2.gz RFQMSJZXGOUACX-INIZCTEOSA-N 1 1 355.394 2.699 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@@H](C)[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505592544 515600628 /nfs/dbraw/zinc/60/06/28/515600628.db2.gz TUGKJRPHZSOTBQ-NWDGAFQWSA-N 1 1 373.400 2.772 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000454623405 515616511 /nfs/dbraw/zinc/61/65/11/515616511.db2.gz ASGRCVOFKAOHTB-MRXNPFEDSA-N 1 1 357.414 2.689 20 5 FFBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000473565870 515666301 /nfs/dbraw/zinc/66/63/01/515666301.db2.gz CFGIETGERVVPKD-CALCHBBNSA-N 1 1 367.405 2.504 20 5 FFBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000473565870 515666311 /nfs/dbraw/zinc/66/63/11/515666311.db2.gz CFGIETGERVVPKD-CALCHBBNSA-N 1 1 367.405 2.504 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)C[C@@H]1C ZINC000493891583 515679088 /nfs/dbraw/zinc/67/90/88/515679088.db2.gz OEJLICDPQHHOSB-GJZGRUSLSA-N 1 1 369.487 2.705 20 5 FFBDMO COc1cc(C[NH+]2CC(C)(CO)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000459624043 515703485 /nfs/dbraw/zinc/70/34/85/515703485.db2.gz SQCFHJKFCAOXIQ-UHFFFAOYSA-N 1 1 372.421 2.997 20 5 FFBDMO C[N@@H+](CCCCNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000457185986 515711372 /nfs/dbraw/zinc/71/13/72/515711372.db2.gz PTSZFANASCNORW-UHFFFAOYSA-N 1 1 374.485 2.802 20 5 FFBDMO COC(=O)c1cnc(NCCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000478274479 515762089 /nfs/dbraw/zinc/76/20/89/515762089.db2.gz DGJMYILYRWIFRL-OKILXGFUSA-N 1 1 364.446 2.946 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000494386542 515826874 /nfs/dbraw/zinc/82/68/74/515826874.db2.gz NRJHDLZJNSYKCA-OZVIIMIRSA-N 1 1 350.394 2.928 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1 ZINC000506477131 515893321 /nfs/dbraw/zinc/89/33/21/515893321.db2.gz LZQULIUIHBDKSY-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000511436601 515905043 /nfs/dbraw/zinc/90/50/43/515905043.db2.gz KMYSHQKKDLFVRL-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1 ZINC000469789548 515967406 /nfs/dbraw/zinc/96/74/06/515967406.db2.gz YUHBGXAFAWJMQL-RDJZCZTQSA-N 1 1 365.474 2.830 20 5 FFBDMO CO[C@]1(C)C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000464820544 515973147 /nfs/dbraw/zinc/97/31/47/515973147.db2.gz FQBZTXYZDQUHEH-VQIMIIECSA-N 1 1 361.442 2.619 20 5 FFBDMO C[C@@H](CNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000487895221 516023981 /nfs/dbraw/zinc/02/39/81/516023981.db2.gz JXRWGBTUAAIPBI-NSHDSACASA-N 1 1 354.838 2.573 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000507003302 516050297 /nfs/dbraw/zinc/05/02/97/516050297.db2.gz VRQGWRJIGPKUSX-XJKSGUPXSA-N 1 1 354.410 2.941 20 5 FFBDMO COCC[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1C ZINC000487986264 516066755 /nfs/dbraw/zinc/06/67/55/516066755.db2.gz GYTVZQYMEMIGRZ-PBHICJAKSA-N 1 1 370.471 2.506 20 5 FFBDMO COCC[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1C ZINC000487986264 516066763 /nfs/dbraw/zinc/06/67/63/516066763.db2.gz GYTVZQYMEMIGRZ-PBHICJAKSA-N 1 1 370.471 2.506 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000469995793 516067553 /nfs/dbraw/zinc/06/75/53/516067553.db2.gz FUGALENZDMSWKT-UHIISALHSA-N 1 1 360.370 2.589 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1 ZINC000507283253 516155291 /nfs/dbraw/zinc/15/52/91/516155291.db2.gz UIRVHUMDEPEKHC-CYBMUJFWSA-N 1 1 369.487 2.692 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000470170583 516160792 /nfs/dbraw/zinc/16/07/92/516160792.db2.gz XLDKBAZJJWKQKN-XOQYZJNISA-N 1 1 373.453 2.569 20 5 FFBDMO Cn1c(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000496390261 516256570 /nfs/dbraw/zinc/25/65/70/516256570.db2.gz PHVCDNLVNDBPRK-AWEZNQCLSA-N 1 1 350.806 2.619 20 5 FFBDMO CC[N@@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000497356911 516313376 /nfs/dbraw/zinc/31/33/76/516313376.db2.gz HFVVQFQRMBBHBH-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO CC[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000497356911 516313380 /nfs/dbraw/zinc/31/33/80/516313380.db2.gz HFVVQFQRMBBHBH-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cc(Cl)ccc2F)cc1 ZINC000543621108 516333934 /nfs/dbraw/zinc/33/39/34/516333934.db2.gz FFGGZPKGUPAWJF-UHFFFAOYSA-N 1 1 372.805 2.951 20 5 FFBDMO O=[N+]([O-])c1cccc(N2CCN([C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000550681065 516382641 /nfs/dbraw/zinc/38/26/41/516382641.db2.gz SUXVUJODGMNSLV-OAQYLSRUSA-N 1 1 366.465 2.991 20 5 FFBDMO COc1cccc(C(=O)N2CC[NH2+]C[C@@H]2c2cccc(F)c2)c1[N+](=O)[O-] ZINC000517922373 516495239 /nfs/dbraw/zinc/49/52/39/516495239.db2.gz HYQHIGFRUPAPPE-OAHLLOKOSA-N 1 1 359.357 2.529 20 5 FFBDMO NC(=O)c1cccc(NCC[N@@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000561305036 516512173 /nfs/dbraw/zinc/51/21/73/516512173.db2.gz LIJRAGQCDBXEHP-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO NC(=O)c1cccc(NCC[N@H+]2CCc3c(Cl)cccc3C2)c1[N+](=O)[O-] ZINC000561305036 516512180 /nfs/dbraw/zinc/51/21/80/516512180.db2.gz LIJRAGQCDBXEHP-UHFFFAOYSA-N 1 1 374.828 2.817 20 5 FFBDMO CN(C(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000551014616 516523553 /nfs/dbraw/zinc/52/35/53/516523553.db2.gz OGJYCSYDNPHYFR-GFCCVEGCSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C[C@@H](C)C1 ZINC000558022811 516555661 /nfs/dbraw/zinc/55/56/61/516555661.db2.gz JOASVHSDNGZAEJ-LXIYXOSZSA-N 1 1 356.426 2.878 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637299 516559049 /nfs/dbraw/zinc/55/90/49/516559049.db2.gz RUTNNNZVMUTTGM-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000554637299 516559058 /nfs/dbraw/zinc/55/90/58/516559058.db2.gz RUTNNNZVMUTTGM-DOTOQJQBSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+](C2CCC2)C1 ZINC000561536044 516637809 /nfs/dbraw/zinc/63/78/09/516637809.db2.gz ROESXQGJHISUEN-OAHLLOKOSA-N 1 1 370.453 2.882 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1 ZINC000540689996 516669417 /nfs/dbraw/zinc/66/94/17/516669417.db2.gz IWTHSLXCPQOMBM-MRXNPFEDSA-N 1 1 361.442 2.805 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000518462265 516670922 /nfs/dbraw/zinc/67/09/22/516670922.db2.gz XWTVORWYCAUNKQ-CABCVRRESA-N 1 1 371.441 2.631 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000513571770 516676239 /nfs/dbraw/zinc/67/62/39/516676239.db2.gz GWJCFYONJQMVDO-QGZVFWFLSA-N 1 1 368.437 2.788 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000536262951 516700589 /nfs/dbraw/zinc/70/05/89/516700589.db2.gz JGHNCNIQONLFBD-UZLBHIALSA-N 1 1 369.421 2.708 20 5 FFBDMO Cc1ccc(C[N@@H+](C)CCn2cc(Br)cn2)cc1[N+](=O)[O-] ZINC000558427760 516736122 /nfs/dbraw/zinc/73/61/22/516736122.db2.gz VJCHSGHOVMDVHI-UHFFFAOYSA-N 1 1 353.220 2.994 20 5 FFBDMO C[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@@H+](C)Cc1ccccc1 ZINC000544395652 516741699 /nfs/dbraw/zinc/74/16/99/516741699.db2.gz GXILYSQMTYGYGR-CQSZACIVSA-N 1 1 351.410 2.892 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441003 516760305 /nfs/dbraw/zinc/76/03/05/516760305.db2.gz UYRCYIHUWTWMDY-GRDNDAEWSA-N 1 1 363.458 2.959 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000544441003 516760309 /nfs/dbraw/zinc/76/03/09/516760309.db2.gz UYRCYIHUWTWMDY-GRDNDAEWSA-N 1 1 363.458 2.959 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000524617633 516770197 /nfs/dbraw/zinc/77/01/97/516770197.db2.gz BPSSAQRVMOCSSG-CABCVRRESA-N 1 1 371.441 2.725 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000518883342 516807340 /nfs/dbraw/zinc/80/73/40/516807340.db2.gz FKDGRCLEWAVVKL-AAEUAGOBSA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@H](C(=O)NCC[N@@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000555309592 516874043 /nfs/dbraw/zinc/87/40/43/516874043.db2.gz GPQHYKVMQSIOFC-ZDUSSCGKSA-N 1 1 359.451 2.934 20 5 FFBDMO C[C@H](C(=O)NCC[N@H+]1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000555309592 516874054 /nfs/dbraw/zinc/87/40/54/516874054.db2.gz GPQHYKVMQSIOFC-ZDUSSCGKSA-N 1 1 359.451 2.934 20 5 FFBDMO C[C@H]([NH2+][C@@H](CO)c1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000562049488 516895440 /nfs/dbraw/zinc/89/54/40/516895440.db2.gz JRXFCAWMVDKWLW-ZBEGNZNMSA-N 1 1 363.801 2.898 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1CNc1ccc(C(=O)N2CC[NH+](C)CC2)cc1 ZINC000551833970 516898509 /nfs/dbraw/zinc/89/85/09/516898509.db2.gz JVIJOBKNANOGQY-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514208514 516904282 /nfs/dbraw/zinc/90/42/82/516904282.db2.gz MSWZHLFAPCCUSS-LBPRGKRZSA-N 1 1 369.368 2.943 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000562234658 516972471 /nfs/dbraw/zinc/97/24/71/516972471.db2.gz XYWDZGPBJIBBDW-OAHLLOKOSA-N 1 1 350.463 2.569 20 5 FFBDMO O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000544941322 516997224 /nfs/dbraw/zinc/99/72/24/516997224.db2.gz WGODUNJTQHQILG-OAHLLOKOSA-N 1 1 370.409 2.891 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)NCc1cc([N+](=O)[O-])ccc1OC ZINC000514698762 517011081 /nfs/dbraw/zinc/01/10/81/517011081.db2.gz HPGYJHRYBPVKHW-ZDUSSCGKSA-N 1 1 352.435 2.523 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1OC ZINC000525560308 517076479 /nfs/dbraw/zinc/07/64/79/517076479.db2.gz NVINIKZMKHEPLM-STQMWFEESA-N 1 1 365.430 2.605 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2 ZINC000562477711 517134129 /nfs/dbraw/zinc/13/41/29/517134129.db2.gz NNGIJRPYYMMTJF-IVMMDQJWSA-N 1 1 357.414 2.874 20 5 FFBDMO CC(C)[C@@H](O)C1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552277736 517175334 /nfs/dbraw/zinc/17/53/34/517175334.db2.gz HLBIMTAAHRWJKA-DLBZAZTESA-N 1 1 358.442 2.804 20 5 FFBDMO CC1(C)C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]2CCC[C@H]21 ZINC000559424975 517248442 /nfs/dbraw/zinc/24/84/42/517248442.db2.gz FTPIHDLQBCLCLL-YPMHNXCESA-N 1 1 361.398 2.773 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000520124032 517279658 /nfs/dbraw/zinc/27/96/58/517279658.db2.gz SKRKZADDEVWNOT-UHFFFAOYSA-N 1 1 369.487 2.700 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000552513151 517290424 /nfs/dbraw/zinc/29/04/24/517290424.db2.gz ILTQCICOILRBLE-CRAIPNDOSA-N 1 1 360.385 2.963 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000515335786 517304173 /nfs/dbraw/zinc/30/41/73/517304173.db2.gz OCEWOJOQKMLFTK-BBRMVZONSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@H]1C[C@H](CCNC(=O)c2cc([N+](=O)[O-])cn2C)C[N@H+]1Cc1ccccc1 ZINC000533114546 517304670 /nfs/dbraw/zinc/30/46/70/517304670.db2.gz YBEQVECVFSDZRX-RDJZCZTQSA-N 1 1 370.453 2.964 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000552874044 517422468 /nfs/dbraw/zinc/42/24/68/517422468.db2.gz DXQPJLCSIDCAAZ-LJQANCHMSA-N 1 1 369.421 2.797 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000552874044 517422478 /nfs/dbraw/zinc/42/24/78/517422478.db2.gz DXQPJLCSIDCAAZ-LJQANCHMSA-N 1 1 369.421 2.797 20 5 FFBDMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)S1 ZINC000533428223 517459240 /nfs/dbraw/zinc/45/92/40/517459240.db2.gz HORTZZVBUADNPY-TXEJJXNPSA-N 1 1 351.428 2.719 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2CC[C@@H](CO)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000559869947 517466030 /nfs/dbraw/zinc/46/60/30/517466030.db2.gz DUKKYWVKFCOHHN-AOIWGVFYSA-N 1 1 360.410 2.969 20 5 FFBDMO C[C@H]([NH2+]CC(=O)NCCOc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000538279971 517538761 /nfs/dbraw/zinc/53/87/61/517538761.db2.gz RHUDYTCPFWQMEY-ZDUSSCGKSA-N 1 1 361.373 2.580 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000546176765 517583152 /nfs/dbraw/zinc/58/31/52/517583152.db2.gz QWUBAQNVVGQYDB-HNNXBMFYSA-N 1 1 355.460 2.528 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000538379160 517595928 /nfs/dbraw/zinc/59/59/28/517595928.db2.gz RPMASYUNMQXXOA-GOSISDBHSA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000538379160 517595937 /nfs/dbraw/zinc/59/59/37/517595937.db2.gz RPMASYUNMQXXOA-GOSISDBHSA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C ZINC000533760471 517601283 /nfs/dbraw/zinc/60/12/83/517601283.db2.gz BPBMHDHOTFOOSL-AWEZNQCLSA-N 1 1 354.414 2.651 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000542654159 517671534 /nfs/dbraw/zinc/67/15/34/517671534.db2.gz UPFAGGYLRVGRBS-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000546540141 517716261 /nfs/dbraw/zinc/71/62/61/517716261.db2.gz SRKHJYDXAPSIHT-QWHCGFSZSA-N 1 1 351.422 2.953 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000549813500 517723013 /nfs/dbraw/zinc/72/30/13/517723013.db2.gz OZIGVOJUDQLXLP-CABCVRRESA-N 1 1 360.385 2.963 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1 ZINC000538711025 517739325 /nfs/dbraw/zinc/73/93/25/517739325.db2.gz NFGXIZRGIHAHGO-UHFFFAOYSA-N 1 1 363.414 2.516 20 5 FFBDMO CCn1cc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000538725850 517750893 /nfs/dbraw/zinc/75/08/93/517750893.db2.gz BKZXZEKKWWTPQZ-UHFFFAOYSA-N 1 1 354.414 2.844 20 5 FFBDMO CCn1cc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000538725850 517750903 /nfs/dbraw/zinc/75/09/03/517750903.db2.gz BKZXZEKKWWTPQZ-UHFFFAOYSA-N 1 1 354.414 2.844 20 5 FFBDMO C[NH+](C)C1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCCCC1 ZINC000560393180 517764095 /nfs/dbraw/zinc/76/40/95/517764095.db2.gz PISXOQPNMDVCDZ-KRWDZBQOSA-N 1 1 365.474 2.579 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2CO)n1 ZINC000542865477 517789050 /nfs/dbraw/zinc/78/90/50/517789050.db2.gz ICQMSEWEQUFNEW-ZWKOTPCHSA-N 1 1 370.453 2.902 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C ZINC000538918886 517842332 /nfs/dbraw/zinc/84/23/32/517842332.db2.gz PGYLAPLFCQZXKP-WOPDTQHZSA-N 1 1 355.822 2.567 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C ZINC000538918886 517842344 /nfs/dbraw/zinc/84/23/44/517842344.db2.gz PGYLAPLFCQZXKP-WOPDTQHZSA-N 1 1 355.822 2.567 20 5 FFBDMO CCOc1cc(N2CC[C@@H]([NH+]3CCN(C(C)C)CC3)C2)ccc1[N+](=O)[O-] ZINC000538937460 517853711 /nfs/dbraw/zinc/85/37/11/517853711.db2.gz IQFLLROWCMTRFT-QGZVFWFLSA-N 1 1 362.474 2.598 20 5 FFBDMO CNc1ccc(C(=O)NCC[N@@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000530654476 517903216 /nfs/dbraw/zinc/90/32/16/517903216.db2.gz AYLMTFNFKUUADF-UHFFFAOYSA-N 1 1 360.389 2.637 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1 ZINC000553812831 517917172 /nfs/dbraw/zinc/91/71/72/517917172.db2.gz AKTOAQGFNKMENA-JKSUJKDBSA-N 1 1 363.458 2.909 20 5 FFBDMO C[C@@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@@H+](C)Cc1ccccc1 ZINC000521955520 517917872 /nfs/dbraw/zinc/91/78/72/517917872.db2.gz LALPOWXRCMIEMM-ZDUSSCGKSA-N 1 1 371.393 2.574 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](COc2ccccc2)C1 ZINC000543185951 517954766 /nfs/dbraw/zinc/95/47/66/517954766.db2.gz BKOBWQLZFRATCT-DLBZAZTESA-N 1 1 372.421 2.735 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000543437171 518091591 /nfs/dbraw/zinc/09/15/91/518091591.db2.gz SAWBGHOSHTYCNP-PWSUYJOCSA-N 1 1 355.236 2.591 20 5 FFBDMO Cc1c(Br)c(N2CC[C@H]3CC[N@H+](C)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000543437171 518091597 /nfs/dbraw/zinc/09/15/97/518091597.db2.gz SAWBGHOSHTYCNP-PWSUYJOCSA-N 1 1 355.236 2.591 20 5 FFBDMO COc1ccc(Cc2nc([C@@H]3C[N@@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843289 518146413 /nfs/dbraw/zinc/14/64/13/518146413.db2.gz URQFMDCJHMINDY-MAUKXSAKSA-N 1 1 374.397 2.503 20 5 FFBDMO COc1ccc(Cc2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000563843289 518146418 /nfs/dbraw/zinc/14/64/18/518146418.db2.gz URQFMDCJHMINDY-MAUKXSAKSA-N 1 1 374.397 2.503 20 5 FFBDMO COc1cccc([C@@H]2[C@H](Nc3c([N+](=O)[O-])ncn3C)CC[N@H+]2C2CC2)c1 ZINC000539773765 518158528 /nfs/dbraw/zinc/15/85/28/518158528.db2.gz FQQHDPKXLWZVBG-HZPDHXFCSA-N 1 1 357.414 2.727 20 5 FFBDMO CC(C)[N@@H+]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000563900297 518221022 /nfs/dbraw/zinc/22/10/22/518221022.db2.gz DYHVSBHHJUVCTA-OAHLLOKOSA-N 1 1 357.458 2.815 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000563900297 518221028 /nfs/dbraw/zinc/22/10/28/518221028.db2.gz DYHVSBHHJUVCTA-OAHLLOKOSA-N 1 1 357.458 2.815 20 5 FFBDMO C[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000569954005 518374736 /nfs/dbraw/zinc/37/47/36/518374736.db2.gz IZONEHWXAZLAQY-HNNXBMFYSA-N 1 1 363.458 2.515 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000584562103 518397583 /nfs/dbraw/zinc/39/75/83/518397583.db2.gz RKNSBGCRMIRDJD-JKSUJKDBSA-N 1 1 354.410 2.517 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[C@H]1C ZINC000567207135 518404626 /nfs/dbraw/zinc/40/46/26/518404626.db2.gz GWXOAQIESFZKPX-ZIAGYGMSSA-N 1 1 373.457 2.743 20 5 FFBDMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)C[C@@H]21 ZINC000584710850 518440817 /nfs/dbraw/zinc/44/08/17/518440817.db2.gz KKIRLDYOSJRPIG-DLBZAZTESA-N 1 1 354.410 2.566 20 5 FFBDMO CCOC(=O)c1cc(C(=O)N2CC[NH2+]Cc3ccccc32)cc([N+](=O)[O-])c1 ZINC000579009434 518479939 /nfs/dbraw/zinc/47/99/39/518479939.db2.gz YIJBBBDTUDLGMW-UHFFFAOYSA-N 1 1 369.377 2.522 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNCC(=O)NCC[NH+]1CCCCCC1 ZINC000564718947 518580684 /nfs/dbraw/zinc/58/06/84/518580684.db2.gz UJBDMZMDCLXXSX-GHRIWEEISA-N 1 1 374.485 2.580 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N[C@@H]1CCc2c[nH+]cn2C1 ZINC000588067669 518715049 /nfs/dbraw/zinc/71/50/49/518715049.db2.gz IFCKBGGIZKASQO-SECBINFHSA-N 1 1 350.762 2.658 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582621433 518842271 /nfs/dbraw/zinc/84/22/71/518842271.db2.gz MYEYNGZINFASTA-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1ccc(C(=O)N2CC[N@H+](C)[C@H](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582621433 518842276 /nfs/dbraw/zinc/84/22/76/518842276.db2.gz MYEYNGZINFASTA-GOSISDBHSA-N 1 1 353.422 2.902 20 5 FFBDMO CCOc1ccc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000582623515 518843714 /nfs/dbraw/zinc/84/37/14/518843714.db2.gz JTOHZOALBUMQFW-AWEZNQCLSA-N 1 1 361.442 2.940 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000589183724 518944680 /nfs/dbraw/zinc/94/46/80/518944680.db2.gz JWFYYHPZVOMDRI-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCCO)Cc2ccccc2)c1 ZINC000589498282 519017837 /nfs/dbraw/zinc/01/78/37/519017837.db2.gz IQBXDPXNBQSEJK-UHFFFAOYSA-N 1 1 358.394 2.766 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCCO)Cc2ccccc2)c1 ZINC000589498282 519017845 /nfs/dbraw/zinc/01/78/45/519017845.db2.gz IQBXDPXNBQSEJK-UHFFFAOYSA-N 1 1 358.394 2.766 20 5 FFBDMO CC[NH+](CC)CC1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1 ZINC000589495036 519018468 /nfs/dbraw/zinc/01/84/68/519018468.db2.gz OPCICRGPCZZXRS-UHFFFAOYSA-N 1 1 363.458 2.935 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509787 519075793 /nfs/dbraw/zinc/07/57/93/519075793.db2.gz ZVXNFKRHBGCQSM-ZYHUDNBSSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@@H+](C)CCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000568509787 519075801 /nfs/dbraw/zinc/07/58/01/519075801.db2.gz ZVXNFKRHBGCQSM-ZYHUDNBSSA-N 1 1 373.862 2.639 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1nc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000580357290 519133706 /nfs/dbraw/zinc/13/37/06/519133706.db2.gz AFBYDKFLYDXCEQ-CYBMUJFWSA-N 1 1 350.419 2.843 20 5 FFBDMO C[N@H+]1CCC[C@@]2(CCN(c3c(Br)cncc3[N+](=O)[O-])C2)C1 ZINC000590141902 519159664 /nfs/dbraw/zinc/15/96/64/519159664.db2.gz HLTHUOCHUXTVGM-CQSZACIVSA-N 1 1 355.236 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC000590169115 519165920 /nfs/dbraw/zinc/16/59/20/519165920.db2.gz JKOFBQZDBLIYEZ-CQSZACIVSA-N 1 1 359.348 2.520 20 5 FFBDMO CN(C)CC[N@@H+](C)CCCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000568794411 519216807 /nfs/dbraw/zinc/21/68/07/519216807.db2.gz NWNRDXUPYSNLCP-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO CN(CCCNc1ccc(Br)cc1[N+](=O)[O-])CC[NH+](C)C ZINC000568794411 519216815 /nfs/dbraw/zinc/21/68/15/519216815.db2.gz NWNRDXUPYSNLCP-UHFFFAOYSA-N 1 1 359.268 2.653 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000590456711 519237825 /nfs/dbraw/zinc/23/78/25/519237825.db2.gz GLTOGPWGMNMRGS-MPGHIAIKSA-N 1 1 360.458 2.586 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000590456709 519237872 /nfs/dbraw/zinc/23/78/72/519237872.db2.gz GLTOGPWGMNMRGS-DAYGRLMNSA-N 1 1 360.458 2.586 20 5 FFBDMO CSc1ccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000590538039 519259577 /nfs/dbraw/zinc/25/95/77/519259577.db2.gz IOOURGHOERRGPV-STQMWFEESA-N 1 1 353.419 2.575 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)cc1SC ZINC000577993116 519360790 /nfs/dbraw/zinc/36/07/90/519360790.db2.gz OWMVOLVGGODHPK-NSHDSACASA-N 1 1 355.460 2.784 20 5 FFBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000572022895 519403484 /nfs/dbraw/zinc/40/34/84/519403484.db2.gz ACAVIRGYTQTKEJ-SFHVURJKSA-N 1 1 357.410 2.775 20 5 FFBDMO Cc1c(C(=O)N(C)CCC[N@@H+](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000574933030 519411915 /nfs/dbraw/zinc/41/19/15/519411915.db2.gz YMOSYUCWNZUIED-UHFFFAOYSA-N 1 1 356.426 2.892 20 5 FFBDMO CN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1C1CC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000580899203 519416221 /nfs/dbraw/zinc/41/62/21/519416221.db2.gz YYUPMAPCIXPLLM-KRWDZBQOSA-N 1 1 368.441 2.861 20 5 FFBDMO Cn1cc(C[N@@H+]2CCO[C@]3(CCSC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000578132954 519435745 /nfs/dbraw/zinc/43/57/45/519435745.db2.gz LHNNPIWMLZGQKK-GOSISDBHSA-N 1 1 374.466 2.703 20 5 FFBDMO Cn1cc(C[N@H+]2CCO[C@]3(CCSC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000578132954 519435753 /nfs/dbraw/zinc/43/57/53/519435753.db2.gz LHNNPIWMLZGQKK-GOSISDBHSA-N 1 1 374.466 2.703 20 5 FFBDMO C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000566564339 519554470 /nfs/dbraw/zinc/55/44/70/519554470.db2.gz OPFOFJRQQRLBIO-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000566564339 519554478 /nfs/dbraw/zinc/55/44/78/519554478.db2.gz OPFOFJRQQRLBIO-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H]1Cc1ccccc1 ZINC000566564339 519554485 /nfs/dbraw/zinc/55/44/85/519554485.db2.gz OPFOFJRQQRLBIO-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2CCCNC2=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591245203 519560893 /nfs/dbraw/zinc/56/08/93/519560893.db2.gz QXOUFMPPZNBYDT-KBXCAEBGSA-N 1 1 357.410 2.955 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461774 519973892 /nfs/dbraw/zinc/97/38/92/519973892.db2.gz VYABRAXCKXGQTC-KOLCDFICSA-N 1 1 362.386 2.886 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c(C)cc1[N+](=O)[O-] ZINC000594483697 519991964 /nfs/dbraw/zinc/99/19/64/519991964.db2.gz NZNCHLLGFQMLII-HUUCEWRRSA-N 1 1 367.471 2.507 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594484875 519995694 /nfs/dbraw/zinc/99/56/94/519995694.db2.gz WLDZUALZSZYCNI-STQMWFEESA-N 1 1 373.862 2.543 20 5 FFBDMO C[C@@H](c1ccccc1)N(C)C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602965525 519996351 /nfs/dbraw/zinc/99/63/51/519996351.db2.gz HXDAQJOCYBPHDA-MGPUTAFESA-N 1 1 371.437 2.612 20 5 FFBDMO O=C(c1c(Cl)cccc1[N+](=O)[O-])N1CCC([N@H+]2CCCOCC2)CC1 ZINC000600008439 519999872 /nfs/dbraw/zinc/99/98/72/519999872.db2.gz PJXFXSSKZWDNNE-UHFFFAOYSA-N 1 1 367.833 2.575 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594602742 520047588 /nfs/dbraw/zinc/04/75/88/520047588.db2.gz SCUKZXCUFJBVPG-VXGBXAGGSA-N 1 1 355.236 2.603 20 5 FFBDMO O=[N+]([O-])c1cncc(Br)c1N[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594602742 520047593 /nfs/dbraw/zinc/04/75/93/520047593.db2.gz SCUKZXCUFJBVPG-VXGBXAGGSA-N 1 1 355.236 2.603 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@]2(CO)CCOC2)cc1[N+](=O)[O-] ZINC000600179515 520105096 /nfs/dbraw/zinc/10/50/96/520105096.db2.gz YVOGOLNGECVGCY-FQEVSTJZSA-N 1 1 371.437 2.946 20 5 FFBDMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccnc(C[NH+](C)C)c1 ZINC000603143296 520106172 /nfs/dbraw/zinc/10/61/72/520106172.db2.gz SHBYCBODGRYALX-UHFFFAOYSA-N 1 1 357.414 2.758 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)ccc1[N+](=O)[O-] ZINC000597574912 520111863 /nfs/dbraw/zinc/11/18/63/520111863.db2.gz IVBIASRDWMOPEL-HUUCEWRRSA-N 1 1 365.405 2.640 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597575936 520113729 /nfs/dbraw/zinc/11/37/29/520113729.db2.gz AIKIZBPSPAOAGU-OLZOCXBDSA-N 1 1 355.797 2.815 20 5 FFBDMO COc1cc(CN2CCC([C@H]3CCC[NH2+]C3)CC2)c([N+](=O)[O-])cc1OC ZINC000594735193 520123365 /nfs/dbraw/zinc/12/33/65/520123365.db2.gz HNMMGMCEOIJCOY-HNNXBMFYSA-N 1 1 363.458 2.824 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000597605702 520132015 /nfs/dbraw/zinc/13/20/15/520132015.db2.gz SAGQLQMGLWTENS-LBPRGKRZSA-N 1 1 357.357 2.753 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600229408 520140692 /nfs/dbraw/zinc/14/06/92/520140692.db2.gz ROFTXYCIJYHAAF-INIZCTEOSA-N 1 1 360.458 2.920 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000600230519 520141289 /nfs/dbraw/zinc/14/12/89/520141289.db2.gz SYJKABQTDKJHJP-INIZCTEOSA-N 1 1 361.442 2.805 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1C ZINC000594788952 520158492 /nfs/dbraw/zinc/15/84/92/520158492.db2.gz INZKRDIATRFDKZ-AWEZNQCLSA-N 1 1 369.487 2.610 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000597709984 520190712 /nfs/dbraw/zinc/19/07/12/520190712.db2.gz FQCLIXFMUBGSCH-QGZVFWFLSA-N 1 1 369.368 2.754 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000594854455 520191213 /nfs/dbraw/zinc/19/12/13/520191213.db2.gz LGSIZZJMXMHDAO-CQSZACIVSA-N 1 1 367.471 2.589 20 5 FFBDMO COc1ccccc1C1([NH2+]CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000592142797 520218859 /nfs/dbraw/zinc/21/88/59/520218859.db2.gz FPJVFKYIUQWNJU-UHFFFAOYSA-N 1 1 367.405 2.771 20 5 FFBDMO CC(C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000592153989 520228813 /nfs/dbraw/zinc/22/88/13/520228813.db2.gz FBHJZXRZVOHXPQ-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1ccc([N+](=O)[O-])n1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000592153989 520228820 /nfs/dbraw/zinc/22/88/20/520228820.db2.gz FBHJZXRZVOHXPQ-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1ccc([N+](=O)[O-])n1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000592153989 520228826 /nfs/dbraw/zinc/22/88/26/520228826.db2.gz FBHJZXRZVOHXPQ-SFHVURJKSA-N 1 1 357.458 2.776 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1cccnc1N1CCCC1)OCCO2 ZINC000594956685 520229172 /nfs/dbraw/zinc/22/91/72/520229172.db2.gz KSRJTKBATNFVHM-UHFFFAOYSA-N 1 1 370.409 2.651 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](CCO)c1ccccc1F ZINC000592162384 520236928 /nfs/dbraw/zinc/23/69/28/520236928.db2.gz ZMZNGNYJMUKSDG-KRWDZBQOSA-N 1 1 361.373 2.694 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000603402070 520249203 /nfs/dbraw/zinc/24/92/03/520249203.db2.gz MBUURZSCLHIECJ-AWEZNQCLSA-N 1 1 356.426 2.833 20 5 FFBDMO COc1ccc(COCC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000609384814 520300244 /nfs/dbraw/zinc/30/02/44/520300244.db2.gz BHXDQYVUCKJEIL-UHFFFAOYSA-N 1 1 371.437 2.942 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1SC ZINC000597922667 520325259 /nfs/dbraw/zinc/32/52/59/520325259.db2.gz KKCHHRDRYKNFCQ-LLVKDONJSA-N 1 1 367.471 2.928 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000603834065 520370679 /nfs/dbraw/zinc/37/06/79/520370679.db2.gz GJNJDPRVQFCBFU-AWEZNQCLSA-N 1 1 370.409 2.939 20 5 FFBDMO Cc1nccc([C@H]2CCC[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)n1 ZINC000603834065 520370689 /nfs/dbraw/zinc/37/06/89/520370689.db2.gz GJNJDPRVQFCBFU-AWEZNQCLSA-N 1 1 370.409 2.939 20 5 FFBDMO CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598040314 520388936 /nfs/dbraw/zinc/38/89/36/520388936.db2.gz OUUDFTOSPCUJAC-AWEZNQCLSA-N 1 1 369.849 2.960 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000609710623 520412312 /nfs/dbraw/zinc/41/23/12/520412312.db2.gz CEHYAVKUXUESEZ-INIZCTEOSA-N 1 1 353.850 2.935 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592494028 520415375 /nfs/dbraw/zinc/41/53/75/520415375.db2.gz ZMKSBISBKOTHSI-JKSUJKDBSA-N 1 1 360.458 2.553 20 5 FFBDMO C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000598195957 520487136 /nfs/dbraw/zinc/48/71/36/520487136.db2.gz XSIRHTZOMYREQK-MRXNPFEDSA-N 1 1 368.437 2.566 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccccc1 ZINC000610003697 520503763 /nfs/dbraw/zinc/50/37/63/520503763.db2.gz HGGDUCJJKPPKNK-UHFFFAOYSA-N 1 1 357.410 2.612 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000595505528 520513630 /nfs/dbraw/zinc/51/36/30/520513630.db2.gz VOGAPSXVLLCXER-KXBFYZLASA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)c1 ZINC000610223889 520588751 /nfs/dbraw/zinc/58/87/51/520588751.db2.gz PBEBTWGVLMKGAA-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO C[C@@H]1COC2(CCC2)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000595682272 520644019 /nfs/dbraw/zinc/64/40/19/520644019.db2.gz QBYGWKMOMAOPJO-CYBMUJFWSA-N 1 1 361.398 2.536 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598558028 520703729 /nfs/dbraw/zinc/70/37/29/520703729.db2.gz BLBQXITUOCKFPA-MRXNPFEDSA-N 1 1 360.458 2.635 20 5 FFBDMO O=C(CSc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598560437 520704836 /nfs/dbraw/zinc/70/48/36/520704836.db2.gz LXOWJZIJAKBZOT-OAHLLOKOSA-N 1 1 363.483 2.925 20 5 FFBDMO COC(=O)c1ccnc(NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598602776 520737485 /nfs/dbraw/zinc/73/74/85/520737485.db2.gz QHTUTCVMBXGWHA-CQSZACIVSA-N 1 1 372.425 2.521 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000598613956 520743307 /nfs/dbraw/zinc/74/33/07/520743307.db2.gz ZYUOWPVQFKBJDM-UKRRQHHQSA-N 1 1 370.409 2.851 20 5 FFBDMO CN(C(=O)C[N@H+]1CC[C@H](N(C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595829156 520753313 /nfs/dbraw/zinc/75/33/13/520753313.db2.gz WXNVJYSLCFQPBZ-IBGZPJMESA-N 1 1 368.437 2.768 20 5 FFBDMO CN(C(=O)C[N@@H+]1CC[C@H](N(C)c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000595829156 520753317 /nfs/dbraw/zinc/75/33/17/520753317.db2.gz WXNVJYSLCFQPBZ-IBGZPJMESA-N 1 1 368.437 2.768 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595830354 520754162 /nfs/dbraw/zinc/75/41/62/520754162.db2.gz KRIVLCZAEMKGJG-ZYHUDNBSSA-N 1 1 358.341 2.673 20 5 FFBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc(F)cc2C(N)=O)CC1 ZINC000598649000 520762415 /nfs/dbraw/zinc/76/24/15/520762415.db2.gz UKPRBLMCIBKMRG-ZDUSSCGKSA-N 1 1 372.400 2.716 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900784 520804532 /nfs/dbraw/zinc/80/45/32/520804532.db2.gz LDZAMUXLZMYIFT-ZBFHGGJFSA-N 1 1 360.458 2.633 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000593188211 520810220 /nfs/dbraw/zinc/81/02/20/520810220.db2.gz YXEYODZNLONPBX-KFWWJZLASA-N 1 1 360.458 2.748 20 5 FFBDMO C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@](C)(C(F)F)O1 ZINC000595922328 520827438 /nfs/dbraw/zinc/82/74/38/520827438.db2.gz ORBCTMARFPSOFF-MEDUHNTESA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@](C)(C(F)F)O1 ZINC000595922328 520827445 /nfs/dbraw/zinc/82/74/45/520827445.db2.gz ORBCTMARFPSOFF-MEDUHNTESA-N 1 1 357.357 2.668 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H]2CCCC[N@@H+]2C2CC2)c1[N+](=O)[O-] ZINC000618068292 520864596 /nfs/dbraw/zinc/86/45/96/520864596.db2.gz NHCUBXAVVRETJT-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-] ZINC000618068292 520864601 /nfs/dbraw/zinc/86/46/01/520864601.db2.gz NHCUBXAVVRETJT-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593322015 520908745 /nfs/dbraw/zinc/90/87/45/520908745.db2.gz KTKFPWOBCHZBTA-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1 ZINC000593322015 520908739 /nfs/dbraw/zinc/90/87/39/520908739.db2.gz KTKFPWOBCHZBTA-SFHVURJKSA-N 1 1 353.422 2.902 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)C[C@H]1Cc1ccccc1 ZINC000593324501 520910443 /nfs/dbraw/zinc/91/04/43/520910443.db2.gz WQKCCLSWJUJFJZ-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)C[C@H]1Cc1ccccc1 ZINC000593324501 520910454 /nfs/dbraw/zinc/91/04/54/520910454.db2.gz WQKCCLSWJUJFJZ-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO CC1(C)C[N@H+](C2(CNc3cc[nH]c(=O)c3[N+](=O)[O-])CCCCC2)CCO1 ZINC000596118703 520923922 /nfs/dbraw/zinc/92/39/22/520923922.db2.gz AURKDDBRYXWNGZ-UHFFFAOYSA-N 1 1 364.446 2.921 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1 ZINC000596127020 520928364 /nfs/dbraw/zinc/92/83/64/520928364.db2.gz SOULVUBANZLBNL-CABCVRRESA-N 1 1 360.458 2.785 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000596140855 520936192 /nfs/dbraw/zinc/93/61/92/520936192.db2.gz JQHPWUGBEQQMIF-LBPRGKRZSA-N 1 1 370.247 2.516 20 5 FFBDMO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C[N@H+]1Cc1ccccc1 ZINC000596163474 520946637 /nfs/dbraw/zinc/94/66/37/520946637.db2.gz VMFJCWQTRWNBFJ-CJNGLKHVSA-N 1 1 354.410 2.769 20 5 FFBDMO CC[N@H+]1CCN(C(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C ZINC000611088167 520979264 /nfs/dbraw/zinc/97/92/64/520979264.db2.gz HRTUPZMLRUAEAT-GFCCVEGCSA-N 1 1 355.822 2.570 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-] ZINC000596231012 520984788 /nfs/dbraw/zinc/98/47/88/520984788.db2.gz NIBFYVJTRUACDR-SECBINFHSA-N 1 1 350.762 2.658 20 5 FFBDMO Nc1ccc(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)nc1[N+](=O)[O-] ZINC000596230533 520984844 /nfs/dbraw/zinc/98/48/44/520984844.db2.gz BOYQPKGDCWYMKZ-LJQANCHMSA-N 1 1 353.426 2.674 20 5 FFBDMO C[N@H+]1CCCC[C@@H](CNC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000599024010 520987346 /nfs/dbraw/zinc/98/73/46/520987346.db2.gz FKDUUSYOMMXQPZ-ZDUSSCGKSA-N 1 1 368.865 2.822 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cccc(Cn2nc([N+](=O)[O-])cc2C)c1 ZINC000593447522 520997493 /nfs/dbraw/zinc/99/74/93/520997493.db2.gz DLOAIHZBIHQFHL-AWEZNQCLSA-N 1 1 373.457 2.608 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)c1 ZINC000601881136 521003726 /nfs/dbraw/zinc/00/37/26/521003726.db2.gz RTJIJWRECZAORQ-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO O=[N+]([O-])c1c2ccncc2ccc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000599086657 521023499 /nfs/dbraw/zinc/02/34/99/521023499.db2.gz RKNQNMFOCIYMPI-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCO[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@H]32)c(F)c1 ZINC000593496994 521033572 /nfs/dbraw/zinc/03/35/72/521033572.db2.gz ZFLWGULRBAOVRR-QZTJIDSGSA-N 1 1 372.400 2.609 20 5 FFBDMO CC(=O)c1ccc(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000596423633 521063260 /nfs/dbraw/zinc/06/32/60/521063260.db2.gz MZTQXIZECOJUDZ-GOSISDBHSA-N 1 1 369.421 2.976 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CCc1ccc(CO)cc1)c1cccc([N+](=O)[O-])c1 ZINC000611560837 521220354 /nfs/dbraw/zinc/22/03/54/521220354.db2.gz LEFUNPIYIDUIJK-LJQANCHMSA-N 1 1 366.421 2.742 20 5 FFBDMO COC(=O)[C@@H]1CCCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000611576178 521229925 /nfs/dbraw/zinc/22/99/25/521229925.db2.gz ODAFVNWTVIBZQC-INIZCTEOSA-N 1 1 363.414 2.649 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000611577218 521231116 /nfs/dbraw/zinc/23/11/16/521231116.db2.gz GRMWMMWMSVPYRU-LBPRGKRZSA-N 1 1 373.356 2.636 20 5 FFBDMO CNc1ccc(C(=O)NCc2ccc(C)[nH+]c2N2CCCC2)cc1[N+](=O)[O-] ZINC000611582213 521236026 /nfs/dbraw/zinc/23/60/26/521236026.db2.gz IOPZHSQKFZCGIO-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000599536954 521282585 /nfs/dbraw/zinc/28/25/85/521282585.db2.gz XQISJULITSBABU-LJQANCHMSA-N 1 1 357.458 2.634 20 5 FFBDMO CC(C)[C@H]1CN(Cc2ccccc2)CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000599536954 521282589 /nfs/dbraw/zinc/28/25/89/521282589.db2.gz XQISJULITSBABU-LJQANCHMSA-N 1 1 357.458 2.634 20 5 FFBDMO CC(C)[C@H]1CN(Cc2ccccc2)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000599536954 521282593 /nfs/dbraw/zinc/28/25/93/521282593.db2.gz XQISJULITSBABU-LJQANCHMSA-N 1 1 357.458 2.634 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)ccc1[N+](=O)[O-] ZINC000596822986 521311245 /nfs/dbraw/zinc/31/12/45/521311245.db2.gz JPOQHUKASHYEAD-IAGOWNOFSA-N 1 1 374.441 2.668 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H](OC2CCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000594027584 521360258 /nfs/dbraw/zinc/36/02/58/521360258.db2.gz WQRPUPFNKZBAJA-KRWDZBQOSA-N 1 1 359.426 2.517 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H](OC2CCC2)C1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000594027584 521360261 /nfs/dbraw/zinc/36/02/61/521360261.db2.gz WQRPUPFNKZBAJA-KRWDZBQOSA-N 1 1 359.426 2.517 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C ZINC000596891934 521360704 /nfs/dbraw/zinc/36/07/04/521360704.db2.gz YFNDGUTVPUUATG-CYBMUJFWSA-N 1 1 350.419 2.988 20 5 FFBDMO CCOC(=O)CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)C ZINC000594051026 521374729 /nfs/dbraw/zinc/37/47/29/521374729.db2.gz KKSDKYUFFROUGC-UHFFFAOYSA-N 1 1 352.387 2.625 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000594200289 521466494 /nfs/dbraw/zinc/46/64/94/521466494.db2.gz KMSQHOWGEBEMOB-JKSUJKDBSA-N 1 1 369.425 2.527 20 5 FFBDMO Nc1c(NC(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc(Cl)cc1[N+](=O)[O-] ZINC000599800294 521481598 /nfs/dbraw/zinc/48/15/98/521481598.db2.gz HHCNXHIKNSETFY-LBPRGKRZSA-N 1 1 367.837 2.969 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597091138 521496254 /nfs/dbraw/zinc/49/62/54/521496254.db2.gz VSZGUZWDBRZKNH-JTQLQIEISA-N 1 1 355.826 2.825 20 5 FFBDMO Nc1c(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc(Cl)cc1[N+](=O)[O-] ZINC000597095659 521500962 /nfs/dbraw/zinc/50/09/62/521500962.db2.gz ZMGKERNUXWGRMH-MNOVXSKESA-N 1 1 353.810 2.579 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599840856 521505826 /nfs/dbraw/zinc/50/58/26/521505826.db2.gz UOQZOPVMAOXPQU-ZDUSSCGKSA-N 1 1 357.414 2.996 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])cc1OC(F)F ZINC000602762577 521518836 /nfs/dbraw/zinc/51/88/36/521518836.db2.gz NIHZMLXHPRFSJI-UHFFFAOYSA-N 1 1 370.356 2.842 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cccc4c3CCOC4)C2)nc1 ZINC000602794753 521536563 /nfs/dbraw/zinc/53/65/63/521536563.db2.gz OXVAXHNQCYHCSP-INIZCTEOSA-N 1 1 354.410 2.749 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1CC(=O)c1ccc(F)cc1 ZINC000602797074 521538589 /nfs/dbraw/zinc/53/85/89/521538589.db2.gz LNFLDKNCFRWEDB-MRXNPFEDSA-N 1 1 360.389 2.976 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000619530282 521754119 /nfs/dbraw/zinc/75/41/19/521754119.db2.gz AOPUOIUMTNLZDB-KRWDZBQOSA-N 1 1 355.394 2.585 20 5 FFBDMO Cc1cc(OCC(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000619530282 521754129 /nfs/dbraw/zinc/75/41/29/521754129.db2.gz AOPUOIUMTNLZDB-KRWDZBQOSA-N 1 1 355.394 2.585 20 5 FFBDMO C[NH+]1CCN(C(=O)c2ccc(NCc3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000619858166 521907198 /nfs/dbraw/zinc/90/71/98/521907198.db2.gz DEUFRPGJKVXURF-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000026218831 535521734 /nfs/dbraw/zinc/52/17/34/535521734.db2.gz OLMJRTMSNPKHKT-CQSZACIVSA-N 1 1 363.414 2.507 20 5 FFBDMO C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@@H]1c1ccccc1 ZINC000826028546 607967865 /nfs/dbraw/zinc/96/78/65/607967865.db2.gz CBLQFYPAKILVJE-IRXDYDNUSA-N 1 1 365.397 2.632 20 5 FFBDMO Nc1cc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC001164627836 719084239 /nfs/dbraw/zinc/08/42/39/719084239.db2.gz RBRFFDBINKJHQH-YJBOKZPZSA-N 1 1 353.426 2.673 20 5 FFBDMO Nc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)ccc1[N+](=O)[O-] ZINC001164629204 719084625 /nfs/dbraw/zinc/08/46/25/719084625.db2.gz WLEJDJJQVINJGR-DOTOQJQBSA-N 1 1 353.426 2.673 20 5 FFBDMO O=[N+]([O-])c1c[nH]c2ccc(N3CC[C@H]4[C@@H]3CC[N@H+]4Cc3cccnc3)nc21 ZINC001164724695 720403965 /nfs/dbraw/zinc/40/39/65/720403965.db2.gz KOCZLXGWUSWNIN-HOTGVXAUSA-N 1 1 364.409 2.719 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CC[N@H+]2C[C@H](Oc3cccc(F)c3)C[C@@H]2C1 ZINC001164897257 721511561 /nfs/dbraw/zinc/51/15/61/721511561.db2.gz FNQHHVCHYADCEU-SJLPKXTDSA-N 1 1 372.400 2.779 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)nc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165038051 721908225 /nfs/dbraw/zinc/90/82/25/721908225.db2.gz JFZHRSBQEDGKJP-JTQLQIEISA-N 1 1 361.229 2.598 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000898039363 735306071 /nfs/dbraw/zinc/30/60/71/735306071.db2.gz ZTYMWUJGWFQHSW-NSHDSACASA-N 1 1 370.247 2.500 20 5 FFBDMO CCOC[C@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000113937406 728558434 /nfs/dbraw/zinc/55/84/34/728558434.db2.gz BVPBTALOLFVMPN-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000113937406 728558436 /nfs/dbraw/zinc/55/84/36/728558436.db2.gz BVPBTALOLFVMPN-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO O=[N+]([O-])c1cc(Br)ccc1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000252668602 729624874 /nfs/dbraw/zinc/62/48/74/729624874.db2.gz YCAFIDOFSBCMIU-NWDGAFQWSA-N 1 1 356.220 2.632 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000857303014 730390101 /nfs/dbraw/zinc/39/01/01/730390101.db2.gz JVOLORSKIXXZRI-JTQLQIEISA-N 1 1 370.247 2.960 20 5 FFBDMO CC(C)(C)[N@@H+]1CC[C@](F)(C(=O)Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000857637121 730403582 /nfs/dbraw/zinc/40/35/82/730403582.db2.gz UZWQEASEJHBGFH-OAHLLOKOSA-N 1 1 355.322 2.621 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)Oc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1 ZINC000857637121 730403583 /nfs/dbraw/zinc/40/35/83/730403583.db2.gz UZWQEASEJHBGFH-OAHLLOKOSA-N 1 1 355.322 2.621 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NCC[N@@H+]1CC[C@@H](O)C1 ZINC000858812740 730434183 /nfs/dbraw/zinc/43/41/83/730434183.db2.gz RXDOYWKVIULIMN-MRVPVSSYSA-N 1 1 353.728 2.746 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000859347819 730451108 /nfs/dbraw/zinc/45/11/08/730451108.db2.gz HIGAIMHUFNUUCQ-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000859347819 730451109 /nfs/dbraw/zinc/45/11/09/730451109.db2.gz HIGAIMHUFNUUCQ-CYBMUJFWSA-N 1 1 373.862 2.543 20 5 FFBDMO CCC[C@H](OCC)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860781106 730546520 /nfs/dbraw/zinc/54/65/20/730546520.db2.gz UPHGQZOOCPRJCD-IRXDYDNUSA-N 1 1 350.415 2.918 20 5 FFBDMO CCC[C@H](OCC)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000860781106 730546523 /nfs/dbraw/zinc/54/65/23/730546523.db2.gz UPHGQZOOCPRJCD-IRXDYDNUSA-N 1 1 350.415 2.918 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000862792603 730726763 /nfs/dbraw/zinc/72/67/63/730726763.db2.gz AVLPGRVYVCIFOI-LLVKDONJSA-N 1 1 357.813 2.778 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000864611049 730865150 /nfs/dbraw/zinc/86/51/50/730865150.db2.gz ZRYKAGYBNREPDM-LBPRGKRZSA-N 1 1 370.247 2.500 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCN1CCC(O)CC1 ZINC000872026538 731721564 /nfs/dbraw/zinc/72/15/64/731721564.db2.gz FULAEXALPQERHG-ZDUSSCGKSA-N 1 1 353.488 2.814 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@@H+]1CCCO ZINC000872074960 731726711 /nfs/dbraw/zinc/72/67/11/731726711.db2.gz KZMFBUCGGWYIEK-DZGCQCFKSA-N 1 1 353.488 2.814 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@H+]1CCCO ZINC000872074960 731726715 /nfs/dbraw/zinc/72/67/15/731726715.db2.gz KZMFBUCGGWYIEK-DZGCQCFKSA-N 1 1 353.488 2.814 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000874837189 732106045 /nfs/dbraw/zinc/10/60/45/732106045.db2.gz IZUFOJFYQPPDAK-QWHCGFSZSA-N 1 1 368.231 2.666 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000874839247 732106358 /nfs/dbraw/zinc/10/63/58/732106358.db2.gz UPBQAJVRTYQZAX-KBPBESRZSA-N 1 1 367.833 2.712 20 5 FFBDMO CC[N@H+]1CCN(Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H]1C ZINC000878297883 732511355 /nfs/dbraw/zinc/51/13/55/732511355.db2.gz BLPRISWPYGLCTN-LLVKDONJSA-N 1 1 365.821 2.824 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(CC(F)(F)F)C1 ZINC000878944466 732619521 /nfs/dbraw/zinc/61/95/21/732619521.db2.gz XBLZAICEDYNOKD-LSDHHAIUSA-N 1 1 361.364 2.587 20 5 FFBDMO COC[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000879050579 732637271 /nfs/dbraw/zinc/63/72/71/732637271.db2.gz GQRCTQWZSRZAQZ-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO COC[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000879050579 732637273 /nfs/dbraw/zinc/63/72/73/732637273.db2.gz GQRCTQWZSRZAQZ-NSHDSACASA-N 1 1 352.778 2.909 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419278 732699691 /nfs/dbraw/zinc/69/96/91/732699691.db2.gz LCELFTSNRKJPLC-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000879419278 732699696 /nfs/dbraw/zinc/69/96/96/732699696.db2.gz LCELFTSNRKJPLC-XPKDYRNWSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1csc([C@@H]2CC[N@@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880007620 732818051 /nfs/dbraw/zinc/81/80/51/732818051.db2.gz KLJOBWSLOXQBEA-CYBMUJFWSA-N 1 1 360.439 2.812 20 5 FFBDMO Cc1csc([C@@H]2CC[N@H+](CC(=O)N(C)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880007620 732818054 /nfs/dbraw/zinc/81/80/54/732818054.db2.gz KLJOBWSLOXQBEA-CYBMUJFWSA-N 1 1 360.439 2.812 20 5 FFBDMO O=C(CC[N@H+]1CCO[C@H](C(F)(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000880052279 732833595 /nfs/dbraw/zinc/83/35/95/732833595.db2.gz HMXDLFUSHKZVHK-ZDUSSCGKSA-N 1 1 361.320 2.577 20 5 FFBDMO CO[C@]1(C(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000880304499 732883827 /nfs/dbraw/zinc/88/38/27/732883827.db2.gz PQGYLBVLOFXDTE-CQSZACIVSA-N 1 1 361.320 2.577 20 5 FFBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H](O)c1ccccc1Br ZINC000886239373 733764875 /nfs/dbraw/zinc/76/48/75/733764875.db2.gz VKUKOPWFJNZENH-CQSZACIVSA-N 1 1 366.215 2.918 20 5 FFBDMO C[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H](O)c1ccccc1Br ZINC000886239373 733764878 /nfs/dbraw/zinc/76/48/78/733764878.db2.gz VKUKOPWFJNZENH-CQSZACIVSA-N 1 1 366.215 2.918 20 5 FFBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000886319848 733773114 /nfs/dbraw/zinc/77/31/14/733773114.db2.gz QTGLHVLEYSCGME-UONOGXRCSA-N 1 1 355.316 2.614 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cccnc1N1CCOCC1 ZINC000892544285 734571214 /nfs/dbraw/zinc/57/12/14/734571214.db2.gz UQKFHQHYFGBDDK-UHFFFAOYSA-N 1 1 362.817 2.770 20 5 FFBDMO CC(C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+]1CCOCC1 ZINC000729630449 734587592 /nfs/dbraw/zinc/58/75/92/734587592.db2.gz MYDHVKPHVOATIZ-CQSZACIVSA-N 1 1 350.444 2.973 20 5 FFBDMO CC(C)[C@H]([NH2+]C1CCOCC1)C(=O)O[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000783924945 738849209 /nfs/dbraw/zinc/84/92/09/738849209.db2.gz RZGWLGGSMKGSKN-DYVFJYSZSA-N 1 1 350.415 2.992 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](C4OCCO4)C3)cs2)c1 ZINC000896386178 735150857 /nfs/dbraw/zinc/15/08/57/735150857.db2.gz LMSGWRACRXRFNW-ZDUSSCGKSA-N 1 1 361.423 2.913 20 5 FFBDMO COc1cc(C[NH+]2CCC(O)(C3CCC3)CC2)c([N+](=O)[O-])cc1OC ZINC000897034815 735192662 /nfs/dbraw/zinc/19/26/62/735192662.db2.gz MIWRPWTWUXUHMU-UHFFFAOYSA-N 1 1 350.415 2.739 20 5 FFBDMO CNC(=O)COc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000748819944 735674746 /nfs/dbraw/zinc/67/47/46/735674746.db2.gz RPTHBKQNRFKHKY-UHFFFAOYSA-N 1 1 363.801 2.663 20 5 FFBDMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000791058698 739526819 /nfs/dbraw/zinc/52/68/19/739526819.db2.gz DZQVKOFIAULKQB-AWEZNQCLSA-N 1 1 355.385 2.923 20 5 FFBDMO CCc1noc(C)c1[C@@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000757674909 736418268 /nfs/dbraw/zinc/41/82/68/736418268.db2.gz HZFRKAODBJTBJA-LLVKDONJSA-N 1 1 367.427 2.578 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761042774 736689760 /nfs/dbraw/zinc/68/97/60/736689760.db2.gz RPYFRXWPBJGYSP-SNVBAGLBSA-N 1 1 359.304 2.777 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761044898 736690000 /nfs/dbraw/zinc/69/00/00/736690000.db2.gz IZYLGWCUOBABNL-SNVBAGLBSA-N 1 1 361.320 2.816 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1)C2 ZINC000908534305 736791098 /nfs/dbraw/zinc/79/10/98/736791098.db2.gz BCBPXTKGBXRJSM-MRXNPFEDSA-N 1 1 355.797 2.945 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000768479263 737425394 /nfs/dbraw/zinc/42/53/94/737425394.db2.gz KGTYJMKTATXBNF-KRWDZBQOSA-N 1 1 362.499 2.918 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)cc([N+](=O)[O-])c1F ZINC000771730121 737750229 /nfs/dbraw/zinc/75/02/29/737750229.db2.gz BEBIBRNAXXHZTD-STQMWFEESA-N 1 1 373.450 2.584 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)OCC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000919226244 737845734 /nfs/dbraw/zinc/84/57/34/737845734.db2.gz DIDQQZYTRKIEIF-CYBMUJFWSA-N 1 1 351.359 2.843 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@@H+]3CCC[C@@H](C4OCCO4)C3)c2c(Cl)c1 ZINC000774634981 738007896 /nfs/dbraw/zinc/00/78/96/738007896.db2.gz GMJIJWJLVVCPBE-LLVKDONJSA-N 1 1 366.805 2.640 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CCC[C@@H](C4OCCO4)C3)c2c(Cl)c1 ZINC000774634981 738007902 /nfs/dbraw/zinc/00/79/02/738007902.db2.gz GMJIJWJLVVCPBE-LLVKDONJSA-N 1 1 366.805 2.640 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cn(C)nc1Br ZINC000922466227 738150015 /nfs/dbraw/zinc/15/00/15/738150015.db2.gz JJWGQWIGXYZLMM-UHFFFAOYSA-N 1 1 353.220 2.997 20 5 FFBDMO Cc1cn2c(nc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cc2=O)s1 ZINC000930354706 739092453 /nfs/dbraw/zinc/09/24/53/739092453.db2.gz SBASGMNFKIRTCI-UHFFFAOYSA-N 1 1 358.423 2.647 20 5 FFBDMO C[N@H+]1C[C@@H]2CCN(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3)[C@@H]2C1 ZINC000931335580 739247257 /nfs/dbraw/zinc/24/72/57/739247257.db2.gz XYGKAMFIFBCQKM-TVQRCGJNSA-N 1 1 369.219 2.525 20 5 FFBDMO O=C1CC2(CCC2)[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])CCN1 ZINC000931622181 739298906 /nfs/dbraw/zinc/29/89/06/739298906.db2.gz XFYNOIRVNJZOHX-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO O=C1CC2(CCC2)[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])CCN1 ZINC000931622181 739298908 /nfs/dbraw/zinc/29/89/08/739298908.db2.gz XFYNOIRVNJZOHX-UHFFFAOYSA-N 1 1 368.231 2.602 20 5 FFBDMO C[C@H]1CCSCC[N@@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000790479306 739460340 /nfs/dbraw/zinc/46/03/40/739460340.db2.gz SOJQIZPNAYFOST-ZDUSSCGKSA-N 1 1 350.444 2.622 20 5 FFBDMO C[C@H]1CCSCC[N@H+]1CN1CCN(c2ccccc2[N+](=O)[O-])C1=O ZINC000790479306 739460343 /nfs/dbraw/zinc/46/03/43/739460343.db2.gz SOJQIZPNAYFOST-ZDUSSCGKSA-N 1 1 350.444 2.622 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790588981 739472248 /nfs/dbraw/zinc/47/22/48/739472248.db2.gz AZWHYRJEGFWBAJ-LLVKDONJSA-N 1 1 357.813 2.776 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790599082 739472986 /nfs/dbraw/zinc/47/29/86/739472986.db2.gz RRYUQFKKFPLTAY-NSHDSACASA-N 1 1 357.813 2.778 20 5 FFBDMO C[N@@H+](CCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000790657967 739482276 /nfs/dbraw/zinc/48/22/76/739482276.db2.gz SEMMZIWOWMOGTH-UHFFFAOYSA-N 1 1 357.813 2.920 20 5 FFBDMO CN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000790886788 739509056 /nfs/dbraw/zinc/50/90/56/739509056.db2.gz AWYFOMOPYVXLJN-LBPRGKRZSA-N 1 1 355.797 2.625 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000933437235 739625074 /nfs/dbraw/zinc/62/50/74/739625074.db2.gz BIVJOAIZXUVJAY-BBRMVZONSA-N 1 1 351.422 2.855 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC000933778813 739689366 /nfs/dbraw/zinc/68/93/66/739689366.db2.gz JEIMEQURIAKCRV-SNVBAGLBSA-N 1 1 372.828 2.773 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c2c(c1)COCO2 ZINC000934337640 739768873 /nfs/dbraw/zinc/76/88/73/739768873.db2.gz TZAWOVSGRMZQDQ-LBPRGKRZSA-N 1 1 361.423 2.982 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000934576255 739808428 /nfs/dbraw/zinc/80/84/28/739808428.db2.gz MDKZAALLJLVTHY-XHDPSFHLSA-N 1 1 351.834 2.780 20 5 FFBDMO Cc1ccc(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC000940107294 740147036 /nfs/dbraw/zinc/14/70/36/740147036.db2.gz HGHVTSAQJOOXFC-GDBMZVCRSA-N 1 1 365.861 2.784 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1sccc1Cl)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963788400 740656041 /nfs/dbraw/zinc/65/60/41/740656041.db2.gz PJRMJNZNURLNRZ-WZOFNLEDSA-N 1 1 369.874 2.584 20 5 FFBDMO CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000809913624 741360035 /nfs/dbraw/zinc/36/00/35/741360035.db2.gz PPHWWVRWKWEYAL-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl ZINC000809913624 741360038 /nfs/dbraw/zinc/36/00/38/741360038.db2.gz PPHWWVRWKWEYAL-UHFFFAOYSA-N 1 1 370.837 2.823 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1COC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1 ZINC000811445383 741522159 /nfs/dbraw/zinc/52/21/59/741522159.db2.gz QMPROLVSJNPNQS-QGZVFWFLSA-N 1 1 354.378 2.859 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](CCO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000817299072 742120664 /nfs/dbraw/zinc/12/06/64/742120664.db2.gz UFVMNMODIXLBLX-GFCCVEGCSA-N 1 1 355.822 2.671 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](CCO)CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000817299072 742120666 /nfs/dbraw/zinc/12/06/66/742120666.db2.gz UFVMNMODIXLBLX-GFCCVEGCSA-N 1 1 355.822 2.671 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000820131719 742466252 /nfs/dbraw/zinc/46/62/52/742466252.db2.gz IPJQFQGZPSCXRK-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO Cc1cc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c(C)s1 ZINC001029964639 742824443 /nfs/dbraw/zinc/82/44/43/742824443.db2.gz SRSUMVPDNNMRKE-IAGOWNOFSA-N 1 1 365.499 2.701 20 5 FFBDMO Cc1cc(C[N@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001029964639 742824451 /nfs/dbraw/zinc/82/44/51/742824451.db2.gz SRSUMVPDNNMRKE-IAGOWNOFSA-N 1 1 365.499 2.701 20 5 FFBDMO Cc1cc(C[N@@H+](C)CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001029964639 742824456 /nfs/dbraw/zinc/82/44/56/742824456.db2.gz SRSUMVPDNNMRKE-IAGOWNOFSA-N 1 1 365.499 2.701 20 5 FFBDMO Cc1cc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)cs1 ZINC001034815724 742934465 /nfs/dbraw/zinc/93/44/65/742934465.db2.gz CLALRBGCSAREIQ-IAGOWNOFSA-N 1 1 359.451 2.628 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@H](O)CNC(=O)OC(C)(C)C ZINC000824571630 743109183 /nfs/dbraw/zinc/10/91/83/743109183.db2.gz NTFZMRGDWCZQME-LBPRGKRZSA-N 1 1 373.837 2.566 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CCC[N@@H+](CCCO)C1 ZINC000824583172 743111636 /nfs/dbraw/zinc/11/16/36/743111636.db2.gz IQPUCBIRMLPYET-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CCC[N@H+](CCCO)C1 ZINC000824583172 743111639 /nfs/dbraw/zinc/11/16/39/743111639.db2.gz IQPUCBIRMLPYET-CYBMUJFWSA-N 1 1 362.257 2.838 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)CCOc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000827321135 743554654 /nfs/dbraw/zinc/55/46/54/743554654.db2.gz UNAYYXCVPCNWAK-TZMCWYRMSA-N 1 1 367.833 2.570 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000831159708 745492775 /nfs/dbraw/zinc/49/27/75/745492775.db2.gz XZCFWIUIDYJQNJ-XNRPHZJLSA-N 1 1 367.833 2.812 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2CCC[C@@H]2CO)cc1Cl ZINC000836780079 746304497 /nfs/dbraw/zinc/30/44/97/746304497.db2.gz VQJYXHBNUYFTLL-CYBMUJFWSA-N 1 1 369.849 2.523 20 5 FFBDMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000836949171 746335577 /nfs/dbraw/zinc/33/55/77/746335577.db2.gz INKHPSLNSZMVNH-GFCCVEGCSA-N 1 1 357.813 2.873 20 5 FFBDMO C[N@@H+](CCCCNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000837225333 746397126 /nfs/dbraw/zinc/39/71/26/746397126.db2.gz QIRWDENDKPAGGC-UHFFFAOYSA-N 1 1 357.813 2.920 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000838514898 746655899 /nfs/dbraw/zinc/65/58/99/746655899.db2.gz WUXVXCANMTUBJJ-CQSZACIVSA-N 1 1 354.838 2.872 20 5 FFBDMO COC(=O)CC[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC(C)C ZINC000839476441 746834663 /nfs/dbraw/zinc/83/46/63/746834663.db2.gz PDEMOJBMKLATEB-UHFFFAOYSA-N 1 1 371.821 2.708 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839505301 746842641 /nfs/dbraw/zinc/84/26/41/746842641.db2.gz LZLKAOYNMGPQKP-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO COC(=O)[C@@]1(C)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839505301 746842643 /nfs/dbraw/zinc/84/26/43/746842643.db2.gz LZLKAOYNMGPQKP-AWEZNQCLSA-N 1 1 357.204 2.742 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]CCS(=O)(=O)C2CC2)c2ccccc2)c1 ZINC000840882317 747211065 /nfs/dbraw/zinc/21/10/65/747211065.db2.gz IRCCWRHEHOYCNZ-GOSISDBHSA-N 1 1 360.435 2.851 20 5 FFBDMO [NH3+][C@H]1CCO[C@@H](C2CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)C1 ZINC000841104797 747270896 /nfs/dbraw/zinc/27/08/96/747270896.db2.gz SQBLGKCSZNKNSC-WMLDXEAASA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652788 747650042 /nfs/dbraw/zinc/65/00/42/747650042.db2.gz YLMVYJHHMLNNJE-ZYHUDNBSSA-N 1 1 373.862 2.639 20 5 FFBDMO C[C@@H](SC[C@H]1C[N@@H+](C)CCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000842652788 747650046 /nfs/dbraw/zinc/65/00/46/747650046.db2.gz YLMVYJHHMLNNJE-ZYHUDNBSSA-N 1 1 373.862 2.639 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](COC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1 ZINC000842831162 747701439 /nfs/dbraw/zinc/70/14/39/747701439.db2.gz QSDZNNRIRTUWAZ-LBPRGKRZSA-N 1 1 350.371 2.601 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000848490225 748939378 /nfs/dbraw/zinc/93/93/78/748939378.db2.gz XQRJRXGDJFWJJD-GDBMZVCRSA-N 1 1 351.353 2.599 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000848490225 748939382 /nfs/dbraw/zinc/93/93/82/748939382.db2.gz XQRJRXGDJFWJJD-GDBMZVCRSA-N 1 1 351.353 2.599 20 5 FFBDMO CCN(C(=O)NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@@H+](CC)C1 ZINC000853848383 750181660 /nfs/dbraw/zinc/18/16/60/750181660.db2.gz XTTJUFCKDGOTRT-CQSZACIVSA-N 1 1 354.838 2.874 20 5 FFBDMO C[N@@H+]1CCO[C@@H](CSCc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000400774057 845875093 /nfs/dbraw/zinc/87/50/93/845875093.db2.gz DLENVIJBJPJVQW-LLVKDONJSA-N 1 1 361.261 2.921 20 5 FFBDMO C[N@H+]1CCO[C@@H](CSCc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000400774057 845875096 /nfs/dbraw/zinc/87/50/96/845875096.db2.gz DLENVIJBJPJVQW-LLVKDONJSA-N 1 1 361.261 2.921 20 5 FFBDMO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@H]1C[N@@H+](C)CCN1C ZINC000896569852 971594799 /nfs/dbraw/zinc/59/47/99/971594799.db2.gz JESHXHYSVYJZLD-MGPUTAFESA-N 1 1 362.477 2.752 20 5 FFBDMO CCOC(=O)c1cnc(NCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC001167750631 971697957 /nfs/dbraw/zinc/69/79/57/971697957.db2.gz ARWAPYQPUZPNPK-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(OC[C@H]3CCCCO3)CC2)c1 ZINC000176211321 965567914 /nfs/dbraw/zinc/56/79/14/965567914.db2.gz CSEGADVUXOJZCA-GOSISDBHSA-N 1 1 374.441 2.952 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC001267590857 969689233 /nfs/dbraw/zinc/68/92/33/969689233.db2.gz LGSSUGDVDBNSHU-UGSOOPFHSA-N 1 1 354.410 2.549 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000874827011 1013910151 /nfs/dbraw/zinc/91/01/51/1013910151.db2.gz AGCGJLCENFUWCS-WOJBJXKFSA-N 1 1 361.445 2.990 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000311652734 970098610 /nfs/dbraw/zinc/09/86/10/970098610.db2.gz UNZVYTPBQZCPSV-ACJLOTCBSA-N 1 1 354.410 2.570 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2csc(N3CC[C@H]4[C@@H]3CCC[N@@H+]4CCO)n2)cc1 ZINC000897219826 973457506 /nfs/dbraw/zinc/45/75/06/973457506.db2.gz OSXYDZICGXNUBY-IRXDYDNUSA-N 1 1 374.466 2.754 20 5 FFBDMO CC(C)(C)Oc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-] ZINC000897221806 973460702 /nfs/dbraw/zinc/46/07/02/973460702.db2.gz OWVNAUDDDQJVKT-HOTGVXAUSA-N 1 1 363.458 2.808 20 5 FFBDMO CC(C)(C)Oc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-] ZINC000897221808 973460904 /nfs/dbraw/zinc/46/09/04/973460904.db2.gz OWVNAUDDDQJVKT-HZPDHXFCSA-N 1 1 363.458 2.808 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCN(c3ccccc3F)CC2)cc1 ZINC000796577974 1014375992 /nfs/dbraw/zinc/37/59/92/1014375992.db2.gz JCGDSVLJNZGJHH-LJQANCHMSA-N 1 1 359.401 2.980 20 5 FFBDMO O=C(Nc1ccc(N2CC[N@H+]3CCC[C@@H]3C2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000893845156 977564763 /nfs/dbraw/zinc/56/47/63/977564763.db2.gz ILZFODRAQSUCJB-OAHLLOKOSA-N 1 1 356.382 2.725 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001152053964 1032092664 /nfs/dbraw/zinc/09/26/64/1032092664.db2.gz ZFOQYQDNKLGNIW-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001152053964 1032092683 /nfs/dbraw/zinc/09/26/83/1032092683.db2.gz ZFOQYQDNKLGNIW-GOSISDBHSA-N 1 1 350.378 2.993 20 5 FFBDMO O=C(NCC[N@H+]1CCc2ccccc2C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000130011553 979639241 /nfs/dbraw/zinc/63/92/41/979639241.db2.gz CCRCWCGNALCVTB-UHFFFAOYSA-N 1 1 364.405 2.864 20 5 FFBDMO CN(C)[C@H]1CC[N@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CCO)cc2)C1 ZINC000906180665 980592661 /nfs/dbraw/zinc/59/26/61/980592661.db2.gz YJFKWJGPOYQZDT-FQEVSTJZSA-N 1 1 369.465 2.933 20 5 FFBDMO CN(C)[C@H]1CC[N@@H+](Cc2ccc(-c3cc([N+](=O)[O-])ccc3CCO)cc2)C1 ZINC000906180665 980592663 /nfs/dbraw/zinc/59/26/63/980592663.db2.gz YJFKWJGPOYQZDT-FQEVSTJZSA-N 1 1 369.465 2.933 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)Cc3cccnc3N2C1 ZINC000877686909 1014678062 /nfs/dbraw/zinc/67/80/62/1014678062.db2.gz ATCVMPLETVOBRQ-RBUKOAKNSA-N 1 1 368.437 2.642 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000130187522 981233955 /nfs/dbraw/zinc/23/39/55/981233955.db2.gz MQCFXHVIFMCLSO-UHFFFAOYSA-N 1 1 373.400 2.991 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)N1CCc2ccccc21 ZINC000729685083 981295654 /nfs/dbraw/zinc/29/56/54/981295654.db2.gz RNYYQBNARTYRSX-UHFFFAOYSA-N 1 1 355.394 2.672 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]Cc1ccccc1C1CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963789879 1014764039 /nfs/dbraw/zinc/76/40/39/1014764039.db2.gz DNEHGUQILUHKTB-LYBMJUBJSA-N 1 1 369.465 2.746 20 5 FFBDMO O=C(NC1CC2(C1)CC([NH2+]CC1CCC3(CC3)CC1)C2)[C@@H]1CC1[N+](=O)[O-] ZINC000963791147 1014766364 /nfs/dbraw/zinc/76/63/64/1014766364.db2.gz OELLBGUFUIHHMM-SWGIKSQZSA-N 1 1 361.486 2.639 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000129309135 981893772 /nfs/dbraw/zinc/89/37/72/981893772.db2.gz HTUWXCSYZJYUMM-VQIMIIECSA-N 1 1 355.442 2.832 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878155572 1014887643 /nfs/dbraw/zinc/88/76/43/1014887643.db2.gz CVCIXCMSUJEAGC-OAHLLOKOSA-N 1 1 371.441 2.809 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878155570 1014888264 /nfs/dbraw/zinc/88/82/64/1014888264.db2.gz CVCIXCMSUJEAGC-HNNXBMFYSA-N 1 1 371.441 2.809 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878603806 1015125890 /nfs/dbraw/zinc/12/58/90/1015125890.db2.gz IENPAEPCSHASIF-WQZURDFPSA-N 1 1 356.382 2.500 20 5 FFBDMO O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913685182 986828046 /nfs/dbraw/zinc/82/80/46/986828046.db2.gz GCDTWSGRJGRNFN-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO O=C(c1ccc(F)cc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1 ZINC000913685182 986828056 /nfs/dbraw/zinc/82/80/56/986828056.db2.gz GCDTWSGRJGRNFN-HOTGVXAUSA-N 1 1 355.369 2.833 20 5 FFBDMO C[C@@H]1CC2(CCC2)C[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000762147233 988153957 /nfs/dbraw/zinc/15/39/57/988153957.db2.gz XXBMDPXQKYFKLW-ACJLOTCBSA-N 1 1 372.425 2.584 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2c3ccccc3C[N@H+]2C)cc1[N+](=O)[O-] ZINC000879142903 1015382919 /nfs/dbraw/zinc/38/29/19/1015382919.db2.gz FKFTWQRGUBLGSS-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)cc1[N+](=O)[O-] ZINC000879142903 1015382933 /nfs/dbraw/zinc/38/29/33/1015382933.db2.gz FKFTWQRGUBLGSS-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2CC=C(C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000762699442 988588082 /nfs/dbraw/zinc/58/80/82/988588082.db2.gz IEPBNKJJFNXMPM-UHFFFAOYSA-N 1 1 362.386 2.502 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](C/C=C/c3ccccc3)C[C@H]2CC1 ZINC000946589068 988771992 /nfs/dbraw/zinc/77/19/92/988771992.db2.gz DPHYXTGSBAAMKS-UQBRJLPXSA-N 1 1 369.465 2.535 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](C/C=C/c3ccccc3)C[C@H]2CC1 ZINC000946589068 988772000 /nfs/dbraw/zinc/77/20/00/988772000.db2.gz DPHYXTGSBAAMKS-UQBRJLPXSA-N 1 1 369.465 2.535 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](C/C=C/c3ccccc3)C[C@H]2CC1 ZINC000946589068 988772011 /nfs/dbraw/zinc/77/20/11/988772011.db2.gz DPHYXTGSBAAMKS-UQBRJLPXSA-N 1 1 369.465 2.535 20 5 FFBDMO O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCCCCC3)C2)CC1 ZINC001035186578 990400231 /nfs/dbraw/zinc/40/02/31/990400231.db2.gz GISZMZVWKNHGHK-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CC3CCCCCC3)C2)CC1 ZINC001035186578 990400236 /nfs/dbraw/zinc/40/02/36/990400236.db2.gz GISZMZVWKNHGHK-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCCCCC3)C2)CC1 ZINC001035186578 990400241 /nfs/dbraw/zinc/40/02/41/990400241.db2.gz GISZMZVWKNHGHK-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)c1 ZINC000879499646 1015564343 /nfs/dbraw/zinc/56/43/43/1015564343.db2.gz AKUMZQADNZFROG-MSOLQXFVSA-N 1 1 354.410 2.508 20 5 FFBDMO CCC1([NH2+]Cc2ccc(Cl)cc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001484812200 991759315 /nfs/dbraw/zinc/75/93/15/991759315.db2.gz OTAJTIZLKTVZKT-HZPDHXFCSA-N 1 1 365.861 2.866 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000810614909 994853766 /nfs/dbraw/zinc/85/37/66/994853766.db2.gz HTZQPKIIVKBLRD-CYBMUJFWSA-N 1 1 358.398 2.945 20 5 FFBDMO CN(C)c1ccc(COC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000810670659 994871293 /nfs/dbraw/zinc/87/12/93/994871293.db2.gz IOVGSQKCAWWLLG-GOSISDBHSA-N 1 1 367.421 2.917 20 5 FFBDMO O=C(CCc1cccnc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170676 995632564 /nfs/dbraw/zinc/63/25/64/995632564.db2.gz JOHKDTBYAVBZMF-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(CCc1cccnc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813170676 995632567 /nfs/dbraw/zinc/63/25/67/995632567.db2.gz JOHKDTBYAVBZMF-SFHVURJKSA-N 1 1 355.394 2.740 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000826752358 1016047543 /nfs/dbraw/zinc/04/75/43/1016047543.db2.gz ZAYJUYNUIWGHFT-IPELMVKDSA-N 1 1 357.454 2.937 20 5 FFBDMO Cc1ccc(C)c(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c1 ZINC001000153876 1016248657 /nfs/dbraw/zinc/24/86/57/1016248657.db2.gz NAOTWOKMSWMBPH-RTBURBONSA-N 1 1 371.481 2.829 20 5 FFBDMO C[N@@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n[nH]1 ZINC000823774284 999077469 /nfs/dbraw/zinc/07/74/69/999077469.db2.gz RRBOGWTTZCZXKK-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO C[N@H+]1CCC[C@@H]1c1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n[nH]1 ZINC000823774284 999077474 /nfs/dbraw/zinc/07/74/74/999077474.db2.gz RRBOGWTTZCZXKK-GOSISDBHSA-N 1 1 369.425 2.889 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)[C@@H](C)C1 ZINC000734401466 999284327 /nfs/dbraw/zinc/28/43/27/999284327.db2.gz HKJJHSHNKWYUTF-SUMWQHHRSA-N 1 1 367.421 2.601 20 5 FFBDMO C[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741017207 999702459 /nfs/dbraw/zinc/70/24/59/999702459.db2.gz MGEWFMGAZZJMTE-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO C[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741017207 999702461 /nfs/dbraw/zinc/70/24/61/999702461.db2.gz MGEWFMGAZZJMTE-FRRDWIJNSA-N 1 1 374.397 2.949 20 5 FFBDMO CC(C)[C@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1CCCC1 ZINC000741017579 999702565 /nfs/dbraw/zinc/70/25/65/999702565.db2.gz OXVJNPWNBOBORP-MRXNPFEDSA-N 1 1 374.397 2.808 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741016725 999702740 /nfs/dbraw/zinc/70/27/40/999702740.db2.gz JYZRDVOVZBXSJR-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO C[C@H](OC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000741016725 999702743 /nfs/dbraw/zinc/70/27/43/999702743.db2.gz JYZRDVOVZBXSJR-CRWXNKLISA-N 1 1 363.414 2.726 20 5 FFBDMO COc1ccc([C@H]2[C@@H](COC(=O)c3cc([N+](=O)[O-])cn3C)CC[N@H+]2C)cc1 ZINC000741120633 999709634 /nfs/dbraw/zinc/70/96/34/999709634.db2.gz JFJQTYCFIOZLFU-KDOFPFPSSA-N 1 1 373.409 2.792 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@H](C[N+](=O)[O-])C4)C3)CC2=O)cc1 ZINC001169030281 1000016115 /nfs/dbraw/zinc/01/61/15/1000016115.db2.gz XWLBPDBIYOJUJE-XKGZKEIXSA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)C1 ZINC001169030393 1000016207 /nfs/dbraw/zinc/01/62/07/1000016207.db2.gz ZKMNCYJJLSMMCP-SFNKJDCFSA-N 1 1 361.442 2.529 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cnn(CC3CC3)c21 ZINC001169018263 1000017311 /nfs/dbraw/zinc/01/73/11/1000017311.db2.gz AJHDBIKSNIBXSZ-SZMVWBNQSA-N 1 1 362.474 2.674 20 5 FFBDMO Cc1ccc(N2C[C@]3(CC[N@H+]([C@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)s1 ZINC001169020115 1000017573 /nfs/dbraw/zinc/01/75/73/1000017573.db2.gz IHYJSKMSQPNCNN-RVKKMQEKSA-N 1 1 363.483 2.931 20 5 FFBDMO Cc1cccc(N2C[C@]3(CC[N@H+]([C@@H]4CC[C@@H](C[N+](=O)[O-])C4)C3)CC2=O)c1 ZINC001169020007 1000017628 /nfs/dbraw/zinc/01/76/28/1000017628.db2.gz HMWCLFIDEQDHFD-MBOZVWFJSA-N 1 1 357.454 2.869 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCC3(CCN(c4ncccn4)CC3)C2)C1 ZINC001169022268 1000017837 /nfs/dbraw/zinc/01/78/37/1000017837.db2.gz RLRKVYGVOWXDKG-IRXDYDNUSA-N 1 1 359.474 2.604 20 5 FFBDMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1 ZINC001169240225 1000033849 /nfs/dbraw/zinc/03/38/49/1000033849.db2.gz RKDUWGKCUNAWTM-MRXNPFEDSA-N 1 1 367.361 2.833 20 5 FFBDMO COC(=O)c1cc(C(=O)OCCCCn2cc[nH+]c2C)cc([N+](=O)[O-])c1 ZINC000769085352 1000432817 /nfs/dbraw/zinc/43/28/17/1000432817.db2.gz VDMPRZMLYCSWIC-UHFFFAOYSA-N 1 1 361.354 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCN([C@@H]3CC[N@@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000770501612 1000802717 /nfs/dbraw/zinc/80/27/17/1000802717.db2.gz RJYNWYPTEBZKJN-OAQYLSRUSA-N 1 1 366.465 2.991 20 5 FFBDMO Cc1[nH+]ccn1CCCOC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000785678877 1001466912 /nfs/dbraw/zinc/46/69/12/1001466912.db2.gz QTRSQOIXQWFCRH-UHFFFAOYSA-N 1 1 355.354 2.533 20 5 FFBDMO COc1ccc(C[N@H+]2CCCN(c3ccc(N)cc3[N+](=O)[O-])CC2)cc1 ZINC000786573488 1001610856 /nfs/dbraw/zinc/61/08/56/1001610856.db2.gz AHEAMWPXKLEPSH-UHFFFAOYSA-N 1 1 356.426 2.898 20 5 FFBDMO Cc1c(CN[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469134 1001807593 /nfs/dbraw/zinc/80/75/93/1001807593.db2.gz NTVGKWYEVUOQEJ-PMACEKPBSA-N 1 1 369.465 2.876 20 5 FFBDMO Cc1c(C[NH2+][C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cccc1[N+](=O)[O-] ZINC000788469134 1001807604 /nfs/dbraw/zinc/80/76/04/1001807604.db2.gz NTVGKWYEVUOQEJ-PMACEKPBSA-N 1 1 369.465 2.876 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)CN2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000791623347 1002748425 /nfs/dbraw/zinc/74/84/25/1002748425.db2.gz TVWBGHFXGLMKHU-ZVDOUQERSA-N 1 1 367.449 2.692 20 5 FFBDMO COc1ccc(C[C@H](C)[NH2+]Cc2nccc(OC(C)C)n2)c([N+](=O)[O-])c1 ZINC001170328671 1003115118 /nfs/dbraw/zinc/11/51/18/1003115118.db2.gz LDZHUSOSMZFLTJ-ZDUSSCGKSA-N 1 1 360.414 2.901 20 5 FFBDMO COC(=O)[C@H]1C[C@H]2C[C@@H](C1)[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170353112 1003121827 /nfs/dbraw/zinc/12/18/27/1003121827.db2.gz VXFZRYKWLWLLJO-VRKREXBASA-N 1 1 362.426 2.808 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCc3cnc(OC)cc3C2)c([N+](=O)[O-])c1 ZINC001170356075 1003122971 /nfs/dbraw/zinc/12/29/71/1003122971.db2.gz WFQQJNSFWKIRMM-ZDUSSCGKSA-N 1 1 357.410 2.996 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](Oc3nccnc3C)C2)c([N+](=O)[O-])c1 ZINC001170354837 1003123272 /nfs/dbraw/zinc/12/32/72/1003123272.db2.gz QBKAVSZTJNUSBE-SUMWQHHRSA-N 1 1 372.425 2.786 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341989 1003130088 /nfs/dbraw/zinc/13/00/88/1003130088.db2.gz LHANOAOVCCIOQZ-LSDHHAIUSA-N 1 1 374.441 2.509 20 5 FFBDMO COC[C@H]1Cn2nccc2C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170341989 1003130091 /nfs/dbraw/zinc/13/00/91/1003130091.db2.gz LHANOAOVCCIOQZ-LSDHHAIUSA-N 1 1 374.441 2.509 20 5 FFBDMO CCCNC(=O)[C@H]1CCCC[N@@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344664 1003132233 /nfs/dbraw/zinc/13/22/33/1003132233.db2.gz DUFBDLXZKYZBTR-RHSMWYFYSA-N 1 1 363.458 2.915 20 5 FFBDMO CCCNC(=O)[C@H]1CCCC[N@H+]1[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170344664 1003132238 /nfs/dbraw/zinc/13/22/38/1003132238.db2.gz DUFBDLXZKYZBTR-RHSMWYFYSA-N 1 1 363.458 2.915 20 5 FFBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](CC(N)=O)c1ccccc1 ZINC000792881396 1003217946 /nfs/dbraw/zinc/21/79/46/1003217946.db2.gz MCEQVCDTOYXFLN-HNNXBMFYSA-N 1 1 358.354 2.552 20 5 FFBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](CC(N)=O)c1ccccc1 ZINC000792881396 1003217952 /nfs/dbraw/zinc/21/79/52/1003217952.db2.gz MCEQVCDTOYXFLN-HNNXBMFYSA-N 1 1 358.354 2.552 20 5 FFBDMO C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)cc1F ZINC001196692792 1003934681 /nfs/dbraw/zinc/93/46/81/1003934681.db2.gz DTSWWNWFTXZNHY-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Br)cc1F ZINC001196692792 1003934688 /nfs/dbraw/zinc/93/46/88/1003934688.db2.gz DTSWWNWFTXZNHY-UHFFFAOYSA-N 1 1 357.183 2.825 20 5 FFBDMO CCCNC(=O)OC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000805774393 1004127464 /nfs/dbraw/zinc/12/74/64/1004127464.db2.gz JECKRNZVVVGLFU-OAHLLOKOSA-N 1 1 365.430 2.964 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](CO)c2ccccc2C)c([N+](=O)[O-])c1 ZINC001197819256 1004386747 /nfs/dbraw/zinc/38/67/47/1004386747.db2.gz ZQZVWNUQJNSOSF-GOSISDBHSA-N 1 1 360.410 2.956 20 5 FFBDMO C[C@@]1(CO)CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001193211408 1004404933 /nfs/dbraw/zinc/40/49/33/1004404933.db2.gz VTCQAVDCPFPLQR-HNNXBMFYSA-N 1 1 352.778 2.645 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000808273055 1004794905 /nfs/dbraw/zinc/79/49/05/1004794905.db2.gz VWAHLBZLTBAVRK-RMKNXTFCSA-N 1 1 368.437 2.984 20 5 FFBDMO Cc1cc(C[N@@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001490372924 1005701441 /nfs/dbraw/zinc/70/14/41/1005701441.db2.gz YBMFTXDZVWKXBK-HZPDHXFCSA-N 1 1 351.472 2.501 20 5 FFBDMO Cc1cc(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001490372924 1005701442 /nfs/dbraw/zinc/70/14/42/1005701442.db2.gz YBMFTXDZVWKXBK-HZPDHXFCSA-N 1 1 351.472 2.501 20 5 FFBDMO Cc1cc(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001490372924 1005701443 /nfs/dbraw/zinc/70/14/43/1005701443.db2.gz YBMFTXDZVWKXBK-HZPDHXFCSA-N 1 1 351.472 2.501 20 5 FFBDMO C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000110349684 1005931159 /nfs/dbraw/zinc/93/11/59/1005931159.db2.gz IPZGDPYAGZHPIJ-ZDUSSCGKSA-N 1 1 372.381 2.753 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1ccccn1)[C@H]1CC[C@H](O)CC1 ZINC000852204639 1005950736 /nfs/dbraw/zinc/95/07/36/1005950736.db2.gz QBDSIBDMHSTQQR-MBOZVWFJSA-N 1 1 371.437 2.829 20 5 FFBDMO CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000776574160 1005952838 /nfs/dbraw/zinc/95/28/38/1005952838.db2.gz DPWFYMLVCMFYSK-IAGOWNOFSA-N 1 1 358.394 2.790 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776583026 1005954431 /nfs/dbraw/zinc/95/44/31/1005954431.db2.gz YQCPWEIBFLBEKX-DNVCBOLYSA-N 1 1 372.421 2.940 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776580742 1005962132 /nfs/dbraw/zinc/96/21/32/1005962132.db2.gz ZHVKUBLQBCEJRC-YXJHDRRASA-N 1 1 363.458 2.645 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776582264 1005963037 /nfs/dbraw/zinc/96/30/37/1005963037.db2.gz NPGYJZFWJWALEB-PBHICJAKSA-N 1 1 363.458 2.503 20 5 FFBDMO C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC(C)(C)NC(=O)OC(C)(C)C ZINC000852306406 1005969724 /nfs/dbraw/zinc/96/97/24/1005969724.db2.gz DQDOSASPDLHYCE-HNNXBMFYSA-N 1 1 367.446 2.863 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](CCc2ccccc2)[C@H]2CCOC2)cc1 ZINC000776590372 1006001919 /nfs/dbraw/zinc/00/19/19/1006001919.db2.gz DBYIJSHMEOJQNN-VQTJNVASSA-N 1 1 356.422 2.962 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000852496924 1006054200 /nfs/dbraw/zinc/05/42/00/1006054200.db2.gz SKSKMGHBXRSDAI-BDXSIMOUSA-N 1 1 362.426 2.682 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(N2CCOC2=O)CC1 ZINC000852722930 1006158254 /nfs/dbraw/zinc/15/82/54/1006158254.db2.gz LIURDGFPYQFRQC-UHFFFAOYSA-N 1 1 363.414 2.799 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](Cc1ccc(C3CC3)cc1)CC2 ZINC001050516731 1017036015 /nfs/dbraw/zinc/03/60/15/1017036015.db2.gz IFLBSRSVKVXBNB-RTBURBONSA-N 1 1 369.465 2.654 20 5 FFBDMO O=[N+]([O-])c1cn(CN2CCC[N@H+](C3CCCC3)CC2)nc1-c1ccccn1 ZINC000853498903 1006415541 /nfs/dbraw/zinc/41/55/41/1006415541.db2.gz QZVHUQIDDMLQLI-UHFFFAOYSA-N 1 1 370.457 2.761 20 5 FFBDMO CCC(=O)c1ccc(N2CCC([N@@H+]3CCOC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000882540529 1006426218 /nfs/dbraw/zinc/42/62/18/1006426218.db2.gz RRHIEOLOVLUTIF-CQSZACIVSA-N 1 1 361.442 2.877 20 5 FFBDMO CCC(=O)c1ccc(N2CCC([N@H+]3CCOC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000882540529 1006426225 /nfs/dbraw/zinc/42/62/25/1006426225.db2.gz RRHIEOLOVLUTIF-CQSZACIVSA-N 1 1 361.442 2.877 20 5 FFBDMO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001116170391 1032168660 /nfs/dbraw/zinc/16/86/60/1032168660.db2.gz CTUKHNJOQNAKRX-OAHLLOKOSA-N 1 1 366.414 2.790 20 5 FFBDMO CCC[N@H+]1CCCC[C@@H]1C(=O)OCCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001116170391 1032168667 /nfs/dbraw/zinc/16/86/67/1032168667.db2.gz CTUKHNJOQNAKRX-OAHLLOKOSA-N 1 1 366.414 2.790 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC([N@@H+]2CCOC[C@H]2C)CC1 ZINC000854570038 1006896684 /nfs/dbraw/zinc/89/66/84/1006896684.db2.gz NTYOQVBTRSYOHI-QJPKHSJYSA-N 1 1 373.453 2.710 20 5 FFBDMO CO[C@@H]1CCC[C@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092417 1006898320 /nfs/dbraw/zinc/89/83/20/1006898320.db2.gz CMNAMOMJJJFGRZ-JQHSSLGASA-N 1 1 362.426 2.918 20 5 FFBDMO CO[C@@H]1CCC[C@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000816092417 1006898328 /nfs/dbraw/zinc/89/83/28/1006898328.db2.gz CMNAMOMJJJFGRZ-JQHSSLGASA-N 1 1 362.426 2.918 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)NCC[NH+]3CC=CC3)cc2[N+](=O)[O-])C1 ZINC001116195177 1032184617 /nfs/dbraw/zinc/18/46/17/1032184617.db2.gz FCHFEDCSBUTGDD-IYBDPMFKSA-N 1 1 372.469 2.679 20 5 FFBDMO O=Cc1cc([N+](=O)[O-])ccc1OCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000817378566 1007571268 /nfs/dbraw/zinc/57/12/68/1007571268.db2.gz ZABVLKJWDCLLEC-UHFFFAOYSA-N 1 1 356.378 2.819 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ccc([N+](=O)[O-])cn3)C2)ccn1 ZINC000856535886 1007874447 /nfs/dbraw/zinc/87/44/47/1007874447.db2.gz IUDJICZNFXRQFJ-GOSISDBHSA-N 1 1 371.441 2.883 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000819016290 1008024424 /nfs/dbraw/zinc/02/44/24/1008024424.db2.gz WUNFZMFPRUVYMT-GHTZIAJQSA-N 1 1 369.465 2.782 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1 ZINC000819016290 1008024429 /nfs/dbraw/zinc/02/44/29/1008024429.db2.gz WUNFZMFPRUVYMT-GHTZIAJQSA-N 1 1 369.465 2.782 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001136379079 1008377568 /nfs/dbraw/zinc/37/75/68/1008377568.db2.gz UHAYSLSXGLAFTE-GRYCIOLGSA-N 1 1 368.865 2.927 20 5 FFBDMO COc1cccc([C@@H](O)C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC000886302043 1008628435 /nfs/dbraw/zinc/62/84/35/1008628435.db2.gz DASYINVBQPBFQO-SFHVURJKSA-N 1 1 357.410 2.944 20 5 FFBDMO CCc1ccc(CC[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001178464475 1008998828 /nfs/dbraw/zinc/99/88/28/1008998828.db2.gz SUDVXKJAWYZSRN-RTBURBONSA-N 1 1 361.486 2.723 20 5 FFBDMO O=C(NCCCCCC[NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464193 1008998872 /nfs/dbraw/zinc/99/88/72/1008998872.db2.gz PQYQQFXEQLRDMP-HUUCEWRRSA-N 1 1 361.433 2.743 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(C(=O)c2cc([N+](=O)[O-])cc3ccccc32)CC1 ZINC000860444533 1009006143 /nfs/dbraw/zinc/00/61/43/1009006143.db2.gz BONUIQOCCAVKRU-UHFFFAOYSA-N 1 1 371.437 2.667 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823600172 1009136574 /nfs/dbraw/zinc/13/65/74/1009136574.db2.gz YWFHAFFTZCPFKK-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823600172 1009136579 /nfs/dbraw/zinc/13/65/79/1009136579.db2.gz YWFHAFFTZCPFKK-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H]1Cc2cc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)ccc2O1 ZINC001179937395 1009497100 /nfs/dbraw/zinc/49/71/00/1009497100.db2.gz LWLWOWHNJGRQDE-BBRMVZONSA-N 1 1 354.410 3.000 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000862631964 1009910253 /nfs/dbraw/zinc/91/02/53/1009910253.db2.gz ZFNXANRXJZCWKU-CQSZACIVSA-N 1 1 362.386 2.640 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000862790208 1009976334 /nfs/dbraw/zinc/97/63/34/1009976334.db2.gz QKHABBMTAGZLAD-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000119385905 1010157205 /nfs/dbraw/zinc/15/72/05/1010157205.db2.gz KNOOFJRZXXHOIE-INIZCTEOSA-N 1 1 374.485 2.903 20 5 FFBDMO Cc1cc(F)cc(C(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)c1[N+](=O)[O-] ZINC000794562716 1010335517 /nfs/dbraw/zinc/33/55/17/1010335517.db2.gz ADWQKRIHKHBTHG-INIZCTEOSA-N 1 1 373.384 2.861 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@@H](O)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000866639858 1011028927 /nfs/dbraw/zinc/02/89/27/1011028927.db2.gz XWCVKPILKYKLAX-QZTJIDSGSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@@]([NH3+])(C(=O)N1CCCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000867958008 1011131798 /nfs/dbraw/zinc/13/17/98/1011131798.db2.gz FRYNQVJPZYXCEZ-FQEVSTJZSA-N 1 1 368.437 2.508 20 5 FFBDMO C[C@@H]1CC[C@@H](O)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009342 1012179119 /nfs/dbraw/zinc/17/91/19/1012179119.db2.gz BHMYZMMKPVGYHF-BXUZGUMPSA-N 1 1 355.385 2.687 20 5 FFBDMO C[C@@H]1CC[C@@H](CO)C[N@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009335 1012179594 /nfs/dbraw/zinc/17/95/94/1012179594.db2.gz BHHSUEARBCVSLM-CHWSQXEVSA-N 1 1 369.412 2.935 20 5 FFBDMO CO[C@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1F ZINC001173010722 1012181923 /nfs/dbraw/zinc/18/19/23/1012181923.db2.gz YATDBPJFMRJZII-GJZGRUSLSA-N 1 1 359.348 2.511 20 5 FFBDMO CO[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@@H]1F ZINC001173010724 1012182330 /nfs/dbraw/zinc/18/23/30/1012182330.db2.gz YATDBPJFMRJZII-LSDHHAIUSA-N 1 1 359.348 2.511 20 5 FFBDMO C[N@@H+](Cc1cnccn1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018369 1012190213 /nfs/dbraw/zinc/19/02/13/1012190213.db2.gz SAEBQAZNQYXCAW-UHFFFAOYSA-N 1 1 363.368 2.764 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3C)CC[NH2+]2)cc1 ZINC000870143682 1012195531 /nfs/dbraw/zinc/19/55/31/1012195531.db2.gz WOVAUZSRBYIIBU-GOSISDBHSA-N 1 1 369.421 2.627 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+](C)C2CCN(C(C)=O)CC2)c1F ZINC001173188107 1012329226 /nfs/dbraw/zinc/32/92/26/1012329226.db2.gz CMUOAYXHGDKBLT-LBPRGKRZSA-N 1 1 367.421 2.616 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173185909 1012330174 /nfs/dbraw/zinc/33/01/74/1012330174.db2.gz QAQJIZYDRHVNLA-NEPJUHHUSA-N 1 1 354.378 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1F ZINC001173192459 1012335972 /nfs/dbraw/zinc/33/59/72/1012335972.db2.gz LDFMQNNHLZSCTN-UGSOOPFHSA-N 1 1 351.422 2.701 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@]3(CCC(=O)O3)C2)c1F ZINC001173194137 1012338916 /nfs/dbraw/zinc/33/89/16/1012338916.db2.gz XSYAXCPQRMLIOF-XIKOKIGWSA-N 1 1 366.389 2.845 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000870667156 1012519398 /nfs/dbraw/zinc/51/93/98/1012519398.db2.gz TYOWRCOHUWZFMZ-ZBFHGGJFSA-N 1 1 372.425 2.736 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CCC1(C)C ZINC000871150570 1012750279 /nfs/dbraw/zinc/75/02/79/1012750279.db2.gz PJPWFLRJWATFEX-UHFFFAOYSA-N 1 1 360.458 2.751 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173697729 1012903079 /nfs/dbraw/zinc/90/30/79/1012903079.db2.gz WHOSVEOZSWQMDW-AWEZNQCLSA-N 1 1 367.471 2.622 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000801580569 1019137452 /nfs/dbraw/zinc/13/74/52/1019137452.db2.gz MZRAKPHZTQPLOD-VQTJNVASSA-N 1 1 356.422 2.654 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@H+](CC[N+](=O)[O-])Cc2ccccn2)CC1 ZINC000930805152 1020194067 /nfs/dbraw/zinc/19/40/67/1020194067.db2.gz CTQJKFIDEASIBU-UHFFFAOYSA-N 1 1 364.446 2.560 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC([N@@H+](CC[N+](=O)[O-])Cc2ccccn2)CC1 ZINC000930805152 1020194072 /nfs/dbraw/zinc/19/40/72/1020194072.db2.gz CTQJKFIDEASIBU-UHFFFAOYSA-N 1 1 364.446 2.560 20 5 FFBDMO Cc1cccc(C[NH2+]C[C@H]2CC[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001048607488 1020349974 /nfs/dbraw/zinc/34/99/74/1020349974.db2.gz DWAXJYFKUAYHCT-PSBWJHGTSA-N 1 1 359.470 2.672 20 5 FFBDMO O=C(NC[C@H]1CC[C@H](C[NH2+]Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001048607885 1020351544 /nfs/dbraw/zinc/35/15/44/1020351544.db2.gz QBYVQBVMFHGLCP-GZOSKZMVSA-N 1 1 363.433 2.503 20 5 FFBDMO O=C(CC[N@H+]1CCC[C@H]1[C@@H]1CCCOC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000828904062 1032898909 /nfs/dbraw/zinc/89/89/09/1032898909.db2.gz BFBSPVSJLMVKIF-DYVFJYSZSA-N 1 1 365.405 2.954 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)cc1 ZINC000931906279 1020628205 /nfs/dbraw/zinc/62/82/05/1020628205.db2.gz RTPVPQGQDUJYQJ-RLLQIKCJSA-N 1 1 354.406 2.528 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC000932192447 1020738284 /nfs/dbraw/zinc/73/82/84/1020738284.db2.gz XFJSELWAQURLBF-ZDUSSCGKSA-N 1 1 374.466 2.581 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C2CCOCC2)C1 ZINC000933079998 1020954007 /nfs/dbraw/zinc/95/40/07/1020954007.db2.gz RHYZPNCPUGVEAO-INIZCTEOSA-N 1 1 361.442 2.980 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000749598921 1021012159 /nfs/dbraw/zinc/01/21/59/1021012159.db2.gz MKUFGURELPZJQY-HNNXBMFYSA-N 1 1 360.458 2.655 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000749602423 1021012360 /nfs/dbraw/zinc/01/23/60/1021012360.db2.gz OUGYYZPQKGIARM-KRWDZBQOSA-N 1 1 373.457 2.715 20 5 FFBDMO C[N@@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001116380603 1021188325 /nfs/dbraw/zinc/18/83/25/1021188325.db2.gz ONZBGCFZZDQQRZ-IEBWSBKVSA-N 1 1 373.384 2.674 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(F)cc1 ZINC001116380603 1021188330 /nfs/dbraw/zinc/18/83/30/1021188330.db2.gz ONZBGCFZZDQQRZ-IEBWSBKVSA-N 1 1 373.384 2.674 20 5 FFBDMO Cc1cc(N2CCC(Nc3ccc([N+](=O)[O-])c4nonc43)CC2)nc(C)[nH+]1 ZINC000750030681 1021246096 /nfs/dbraw/zinc/24/60/96/1021246096.db2.gz VEYBIBMFDVBNGS-UHFFFAOYSA-N 1 1 369.385 2.619 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC000934838190 1021421920 /nfs/dbraw/zinc/42/19/20/1021421920.db2.gz IZMORKOSZXDOPO-CVEARBPZSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc(NCCNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)[nH+]1 ZINC000750172247 1021468495 /nfs/dbraw/zinc/46/84/95/1021468495.db2.gz XDTSMZGVXPIKEG-UHFFFAOYSA-N 1 1 355.398 2.714 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)c1 ZINC000156033373 1022317030 /nfs/dbraw/zinc/31/70/30/1022317030.db2.gz LVMMOPYPBKELBB-VQTJNVASSA-N 1 1 356.422 2.901 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001119387011 1022731408 /nfs/dbraw/zinc/73/14/08/1022731408.db2.gz ZXXAZTLBTWBSLJ-CYBMUJFWSA-N 1 1 350.394 2.977 20 5 FFBDMO CN1CC[NH+](Cc2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)CC1 ZINC000751085031 1022754386 /nfs/dbraw/zinc/75/43/86/1022754386.db2.gz SCASTCMNFLJYKL-UHFFFAOYSA-N 1 1 372.400 2.734 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@]1(O)CCc2ccccc21 ZINC000829377752 1033128045 /nfs/dbraw/zinc/12/80/45/1033128045.db2.gz VGLSPSISFRMYEL-LJQANCHMSA-N 1 1 352.394 2.737 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001123268821 1023715915 /nfs/dbraw/zinc/71/59/15/1023715915.db2.gz UIQDHYDADBXENI-SWLSCSKDSA-N 1 1 350.419 2.797 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@@H]2CCC[N@@H+]2C)n1C ZINC001121374996 1023736745 /nfs/dbraw/zinc/73/67/45/1023736745.db2.gz KGBQVCOJRYADSF-INIZCTEOSA-N 1 1 358.446 2.905 20 5 FFBDMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)c1nnc([C@@H]2CCC[N@H+]2C)n1C ZINC001121374996 1023736751 /nfs/dbraw/zinc/73/67/51/1023736751.db2.gz KGBQVCOJRYADSF-INIZCTEOSA-N 1 1 358.446 2.905 20 5 FFBDMO Cc1ccnc(C2CC[NH+](Cn3ncc4cc([N+](=O)[O-])ccc43)CC2)n1 ZINC000758267329 1024008075 /nfs/dbraw/zinc/00/80/75/1024008075.db2.gz XXWSHHXITIFVGA-UHFFFAOYSA-N 1 1 352.398 2.880 20 5 FFBDMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)O[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000837574283 1025908703 /nfs/dbraw/zinc/90/87/03/1025908703.db2.gz XVPCXRVWWKBEMP-ZDUSSCGKSA-N 1 1 359.357 2.747 20 5 FFBDMO COc1cc(N)c([N+](=O)[O-])cc1C(=O)O[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000837667669 1025954100 /nfs/dbraw/zinc/95/41/00/1025954100.db2.gz ZLRHCAGEDHFLJK-AWEZNQCLSA-N 1 1 371.393 2.617 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@](C(N)=O)(c2ccccc2)C1 ZINC000839643361 1026772168 /nfs/dbraw/zinc/77/21/68/1026772168.db2.gz RQPYJQFDBLNXDC-HXUWFJFHSA-N 1 1 369.421 2.623 20 5 FFBDMO O=[N+]([O-])c1ccc(N(CCC[NH+]2CCOCC2)Cc2ccncc2)cc1 ZINC000091503785 1026817658 /nfs/dbraw/zinc/81/76/58/1026817658.db2.gz JATVFHSCFQZEMO-UHFFFAOYSA-N 1 1 356.426 2.719 20 5 FFBDMO C[C@@]12C[N@@H+](Cn3cnc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]1[C@@H]1C=C[C@H]2C1 ZINC000840118174 1026965096 /nfs/dbraw/zinc/96/50/96/1026965096.db2.gz YCKVLLQQJAOVRS-UJNZZBMASA-N 1 1 351.410 2.955 20 5 FFBDMO Cc1c(C(=O)OCC[C@@H]2CCCC[N@@H+]2C)nnn1-c1cccc([N+](=O)[O-])c1 ZINC000840231143 1027013491 /nfs/dbraw/zinc/01/34/91/1027013491.db2.gz ZBGVVWRCCCKGIG-AWEZNQCLSA-N 1 1 373.413 2.515 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[NH+](Cc3cccc4cccnc43)CC2)c(F)c1 ZINC000840242159 1027016485 /nfs/dbraw/zinc/01/64/85/1027016485.db2.gz WZLJBNSONICZTB-UHFFFAOYSA-N 1 1 367.384 2.999 20 5 FFBDMO CCCCOC(=O)[C@@H]1CCN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1 ZINC001158537626 1027055075 /nfs/dbraw/zinc/05/50/75/1027055075.db2.gz AWITYYBMSSRORD-PMGBHYCQSA-N 1 1 362.430 2.692 20 5 FFBDMO C[N@@H+](C1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1)[C@H]1CCOC1 ZINC001158734312 1027116335 /nfs/dbraw/zinc/11/63/35/1027116335.db2.gz CGMRWQVHEMHUNI-HNNXBMFYSA-N 1 1 354.410 2.566 20 5 FFBDMO C[NH+](C)/C=C/c1cc(NC2CCN(CC(F)(F)F)CC2)ncc1[N+](=O)[O-] ZINC001159390678 1027375755 /nfs/dbraw/zinc/37/57/55/1027375755.db2.gz ZKLAASIBYNPITH-ZZXKWVIFSA-N 1 1 373.379 2.961 20 5 FFBDMO COc1nc(C)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2Cc2ccccc2)n1 ZINC001161885415 1028350503 /nfs/dbraw/zinc/35/05/03/1028350503.db2.gz NOOHDCFPVHKODV-HNNXBMFYSA-N 1 1 357.414 2.778 20 5 FFBDMO CO[C@H](C[NH+]1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)c1ccccc1 ZINC001155706201 1028860848 /nfs/dbraw/zinc/86/08/48/1028860848.db2.gz NKKGXNFSIKKPDO-QGZVFWFLSA-N 1 1 356.426 2.808 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@@H+](C)C(C)(C)CC1 ZINC001163826678 1029076273 /nfs/dbraw/zinc/07/62/73/1029076273.db2.gz XEJOMGLKNFITBT-UHFFFAOYSA-N 1 1 355.822 2.955 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])c1 ZINC001163831722 1029083193 /nfs/dbraw/zinc/08/31/93/1029083193.db2.gz UHTGSUHTAPTLSX-QGZVFWFLSA-N 1 1 368.437 2.949 20 5 FFBDMO Cc1cc(N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001164378883 1029268118 /nfs/dbraw/zinc/26/81/18/1029268118.db2.gz DAEFHPVTASFRST-DJIMGWMZSA-N 1 1 353.426 2.534 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cnc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC001165107416 1029394780 /nfs/dbraw/zinc/39/47/80/1029394780.db2.gz GPMGPWBUDOXIOM-INIZCTEOSA-N 1 1 371.441 2.618 20 5 FFBDMO C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000888092493 1029618712 /nfs/dbraw/zinc/61/87/12/1029618712.db2.gz XFOCXZYYRGKCKJ-SJKOYZFVSA-N 1 1 366.801 2.826 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001142221307 1030181319 /nfs/dbraw/zinc/18/13/19/1030181319.db2.gz AFWKWANNAOEVMQ-KGLIPLIRSA-N 1 1 351.422 2.903 20 5 FFBDMO COC(=O)c1cccc2c1CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C2 ZINC001166757979 1030508562 /nfs/dbraw/zinc/50/85/62/1030508562.db2.gz NZFQHIULUDQRKL-BQYQJAHWSA-N 1 1 368.393 2.829 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)nc1-c1ccncc1 ZINC000842620350 1030835277 /nfs/dbraw/zinc/83/52/77/1030835277.db2.gz ZZKCNXDMRPBSTA-HZPDHXFCSA-N 1 1 357.414 2.702 20 5 FFBDMO C[C@@]1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000799014538 1031613674 /nfs/dbraw/zinc/61/36/74/1031613674.db2.gz IFUCXYUREGTXDC-FQEVSTJZSA-N 1 1 369.421 2.942 20 5 FFBDMO C[C@@]1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](Cc2ccccc2)C1 ZINC000799014538 1031613685 /nfs/dbraw/zinc/61/36/85/1031613685.db2.gz IFUCXYUREGTXDC-FQEVSTJZSA-N 1 1 369.421 2.942 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195197 1031690150 /nfs/dbraw/zinc/69/01/50/1031690150.db2.gz WRJASIOZGTZHPS-UONOGXRCSA-N 1 1 370.409 2.815 20 5 FFBDMO COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799195197 1031690160 /nfs/dbraw/zinc/69/01/60/1031690160.db2.gz WRJASIOZGTZHPS-UONOGXRCSA-N 1 1 370.409 2.815 20 5 FFBDMO Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1F ZINC001115530848 1031788519 /nfs/dbraw/zinc/78/85/19/1031788519.db2.gz VBHZRWRJMXSWKV-NVXWUHKLSA-N 1 1 363.433 2.708 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](OC[C@@H]1C[N@H+](Cc3ccccc3)CCO1)C2 ZINC001224955246 1034070465 /nfs/dbraw/zinc/07/04/65/1034070465.db2.gz FCNBIQMFSKQQMG-SFTDATJTSA-N 1 1 368.433 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H](OC[C@@H]1C[N@@H+](Cc3ccccc3)CCO1)C2 ZINC001224955246 1034070477 /nfs/dbraw/zinc/07/04/77/1034070477.db2.gz FCNBIQMFSKQQMG-SFTDATJTSA-N 1 1 368.433 2.980 20 5 FFBDMO O=c1cc[nH]c(O[C@@H]2CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]23)c1[N+](=O)[O-] ZINC001225664525 1034360172 /nfs/dbraw/zinc/36/01/72/1034360172.db2.gz QCENFWHHGIUHTC-BFYDXBDKSA-N 1 1 355.394 2.985 20 5 FFBDMO Cc1ccc(CNC(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC001221093088 1034542930 /nfs/dbraw/zinc/54/29/30/1034542930.db2.gz PCAYTMYQTPBSFS-GOSISDBHSA-N 1 1 368.437 2.977 20 5 FFBDMO CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cc([N+](=O)[O-])c(F)cc3Cl)C[C@H]1[N@H+]2C ZINC001226198574 1034568291 /nfs/dbraw/zinc/56/82/91/1034568291.db2.gz NOPMRGGQWBZFGU-SUJZYYJXSA-N 1 1 372.780 2.933 20 5 FFBDMO Cc1ccc(N2CCC[C@H](Oc3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C2)[nH+]c1 ZINC001227111949 1034939192 /nfs/dbraw/zinc/93/91/92/1034939192.db2.gz UMDWHEUKSATYCU-ZDUSSCGKSA-N 1 1 359.342 2.649 20 5 FFBDMO CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c4cccnc34)C[C@H]1[N@H+]2C ZINC001228139637 1035955478 /nfs/dbraw/zinc/95/54/78/1035955478.db2.gz VMNULGNOWHDGGO-HINSOXJESA-N 1 1 371.393 2.689 20 5 FFBDMO O=[N+]([O-])c1c[n+]([O-])ccc1O[C@H]1[C@@H]2CC[C@H]1C[N@H+](Cc1ccccc1)C2 ZINC001229451088 1036682252 /nfs/dbraw/zinc/68/22/52/1036682252.db2.gz BOXYQPNJVDUURE-MNZLEMJZSA-N 1 1 355.394 2.518 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2cccc(I)c2[N+](=O)[O-])C1 ZINC001229656609 1036807320 /nfs/dbraw/zinc/80/73/20/1036807320.db2.gz KBTFRFSZEQHOMX-SECBINFHSA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@@H+]1CC[C@H](Oc2cc([N+](=O)[O-])ccc2I)C1 ZINC001229836428 1036927405 /nfs/dbraw/zinc/92/74/05/1036927405.db2.gz UVPVJFODNGZNGA-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO CC[N@H+]1CC[C@H](Oc2cc([N+](=O)[O-])ccc2I)C1 ZINC001229836428 1036927419 /nfs/dbraw/zinc/92/74/19/1036927419.db2.gz UVPVJFODNGZNGA-JTQLQIEISA-N 1 1 362.167 2.672 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](Oc2cc(O)cc3oc4c(O)ccc(O)c4c(=O)c23)C1 ZINC001234125853 1036931829 /nfs/dbraw/zinc/93/18/29/1036931829.db2.gz YWHJTYOPJYQETG-LBPRGKRZSA-N 1 1 371.389 2.925 20 5 FFBDMO Cc1cc(O)c([N+](=O)[O-])c(OC[C@H]2C[N@H+](Cc3ccccc3)CCCO2)n1 ZINC001231265156 1037518224 /nfs/dbraw/zinc/51/82/24/1037518224.db2.gz ZFRCWTQHASFIRD-MRXNPFEDSA-N 1 1 373.409 2.674 20 5 FFBDMO Cc1cc(O)c([N+](=O)[O-])c(OC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1 ZINC001231265156 1037518228 /nfs/dbraw/zinc/51/82/28/1037518228.db2.gz ZFRCWTQHASFIRD-MRXNPFEDSA-N 1 1 373.409 2.674 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCN1 ZINC001235754832 1037724344 /nfs/dbraw/zinc/72/43/44/1037724344.db2.gz TUHUNYMUEQCBPZ-SFHVURJKSA-N 1 1 353.853 2.906 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@H](N(C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256098681 1038382824 /nfs/dbraw/zinc/38/28/24/1038382824.db2.gz CMDJAILBWKANLK-KRWDZBQOSA-N 1 1 362.474 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@H]([NH+](C)C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256098681 1038382836 /nfs/dbraw/zinc/38/28/36/1038382836.db2.gz CMDJAILBWKANLK-KRWDZBQOSA-N 1 1 362.474 2.598 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCOCC34CCC4)CC2)ccc1[N+](=O)[O-] ZINC001256100288 1038384546 /nfs/dbraw/zinc/38/45/46/1038384546.db2.gz DFSYYUJGZAEGLU-UHFFFAOYSA-N 1 1 361.442 2.827 20 5 FFBDMO Cc1cc(Cc2nnc(CC[NH+]3C[C@@H](C)O[C@H](C)C3)o2)ccc1[N+](=O)[O-] ZINC001258071884 1039153067 /nfs/dbraw/zinc/15/30/67/1039153067.db2.gz NQLVJIOVHSHRPD-ZIAGYGMSSA-N 1 1 360.414 2.529 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H](C)O1 ZINC001258139704 1039221641 /nfs/dbraw/zinc/22/16/41/1039221641.db2.gz VSHWYACCYSVMQO-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC001258146658 1039227575 /nfs/dbraw/zinc/22/75/75/1039227575.db2.gz QOTPJYNUZDXFJK-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO Cc1nc(N2C[C@@H](C)O[C@@H](C)C2)cc(Nc2ccc(N)c([N+](=O)[O-])c2)[nH+]1 ZINC001209933757 1039295320 /nfs/dbraw/zinc/29/53/20/1039295320.db2.gz CBBCVLUCBHCDLW-PHIMTYICSA-N 1 1 358.402 2.633 20 5 FFBDMO Nc1c2cccnc2c2ncccc2c1Nc1ccnc(N2CC[NH2+]CC2)c1 ZINC001210265403 1039456848 /nfs/dbraw/zinc/45/68/48/1039456848.db2.gz CRRGHBXBCUOLQQ-UHFFFAOYSA-N 1 1 371.448 2.913 20 5 FFBDMO COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247640153 1039854777 /nfs/dbraw/zinc/85/47/77/1039854777.db2.gz LFRDZKXYAIHEMQ-ZDUSSCGKSA-N 1 1 363.377 2.786 20 5 FFBDMO COCc1noc2c1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)CC2 ZINC001254474497 1040740681 /nfs/dbraw/zinc/74/06/81/1040740681.db2.gz JXSOCDDZSIGKQQ-UHFFFAOYSA-N 1 1 372.425 2.756 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553322 1040793666 /nfs/dbraw/zinc/79/36/66/1040793666.db2.gz VAFVKUUTJKZTQE-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553322 1040793684 /nfs/dbraw/zinc/79/36/84/1040793684.db2.gz VAFVKUUTJKZTQE-HOCLYGCPSA-N 1 1 358.442 2.895 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(c2nccc(Cl)n2)CC1 ZINC001254560249 1040797418 /nfs/dbraw/zinc/79/74/18/1040797418.db2.gz QNISRSPTZKHXPL-ZDUSSCGKSA-N 1 1 361.833 2.791 20 5 FFBDMO Cc1cc(N2CC[NH+]([C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)nc(C)n1 ZINC001254562134 1040800336 /nfs/dbraw/zinc/80/03/36/1040800336.db2.gz JUNFOFRCOHXTJF-OAHLLOKOSA-N 1 1 355.442 2.755 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@@H](F)[C@@](O)(C(F)(F)F)CC1)C2 ZINC001254593152 1040822846 /nfs/dbraw/zinc/82/28/46/1040822846.db2.gz JJDFGGVOJIHBJZ-RBSFLKMASA-N 1 1 362.323 2.789 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CC3(C1)CCN(Cc1cccnc1)C3)C2 ZINC001254593917 1040823227 /nfs/dbraw/zinc/82/32/27/1040823227.db2.gz BTHJVZLWVHWAJN-FQEVSTJZSA-N 1 1 364.449 2.665 20 5 FFBDMO CC(C)(C)OC(=O)NC[C@@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001254601377 1040832606 /nfs/dbraw/zinc/83/26/06/1040832606.db2.gz YZEYEOSWEWKRCV-SUMWQHHRSA-N 1 1 361.442 2.909 20 5 FFBDMO O=c1[nH]cc(-c2nnc([C@@H]3CC[N@@H+](Cc4ccccc4)C3)o2)cc1[N+](=O)[O-] ZINC001255450450 1041344678 /nfs/dbraw/zinc/34/46/78/1041344678.db2.gz AWNCRCZFWAUFOR-CYBMUJFWSA-N 1 1 367.365 2.735 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c(F)c1N1CCOCC1 ZINC001262678648 1041789523 /nfs/dbraw/zinc/78/95/23/1041789523.db2.gz IXWLTGOIKHIGFF-HIFRSBDPSA-N 1 1 364.421 2.609 20 5 FFBDMO C[C@@H](c1nnc(N(C)C[C@H]2CCCC[N@H+]2Cc2ccccc2)n1C)[N+](=O)[O-] ZINC001262863737 1041910993 /nfs/dbraw/zinc/91/09/93/1041910993.db2.gz OLBRMCXTUFOWKT-DOTOQJQBSA-N 1 1 372.473 2.644 20 5 FFBDMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001538762447 1070488022 /nfs/dbraw/zinc/48/80/22/1070488022.db2.gz PDRPQQUEMUGYNC-JTQLQIEISA-N 1 1 367.793 2.521 20 5 FFBDMO CCOc1cc(NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OCC ZINC001309999361 1043621299 /nfs/dbraw/zinc/62/12/99/1043621299.db2.gz BIEXEXYXHKCTRY-RYUDHWBXSA-N 1 1 366.418 2.606 20 5 FFBDMO Cc1c(C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)cnn1-c1cc[nH+]cc1 ZINC001321268677 1045608060 /nfs/dbraw/zinc/60/80/60/1045608060.db2.gz PEHURIIYMFRZAL-UHFFFAOYSA-N 1 1 365.393 2.799 20 5 FFBDMO COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cc1[N+](=O)[O-] ZINC001539647564 1070673688 /nfs/dbraw/zinc/67/36/88/1070673688.db2.gz ZMJCEBXXSUAPRA-MRXNPFEDSA-N 1 1 361.442 2.527 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001324255790 1045940181 /nfs/dbraw/zinc/94/01/81/1045940181.db2.gz SMCUEYCIEPYERQ-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]2OCCC[C@H]2C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001324255790 1045940194 /nfs/dbraw/zinc/94/01/94/1045940194.db2.gz SMCUEYCIEPYERQ-NHYWBVRUSA-N 1 1 353.806 2.688 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001323033248 1046315193 /nfs/dbraw/zinc/31/51/93/1046315193.db2.gz LWVKBRHWMOVCFL-GOSISDBHSA-N 1 1 352.394 2.807 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001323033248 1046315204 /nfs/dbraw/zinc/31/52/04/1046315204.db2.gz LWVKBRHWMOVCFL-GOSISDBHSA-N 1 1 352.394 2.807 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c2ccccc21 ZINC001332182426 1048286431 /nfs/dbraw/zinc/28/64/31/1048286431.db2.gz BCKGASKTQUEZOC-HNNXBMFYSA-N 1 1 356.426 2.834 20 5 FFBDMO CCO[C@H]1COCC[C@@H]1[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001334095338 1049246020 /nfs/dbraw/zinc/24/60/20/1049246020.db2.gz XLEOZOZBSQQJKE-JSGCOSHPSA-N 1 1 359.220 2.641 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(NCC[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001307230554 1050137085 /nfs/dbraw/zinc/13/70/85/1050137085.db2.gz WRWXJMSLQFKPAB-UHFFFAOYSA-N 1 1 371.441 2.703 20 5 FFBDMO NC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC001341604387 1050230652 /nfs/dbraw/zinc/23/06/52/1050230652.db2.gz IWLHMWASNJERPN-LLVKDONJSA-N 1 1 364.789 2.751 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)NCc4cccc([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001340622340 1051001888 /nfs/dbraw/zinc/00/18/88/1051001888.db2.gz YBIIFBRMGBPARC-KDURUIRLSA-N 1 1 358.442 2.612 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cc1cccc(F)c1[N+](=O)[O-] ZINC001542262190 1071199131 /nfs/dbraw/zinc/19/91/31/1071199131.db2.gz DBZXEBCSJJZMBW-MJBXVCDLSA-N 1 1 351.422 2.759 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2nc3ccccc3[nH]2)C1 ZINC001341278167 1051635897 /nfs/dbraw/zinc/63/58/97/1051635897.db2.gz VHJXTDTXSBLPDG-CQSZACIVSA-N 1 1 367.409 2.512 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2nc3ccccc3[nH]2)C1 ZINC001341278166 1051636048 /nfs/dbraw/zinc/63/60/48/1051636048.db2.gz VHJXTDTXSBLPDG-AWEZNQCLSA-N 1 1 367.409 2.512 20 5 FFBDMO C[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@@H]1O ZINC001307710067 1052339821 /nfs/dbraw/zinc/33/98/21/1052339821.db2.gz PNWJFUFGUWMLHP-ZANVPECISA-N 1 1 352.778 2.501 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC[C@@H]1O ZINC001307710067 1052339824 /nfs/dbraw/zinc/33/98/24/1052339824.db2.gz PNWJFUFGUWMLHP-ZANVPECISA-N 1 1 352.778 2.501 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1c1ncccn1 ZINC001307947796 1052370454 /nfs/dbraw/zinc/37/04/54/1052370454.db2.gz WCGGEBUTJPSFFV-INIZCTEOSA-N 1 1 355.398 2.859 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ncccn1 ZINC001307947796 1052370456 /nfs/dbraw/zinc/37/04/56/1052370456.db2.gz WCGGEBUTJPSFFV-INIZCTEOSA-N 1 1 355.398 2.859 20 5 FFBDMO CN(C[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1)C(=O)OC(C)(C)C ZINC001308083372 1052402127 /nfs/dbraw/zinc/40/21/27/1052402127.db2.gz HARTTXWOHIECOK-AWEZNQCLSA-N 1 1 367.450 2.513 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO ZINC001346068358 1052731434 /nfs/dbraw/zinc/73/14/34/1052731434.db2.gz MPDVNYXPZIHNJX-OLZOCXBDSA-N 1 1 359.348 2.649 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)C1 ZINC001350442083 1055777052 /nfs/dbraw/zinc/77/70/52/1055777052.db2.gz XMXATXKMMQCCJG-AWEZNQCLSA-N 1 1 366.437 2.714 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3C)n2C)C1 ZINC001338796853 1055824161 /nfs/dbraw/zinc/82/41/61/1055824161.db2.gz GRAOZTROUBEMOY-HNNXBMFYSA-N 1 1 372.473 2.867 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001544705066 1071680204 /nfs/dbraw/zinc/68/02/04/1071680204.db2.gz XDWUFMDGQSWYDV-KRWDZBQOSA-N 1 1 361.442 2.887 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001445038636 1058361359 /nfs/dbraw/zinc/36/13/59/1058361359.db2.gz WJZUQIAZKKVJSJ-INIZCTEOSA-N 1 1 354.410 2.524 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001520250047 1059533798 /nfs/dbraw/zinc/53/37/98/1059533798.db2.gz DNFOXHFRVOKDJG-KDURUIRLSA-N 1 1 374.441 2.943 20 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O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000848481644 1060119554 /nfs/dbraw/zinc/11/95/54/1060119554.db2.gz BBVNPTUNUFXBNZ-LNLFQRSKSA-N 1 1 373.453 2.617 20 5 FFBDMO CCOCCO[C@H]1CC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482840 1060121238 /nfs/dbraw/zinc/12/12/38/1060121238.db2.gz SLXJJFWRTFIGEF-INIZCTEOSA-N 1 1 360.414 2.543 20 5 FFBDMO CCOCCO[C@H]1CC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848482840 1060121245 /nfs/dbraw/zinc/12/12/45/1060121245.db2.gz SLXJJFWRTFIGEF-INIZCTEOSA-N 1 1 360.414 2.543 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000848485260 1060125809 /nfs/dbraw/zinc/12/58/09/1060125809.db2.gz XFTNUYWYGQKLCP-MOPGFXCFSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H](OCC2CC2)C1 ZINC000848485260 1060125821 /nfs/dbraw/zinc/12/58/21/1060125821.db2.gz XFTNUYWYGQKLCP-MOPGFXCFSA-N 1 1 373.453 2.759 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C12CCC2 ZINC000848489260 1060140418 /nfs/dbraw/zinc/14/04/18/1060140418.db2.gz RQIRPALYOGGQPJ-KZNAEPCWSA-N 1 1 373.453 2.758 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000848591731 1060324382 /nfs/dbraw/zinc/32/43/82/1060324382.db2.gz XILPTXBHYHAMAU-INIZCTEOSA-N 1 1 369.368 2.511 20 5 FFBDMO CC(C)(C)OC[C@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001460746152 1061086111 /nfs/dbraw/zinc/08/61/11/1061086111.db2.gz GDFODFATLSIQEH-MRXNPFEDSA-N 1 1 361.442 2.763 20 5 FFBDMO CC(C)(C)OC[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC001460746152 1061086120 /nfs/dbraw/zinc/08/61/20/1061086120.db2.gz GDFODFATLSIQEH-MRXNPFEDSA-N 1 1 361.442 2.763 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1C[C@H]2COC[C@@]2(c2ccccc2)C1 ZINC001460747401 1061087626 /nfs/dbraw/zinc/08/76/26/1061087626.db2.gz HIGYCEOPBMGTOS-FXAWDEMLSA-N 1 1 354.406 2.874 20 5 FFBDMO CCc1nnc(N(C)Cc2ccccc2[N+](=O)[O-])n1C[C@@H]1CC[N@H+](CC)C1 ZINC001546421462 1061119282 /nfs/dbraw/zinc/11/92/82/1061119282.db2.gz GQOVFKFOXIWXBA-OAHLLOKOSA-N 1 1 372.473 2.727 20 5 FFBDMO Cn1c(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc2ccccc21 ZINC001461927886 1061453250 /nfs/dbraw/zinc/45/32/50/1061453250.db2.gz NDIWIELJFHVIRD-UHFFFAOYSA-N 1 1 351.410 2.804 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001462256096 1061558341 /nfs/dbraw/zinc/55/83/41/1061558341.db2.gz CATGIWBYDKTURJ-LJQANCHMSA-N 1 1 369.421 2.534 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC001462256096 1061558358 /nfs/dbraw/zinc/55/83/58/1061558358.db2.gz CATGIWBYDKTURJ-LJQANCHMSA-N 1 1 369.421 2.534 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC001462417298 1061614992 /nfs/dbraw/zinc/61/49/92/1061614992.db2.gz VGDBVBLTVJHUHQ-NSHDSACASA-N 1 1 362.386 2.835 20 5 FFBDMO COc1cc(C(=O)Nc2c[nH+]ccc2-n2cccn2)c([N+](=O)[O-])cc1F ZINC001360111751 1061894806 /nfs/dbraw/zinc/89/48/06/1061894806.db2.gz CJPQNEJCBIVBEU-UHFFFAOYSA-N 1 1 357.301 2.576 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC001530919678 1062664094 /nfs/dbraw/zinc/66/40/94/1062664094.db2.gz WECKVMXMABBESE-DBBZSVRUSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)[C@@H](Cc2ccccc2)C1 ZINC001530919678 1062664100 /nfs/dbraw/zinc/66/41/00/1062664100.db2.gz WECKVMXMABBESE-DBBZSVRUSA-N 1 1 365.433 2.993 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001479843458 1063003989 /nfs/dbraw/zinc/00/39/89/1063003989.db2.gz DRFYSBXASKZQHP-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001479843458 1063004007 /nfs/dbraw/zinc/00/40/07/1063004007.db2.gz DRFYSBXASKZQHP-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001479843458 1063004030 /nfs/dbraw/zinc/00/40/30/1063004030.db2.gz DRFYSBXASKZQHP-QZTJIDSGSA-N 1 1 361.486 2.978 20 5 FFBDMO O=C(Nc1cc[nH+]c(N2CCCCC2)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001439694190 1063204141 /nfs/dbraw/zinc/20/41/41/1063204141.db2.gz OMVPUWLOLOCDTB-UHFFFAOYSA-N 1 1 370.365 2.961 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC001468184122 1063940422 /nfs/dbraw/zinc/94/04/22/1063940422.db2.gz WTQZPDBWRVIOLD-QGZVFWFLSA-N 1 1 351.834 2.735 20 5 FFBDMO CC(C)(C(=O)Nc1ccc2nc(C[NH3+])[nH]c2c1)c1ccccc1[N+](=O)[O-] ZINC001575096364 1078106043 /nfs/dbraw/zinc/10/60/43/1078106043.db2.gz CBBAJKOWXDFOJB-UHFFFAOYSA-N 1 1 353.382 2.846 20 5 FFBDMO Cc1cccc(C[N@@H+]2CCO[C@H](CNc3ccc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001472855720 1065159047 /nfs/dbraw/zinc/15/90/47/1065159047.db2.gz MXPPVULOLAABQR-QGZVFWFLSA-N 1 1 356.426 2.920 20 5 FFBDMO Cc1cccc(C[N@H+]2CCO[C@H](CNc3ccc([N+](=O)[O-])c(C)n3)C2)c1 ZINC001472855720 1065159051 /nfs/dbraw/zinc/15/90/51/1065159051.db2.gz MXPPVULOLAABQR-QGZVFWFLSA-N 1 1 356.426 2.920 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNc2cc[nH]c(=O)c2[N+](=O)[O-])CCOCC1 ZINC001472871720 1065163538 /nfs/dbraw/zinc/16/35/38/1065163538.db2.gz NJPDHOYQXVUUEH-UHFFFAOYSA-N 1 1 372.425 2.789 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC001473528116 1065279568 /nfs/dbraw/zinc/27/95/68/1065279568.db2.gz NJFLDPIWAKWEOO-RTBURBONSA-N 1 1 370.405 2.862 20 5 FFBDMO COC1(c2nccn2C)CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC001473766213 1065352671 /nfs/dbraw/zinc/35/26/71/1065352671.db2.gz VCIRWPNYHAWCHQ-UHFFFAOYSA-N 1 1 371.397 2.607 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](c3cnccn3)C2)cccc1[N+](=O)[O-] ZINC001473833572 1065383894 /nfs/dbraw/zinc/38/38/94/1065383894.db2.gz MCTCTDAMAVBFEZ-AWEZNQCLSA-N 1 1 355.398 2.511 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@H]3CC[C@H](C3)[C@@]2(C)C1 ZINC001473841120 1065386070 /nfs/dbraw/zinc/38/60/70/1065386070.db2.gz VOFCRNHPMOPZJL-QRDCCXFBSA-N 1 1 359.426 2.910 20 5 FFBDMO CN(C)c1cc(NC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)cc[nH+]1 ZINC001584016583 1079295762 /nfs/dbraw/zinc/29/57/62/1079295762.db2.gz GDEYTTQSXNEFHU-UHFFFAOYSA-N 1 1 366.381 2.553 20 5 FFBDMO Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)[NH+]2CCCC2)o1 ZINC001584306818 1079337050 /nfs/dbraw/zinc/33/70/50/1079337050.db2.gz PMZBOSNIKJOUGO-INIZCTEOSA-N 1 1 358.398 2.767 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC001557139872 1075813040 /nfs/dbraw/zinc/81/30/40/1075813040.db2.gz MRVCMOHLLXZOQE-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC001557139872 1075813042 /nfs/dbraw/zinc/81/30/42/1075813042.db2.gz MRVCMOHLLXZOQE-UHFFFAOYSA-N 1 1 351.406 2.624 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001558291477 1075973237 /nfs/dbraw/zinc/97/32/37/1075973237.db2.gz MWIPVAYTAKLQFA-UHFFFAOYSA-N 1 1 353.382 2.519 20 5 FFBDMO CC[C@@H]1COCC[N@@H+]1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559272931 1076143597 /nfs/dbraw/zinc/14/35/97/1076143597.db2.gz SAHPQYKWUFWJJL-CYBMUJFWSA-N 1 1 364.833 2.741 20 5 FFBDMO CC[C@@H]1COCC[N@H+]1CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-] ZINC001559272931 1076143600 /nfs/dbraw/zinc/14/36/00/1076143600.db2.gz SAHPQYKWUFWJJL-CYBMUJFWSA-N 1 1 364.833 2.741 20 5 FFBDMO CC(C)[C@H](CC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)NC(=O)OC(C)(C)C ZINC001559571163 1076174382 /nfs/dbraw/zinc/17/43/82/1076174382.db2.gz MKXOVQXBMKCUSN-AWEZNQCLSA-N 1 1 369.466 2.663 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1CO ZINC001559753925 1076187805 /nfs/dbraw/zinc/18/78/05/1076187805.db2.gz XUPROBMXIIYKKT-TVQRCGJNSA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@H](CO)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC001560085189 1076223919 /nfs/dbraw/zinc/22/39/19/1076223919.db2.gz QCXROKSJUOCGPC-QGZVFWFLSA-N 1 1 371.437 2.831 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Nc2ncccn2)C1 ZINC001560205398 1076246746 /nfs/dbraw/zinc/24/67/46/1076246746.db2.gz ABQYHWQCWZBTAV-HNNXBMFYSA-N 1 1 357.414 2.858 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Nc2ncccn2)C1 ZINC001560205398 1076246752 /nfs/dbraw/zinc/24/67/52/1076246752.db2.gz ABQYHWQCWZBTAV-HNNXBMFYSA-N 1 1 357.414 2.858 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccc(F)c(F)c2F)cc1 ZINC001560434949 1076273216 /nfs/dbraw/zinc/27/32/16/1076273216.db2.gz RAYDFGDNPRACDF-UHFFFAOYSA-N 1 1 374.340 2.576 20 5 FFBDMO Cc1ccccc1-c1nc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)no1 ZINC001560778410 1076298896 /nfs/dbraw/zinc/29/88/96/1076298896.db2.gz CKXGTMVAGKJMMR-UHFFFAOYSA-N 1 1 354.370 2.643 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)cc1F ZINC001561309338 1076360143 /nfs/dbraw/zinc/36/01/43/1076360143.db2.gz XVSUTUZMTMKEQX-ZDUSSCGKSA-N 1 1 373.450 2.537 20 5 FFBDMO Cc1ccc(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c(C)c1[N+](=O)[O-] ZINC001561474842 1076381908 /nfs/dbraw/zinc/38/19/08/1076381908.db2.gz RJGUOXSUSZBAOM-TZMCWYRMSA-N 1 1 369.487 2.610 20 5 FFBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3cnc(N)c([N+](=O)[O-])c3)c2C1 ZINC001566731219 1076978967 /nfs/dbraw/zinc/97/89/67/1076978967.db2.gz SMLUDHFRKGAGLL-UHFFFAOYSA-N 1 1 355.398 2.796 20 5 FFBDMO COc1ccc(NC(=O)[C@H]2C[N@@H+](C)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC001566755227 1076980379 /nfs/dbraw/zinc/98/03/79/1076980379.db2.gz YMJNIJGENAAERN-CVEARBPZSA-N 1 1 355.394 2.887 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1N)C1CC1 ZINC001567881116 1077057225 /nfs/dbraw/zinc/05/72/25/1077057225.db2.gz DBGNZLBSWIHGRB-LJQANCHMSA-N 1 1 368.437 2.817 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3cccc(OC)c3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001568140942 1077074087 /nfs/dbraw/zinc/07/40/87/1077074087.db2.gz YOOCHQNYGBVXGP-KRWDZBQOSA-N 1 1 369.421 2.953 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C ZINC001570910774 1077242154 /nfs/dbraw/zinc/24/21/54/1077242154.db2.gz RUGIYHDHILTPNK-QGZVFWFLSA-N 1 1 371.441 2.583 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3C)CC[NH2+]2)cc1 ZINC001586889378 1079701281 /nfs/dbraw/zinc/70/12/81/1079701281.db2.gz WHBJFAQZTUGJJJ-QGZVFWFLSA-N 1 1 373.384 2.838 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2CSCC[N@@H+]2Cc2ccccc2)s1 ZINC000409651326 512116879 /nfs/dbraw/zinc/11/68/79/512116879.db2.gz KDHPSVFKYQGFQI-ZDUSSCGKSA-N 1 1 350.469 2.503 20 5 FFBDMO O=[N+]([O-])c1cnc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)s1 ZINC000409651326 512116881 /nfs/dbraw/zinc/11/68/81/512116881.db2.gz KDHPSVFKYQGFQI-ZDUSSCGKSA-N 1 1 350.469 2.503 20 5 FFBDMO C[C@@H]1C[C@H]([N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCN1C ZINC000093643725 250038321 /nfs/dbraw/zinc/03/83/21/250038321.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@@H]1C[C@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C ZINC000093643725 250038328 /nfs/dbraw/zinc/03/83/28/250038328.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 1 1 357.458 2.910 20 5 FFBDMO C[C@@H]1C[C@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000093643725 250038332 /nfs/dbraw/zinc/03/83/32/250038332.db2.gz HMVXHNNZSXELAV-RDTXWAMCSA-N 1 1 357.458 2.910 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1NC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000098099250 250071403 /nfs/dbraw/zinc/07/14/03/250071403.db2.gz ULDGMHVAMGHFOW-UHFFFAOYSA-N 1 1 353.338 2.501 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@H](C)C2)cc1SC ZINC000103070037 250133120 /nfs/dbraw/zinc/13/31/20/250133120.db2.gz ZUDREOYLPSYJSC-LBPRGKRZSA-N 1 1 367.471 2.787 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)Cc1ccccc1 ZINC000103140586 250136727 /nfs/dbraw/zinc/13/67/27/250136727.db2.gz CLKWOVWFHSIHQV-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO CCc1ccc(C(=O)Nc2ccc(NC(=O)C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000173498085 251193528 /nfs/dbraw/zinc/19/35/28/251193528.db2.gz JJOMRAAFNMEKNT-UHFFFAOYSA-N 1 1 370.409 2.910 20 5 FFBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000181083671 251237647 /nfs/dbraw/zinc/23/76/47/251237647.db2.gz UOBVZCVBKKPJBJ-GJZGRUSLSA-N 1 1 360.458 2.904 20 5 FFBDMO C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(Br)cc([N+](=O)[O-])c3)[C@H]2C1 ZINC000272604403 252078507 /nfs/dbraw/zinc/07/85/07/252078507.db2.gz YYBYDVUWTAOWQY-YGRLFVJLSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000273033241 252196973 /nfs/dbraw/zinc/19/69/73/252196973.db2.gz VFMSUUKAYJLZJI-LBPRGKRZSA-N 1 1 362.386 2.500 20 5 FFBDMO O=[N+]([O-])c1cnc(NCc2ccccc2C[N@@H+]2CC[C@H](O)C2)c(Cl)c1 ZINC000273049829 252201038 /nfs/dbraw/zinc/20/10/38/252201038.db2.gz BIDBOGLHHPOSDQ-HNNXBMFYSA-N 1 1 362.817 2.822 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@H+]1CCC[C@@H]1CO ZINC000273079661 252210323 /nfs/dbraw/zinc/21/03/23/252210323.db2.gz HDBPKLIURKBYES-QGZVFWFLSA-N 1 1 356.426 2.867 20 5 FFBDMO CC(=O)c1ccc(NCc2ccccc2C[N@H+]2CC[C@H](O)C2)c([N+](=O)[O-])c1 ZINC000273196016 252247514 /nfs/dbraw/zinc/24/75/14/252247514.db2.gz NOYSJHLLKWSLCF-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO Cc1cc(-c2noc([C@@H](C)[NH2+]CCn3ccc([N+](=O)[O-])n3)n2)ccc1F ZINC000273257195 252265696 /nfs/dbraw/zinc/26/56/96/252265696.db2.gz BJQUASJHGRZICP-LLVKDONJSA-N 1 1 360.349 2.640 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000366649108 512123110 /nfs/dbraw/zinc/12/31/10/512123110.db2.gz CGNREDMQFOLABG-RYUDHWBXSA-N 1 1 353.806 2.545 20 5 FFBDMO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000285764419 257003613 /nfs/dbraw/zinc/00/36/13/257003613.db2.gz RRPVIRIFVVLSTD-JTQLQIEISA-N 1 1 350.325 2.947 20 5 FFBDMO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@@]1=O ZINC000277305710 256182752 /nfs/dbraw/zinc/18/27/52/256182752.db2.gz UKXJSCDRORFKEX-SHZVTRLKSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[S@@]1=O ZINC000277305710 256182754 /nfs/dbraw/zinc/18/27/54/256182754.db2.gz UKXJSCDRORFKEX-SHZVTRLKSA-N 1 1 363.439 2.635 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000277753674 256235489 /nfs/dbraw/zinc/23/54/89/256235489.db2.gz CIBUAJBVCWQMSV-INIZCTEOSA-N 1 1 356.426 2.752 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000278746291 256343695 /nfs/dbraw/zinc/34/36/95/256343695.db2.gz UMXWQNUBEVVIDX-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000071862570 221384189 /nfs/dbraw/zinc/38/41/89/221384189.db2.gz ROISKPZMIQUSSF-INIZCTEOSA-N 1 1 353.382 2.504 20 5 FFBDMO C[N@@H+](CCc1nc(-c2ccccc2)no1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000285880749 257009367 /nfs/dbraw/zinc/00/93/67/257009367.db2.gz JKCKREACFLNXFI-QGZVFWFLSA-N 1 1 368.393 2.853 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOC[C@@H]1CC(F)F ZINC000286257062 257028071 /nfs/dbraw/zinc/02/80/71/257028071.db2.gz AWRSBFAZOTUKBR-ZDUSSCGKSA-N 1 1 357.357 2.588 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H]1CC(F)F ZINC000286257062 257028072 /nfs/dbraw/zinc/02/80/72/257028072.db2.gz AWRSBFAZOTUKBR-ZDUSSCGKSA-N 1 1 357.357 2.588 20 5 FFBDMO C[N@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000286702659 257050618 /nfs/dbraw/zinc/05/06/18/257050618.db2.gz DYZZEIQBFVCRJH-UHFFFAOYSA-N 1 1 362.398 2.878 20 5 FFBDMO C[N@@H+](CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000286702659 257050619 /nfs/dbraw/zinc/05/06/19/257050619.db2.gz DYZZEIQBFVCRJH-UHFFFAOYSA-N 1 1 362.398 2.878 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1 ZINC000287431544 257089092 /nfs/dbraw/zinc/08/90/92/257089092.db2.gz OQCREJUXNRXBKU-MRXNPFEDSA-N 1 1 362.474 2.899 20 5 FFBDMO COC(=O)CCn1nc(C)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1C ZINC000289379151 257277672 /nfs/dbraw/zinc/27/76/72/257277672.db2.gz MHVYWBZSANVYBX-UHFFFAOYSA-N 1 1 374.441 2.646 20 5 FFBDMO C[C@@H](CCN1CC[NH+](C)CC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000302305630 258098812 /nfs/dbraw/zinc/09/88/12/258098812.db2.gz ZKSABRDKGYKQPQ-LBPRGKRZSA-N 1 1 371.279 2.795 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NCC[N@@H+]3CCc4c(Cl)cccc4C3)nn21 ZINC000302681091 258108042 /nfs/dbraw/zinc/10/80/42/258108042.db2.gz RZWONSGDVHPAIX-UHFFFAOYSA-N 1 1 372.816 2.761 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NCC[N@H+]3CCc4c(Cl)cccc4C3)nn21 ZINC000302681091 258108043 /nfs/dbraw/zinc/10/80/43/258108043.db2.gz RZWONSGDVHPAIX-UHFFFAOYSA-N 1 1 372.816 2.761 20 5 FFBDMO Cc1cc(NCC[NH+]2CCN(c3ccc(F)cc3)CC2)ncc1[N+](=O)[O-] ZINC000301459895 258050740 /nfs/dbraw/zinc/05/07/40/258050740.db2.gz YGYFWRGUMDZSIJ-UHFFFAOYSA-N 1 1 359.405 2.671 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000301703870 258063877 /nfs/dbraw/zinc/06/38/77/258063877.db2.gz URWCLHHFNSLDID-ZDUSSCGKSA-N 1 1 362.430 2.992 20 5 FFBDMO Cc1cnc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2CO)c([N+](=O)[O-])c1 ZINC000301731034 258065375 /nfs/dbraw/zinc/06/53/75/258065375.db2.gz SLCAWAHEQKRRNU-IAGOWNOFSA-N 1 1 356.426 2.593 20 5 FFBDMO CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000301826375 258069449 /nfs/dbraw/zinc/06/94/49/258069449.db2.gz JEEOUYIKFUQJAT-WMZOPIPTSA-N 1 1 372.400 2.951 20 5 FFBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[NH+]1CCN(C)CC1 ZINC000301899786 258073798 /nfs/dbraw/zinc/07/37/98/258073798.db2.gz YKYHXZBWNJEQIJ-AWEZNQCLSA-N 1 1 350.463 2.820 20 5 FFBDMO COc1cc(CN2C[C@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000330585613 258166048 /nfs/dbraw/zinc/16/60/48/258166048.db2.gz LJAPIOUJKGVGSN-QWRGUYRKSA-N 1 1 359.373 2.729 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(Br)cc1[N+](=O)[O-] ZINC000332228245 258219879 /nfs/dbraw/zinc/21/98/79/258219879.db2.gz CQYPJFWXOBIUPW-QWHCGFSZSA-N 1 1 368.231 2.714 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000331738464 258198890 /nfs/dbraw/zinc/19/88/90/258198890.db2.gz UWVNWRILWKVTPW-ZDUSSCGKSA-N 1 1 365.405 2.577 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])cc1F ZINC000331738464 258198891 /nfs/dbraw/zinc/19/88/91/258198891.db2.gz UWVNWRILWKVTPW-ZDUSSCGKSA-N 1 1 365.405 2.577 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1 ZINC000370945257 512146522 /nfs/dbraw/zinc/14/65/22/512146522.db2.gz UACDKDMVABIFKG-GFCCVEGCSA-N 1 1 359.361 2.951 20 5 FFBDMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000121870054 508436440 /nfs/dbraw/zinc/43/64/40/508436440.db2.gz AXTBWXRWQFSWJJ-GWCFXTLKSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000120827963 509072048 /nfs/dbraw/zinc/07/20/48/509072048.db2.gz ZDGBXKCOGHHJMF-JTQLQIEISA-N 1 1 358.236 2.817 20 5 FFBDMO CNC(=O)c1ccc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000064914733 506239405 /nfs/dbraw/zinc/23/94/05/506239405.db2.gz XCADOIVKZFPPCA-LZWOXQAQSA-N 1 1 360.458 2.796 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)cc1 ZINC000371063017 512199458 /nfs/dbraw/zinc/19/94/58/512199458.db2.gz MQNMTFMQZGDEQC-MJGOQNOKSA-N 1 1 357.385 2.838 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c1 ZINC000371065725 512201625 /nfs/dbraw/zinc/20/16/25/512201625.db2.gz XNFVAUQEFNCSAM-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c1 ZINC000371065725 512201628 /nfs/dbraw/zinc/20/16/28/512201628.db2.gz XNFVAUQEFNCSAM-SJLPKXTDSA-N 1 1 373.384 2.918 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](C4CCOCC4)C3)o2)cc1 ZINC000371072565 512205829 /nfs/dbraw/zinc/20/58/29/512205829.db2.gz CIRAAZYPOUKXLU-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO CCc1cccc(C)c1NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000373238967 512235567 /nfs/dbraw/zinc/23/55/67/512235567.db2.gz AZCHDIKLKDOBEZ-UHFFFAOYSA-N 1 1 371.441 2.938 20 5 FFBDMO Cc1cc(C)c(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c(C)c1 ZINC000373247239 512238744 /nfs/dbraw/zinc/23/87/44/512238744.db2.gz QMAKXSODNJKNHT-UHFFFAOYSA-N 1 1 371.441 2.992 20 5 FFBDMO COc1ccccc1[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000008088770 506620815 /nfs/dbraw/zinc/62/08/15/506620815.db2.gz ZQGMPQHDXRZIGH-KRWDZBQOSA-N 1 1 357.410 2.945 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CSc1ccc([N+](=O)[O-])cc1 ZINC000055401645 506743058 /nfs/dbraw/zinc/74/30/58/506743058.db2.gz JTCSABFOQZVDNW-ZIAGYGMSSA-N 1 1 351.472 2.924 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000056460266 507019271 /nfs/dbraw/zinc/01/92/71/507019271.db2.gz STWRAIDDTUGBTR-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO COc1cccc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000046038019 507065609 /nfs/dbraw/zinc/06/56/09/507065609.db2.gz ZSTCZCNMFFPZQF-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO CC(C)(C)CC[NH+]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000068116095 507117647 /nfs/dbraw/zinc/11/76/47/507117647.db2.gz HSPCPKWNRYNLBP-UHFFFAOYSA-N 1 1 359.430 2.665 20 5 FFBDMO C[C@H](CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC000068195861 507144310 /nfs/dbraw/zinc/14/43/10/507144310.db2.gz VDDVPDOWMFPUOC-MNOVXSKESA-N 1 1 355.822 2.614 20 5 FFBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1(C(N)=O)CCCC1 ZINC000425416359 513552901 /nfs/dbraw/zinc/55/29/01/513552901.db2.gz GFUGJZXPUKBWHA-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccco1 ZINC000068409776 507219225 /nfs/dbraw/zinc/21/92/25/507219225.db2.gz GKWVVGPOXQOIEY-INIZCTEOSA-N 1 1 356.382 2.562 20 5 FFBDMO CC(C)N(C(=O)[C@@H](C)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(C)C ZINC000047744181 507387092 /nfs/dbraw/zinc/38/70/92/507387092.db2.gz SXYWMAIWCGNBSG-MRXNPFEDSA-N 1 1 362.474 2.751 20 5 FFBDMO CC(C)[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000069083248 507401803 /nfs/dbraw/zinc/40/18/03/507401803.db2.gz NNWNQTMKKICRMJ-UHFFFAOYSA-N 1 1 354.838 2.603 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000051468345 507771606 /nfs/dbraw/zinc/77/16/06/507771606.db2.gz QZLQHSMRCWQHQV-UHFFFAOYSA-N 1 1 360.439 2.886 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064724357 507807196 /nfs/dbraw/zinc/80/71/96/507807196.db2.gz SDHPHTOANKNQFZ-LBPRGKRZSA-N 1 1 357.838 2.862 20 5 FFBDMO CC[C@](C)([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000072685186 507841932 /nfs/dbraw/zinc/84/19/32/507841932.db2.gz QOHUDUMQKMUEDE-KRWDZBQOSA-N 1 1 360.439 2.855 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c(F)c1 ZINC000089644925 507853213 /nfs/dbraw/zinc/85/32/13/507853213.db2.gz RWGWIVXSUUFPOM-HUUCEWRRSA-N 1 1 363.364 2.920 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(NC[C@H]2C[C@@H](O)C[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000089644925 507853215 /nfs/dbraw/zinc/85/32/15/507853215.db2.gz RWGWIVXSUUFPOM-HUUCEWRRSA-N 1 1 363.364 2.920 20 5 FFBDMO CC[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000072861827 507865958 /nfs/dbraw/zinc/86/59/58/507865958.db2.gz GSZDWZXFFVFREV-ZDUSSCGKSA-N 1 1 351.428 2.720 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCS[C@H]4COCC[C@@H]43)co2)cc1 ZINC000089910202 507882588 /nfs/dbraw/zinc/88/25/88/507882588.db2.gz SMCKWUFUDGNRKU-HOTGVXAUSA-N 1 1 361.423 2.956 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@H]4COCC[C@@H]43)co2)cc1 ZINC000089910202 507882589 /nfs/dbraw/zinc/88/25/89/507882589.db2.gz SMCKWUFUDGNRKU-HOTGVXAUSA-N 1 1 361.423 2.956 20 5 FFBDMO CN(C)c1cccc(C[N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000089923218 507884365 /nfs/dbraw/zinc/88/43/65/507884365.db2.gz DBABQEBRJJKOQH-UHFFFAOYSA-N 1 1 368.437 2.682 20 5 FFBDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1 ZINC000089923218 507884366 /nfs/dbraw/zinc/88/43/66/507884366.db2.gz DBABQEBRJJKOQH-UHFFFAOYSA-N 1 1 368.437 2.682 20 5 FFBDMO Cc1cc(S(=O)(=O)N(CC[NH+](C)C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000078737131 507902953 /nfs/dbraw/zinc/90/29/53/507902953.db2.gz MSFZDNYZRNSHOS-UHFFFAOYSA-N 1 1 363.439 2.660 20 5 FFBDMO CCc1nn(C)c(N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000091729099 508005689 /nfs/dbraw/zinc/00/56/89/508005689.db2.gz CGYBOIAZYMBQHD-MRXNPFEDSA-N 1 1 357.458 2.849 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1 ZINC000074321138 508012002 /nfs/dbraw/zinc/01/20/02/508012002.db2.gz CJUAHTVHEHZEJP-INIZCTEOSA-N 1 1 370.453 2.740 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(CNc2ncc([N+](=O)[O-])c(N)n2)cc1 ZINC000079906324 508013376 /nfs/dbraw/zinc/01/33/76/508013376.db2.gz KCRVHNFUPBXALY-CYBMUJFWSA-N 1 1 356.430 2.954 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000079929710 508016171 /nfs/dbraw/zinc/01/61/71/508016171.db2.gz CYVPSBXFQIOJQE-ZDUSSCGKSA-N 1 1 359.430 2.898 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](CCC(N)=O)C1 ZINC000110627277 508037970 /nfs/dbraw/zinc/03/79/70/508037970.db2.gz UACJYQOQOGUXQF-CHWSQXEVSA-N 1 1 373.413 2.683 20 5 FFBDMO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)CC[N@H+]1Cc1ccccc1 ZINC000080230708 508054195 /nfs/dbraw/zinc/05/41/95/508054195.db2.gz ZEJJLJIALRSMQQ-ZFWWWQNUSA-N 1 1 369.425 2.554 20 5 FFBDMO C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000110965704 508060851 /nfs/dbraw/zinc/06/08/51/508060851.db2.gz YHFINTVPEUVFJE-OAHLLOKOSA-N 1 1 356.426 2.643 20 5 FFBDMO COc1cc(C[N@H+](CCCO)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000093102126 508120775 /nfs/dbraw/zinc/12/07/75/508120775.db2.gz LOOATPJTZMSRBF-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COc1cc(C[N@@H+](CCCO)Cc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000093102126 508120777 /nfs/dbraw/zinc/12/07/77/508120777.db2.gz LOOATPJTZMSRBF-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO CNc1ccc(C(=O)N2CC[C@@H]([N@@H+](C)Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000081127247 508140140 /nfs/dbraw/zinc/14/01/40/508140140.db2.gz GDRDOZGNQOIUKN-QGZVFWFLSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1cc(C[N@@H+](CCO)CCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000093389683 508143490 /nfs/dbraw/zinc/14/34/90/508143490.db2.gz QLDFAWUVVSJFKW-UHFFFAOYSA-N 1 1 360.410 2.649 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)C1 ZINC000081361073 508167162 /nfs/dbraw/zinc/16/71/62/508167162.db2.gz WHWZCDYLAIEFOE-HNNXBMFYSA-N 1 1 371.441 2.584 20 5 FFBDMO Cc1ccc2nc(C[N@@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn2c1 ZINC000084083732 508265164 /nfs/dbraw/zinc/26/51/64/508265164.db2.gz QPYXGUQGJVALAK-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO Cc1ccc2nc(C[N@H+]3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)cn2c1 ZINC000084083732 508265165 /nfs/dbraw/zinc/26/51/65/508265165.db2.gz QPYXGUQGJVALAK-AWEZNQCLSA-N 1 1 352.398 2.632 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000113939600 508287334 /nfs/dbraw/zinc/28/73/34/508287334.db2.gz FZADILRLDLVJNZ-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO CCOC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC000113939600 508287336 /nfs/dbraw/zinc/28/73/36/508287336.db2.gz FZADILRLDLVJNZ-KBPBESRZSA-N 1 1 365.430 2.679 20 5 FFBDMO C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000114489958 508320899 /nfs/dbraw/zinc/32/08/99/508320899.db2.gz HBFABCLKBNOQIX-MJGOQNOKSA-N 1 1 356.422 2.824 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000115414910 508391946 /nfs/dbraw/zinc/39/19/46/508391946.db2.gz KNYLJHMRGBTAJE-VXGBXAGGSA-N 1 1 352.391 2.803 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000106787613 508404535 /nfs/dbraw/zinc/40/45/35/508404535.db2.gz UKQFHYFEZWTSNZ-HNNXBMFYSA-N 1 1 358.442 2.916 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nncn3C3CC3)C2)c1 ZINC000152454422 508450198 /nfs/dbraw/zinc/45/01/98/508450198.db2.gz NNPNIXXICKMANO-AWEZNQCLSA-N 1 1 357.414 2.780 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000156687926 508462492 /nfs/dbraw/zinc/46/24/92/508462492.db2.gz CELXJNXCAQZVCB-WBMJQRKESA-N 1 1 372.400 2.566 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC[N@H+]1CCOC ZINC000127561913 508469194 /nfs/dbraw/zinc/46/91/94/508469194.db2.gz PLLQUDYBQBVUFE-OAHLLOKOSA-N 1 1 364.446 2.786 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153055946 508543240 /nfs/dbraw/zinc/54/32/40/508543240.db2.gz UBVGYQVOUXFAQR-INIZCTEOSA-N 1 1 372.421 2.792 20 5 FFBDMO CCOc1ccc(OC[C@@H](O)C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000153055946 508543244 /nfs/dbraw/zinc/54/32/44/508543244.db2.gz UBVGYQVOUXFAQR-INIZCTEOSA-N 1 1 372.421 2.792 20 5 FFBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000136125781 508672499 /nfs/dbraw/zinc/67/24/99/508672499.db2.gz XEJOJWALQGQFDZ-HNNXBMFYSA-N 1 1 358.442 2.951 20 5 FFBDMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000153938117 508681229 /nfs/dbraw/zinc/68/12/29/508681229.db2.gz FCQCBNLWFDTSHT-MAUKXSAKSA-N 1 1 372.469 2.872 20 5 FFBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136893896 508723063 /nfs/dbraw/zinc/72/30/63/508723063.db2.gz UBUDSOHOMVXJDQ-LIRRHRJNSA-N 1 1 367.409 2.902 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000123817051 508742671 /nfs/dbraw/zinc/74/26/71/508742671.db2.gz NEEZZXFPMKKXPH-OAHLLOKOSA-N 1 1 371.441 2.612 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1Cc1ccccc1 ZINC000137455710 508756664 /nfs/dbraw/zinc/75/66/64/508756664.db2.gz WDRKRUHYXLLZEF-RDJZCZTQSA-N 1 1 369.421 2.753 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154416048 508780342 /nfs/dbraw/zinc/78/03/42/508780342.db2.gz NISWKKSYBJNGKH-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154416048 508780347 /nfs/dbraw/zinc/78/03/47/508780347.db2.gz NISWKKSYBJNGKH-CVEARBPZSA-N 1 1 365.430 2.569 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000139256495 508786109 /nfs/dbraw/zinc/78/61/09/508786109.db2.gz SHIWSFBZOPVKRP-IJEWVQPXSA-N 1 1 367.471 2.621 20 5 FFBDMO C[C@H](C[NH+]1CCN(c2ccccc2)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000119534294 508814968 /nfs/dbraw/zinc/81/49/68/508814968.db2.gz KYZODTZGKOBZAE-MRXNPFEDSA-N 1 1 368.437 2.535 20 5 FFBDMO COc1cc(C[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000130744412 508840184 /nfs/dbraw/zinc/84/01/84/508840184.db2.gz OTGNSMPATHQHKY-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000130744412 508840190 /nfs/dbraw/zinc/84/01/90/508840190.db2.gz OTGNSMPATHQHKY-AWEZNQCLSA-N 1 1 360.410 2.995 20 5 FFBDMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159517407 508852026 /nfs/dbraw/zinc/85/20/26/508852026.db2.gz AGNSKMHBZJTQLV-WCQYABFASA-N 1 1 360.439 2.804 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000369461289 512421979 /nfs/dbraw/zinc/42/19/79/512421979.db2.gz IIAAGBZFVDBNBN-GFCCVEGCSA-N 1 1 361.377 2.795 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000369461289 512421982 /nfs/dbraw/zinc/42/19/82/512421982.db2.gz IIAAGBZFVDBNBN-GFCCVEGCSA-N 1 1 361.377 2.795 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2C)cn1 ZINC000124944628 508908836 /nfs/dbraw/zinc/90/88/36/508908836.db2.gz GGWWMTXOLRFHCX-UHFFFAOYSA-N 1 1 351.366 2.722 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000120223161 508953551 /nfs/dbraw/zinc/95/35/51/508953551.db2.gz HKTUSGXSJOUWRP-OAHLLOKOSA-N 1 1 369.487 2.550 20 5 FFBDMO Cn1ccnc1[C@H](O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000120387315 508985617 /nfs/dbraw/zinc/98/56/17/508985617.db2.gz QHZSZTXKSUEVSD-MRXNPFEDSA-N 1 1 364.833 2.927 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155449472 509003635 /nfs/dbraw/zinc/00/36/35/509003635.db2.gz SDOWGENASWGSCC-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2OCCC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000155449472 509003639 /nfs/dbraw/zinc/00/36/39/509003639.db2.gz SDOWGENASWGSCC-IAQYHMDHSA-N 1 1 353.806 2.688 20 5 FFBDMO CCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000132277651 509009935 /nfs/dbraw/zinc/00/99/35/509009935.db2.gz ZGTATODWVDRDGR-AWEZNQCLSA-N 1 1 367.471 2.547 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000125738724 509024064 /nfs/dbraw/zinc/02/40/64/509024064.db2.gz IITARBGUGPMJJC-CJNGLKHVSA-N 1 1 354.410 2.699 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCC1CCOCC1 ZINC000120595140 509028355 /nfs/dbraw/zinc/02/83/55/509028355.db2.gz IMSDQVYXKRCJDH-UHFFFAOYSA-N 1 1 365.430 2.681 20 5 FFBDMO CCC(CC)(C[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(=O)OC ZINC000120838319 509073876 /nfs/dbraw/zinc/07/38/76/509073876.db2.gz WNHSJRUXIUMYND-UHFFFAOYSA-N 1 1 362.386 2.714 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-] ZINC000161318178 509101664 /nfs/dbraw/zinc/10/16/64/509101664.db2.gz AIZLDPYECKTVNV-AWEZNQCLSA-N 1 1 364.446 2.946 20 5 FFBDMO COC(=O)C1=NOC2(C1)CC[NH+](Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000161402650 509112449 /nfs/dbraw/zinc/11/24/49/509112449.db2.gz MWJMKNOWDFMZIQ-UHFFFAOYSA-N 1 1 367.789 2.532 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121124080 509133269 /nfs/dbraw/zinc/13/32/69/509133269.db2.gz CMUHXOSNRLJQAL-XLIONFOSSA-N 1 1 374.529 2.779 20 5 FFBDMO CCn1cc([N+](=O)[O-])c(C(=O)NCc2cccc(C[N@@H+](C)C(C)C)c2)n1 ZINC000191810109 509193781 /nfs/dbraw/zinc/19/37/81/509193781.db2.gz GNMFJWVZOSCWCG-UHFFFAOYSA-N 1 1 359.430 2.581 20 5 FFBDMO CN(CC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000248088085 509234297 /nfs/dbraw/zinc/23/42/97/509234297.db2.gz SZZHGDNOFSXMND-OXJNMPFZSA-N 1 1 368.437 2.593 20 5 FFBDMO CC(C)C[NH+]1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 ZINC000248234154 509262748 /nfs/dbraw/zinc/26/27/48/509262748.db2.gz LXVJISBKLFAVSW-AWEZNQCLSA-N 1 1 351.472 2.876 20 5 FFBDMO C[C@@H](C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000248466737 509334859 /nfs/dbraw/zinc/33/48/59/509334859.db2.gz SMGDPOUMUPCBHZ-GXTWGEPZSA-N 1 1 351.428 2.527 20 5 FFBDMO CC(C)c1ccc(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000188958685 509342932 /nfs/dbraw/zinc/34/29/32/509342932.db2.gz QXJNMMRNGMUEPJ-GASCZTMLSA-N 1 1 363.458 2.947 20 5 FFBDMO Cc1ccccc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226688522 509401512 /nfs/dbraw/zinc/40/15/12/509401512.db2.gz BOFUMBBLBGSZQA-LSDHHAIUSA-N 1 1 369.425 2.812 20 5 FFBDMO Cc1ccccc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226688522 509401519 /nfs/dbraw/zinc/40/15/19/509401519.db2.gz BOFUMBBLBGSZQA-LSDHHAIUSA-N 1 1 369.425 2.812 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CC[C@H]([NH+]3CCCCC3)C2)c(Br)c1 ZINC000267275443 509423654 /nfs/dbraw/zinc/42/36/54/509423654.db2.gz UCWAMGJTYOUUSJ-NSHDSACASA-N 1 1 355.236 2.817 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1[N+](=O)[O-] ZINC000182853741 509460545 /nfs/dbraw/zinc/46/05/45/509460545.db2.gz QVWKZBNAOFQLKP-OLZOCXBDSA-N 1 1 363.462 2.653 20 5 FFBDMO CC(C)C[C@@H](C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000236673233 509477414 /nfs/dbraw/zinc/47/74/14/509477414.db2.gz LCKCANAYLVHFNB-VIFPVBQESA-N 1 1 370.258 2.553 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000248837793 509507173 /nfs/dbraw/zinc/50/71/73/509507173.db2.gz DQQMDZWZZPSJDO-WMLDXEAASA-N 1 1 369.421 2.854 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 ZINC000173353207 509548540 /nfs/dbraw/zinc/54/85/40/509548540.db2.gz LILSXLFDWVYFNM-LPHOPBHVSA-N 1 1 369.425 2.861 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)[C@@H](C)C1 ZINC000249030619 509575606 /nfs/dbraw/zinc/57/56/06/509575606.db2.gz LYCWYXDUBRLMPV-GJZGRUSLSA-N 1 1 369.487 2.562 20 5 FFBDMO COc1ccc(COC[C@H](O)C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000192707320 509607159 /nfs/dbraw/zinc/60/71/59/509607159.db2.gz IDYYKXUCNNRWBZ-QGZVFWFLSA-N 1 1 360.410 2.613 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1C[N@@H+](Cc2ccccc2)CCCO1 ZINC000192924745 509701632 /nfs/dbraw/zinc/70/16/32/509701632.db2.gz JAVIABLFRQIMRP-KRWDZBQOSA-N 1 1 373.457 2.823 20 5 FFBDMO COc1ccc(OC)c([C@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193050761 509755188 /nfs/dbraw/zinc/75/51/88/509755188.db2.gz BYKQOHPAXDWLIG-ZDUSSCGKSA-N 1 1 373.409 2.926 20 5 FFBDMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000186586913 509787608 /nfs/dbraw/zinc/78/76/08/509787608.db2.gz KHGUZKPBQCCCEC-QWFCFKBJSA-N 1 1 374.529 2.922 20 5 FFBDMO CN(CC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000180208151 509813630 /nfs/dbraw/zinc/81/36/30/509813630.db2.gz SZZHGDNOFSXMND-UZLBHIALSA-N 1 1 368.437 2.593 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCOC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180241981 509829494 /nfs/dbraw/zinc/82/94/94/509829494.db2.gz RFOLQGDYBHZUEL-LLVKDONJSA-N 1 1 360.357 2.716 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OCC(F)F ZINC000180259915 509837293 /nfs/dbraw/zinc/83/72/93/509837293.db2.gz WSBZJWCEBIFDBD-RISCZKNCSA-N 1 1 374.384 2.840 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)Nc2ccncc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000183585800 509873577 /nfs/dbraw/zinc/87/35/77/509873577.db2.gz GBURDIOQKXCHKJ-HIFRSBDPSA-N 1 1 355.398 2.774 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-] ZINC000190018616 509887824 /nfs/dbraw/zinc/88/78/24/509887824.db2.gz IVPPTDOXWHWLJU-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255019852 509915740 /nfs/dbraw/zinc/91/57/40/509915740.db2.gz AMTNCQZPQKAXQW-QJSCKGPTSA-N 1 1 358.486 2.710 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000245432936 509928635 /nfs/dbraw/zinc/92/86/35/509928635.db2.gz OYJZDIHMMSOEPM-LRDDRELGSA-N 1 1 368.865 2.849 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 ZINC000245446674 509942129 /nfs/dbraw/zinc/94/21/29/509942129.db2.gz LILSXLFDWVYFNM-APWZRJJASA-N 1 1 369.425 2.861 20 5 FFBDMO C[C@@H](CN1CCN(C)CC1)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180497704 509955791 /nfs/dbraw/zinc/95/57/91/509955791.db2.gz TZPSKPPEJSMHOR-LAUBAEHRSA-N 1 1 368.481 2.910 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C ZINC000174122799 509958291 /nfs/dbraw/zinc/95/82/91/509958291.db2.gz RSZJRYMSBPBTPS-ZDUSSCGKSA-N 1 1 350.419 2.942 20 5 FFBDMO CC(C)[N@H+]1[C@@H]2CC[C@H]1CN([C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])CC2 ZINC000245500037 509968766 /nfs/dbraw/zinc/96/87/66/509968766.db2.gz ZHXQLMQCFRQMBM-XHSDSOJGSA-N 1 1 360.458 2.869 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000177290281 509981517 /nfs/dbraw/zinc/98/15/17/509981517.db2.gz SCUYMGZERTZINW-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000174217691 510009207 /nfs/dbraw/zinc/00/92/07/510009207.db2.gz DELWZNFHIBAAJG-WBVHZDCISA-N 1 1 360.458 2.789 20 5 FFBDMO C[C@@H](C[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000183940171 510048044 /nfs/dbraw/zinc/04/80/44/510048044.db2.gz IGZQIJAJQRFAFA-LBPRGKRZSA-N 1 1 360.439 2.676 20 5 FFBDMO C[C@@H](C[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1nccs1 ZINC000183940171 510048051 /nfs/dbraw/zinc/04/80/51/510048051.db2.gz IGZQIJAJQRFAFA-LBPRGKRZSA-N 1 1 360.439 2.676 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193769702 510059614 /nfs/dbraw/zinc/05/96/14/510059614.db2.gz GTUIQSDLUBZDAR-QGZVFWFLSA-N 1 1 369.421 2.612 20 5 FFBDMO Cc1nc(C[NH+]2CCC(CNc3ncc([N+](=O)[O-])s3)CC2)oc1C ZINC000190328474 510067411 /nfs/dbraw/zinc/06/74/11/510067411.db2.gz HGSLZVGMIJFMIO-UHFFFAOYSA-N 1 1 351.432 2.980 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000193814082 510083945 /nfs/dbraw/zinc/08/39/45/510083945.db2.gz SAVHHTCFTAPTER-INIZCTEOSA-N 1 1 369.421 2.855 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193827184 510087539 /nfs/dbraw/zinc/08/75/39/510087539.db2.gz OVYKLHDFPNNLBR-CQSZACIVSA-N 1 1 364.402 2.631 20 5 FFBDMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000193827184 510087551 /nfs/dbraw/zinc/08/75/51/510087551.db2.gz OVYKLHDFPNNLBR-CQSZACIVSA-N 1 1 364.402 2.631 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000268847585 510097702 /nfs/dbraw/zinc/09/77/02/510097702.db2.gz PXYPUVCDOQVYOU-DLBZAZTESA-N 1 1 355.442 2.819 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000265741523 510204756 /nfs/dbraw/zinc/20/47/56/510204756.db2.gz CCOLYJMWKZWRGI-UHFFFAOYSA-N 1 1 367.203 2.682 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000174655409 510232482 /nfs/dbraw/zinc/23/24/82/510232482.db2.gz DIHPCTJLJGSODF-AWEZNQCLSA-N 1 1 362.411 2.509 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000184482910 510348641 /nfs/dbraw/zinc/34/86/41/510348641.db2.gz OSOKDXXMJDZMHY-HNNXBMFYSA-N 1 1 364.446 2.690 20 5 FFBDMO Cc1cc(N2CCC(NC(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2)nc(C)[nH+]1 ZINC000174882426 510362824 /nfs/dbraw/zinc/36/28/24/510362824.db2.gz IZMLKLIKLIKWHP-UHFFFAOYSA-N 1 1 369.425 2.709 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCC[N@H+]2CCc3ccccc3C2)c1[N+](=O)[O-] ZINC000269400131 510385334 /nfs/dbraw/zinc/38/53/34/510385334.db2.gz SUPMMFLWIBBLFR-UHFFFAOYSA-N 1 1 371.441 2.620 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] ZINC000194604516 510442845 /nfs/dbraw/zinc/44/28/45/510442845.db2.gz XMDINQNFFPWQEP-UHFFFAOYSA-N 1 1 357.410 2.855 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000178142253 510454254 /nfs/dbraw/zinc/45/42/54/510454254.db2.gz MHKGWQAODARLPG-CQSZACIVSA-N 1 1 361.442 2.874 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+](C)Cc2nccs2)c([N+](=O)[O-])c1 ZINC000175061588 510464844 /nfs/dbraw/zinc/46/48/44/510464844.db2.gz PQEOWPNTSIBQCX-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2nccs2)c([N+](=O)[O-])c1 ZINC000175061588 510464851 /nfs/dbraw/zinc/46/48/51/510464851.db2.gz PQEOWPNTSIBQCX-UHFFFAOYSA-N 1 1 350.400 2.521 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](CO)c1ccccc1 ZINC000269641270 510494931 /nfs/dbraw/zinc/49/49/31/510494931.db2.gz XTIZVEQXLPVNGK-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO COc1cc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000181673174 510532431 /nfs/dbraw/zinc/53/24/31/510532431.db2.gz AAGRVIRNFKFMGS-DZGCQCFKSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000181680569 510537660 /nfs/dbraw/zinc/53/76/60/510537660.db2.gz MPPLLRGRYPPENR-GJZGRUSLSA-N 1 1 361.442 2.743 20 5 FFBDMO CSc1cccc(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000188030783 510558192 /nfs/dbraw/zinc/55/81/92/510558192.db2.gz KJAQPZHOCODEBQ-BETUJISGSA-N 1 1 367.471 2.546 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2CCC2CCCCC2)c1 ZINC000246732955 510641623 /nfs/dbraw/zinc/64/16/23/510641623.db2.gz GHNBWRONIIIFGP-WMZOPIPTSA-N 1 1 350.463 2.977 20 5 FFBDMO CN(Cc1csc([N+](=O)[O-])c1)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188322969 510709485 /nfs/dbraw/zinc/70/94/85/510709485.db2.gz DFAKYJLRNJINMY-SFHVURJKSA-N 1 1 361.467 2.725 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C ZINC000178730436 510742495 /nfs/dbraw/zinc/74/24/95/510742495.db2.gz HIGNNOBBQDMSSD-KXBFYZLASA-N 1 1 370.453 2.999 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C ZINC000178730436 510742502 /nfs/dbraw/zinc/74/25/02/510742502.db2.gz HIGNNOBBQDMSSD-KXBFYZLASA-N 1 1 370.453 2.999 20 5 FFBDMO CC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000172541803 510781783 /nfs/dbraw/zinc/78/17/83/510781783.db2.gz YZQUDROFSWJNQW-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO O=C1[C@H]([NH+]2CCC(c3ccncc3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000191679512 510783633 /nfs/dbraw/zinc/78/36/33/510783633.db2.gz VXFMGICLCPHWAP-LJQANCHMSA-N 1 1 366.421 2.975 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182166300 510790877 /nfs/dbraw/zinc/79/08/77/510790877.db2.gz DVPPQRMRQRQZJN-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182166300 510790884 /nfs/dbraw/zinc/79/08/84/510790884.db2.gz DVPPQRMRQRQZJN-CQSZACIVSA-N 1 1 353.850 2.792 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[NH+]1CCOCC1 ZINC000195337903 510791237 /nfs/dbraw/zinc/79/12/37/510791237.db2.gz ORBHFXWVHBMDME-UHFFFAOYSA-N 1 1 359.430 2.564 20 5 FFBDMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000247070994 510825502 /nfs/dbraw/zinc/82/55/02/510825502.db2.gz IWOGOPDOCXJNGW-GDBMZVCRSA-N 1 1 360.458 2.654 20 5 FFBDMO CC(C)(C)c1ccc2c(c1)C[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC2 ZINC000182251033 510833783 /nfs/dbraw/zinc/83/37/83/510833783.db2.gz XXUVGIZGMQRLKS-GOSISDBHSA-N 1 1 358.442 2.508 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000247440252 510860967 /nfs/dbraw/zinc/86/09/67/510860967.db2.gz WRKFBIYPXKWIRK-IRXDYDNUSA-N 1 1 372.469 2.751 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000360305679 510894319 /nfs/dbraw/zinc/89/43/19/510894319.db2.gz LSDPPFIOFGGIGM-HNNXBMFYSA-N 1 1 371.441 2.845 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000360341610 510900238 /nfs/dbraw/zinc/90/02/38/510900238.db2.gz GOUYEPYYYAUQFJ-VXGBXAGGSA-N 1 1 368.231 2.714 20 5 FFBDMO CC(C)C(=O)NC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000270582637 510913615 /nfs/dbraw/zinc/91/36/15/510913615.db2.gz IWCZOXZATDLMGS-UHFFFAOYSA-N 1 1 372.425 2.986 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000279381558 511062947 /nfs/dbraw/zinc/06/29/47/511062947.db2.gz VAFJGJCBGCYDKB-GXSJLCMTSA-N 1 1 355.797 2.671 20 5 FFBDMO C[C@H](NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000279627740 511151363 /nfs/dbraw/zinc/15/13/63/511151363.db2.gz IGNVYBXIAGSCSL-JTQLQIEISA-N 1 1 355.797 2.696 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](CO)c2ccccc2)c([N+](=O)[O-])c1 ZINC000298067062 511165181 /nfs/dbraw/zinc/16/51/81/511165181.db2.gz JFXPPOAQIITTSX-SFHVURJKSA-N 1 1 373.409 2.597 20 5 FFBDMO CN(C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)[C@H]1C[NH+]2CCC1CC2 ZINC000333016999 511178608 /nfs/dbraw/zinc/17/86/08/511178608.db2.gz CKENVBHGXZILLK-FQEVSTJZSA-N 1 1 361.445 2.848 20 5 FFBDMO COc1cccc(CNC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271577760 511251109 /nfs/dbraw/zinc/25/11/09/511251109.db2.gz BGYSZSSVMZSJQA-ZIAGYGMSSA-N 1 1 357.410 2.959 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[NH2+]C2(c3c(Cl)cccc3Cl)CC2)c1 ZINC000271788232 511323969 /nfs/dbraw/zinc/32/39/69/511323969.db2.gz MHWDMXJDYGIXDI-NSHDSACASA-N 1 1 371.224 2.738 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000271796599 511327546 /nfs/dbraw/zinc/32/75/46/511327546.db2.gz VUZXTNMLPWOXBG-GFCCVEGCSA-N 1 1 359.382 2.901 20 5 FFBDMO C[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000295278610 511346206 /nfs/dbraw/zinc/34/62/06/511346206.db2.gz IIMVVQJILXNPBF-BBRMVZONSA-N 1 1 369.425 2.684 20 5 FFBDMO Cc1nc(NCc2cccc(C[N@@H+]3CCO[C@@H](C)C3)c2)ncc1[N+](=O)[O-] ZINC000295446859 511408275 /nfs/dbraw/zinc/40/82/75/511408275.db2.gz GXJUNHODPDPQDP-ZDUSSCGKSA-N 1 1 357.414 2.526 20 5 FFBDMO Cc1nc(NCc2cccc(C[N@H+]3CCO[C@@H](C)C3)c2)ncc1[N+](=O)[O-] ZINC000295446859 511408278 /nfs/dbraw/zinc/40/82/78/511408278.db2.gz GXJUNHODPDPQDP-ZDUSSCGKSA-N 1 1 357.414 2.526 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@](C)(OC)CC2)c([N+](=O)[O-])c1 ZINC000280355272 511434748 /nfs/dbraw/zinc/43/47/48/511434748.db2.gz JJSVBVYEDBWTGN-SFHVURJKSA-N 1 1 365.430 2.823 20 5 FFBDMO COc1ccc(CNC(=O)NCCCNc2ccc(C)c[nH+]2)cc1[N+](=O)[O-] ZINC000298934430 511456777 /nfs/dbraw/zinc/45/67/77/511456777.db2.gz NCXYSVOIEUWWBD-UHFFFAOYSA-N 1 1 373.413 2.608 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCOC[C@@H](C4CCC4)C3)n2)c1 ZINC000292085066 511459583 /nfs/dbraw/zinc/45/95/83/511459583.db2.gz GCUUFNVVAHCYOO-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)n2)c1 ZINC000292085066 511459586 /nfs/dbraw/zinc/45/95/86/511459586.db2.gz GCUUFNVVAHCYOO-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO CC(C)([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000292249580 511522004 /nfs/dbraw/zinc/52/20/04/511522004.db2.gz XNWBSFOGSXQPGT-IAGOWNOFSA-N 1 1 361.442 2.590 20 5 FFBDMO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)NCC1CCCC1 ZINC000283882761 511531500 /nfs/dbraw/zinc/53/15/00/511531500.db2.gz ASBDDNPVODNLRG-UHFFFAOYSA-N 1 1 364.402 2.678 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1 ZINC000299220964 511556200 /nfs/dbraw/zinc/55/62/00/511556200.db2.gz LXFVLMKNCOMMOF-HNNXBMFYSA-N 1 1 361.398 2.684 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000365738131 511629566 /nfs/dbraw/zinc/62/95/66/511629566.db2.gz GSIQZPFMMMFERD-IRXDYDNUSA-N 1 1 366.421 2.584 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)c1 ZINC000365841944 511681955 /nfs/dbraw/zinc/68/19/55/511681955.db2.gz PAZKGTREQWRUQX-NHCUHLMSSA-N 1 1 370.449 2.945 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC3(CCOCC3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000363792670 511771425 /nfs/dbraw/zinc/77/14/25/511771425.db2.gz GBQFNQCPIRNLIB-AWEZNQCLSA-N 1 1 350.415 2.873 20 5 FFBDMO CNc1c(C(=O)N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000312486251 511784839 /nfs/dbraw/zinc/78/48/39/511784839.db2.gz JJYZMJKFCKGZDB-MRXNPFEDSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCCO[C@@H](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000293042150 511817846 /nfs/dbraw/zinc/81/78/46/511817846.db2.gz HCXVEFMWNQGFMO-QGZVFWFLSA-N 1 1 365.430 2.679 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[N@H+](C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696808 511858842 /nfs/dbraw/zinc/85/88/42/511858842.db2.gz KNPFAUCKJDUSMX-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCN(C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696808 511858847 /nfs/dbraw/zinc/85/88/47/511858847.db2.gz KNPFAUCKJDUSMX-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCN(C3CC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000296696808 511858854 /nfs/dbraw/zinc/85/88/54/511858854.db2.gz KNPFAUCKJDUSMX-CQSZACIVSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@@H]1CN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1 ZINC000293159652 511863013 /nfs/dbraw/zinc/86/30/13/511863013.db2.gz CHKIPYUIBVXCPY-HNNXBMFYSA-N 1 1 360.458 2.653 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CCCO[C@H](C(C)C)C1 ZINC000293184523 511873503 /nfs/dbraw/zinc/87/35/03/511873503.db2.gz PVSMCQGOIMXBLZ-GUYCJALGSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000293184523 511873508 /nfs/dbraw/zinc/87/35/08/511873508.db2.gz PVSMCQGOIMXBLZ-GUYCJALGSA-N 1 1 365.430 2.677 20 5 FFBDMO CCc1nn(C)c(N2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000281868323 511994490 /nfs/dbraw/zinc/99/44/90/511994490.db2.gz KQRLTESMTWHKOX-ZDUSSCGKSA-N 1 1 358.446 2.808 20 5 FFBDMO CCc1nn(C)c(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1[N+](=O)[O-] ZINC000281868318 511994749 /nfs/dbraw/zinc/99/47/49/511994749.db2.gz KQRLTESMTWHKOX-CYBMUJFWSA-N 1 1 358.446 2.808 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000281880850 511999230 /nfs/dbraw/zinc/99/92/30/511999230.db2.gz GFDHKYZXBQTVLU-QWHCGFSZSA-N 1 1 350.419 2.940 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H](c3nccn3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000377890444 512500491 /nfs/dbraw/zinc/50/04/91/512500491.db2.gz VHFLFAAHJNITDD-OAHLLOKOSA-N 1 1 366.425 2.718 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000369731860 512578577 /nfs/dbraw/zinc/57/85/77/512578577.db2.gz LOVJSWQFDTZADA-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)c([N+](=O)[O-])cc1F ZINC000372009631 512677264 /nfs/dbraw/zinc/67/72/64/512677264.db2.gz LCBLZWIOZZYHMI-ZDUSSCGKSA-N 1 1 368.405 2.760 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCOC2(CCOCC2)CC1 ZINC000372202545 512759813 /nfs/dbraw/zinc/75/98/13/512759813.db2.gz BKOSPYBRMVYCOC-UHFFFAOYSA-N 1 1 350.415 2.765 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCOC2(CCOCC2)CC1 ZINC000372202545 512759818 /nfs/dbraw/zinc/75/98/18/512759818.db2.gz BKOSPYBRMVYCOC-UHFFFAOYSA-N 1 1 350.415 2.765 20 5 FFBDMO COC[C@H]1CCCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000376370615 512788855 /nfs/dbraw/zinc/78/88/55/512788855.db2.gz RJSLPWOVFINBLA-KGLIPLIRSA-N 1 1 365.430 2.679 20 5 FFBDMO CNc1c(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000389892134 512903222 /nfs/dbraw/zinc/90/32/22/512903222.db2.gz WOLVNSRVWOVZMD-RHSMWYFYSA-N 1 1 368.437 2.887 20 5 FFBDMO C[C@H]1C[C@@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[N@H+]1Cc1ccccc1 ZINC000397984486 512951740 /nfs/dbraw/zinc/95/17/40/512951740.db2.gz NSYJWHNOGIFWFJ-DZGCQCFKSA-N 1 1 351.410 2.968 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](Cc2ccncc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000368487031 512970352 /nfs/dbraw/zinc/97/03/52/512970352.db2.gz RCFLFPRQKZPUNB-INIZCTEOSA-N 1 1 354.410 2.883 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H](C)[N@@H+]1C ZINC000408169666 513013193 /nfs/dbraw/zinc/01/31/93/513013193.db2.gz SNVNTCUFRZVSKZ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2Br)C[C@H](C)[N@H+]1C ZINC000408169666 513013190 /nfs/dbraw/zinc/01/31/90/513013190.db2.gz SNVNTCUFRZVSKZ-AOOOYVTPSA-N 1 1 356.220 2.522 20 5 FFBDMO Cc1cc(-c2noc([C@H](C)[NH2+]CCn3cc([N+](=O)[O-])cn3)n2)ccc1F ZINC000370708090 513064298 /nfs/dbraw/zinc/06/42/98/513064298.db2.gz IIKGYONQPRLRPF-NSHDSACASA-N 1 1 360.349 2.640 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000433828104 513161063 /nfs/dbraw/zinc/16/10/63/513161063.db2.gz HMYGITCQCIOKOP-CYBMUJFWSA-N 1 1 351.451 2.683 20 5 FFBDMO Cc1c(Br)c(N2CC[N@@H+](C3CC3)C[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000450550367 513247234 /nfs/dbraw/zinc/24/72/34/513247234.db2.gz XIWCBZUBUXEGPJ-SNVBAGLBSA-N 1 1 369.263 2.981 20 5 FFBDMO Cc1c(Br)c(N2CC[N@H+](C3CC3)C[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000450550367 513247239 /nfs/dbraw/zinc/24/72/39/513247239.db2.gz XIWCBZUBUXEGPJ-SNVBAGLBSA-N 1 1 369.263 2.981 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434418872 513318757 /nfs/dbraw/zinc/31/87/57/513318757.db2.gz GGWGZBXFBIBAOZ-SFHVURJKSA-N 1 1 360.458 2.920 20 5 FFBDMO C[C@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cc3C(F)(F)F)CC2)CCO1 ZINC000413073872 513426891 /nfs/dbraw/zinc/42/68/91/513426891.db2.gz IUAIADYQSGHWRD-NSHDSACASA-N 1 1 374.363 2.698 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000440928374 513439732 /nfs/dbraw/zinc/43/97/32/513439732.db2.gz YIYQKTJDPIITIT-NTZNESFSSA-N 1 1 367.833 2.757 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000440928371 513440080 /nfs/dbraw/zinc/44/00/80/513440080.db2.gz YIYQKTJDPIITIT-GMXVVIOVSA-N 1 1 367.833 2.757 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413137862 513473081 /nfs/dbraw/zinc/47/30/81/513473081.db2.gz OZELZLRJPQLJMU-SFHVURJKSA-N 1 1 369.469 2.749 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000434960589 513476491 /nfs/dbraw/zinc/47/64/91/513476491.db2.gz VEZANKJCEDEKLJ-KRWDZBQOSA-N 1 1 362.817 2.692 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000425286450 513491702 /nfs/dbraw/zinc/49/17/02/513491702.db2.gz YFTAQKUEENYSCU-UHFFFAOYSA-N 1 1 362.352 2.556 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C2CC2)C[C@@H](C)C1 ZINC000451087480 513510171 /nfs/dbraw/zinc/51/01/71/513510171.db2.gz OBQFDZFSBYAIKJ-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C2CC2)C[C@@H](C)C1 ZINC000451087480 513510180 /nfs/dbraw/zinc/51/01/80/513510180.db2.gz OBQFDZFSBYAIKJ-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C2CC2)C[C@@H](C)C1 ZINC000451087480 513510187 /nfs/dbraw/zinc/51/01/87/513510187.db2.gz OBQFDZFSBYAIKJ-AWEZNQCLSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000441276560 513525706 /nfs/dbraw/zinc/52/57/06/513525706.db2.gz KLSHLTGQLWKRBZ-IAQYHMDHSA-N 1 1 372.347 2.864 20 5 FFBDMO COc1cc(CN2CCC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000425357898 513528636 /nfs/dbraw/zinc/52/86/36/513528636.db2.gz PPTFEIHVZCOZPE-SMDDNHRTSA-N 1 1 371.384 2.731 20 5 FFBDMO CCC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccccc1OC ZINC000441289771 513532059 /nfs/dbraw/zinc/53/20/59/513532059.db2.gz VHFJHCXESKTZDD-GOEBONIOSA-N 1 1 362.430 2.634 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(=NCCC[N@H+]3CCc4ccccc4C3)[nH]c2c1 ZINC000447676860 513540344 /nfs/dbraw/zinc/54/03/44/513540344.db2.gz DGXLSZQFWHEDDV-UHFFFAOYSA-N 1 1 351.410 2.753 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000447689158 513545080 /nfs/dbraw/zinc/54/50/80/513545080.db2.gz ONPGVYKEJDXTNG-UHFFFAOYSA-N 1 1 367.409 2.802 20 5 FFBDMO C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1(C(N)=O)CCCC1 ZINC000425416359 513552893 /nfs/dbraw/zinc/55/28/93/513552893.db2.gz GFUGJZXPUKBWHA-UHFFFAOYSA-N 1 1 356.220 2.587 20 5 FFBDMO COc1cc(CN2CCC([C@H](C)[NH3+])CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000435369857 513567655 /nfs/dbraw/zinc/56/76/55/513567655.db2.gz NEJRZHSRACFVMI-NSHDSACASA-N 1 1 373.400 2.807 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](C[C@@H]2CCCO2)C2CCCC2)c1 ZINC000441438327 513567745 /nfs/dbraw/zinc/56/77/45/513567745.db2.gz JMKKKFVKAHQLBA-HKUYNNGSSA-N 1 1 364.442 2.758 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1)C(N)=O ZINC000451213245 513597255 /nfs/dbraw/zinc/59/72/55/513597255.db2.gz DNCOXWANUYJPAN-LBPRGKRZSA-N 1 1 359.430 2.585 20 5 FFBDMO CC(C)(C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1)C(N)=O ZINC000451213245 513597264 /nfs/dbraw/zinc/59/72/64/513597264.db2.gz DNCOXWANUYJPAN-LBPRGKRZSA-N 1 1 359.430 2.585 20 5 FFBDMO Cn1cc(C[N@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccc(Cl)cc2)cn1 ZINC000430252928 513600192 /nfs/dbraw/zinc/60/01/92/513600192.db2.gz HADPJGWPVVJJOR-UHFFFAOYSA-N 1 1 374.832 2.881 20 5 FFBDMO Cn1cc(C[N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccc(Cl)cc2)cn1 ZINC000430252928 513600196 /nfs/dbraw/zinc/60/01/96/513600196.db2.gz HADPJGWPVVJJOR-UHFFFAOYSA-N 1 1 374.832 2.881 20 5 FFBDMO COc1cccc(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000435658131 513649498 /nfs/dbraw/zinc/64/94/98/513649498.db2.gz YKXQVHNZEZHWAA-OAHLLOKOSA-N 1 1 355.394 2.608 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@@H]3O)n2)c1 ZINC000451420466 513740087 /nfs/dbraw/zinc/74/00/87/513740087.db2.gz PAHHYBSWNYBGRH-XHSDSOJGSA-N 1 1 358.398 2.770 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000451430620 513747784 /nfs/dbraw/zinc/74/77/84/513747784.db2.gz YCBHJHSWOBHVIA-OLMNPRSZSA-N 1 1 361.442 2.857 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[N@H+]2C2CCCCC2)c1[N+](=O)[O-] ZINC000436234369 513803702 /nfs/dbraw/zinc/80/37/02/513803702.db2.gz XBRJUDPMPWQGPP-CQSZACIVSA-N 1 1 363.462 2.968 20 5 FFBDMO CCO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C ZINC000451540410 513820040 /nfs/dbraw/zinc/82/00/40/513820040.db2.gz KWARWSLLMSQAOD-CZUORRHYSA-N 1 1 365.430 2.679 20 5 FFBDMO O=c1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc2ccccn12 ZINC000451554058 513829641 /nfs/dbraw/zinc/82/96/41/513829641.db2.gz YWUWKWYRMLQBNM-INIZCTEOSA-N 1 1 364.405 2.982 20 5 FFBDMO Cc1cc(NC(=O)CC[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000451569251 513840871 /nfs/dbraw/zinc/84/08/71/513840871.db2.gz OOYVPLUWLXXFPM-HNNXBMFYSA-N 1 1 358.398 2.521 20 5 FFBDMO C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H]1C ZINC000448697174 513851071 /nfs/dbraw/zinc/85/10/71/513851071.db2.gz LFKBBLCFFQQHBF-LSDHHAIUSA-N 1 1 361.442 2.937 20 5 FFBDMO O=C(c1cc(C(F)(F)F)ccc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1 ZINC000448745995 513877794 /nfs/dbraw/zinc/87/77/94/513877794.db2.gz TXNNRYTYDCCAGO-UHFFFAOYSA-N 1 1 357.332 2.781 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]2CCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000426236579 513879663 /nfs/dbraw/zinc/87/96/63/513879663.db2.gz JTVQMQOMGOQLHL-LBPRGKRZSA-N 1 1 360.357 2.594 20 5 FFBDMO CC(C)[N@@H+](C)CCCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431504100 513912829 /nfs/dbraw/zinc/91/28/29/513912829.db2.gz ZKZKPECFITWGKE-UHFFFAOYSA-N 1 1 358.236 2.817 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H]4C[C@H](O)CC[C@@H]4C3)o2)cc1 ZINC000451714594 513933472 /nfs/dbraw/zinc/93/34/72/513933472.db2.gz SIBCTDXKSSOTIX-IIAWOOMASA-N 1 1 358.398 2.628 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@H]1CC[C@H](C[NH3+])CC1)c1cccc([N+](=O)[O-])c1 ZINC000423422508 514137524 /nfs/dbraw/zinc/13/75/24/514137524.db2.gz LGLWZWGTDAHOKZ-MPGHIAIKSA-N 1 1 357.458 2.772 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@H](C(=O)N(C)C)C3)o2)c([N+](=O)[O-])c1 ZINC000414494906 514148703 /nfs/dbraw/zinc/14/87/03/514148703.db2.gz FVTCZZZQOOGYGY-ZDUSSCGKSA-N 1 1 373.409 2.774 20 5 FFBDMO COc1ccc(C[N@@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422710 514205940 /nfs/dbraw/zinc/20/59/40/514205940.db2.gz NHOPBVPXGKQRMN-APWZRJJASA-N 1 1 360.385 2.903 20 5 FFBDMO COc1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1[N+](=O)[O-] ZINC000449422710 514205941 /nfs/dbraw/zinc/20/59/41/514205941.db2.gz NHOPBVPXGKQRMN-APWZRJJASA-N 1 1 360.385 2.903 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cc1[N+](=O)[O-] ZINC000449452308 514214514 /nfs/dbraw/zinc/21/45/14/514214514.db2.gz UHIKSMVXWOIAMV-OLPIVMHESA-N 1 1 372.421 2.791 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000414656225 514224825 /nfs/dbraw/zinc/22/48/25/514224825.db2.gz ICFFGNRCKLKNCR-INIZCTEOSA-N 1 1 356.382 2.782 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000449542637 514247324 /nfs/dbraw/zinc/24/73/24/514247324.db2.gz QUYKEFHRFITTCE-HNAYVOBHSA-N 1 1 360.410 2.767 20 5 FFBDMO Cc1cc(NCCC[N@@H+]2CCCO[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000432865826 514304853 /nfs/dbraw/zinc/30/48/53/514304853.db2.gz MMRAOCFFWOOVMD-OAHLLOKOSA-N 1 1 358.442 2.786 20 5 FFBDMO Cc1cc(NCCC[N@H+]2CCCO[C@H](C)C2)c2cc([N+](=O)[O-])ccc2n1 ZINC000432865826 514304858 /nfs/dbraw/zinc/30/48/58/514304858.db2.gz MMRAOCFFWOOVMD-OAHLLOKOSA-N 1 1 358.442 2.786 20 5 FFBDMO O=C(c1cc([O-])cc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000427915344 514344635 /nfs/dbraw/zinc/34/46/35/514344635.db2.gz JHFGRLDTYAZVHO-UHFFFAOYSA-N 1 1 355.394 2.649 20 5 FFBDMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000427915344 514344645 /nfs/dbraw/zinc/34/46/45/514344645.db2.gz JHFGRLDTYAZVHO-UHFFFAOYSA-N 1 1 355.394 2.649 20 5 FFBDMO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]3COC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449781605 514351700 /nfs/dbraw/zinc/35/17/00/514351700.db2.gz IULYHKCLPRLFRA-SJORKVTESA-N 1 1 356.426 2.852 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](C2CCCC2)C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000420963289 514405031 /nfs/dbraw/zinc/40/50/31/514405031.db2.gz MYCXYGRBFAEQAY-ZDUSSCGKSA-N 1 1 361.398 2.774 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCSC1 ZINC000433182037 514410122 /nfs/dbraw/zinc/41/01/22/514410122.db2.gz LSRWJNFIYNOUFI-OAHLLOKOSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCSC1 ZINC000433182037 514410132 /nfs/dbraw/zinc/41/01/32/514410132.db2.gz LSRWJNFIYNOUFI-OAHLLOKOSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433192936 514416280 /nfs/dbraw/zinc/41/62/80/514416280.db2.gz IFTXCTFRBXEGLO-CQSZACIVSA-N 1 1 370.471 2.826 20 5 FFBDMO COc1cc(CN(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000421006124 514435267 /nfs/dbraw/zinc/43/52/67/514435267.db2.gz PRPLULZHRYVACM-CYBMUJFWSA-N 1 1 373.400 2.773 20 5 FFBDMO Cc1c(CC(=O)N2CC[NH+](CCc3cccs3)CC2)cccc1[N+](=O)[O-] ZINC000438893121 514461506 /nfs/dbraw/zinc/46/15/06/514461506.db2.gz FPYUNZRGCXDOQK-UHFFFAOYSA-N 1 1 373.478 2.894 20 5 FFBDMO NC(=O)c1cccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000439098499 514493172 /nfs/dbraw/zinc/49/31/72/514493172.db2.gz JMJYFWSITUNVBY-OAHLLOKOSA-N 1 1 354.410 2.770 20 5 FFBDMO C[NH+](C)Cc1cc(C(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)no1 ZINC000452838266 514511575 /nfs/dbraw/zinc/51/15/75/514511575.db2.gz FNQMBRHMXHZJOE-CQSZACIVSA-N 1 1 358.398 2.664 20 5 FFBDMO CCC[C@H]1CN(Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000466199517 514573796 /nfs/dbraw/zinc/57/37/96/514573796.db2.gz DTXJJFMJHWJQHV-HNNXBMFYSA-N 1 1 369.437 2.675 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1 ZINC000475314503 514616181 /nfs/dbraw/zinc/61/61/81/514616181.db2.gz UQYFBCFEAFFGII-INIZCTEOSA-N 1 1 369.421 2.950 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000461544595 514651822 /nfs/dbraw/zinc/65/18/22/514651822.db2.gz JZRFADMXTJXWJJ-AWEZNQCLSA-N 1 1 359.430 2.631 20 5 FFBDMO Cc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000489179377 514740182 /nfs/dbraw/zinc/74/01/82/514740182.db2.gz ZAEKPCMZZXICNV-RDJZCZTQSA-N 1 1 353.426 2.821 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]1(CO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000475668398 514753680 /nfs/dbraw/zinc/75/36/80/514753680.db2.gz QODPDERMCGNAPQ-FQEVSTJZSA-N 1 1 369.421 2.603 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]1(CO)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000475668398 514753687 /nfs/dbraw/zinc/75/36/87/514753687.db2.gz QODPDERMCGNAPQ-FQEVSTJZSA-N 1 1 369.421 2.603 20 5 FFBDMO COc1cc(C[NH+]2CCC(NC(=O)c3ccoc3C)CC2)ccc1[N+](=O)[O-] ZINC000489226266 514759602 /nfs/dbraw/zinc/75/96/02/514759602.db2.gz RCBIPEHVPVXJCE-UHFFFAOYSA-N 1 1 373.409 2.899 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000471281328 514824393 /nfs/dbraw/zinc/82/43/93/514824393.db2.gz CWNNANFVGSDXCV-HNNXBMFYSA-N 1 1 357.385 2.986 20 5 FFBDMO COc1cc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c([N+](=O)[O-])cc1OC ZINC000502959594 514859123 /nfs/dbraw/zinc/85/91/23/514859123.db2.gz LNSRAZNOITZMIA-UHFFFAOYSA-N 1 1 356.338 2.820 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000471387919 514862853 /nfs/dbraw/zinc/86/28/53/514862853.db2.gz LDZVLFXROANKTO-KDURUIRLSA-N 1 1 365.433 2.728 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000485074470 514901125 /nfs/dbraw/zinc/90/11/25/514901125.db2.gz NYFFTTGVCHWFHD-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000485074470 514901134 /nfs/dbraw/zinc/90/11/34/514901134.db2.gz NYFFTTGVCHWFHD-AWEZNQCLSA-N 1 1 373.409 2.941 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](S(C)(=O)=O)CC1 ZINC000503074084 514907842 /nfs/dbraw/zinc/90/78/42/514907842.db2.gz KBPNVHAVFOKBNB-IFCKCIONSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](S(C)(=O)=O)CC1 ZINC000503074084 514907852 /nfs/dbraw/zinc/90/78/52/514907852.db2.gz KBPNVHAVFOKBNB-IFCKCIONSA-N 1 1 352.456 2.897 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1C ZINC000467222029 514944340 /nfs/dbraw/zinc/94/43/40/514944340.db2.gz GMIDNMPSLNUMNG-NWDGAFQWSA-N 1 1 354.838 2.872 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCOc2ccccc21)CCc1cccc([N+](=O)[O-])c1 ZINC000503265396 514985241 /nfs/dbraw/zinc/98/52/41/514985241.db2.gz OREIUOGIPVAAEA-UHFFFAOYSA-N 1 1 369.421 2.885 20 5 FFBDMO CCN(C(=O)c1cc([N+](=O)[O-])nn1C)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000476381879 515027362 /nfs/dbraw/zinc/02/73/62/515027362.db2.gz YEYXDRGEKZQOAK-HOCLYGCPSA-N 1 1 371.441 2.626 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000489946956 515042895 /nfs/dbraw/zinc/04/28/95/515042895.db2.gz RGJWHKVRAFUAGL-RLFYNMQTSA-N 1 1 360.458 2.509 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000503483698 515050533 /nfs/dbraw/zinc/05/05/33/515050533.db2.gz CGOIJAWPSTVNCE-OAHLLOKOSA-N 1 1 372.425 2.755 20 5 FFBDMO COc1c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000476538285 515092332 /nfs/dbraw/zinc/09/23/32/515092332.db2.gz CDBWJXFFTUZTGB-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO CC(=O)N[C@@H](C)C1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000481133436 515218120 /nfs/dbraw/zinc/21/81/20/515218120.db2.gz AXOVFQIZWICMLV-ZDUSSCGKSA-N 1 1 372.425 2.986 20 5 FFBDMO O=C(C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)NC1CC1 ZINC000504129783 515226981 /nfs/dbraw/zinc/22/69/81/515226981.db2.gz AYFZBUMSDXNVEF-UHFFFAOYSA-N 1 1 359.357 2.894 20 5 FFBDMO O=C(Nc1ccccc1)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccccc1 ZINC000472436757 515270401 /nfs/dbraw/zinc/27/04/01/515270401.db2.gz WKWRCTPPTZRUNO-SFHVURJKSA-N 1 1 365.393 2.761 20 5 FFBDMO COc1cc[nH+]c(N2CCN(Cc3c(F)cc([N+](=O)[O-])cc3F)CC2)c1 ZINC000509685072 515289601 /nfs/dbraw/zinc/28/96/01/515289601.db2.gz MOBGKSYQDSTWEJ-UHFFFAOYSA-N 1 1 364.352 2.599 20 5 FFBDMO Cn1c(C(=O)Nc2ccccc2C[NH+]2CCSCC2)ccc1[N+](=O)[O-] ZINC000499337361 515291815 /nfs/dbraw/zinc/29/18/15/515291815.db2.gz KXWKXKHBWWXTHJ-UHFFFAOYSA-N 1 1 360.439 2.734 20 5 FFBDMO CC[C@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000486037263 515306633 /nfs/dbraw/zinc/30/66/33/515306633.db2.gz SHFVOMXGSBWDCR-INIZCTEOSA-N 1 1 356.426 2.601 20 5 FFBDMO CC[C@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CCO1 ZINC000486037263 515306637 /nfs/dbraw/zinc/30/66/37/515306637.db2.gz SHFVOMXGSBWDCR-INIZCTEOSA-N 1 1 356.426 2.601 20 5 FFBDMO CC[N@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000463039310 515343185 /nfs/dbraw/zinc/34/31/85/515343185.db2.gz SODIHXSGGPHSCD-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000463039310 515343196 /nfs/dbraw/zinc/34/31/96/515343196.db2.gz SODIHXSGGPHSCD-LBPRGKRZSA-N 1 1 360.357 2.858 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000486145185 515351536 /nfs/dbraw/zinc/35/15/36/515351536.db2.gz NLRKKIXMDGLIFX-YUMQZZPRSA-N 1 1 362.249 2.631 20 5 FFBDMO C[C@H]1[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000486145185 515351544 /nfs/dbraw/zinc/35/15/44/515351544.db2.gz NLRKKIXMDGLIFX-YUMQZZPRSA-N 1 1 362.249 2.631 20 5 FFBDMO Cc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000456687107 515352678 /nfs/dbraw/zinc/35/26/78/515352678.db2.gz FUISKPPGTXBHFL-UHFFFAOYSA-N 1 1 351.451 2.599 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176091 515386905 /nfs/dbraw/zinc/38/69/05/515386905.db2.gz KHDFVUKWMNMOQI-UGSOOPFHSA-N 1 1 355.394 2.551 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000463176091 515386911 /nfs/dbraw/zinc/38/69/11/515386911.db2.gz KHDFVUKWMNMOQI-UGSOOPFHSA-N 1 1 355.394 2.551 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713379 515435402 /nfs/dbraw/zinc/43/54/02/515435402.db2.gz CHGBPTXREABMAM-KGLIPLIRSA-N 1 1 356.806 2.791 20 5 FFBDMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000481713379 515435408 /nfs/dbraw/zinc/43/54/08/515435408.db2.gz CHGBPTXREABMAM-KGLIPLIRSA-N 1 1 356.806 2.791 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510106163 515435750 /nfs/dbraw/zinc/43/57/50/515435750.db2.gz QHCANVBCDIRMNL-TXEJJXNPSA-N 1 1 360.357 2.857 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000510106163 515435758 /nfs/dbraw/zinc/43/57/58/515435758.db2.gz QHCANVBCDIRMNL-TXEJJXNPSA-N 1 1 360.357 2.857 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnnn1-c1ccccc1 ZINC000468636315 515448771 /nfs/dbraw/zinc/44/87/71/515448771.db2.gz ZKBDUSLTSGVLSL-GXDHUFHOSA-N 1 1 350.382 2.764 20 5 FFBDMO CC[C@@H](C)[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(=O)OC ZINC000499787143 515454092 /nfs/dbraw/zinc/45/40/92/515454092.db2.gz SQNLWGHYWIYKCD-CYBMUJFWSA-N 1 1 351.403 2.505 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000463621318 515561565 /nfs/dbraw/zinc/56/15/65/515561565.db2.gz FAFGTROFNKQWHQ-INIZCTEOSA-N 1 1 362.474 2.802 20 5 FFBDMO COc1cc(CN2CC[N@@H+](C)[C@H](C)[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505592543 515599966 /nfs/dbraw/zinc/59/99/66/515599966.db2.gz TUGKJRPHZSOTBQ-NEPJUHHUSA-N 1 1 373.400 2.772 20 5 FFBDMO NC(=O)c1ccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cn1 ZINC000493148522 515602820 /nfs/dbraw/zinc/60/28/20/515602820.db2.gz MNXCOMUJWCEIAJ-LJQANCHMSA-N 1 1 362.389 2.968 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H]2CCC3(CCCCC3)O2)CC1 ZINC000459511494 515608124 /nfs/dbraw/zinc/60/81/24/515608124.db2.gz PKTVQRWCWSVGLF-INIZCTEOSA-N 1 1 360.458 2.994 20 5 FFBDMO COc1cc(CN2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000505627284 515614260 /nfs/dbraw/zinc/61/42/60/515614260.db2.gz BXKANRXTAPVJIS-NEPJUHHUSA-N 1 1 373.400 2.772 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000457088286 515641307 /nfs/dbraw/zinc/64/13/07/515641307.db2.gz RCKCVRZOMANCTR-INIZCTEOSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000493998980 515708682 /nfs/dbraw/zinc/70/86/82/515708682.db2.gz GWLRKXLMLPSGNS-FZKQIMNGSA-N 1 1 355.394 2.693 20 5 FFBDMO C[C@@H]1[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000493998980 515708688 /nfs/dbraw/zinc/70/86/88/515708688.db2.gz GWLRKXLMLPSGNS-FZKQIMNGSA-N 1 1 355.394 2.693 20 5 FFBDMO C[N@@H+](CCCCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000454787326 515742573 /nfs/dbraw/zinc/74/25/73/515742573.db2.gz XOSUQNSEGSXCTF-UHFFFAOYSA-N 1 1 368.865 2.964 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](CN(C)S(C)(=O)=O)C1 ZINC000511124723 515793876 /nfs/dbraw/zinc/79/38/76/515793876.db2.gz LTDUJBQQKDPEOL-CABCVRRESA-N 1 1 369.487 2.568 20 5 FFBDMO C[C@@H](C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C ZINC000459812637 515823541 /nfs/dbraw/zinc/82/35/41/515823541.db2.gz RZHREPVHYGZXIU-STQMWFEESA-N 1 1 365.430 2.831 20 5 FFBDMO O=C(Nc1cc(Br)cc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1 ZINC000501113840 515988072 /nfs/dbraw/zinc/98/80/72/515988072.db2.gz UYNBADPUTOKQDO-UHFFFAOYSA-N 1 1 369.219 2.669 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000469997510 516068989 /nfs/dbraw/zinc/06/89/89/516068989.db2.gz ZYKKEKUDSOQWOE-SWLSCSKDSA-N 1 1 359.382 2.676 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512147839 516174716 /nfs/dbraw/zinc/17/47/16/516174716.db2.gz VJSLXMYJUPBDTD-NWDGAFQWSA-N 1 1 355.822 2.568 20 5 FFBDMO CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000488409762 516218274 /nfs/dbraw/zinc/21/82/74/516218274.db2.gz HPZJXWKCPJVYJF-NSHDSACASA-N 1 1 357.357 2.658 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000507542616 516237744 /nfs/dbraw/zinc/23/77/44/516237744.db2.gz DDTJLUWQHRLMFD-CYBMUJFWSA-N 1 1 369.468 2.546 20 5 FFBDMO Cc1n[nH]c(C(=O)NCC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000512570889 516307252 /nfs/dbraw/zinc/30/72/52/516307252.db2.gz WQMZFVWBSZUBJN-CJNGLKHVSA-N 1 1 371.441 2.657 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)[C@H](c2ccccc2)C1 ZINC000497401296 516320044 /nfs/dbraw/zinc/32/00/44/516320044.db2.gz ZBLNGMAUZWOIOI-HKUYNNGSSA-N 1 1 364.405 2.904 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)cc1C ZINC000497544742 516325918 /nfs/dbraw/zinc/32/59/18/516325918.db2.gz ZVCCAVRVXZRPOZ-IUODEOHRSA-N 1 1 369.487 2.610 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C[C@@H]1C ZINC000497603994 516327736 /nfs/dbraw/zinc/32/77/36/516327736.db2.gz JXXKKPXTMHERES-QWRGUYRKSA-N 1 1 357.357 2.751 20 5 FFBDMO COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000557639662 516353835 /nfs/dbraw/zinc/35/38/35/516353835.db2.gz SBFBJSLDKKPBOG-HOTGVXAUSA-N 1 1 370.409 2.942 20 5 FFBDMO Cc1cc(N2C[C@@H]([NH+]3CCOCC3)C[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000557696344 516388608 /nfs/dbraw/zinc/38/86/08/516388608.db2.gz CLHCLOIWEPIRIO-GJZGRUSLSA-N 1 1 356.426 2.751 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1NCCCN1CCN(c2cc[nH+]cc2)CC1 ZINC000561155957 516413678 /nfs/dbraw/zinc/41/36/78/516413678.db2.gz JNELAKFBJVIILR-UHFFFAOYSA-N 1 1 359.405 2.753 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000554699307 516593277 /nfs/dbraw/zinc/59/32/77/516593277.db2.gz BWJWVVBPLNDRLV-GXTWGEPZSA-N 1 1 371.441 2.543 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000547855508 516600466 /nfs/dbraw/zinc/60/04/66/516600466.db2.gz VURHKAWDNJALDD-GOSISDBHSA-N 1 1 356.426 2.574 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000536076579 516620567 /nfs/dbraw/zinc/62/05/67/516620567.db2.gz HXMWJYWQNRKAFR-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000536076579 516620569 /nfs/dbraw/zinc/62/05/69/516620569.db2.gz HXMWJYWQNRKAFR-INIZCTEOSA-N 1 1 356.382 2.912 20 5 FFBDMO C[C@@H]1CC[C@@]2(CC[N@H+]([C@H]3CC(=O)N(c4cccc([N+](=O)[O-])c4)C3=O)C2)C1 ZINC000540977320 516812781 /nfs/dbraw/zinc/81/27/81/516812781.db2.gz HQKVGPVGTWTIJX-ACWOFJMJSA-N 1 1 357.410 2.739 20 5 FFBDMO NC(=O)c1ccc(C[NH2+][C@H](CCO)c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000561927941 516833851 /nfs/dbraw/zinc/83/38/51/516833851.db2.gz IEZGISBGMKLHOH-OAHLLOKOSA-N 1 1 363.801 2.560 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1 ZINC000532169965 516840406 /nfs/dbraw/zinc/84/04/06/516840406.db2.gz YZQACRUNJQWGCD-RDJZCZTQSA-N 1 1 362.430 2.668 20 5 FFBDMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000551821242 516889195 /nfs/dbraw/zinc/88/91/95/516889195.db2.gz JCEGMQHFOXBBRM-LSDHHAIUSA-N 1 1 359.426 2.742 20 5 FFBDMO CCc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)C(C)(C)C2)c1[N+](=O)[O-] ZINC000536703836 516900134 /nfs/dbraw/zinc/90/01/34/516900134.db2.gz AZOAAULIOLBFCR-UHFFFAOYSA-N 1 1 357.458 2.992 20 5 FFBDMO CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000532392707 516949823 /nfs/dbraw/zinc/94/98/23/516949823.db2.gz YVGOUNAFPVCOPG-UHFFFAOYSA-N 1 1 354.410 2.557 20 5 FFBDMO Cc1ccc(NC(=O)N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000532424059 516969994 /nfs/dbraw/zinc/96/99/94/516969994.db2.gz NLRMJRFAOLNMCN-HZPDHXFCSA-N 1 1 362.430 2.668 20 5 FFBDMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000548455671 516997663 /nfs/dbraw/zinc/99/76/63/516997663.db2.gz KYGLMHWAEBGYCT-UHFFFAOYSA-N 1 1 361.442 2.768 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)Nc1nnc(-c2ccco2)o1)c1cccc([N+](=O)[O-])c1 ZINC000537077775 517030236 /nfs/dbraw/zinc/03/02/36/517030236.db2.gz HVCMICMSBTZIJN-SNVBAGLBSA-N 1 1 357.326 2.527 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CCCOC1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000552062010 517057543 /nfs/dbraw/zinc/05/75/43/517057543.db2.gz IHDHCOYHKMSWRR-SFHVURJKSA-N 1 1 374.441 2.593 20 5 FFBDMO COc1cc(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)cc([N+](=O)[O-])c1OC ZINC000525560306 517076239 /nfs/dbraw/zinc/07/62/39/517076239.db2.gz NVINIKZMKHEPLM-OLZOCXBDSA-N 1 1 365.430 2.605 20 5 FFBDMO COc1ccc(CC(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)cc1[N+](=O)[O-] ZINC000532691299 517100732 /nfs/dbraw/zinc/10/07/32/517100732.db2.gz DXYAPARGEZWGPM-INIZCTEOSA-N 1 1 363.458 2.773 20 5 FFBDMO COC(=O)CCC1CC[NH+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000545222572 517114245 /nfs/dbraw/zinc/11/42/45/517114245.db2.gz AOSPWNLIZGXODC-UHFFFAOYSA-N 1 1 354.378 2.908 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])cc1OC ZINC000552190217 517131199 /nfs/dbraw/zinc/13/11/99/517131199.db2.gz CWKCLRQDWNYIFS-KBPBESRZSA-N 1 1 350.415 2.861 20 5 FFBDMO CC(C)N(CC(F)(F)F)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934361 517312695 /nfs/dbraw/zinc/31/26/95/517312695.db2.gz CBNBWPZISUCEMV-UHFFFAOYSA-N 1 1 361.364 2.868 20 5 FFBDMO CC(C)N(CC(F)(F)F)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548934361 517312704 /nfs/dbraw/zinc/31/27/04/517312704.db2.gz CBNBWPZISUCEMV-UHFFFAOYSA-N 1 1 361.364 2.868 20 5 FFBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000541961284 517313503 /nfs/dbraw/zinc/31/35/03/517313503.db2.gz UETWHDRRQFGBMB-UHFFFAOYSA-N 1 1 368.340 2.863 20 5 FFBDMO C[C@H](C(=O)NC(=O)Nc1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000520257959 517321093 /nfs/dbraw/zinc/32/10/93/517321093.db2.gz SHRCCCJAFDNZLI-CQSZACIVSA-N 1 1 370.409 2.806 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C[C@H]1C ZINC000545830095 517383926 /nfs/dbraw/zinc/38/39/26/517383926.db2.gz QRKSQHVLJBCRKS-CHWSQXEVSA-N 1 1 351.422 2.953 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000520897518 517546539 /nfs/dbraw/zinc/54/65/39/517546539.db2.gz FKJJSBVEUZHZOE-AWEZNQCLSA-N 1 1 357.476 2.610 20 5 FFBDMO Cc1cccc(OCC(=O)N2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000533681849 517569715 /nfs/dbraw/zinc/56/97/15/517569715.db2.gz HFQXZRFRPFFCJE-UHFFFAOYSA-N 1 1 369.421 2.626 20 5 FFBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)[C@H]2CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496331 517595536 /nfs/dbraw/zinc/59/55/36/517595536.db2.gz KXDRLEYQNHKQKO-UCLAIMLFSA-N 1 1 360.410 2.827 20 5 FFBDMO CNC(=O)CC[N@@H+](C)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000538739327 517757743 /nfs/dbraw/zinc/75/77/43/517757743.db2.gz RPOYEMYHWFQSPO-UHFFFAOYSA-N 1 1 356.426 2.931 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)Nc1ccncc1[N+](=O)[O-] ZINC000542837973 517773645 /nfs/dbraw/zinc/77/36/45/517773645.db2.gz GGJCAPBLCXMGAX-HNNXBMFYSA-N 1 1 361.446 2.578 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)Nc1ccncc1[N+](=O)[O-] ZINC000542837974 517774205 /nfs/dbraw/zinc/77/42/05/517774205.db2.gz GGJCAPBLCXMGAX-OAHLLOKOSA-N 1 1 361.446 2.578 20 5 FFBDMO CC(C)(C)C1CC[NH+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000530461361 517788500 /nfs/dbraw/zinc/78/85/00/517788500.db2.gz ZRXXYMBCRJHHLS-MRXNPFEDSA-N 1 1 359.426 2.985 20 5 FFBDMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553600853 517804497 /nfs/dbraw/zinc/80/44/97/517804497.db2.gz BOUNBMUVNLASBH-WCQYABFASA-N 1 1 359.348 2.913 20 5 FFBDMO C[C@@H]1C[C@H](N[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1 ZINC000560524576 517870889 /nfs/dbraw/zinc/87/08/89/517870889.db2.gz GWANERQKUTYDLY-QIIPPGSGSA-N 1 1 355.442 2.633 20 5 FFBDMO CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@@H+]1Cc1ccccc1 ZINC000546820553 517875282 /nfs/dbraw/zinc/87/52/82/517875282.db2.gz XQBOCJPFJDKRTA-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+]1Cc1ccccc1 ZINC000546820553 517875294 /nfs/dbraw/zinc/87/52/94/517875294.db2.gz XQBOCJPFJDKRTA-INIZCTEOSA-N 1 1 356.426 2.670 20 5 FFBDMO C[N@@H+](Cc1ccco1)Cc1ccccc1CNc1ncc([N+](=O)[O-])cn1 ZINC000546880560 517902662 /nfs/dbraw/zinc/90/26/62/517902662.db2.gz BWFMJZSYLJWUAU-UHFFFAOYSA-N 1 1 353.382 2.644 20 5 FFBDMO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000516950036 517934836 /nfs/dbraw/zinc/93/48/36/517934836.db2.gz UWCOKEMFHCNBRH-SFHVURJKSA-N 1 1 350.415 2.885 20 5 FFBDMO C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000557522298 518052830 /nfs/dbraw/zinc/05/28/30/518052830.db2.gz ZMSUSJCIZSQDMV-CYBMUJFWSA-N 1 1 354.410 2.552 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1 ZINC000539502768 518079534 /nfs/dbraw/zinc/07/95/34/518079534.db2.gz VYMOUFKAFWQTIQ-CVEARBPZSA-N 1 1 363.458 2.909 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000531057925 518119127 /nfs/dbraw/zinc/11/91/27/518119127.db2.gz MBHXRYKTFQBBHJ-AWEZNQCLSA-N 1 1 356.426 2.880 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C2(CCCCC2)C1 ZINC000569739764 518266069 /nfs/dbraw/zinc/26/60/69/518266069.db2.gz QJRWFWPTMQHVTN-UHFFFAOYSA-N 1 1 360.458 2.792 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000572872380 518401285 /nfs/dbraw/zinc/40/12/85/518401285.db2.gz WCEGNYPLHFVHCG-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000572872380 518401289 /nfs/dbraw/zinc/40/12/89/518401289.db2.gz WCEGNYPLHFVHCG-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO COC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000581690560 518409140 /nfs/dbraw/zinc/40/91/40/518409140.db2.gz OENKVFCNTDMBDK-HNNXBMFYSA-N 1 1 363.801 2.824 20 5 FFBDMO C[C@@H]1CCSCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000576129022 518444147 /nfs/dbraw/zinc/44/41/47/518444147.db2.gz KPMXUPUMFPTDHE-GFCCVEGCSA-N 1 1 351.428 2.720 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430134 518517398 /nfs/dbraw/zinc/51/73/98/518517398.db2.gz LKKBNSFZWQDLHP-HIFRSBDPSA-N 1 1 352.431 2.841 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC ZINC000567430134 518517403 /nfs/dbraw/zinc/51/74/03/518517403.db2.gz LKKBNSFZWQDLHP-HIFRSBDPSA-N 1 1 352.431 2.841 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000567541547 518575105 /nfs/dbraw/zinc/57/51/05/518575105.db2.gz FDDPGRFOINMXNQ-NVXWUHKLSA-N 1 1 360.385 2.963 20 5 FFBDMO C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)C[C@@H]21 ZINC000585781919 518595311 /nfs/dbraw/zinc/59/53/11/518595311.db2.gz CXXAPYLQXGSABT-IRXDYDNUSA-N 1 1 372.400 2.705 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NCc1ccc(C(=O)N2CC[NH+](C)CC2)cc1 ZINC000573497904 518694923 /nfs/dbraw/zinc/69/49/23/518694923.db2.gz KQIVZPRKTPRERH-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CCc3c[nH+]cn3C2)nc1-c1ccc(F)cc1 ZINC000588067691 518714590 /nfs/dbraw/zinc/71/45/90/518714590.db2.gz JMJWXVGCGKJHQZ-AWEZNQCLSA-N 1 1 353.357 2.841 20 5 FFBDMO CNc1c(C(=O)NCc2cc(C)[nH+]c(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000579538360 518726147 /nfs/dbraw/zinc/72/61/47/518726147.db2.gz JZTFVJYDJXHOHC-UHFFFAOYSA-N 1 1 369.425 2.870 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)NC(=O)NC1CCCC1 ZINC000576791009 518763968 /nfs/dbraw/zinc/76/39/68/518763968.db2.gz NTJFFBOXUILOCS-OAHLLOKOSA-N 1 1 374.441 2.543 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)NC(=O)NC1CCCC1 ZINC000576791009 518763971 /nfs/dbraw/zinc/76/39/71/518763971.db2.gz NTJFFBOXUILOCS-OAHLLOKOSA-N 1 1 374.441 2.543 20 5 FFBDMO Cc1c(Cc2noc(CCCC[NH+]3CCOCC3)n2)cccc1[N+](=O)[O-] ZINC000579644432 518779116 /nfs/dbraw/zinc/77/91/16/518779116.db2.gz GYYJICRREPXJQQ-UHFFFAOYSA-N 1 1 360.414 2.532 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000571007615 518881452 /nfs/dbraw/zinc/88/14/52/518881452.db2.gz SITYXXVWXYVNKO-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000582922267 518987899 /nfs/dbraw/zinc/98/78/99/518987899.db2.gz PTBRBFWJGVAUPP-QGZVFWFLSA-N 1 1 368.437 2.645 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCC(=O)CC23CCC3)c([N+](=O)[O-])c1 ZINC000580089850 519002759 /nfs/dbraw/zinc/00/27/59/519002759.db2.gz BDLQMPGFBRRUMM-UHFFFAOYSA-N 1 1 361.398 2.520 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC(=O)CC23CCC3)c([N+](=O)[O-])c1 ZINC000580089850 519002761 /nfs/dbraw/zinc/00/27/61/519002761.db2.gz BDLQMPGFBRRUMM-UHFFFAOYSA-N 1 1 361.398 2.520 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659907 519152979 /nfs/dbraw/zinc/15/29/79/519152979.db2.gz MRKJNEJDKSRWGL-KXBFYZLASA-N 1 1 366.421 2.893 20 5 FFBDMO Cc1ccnc([C@H]2CC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C2)c1 ZINC000568659907 519152988 /nfs/dbraw/zinc/15/29/88/519152988.db2.gz MRKJNEJDKSRWGL-KXBFYZLASA-N 1 1 366.421 2.893 20 5 FFBDMO C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CC2(CCC2)O1 ZINC000583261120 519159508 /nfs/dbraw/zinc/15/95/08/519159508.db2.gz FVYWZQUWYSIZRY-ZDUSSCGKSA-N 1 1 361.398 2.536 20 5 FFBDMO CSc1ccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000590538038 519259711 /nfs/dbraw/zinc/25/97/11/519259711.db2.gz IOOURGHOERRGPV-QWHCGFSZSA-N 1 1 353.419 2.575 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000590586537 519275813 /nfs/dbraw/zinc/27/58/13/519275813.db2.gz ZIFIOHDPOHSRBD-UHFFFAOYSA-N 1 1 361.364 2.897 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000568928534 519287667 /nfs/dbraw/zinc/28/76/67/519287667.db2.gz UQHRJJHQDAUIGA-NEPJUHHUSA-N 1 1 353.369 2.501 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000578149354 519444578 /nfs/dbraw/zinc/44/45/78/519444578.db2.gz RUGYOVPDLLMFNE-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000578149354 519444582 /nfs/dbraw/zinc/44/45/82/519444582.db2.gz RUGYOVPDLLMFNE-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1Cc1ccccc1 ZINC000578149354 519444593 /nfs/dbraw/zinc/44/45/93/519444593.db2.gz RUGYOVPDLLMFNE-IBGZPJMESA-N 1 1 355.438 2.832 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000566532624 519535288 /nfs/dbraw/zinc/53/52/88/519535288.db2.gz VVDYVERQIJIRTI-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000581243434 519594996 /nfs/dbraw/zinc/59/49/96/519594996.db2.gz BOZYFIASBSZCRK-ROUUACIJSA-N 1 1 357.458 2.882 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-] ZINC000594484095 519992021 /nfs/dbraw/zinc/99/20/21/519992021.db2.gz SAJZTWDXWISUML-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(C[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997776 520012765 /nfs/dbraw/zinc/01/27/65/520012765.db2.gz QMTMYCXSDGZUHM-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000602997776 520012771 /nfs/dbraw/zinc/01/27/71/520012771.db2.gz QMTMYCXSDGZUHM-NOLJZWGESA-N 1 1 367.833 2.812 20 5 FFBDMO O=[N+]([O-])c1cc2c(nc1N1CCC[N@@H+](C[C@H]3CCCO3)CC1)CCCC2 ZINC000591895810 520072611 /nfs/dbraw/zinc/07/26/11/520072611.db2.gz CLZUICORNRYWNN-MRXNPFEDSA-N 1 1 360.458 2.560 20 5 FFBDMO CN(C)c1c(F)c(F)ccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000600156517 520088025 /nfs/dbraw/zinc/08/80/25/520088025.db2.gz QLLRIAOWDYRICF-UHFFFAOYSA-N 1 1 365.384 2.973 20 5 FFBDMO CCn1ccc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000616786210 520139264 /nfs/dbraw/zinc/13/92/64/520139264.db2.gz OZGQQXJJUSGXAQ-UHFFFAOYSA-N 1 1 360.414 2.885 20 5 FFBDMO COc1ccc(CC(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000600229423 520141265 /nfs/dbraw/zinc/14/12/65/520141265.db2.gz SEPYCHRYFRJCBM-INIZCTEOSA-N 1 1 361.442 2.669 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2ccc(CC)c([N+](=O)[O-])c2)C1 ZINC000592039536 520149221 /nfs/dbraw/zinc/14/92/21/520149221.db2.gz YXQAEQGGGQLTPS-CQSZACIVSA-N 1 1 369.487 2.510 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000600298746 520188576 /nfs/dbraw/zinc/18/85/76/520188576.db2.gz LXVMHHDYERSQOW-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000600298746 520188584 /nfs/dbraw/zinc/18/85/84/520188584.db2.gz LXVMHHDYERSQOW-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO O=C([C@@H]1CCc2[nH]cnc2C1)N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597723651 520198050 /nfs/dbraw/zinc/19/80/50/520198050.db2.gz MDJIZNAOWZUZBK-HUUCEWRRSA-N 1 1 354.410 2.829 20 5 FFBDMO CC[C@H](C)NC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131028 520207281 /nfs/dbraw/zinc/20/72/81/520207281.db2.gz QLFUNKMLVIZBBY-XIRDDKMYSA-N 1 1 363.458 2.615 20 5 FFBDMO CC[C@H](C)NC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131028 520207287 /nfs/dbraw/zinc/20/72/87/520207287.db2.gz QLFUNKMLVIZBBY-XIRDDKMYSA-N 1 1 363.458 2.615 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000609157386 520213975 /nfs/dbraw/zinc/21/39/75/520213975.db2.gz HSWIFQRRJYJSOE-HNNXBMFYSA-N 1 1 357.414 2.765 20 5 FFBDMO Cn1cc(CN[C@@H]2CC[N@H+](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594956287 520228654 /nfs/dbraw/zinc/22/86/54/520228654.db2.gz IYIQBQXPMGVLPC-MRXNPFEDSA-N 1 1 357.458 2.958 20 5 FFBDMO Cn1cc(C[NH2+][C@@H]2CCN(C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594956287 520228662 /nfs/dbraw/zinc/22/86/62/520228662.db2.gz IYIQBQXPMGVLPC-MRXNPFEDSA-N 1 1 357.458 2.958 20 5 FFBDMO COCC[N@H+]1CCC[C@H](NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 ZINC000609269515 520248617 /nfs/dbraw/zinc/24/86/17/520248617.db2.gz SDLKWNUJLZLZAL-HNNXBMFYSA-N 1 1 363.458 2.733 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1C[N@@H+](CC(C)C)CCO1 ZINC000595003780 520253275 /nfs/dbraw/zinc/25/32/75/520253275.db2.gz JZUDNWCXPKGJLX-HOCLYGCPSA-N 1 1 351.447 2.611 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CN(CC(C)C)CCO1 ZINC000595003780 520253286 /nfs/dbraw/zinc/25/32/86/520253286.db2.gz JZUDNWCXPKGJLX-HOCLYGCPSA-N 1 1 351.447 2.611 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000609310299 520270582 /nfs/dbraw/zinc/27/05/82/520270582.db2.gz ZXNZQVNXLSZYJZ-INIZCTEOSA-N 1 1 360.458 2.920 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1Cc2ccccc2N(C)C1=O ZINC000595067896 520277600 /nfs/dbraw/zinc/27/76/00/520277600.db2.gz YYDDQYSTBPGWRL-LRDDRELGSA-N 1 1 355.394 2.842 20 5 FFBDMO COc1ccnc(C[NH2+][C@H](C)CC(=O)Nc2cccc([N+](=O)[O-])c2)c1F ZINC000595081616 520284337 /nfs/dbraw/zinc/28/43/37/520284337.db2.gz SULMVTPAOJLOTQ-LLVKDONJSA-N 1 1 362.361 2.644 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000597859746 520285539 /nfs/dbraw/zinc/28/55/39/520285539.db2.gz GSKKZWASDOBYGT-LBPRGKRZSA-N 1 1 372.425 2.699 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000597859849 520286052 /nfs/dbraw/zinc/28/60/52/520286052.db2.gz ZHVDPBYXTQVAIT-LLVKDONJSA-N 1 1 357.357 2.799 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000597924395 520326850 /nfs/dbraw/zinc/32/68/50/520326850.db2.gz QSIGJBBKHSKHCK-CYBMUJFWSA-N 1 1 372.425 2.511 20 5 FFBDMO CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CC[N@@H+](C)C1 ZINC000597945599 520344293 /nfs/dbraw/zinc/34/42/93/520344293.db2.gz JLGTWAUTTLSRTR-CQSZACIVSA-N 1 1 360.439 2.885 20 5 FFBDMO Cc1nccc([C@@H]2CCC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)n1 ZINC000603834060 520370270 /nfs/dbraw/zinc/37/02/70/520370270.db2.gz GDTLHDJRDNDHLH-OAHLLOKOSA-N 1 1 369.425 2.901 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@]2(CO)CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000609620416 520383606 /nfs/dbraw/zinc/38/36/06/520383606.db2.gz DZRUDBYKQNLRTH-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO O=[N+]([O-])c1ccc(CN[C@@]2(CO)CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC000609620416 520383613 /nfs/dbraw/zinc/38/36/13/520383613.db2.gz DZRUDBYKQNLRTH-FQEVSTJZSA-N 1 1 355.438 2.712 20 5 FFBDMO CC(=O)c1[nH]c(CC[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nc1C ZINC000595331282 520413733 /nfs/dbraw/zinc/41/37/33/520413733.db2.gz ULTWRPZIAUXCCA-UHFFFAOYSA-N 1 1 372.425 2.915 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592493035 520415751 /nfs/dbraw/zinc/41/57/51/520415751.db2.gz MUNIEVNUEFMLNL-OWCLPIDISA-N 1 1 360.458 2.633 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[NH+](CCC(C)(C)C)CC1 ZINC000603959787 520415950 /nfs/dbraw/zinc/41/59/50/520415950.db2.gz RINNPPLTFRTSFI-UHFFFAOYSA-N 1 1 369.487 2.646 20 5 FFBDMO Cc1noc(C[NH+]2CCC(C(=O)Nc3cccc(F)c3)CC2)c1[N+](=O)[O-] ZINC000595364149 520431189 /nfs/dbraw/zinc/43/11/89/520431189.db2.gz DLVYLZHDSCJLKI-UHFFFAOYSA-N 1 1 362.361 2.881 20 5 FFBDMO O=[N+]([O-])c1cc(CNC[C@@H]2COCC[NH2+]2)ccc1Oc1ccc(F)cc1 ZINC000600773382 520461571 /nfs/dbraw/zinc/46/15/71/520461571.db2.gz HJLAXOYMDBJNPQ-OAHLLOKOSA-N 1 1 361.373 2.604 20 5 FFBDMO CN(Cc1ccc(F)cc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000595448403 520477848 /nfs/dbraw/zinc/47/78/48/520477848.db2.gz KBBFLSIEVXGRGF-FQEVSTJZSA-N 1 1 373.428 2.803 20 5 FFBDMO C[C@H](CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C[NH+]1CCOCC1 ZINC000609996798 520499595 /nfs/dbraw/zinc/49/95/95/520499595.db2.gz NACCGPBCMPOTAJ-CQSZACIVSA-N 1 1 363.458 2.590 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(Cc1nc(-c3ccc([N+](=O)[O-])cc3)no1)C2 ZINC000595505413 520514846 /nfs/dbraw/zinc/51/48/46/520514846.db2.gz SZOKMBIFJHTBRJ-GOSISDBHSA-N 1 1 357.414 2.563 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000610065067 520521995 /nfs/dbraw/zinc/52/19/95/520521995.db2.gz GYRPIAWTIGGAQI-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C[C@H]1C ZINC000610135244 520553587 /nfs/dbraw/zinc/55/35/87/520553587.db2.gz NLQKOJUTGKOLOF-HUUCEWRRSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000604446361 520565140 /nfs/dbraw/zinc/56/51/40/520565140.db2.gz ZAWOIBHAQGLHCH-FPMFFAJLSA-N 1 1 367.833 2.759 20 5 FFBDMO CCc1ccc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)cc1[N+](=O)[O-] ZINC000598366834 520574701 /nfs/dbraw/zinc/57/47/01/520574701.db2.gz FOYLVVLFDAFRET-QZTJIDSGSA-N 1 1 373.453 2.530 20 5 FFBDMO Cc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604508528 520583082 /nfs/dbraw/zinc/58/30/82/520583082.db2.gz HMKQSHPLOWIPJF-CQSZACIVSA-N 1 1 353.426 2.678 20 5 FFBDMO CCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CC[N@@H+](C)C1 ZINC000592830326 520607201 /nfs/dbraw/zinc/60/72/01/520607201.db2.gz CVXXPZVDOBMGEI-QGZVFWFLSA-N 1 1 374.485 2.754 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1 ZINC000598465942 520629884 /nfs/dbraw/zinc/62/98/84/520629884.db2.gz OTWDRLMUQCJNLZ-UHFFFAOYSA-N 1 1 359.430 2.631 20 5 FFBDMO CCC[N@@H+](C)CC(C)(C)NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] ZINC000598466797 520629911 /nfs/dbraw/zinc/62/99/11/520629911.db2.gz VUZSYMVBOHPKEQ-UHFFFAOYSA-N 1 1 351.447 2.909 20 5 FFBDMO CSc1ccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000610367422 520651117 /nfs/dbraw/zinc/65/11/17/520651117.db2.gz BFUITPPFCZUSTD-UHFFFAOYSA-N 1 1 374.466 2.913 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCc3ccc(O)cc3CC2)c([N+](=O)[O-])c1 ZINC000610390304 520661521 /nfs/dbraw/zinc/66/15/21/520661521.db2.gz IITFWABVFBBLKO-UHFFFAOYSA-N 1 1 358.394 2.789 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000593031408 520695406 /nfs/dbraw/zinc/69/54/06/520695406.db2.gz VZWVNRARLRIRBC-MJGOQNOKSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1 ZINC000593031408 520695413 /nfs/dbraw/zinc/69/54/13/520695413.db2.gz VZWVNRARLRIRBC-MJGOQNOKSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000593031409 520695444 /nfs/dbraw/zinc/69/54/44/520695444.db2.gz VZWVNRARLRIRBC-PKOBYXMFSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1 ZINC000593031409 520695448 /nfs/dbraw/zinc/69/54/48/520695448.db2.gz VZWVNRARLRIRBC-PKOBYXMFSA-N 1 1 369.421 2.916 20 5 FFBDMO O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598557343 520704134 /nfs/dbraw/zinc/70/41/34/520704134.db2.gz FDQVQAVFOQOAOX-INIZCTEOSA-N 1 1 373.453 2.796 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])cc1OCC(F)F ZINC000595767159 520710127 /nfs/dbraw/zinc/71/01/27/520710127.db2.gz VRZFMVMECJVGES-CMPLNLGQSA-N 1 1 360.357 2.593 20 5 FFBDMO CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000593058105 520715676 /nfs/dbraw/zinc/71/56/76/520715676.db2.gz JIBYWNBKBGRJBM-HIFRSBDPSA-N 1 1 365.430 2.821 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2C)C1 ZINC000598603933 520737310 /nfs/dbraw/zinc/73/73/10/520737310.db2.gz IAYKBZPSKVEWKO-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO CN(c1ccccc1)[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000595825995 520748399 /nfs/dbraw/zinc/74/83/99/520748399.db2.gz ISXBZKSCJCCYFA-ZWKOTPCHSA-N 1 1 371.437 2.545 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593128356 520766785 /nfs/dbraw/zinc/76/67/85/520766785.db2.gz GWHKKUNERRLRSK-KBXCAEBGSA-N 1 1 371.412 2.913 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593128358 520767727 /nfs/dbraw/zinc/76/77/27/520767727.db2.gz GWHKKUNERRLRSK-KSSFIOAISA-N 1 1 371.412 2.913 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595912030 520816916 /nfs/dbraw/zinc/81/69/16/520816916.db2.gz XVOVWPAKIAHOAN-ZOCIIQOWSA-N 1 1 359.426 2.814 20 5 FFBDMO C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@](C)(C(F)F)O1 ZINC000595922329 520826992 /nfs/dbraw/zinc/82/69/92/520826992.db2.gz ORBCTMARFPSOFF-ZBEGNZNMSA-N 1 1 357.357 2.668 20 5 FFBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@](C)(C(F)F)O1 ZINC000595922329 520827000 /nfs/dbraw/zinc/82/70/00/520827000.db2.gz ORBCTMARFPSOFF-ZBEGNZNMSA-N 1 1 357.357 2.668 20 5 FFBDMO COc1c(C(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593319012 520907019 /nfs/dbraw/zinc/90/70/19/520907019.db2.gz ILFJZBNARKJXON-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1c(C(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000593319012 520907025 /nfs/dbraw/zinc/90/70/25/520907025.db2.gz ILFJZBNARKJXON-INIZCTEOSA-N 1 1 369.421 2.602 20 5 FFBDMO C[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593322462 520909356 /nfs/dbraw/zinc/90/93/56/520909356.db2.gz NIKHGYIPMGYYBY-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](Cc2ccccc2)C1 ZINC000593322462 520909365 /nfs/dbraw/zinc/90/93/65/520909365.db2.gz NIKHGYIPMGYYBY-LJQANCHMSA-N 1 1 353.422 2.523 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1 ZINC000593336209 520918647 /nfs/dbraw/zinc/91/86/47/520918647.db2.gz DUXQJPILEBUXTR-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO CCCc1[nH]nc(C(=O)N2CCC(CC)([NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000601744035 520930363 /nfs/dbraw/zinc/93/03/63/520930363.db2.gz JPZILGXJZPDOPL-UHFFFAOYSA-N 1 1 363.462 2.751 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000596137767 520935151 /nfs/dbraw/zinc/93/51/51/520935151.db2.gz WIOKWAQVWVFWCU-MNOVXSKESA-N 1 1 355.822 2.954 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596145624 520938162 /nfs/dbraw/zinc/93/81/62/520938162.db2.gz UWBJMEJNQVRMAP-INIZCTEOSA-N 1 1 368.437 2.652 20 5 FFBDMO CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000593422261 520983684 /nfs/dbraw/zinc/98/36/84/520983684.db2.gz DNZBYGZDGWUNNO-UHFFFAOYSA-N 1 1 351.422 2.999 20 5 FFBDMO Cc1cc(N2CC(C[NH+]3CCOCC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000596240343 520989752 /nfs/dbraw/zinc/98/97/52/520989752.db2.gz WFWSZAIIEHIISS-UHFFFAOYSA-N 1 1 359.348 2.690 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c2ccncc21 ZINC000596267877 521000730 /nfs/dbraw/zinc/00/07/30/521000730.db2.gz AUHSWNNVMIDRJK-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000611185035 521028957 /nfs/dbraw/zinc/02/89/57/521028957.db2.gz OOVYGDWAERFRHL-FXAWDEMLSA-N 1 1 371.437 2.856 20 5 FFBDMO CCC[N@@H+](CC)CCNC(=O)c1cccc(Cn2nc([N+](=O)[O-])cc2C)c1 ZINC000593500667 521034495 /nfs/dbraw/zinc/03/44/95/521034495.db2.gz QYUDGQKLHZWELO-UHFFFAOYSA-N 1 1 373.457 2.610 20 5 FFBDMO Cn1c2cc(NC[C@H]3CC[N@H+]3C3CCCCC3)c([N+](=O)[O-])cc2n(C)c1=O ZINC000599128380 521044463 /nfs/dbraw/zinc/04/44/63/521044463.db2.gz YVOYOHJSZSEFBL-CQSZACIVSA-N 1 1 373.457 2.604 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+][C@@H](CF)c1ccc(F)cc1 ZINC000601973568 521049710 /nfs/dbraw/zinc/04/97/10/521049710.db2.gz QGYFQBSIUAWRQS-CABCVRRESA-N 1 1 352.337 2.774 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350404 521112213 /nfs/dbraw/zinc/11/22/13/521112213.db2.gz LACVHEBUQMJPKX-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000611350404 521112220 /nfs/dbraw/zinc/11/22/20/521112220.db2.gz LACVHEBUQMJPKX-HZPDHXFCSA-N 1 1 361.442 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)nc1-c1ccccc1 ZINC000596537364 521121736 /nfs/dbraw/zinc/12/17/36/521121736.db2.gz DJEOCDRWBUJRNY-KRWDZBQOSA-N 1 1 368.437 2.692 20 5 FFBDMO CC[N@@H+](CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])CCC(F)(F)F ZINC000593653213 521133756 /nfs/dbraw/zinc/13/37/56/521133756.db2.gz WIPXUJKQOBCTQR-UHFFFAOYSA-N 1 1 365.327 2.667 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000596625224 521174032 /nfs/dbraw/zinc/17/40/32/521174032.db2.gz QGELKAXDPFHDFI-AWEZNQCLSA-N 1 1 362.430 2.847 20 5 FFBDMO C[N@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000611557598 521219851 /nfs/dbraw/zinc/21/98/51/521219851.db2.gz GPHSMYFLUWTVJO-INIZCTEOSA-N 1 1 355.394 2.647 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 ZINC000611557598 521219858 /nfs/dbraw/zinc/21/98/58/521219858.db2.gz GPHSMYFLUWTVJO-INIZCTEOSA-N 1 1 355.394 2.647 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c(Cl)c1 ZINC000599464863 521239860 /nfs/dbraw/zinc/23/98/60/521239860.db2.gz VDUVBBRDLVFPMG-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611710645 521292117 /nfs/dbraw/zinc/29/21/17/521292117.db2.gz DXFONHWMMSMGED-UHFFFAOYSA-N 1 1 366.381 2.822 20 5 FFBDMO Cn1cc(CN2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])n1 ZINC000602433355 521341518 /nfs/dbraw/zinc/34/15/18/521341518.db2.gz LULZWLSKWCFYTK-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO Cn1cc(CN2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])n1 ZINC000602433355 521341520 /nfs/dbraw/zinc/34/15/20/521341520.db2.gz LULZWLSKWCFYTK-UHFFFAOYSA-N 1 1 363.849 2.690 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000599635274 521347011 /nfs/dbraw/zinc/34/70/11/521347011.db2.gz GTPZBBIXOFCMFF-UHFFFAOYSA-N 1 1 367.327 2.834 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2cccc(C(F)(F)F)c2C1 ZINC000599635274 521347020 /nfs/dbraw/zinc/34/70/20/521347020.db2.gz GTPZBBIXOFCMFF-UHFFFAOYSA-N 1 1 367.327 2.834 20 5 FFBDMO COc1cc(C[N@H+]2CCCCC[C@H]2CO)c([N+](=O)[O-])cc1OC(F)F ZINC000594014379 521350639 /nfs/dbraw/zinc/35/06/39/521350639.db2.gz CMEJKELIQFBUIS-LBPRGKRZSA-N 1 1 360.357 2.942 20 5 FFBDMO CCN(C(=O)Nc1cc(Br)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000596900349 521366651 /nfs/dbraw/zinc/36/66/51/521366651.db2.gz MVBZBDKUBLPCSC-LBPRGKRZSA-N 1 1 371.235 2.915 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C[N@H+]1C1CC1 ZINC000599659917 521372096 /nfs/dbraw/zinc/37/20/96/521372096.db2.gz LSMQKTVMFWJUDU-ZJUUUORDSA-N 1 1 368.231 2.712 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCN(c2cnccn2)CC1 ZINC000619058285 521376174 /nfs/dbraw/zinc/37/61/74/521376174.db2.gz HACLEQFONNNREH-UHFFFAOYSA-N 1 1 368.397 2.627 20 5 FFBDMO CCN1CCN([C@@H](C)C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602513227 521388069 /nfs/dbraw/zinc/38/80/69/521388069.db2.gz AUBRRIIWPDPMGK-ZDUSSCGKSA-N 1 1 374.407 2.729 20 5 FFBDMO Cc1cc(NC(=O)NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594082022 521395199 /nfs/dbraw/zinc/39/51/99/521395199.db2.gz XXDQNRPKLILAEN-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO Cc1cc(NC(=O)NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000594082022 521395204 /nfs/dbraw/zinc/39/52/04/521395204.db2.gz XXDQNRPKLILAEN-MCIONIFRSA-N 1 1 350.419 2.522 20 5 FFBDMO C[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(=O)NC(C)(C)C ZINC000602536618 521400122 /nfs/dbraw/zinc/40/01/22/521400122.db2.gz VJNQNCUMKWUJQX-ZETCQYMHSA-N 1 1 364.265 2.812 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000594199233 521464967 /nfs/dbraw/zinc/46/49/67/521464967.db2.gz IGRAZEJQHLSKPD-MSOLQXFVSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C1[C@H]([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)C[C@H]2CCCCN12 ZINC000602686767 521478721 /nfs/dbraw/zinc/47/87/21/521478721.db2.gz HTGAXDMFWBPGMZ-LDYMZIIASA-N 1 1 374.260 2.662 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](CC(=O)OC(C)(C)C)C1 ZINC000602787095 521531803 /nfs/dbraw/zinc/53/18/03/521531803.db2.gz OHASKZBFISWKLC-CQSZACIVSA-N 1 1 352.435 2.544 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](Cn2cnc3ccccc32)C1 ZINC000602810251 521545642 /nfs/dbraw/zinc/54/56/42/521545642.db2.gz GFXIQVOHQNUFNJ-MRXNPFEDSA-N 1 1 368.441 2.862 20 5 FFBDMO Cn1cc(C[N@@H+](CCCOc2ccccc2)C2CCOCC2)c([N+](=O)[O-])n1 ZINC000602812455 521548168 /nfs/dbraw/zinc/54/81/68/521548168.db2.gz XOQLASGRXLREDH-UHFFFAOYSA-N 1 1 374.441 2.778 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000619537111 521756921 /nfs/dbraw/zinc/75/69/21/521756921.db2.gz VKGVQBQTUPSNBJ-BEFAXECRSA-N 1 1 373.453 2.757 20 5 FFBDMO Cc1cccc(N2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)[nH+]1 ZINC000619745295 521850693 /nfs/dbraw/zinc/85/06/93/521850693.db2.gz RCFBSWOGMQLEEG-UHFFFAOYSA-N 1 1 352.398 2.891 20 5 FFBDMO C[N@H+](CCO)Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)ccc1Cl ZINC000619867336 521911580 /nfs/dbraw/zinc/91/15/80/521911580.db2.gz UDPXYNYFEOIORO-UHFFFAOYSA-N 1 1 369.830 2.986 20 5 FFBDMO C[N@@H+](CCO)Cc1cc(NC(=O)c2csc([N+](=O)[O-])c2)ccc1Cl ZINC000619867336 521911588 /nfs/dbraw/zinc/91/15/88/521911588.db2.gz UDPXYNYFEOIORO-UHFFFAOYSA-N 1 1 369.830 2.986 20 5 FFBDMO C[C@@H](CCNc1ccc2ncc([N+](=O)[O-])n2n1)[N@@H+](C)Cc1ccccc1 ZINC000502353699 561616800 /nfs/dbraw/zinc/61/68/00/561616800.db2.gz QPMHQWNAXABSIR-AWEZNQCLSA-N 1 1 354.414 2.960 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473517945 561051773 /nfs/dbraw/zinc/05/17/73/561051773.db2.gz CIFKNWHXESOXLR-OAHLLOKOSA-N 1 1 357.458 2.829 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000826169868 608469049 /nfs/dbraw/zinc/46/90/49/608469049.db2.gz IGQHNPVMDXPCNT-LLVKDONJSA-N 1 1 354.370 2.634 20 5 FFBDMO C[C@@H](Nc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000824648958 609314070 /nfs/dbraw/zinc/31/40/70/609314070.db2.gz JZBURIHZBFYHHJ-TZMCWYRMSA-N 1 1 371.445 2.840 20 5 FFBDMO Nc1nc(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ccc1[N+](=O)[O-] ZINC001164629208 719085079 /nfs/dbraw/zinc/08/50/79/719085079.db2.gz WLEJDJJQVINJGR-RDJZCZTQSA-N 1 1 353.426 2.673 20 5 FFBDMO Cc1nc(N2CCc3c(C[NH+](C)C)nn(C(C)C)c3C2)ccc1[N+](=O)[O-] ZINC001164647483 719306954 /nfs/dbraw/zinc/30/69/54/719306954.db2.gz MMLMLPCTXSZKKR-UHFFFAOYSA-N 1 1 358.446 2.700 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164724904 720331743 /nfs/dbraw/zinc/33/17/43/720331743.db2.gz LOYQWGLQOKCXDV-HUUCEWRRSA-N 1 1 359.817 2.891 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)nc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1 ZINC001164724905 720332057 /nfs/dbraw/zinc/33/20/57/720332057.db2.gz LOYQWGLQOKCXDV-LSDHHAIUSA-N 1 1 359.817 2.891 20 5 FFBDMO CC(C)[N@H+]1[C@H](Cn2cccn2)C[C@@H]2CN(c3cccc([N+](=O)[O-])n3)CC[C@@H]21 ZINC001164832949 720519320 /nfs/dbraw/zinc/51/93/20/720519320.db2.gz CCNMASFKISGJEX-IKGGRYGDSA-N 1 1 370.457 2.564 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ncc(F)cc1[N+](=O)[O-])[C@@H]2C ZINC001164858696 720937487 /nfs/dbraw/zinc/93/74/87/720937487.db2.gz KHKBZRXXRMOQPD-GFCCVEGCSA-N 1 1 362.409 2.747 20 5 FFBDMO Cc1cnc(N2CC[N@H+]3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001164901703 721512913 /nfs/dbraw/zinc/51/29/13/721512913.db2.gz YDLPQNDFWUKPEQ-NVXWUHKLSA-N 1 1 372.400 2.779 20 5 FFBDMO CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926754 721855033 /nfs/dbraw/zinc/85/50/33/721855033.db2.gz JFJNMFVORBXGNZ-MOPGFXCFSA-N 1 1 361.493 2.998 20 5 FFBDMO C[NH+](C)CCN1CC[C@H]2[C@H]1CCN2c1ccc2ccc3cccnc3c2n1 ZINC001164926754 721855034 /nfs/dbraw/zinc/85/50/34/721855034.db2.gz JFJNMFVORBXGNZ-MOPGFXCFSA-N 1 1 361.493 2.998 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)cnc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC000153523030 721953072 /nfs/dbraw/zinc/95/30/72/721953072.db2.gz RKKDKYCSBUCLHE-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C[C@@H](C)O1 ZINC000152997678 728770355 /nfs/dbraw/zinc/77/03/55/728770355.db2.gz FPKZAGGLBAXCKK-VXGBXAGGSA-N 1 1 369.849 2.866 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000154001950 728793793 /nfs/dbraw/zinc/79/37/93/728793793.db2.gz HLFOPNZURPUIFM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000154001950 728793795 /nfs/dbraw/zinc/79/37/95/728793795.db2.gz HLFOPNZURPUIFM-CQSZACIVSA-N 1 1 370.247 2.770 20 5 FFBDMO Cc1nn(C)c(C)c1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162199557 728940548 /nfs/dbraw/zinc/94/05/48/728940548.db2.gz FNPUJXCUMGGINC-UHFFFAOYSA-N 1 1 353.220 2.997 20 5 FFBDMO CCN(C[C@@H]1CC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1)CC(F)(F)F ZINC000177639619 729141751 /nfs/dbraw/zinc/14/17/51/729141751.db2.gz IBTQLKBEECNJJL-ZDUSSCGKSA-N 1 1 363.384 2.572 20 5 FFBDMO CCN(C[C@@H]1CC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1)CC(F)(F)F ZINC000177639619 729141753 /nfs/dbraw/zinc/14/17/53/729141753.db2.gz IBTQLKBEECNJJL-ZDUSSCGKSA-N 1 1 363.384 2.572 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000906201147 736469380 /nfs/dbraw/zinc/46/93/80/736469380.db2.gz WDHAYHSLORBKRU-JKSUJKDBSA-N 1 1 351.834 2.924 20 5 FFBDMO Cc1nn(CCC(=O)O[C@H](C)C[C@@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000870789662 731558416 /nfs/dbraw/zinc/55/84/16/731558416.db2.gz IVBKYGQYYIZNSY-DOMZBBRYSA-N 1 1 352.435 2.604 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000872720487 731819529 /nfs/dbraw/zinc/81/95/29/731819529.db2.gz QRPHTXXZHGRFHV-VYDXJSESSA-N 1 1 361.467 2.553 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000874834507 732105498 /nfs/dbraw/zinc/10/54/98/732105498.db2.gz SFXIXUGLQUEWHR-KBPBESRZSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C ZINC000874844033 732107129 /nfs/dbraw/zinc/10/71/29/732107129.db2.gz QEYQNNZFQBFQID-FPMFFAJLSA-N 1 1 367.833 2.711 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000877021421 732313790 /nfs/dbraw/zinc/31/37/90/732313790.db2.gz BFZAZCJXPZDUKH-UONOGXRCSA-N 1 1 359.348 2.566 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](O)CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877752386 732423520 /nfs/dbraw/zinc/42/35/20/732423520.db2.gz DRBUFSFHDWEYII-LLVKDONJSA-N 1 1 360.357 2.798 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](O)CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877752386 732423523 /nfs/dbraw/zinc/42/35/23/732423523.db2.gz DRBUFSFHDWEYII-LLVKDONJSA-N 1 1 360.357 2.798 20 5 FFBDMO C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878341254 732516708 /nfs/dbraw/zinc/51/67/08/732516708.db2.gz ZTTRZKVXQWPQBK-QWRGUYRKSA-N 1 1 365.821 2.823 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1 ZINC000879575733 732727445 /nfs/dbraw/zinc/72/74/45/732727445.db2.gz MYBKEAHCKURVSS-WQGACYEGSA-N 1 1 366.849 2.601 20 5 FFBDMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCSC[C@H]1c1ccccc1 ZINC000880387982 732900674 /nfs/dbraw/zinc/90/06/74/732900674.db2.gz ODQKWUMNBKJTBG-KRWDZBQOSA-N 1 1 359.451 2.937 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435025 732907364 /nfs/dbraw/zinc/90/73/64/732907364.db2.gz IDYISIWMSAMWBA-DGCLKSJQSA-N 1 1 359.220 2.593 20 5 FFBDMO CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1Br ZINC000880435025 732907367 /nfs/dbraw/zinc/90/73/67/732907367.db2.gz IDYISIWMSAMWBA-DGCLKSJQSA-N 1 1 359.220 2.593 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000886069230 733745346 /nfs/dbraw/zinc/74/53/46/733745346.db2.gz DGGWTARDVAOJHE-OCCSQVGLSA-N 1 1 350.419 2.725 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C ZINC000886069230 733745349 /nfs/dbraw/zinc/74/53/49/733745349.db2.gz DGGWTARDVAOJHE-OCCSQVGLSA-N 1 1 350.419 2.725 20 5 FFBDMO CC(C)(C)OC(=O)NC1(C)CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886157946 733755270 /nfs/dbraw/zinc/75/52/70/733755270.db2.gz OJAGBZULOILSPF-UHFFFAOYSA-N 1 1 350.419 2.869 20 5 FFBDMO CCOC(=O)N(C)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000726971103 734457015 /nfs/dbraw/zinc/45/70/15/734457015.db2.gz HYCPLTDONUXEMQ-UHFFFAOYSA-N 1 1 351.403 2.656 20 5 FFBDMO Cc1c(COC(=O)[C@H]([NH2+]C2CCOCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000754510035 736166861 /nfs/dbraw/zinc/16/68/61/736166861.db2.gz MYUSUSZMAMIHQY-QGZVFWFLSA-N 1 1 350.415 2.740 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)CC[N@H+]1C ZINC000755012018 736226536 /nfs/dbraw/zinc/22/65/36/736226536.db2.gz CNLUUOPLFUWDBX-WCBMZHEXSA-N 1 1 374.210 2.709 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]2COCC[C@H]21)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000756902166 736371813 /nfs/dbraw/zinc/37/18/13/736371813.db2.gz QMQHQNMSBBBVJB-BXUZGUMPSA-N 1 1 353.806 2.688 20 5 FFBDMO CCc1noc(C)c1[C@H](C)[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000757674912 736418336 /nfs/dbraw/zinc/41/83/36/736418336.db2.gz HZFRKAODBJTBJA-NSHDSACASA-N 1 1 367.427 2.578 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000757729255 736423043 /nfs/dbraw/zinc/42/30/43/736423043.db2.gz LGXORFYFHCAQOI-BMIGLBTASA-N 1 1 352.822 2.530 20 5 FFBDMO COC[C@H]1CCCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767948147 737385224 /nfs/dbraw/zinc/38/52/24/737385224.db2.gz LJCDZAXENUWBAR-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000769141858 737500410 /nfs/dbraw/zinc/50/04/10/737500410.db2.gz NITRCCSPDXNQTL-DTWKUNHWSA-N 1 1 374.210 2.661 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1Br ZINC000769141858 737500411 /nfs/dbraw/zinc/50/04/11/737500411.db2.gz NITRCCSPDXNQTL-DTWKUNHWSA-N 1 1 374.210 2.661 20 5 FFBDMO COCCC[N@@H+](CCOC)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774626892 738006606 /nfs/dbraw/zinc/00/66/06/738006606.db2.gz MPJJYCNHPKQUGN-UHFFFAOYSA-N 1 1 356.810 2.540 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])cc(Cl)c43)CC[C@@H]21 ZINC000774640387 738008942 /nfs/dbraw/zinc/00/89/42/738008942.db2.gz RXUYTFNSPRDOGN-WBMJQRKESA-N 1 1 363.849 2.972 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc(Br)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000930544027 739124509 /nfs/dbraw/zinc/12/45/09/739124509.db2.gz KBCUNSGVONOXSC-RNCFNFMXSA-N 1 1 369.219 2.525 20 5 FFBDMO O=[N+]([O-])c1ccc(Br)c(C[N@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)c1 ZINC000930929183 739186912 /nfs/dbraw/zinc/18/69/12/739186912.db2.gz MMVYOBZHJIISQL-UHIISALHSA-N 1 1 355.232 2.950 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC1 ZINC000931124572 739215762 /nfs/dbraw/zinc/21/57/62/739215762.db2.gz QIVYGGUXOLNXDE-UHFFFAOYSA-N 1 1 372.828 2.916 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000791142756 739532268 /nfs/dbraw/zinc/53/22/68/739532268.db2.gz RBNKLUIPCRXWEH-GFCCVEGCSA-N 1 1 357.813 2.919 20 5 FFBDMO Cc1c(NC(=O)NC[C@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000933340785 739607064 /nfs/dbraw/zinc/60/70/64/739607064.db2.gz VSPSCCHACCYGLO-SNVBAGLBSA-N 1 1 360.336 2.995 20 5 FFBDMO CN(C)[S@@](C)(=O)=NCC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000934758111 739833828 /nfs/dbraw/zinc/83/38/28/739833828.db2.gz ZTMBMLKQDUQNAW-VWLOTQADSA-N 1 1 372.466 2.520 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H]2CSC[C@]2(C)C1 ZINC000934777012 739838748 /nfs/dbraw/zinc/83/87/48/739838748.db2.gz PXXUJFAGFLRBBM-PXAZEXFGSA-N 1 1 365.455 2.617 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000796165172 740110809 /nfs/dbraw/zinc/11/08/09/740110809.db2.gz PWIZLVYZTKJANS-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO CCNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000796165172 740110812 /nfs/dbraw/zinc/11/08/12/740110812.db2.gz PWIZLVYZTKJANS-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)Nc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-] ZINC000808178033 741195678 /nfs/dbraw/zinc/19/56/78/741195678.db2.gz ZQGKWLGBJGCHML-NSHDSACASA-N 1 1 354.407 2.836 20 5 FFBDMO CCN1C(=O)N=NC1C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000808740014 741256865 /nfs/dbraw/zinc/25/68/65/741256865.db2.gz FVGCBZMWINCRPW-UHFFFAOYSA-N 1 1 365.821 2.945 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000815232248 741915132 /nfs/dbraw/zinc/91/51/32/741915132.db2.gz CZAXFHVEIIBNRA-QGZVFWFLSA-N 1 1 369.849 2.917 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000815232248 741915139 /nfs/dbraw/zinc/91/51/39/741915139.db2.gz CZAXFHVEIIBNRA-QGZVFWFLSA-N 1 1 369.849 2.917 20 5 FFBDMO Cc1[nH+]cc(CN2CCc3c(Br)ccc([N+](=O)[O-])c3C2)n1C ZINC000825824402 743331424 /nfs/dbraw/zinc/33/14/24/743331424.db2.gz JBQRCCSMCYGUDC-UHFFFAOYSA-N 1 1 365.231 2.958 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@]2(CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000832343992 745680490 /nfs/dbraw/zinc/68/04/90/745680490.db2.gz QEOQTDVRBXFKLN-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000832343992 745680496 /nfs/dbraw/zinc/68/04/96/745680496.db2.gz QEOQTDVRBXFKLN-MRXNPFEDSA-N 1 1 353.806 2.689 20 5 FFBDMO COC[C@@H]1CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000832746572 745748714 /nfs/dbraw/zinc/74/87/14/745748714.db2.gz WOJINJVMTMBIPB-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO COC[C@@H]1CCC[N@@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000832746572 745748719 /nfs/dbraw/zinc/74/87/19/745748719.db2.gz WOJINJVMTMBIPB-GFCCVEGCSA-N 1 1 355.822 2.935 20 5 FFBDMO CC(C)(CN1CCCC1)[NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000832756050 745749839 /nfs/dbraw/zinc/74/98/39/745749839.db2.gz IWJPZWMZOOVHPB-UHFFFAOYSA-N 1 1 354.838 2.651 20 5 FFBDMO C[C@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000839568224 746858042 /nfs/dbraw/zinc/85/80/42/746858042.db2.gz KTZVYFWGNFEBTG-ZBEGNZNMSA-N 1 1 355.822 2.670 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)C1 ZINC000840155430 747022069 /nfs/dbraw/zinc/02/20/69/747022069.db2.gz XWMMCLNUZJYJFN-ZDUSSCGKSA-N 1 1 351.838 2.970 20 5 FFBDMO O=C(CN1CCC[C@@H]([C@H]2CC[NH2+]C2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000843387118 747822305 /nfs/dbraw/zinc/82/23/05/747822305.db2.gz FEFXJYPLBQTVHU-QWHCGFSZSA-N 1 1 366.849 2.508 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F ZINC000844653633 748066246 /nfs/dbraw/zinc/06/62/46/748066246.db2.gz CIEZKAGYNMWBLV-UHFFFAOYSA-N 1 1 354.426 2.508 20 5 FFBDMO C[N@H+]1CC[C@@]2(C1)CCCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000852108933 749775760 /nfs/dbraw/zinc/77/57/60/749775760.db2.gz PZVKGMZOAFHHMJ-QGZVFWFLSA-N 1 1 366.849 2.604 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)ccc1Br ZINC000852346075 749840646 /nfs/dbraw/zinc/84/06/46/749840646.db2.gz VRGYPRNZVQBGIB-FRRDWIJNSA-N 1 1 355.232 2.950 20 5 FFBDMO Cc1cc(C(=O)Nc2ccc(C[NH+]3CCN(C)CC3)cc2)cc([N+](=O)[O-])c1 ZINC000147881403 971367921 /nfs/dbraw/zinc/36/79/21/971367921.db2.gz MVBVTEKMWOFVLS-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO O=C(NCCC1CC[NH+](Cc2ccc(C3CC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001267943470 971684374 /nfs/dbraw/zinc/68/43/74/971684374.db2.gz OYKHMLKBMPCRGN-WOJBJXKFSA-N 1 1 371.481 2.948 20 5 FFBDMO COc1ccccc1OCC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000053709987 971879641 /nfs/dbraw/zinc/87/96/41/971879641.db2.gz AZZIKYZEJYUATR-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=C1CN([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c2ccccc2N1 ZINC000759893607 971911067 /nfs/dbraw/zinc/91/10/67/971911067.db2.gz DWKMUFWGZAHEHY-MRXNPFEDSA-N 1 1 352.394 2.628 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000866846359 958885580 /nfs/dbraw/zinc/88/55/80/958885580.db2.gz CSLFNZWWYZZHSD-PBHICJAKSA-N 1 1 361.417 2.752 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C)cc2)C1 ZINC001174841807 1013315488 /nfs/dbraw/zinc/31/54/88/1013315488.db2.gz DVFOLHWHNBRLQG-MRXNPFEDSA-N 1 1 369.421 2.916 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000083629629 962793498 /nfs/dbraw/zinc/79/34/98/962793498.db2.gz XJXOTFCDTNHGED-QGZVFWFLSA-N 1 1 359.430 2.948 20 5 FFBDMO CC(C)CCO[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000083629629 962793504 /nfs/dbraw/zinc/79/35/04/962793504.db2.gz XJXOTFCDTNHGED-QGZVFWFLSA-N 1 1 359.430 2.948 20 5 FFBDMO CC(C)(C)CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001269621809 964230574 /nfs/dbraw/zinc/23/05/74/964230574.db2.gz PSLWFNVPJLSJHQ-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)(C)CC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001269621809 964230578 /nfs/dbraw/zinc/23/05/78/964230578.db2.gz PSLWFNVPJLSJHQ-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO CC(C)(C)CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001269621809 964230585 /nfs/dbraw/zinc/23/05/85/964230585.db2.gz PSLWFNVPJLSJHQ-IAGOWNOFSA-N 1 1 351.491 2.791 20 5 FFBDMO COc1c(O)ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1[N+](=O)[O-] ZINC000892235114 966348947 /nfs/dbraw/zinc/34/89/47/966348947.db2.gz KURCJILEVCUBLG-XJKSGUPXSA-N 1 1 361.442 2.758 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176525152 1013722638 /nfs/dbraw/zinc/72/26/38/1013722638.db2.gz WKNIKHFQHGJJRX-TZMCWYRMSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176525152 1013722642 /nfs/dbraw/zinc/72/26/42/1013722642.db2.gz WKNIKHFQHGJJRX-TZMCWYRMSA-N 1 1 366.381 2.985 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(c2c[nH+]cn2C)CC1 ZINC001176977994 1013819784 /nfs/dbraw/zinc/81/97/84/1013819784.db2.gz PMITUYSGQQZENH-ZDUSSCGKSA-N 1 1 357.414 2.535 20 5 FFBDMO Cc1cc(N2CCC[C@H](OC(=O)c3ccc([N+](=O)[O-])cc3)C2)nc(C)[nH+]1 ZINC000066732259 970101049 /nfs/dbraw/zinc/10/10/49/970101049.db2.gz GAZBYUSFWSMTEJ-INIZCTEOSA-N 1 1 356.382 2.827 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)nc1-c1ccccc1 ZINC000897220654 973458490 /nfs/dbraw/zinc/45/84/90/973458490.db2.gz CWTIHFYUWAOSCH-IRXDYDNUSA-N 1 1 368.437 2.692 20 5 FFBDMO Cn1cc[nH+]c1[C@H]1CCCN(c2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC000893531019 974913791 /nfs/dbraw/zinc/91/37/91/974913791.db2.gz GKAQISMYXVZPLW-ZDUSSCGKSA-N 1 1 367.409 2.564 20 5 FFBDMO CCc1cccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278884 977376173 /nfs/dbraw/zinc/37/61/73/977376173.db2.gz UVFNDGHCOHLEKK-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1cccc(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278884 977376178 /nfs/dbraw/zinc/37/61/78/977376178.db2.gz UVFNDGHCOHLEKK-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO CCc1cccc(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278884 977376183 /nfs/dbraw/zinc/37/61/83/977376183.db2.gz UVFNDGHCOHLEKK-UKAVVXHISA-N 1 1 371.481 2.585 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)cc1C ZINC001211756708 977796745 /nfs/dbraw/zinc/79/67/45/977796745.db2.gz YQJTWASAWLHUHE-INIZCTEOSA-N 1 1 369.487 2.610 20 5 FFBDMO C[N@@H+](CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1)CC1CCC2(CC2)CC1 ZINC001029964603 980152878 /nfs/dbraw/zinc/15/28/78/980152878.db2.gz QORVZVSXOFDVRJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO C[N@H+](CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CCC2(CC2)CC1 ZINC001029964603 980152881 /nfs/dbraw/zinc/15/28/81/980152881.db2.gz QORVZVSXOFDVRJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO C[N@@H+](CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1)CC1CCC2(CC2)CC1 ZINC001029964603 980152886 /nfs/dbraw/zinc/15/28/86/980152886.db2.gz QORVZVSXOFDVRJ-QZTJIDSGSA-N 1 1 363.502 2.792 20 5 FFBDMO C[C@@H]1CN(Cc2ccccc2)C[C@@H]1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877665872 1014668288 /nfs/dbraw/zinc/66/82/88/1014668288.db2.gz MLCJIHVSHAORBM-SVUBNXHSSA-N 1 1 369.469 2.853 20 5 FFBDMO CC[N@H+]1CCCN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)[C@H](C)C1 ZINC000910295970 981903231 /nfs/dbraw/zinc/90/32/31/981903231.db2.gz QOXMRKIKDSEQIA-MRXNPFEDSA-N 1 1 374.485 2.754 20 5 FFBDMO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cn(-c2ccccc2)nn1 ZINC000760464027 982419611 /nfs/dbraw/zinc/41/96/11/982419611.db2.gz WULIXASJFBYJQZ-FZKQIMNGSA-N 1 1 353.382 2.560 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)C2)C1 ZINC000897848807 982536693 /nfs/dbraw/zinc/53/66/93/982536693.db2.gz BYWBEPVMRDQHOF-FQEVSTJZSA-N 1 1 368.437 2.888 20 5 FFBDMO CCOc1ccc(C[NH+]2CCN(Cn3nc(C)c([N+](=O)[O-])c3C)CC2)cc1 ZINC000073136297 984033341 /nfs/dbraw/zinc/03/33/41/984033341.db2.gz WGVYIMSCFIECBF-UHFFFAOYSA-N 1 1 373.457 2.582 20 5 FFBDMO CCCC(=O)NC[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000764967876 984895751 /nfs/dbraw/zinc/89/57/51/984895751.db2.gz YFOTVPCSTWMPOM-OAHLLOKOSA-N 1 1 373.457 2.839 20 5 FFBDMO Cc1nn(C[N@@H+]2CCC[C@H](N3CCCCC3=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764992440 984904292 /nfs/dbraw/zinc/90/42/92/984904292.db2.gz ZZVFORRGCQBROG-INIZCTEOSA-N 1 1 371.441 2.687 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](N3CCCCC3=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764992440 984904298 /nfs/dbraw/zinc/90/42/98/984904298.db2.gz ZZVFORRGCQBROG-INIZCTEOSA-N 1 1 371.441 2.687 20 5 FFBDMO Cc1nn(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765058977 984955621 /nfs/dbraw/zinc/95/56/21/984955621.db2.gz IHOLRYLAYWNENE-CYBMUJFWSA-N 1 1 360.414 2.874 20 5 FFBDMO Cc1nn(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c2ccc([N+](=O)[O-])cc12 ZINC000765058977 984955628 /nfs/dbraw/zinc/95/56/28/984955628.db2.gz IHOLRYLAYWNENE-CYBMUJFWSA-N 1 1 360.414 2.874 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)o1 ZINC000878643979 1015149453 /nfs/dbraw/zinc/14/94/53/1015149453.db2.gz QVFFVQRFWDLLPD-AWEZNQCLSA-N 1 1 358.398 2.893 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)o1 ZINC000878643979 1015149462 /nfs/dbraw/zinc/14/94/62/1015149462.db2.gz QVFFVQRFWDLLPD-AWEZNQCLSA-N 1 1 358.398 2.893 20 5 FFBDMO Cc1cc(NCC2([NH+]3CCCC3)COC2)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001168443586 986976012 /nfs/dbraw/zinc/97/60/12/986976012.db2.gz MABVDUZKTCVNMJ-UHFFFAOYSA-N 1 1 369.425 2.637 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CC[NH+](Cc3ccc(C(F)(F)F)cc3)CC2)c1 ZINC000914565917 987792492 /nfs/dbraw/zinc/79/24/92/987792492.db2.gz JSLWESTZOUOHFJ-UHFFFAOYSA-N 1 1 369.347 2.585 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000915297297 988395315 /nfs/dbraw/zinc/39/53/15/988395315.db2.gz BTKLAYIHWXVVEZ-NWDGAFQWSA-N 1 1 364.402 2.804 20 5 FFBDMO O=[N+]([O-])c1cnn(CN2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762498665 988414529 /nfs/dbraw/zinc/41/45/29/988414529.db2.gz ACMQDTQYUOUZAZ-UHFFFAOYSA-N 1 1 355.442 2.737 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000879244543 1015434568 /nfs/dbraw/zinc/43/45/68/1015434568.db2.gz QZKMEIVRRIXDRB-POAQFYNOSA-N 1 1 372.421 2.533 20 5 FFBDMO CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000068964554 991554882 /nfs/dbraw/zinc/55/48/82/991554882.db2.gz PBCIAAFSNOMPBT-LSDHHAIUSA-N 1 1 373.457 2.919 20 5 FFBDMO CC[N@@H+]1C[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001127682976 992007259 /nfs/dbraw/zinc/00/72/59/992007259.db2.gz GWBOTSRWJSZEOG-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2c(Br)cccc2[N+](=O)[O-])C[C@@H]1C ZINC001127682976 992007268 /nfs/dbraw/zinc/00/72/68/992007268.db2.gz GWBOTSRWJSZEOG-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1Cc1ccccc1 ZINC000184481518 992778885 /nfs/dbraw/zinc/77/88/85/992778885.db2.gz BRQKVODVEXURBL-GDBMZVCRSA-N 1 1 368.437 2.960 20 5 FFBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](CO)c1ccccc1 ZINC000880462220 1015841073 /nfs/dbraw/zinc/84/10/73/1015841073.db2.gz QREPMTASYJWMFE-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](CO)c1ccccc1 ZINC000880462220 1015841080 /nfs/dbraw/zinc/84/10/80/1015841080.db2.gz QREPMTASYJWMFE-GOSISDBHSA-N 1 1 357.410 2.897 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](N2CCCCC2=O)C1 ZINC000747530212 994257529 /nfs/dbraw/zinc/25/75/29/994257529.db2.gz QWNXWKGDXHKQMD-QGZVFWFLSA-N 1 1 361.442 2.970 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](N2CCCCC2=O)C1 ZINC000747530212 994257537 /nfs/dbraw/zinc/25/75/37/994257537.db2.gz QWNXWKGDXHKQMD-QGZVFWFLSA-N 1 1 361.442 2.970 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H]1COC(=O)NC1CC1 ZINC000810039970 994685293 /nfs/dbraw/zinc/68/52/93/994685293.db2.gz KUXQFSQHWGYXQS-INIZCTEOSA-N 1 1 363.414 2.847 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1COC(=O)NC1CC1 ZINC000810039970 994685297 /nfs/dbraw/zinc/68/52/97/994685297.db2.gz KUXQFSQHWGYXQS-INIZCTEOSA-N 1 1 363.414 2.847 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000810618450 994838561 /nfs/dbraw/zinc/83/85/61/994838561.db2.gz QGIDCYDSCRGXNH-LBPRGKRZSA-N 1 1 369.381 2.746 20 5 FFBDMO O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001132400115 994873823 /nfs/dbraw/zinc/87/38/23/994873823.db2.gz CMQKFSAWAKQCER-KRWDZBQOSA-N 1 1 361.442 2.887 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494640 995559253 /nfs/dbraw/zinc/55/92/53/995559253.db2.gz PWAIMDDZUSYVDE-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC001133494640 995559264 /nfs/dbraw/zinc/55/92/64/995559264.db2.gz PWAIMDDZUSYVDE-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(C)c(F)ccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000843844209 997440762 /nfs/dbraw/zinc/44/07/62/997440762.db2.gz PXXDATZWARFDBU-AWEZNQCLSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@H]1CN(C(=O)c2c(C)c(F)ccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000843844209 997440768 /nfs/dbraw/zinc/44/07/68/997440768.db2.gz PXXDATZWARFDBU-AWEZNQCLSA-N 1 1 367.421 2.615 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)OCCn2cc[nH+]c2C)c1 ZINC000845287313 998467728 /nfs/dbraw/zinc/46/77/28/998467728.db2.gz XDVUZSPTIGNAIX-UHFFFAOYSA-N 1 1 369.381 2.510 20 5 FFBDMO CCOCC[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])c(Cl)cc2C)CC1 ZINC000823331715 999018083 /nfs/dbraw/zinc/01/80/83/999018083.db2.gz SQPNTQABYSYEHW-UHFFFAOYSA-N 1 1 370.837 2.743 20 5 FFBDMO CC(C)[C@H](C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)[NH+]1CCCC1 ZINC000741013537 999700436 /nfs/dbraw/zinc/70/04/36/999700436.db2.gz KQNWWTDDIYELSM-MRXNPFEDSA-N 1 1 374.397 2.808 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@@H](C(C)C)[NH+]1CCCC1 ZINC000741014012 999700706 /nfs/dbraw/zinc/70/07/06/999700706.db2.gz QCWRCWKOGDXGLD-QGZVFWFLSA-N 1 1 363.414 2.505 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H](C)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741022163 999703894 /nfs/dbraw/zinc/70/38/94/999703894.db2.gz QKPLKQSGJOBHKD-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000741022163 999703897 /nfs/dbraw/zinc/70/38/97/999703897.db2.gz QKPLKQSGJOBHKD-HZSPNIEDSA-N 1 1 363.414 2.646 20 5 FFBDMO C[C@H](C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2)[NH+]1CCCCCC1 ZINC000741029475 999705300 /nfs/dbraw/zinc/70/53/00/999705300.db2.gz PVBVXIMMYLDHIG-CYBMUJFWSA-N 1 1 364.398 2.769 20 5 FFBDMO CC(C)C[C@H]1CC[N@@H+](CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000744437106 999856477 /nfs/dbraw/zinc/85/64/77/999856477.db2.gz GUBSHIPGRUNEQI-KUHUBIRLSA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000745088439 999891549 /nfs/dbraw/zinc/89/15/49/999891549.db2.gz NXKKTJTZQPYTIJ-XJKSGUPXSA-N 1 1 363.414 2.585 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCc3ncnc(-c4ccccc4)c3CC2)C1 ZINC001169024873 1000018079 /nfs/dbraw/zinc/01/80/79/1000018079.db2.gz RWTBWFNMDFWFFV-DOTOQJQBSA-N 1 1 352.438 2.990 20 5 FFBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCc3ncnc(-c4ccccc4)c3CC2)C1 ZINC001169024876 1000018096 /nfs/dbraw/zinc/01/80/96/1000018096.db2.gz RWTBWFNMDFWFFV-WBVHZDCISA-N 1 1 352.438 2.990 20 5 FFBDMO CCOc1cc(C(=O)OCCCn2cc[nH+]c2C)c([N+](=O)[O-])cc1OC ZINC000767519024 1000119734 /nfs/dbraw/zinc/11/97/34/1000119734.db2.gz SQKAUJMNJGYWLF-UHFFFAOYSA-N 1 1 363.370 2.754 20 5 FFBDMO C[C@]1(NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+](Cc2ccccc2)C1 ZINC000846593788 1000382626 /nfs/dbraw/zinc/38/26/26/1000382626.db2.gz SOBXUOHAEKWUDW-IBGZPJMESA-N 1 1 372.400 2.711 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194074 1001674464 /nfs/dbraw/zinc/67/44/64/1001674464.db2.gz ZBLYWHSTDNQAPE-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000787194074 1001674467 /nfs/dbraw/zinc/67/44/67/1001674467.db2.gz ZBLYWHSTDNQAPE-LSDHHAIUSA-N 1 1 368.437 2.912 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000788260678 1001780102 /nfs/dbraw/zinc/78/01/02/1001780102.db2.gz FGNVTEMZBCSQAK-MRXNPFEDSA-N 1 1 360.458 2.508 20 5 FFBDMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000789522666 1002106824 /nfs/dbraw/zinc/10/68/24/1002106824.db2.gz XEAYVZLITMPPDR-KRWDZBQOSA-N 1 1 371.441 2.797 20 5 FFBDMO COC(=O)[C@@H]1C[C@H](C)C[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345426 1003131808 /nfs/dbraw/zinc/13/18/08/1003131808.db2.gz KIIIUASYEWWOGH-KCQAQPDRSA-N 1 1 350.415 2.665 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](Oc3cnccn3)C2)c([N+](=O)[O-])c1 ZINC001170351240 1003136732 /nfs/dbraw/zinc/13/67/32/1003136732.db2.gz BQLDCTXCJDZQON-RHSMWYFYSA-N 1 1 372.425 2.868 20 5 FFBDMO CN(c1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000804814949 1003861937 /nfs/dbraw/zinc/86/19/37/1003861937.db2.gz LMBYHMCDULTFRW-MZBDJJRSSA-N 1 1 358.442 2.548 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(Cc3ccc(Br)cc3[N+](=O)[O-])C[C@@H]2C1 ZINC001196788857 1003955396 /nfs/dbraw/zinc/95/53/96/1003955396.db2.gz DCNVLZYNFFYUHP-YPMHNXCESA-N 1 1 354.248 2.741 20 5 FFBDMO C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001196773855 1003965857 /nfs/dbraw/zinc/96/58/57/1003965857.db2.gz UVECIKVIHAXGBK-KBPBESRZSA-N 1 1 365.430 2.961 20 5 FFBDMO CC[C@H]1C[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H]1O ZINC001193002224 1004339060 /nfs/dbraw/zinc/33/90/60/1004339060.db2.gz LAVIBFZFVYCWPL-ZANVPECISA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@H]1C[N@@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C[C@@H]1O ZINC001193002224 1004339069 /nfs/dbraw/zinc/33/90/69/1004339069.db2.gz LAVIBFZFVYCWPL-ZANVPECISA-N 1 1 352.778 2.501 20 5 FFBDMO CC[C@]1(C(=O)OC(C)(C)C)CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1 ZINC001198310474 1004588671 /nfs/dbraw/zinc/58/86/71/1004588671.db2.gz QPXMPLACSPNXNL-SFHVURJKSA-N 1 1 366.462 2.934 20 5 FFBDMO CCc1nn(C)c(Nc2cccc3c2CC[N@@H+](CC(C)(C)O)C3)c1[N+](=O)[O-] ZINC000808015533 1004738264 /nfs/dbraw/zinc/73/82/64/1004738264.db2.gz RPCUPQICJFPNLA-UHFFFAOYSA-N 1 1 373.457 2.763 20 5 FFBDMO C[C@@H]1CC[C@H](C(N)=O)[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Br ZINC001195595669 1004995404 /nfs/dbraw/zinc/99/54/04/1004995404.db2.gz GFIJWSIQWBJRIE-NRUUGDAUSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1ccc(C)c(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1 ZINC001050326316 1016971112 /nfs/dbraw/zinc/97/11/12/1016971112.db2.gz XFUWKQIJWJHAIG-NXWXRZEISA-N 1 1 359.470 2.733 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776581573 1005962910 /nfs/dbraw/zinc/96/29/10/1005962910.db2.gz KJQRDQXORUSEAA-INIZCTEOSA-N 1 1 365.430 2.571 20 5 FFBDMO CC(C)(C)OC(=O)N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776581573 1005962917 /nfs/dbraw/zinc/96/29/17/1005962917.db2.gz KJQRDQXORUSEAA-INIZCTEOSA-N 1 1 365.430 2.571 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499103 1006415654 /nfs/dbraw/zinc/41/56/54/1006415654.db2.gz IRNCLZAGVWWQEH-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1(C)C ZINC000853499103 1006415657 /nfs/dbraw/zinc/41/56/57/1006415657.db2.gz IRNCLZAGVWWQEH-QAPCUYQASA-N 1 1 359.430 2.946 20 5 FFBDMO Cc1noc(COC(=O)C2CCN(c3ccc(C)c[nH+]3)CC2)c1[N+](=O)[O-] ZINC000853893202 1006574147 /nfs/dbraw/zinc/57/41/47/1006574147.db2.gz LYHCLBAJMZUZBA-UHFFFAOYSA-N 1 1 360.370 2.554 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980907 1006588150 /nfs/dbraw/zinc/58/81/50/1006588150.db2.gz WTWNHDXAGZFGAR-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(c3cccnc3[N+](=O)[O-])C2)O1 ZINC000882980907 1006588158 /nfs/dbraw/zinc/58/81/58/1006588158.db2.gz WTWNHDXAGZFGAR-UZLBHIALSA-N 1 1 368.437 2.860 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001116170390 1032168170 /nfs/dbraw/zinc/16/81/70/1032168170.db2.gz CTUKHNJOQNAKRX-HNNXBMFYSA-N 1 1 366.414 2.790 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCCOc1ccc(OC)cc1[N+](=O)[O-] ZINC001116170390 1032168178 /nfs/dbraw/zinc/16/81/78/1032168178.db2.gz CTUKHNJOQNAKRX-HNNXBMFYSA-N 1 1 366.414 2.790 20 5 FFBDMO C[C@H]1[C@@H](OC(=O)CCn2cc([N+](=O)[O-])cn2)CCC[N@H+]1Cc1ccccc1 ZINC000816468353 1007051639 /nfs/dbraw/zinc/05/16/39/1007051639.db2.gz FWSZBMFVKUVYBS-YJBOKZPZSA-N 1 1 372.425 2.778 20 5 FFBDMO CCCCCCNC(=O)[C@@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000133132611 1007071603 /nfs/dbraw/zinc/07/16/03/1007071603.db2.gz PVHWKQXSBUFYHY-MRXNPFEDSA-N 1 1 365.478 2.774 20 5 FFBDMO CCCCCCNC(=O)[C@@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1 ZINC000133132611 1007071616 /nfs/dbraw/zinc/07/16/16/1007071616.db2.gz PVHWKQXSBUFYHY-MRXNPFEDSA-N 1 1 365.478 2.774 20 5 FFBDMO Cc1c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000855166673 1007149349 /nfs/dbraw/zinc/14/93/49/1007149349.db2.gz NXPGZWINGLZVEM-LBPRGKRZSA-N 1 1 364.402 2.722 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 ZINC000817286405 1007510523 /nfs/dbraw/zinc/51/05/23/1007510523.db2.gz ULLUVJONLKOXRJ-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 ZINC000817286405 1007510531 /nfs/dbraw/zinc/51/05/31/1007510531.db2.gz ULLUVJONLKOXRJ-UHFFFAOYSA-N 1 1 364.465 2.726 20 5 FFBDMO C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000817288623 1007510594 /nfs/dbraw/zinc/51/05/94/1007510594.db2.gz JUFLLAHKEMXUEE-FRFSOERESA-N 1 1 364.442 2.928 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000856353661 1007783167 /nfs/dbraw/zinc/78/31/67/1007783167.db2.gz FSJVPKIVYWTQNC-QGZVFWFLSA-N 1 1 368.437 2.665 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1Cc1ccccc1 ZINC000856353661 1007783173 /nfs/dbraw/zinc/78/31/73/1007783173.db2.gz FSJVPKIVYWTQNC-QGZVFWFLSA-N 1 1 368.437 2.665 20 5 FFBDMO CCc1noc(C[C@@]2(O)CCC[N@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000856677257 1007943867 /nfs/dbraw/zinc/94/38/67/1007943867.db2.gz NCTHIZYSVVPLQS-KUHUBIRLSA-N 1 1 374.441 2.979 20 5 FFBDMO C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000886241275 1008610295 /nfs/dbraw/zinc/61/02/95/1008610295.db2.gz TXDDOYHIIUSUNM-UKRRQHHQSA-N 1 1 364.446 2.973 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C ZINC000886241275 1008610301 /nfs/dbraw/zinc/61/03/01/1008610301.db2.gz TXDDOYHIIUSUNM-UKRRQHHQSA-N 1 1 364.446 2.973 20 5 FFBDMO Cc1[nH]c(C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC2)[nH+]c1C ZINC001178042585 1008855980 /nfs/dbraw/zinc/85/59/80/1008855980.db2.gz DWLNZMGFEHFZMA-UHFFFAOYSA-N 1 1 361.377 2.676 20 5 FFBDMO O=C(NCCCCCC[NH2+]Cc1sccc1Cl)[C@@H]1CC1[N+](=O)[O-] ZINC001178458544 1008994784 /nfs/dbraw/zinc/99/47/84/1008994784.db2.gz KYNWPZAGENJROU-DGCLKSJQSA-N 1 1 359.879 2.833 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823599452 1009133968 /nfs/dbraw/zinc/13/39/68/1009133968.db2.gz UKHQXQZBOFVSLE-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823599452 1009133978 /nfs/dbraw/zinc/13/39/78/1009133978.db2.gz UKHQXQZBOFVSLE-KUHUBIRLSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598050 1009135396 /nfs/dbraw/zinc/13/53/96/1009135396.db2.gz FFLKCIIOPQWKMJ-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823598050 1009135404 /nfs/dbraw/zinc/13/54/04/1009135404.db2.gz FFLKCIIOPQWKMJ-AUUYWEPGSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598053 1009135487 /nfs/dbraw/zinc/13/54/87/1009135487.db2.gz FFLKCIIOPQWKMJ-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823598053 1009135495 /nfs/dbraw/zinc/13/54/95/1009135495.db2.gz FFLKCIIOPQWKMJ-LIRRHRJNSA-N 1 1 357.410 2.761 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000823956530 1009277513 /nfs/dbraw/zinc/27/75/13/1009277513.db2.gz SKSUWUJSSLDTLM-NVXWUHKLSA-N 1 1 355.398 2.744 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cnn(-c2ccc(F)cc2)c1)c1cccc([N+](=O)[O-])c1 ZINC001179352572 1009314046 /nfs/dbraw/zinc/31/40/46/1009314046.db2.gz GEULBYYAIBGQFJ-IBGZPJMESA-N 1 1 370.384 2.917 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cc2ccccc2[nH]c1=O)c1cccc([N+](=O)[O-])c1 ZINC001179352326 1009314324 /nfs/dbraw/zinc/31/43/24/1009314324.db2.gz ASFBGZMEYJGVEI-IBGZPJMESA-N 1 1 353.378 2.846 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000863035249 1010091918 /nfs/dbraw/zinc/09/19/18/1010091918.db2.gz UNUNJBKXXUSJEE-KRWDZBQOSA-N 1 1 372.469 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(-n2cc(C[NH2+][C@H]3CCCc4ccccc43)nn2)nc1 ZINC000864629555 1010534208 /nfs/dbraw/zinc/53/42/08/1010534208.db2.gz QIEDJIBCBFIYPZ-KRWDZBQOSA-N 1 1 350.382 2.738 20 5 FFBDMO CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000865443335 1010786560 /nfs/dbraw/zinc/78/65/60/1010786560.db2.gz YVJDHCHVPWUIPG-UHFFFAOYSA-N 1 1 370.400 2.935 20 5 FFBDMO Cn1ccnc1[C@H](O)[C@@H]1CCCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865625646 1010829676 /nfs/dbraw/zinc/82/96/76/1010829676.db2.gz TVQBQBXFUZKJII-FZKQIMNGSA-N 1 1 367.409 2.827 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC[C@H](O)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000866639860 1011028973 /nfs/dbraw/zinc/02/89/73/1011028973.db2.gz XWCVKPILKYKLAX-ZWKOTPCHSA-N 1 1 358.442 2.949 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1n1ccnc1 ZINC000121643605 1011065974 /nfs/dbraw/zinc/06/59/74/1011065974.db2.gz DWCHIVFCZPOTDP-PBHICJAKSA-N 1 1 367.413 2.590 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@](O)(c3ccc(F)cc3)C1)OCCO2 ZINC000777436441 1011290271 /nfs/dbraw/zinc/29/02/71/1011290271.db2.gz BRDZPTJVEYUOEF-IBGZPJMESA-N 1 1 374.368 2.599 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@](O)(c3ccc(F)cc3)C1)OCCO2 ZINC000777436441 1011290279 /nfs/dbraw/zinc/29/02/79/1011290279.db2.gz BRDZPTJVEYUOEF-IBGZPJMESA-N 1 1 374.368 2.599 20 5 FFBDMO O=C(OCc1ccc(C[NH+]2CCOCC2)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000869897439 1012004239 /nfs/dbraw/zinc/00/42/39/1012004239.db2.gz UFFAUIBPWWPVEZ-UHFFFAOYSA-N 1 1 374.368 2.923 20 5 FFBDMO C[C@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[C@@H]1CO ZINC001173009676 1012179299 /nfs/dbraw/zinc/17/92/99/1012179299.db2.gz HAAJSOCHXHKDPK-YVEFUNNKSA-N 1 1 369.412 2.935 20 5 FFBDMO CN(C)[C@@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173013814 1012183377 /nfs/dbraw/zinc/18/33/77/1012183377.db2.gz YEZXTQJCAUDHGY-CQSZACIVSA-N 1 1 368.428 2.868 20 5 FFBDMO CN(C)[C@@H]1CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173013814 1012183390 /nfs/dbraw/zinc/18/33/90/1012183390.db2.gz YEZXTQJCAUDHGY-CQSZACIVSA-N 1 1 368.428 2.868 20 5 FFBDMO COC(=O)[C@@H]1CC[C@@H](C)[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173180473 1012324843 /nfs/dbraw/zinc/32/48/43/1012324843.db2.gz KZVXTUDAZFPCSF-FRRDWIJNSA-N 1 1 368.405 2.947 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2CC[C@@H]([N@@H+](C)C3CC3)C2)c1F ZINC001173192119 1012334804 /nfs/dbraw/zinc/33/48/04/1012334804.db2.gz IGMNMOLOKYITOV-TZMCWYRMSA-N 1 1 351.422 2.842 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCN(C(=O)c3ccco3)[C@@H]2C1 ZINC001173223266 1012354915 /nfs/dbraw/zinc/35/49/15/1012354915.db2.gz AMBURFQUUOITPN-UWWQBHOKSA-N 1 1 369.421 2.965 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227720 1012359802 /nfs/dbraw/zinc/35/98/02/1012359802.db2.gz VIRLWRKLZXORJF-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)Cc2ncn(C)c21 ZINC001173227720 1012359817 /nfs/dbraw/zinc/35/98/17/1012359817.db2.gz VIRLWRKLZXORJF-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC(=O)c1ncn2c1C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173225988 1012361363 /nfs/dbraw/zinc/36/13/63/1012361363.db2.gz KKWHGHKZJYUMDA-CQSZACIVSA-N 1 1 372.425 2.805 20 5 FFBDMO CCOC(=O)c1ncn2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173225988 1012361384 /nfs/dbraw/zinc/36/13/84/1012361384.db2.gz KKWHGHKZJYUMDA-CQSZACIVSA-N 1 1 372.425 2.805 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nn(C)cc1Br ZINC001173235451 1012366175 /nfs/dbraw/zinc/36/61/75/1012366175.db2.gz SVEQIAZFTQGJPP-SNVBAGLBSA-N 1 1 353.220 2.812 20 5 FFBDMO COc1cc(C)nc(O[C@H]2CC[N@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001173237127 1012383768 /nfs/dbraw/zinc/38/37/68/1012383768.db2.gz IAZCJIVNXHLWAZ-PBHICJAKSA-N 1 1 372.425 2.786 20 5 FFBDMO O=[N+]([O-])c1ccc2cnn(CN3CC[C@H]4[C@@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000252692209 1012630219 /nfs/dbraw/zinc/63/02/19/1012630219.db2.gz RHQVSPLPRGBJER-YJBOKZPZSA-N 1 1 355.442 2.851 20 5 FFBDMO CC[C@@H]1CCC[N@H+]1C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC001173698855 1012901658 /nfs/dbraw/zinc/90/16/58/1012901658.db2.gz RNBVPDFVAWVKTO-CQSZACIVSA-N 1 1 367.471 2.622 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC[C@@H]21 ZINC000827330622 1017640734 /nfs/dbraw/zinc/64/07/34/1017640734.db2.gz QBULSIVHDZNGPY-CJNGLKHVSA-N 1 1 372.450 2.885 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc(F)cc3c(=O)c4cc(F)ccc4[nH]c23)CC[N@H+]1C ZINC000928440783 1018978195 /nfs/dbraw/zinc/97/81/95/1018978195.db2.gz KXNOHNBDRMBGSA-MGPLVRAMSA-N 1 1 371.387 2.782 20 5 FFBDMO C[N@H+]1C[C@@H]2CN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)C[C@]2(C)C1 ZINC000929834662 1019679706 /nfs/dbraw/zinc/67/97/06/1019679706.db2.gz PBDROPSBRYTOAL-HWPZZCPQSA-N 1 1 370.356 2.612 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CCC[C@H](C(F)(F)F)O3)C2)nc1 ZINC000929989945 1019795698 /nfs/dbraw/zinc/79/56/98/1019795698.db2.gz TYSHQFMLJZIBCS-MRVWCRGKSA-N 1 1 374.363 2.976 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000930314219 1019975330 /nfs/dbraw/zinc/97/53/30/1019975330.db2.gz DEZUYMDPJFHIQE-HNNXBMFYSA-N 1 1 362.430 2.586 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000902537729 1020265520 /nfs/dbraw/zinc/26/55/20/1020265520.db2.gz DJEXXCWCXNVUQC-RTBURBONSA-N 1 1 374.485 2.530 20 5 FFBDMO CCOc1cc(C[NH+]2CCC(O)(Cc3ccccn3)CC2)ccc1[N+](=O)[O-] ZINC000930988900 1020271978 /nfs/dbraw/zinc/27/19/78/1020271978.db2.gz FOTAETWNVUYLCA-UHFFFAOYSA-N 1 1 371.437 2.958 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C3)c1 ZINC001048525122 1020276030 /nfs/dbraw/zinc/27/60/30/1020276030.db2.gz MBCKZNARQVZWDN-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1cc(C)cc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525122 1020276035 /nfs/dbraw/zinc/27/60/35/1020276035.db2.gz MBCKZNARQVZWDN-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO Cc1cc(C)cc(C[N@@H+]2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C3)c1 ZINC001048525122 1020276043 /nfs/dbraw/zinc/27/60/43/1020276043.db2.gz MBCKZNARQVZWDN-HKUYMTLNSA-N 1 1 371.481 2.828 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC000931495361 1020489814 /nfs/dbraw/zinc/48/98/14/1020489814.db2.gz JMBBWADDUAYGRP-INIZCTEOSA-N 1 1 362.430 2.532 20 5 FFBDMO Cc1cccc(C[N@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000726586993 1020490110 /nfs/dbraw/zinc/49/01/10/1020490110.db2.gz KTTRVIQJLFPWBP-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO Cc1cccc(C[N@@H+](C)CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000726586993 1020490117 /nfs/dbraw/zinc/49/01/17/1020490117.db2.gz KTTRVIQJLFPWBP-UHFFFAOYSA-N 1 1 368.393 2.761 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3ccn(C)n3)C2)c([N+](=O)[O-])c1 ZINC000932135480 1020716034 /nfs/dbraw/zinc/71/60/34/1020716034.db2.gz LAQAUVDIQQNVLN-AWEZNQCLSA-N 1 1 360.414 2.595 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932138800 1020718255 /nfs/dbraw/zinc/71/82/55/1020718255.db2.gz YUFULMLGUDTRJT-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000932138800 1020718257 /nfs/dbraw/zinc/71/82/57/1020718257.db2.gz YUFULMLGUDTRJT-ZIAGYGMSSA-N 1 1 357.414 2.535 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](CO)C2)o1 ZINC001118013597 1022019250 /nfs/dbraw/zinc/01/92/50/1022019250.db2.gz ZQPLRMJHPIGTQV-BDJLRTHQSA-N 1 1 366.801 2.683 20 5 FFBDMO CC(C)CC[N@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000045722195 1022424175 /nfs/dbraw/zinc/42/41/75/1022424175.db2.gz AERIYXRDJJAIQO-IBGZPJMESA-N 1 1 374.441 2.830 20 5 FFBDMO CC(C)CC[N@@H+](CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1 ZINC000045722195 1022424184 /nfs/dbraw/zinc/42/41/84/1022424184.db2.gz AERIYXRDJJAIQO-IBGZPJMESA-N 1 1 374.441 2.830 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000047213892 1022526339 /nfs/dbraw/zinc/52/63/39/1022526339.db2.gz FIQJVQABTVAGQX-OAHLLOKOSA-N 1 1 362.474 2.903 20 5 FFBDMO Cc1ccccc1C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001039485627 1022760211 /nfs/dbraw/zinc/76/02/11/1022760211.db2.gz GWLVTEWEPXFAKI-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1ccccc1C[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001039485627 1022760220 /nfs/dbraw/zinc/76/02/20/1022760220.db2.gz GWLVTEWEPXFAKI-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO Cc1ccccc1C[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001039485627 1022760228 /nfs/dbraw/zinc/76/02/28/1022760228.db2.gz GWLVTEWEPXFAKI-WOJBJXKFSA-N 1 1 371.481 2.863 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCCc1ccccc1)CC2 ZINC001040701204 1022954687 /nfs/dbraw/zinc/95/46/87/1022954687.db2.gz WKQYXDBKUXMGJG-RTBURBONSA-N 1 1 371.481 2.599 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](C/C=C\c1ccccc1)CC2 ZINC001040699209 1022954758 /nfs/dbraw/zinc/95/47/58/1022954758.db2.gz AGTHQEUJVQUOCH-ZSKSOVMSSA-N 1 1 369.465 2.680 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350648 1033113969 /nfs/dbraw/zinc/11/39/69/1033113969.db2.gz QZTFXIFXSSZUCD-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@]1(O)CCc2ccccc21 ZINC000829350648 1033113978 /nfs/dbraw/zinc/11/39/78/1033113978.db2.gz QZTFXIFXSSZUCD-VBKZILBWSA-N 1 1 369.421 2.688 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC001121700258 1023934464 /nfs/dbraw/zinc/93/44/64/1023934464.db2.gz UNTHOXWKJXLOKU-HRCADAONSA-N 1 1 364.494 2.727 20 5 FFBDMO O=C(NCC1CC[NH+](CC/C=C/c2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001223113940 1033293965 /nfs/dbraw/zinc/29/39/65/1033293965.db2.gz FCFNIRHJJFVZBE-KDBJMCLYSA-N 1 1 357.454 2.583 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000246569837 1026273572 /nfs/dbraw/zinc/27/35/72/1026273572.db2.gz RHZKAPPCNKGVBE-KSSFIOAISA-N 1 1 355.442 2.851 20 5 FFBDMO C[C@@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000839646239 1026772747 /nfs/dbraw/zinc/77/27/47/1026772747.db2.gz KTFRQWYFISFAJL-OXQOHEQNSA-N 1 1 355.438 2.835 20 5 FFBDMO COC[C@]1(C)CC(=O)N(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840127003 1026970014 /nfs/dbraw/zinc/97/00/14/1026970014.db2.gz QMUDIFVLOJUKMI-VQIMIIECSA-N 1 1 361.442 2.617 20 5 FFBDMO COC[C@]1(C)CC(=O)N(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000840127003 1026970020 /nfs/dbraw/zinc/97/00/20/1026970020.db2.gz QMUDIFVLOJUKMI-VQIMIIECSA-N 1 1 361.442 2.617 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1 ZINC000840138463 1026978425 /nfs/dbraw/zinc/97/84/25/1026978425.db2.gz QZBFRXODMLJEFV-PBHICJAKSA-N 1 1 372.425 2.910 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000840159314 1026991689 /nfs/dbraw/zinc/99/16/89/1026991689.db2.gz HLZZIKGKLUNYPH-SFHVURJKSA-N 1 1 360.414 2.956 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000840159314 1026991695 /nfs/dbraw/zinc/99/16/95/1026991695.db2.gz HLZZIKGKLUNYPH-SFHVURJKSA-N 1 1 360.414 2.956 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000840224248 1027011571 /nfs/dbraw/zinc/01/15/71/1027011571.db2.gz DFQURLBPYWNJMG-CQSZACIVSA-N 1 1 358.398 2.812 20 5 FFBDMO C/C(=C\C(=O)N(C)C(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000840567836 1027120924 /nfs/dbraw/zinc/12/09/24/1027120924.db2.gz DKQOUPUMWUILFY-FYWRMAATSA-N 1 1 361.442 2.567 20 5 FFBDMO CCc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001160106855 1027593940 /nfs/dbraw/zinc/59/39/40/1027593940.db2.gz FAEHWZBUISMIPT-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1ccc(C[N@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160106855 1027593947 /nfs/dbraw/zinc/59/39/47/1027593947.db2.gz FAEHWZBUISMIPT-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO CCc1ccc(C[N@@H+]2CC=C(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001160106855 1027593952 /nfs/dbraw/zinc/59/39/52/1027593952.db2.gz FAEHWZBUISMIPT-RTBURBONSA-N 1 1 357.454 2.553 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(N[C@@H]3CCC[C@H]3[NH+]3CCOCC3)nn2)cc1 ZINC001160722881 1027825251 /nfs/dbraw/zinc/82/52/51/1027825251.db2.gz DJVROAJCCSMHMB-QZTJIDSGSA-N 1 1 369.425 2.717 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1ccc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)nn1 ZINC001160732622 1027838408 /nfs/dbraw/zinc/83/84/08/1027838408.db2.gz QYJMHNDMPCUOBY-SJLPKXTDSA-N 1 1 369.425 2.717 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249741389 1028289103 /nfs/dbraw/zinc/28/91/03/1028289103.db2.gz IVKNXPIPFKTGFL-NEPJUHHUSA-N 1 1 364.402 2.662 20 5 FFBDMO CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1cnc2cc([N+](=O)[O-])ccc2n1 ZINC001162877567 1028691136 /nfs/dbraw/zinc/69/11/36/1028691136.db2.gz JRZYOBTXSGTPRT-MRXNPFEDSA-N 1 1 359.430 2.697 20 5 FFBDMO C[C@H]1CN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC001163069901 1028785439 /nfs/dbraw/zinc/78/54/39/1028785439.db2.gz SBNWJTKEQHXNKE-LBPRGKRZSA-N 1 1 362.405 2.564 20 5 FFBDMO Cc1noc(C2(C)CC[NH+](Cn3ncc4ccc([N+](=O)[O-])cc43)CC2)n1 ZINC000781151128 1029026944 /nfs/dbraw/zinc/02/69/44/1029026944.db2.gz WPMAWUBFMBAURA-UHFFFAOYSA-N 1 1 356.386 2.647 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]2CCCC[C@H]21)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000245612880 1029044314 /nfs/dbraw/zinc/04/43/14/1029044314.db2.gz WPEMUKSYYJMMQQ-TZMCWYRMSA-N 1 1 361.398 2.917 20 5 FFBDMO O=C(NCCC1(C[NH2+]Cc2cc(Cl)ccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001164490531 1029294779 /nfs/dbraw/zinc/29/47/79/1029294779.db2.gz LPMONIJPPAUCMW-UKRRQHHQSA-N 1 1 369.824 2.520 20 5 FFBDMO O=[N+]([O-])c1cnc(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c([N+](=O)[O-])c1 ZINC001165083547 1029370437 /nfs/dbraw/zinc/37/04/37/1029370437.db2.gz GXWKUOUYSBUNLE-PBHICJAKSA-N 1 1 369.381 2.609 20 5 FFBDMO COc1cc(N2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)ncc1[N+](=O)[O-] ZINC001165086704 1029376042 /nfs/dbraw/zinc/37/60/42/1029376042.db2.gz OBMGJZQUKRTGPO-DOTOQJQBSA-N 1 1 354.410 2.709 20 5 FFBDMO C[N@@H+]1C[C@H]2CN(c3ccc(-c4ccc(Cl)c([N+](=O)[O-])c4)nn3)C[C@H]2C1 ZINC001165146519 1029419968 /nfs/dbraw/zinc/41/99/68/1029419968.db2.gz AQMUMTQJSXTVBL-BETUJISGSA-N 1 1 359.817 2.703 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NCc1ccc(N)[nH+]c1C ZINC001156974512 1029426645 /nfs/dbraw/zinc/42/66/45/1029426645.db2.gz LQNBWKITFLHQIF-UHFFFAOYSA-N 1 1 365.777 2.718 20 5 FFBDMO Cc1nc(N2CCC([N@@H+](C)Cc3ccc(F)cc3)CC2)ncc1[N+](=O)[O-] ZINC001157082564 1029459655 /nfs/dbraw/zinc/45/96/55/1029459655.db2.gz BVDYEACDWNTJAJ-UHFFFAOYSA-N 1 1 359.405 2.933 20 5 FFBDMO CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000782095209 1029565768 /nfs/dbraw/zinc/56/57/68/1029565768.db2.gz JKESWYJSDQUMAP-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000782095209 1029565776 /nfs/dbraw/zinc/56/57/76/1029565776.db2.gz JKESWYJSDQUMAP-CQSZACIVSA-N 1 1 367.450 2.513 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000136515808 1029571373 /nfs/dbraw/zinc/57/13/73/1029571373.db2.gz GWJQEMWZAJLVLG-MRXNPFEDSA-N 1 1 370.453 2.999 20 5 FFBDMO C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])cc1N1CCOC1=O)CC2 ZINC000782357455 1029670220 /nfs/dbraw/zinc/67/02/20/1029670220.db2.gz NUBJYPIZEWIDEJ-UHFFFAOYSA-N 1 1 360.414 2.616 20 5 FFBDMO CC(C)(C)C[C@H]1CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)O1 ZINC000782861591 1029839817 /nfs/dbraw/zinc/83/98/17/1029839817.db2.gz XMTPXDPRYLJMBI-AWEZNQCLSA-N 1 1 365.434 2.643 20 5 FFBDMO COC(=O)c1cc([N+](=O)[O-])c(NCC[C@@H]2CCC[N@@H+](C)C2)cc1OC ZINC001165290441 1029931644 /nfs/dbraw/zinc/93/16/44/1029931644.db2.gz UOLBQWPKWGLLGN-LBPRGKRZSA-N 1 1 351.403 2.534 20 5 FFBDMO C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@]1(O)CCc2ccccc21 ZINC000843423116 1031395138 /nfs/dbraw/zinc/39/51/38/1031395138.db2.gz ZVGOGRZSQXVMDI-HXUWFJFHSA-N 1 1 370.405 2.632 20 5 FFBDMO Cc1nn(CN2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c(C)c1[N+](=O)[O-] ZINC000799941735 1031928480 /nfs/dbraw/zinc/92/84/80/1031928480.db2.gz CSSQNRYGNWLLNU-OAHLLOKOSA-N 1 1 358.446 2.778 20 5 FFBDMO N=c1cc(C[NH3+])ccn1C(=O)[C@@H](N)Cc1c2ccccc2cc2ccccc21 ZINC001220044996 1033957556 /nfs/dbraw/zinc/95/75/56/1033957556.db2.gz HKGIMRPQMOPKBT-NRFANRHFSA-N 1 1 370.456 2.943 20 5 FFBDMO COc1cc(O[C@H]2COCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001225441481 1034256745 /nfs/dbraw/zinc/25/67/45/1034256745.db2.gz PHRFHQQHAWODIR-QGZVFWFLSA-N 1 1 358.394 2.883 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1 ZINC000832040832 1034509168 /nfs/dbraw/zinc/50/91/68/1034509168.db2.gz JALBOLNDPBMIFA-QAPCUYQASA-N 1 1 362.426 2.981 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1C(N)=O ZINC001226173577 1034558812 /nfs/dbraw/zinc/55/88/12/1034558812.db2.gz UGXQXEPJCGZUPJ-UGSOOPFHSA-N 1 1 355.394 2.593 20 5 FFBDMO COC(=O)Cc1ccc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001226215511 1034575467 /nfs/dbraw/zinc/57/54/67/1034575467.db2.gz XRSGHOSTUWNUGI-QGZVFWFLSA-N 1 1 370.405 2.964 20 5 FFBDMO CC[N@H+]1CCO[C@@H]2CN(Cc3ccc4ccc5cccnc5c4n3)C[C@@H]2C1 ZINC001232222713 1035503328 /nfs/dbraw/zinc/50/33/28/1035503328.db2.gz QAPJJUSKPXPGQC-AZUAARDMSA-N 1 1 362.477 2.936 20 5 FFBDMO COC(=O)C1=C[C@@H](Oc2ccccc2[N+](=O)[O-])C[N@H+](Cc2ccccc2)C1 ZINC001227483950 1035576160 /nfs/dbraw/zinc/57/61/60/1035576160.db2.gz FVMYHMRQWRCPGN-QGZVFWFLSA-N 1 1 368.389 2.957 20 5 FFBDMO COC(=O)C1=C[C@@H](Oc2ccccc2[N+](=O)[O-])C[N@@H+](Cc2ccccc2)C1 ZINC001227483950 1035576164 /nfs/dbraw/zinc/57/61/64/1035576164.db2.gz FVMYHMRQWRCPGN-QGZVFWFLSA-N 1 1 368.389 2.957 20 5 FFBDMO O=c1[nH]cnc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1[N+](=O)[O-] ZINC001228141715 1035958019 /nfs/dbraw/zinc/95/80/19/1035958019.db2.gz TUWDNAIYTVLFEX-FICVDOATSA-N 1 1 356.382 2.665 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228143385 1035958680 /nfs/dbraw/zinc/95/86/80/1035958680.db2.gz LTQITPLQVGZSRA-CQSZACIVSA-N 1 1 358.398 2.770 20 5 FFBDMO Cc1ccc(N2CCC(Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)CC2)[nH+]c1 ZINC001230231516 1037163947 /nfs/dbraw/zinc/16/39/47/1037163947.db2.gz MANWGNCMNFLSMF-UHFFFAOYSA-N 1 1 354.370 2.617 20 5 FFBDMO COc1cc(N2CCC([N@@H+](C)C3CCN(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC001256093665 1038378819 /nfs/dbraw/zinc/37/88/19/1038378819.db2.gz DBCDXTDCVPWXDB-UHFFFAOYSA-N 1 1 362.474 2.598 20 5 FFBDMO CCN(CC)CC[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256095109 1038379107 /nfs/dbraw/zinc/37/91/07/1038379107.db2.gz YVBRTIYMUIIPDM-UHFFFAOYSA-N 1 1 364.490 2.846 20 5 FFBDMO CC[NH+](CC)CCN(C)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256095109 1038379122 /nfs/dbraw/zinc/37/91/22/1038379122.db2.gz YVBRTIYMUIIPDM-UHFFFAOYSA-N 1 1 364.490 2.846 20 5 FFBDMO CC[N@@H+](CC(C)(C)O)C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC001256100943 1038384721 /nfs/dbraw/zinc/38/47/21/1038384721.db2.gz VVUQSCLZWGCUCJ-UHFFFAOYSA-N 1 1 351.447 2.665 20 5 FFBDMO COc1cc(N2CCC([NH+]3CC(N4CCCCC4)C3)CC2)ccc1[N+](=O)[O-] ZINC001256100969 1038384837 /nfs/dbraw/zinc/38/48/37/1038384837.db2.gz WQDGJZAQQSQPJQ-UHFFFAOYSA-N 1 1 374.485 2.742 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@H]4CC[C@@H](C3)N4C)CC2)ccc1[N+](=O)[O-] ZINC001256101332 1038387368 /nfs/dbraw/zinc/38/73/68/1038387368.db2.gz FHLZKPYRFBZCEF-QAPCUYQASA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101332 1038387381 /nfs/dbraw/zinc/38/73/81/1038387381.db2.gz FHLZKPYRFBZCEF-QAPCUYQASA-N 1 1 374.485 2.741 20 5 FFBDMO COc1cc(N2CCC(N3CC[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC001256101332 1038387397 /nfs/dbraw/zinc/38/73/97/1038387397.db2.gz FHLZKPYRFBZCEF-QAPCUYQASA-N 1 1 374.485 2.741 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(-c3cc(Cl)cc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC001258150657 1039230632 /nfs/dbraw/zinc/23/06/32/1039230632.db2.gz AUOQCAWXKLONLC-PHIMTYICSA-N 1 1 366.805 2.950 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H](N1CCOC[C@]3(CCC[NH2+]C3)C1)CC2 ZINC001246633202 1039424839 /nfs/dbraw/zinc/42/48/39/1039424839.db2.gz FBRQXYUKSPNGEI-QUCCMNQESA-N 1 1 359.470 2.544 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)N1 ZINC001246825124 1039492999 /nfs/dbraw/zinc/49/29/99/1039492999.db2.gz QHLXTTVQUBCCGQ-TXEJJXNPSA-N 1 1 354.401 2.524 20 5 FFBDMO C[C@@H]1C[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C[C@H](C)N1 ZINC001246825124 1039493005 /nfs/dbraw/zinc/49/30/05/1039493005.db2.gz QHLXTTVQUBCCGQ-TXEJJXNPSA-N 1 1 354.401 2.524 20 5 FFBDMO C[N@@H+](CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)Cc1ccc(F)cc1 ZINC001252578883 1039601173 /nfs/dbraw/zinc/60/11/73/1039601173.db2.gz LXWLLPYZLHXWGV-UHFFFAOYSA-N 1 1 372.400 2.891 20 5 FFBDMO CC(=O)NCCn1c2ccccc2[nH+]c1Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001211192746 1039988483 /nfs/dbraw/zinc/98/84/83/1039988483.db2.gz KZNVGRONHFDDRC-UHFFFAOYSA-N 1 1 357.345 2.963 20 5 FFBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccc3c(c2)OCCO3)no1 ZINC001248208852 1040171824 /nfs/dbraw/zinc/17/18/24/1040171824.db2.gz MDQOGLLSXSVRHA-CQSZACIVSA-N 1 1 368.349 2.659 20 5 FFBDMO O=c1ccc2c([nH]1)CC[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)CC2 ZINC001254479914 1040745356 /nfs/dbraw/zinc/74/53/56/1040745356.db2.gz QAEKFLYKHPQTBH-UHFFFAOYSA-N 1 1 368.437 2.765 20 5 FFBDMO CC(=O)N1CCC[C@H]([N@@H+](C)C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001254480307 1040747854 /nfs/dbraw/zinc/74/78/54/1040747854.db2.gz DQLQHRKZPCGNBQ-IBGZPJMESA-N 1 1 360.458 2.506 20 5 FFBDMO COC(=O)[C@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC001254482980 1040749019 /nfs/dbraw/zinc/74/90/19/1040749019.db2.gz NVQQJCHGTHPNGE-HNNXBMFYSA-N 1 1 361.442 2.839 20 5 FFBDMO CCOC[C@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553320 1040794822 /nfs/dbraw/zinc/79/48/22/1040794822.db2.gz VAFVKUUTJKZTQE-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2c1cnn2C ZINC001254553320 1040794839 /nfs/dbraw/zinc/79/48/39/1040794839.db2.gz VAFVKUUTJKZTQE-GDBMZVCRSA-N 1 1 358.442 2.895 20 5 FFBDMO CCOC[C@@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560823 1040795875 /nfs/dbraw/zinc/79/58/75/1040795875.db2.gz HNPSRMWQAWVNSF-ZBFHGGJFSA-N 1 1 373.457 2.773 20 5 FFBDMO CCOC[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])Cc2nnn(CC)c21 ZINC001254560823 1040795899 /nfs/dbraw/zinc/79/58/99/1040795899.db2.gz HNPSRMWQAWVNSF-ZBFHGGJFSA-N 1 1 373.457 2.773 20 5 FFBDMO CCN(C)c1ncnc2c1CC[N@H+]([C@@H](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC001254563033 1040800571 /nfs/dbraw/zinc/80/05/71/1040800571.db2.gz WMJMUIWMIRPJHG-HNNXBMFYSA-N 1 1 369.469 2.873 20 5 FFBDMO CN1CCN(c2ccccc2C[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001254583924 1040817192 /nfs/dbraw/zinc/81/71/92/1040817192.db2.gz OYWSHZSSTPPGEB-IBGZPJMESA-N 1 1 366.465 2.604 20 5 FFBDMO O=C1[C@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2CN1c1ccccc1 ZINC001254595888 1040825876 /nfs/dbraw/zinc/82/58/76/1040825876.db2.gz OCUQKRLPUHWKSF-VDGAXYAQSA-N 1 1 363.417 2.657 20 5 FFBDMO Cc1cccc(N2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CC2)n1 ZINC001254607277 1040834258 /nfs/dbraw/zinc/83/42/58/1040834258.db2.gz KQCFLOJIRZOFRD-IBGZPJMESA-N 1 1 352.438 2.978 20 5 FFBDMO Cc1cc(O[C@H]2CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ncn1 ZINC001254610334 1040839368 /nfs/dbraw/zinc/83/93/68/1040839368.db2.gz JQOQRMZIKMLXIF-ROUUACIJSA-N 1 1 354.410 2.704 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCCc2ccccc2)CC1 ZINC001278607984 1041406113 /nfs/dbraw/zinc/40/61/13/1041406113.db2.gz UACIWDDYZMOPFH-QZTJIDSGSA-N 1 1 359.470 2.503 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)o1 ZINC001262011947 1041510429 /nfs/dbraw/zinc/51/04/29/1041510429.db2.gz FONZCHFIKJTWKS-TXEJJXNPSA-N 1 1 366.801 2.541 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC001310265025 1043658954 /nfs/dbraw/zinc/65/89/54/1043658954.db2.gz ZXARSYAFBUZUIB-JSGCOSHPSA-N 1 1 370.862 2.950 20 5 FFBDMO Cc1cncc([N+](=O)[O-])c1NC(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001310517772 1043700532 /nfs/dbraw/zinc/70/05/32/1043700532.db2.gz CHWNXWZCMCECTC-OKILXGFUSA-N 1 1 363.462 2.600 20 5 FFBDMO CC[N@H+]1CCN(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC001312381007 1044104694 /nfs/dbraw/zinc/10/46/94/1044104694.db2.gz NZOZKYOLHGELKF-LBPRGKRZSA-N 1 1 354.838 2.526 20 5 FFBDMO CCC1([NH2+]CCc2ccc(C)cc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281004400 1044792887 /nfs/dbraw/zinc/79/28/87/1044792887.db2.gz NBWXZYIUOJMQDU-QZTJIDSGSA-N 1 1 359.470 2.564 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)cc1 ZINC001319485174 1045168187 /nfs/dbraw/zinc/16/81/87/1045168187.db2.gz LVSGIQFSJCEXFZ-VQIMIIECSA-N 1 1 372.400 2.707 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[N@@H+]1Cc1ccncc1 ZINC001318487851 1045312510 /nfs/dbraw/zinc/31/25/10/1045312510.db2.gz WIZFLGZNBPGBTH-SFHVURJKSA-N 1 1 354.410 2.661 20 5 FFBDMO O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[N@H+]1Cc1ccncc1 ZINC001318487851 1045312519 /nfs/dbraw/zinc/31/25/19/1045312519.db2.gz WIZFLGZNBPGBTH-SFHVURJKSA-N 1 1 354.410 2.661 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001325063896 1046360787 /nfs/dbraw/zinc/36/07/87/1046360787.db2.gz HIVHKOZQVPLMDM-KRWDZBQOSA-N 1 1 374.384 2.842 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001325063896 1046360800 /nfs/dbraw/zinc/36/08/00/1046360800.db2.gz HIVHKOZQVPLMDM-KRWDZBQOSA-N 1 1 374.384 2.842 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)/C=C\c4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3 ZINC001540270187 1070812627 /nfs/dbraw/zinc/81/26/27/1070812627.db2.gz DJTQPWJIUNCKOW-HMVHIAHLSA-N 1 1 355.438 2.942 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](Cc3nccn3C)C2)c1 ZINC001326387971 1046911577 /nfs/dbraw/zinc/91/15/77/1046911577.db2.gz NHFVHWKWTPTFLO-AWEZNQCLSA-N 1 1 372.425 2.570 20 5 FFBDMO Cc1cccc(Cl)c1C[N@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001327213586 1047238026 /nfs/dbraw/zinc/23/80/26/1047238026.db2.gz UYGPTAMOBXDPST-CZUORRHYSA-N 1 1 353.850 2.594 20 5 FFBDMO Cc1cccc(Cl)c1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001327213586 1047238036 /nfs/dbraw/zinc/23/80/36/1047238036.db2.gz UYGPTAMOBXDPST-CZUORRHYSA-N 1 1 353.850 2.594 20 5 FFBDMO Cc1cccc(Cl)c1C[N@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001327213586 1047238045 /nfs/dbraw/zinc/23/80/45/1047238045.db2.gz UYGPTAMOBXDPST-CZUORRHYSA-N 1 1 353.850 2.594 20 5 FFBDMO O=C(CCc1c(Cl)cccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001332911454 1048617677 /nfs/dbraw/zinc/61/76/77/1048617677.db2.gz JDZPKTIYFWELES-STQMWFEESA-N 1 1 351.834 2.924 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC001333317007 1048832301 /nfs/dbraw/zinc/83/23/01/1048832301.db2.gz QWBYEKFENOPYGO-HOCLYGCPSA-N 1 1 372.450 2.814 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@H](c2nccs2)C1 ZINC001333317007 1048832310 /nfs/dbraw/zinc/83/23/10/1048832310.db2.gz QWBYEKFENOPYGO-HOCLYGCPSA-N 1 1 372.450 2.814 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC001329881151 1048947703 /nfs/dbraw/zinc/94/77/03/1048947703.db2.gz USXCPUABKYBFMA-HZMBPMFUSA-N 1 1 368.231 2.524 20 5 FFBDMO Nc1nc(NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3Cc2ccccc2)ncc1[N+](=O)[O-] ZINC001330154946 1049061030 /nfs/dbraw/zinc/06/10/30/1049061030.db2.gz FTBSLYNMQYLLFG-MQVJKMGUSA-N 1 1 368.441 2.965 20 5 FFBDMO COC(=O)/C=C\c1ccc(N[C@H]2CCC[N@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153578 1049434342 /nfs/dbraw/zinc/43/43/42/1049434342.db2.gz ZREYMPCLEBOTQN-VSKVDJIOSA-N 1 1 351.378 2.627 20 5 FFBDMO COC(=O)/C=C\c1ccc(N[C@H]2CCC[N@@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC001307153578 1049434344 /nfs/dbraw/zinc/43/43/44/1049434344.db2.gz ZREYMPCLEBOTQN-VSKVDJIOSA-N 1 1 351.378 2.627 20 5 FFBDMO CCn1c(-c2cccc([N+](=O)[O-])c2C)nnc1N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC001342553199 1051156590 /nfs/dbraw/zinc/15/65/90/1051156590.db2.gz FWJPDNWCQJAXKB-IFXJQAMLSA-N 1 1 370.457 2.570 20 5 FFBDMO CCc1[nH+]ccn1CCNC(=O)CSc1ccc(Cl)cc1[N+](=O)[O-] ZINC001303469160 1051361024 /nfs/dbraw/zinc/36/10/24/1051361024.db2.gz BPOWIEJLGJGHRX-UHFFFAOYSA-N 1 1 368.846 2.916 20 5 FFBDMO C[C@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001303545160 1051381988 /nfs/dbraw/zinc/38/19/88/1051381988.db2.gz XYKBQGSBIQTNFM-NSHDSACASA-N 1 1 366.849 2.919 20 5 FFBDMO CN(C)c1[nH+]cc(CNc2c3cccc(Cl)c3ncc2[N+](=O)[O-])n1C ZINC001306958833 1052228287 /nfs/dbraw/zinc/22/82/87/1052228287.db2.gz MQXXMOIUDRLTQT-UHFFFAOYSA-N 1 1 360.805 2.630 20 5 FFBDMO C[N@@H+](CCNc1cc(F)c([N+](=O)[O-])cc1CO)Cc1ccc(F)cc1 ZINC001306989857 1052232612 /nfs/dbraw/zinc/23/26/12/1052232612.db2.gz PFYXWMGPQZITTL-UHFFFAOYSA-N 1 1 351.353 2.909 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+]2CCC[C@@H]2c2ncccn2)c([N+](=O)[O-])c1 ZINC001307946509 1052370910 /nfs/dbraw/zinc/37/09/10/1052370910.db2.gz NXOCOEPPJAZHNA-OAHLLOKOSA-N 1 1 371.397 2.559 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2c2ncccn2)c([N+](=O)[O-])c1 ZINC001307946509 1052370915 /nfs/dbraw/zinc/37/09/15/1052370915.db2.gz NXOCOEPPJAZHNA-OAHLLOKOSA-N 1 1 371.397 2.559 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)(C)C(=O)OC ZINC001308100202 1052405977 /nfs/dbraw/zinc/40/59/77/1052405977.db2.gz DJNSTYQHVHUQQL-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CC(C)(C)[NH+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001334930418 1053154701 /nfs/dbraw/zinc/15/47/01/1053154701.db2.gz KNAHKBPMYDHTMK-UHFFFAOYSA-N 1 1 370.247 2.914 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)N(Cc3ccccc3[N+](=O)[O-])C3CC3)[C@H]2C1 ZINC001348312207 1054624888 /nfs/dbraw/zinc/62/48/88/1054624888.db2.gz VBRUWTNTGMZREC-JQFCIGGWSA-N 1 1 358.442 2.609 20 5 FFBDMO CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](Cc2ccccc2)C[C@H]1C ZINC001352452853 1055489320 /nfs/dbraw/zinc/48/93/20/1055489320.db2.gz LNRGNUHRTYRAJR-OAGGEKHMSA-N 1 1 372.473 2.735 20 5 FFBDMO C[N@H+]1C[C@@]23CN(C(=O)NCc4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3 ZINC001353168952 1056145487 /nfs/dbraw/zinc/14/54/87/1056145487.db2.gz AKLNJVCCJNXAAL-KDURUIRLSA-N 1 1 358.442 2.612 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC001339454184 1056470394 /nfs/dbraw/zinc/47/03/94/1056470394.db2.gz HMXAWZDAEQQNGH-NVXWUHKLSA-N 1 1 372.473 2.564 20 5 FFBDMO CC[N@@H+](CCCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)C1CCCCC1 ZINC001300338052 1056524865 /nfs/dbraw/zinc/52/48/65/1056524865.db2.gz PNOZOWFRHMSJNJ-UHFFFAOYSA-N 1 1 357.842 2.746 20 5 FFBDMO C[C@H](c1nnc(N2C[C@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)[C@H]2C)n1C)[N+](=O)[O-] ZINC001519598448 1058867472 /nfs/dbraw/zinc/86/74/72/1058867472.db2.gz VZGUHLDTHGVPGK-CAOSSQGBSA-N 1 1 372.473 2.641 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C(C)C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001454899622 1059642063 /nfs/dbraw/zinc/64/20/63/1059642063.db2.gz KTNUDDFWFFEMSN-DAYGRLMNSA-N 1 1 363.458 2.653 20 5 FFBDMO Cc1ccc(CNC(=O)[C@H](C(C)C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC001454899622 1059642073 /nfs/dbraw/zinc/64/20/73/1059642073.db2.gz KTNUDDFWFFEMSN-DAYGRLMNSA-N 1 1 363.458 2.653 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1c1ncc([N+](=O)[O-])c(C)c1Br ZINC001458458605 1060595004 /nfs/dbraw/zinc/59/50/04/1060595004.db2.gz XIBAYZXNIDJCFL-NSHDSACASA-N 1 1 357.252 2.981 20 5 FFBDMO Cc1cc(C)c(CN2C(=O)N[C@](C)(c3cccc([N+](=O)[O-])c3)C2=O)c(C)[nH+]1 ZINC001458908113 1060678899 /nfs/dbraw/zinc/67/88/99/1060678899.db2.gz CXXRCONSCYJUNJ-LJQANCHMSA-N 1 1 368.393 2.882 20 5 FFBDMO CC(C)CNC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCC1 ZINC001459703351 1060797071 /nfs/dbraw/zinc/79/70/71/1060797071.db2.gz TYROZJBYFVQAOP-UHFFFAOYSA-N 1 1 359.430 2.646 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001460602310 1061029076 /nfs/dbraw/zinc/02/90/76/1061029076.db2.gz AFOQLRRWBKNWFY-INWMFGNUSA-N 1 1 365.430 2.616 20 5 FFBDMO O=C1[C@H]([N@H+]2CCC[C@@H](C3CCOCC3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC001460834774 1061120944 /nfs/dbraw/zinc/12/09/44/1061120944.db2.gz NNBYRLLFUFTTAV-VQIMIIECSA-N 1 1 373.453 2.839 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(NC(=O)COC)c1 ZINC001461020071 1061189177 /nfs/dbraw/zinc/18/91/77/1061189177.db2.gz VEJVKNCMRJCTBJ-UHFFFAOYSA-N 1 1 373.409 2.868 20 5 FFBDMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001463224177 1062003124 /nfs/dbraw/zinc/00/31/24/1062003124.db2.gz SCNLOSGQLYTADA-CQSZACIVSA-N 1 1 360.439 2.932 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(Cl)s1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001479868355 1063012190 /nfs/dbraw/zinc/01/21/90/1063012190.db2.gz DLFNGLURWFGPRX-CHWSQXEVSA-N 1 1 357.863 2.537 20 5 FFBDMO O=C(NCCC[N@H+](Cc1ccc(Cl)s1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001479868355 1063012211 /nfs/dbraw/zinc/01/22/11/1063012211.db2.gz DLFNGLURWFGPRX-CHWSQXEVSA-N 1 1 357.863 2.537 20 5 FFBDMO O=C(NCCC[N@@H+](Cc1ccc(Cl)s1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001479868355 1063012225 /nfs/dbraw/zinc/01/22/25/1063012225.db2.gz DLFNGLURWFGPRX-CHWSQXEVSA-N 1 1 357.863 2.537 20 5 FFBDMO C[C@H](CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC001441359653 1063428219 /nfs/dbraw/zinc/42/82/19/1063428219.db2.gz HCQVPESHTQDPFL-WDEREUQCSA-N 1 1 354.838 2.681 20 5 FFBDMO O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)Nc1ccc([N+](=O)[O-])c2ccccc12 ZINC001467548692 1063777597 /nfs/dbraw/zinc/77/75/97/1063777597.db2.gz UNSJGDYHXKYREI-UONOGXRCSA-N 1 1 370.409 2.733 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@@H]1C(C)(C)C ZINC001469617980 1064180989 /nfs/dbraw/zinc/18/09/89/1064180989.db2.gz JXICDJVEMZOLBC-LLVKDONJSA-N 1 1 372.828 2.772 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C[C@@H]1C(C)(C)C ZINC001469617980 1064180992 /nfs/dbraw/zinc/18/09/92/1064180992.db2.gz JXICDJVEMZOLBC-LLVKDONJSA-N 1 1 372.828 2.772 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001575969133 1078182750 /nfs/dbraw/zinc/18/27/50/1078182750.db2.gz IZGUHVWIDGVQFT-XQQFMLRXSA-N 1 1 359.434 2.553 20 5 FFBDMO O=[N+]([O-])CCN(Cc1ccncc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001473501368 1065274668 /nfs/dbraw/zinc/27/46/68/1065274668.db2.gz HXXHICPSKHRNPJ-HXUWFJFHSA-N 1 1 354.454 2.825 20 5 FFBDMO COC(=O)CC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001473767811 1065352416 /nfs/dbraw/zinc/35/24/16/1065352416.db2.gz NDQYNFRSGCODTP-UONOGXRCSA-N 1 1 363.414 2.587 20 5 FFBDMO C[C@H]1CN(c2cc[nH+]cc2)CCN1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001473810090 1065373130 /nfs/dbraw/zinc/37/31/30/1065373130.db2.gz UIENKVUBWPQYIP-INIZCTEOSA-N 1 1 356.426 2.969 20 5 FFBDMO CCc1noc(C[C@]2(O)CCC[N@@H+](Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC001474633240 1065565668 /nfs/dbraw/zinc/56/56/68/1065565668.db2.gz ANLWCIUAIHHVAE-LJQANCHMSA-N 1 1 374.441 2.727 20 5 FFBDMO COc1c(F)cc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cc1F ZINC001579134373 1078573076 /nfs/dbraw/zinc/57/30/76/1078573076.db2.gz HVVMDFGMHVWSDS-INIZCTEOSA-N 1 1 351.309 2.694 20 5 FFBDMO COc1ccccc1[C@H]([NH3+])C(=O)Nc1ccc([N+](=O)[O-])c2ncccc12 ZINC001579302504 1078614763 /nfs/dbraw/zinc/61/47/63/1078614763.db2.gz XXYLIUUDJWAJSS-INIZCTEOSA-N 1 1 352.350 2.790 20 5 FFBDMO COc1ccc2ncc([N+](=O)[O-])c(N[C@@H]3CCC[N@H+]4CCSC[C@@H]34)c2c1 ZINC001559277869 1076144845 /nfs/dbraw/zinc/14/48/45/1076144845.db2.gz FTONSZGELDINQS-WBVHZDCISA-N 1 1 374.466 2.565 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC001559616891 1076177494 /nfs/dbraw/zinc/17/74/94/1076177494.db2.gz SLMJSNPGLTWXIK-GFCCVEGCSA-N 1 1 354.370 2.748 20 5 FFBDMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC001559616891 1076177496 /nfs/dbraw/zinc/17/74/96/1076177496.db2.gz SLMJSNPGLTWXIK-GFCCVEGCSA-N 1 1 354.370 2.748 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1 ZINC001560165068 1076239617 /nfs/dbraw/zinc/23/96/17/1076239617.db2.gz AMKQBBPHMCPBEF-ZIAGYGMSSA-N 1 1 363.414 2.505 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC001561699921 1076409158 /nfs/dbraw/zinc/40/91/58/1076409158.db2.gz GBWWIQGQLYTJAI-CVEARBPZSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1CC[N@@H+](CCNC(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001562575424 1076504600 /nfs/dbraw/zinc/50/46/00/1076504600.db2.gz NSMLPPRGEOGWNQ-SNVBAGLBSA-N 1 1 371.235 2.821 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCC[N@H+]1C ZINC001585855716 1079506076 /nfs/dbraw/zinc/50/60/76/1079506076.db2.gz MKUDNGPTQJKGIS-AAEUAGOBSA-N 1 1 355.822 2.616 20 5 FFBDMO Cc1c(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC001586242939 1079583135 /nfs/dbraw/zinc/58/31/35/1079583135.db2.gz VZZFPHAQXVCUDA-UHFFFAOYSA-N 1 1 364.402 2.582 20 5 FFBDMO Cc1ccc(C[N@H+]2CC[C@H](NC(=O)Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC001587795623 1079866274 /nfs/dbraw/zinc/86/62/74/1079866274.db2.gz FGKZMJAHMYIQIS-SFHVURJKSA-N 1 1 353.422 2.836 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)c1cccc(-c2nn[nH]n2)c1 ZINC001590052742 1080981122 /nfs/dbraw/zinc/98/11/22/1080981122.db2.gz TXBFOOOEOPNKBE-PXAZEXFGSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226634 1081107318 /nfs/dbraw/zinc/10/73/18/1081107318.db2.gz RCWCTTZJTFYAEY-CABZTGNLSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226634 1081107320 /nfs/dbraw/zinc/10/73/20/1081107320.db2.gz RCWCTTZJTFYAEY-CABZTGNLSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC001590260596 1081129401 /nfs/dbraw/zinc/12/94/01/1081129401.db2.gz QBTRVLAWZPFVOQ-NXEZZACHSA-N 1 1 351.436 2.511 20 5 FFBDMO C[C@H](CNc1cc(-c2nn[nH]n2)sc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C ZINC001590260596 1081129403 /nfs/dbraw/zinc/12/94/03/1081129403.db2.gz QBTRVLAWZPFVOQ-NXEZZACHSA-N 1 1 351.436 2.511 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008595 251037458 /nfs/dbraw/zinc/03/74/58/251037458.db2.gz MYQHJKAQTKZQEM-WBMJQRKESA-N 1 1 364.833 2.927 20 5 FFBDMO Cn1ccnc1[C@@H](O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000132008595 251037460 /nfs/dbraw/zinc/03/74/60/251037460.db2.gz MYQHJKAQTKZQEM-WBMJQRKESA-N 1 1 364.833 2.927 20 5 FFBDMO CC[N@@H+](C)C[C@@H]1CCN(c2cc(Cl)c(C(=O)OC)cc2[N+](=O)[O-])C1 ZINC000268789364 251382940 /nfs/dbraw/zinc/38/29/40/251382940.db2.gz FXYUMADHSGHXMY-NSHDSACASA-N 1 1 355.822 2.813 20 5 FFBDMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000272425335 252035843 /nfs/dbraw/zinc/03/58/43/252035843.db2.gz CARKBRLVZRYJET-MLGOLLRUSA-N 1 1 366.849 2.874 20 5 FFBDMO C[C@H](NC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000272926883 252167158 /nfs/dbraw/zinc/16/71/58/252167158.db2.gz KSRFHBGAOMAEBW-LBPRGKRZSA-N 1 1 367.833 2.784 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1 ZINC000276340527 256091461 /nfs/dbraw/zinc/09/14/61/256091461.db2.gz SGKGHZYEOJULGB-AWEZNQCLSA-N 1 1 369.487 2.778 20 5 FFBDMO CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000286545353 257042173 /nfs/dbraw/zinc/04/21/73/257042173.db2.gz OJFDDEJIYMADJC-XBRIKIQZSA-N 1 1 359.426 2.587 20 5 FFBDMO CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000286581705 257043977 /nfs/dbraw/zinc/04/39/77/257043977.db2.gz VFVPEUMNTSMHBX-AWEZNQCLSA-N 1 1 373.413 2.526 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 ZINC000287635749 257099977 /nfs/dbraw/zinc/09/99/77/257099977.db2.gz HLSWNQPGOCDJCD-UHFFFAOYSA-N 1 1 370.413 2.919 20 5 FFBDMO CN(C)C(=O)COc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000289351227 257275981 /nfs/dbraw/zinc/27/59/81/257275981.db2.gz JDIZDRCUBYATJV-UHFFFAOYSA-N 1 1 371.437 2.736 20 5 FFBDMO Cc1cnn([C@@H]2CC[N@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000290926141 257365367 /nfs/dbraw/zinc/36/53/67/257365367.db2.gz OMCGSBAWGAUJME-GOSISDBHSA-N 1 1 366.425 2.947 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1 ZINC000301178962 258032233 /nfs/dbraw/zinc/03/22/33/258032233.db2.gz YDKJQRSMUVONNQ-UHFFFAOYSA-N 1 1 373.438 2.635 20 5 FFBDMO NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(CNc3sccc3[N+](=O)[O-])c2)C1 ZINC000302035768 258083315 /nfs/dbraw/zinc/08/33/15/258083315.db2.gz UPMUEQWQFOJTEO-HNNXBMFYSA-N 1 1 374.466 2.966 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000302120775 258089341 /nfs/dbraw/zinc/08/93/41/258089341.db2.gz XTWZWINVXYGNJH-BETUJISGSA-N 1 1 365.430 2.681 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000302120775 258089342 /nfs/dbraw/zinc/08/93/42/258089342.db2.gz XTWZWINVXYGNJH-BETUJISGSA-N 1 1 365.430 2.681 20 5 FFBDMO CNC(=O)c1ccc(N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000302163213 258092178 /nfs/dbraw/zinc/09/21/78/258092178.db2.gz IKQPPQZZDLMUAT-KBXCAEBGSA-N 1 1 368.437 2.887 20 5 FFBDMO CC[C@@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1Cc1ccccc1 ZINC000302175635 258092997 /nfs/dbraw/zinc/09/29/97/258092997.db2.gz WWODALCBFRPHMQ-MRXNPFEDSA-N 1 1 366.425 2.738 20 5 FFBDMO Cc1cc(NC[C@H](O)C[NH+]2CCC(C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000302185620 258094088 /nfs/dbraw/zinc/09/40/88/258094088.db2.gz PGMMYRSDXRAROO-INIZCTEOSA-N 1 1 358.442 2.956 20 5 FFBDMO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302611452 258106830 /nfs/dbraw/zinc/10/68/30/258106830.db2.gz FCAWZZNDOVATEC-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O ZINC000302611452 258106831 /nfs/dbraw/zinc/10/68/31/258106831.db2.gz FCAWZZNDOVATEC-CYBMUJFWSA-N 1 1 355.460 2.675 20 5 FFBDMO C[NH+](C)[C@@H](CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])c1ccccc1 ZINC000301921135 258075247 /nfs/dbraw/zinc/07/52/47/258075247.db2.gz XICYJJFVWOJGMQ-HNNXBMFYSA-N 1 1 363.439 2.713 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000330783049 258170528 /nfs/dbraw/zinc/17/05/28/258170528.db2.gz HRWUWZBYUGSXLM-CMPLNLGQSA-N 1 1 357.357 2.751 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000331215235 258180074 /nfs/dbraw/zinc/18/00/74/258180074.db2.gz NXSVDUHZHZWMMB-LBPRGKRZSA-N 1 1 351.451 2.682 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270753 258180836 /nfs/dbraw/zinc/18/08/36/258180836.db2.gz AROXMDPIOYREAL-GYSYKLTISA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000331270753 258180837 /nfs/dbraw/zinc/18/08/37/258180837.db2.gz AROXMDPIOYREAL-GYSYKLTISA-N 1 1 355.822 2.668 20 5 FFBDMO Cn1cc[nH+]c1[C@@H]1CCCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000373056037 512150895 /nfs/dbraw/zinc/15/08/95/512150895.db2.gz GWYWOGMHZXHPEM-SNVBAGLBSA-N 1 1 366.219 2.870 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N[C@@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000409846857 512154506 /nfs/dbraw/zinc/15/45/06/512154506.db2.gz UZVNPMVPOBKLHE-XJKSGUPXSA-N 1 1 355.394 2.885 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(C1)C(=O)Nc1ccccc12 ZINC000377213102 512169053 /nfs/dbraw/zinc/16/90/53/512169053.db2.gz FVVXUWWWXODCHV-LJQANCHMSA-N 1 1 353.378 2.699 20 5 FFBDMO O=C(NCCCCc1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCCC2 ZINC000375208222 512212780 /nfs/dbraw/zinc/21/27/80/512212780.db2.gz SZJXHXOXDPAMPD-UHFFFAOYSA-N 1 1 371.441 2.950 20 5 FFBDMO CNC(=O)c1ccc(N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000053573704 506408656 /nfs/dbraw/zinc/40/86/56/506408656.db2.gz XCADOIVKZFPPCA-IJEWVQPXSA-N 1 1 360.458 2.796 20 5 FFBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1 ZINC000007782416 506588740 /nfs/dbraw/zinc/58/87/40/506588740.db2.gz GWACBXBTZLIGIM-IBGZPJMESA-N 1 1 368.437 2.830 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000067032229 506732274 /nfs/dbraw/zinc/73/22/74/506732274.db2.gz ZEFSKNOJPRQCJN-UHFFFAOYSA-N 1 1 353.422 2.904 20 5 FFBDMO Cc1c(NC(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)cccc1[N+](=O)[O-] ZINC000043347308 506736695 /nfs/dbraw/zinc/73/66/95/506736695.db2.gz YCIPCEHVJMJNRK-HNNXBMFYSA-N 1 1 364.446 2.772 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000375386654 512296674 /nfs/dbraw/zinc/29/66/74/512296674.db2.gz JLDGNCGOAVPPEU-UHFFFAOYSA-N 1 1 355.398 2.632 20 5 FFBDMO C[N@H+](Cc1ccc2c(c1)OCO2)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375174 506851169 /nfs/dbraw/zinc/85/11/69/506851169.db2.gz BHECPCZSQNQLRH-MRXNPFEDSA-N 1 1 369.377 2.561 20 5 FFBDMO C[N@@H+](Cc1ccc2c(c1)OCO2)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000067375174 506851178 /nfs/dbraw/zinc/85/11/78/506851178.db2.gz BHECPCZSQNQLRH-MRXNPFEDSA-N 1 1 369.377 2.561 20 5 FFBDMO Cc1ccccc1C[NH+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1 ZINC000067536913 506916252 /nfs/dbraw/zinc/91/62/52/506916252.db2.gz ICRRRVLFQWTLEZ-UHFFFAOYSA-N 1 1 368.437 2.931 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000045465038 506971097 /nfs/dbraw/zinc/97/10/97/506971097.db2.gz BKTGTLFTYXDQOJ-AWEZNQCLSA-N 1 1 369.421 2.780 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c2c(c1)COCO2 ZINC000375409673 512311706 /nfs/dbraw/zinc/31/17/06/512311706.db2.gz XTDGGIQZHTYIEE-LBPRGKRZSA-N 1 1 372.381 2.711 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CN1CC[NH+](CCOc2ccccc2)CC1 ZINC000015302121 507031274 /nfs/dbraw/zinc/03/12/74/507031274.db2.gz XRMLTLCWOFVNOO-UHFFFAOYSA-N 1 1 371.437 2.800 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000369260155 512314610 /nfs/dbraw/zinc/31/46/10/512314610.db2.gz SRKUNMOOSRNELI-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000369260155 512314616 /nfs/dbraw/zinc/31/46/16/512314616.db2.gz SRKUNMOOSRNELI-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)COc2ccccc2[N+](=O)[O-])C1 ZINC000047038423 507254674 /nfs/dbraw/zinc/25/46/74/507254674.db2.gz BWCFVNZVYOMSFW-IYBDPMFKSA-N 1 1 363.458 2.848 20 5 FFBDMO C[C@@H](CNC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@@H+](C)C1CC1 ZINC000057705545 507311500 /nfs/dbraw/zinc/31/15/00/507311500.db2.gz UEUKNUVGWYBGAY-NSHDSACASA-N 1 1 360.439 2.931 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000058298705 507401417 /nfs/dbraw/zinc/40/14/17/507401417.db2.gz SWHGESNOULEQPW-HOTGVXAUSA-N 1 1 358.442 2.552 20 5 FFBDMO O=C(CC[NH+]1CCN(Cc2cccs2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000026257104 507571954 /nfs/dbraw/zinc/57/19/54/507571954.db2.gz XRLQSHFVLQVTGB-UHFFFAOYSA-N 1 1 374.466 2.803 20 5 FFBDMO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000051051068 507728427 /nfs/dbraw/zinc/72/84/27/507728427.db2.gz YRLXKXFDNLTPGN-JKSUJKDBSA-N 1 1 363.458 2.990 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])c(N)n2)C1 ZINC000071954877 507728859 /nfs/dbraw/zinc/72/88/59/507728859.db2.gz OAFIFUJXPITLBL-ZDUSSCGKSA-N 1 1 356.430 2.811 20 5 FFBDMO CC(=O)Nc1cccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665054 507840293 /nfs/dbraw/zinc/84/02/93/507840293.db2.gz QRURRDVHZYQUME-INIZCTEOSA-N 1 1 355.398 2.635 20 5 FFBDMO CCOc1ccccc1OCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664948 507840323 /nfs/dbraw/zinc/84/03/23/507840323.db2.gz GAISNWYUGXCJFQ-HNNXBMFYSA-N 1 1 372.425 2.954 20 5 FFBDMO CN(CC[C@H]1CCCC[N@H+]1C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000072759321 507850367 /nfs/dbraw/zinc/85/03/67/507850367.db2.gz SRIYIEXNBAZHON-OAHLLOKOSA-N 1 1 359.430 2.951 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000072976367 507878907 /nfs/dbraw/zinc/87/89/07/507878907.db2.gz WPRFEYRYOMUZKU-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089891305 507879461 /nfs/dbraw/zinc/87/94/61/507879461.db2.gz VRXFGACAGNEZGV-HNNXBMFYSA-N 1 1 372.425 2.988 20 5 FFBDMO COCC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000073604893 507937195 /nfs/dbraw/zinc/93/71/95/507937195.db2.gz JMVTWTTXEAMLRU-UHFFFAOYSA-N 1 1 369.421 2.633 20 5 FFBDMO COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000073604893 507937197 /nfs/dbraw/zinc/93/71/97/507937197.db2.gz JMVTWTTXEAMLRU-UHFFFAOYSA-N 1 1 369.421 2.633 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000079771254 507999971 /nfs/dbraw/zinc/99/99/71/507999971.db2.gz MMOIPWPUZUVUJQ-NSHDSACASA-N 1 1 356.220 2.571 20 5 FFBDMO COc1cc(N2CCC(C[N@@H+]3C[C@@H](C)O[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC000091478514 507988705 /nfs/dbraw/zinc/98/87/05/507988705.db2.gz CYMWFYKTGCVKBH-GASCZTMLSA-N 1 1 363.458 2.929 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1 ZINC000091479506 507988805 /nfs/dbraw/zinc/98/88/05/507988805.db2.gz DNQXFDSKFLVGHB-AWEZNQCLSA-N 1 1 357.414 2.840 20 5 FFBDMO C[C@H](CNC(=O)COc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000110355879 508022748 /nfs/dbraw/zinc/02/27/48/508022748.db2.gz XIDINPGXSRMMMQ-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1 ZINC000074764039 508053002 /nfs/dbraw/zinc/05/30/02/508053002.db2.gz IYDLSAJNKUWMMQ-UHFFFAOYSA-N 1 1 362.474 2.899 20 5 FFBDMO C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000110966084 508061270 /nfs/dbraw/zinc/06/12/70/508061270.db2.gz OGUHNGQPNYKDSS-GFCCVEGCSA-N 1 1 360.389 2.566 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[NH+]2Cc3ccccc3-c3ccccc3C2)c1 ZINC000075683525 508128503 /nfs/dbraw/zinc/12/85/03/508128503.db2.gz CETHJKQKRUNKOT-SFHVURJKSA-N 1 1 364.405 2.835 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000081122693 508140301 /nfs/dbraw/zinc/14/03/01/508140301.db2.gz FTMSLEFOMZOKEP-GOSISDBHSA-N 1 1 353.422 2.870 20 5 FFBDMO CCc1nn(C)c(CC)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000093534953 508148172 /nfs/dbraw/zinc/14/81/72/508148172.db2.gz TUAPCIQZFUUDQX-CYBMUJFWSA-N 1 1 358.446 2.535 20 5 FFBDMO CCc1ccc(C[NH+]2CCN(c3c([N+](=O)[O-])c(CC)nn3C)CC2)s1 ZINC000094163269 508171884 /nfs/dbraw/zinc/17/18/84/508171884.db2.gz IFLSTNAMDRDSDL-UHFFFAOYSA-N 1 1 363.487 2.837 20 5 FFBDMO CC(C)(C)C(=O)NC[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000112699747 508210421 /nfs/dbraw/zinc/21/04/21/508210421.db2.gz ZMTREGAVZRIVTI-OAHLLOKOSA-N 1 1 363.458 2.848 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCO)CCc3ccccc3)n2)c1 ZINC000112698609 508210919 /nfs/dbraw/zinc/21/09/19/508210919.db2.gz HVJPOLQITSSOIV-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCO)CCc3ccccc3)n2)c1 ZINC000112698609 508210922 /nfs/dbraw/zinc/21/09/22/508210922.db2.gz HVJPOLQITSSOIV-UHFFFAOYSA-N 1 1 368.393 2.682 20 5 FFBDMO CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000076921944 508262899 /nfs/dbraw/zinc/26/28/99/508262899.db2.gz WRJYOSMSJKEPSN-HNNXBMFYSA-N 1 1 357.458 2.829 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCc2ccccc2C1 ZINC000114489991 508321256 /nfs/dbraw/zinc/32/12/56/508321256.db2.gz QRCTXVQINQWKNM-SFHVURJKSA-N 1 1 365.433 2.973 20 5 FFBDMO COc1ccc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000114645319 508333529 /nfs/dbraw/zinc/33/35/29/508333529.db2.gz VHZUZFXXGXXVBO-QGZVFWFLSA-N 1 1 369.421 2.998 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000087104108 508336977 /nfs/dbraw/zinc/33/69/77/508336977.db2.gz JWFJXADCQKQFEM-QGZVFWFLSA-N 1 1 360.458 2.927 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000105168796 508363729 /nfs/dbraw/zinc/36/37/29/508363729.db2.gz LSRZFIVETLUFLV-CQSZACIVSA-N 1 1 364.446 2.523 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122039789 508471103 /nfs/dbraw/zinc/47/11/03/508471103.db2.gz JCFCNHHAKNKPLN-GFCCVEGCSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])c(C)n3)CC2)c1 ZINC000152668586 508490601 /nfs/dbraw/zinc/49/06/01/508490601.db2.gz KTCBKCSFBBLIRR-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CS(=O)(=O)c1ccccc1 ZINC000122343307 508520135 /nfs/dbraw/zinc/52/01/35/508520135.db2.gz JIGSYQOKMPGSPA-CYBMUJFWSA-N 1 1 364.423 2.555 20 5 FFBDMO C[C@H](CCS(C)(=O)=O)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000134572941 508547897 /nfs/dbraw/zinc/54/78/97/508547897.db2.gz GOAHNRYOHWQYPA-LLVKDONJSA-N 1 1 369.468 2.631 20 5 FFBDMO CC[N@H+]1CCC[C@@H]1CNC(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000116718074 508550687 /nfs/dbraw/zinc/55/06/87/508550687.db2.gz SQCOIQMAZGQZAK-CYBMUJFWSA-N 1 1 355.822 2.618 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157855849 508622202 /nfs/dbraw/zinc/62/22/02/508622202.db2.gz DZSAOFRDXZVBED-LLVKDONJSA-N 1 1 364.427 2.561 20 5 FFBDMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCc2nccs2)c([N+](=O)[O-])c1 ZINC000157855849 508622206 /nfs/dbraw/zinc/62/22/06/508622206.db2.gz DZSAOFRDXZVBED-LLVKDONJSA-N 1 1 364.427 2.561 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCCc2c1cnn2C ZINC000135651960 508637477 /nfs/dbraw/zinc/63/74/77/508637477.db2.gz LVWCPBBCODDADC-KRWDZBQOSA-N 1 1 371.441 2.975 20 5 FFBDMO CCOc1ccc([C@H](C)NCC2([NH+](C)C)CCOCC2)cc1[N+](=O)[O-] ZINC000153791731 508650224 /nfs/dbraw/zinc/65/02/24/508650224.db2.gz HAINLLYLQYPQJE-AWEZNQCLSA-N 1 1 351.447 2.755 20 5 FFBDMO CC(C)[C@H]1C[N@H+](C)CCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000153898437 508672705 /nfs/dbraw/zinc/67/27/05/508672705.db2.gz QWEJTTXHBFTWSO-CZUORRHYSA-N 1 1 351.472 2.874 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 ZINC000153898437 508672708 /nfs/dbraw/zinc/67/27/08/508672708.db2.gz QWEJTTXHBFTWSO-CZUORRHYSA-N 1 1 351.472 2.874 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000118841700 508683118 /nfs/dbraw/zinc/68/31/18/508683118.db2.gz UIOHIAQFRDTFHP-CHWSQXEVSA-N 1 1 368.865 2.849 20 5 FFBDMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000371454784 512412295 /nfs/dbraw/zinc/41/22/95/512412295.db2.gz BDYRCVCGEJAXLU-HKUYNNGSSA-N 1 1 374.441 2.685 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000137114148 508738481 /nfs/dbraw/zinc/73/84/81/508738481.db2.gz OSWLXAUHYZIPLO-OAHLLOKOSA-N 1 1 369.425 2.891 20 5 FFBDMO CCC(CC)(C[NH3+])NS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000124061675 508778183 /nfs/dbraw/zinc/77/81/83/508778183.db2.gz VIVJTZVKXHHBBN-UHFFFAOYSA-N 1 1 370.258 2.697 20 5 FFBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCn1ccnc1 ZINC000124359915 508820727 /nfs/dbraw/zinc/82/07/27/508820727.db2.gz YWKIIQYESOWNAC-CYBMUJFWSA-N 1 1 356.386 2.924 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000369460206 512420728 /nfs/dbraw/zinc/42/07/28/512420728.db2.gz BDFNDXAITGBZPO-AWEZNQCLSA-N 1 1 373.413 2.535 20 5 FFBDMO CCc1cc(N[C@H](C)[C@H]2C[N@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832423 508865438 /nfs/dbraw/zinc/86/54/38/508865438.db2.gz FUCDGWAQJCDDJF-CXAGYDPISA-N 1 1 371.441 2.745 20 5 FFBDMO CCc1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCO2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154832423 508865443 /nfs/dbraw/zinc/86/54/43/508865443.db2.gz FUCDGWAQJCDDJF-CXAGYDPISA-N 1 1 371.441 2.745 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000119833518 508873106 /nfs/dbraw/zinc/87/31/06/508873106.db2.gz HUBOQGXXFKTORG-KSSFIOAISA-N 1 1 369.421 2.854 20 5 FFBDMO NC(=O)CC1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000159726711 508881597 /nfs/dbraw/zinc/88/15/97/508881597.db2.gz QSFUHSPYNXSQBR-UHFFFAOYSA-N 1 1 360.439 2.806 20 5 FFBDMO Cc1ccc(NCCCNC(=O)CCOc2ccccc2[N+](=O)[O-])[nH+]c1 ZINC000119931356 508892013 /nfs/dbraw/zinc/89/20/13/508892013.db2.gz HSKSFIJYMBPDIA-UHFFFAOYSA-N 1 1 358.398 2.686 20 5 FFBDMO Cc1nc(CN2CC[NH+](CCCOc3ccc([N+](=O)[O-])cc3)CC2)oc1C ZINC000155024963 508905678 /nfs/dbraw/zinc/90/56/78/508905678.db2.gz MJOSDPAMPOESTR-UHFFFAOYSA-N 1 1 374.441 2.786 20 5 FFBDMO O=C1CCCCN1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000120210632 508950964 /nfs/dbraw/zinc/95/09/64/508950964.db2.gz GJTCFUMXQUQKIF-UHFFFAOYSA-N 1 1 358.398 2.713 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)cc1 ZINC000155264309 508961314 /nfs/dbraw/zinc/96/13/14/508961314.db2.gz QBFKPTDPSLBJGI-OAHLLOKOSA-N 1 1 355.394 2.692 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000120387467 508985565 /nfs/dbraw/zinc/98/55/65/508985565.db2.gz QHZSZTXKSUEVSD-INIZCTEOSA-N 1 1 364.833 2.927 20 5 FFBDMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000160550148 509001334 /nfs/dbraw/zinc/00/13/34/509001334.db2.gz AKYPIWALGWKBLY-GFCCVEGCSA-N 1 1 352.387 2.858 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000120554890 509019856 /nfs/dbraw/zinc/01/98/56/509019856.db2.gz ZHGBDTOATHXULD-JSGCOSHPSA-N 1 1 369.849 2.816 20 5 FFBDMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)Nc1cccc([N+](=O)[O-])c1 ZINC000151546141 509040623 /nfs/dbraw/zinc/04/06/23/509040623.db2.gz PVYCDZPYCSCHOI-SFHVURJKSA-N 1 1 355.394 2.824 20 5 FFBDMO O=C(C[C@H]1C[N@@H+](Cc2ccccc2)CCO1)Nc1cccc([N+](=O)[O-])c1 ZINC000151546141 509040627 /nfs/dbraw/zinc/04/06/27/509040627.db2.gz PVYCDZPYCSCHOI-SFHVURJKSA-N 1 1 355.394 2.824 20 5 FFBDMO O=c1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc2ccccn12 ZINC000155699681 509054774 /nfs/dbraw/zinc/05/47/74/509054774.db2.gz POEUZWSKVVVMML-UHFFFAOYSA-N 1 1 350.378 2.767 20 5 FFBDMO O=c1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nc2ccccn12 ZINC000155699681 509054775 /nfs/dbraw/zinc/05/47/75/509054775.db2.gz POEUZWSKVVVMML-UHFFFAOYSA-N 1 1 350.378 2.767 20 5 FFBDMO COc1c(C)c[nH+]c(Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)c1C ZINC000132714321 509066395 /nfs/dbraw/zinc/06/63/95/509066395.db2.gz TYZIZFRPDNRCCP-UHFFFAOYSA-N 1 1 368.187 2.588 20 5 FFBDMO CC1CCN(c2ccc(C(=O)N3[C@H](C)C[NH+](C)C[C@H]3C)cc2[N+](=O)[O-])CC1 ZINC000155771834 509068872 /nfs/dbraw/zinc/06/88/72/509068872.db2.gz QGIMZRHIPRAAPP-HZPDHXFCSA-N 1 1 374.485 2.996 20 5 FFBDMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccn1 ZINC000161087731 509069325 /nfs/dbraw/zinc/06/93/25/509069325.db2.gz GLWKFRHTRLFHAT-UHFFFAOYSA-N 1 1 358.398 2.849 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000151703375 509070117 /nfs/dbraw/zinc/07/01/17/509070117.db2.gz KKPFGRXNODKAOL-SJORKVTESA-N 1 1 373.409 2.739 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000151703375 509070119 /nfs/dbraw/zinc/07/01/19/509070119.db2.gz KKPFGRXNODKAOL-SJORKVTESA-N 1 1 373.409 2.739 20 5 FFBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)n1 ZINC000133120700 509119577 /nfs/dbraw/zinc/11/95/77/509119577.db2.gz HDBCORSBCJZHQD-ZDUSSCGKSA-N 1 1 350.806 2.988 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000126740832 509120868 /nfs/dbraw/zinc/12/08/68/509120868.db2.gz WKSZFBPPBYIQKQ-RDTXWAMCSA-N 1 1 372.469 2.750 20 5 FFBDMO COc1ccc(OCC[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000126858453 509139614 /nfs/dbraw/zinc/13/96/14/509139614.db2.gz OPBQAZSFCJBMQM-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000126858453 509139615 /nfs/dbraw/zinc/13/96/15/509139615.db2.gz OPBQAZSFCJBMQM-CQSZACIVSA-N 1 1 373.409 2.941 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000247915500 509190663 /nfs/dbraw/zinc/19/06/63/509190663.db2.gz AXLFVZDXEIDHHF-DNVCBOLYSA-N 1 1 355.394 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185502702 509210084 /nfs/dbraw/zinc/21/00/84/509210084.db2.gz KMNLEWFIHSKDLC-OAHLLOKOSA-N 1 1 369.421 2.905 20 5 FFBDMO Cc1cc(C(=O)N[C@@H](C)C2([NH+]3CCOCC3)CCCC2)cc([N+](=O)[O-])c1 ZINC000175923782 509218273 /nfs/dbraw/zinc/21/82/73/509218273.db2.gz QNRHZPRZHCCIRB-HNNXBMFYSA-N 1 1 361.442 2.667 20 5 FFBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3c([N+](=O)[O-])cnn3C)cc2)C1 ZINC000162487992 509235056 /nfs/dbraw/zinc/23/50/56/509235056.db2.gz PDBOFASBCAIZFZ-ZDUSSCGKSA-N 1 1 357.414 2.813 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])C1 ZINC000172788098 509236076 /nfs/dbraw/zinc/23/60/76/509236076.db2.gz BSRGAWGDDGTNRZ-HNNXBMFYSA-N 1 1 362.474 2.901 20 5 FFBDMO O=C(c1cc(F)ccc1F)C1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000266889534 509242795 /nfs/dbraw/zinc/24/27/95/509242795.db2.gz DJACEXGVUUGIPT-UHFFFAOYSA-N 1 1 364.352 2.664 20 5 FFBDMO COc1cc(C(=O)NCCCNc2ccc(C)c[nH+]2)cc([N+](=O)[O-])c1C ZINC000188758611 509249378 /nfs/dbraw/zinc/24/93/78/509249378.db2.gz WQGPBWMXTDCNIC-UHFFFAOYSA-N 1 1 358.398 2.847 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1SC ZINC000264030991 509292324 /nfs/dbraw/zinc/29/23/24/509292324.db2.gz MQXHWVUCJOTMMK-LLVKDONJSA-N 1 1 365.455 2.539 20 5 FFBDMO CCCS(=O)(=O)NC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182658410 509355870 /nfs/dbraw/zinc/35/58/70/509355870.db2.gz IDRBLIFMPUALRD-CQSZACIVSA-N 1 1 369.487 2.758 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000176280038 509418915 /nfs/dbraw/zinc/41/89/15/509418915.db2.gz UBHJHXDLEJKOET-JKSUJKDBSA-N 1 1 362.474 2.894 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000179397990 509420527 /nfs/dbraw/zinc/42/05/27/509420527.db2.gz INNLTJRIHNNXJN-UHFFFAOYSA-N 1 1 361.442 2.588 20 5 FFBDMO O=C1[C@@H]([NH+]2CCC([C@@H]3CCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000189163618 509443766 /nfs/dbraw/zinc/44/37/66/509443766.db2.gz RCJVGPMQKGMJJV-ROUUACIJSA-N 1 1 359.426 2.591 20 5 FFBDMO CCC[C@]1(COC)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000248745662 509466298 /nfs/dbraw/zinc/46/62/98/509466298.db2.gz RTWRVCGQHPOWQM-SJLPKXTDSA-N 1 1 352.431 2.616 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000248961553 509556011 /nfs/dbraw/zinc/55/60/11/509556011.db2.gz BGDALIZQZUKPOM-BLLLJJGKSA-N 1 1 359.382 2.881 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@@H]1C ZINC000248961553 509556012 /nfs/dbraw/zinc/55/60/12/509556012.db2.gz BGDALIZQZUKPOM-BLLLJJGKSA-N 1 1 359.382 2.881 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC1CCN(c2cc(C)[nH+]c(C)n2)CC1 ZINC000192666877 509591256 /nfs/dbraw/zinc/59/12/56/509591256.db2.gz OAKQXUITSLPHIS-UHFFFAOYSA-N 1 1 359.434 2.607 20 5 FFBDMO CCN(C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000173464466 509618179 /nfs/dbraw/zinc/61/81/79/509618179.db2.gz DQIRJINIGIHRQE-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO CCN(C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000173464466 509618182 /nfs/dbraw/zinc/61/81/82/509618182.db2.gz DQIRJINIGIHRQE-HNNXBMFYSA-N 1 1 369.425 2.529 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000173596859 509666664 /nfs/dbraw/zinc/66/66/64/509666664.db2.gz BINXGDGZWNIACC-HNNXBMFYSA-N 1 1 373.457 2.517 20 5 FFBDMO CC[C@@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000189657234 509686685 /nfs/dbraw/zinc/68/66/85/509686685.db2.gz YLRWNSPIBADPKX-QGZVFWFLSA-N 1 1 353.394 2.547 20 5 FFBDMO O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)nn21 ZINC000192958035 509714898 /nfs/dbraw/zinc/71/48/98/509714898.db2.gz XZJGJGLNSAZHLZ-HNNXBMFYSA-N 1 1 352.398 2.572 20 5 FFBDMO O=c1c2ccc([N+](=O)[O-])cc2ncn1Cc1[nH+]ccn1Cc1ccccc1 ZINC000192963975 509718002 /nfs/dbraw/zinc/71/80/02/509718002.db2.gz FQYBXLVEVLWQFU-UHFFFAOYSA-N 1 1 361.361 2.598 20 5 FFBDMO CCOc1ccnc(N2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3C)CC2)n1 ZINC000183392389 509758383 /nfs/dbraw/zinc/75/83/83/509758383.db2.gz RSWFLTJZUOFCBE-UHFFFAOYSA-N 1 1 371.441 2.804 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000268153867 509784323 /nfs/dbraw/zinc/78/43/23/509784323.db2.gz PCPLKOREEXVSMJ-GFCCVEGCSA-N 1 1 354.838 2.731 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000173849276 509813737 /nfs/dbraw/zinc/81/37/37/509813737.db2.gz VAKIREUOVBJOSQ-CABCVRRESA-N 1 1 367.471 2.539 20 5 FFBDMO CN(C)c1[nH+]cc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n1C ZINC000265045800 509837052 /nfs/dbraw/zinc/83/70/52/509837052.db2.gz AMPCWIBBAQRASY-UHFFFAOYSA-N 1 1 359.411 2.539 20 5 FFBDMO O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)Nc1ccncc1[N+](=O)[O-] ZINC000183568049 509864854 /nfs/dbraw/zinc/86/48/54/509864854.db2.gz IFQYUPKPIDASPE-OAHLLOKOSA-N 1 1 355.398 2.776 20 5 FFBDMO O=C(NCCC[N@H+]1CCc2ccccc2C1)Nc1ccncc1[N+](=O)[O-] ZINC000183626855 509892383 /nfs/dbraw/zinc/89/23/83/509892383.db2.gz YGLYSODPAITNSY-UHFFFAOYSA-N 1 1 355.398 2.560 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)[C@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019730 509906959 /nfs/dbraw/zinc/90/69/59/509906959.db2.gz ACQRXGPNAJCHMI-YJBOKZPZSA-N 1 1 365.430 2.677 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H]2C[C@](C)(OC)C2(C)C)c([N+](=O)[O-])c1 ZINC000174019730 509906965 /nfs/dbraw/zinc/90/69/65/509906965.db2.gz ACQRXGPNAJCHMI-YJBOKZPZSA-N 1 1 365.430 2.677 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000193585133 509978589 /nfs/dbraw/zinc/97/85/89/509978589.db2.gz YHIYOSQAJDWGFP-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585133 509978592 /nfs/dbraw/zinc/97/85/92/509978592.db2.gz YHIYOSQAJDWGFP-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ccn[nH]2)C1 ZINC000193585133 509978597 /nfs/dbraw/zinc/97/85/97/509978597.db2.gz YHIYOSQAJDWGFP-AWEZNQCLSA-N 1 1 357.414 2.835 20 5 FFBDMO COC(=O)c1cnc(NCCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000190168028 509982534 /nfs/dbraw/zinc/98/25/34/509982534.db2.gz IILBMKXRPAHCHZ-ZDUSSCGKSA-N 1 1 350.419 2.843 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000180578622 509995544 /nfs/dbraw/zinc/99/55/44/509995544.db2.gz LIBXRLXZMIIESO-LLVKDONJSA-N 1 1 370.247 2.771 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1CCO ZINC000190241807 510022462 /nfs/dbraw/zinc/02/24/62/510022462.db2.gz CHDXDGLCHLQYGI-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@@H+]1CCO ZINC000190241807 510022471 /nfs/dbraw/zinc/02/24/71/510022471.db2.gz CHDXDGLCHLQYGI-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[N@H+]1CCO ZINC000190241807 510022477 /nfs/dbraw/zinc/02/24/77/510022477.db2.gz CHDXDGLCHLQYGI-AWEZNQCLSA-N 1 1 361.467 2.822 20 5 FFBDMO COc1cc(C[NH2+]Cc2c[nH]nc2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000171384306 510120637 /nfs/dbraw/zinc/12/06/37/510120637.db2.gz JGMHAFHFFGNMJO-UHFFFAOYSA-N 1 1 374.319 2.866 20 5 FFBDMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c1 ZINC000180887085 510166109 /nfs/dbraw/zinc/16/61/09/510166109.db2.gz FPKFLMGGWRARMY-UHFFFAOYSA-N 1 1 371.393 2.705 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000184250833 510217574 /nfs/dbraw/zinc/21/75/74/510217574.db2.gz YRWCUATXTDNZIB-LLVKDONJSA-N 1 1 350.350 2.814 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](c3nc(C)no3)C2)c([N+](=O)[O-])cc1F ZINC000184250833 510217581 /nfs/dbraw/zinc/21/75/81/510217581.db2.gz YRWCUATXTDNZIB-LLVKDONJSA-N 1 1 350.350 2.814 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000171618997 510254986 /nfs/dbraw/zinc/25/49/86/510254986.db2.gz ZOJKIJLUEKZGNC-HNNXBMFYSA-N 1 1 371.441 2.781 20 5 FFBDMO COc1ccc([C@H]2CCCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000174709255 510264243 /nfs/dbraw/zinc/26/42/43/510264243.db2.gz VNMKFJPFVAOCNP-PKOBYXMFSA-N 1 1 374.441 2.778 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 ZINC000177809750 510265484 /nfs/dbraw/zinc/26/54/84/510265484.db2.gz HGVOSJTWWWPJSH-KGLIPLIRSA-N 1 1 362.386 2.510 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCCOC(C)C ZINC000265884852 510281838 /nfs/dbraw/zinc/28/18/38/510281838.db2.gz PJTWLJLZUUEBHJ-UHFFFAOYSA-N 1 1 353.419 2.679 20 5 FFBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174738141 510283067 /nfs/dbraw/zinc/28/30/67/510283067.db2.gz KOUBFQZGGRINIC-AWEZNQCLSA-N 1 1 359.213 2.591 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000269288770 510325625 /nfs/dbraw/zinc/32/56/25/510325625.db2.gz UBXZWOHCHHLKLF-ZWKOTPCHSA-N 1 1 358.442 2.896 20 5 FFBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)C(F)(F)F ZINC000181263266 510327798 /nfs/dbraw/zinc/32/77/98/510327798.db2.gz ZAQFAJDVHOGECE-ZDUSSCGKSA-N 1 1 359.304 2.647 20 5 FFBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)C(F)(F)F ZINC000181263266 510327805 /nfs/dbraw/zinc/32/78/05/510327805.db2.gz ZAQFAJDVHOGECE-ZDUSSCGKSA-N 1 1 359.304 2.647 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000184462412 510336700 /nfs/dbraw/zinc/33/67/00/510336700.db2.gz PIRJCYSGQFUUQN-INIZCTEOSA-N 1 1 368.437 2.771 20 5 FFBDMO CC(C)c1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000269355080 510357675 /nfs/dbraw/zinc/35/76/75/510357675.db2.gz TZBXAVJSAFLDKN-LBPRGKRZSA-N 1 1 361.402 2.601 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000171809405 510383442 /nfs/dbraw/zinc/38/34/42/510383442.db2.gz UXGAIFPXPDZMGQ-CQSZACIVSA-N 1 1 363.462 2.609 20 5 FFBDMO O=C1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CN1C1CC1 ZINC000174932755 510393190 /nfs/dbraw/zinc/39/31/90/510393190.db2.gz XKDRZIQVHVMBSB-GFCCVEGCSA-N 1 1 358.423 2.571 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000187744830 510414053 /nfs/dbraw/zinc/41/40/53/510414053.db2.gz QVVOZMHHMVGETE-UHFFFAOYSA-N 1 1 358.394 2.821 20 5 FFBDMO CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])C2 ZINC000175059682 510464594 /nfs/dbraw/zinc/46/45/94/510464594.db2.gz VNWHXYNCTYDCOC-JKSUJKDBSA-N 1 1 361.442 2.837 20 5 FFBDMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000266298925 510504642 /nfs/dbraw/zinc/50/46/42/510504642.db2.gz KNZKPXSRJATNRI-CMPLNLGQSA-N 1 1 357.332 2.922 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@@H]1CCC[C@H]1O ZINC000246535355 510541586 /nfs/dbraw/zinc/54/15/86/510541586.db2.gz LBXJJXJFPFEYRV-JRPNMDOOSA-N 1 1 355.822 2.668 20 5 FFBDMO C[C@@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000188009247 510547273 /nfs/dbraw/zinc/54/72/73/510547273.db2.gz QUNZQBPLYFRETG-BZNIZROVSA-N 1 1 355.822 2.670 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000246742454 510647617 /nfs/dbraw/zinc/64/76/17/510647617.db2.gz IPNVHXXLZHDRDH-RDJZCZTQSA-N 1 1 363.458 2.770 20 5 FFBDMO O=C(CC[N@@H+](C[C@H]1CCOC1)C1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000185182037 510733146 /nfs/dbraw/zinc/73/31/46/510733146.db2.gz KUXOXIMEEYPWEQ-GFCCVEGCSA-N 1 1 351.378 2.563 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000246944474 510761170 /nfs/dbraw/zinc/76/11/70/510761170.db2.gz CBMLPFOHMIGJCE-JKIFEVAISA-N 1 1 357.414 2.701 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195314692 510779078 /nfs/dbraw/zinc/77/90/78/510779078.db2.gz GXKJCFLIRUFCPP-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1CN(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000195314692 510779084 /nfs/dbraw/zinc/77/90/84/510779084.db2.gz GXKJCFLIRUFCPP-GASCZTMLSA-N 1 1 351.447 2.535 20 5 FFBDMO CN(C(=O)C[NH+]1CCC(OC2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000195323081 510782960 /nfs/dbraw/zinc/78/29/60/510782960.db2.gz ZLESNLVETHPVHG-UHFFFAOYSA-N 1 1 361.442 2.981 20 5 FFBDMO CCC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000182156973 510785602 /nfs/dbraw/zinc/78/56/02/510785602.db2.gz HKDMMOJWTYNQEY-HOTGVXAUSA-N 1 1 352.431 2.616 20 5 FFBDMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000178832899 510795168 /nfs/dbraw/zinc/79/51/68/510795168.db2.gz BSMDQMCSAXJCDL-CYBMUJFWSA-N 1 1 363.414 2.587 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000247556955 510865560 /nfs/dbraw/zinc/86/55/60/510865560.db2.gz ZHGBDTOATHXULD-GXTWGEPZSA-N 1 1 369.849 2.816 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000285361435 510876228 /nfs/dbraw/zinc/87/62/28/510876228.db2.gz QIURSIATKUNCHQ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000285361435 510876233 /nfs/dbraw/zinc/87/62/33/510876233.db2.gz QIURSIATKUNCHQ-UHFFFAOYSA-N 1 1 373.409 2.725 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000285469979 510919097 /nfs/dbraw/zinc/91/90/97/510919097.db2.gz ZILLRMUMKWWCES-LBPRGKRZSA-N 1 1 355.385 2.558 20 5 FFBDMO CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000285521539 510940736 /nfs/dbraw/zinc/94/07/36/510940736.db2.gz OJILJVHHAMEYHK-XYPWUTKMSA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)[N@@H+](CCOCCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294066350 510945532 /nfs/dbraw/zinc/94/55/32/510945532.db2.gz KIHDKMYLEHHRPE-UHFFFAOYSA-N 1 1 350.337 2.833 20 5 FFBDMO O=[N+]([O-])c1cnc(C(F)(F)F)cc1N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000282622723 511049541 /nfs/dbraw/zinc/04/95/41/511049541.db2.gz AEVHXPFQEHDKIW-LBPRGKRZSA-N 1 1 374.363 2.557 20 5 FFBDMO COc1cccc([C@@H](C)[NH+]2CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC2)c1 ZINC000294405018 511053053 /nfs/dbraw/zinc/05/30/53/511053053.db2.gz AEYKKSCVKJZICT-OAHLLOKOSA-N 1 1 363.458 2.736 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](C4CCOCC4)C3)n2)cc1 ZINC000361955600 511108547 /nfs/dbraw/zinc/10/85/47/511108547.db2.gz SQXHPHCMRYQBPX-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294604458 511118897 /nfs/dbraw/zinc/11/88/97/511118897.db2.gz VIIYIAKPYHDXJH-OCCSQVGLSA-N 1 1 357.332 2.970 20 5 FFBDMO Cc1cc([C@H](C)[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)oc1C ZINC000282876959 511144019 /nfs/dbraw/zinc/14/40/19/511144019.db2.gz VNPKKBPNQZOKQM-LBPRGKRZSA-N 1 1 352.412 2.929 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCc2cc(C)[nH+]c(N3CCCC3)c2)n1 ZINC000291052773 511157961 /nfs/dbraw/zinc/15/79/61/511157961.db2.gz DVHAVFKYFVJCIK-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO CCn1c(SCCc2c[nH+]cn2C)nnc1-c1ccc([N+](=O)[O-])cc1 ZINC000298183009 511201628 /nfs/dbraw/zinc/20/16/28/511201628.db2.gz DTYHIEKHPGMWCC-UHFFFAOYSA-N 1 1 358.427 2.942 20 5 FFBDMO Cc1nc(N2CCC3(C[C@H]3[N@H+](C)Cc3nccs3)CC2)ncc1[N+](=O)[O-] ZINC000294903392 511214292 /nfs/dbraw/zinc/21/42/92/511214292.db2.gz HGQZZRRESJEUEB-CQSZACIVSA-N 1 1 374.470 2.641 20 5 FFBDMO Cc1nc(N2CCC3(C[C@H]3[N@@H+](C)Cc3nccs3)CC2)ncc1[N+](=O)[O-] ZINC000294903392 511214296 /nfs/dbraw/zinc/21/42/96/511214296.db2.gz HGQZZRRESJEUEB-CQSZACIVSA-N 1 1 374.470 2.641 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000362792368 511239239 /nfs/dbraw/zinc/23/92/39/511239239.db2.gz QNBOJHFHBDTJGW-NVXWUHKLSA-N 1 1 358.442 2.896 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1 ZINC000271562939 511246389 /nfs/dbraw/zinc/24/63/89/511246389.db2.gz AFLTVGBMZBMWPE-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1cc(C2CC[NH+]([C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)[nH]n1 ZINC000271562939 511246392 /nfs/dbraw/zinc/24/63/92/511246392.db2.gz AFLTVGBMZBMWPE-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291625653 511272363 /nfs/dbraw/zinc/27/23/63/511272363.db2.gz AAADWTJRKBLFEV-CYBMUJFWSA-N 1 1 359.430 2.970 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000365188054 511306412 /nfs/dbraw/zinc/30/64/12/511306412.db2.gz AOCIXCQLRWCVAW-DOTOQJQBSA-N 1 1 373.453 2.969 20 5 FFBDMO CCOc1cccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271792796 511325384 /nfs/dbraw/zinc/32/53/84/511325384.db2.gz VAMAKCFKISRWMX-AWEZNQCLSA-N 1 1 357.410 2.961 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)CC[C@H]21 ZINC000295429931 511402828 /nfs/dbraw/zinc/40/28/28/511402828.db2.gz MKPKVBNNMBXCLC-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@H]21 ZINC000295429931 511402830 /nfs/dbraw/zinc/40/28/30/511402830.db2.gz MKPKVBNNMBXCLC-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@H]21 ZINC000295429931 511402834 /nfs/dbraw/zinc/40/28/34/511402834.db2.gz MKPKVBNNMBXCLC-RDTXWAMCSA-N 1 1 369.425 2.541 20 5 FFBDMO C[C@@H](CO)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000280293279 511410130 /nfs/dbraw/zinc/41/01/30/511410130.db2.gz FGSMWDBQUIJGLK-NSHDSACASA-N 1 1 355.822 2.670 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C)c1[N+](=O)[O-] ZINC000291975662 511413631 /nfs/dbraw/zinc/41/36/31/511413631.db2.gz YEFJODWDSSQEFR-ZFWWWQNUSA-N 1 1 371.441 2.663 20 5 FFBDMO CCOc1cc(N2CCN(CC[C@H]3CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000280322633 511420456 /nfs/dbraw/zinc/42/04/56/511420456.db2.gz YNQBIXCJRJIOPR-MRXNPFEDSA-N 1 1 362.474 2.600 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3cn[nH]c3)CC2)cccc1[N+](=O)[O-] ZINC000365392166 511421636 /nfs/dbraw/zinc/42/16/36/511421636.db2.gz NKXVLERFZYOMMO-CYBMUJFWSA-N 1 1 357.414 2.833 20 5 FFBDMO C[C@@H]1CC[S@@](=O)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468703 511469241 /nfs/dbraw/zinc/46/92/41/511469241.db2.gz HTBLJPGGTKRUBK-YMXBGEKHSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H]1CC[S@@](=O)CC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000365468703 511469245 /nfs/dbraw/zinc/46/92/45/511469245.db2.gz HTBLJPGGTKRUBK-YMXBGEKHSA-N 1 1 363.439 2.635 20 5 FFBDMO C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1 ZINC000295697532 511487287 /nfs/dbraw/zinc/48/72/87/511487287.db2.gz IXJHZUKYRZDBJP-SNVBAGLBSA-N 1 1 357.332 2.994 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000283905016 511539162 /nfs/dbraw/zinc/53/91/62/511539162.db2.gz BOZSHPHYWBVPMF-LLVKDONJSA-N 1 1 370.365 2.873 20 5 FFBDMO CCOc1cc(N2CC[NH+](CCc3cscn3)CC2)ccc1[N+](=O)[O-] ZINC000295915868 511554128 /nfs/dbraw/zinc/55/41/28/511554128.db2.gz GBLVZNRNNBEQAE-UHFFFAOYSA-N 1 1 362.455 2.815 20 5 FFBDMO CCS(=O)(=O)c1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000280671107 511557887 /nfs/dbraw/zinc/55/78/87/511557887.db2.gz UFBYEEYAQWFBPB-UHFFFAOYSA-N 1 1 370.452 2.748 20 5 FFBDMO Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000365633065 511571166 /nfs/dbraw/zinc/57/11/66/511571166.db2.gz URKOPWBWVHRRDF-CYBMUJFWSA-N 1 1 358.398 2.574 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000365819333 511667589 /nfs/dbraw/zinc/66/75/89/511667589.db2.gz IYRNHUQHDGZBQZ-AWEZNQCLSA-N 1 1 362.430 2.620 20 5 FFBDMO Cc1ccc(C)c(NC(=O)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000365820651 511668475 /nfs/dbraw/zinc/66/84/75/511668475.db2.gz OCEHWLJMLHNVDG-UHFFFAOYSA-N 1 1 357.414 2.684 20 5 FFBDMO COc1ccc(CN2CCC(CC[NH+]3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000363667455 511693810 /nfs/dbraw/zinc/69/38/10/511693810.db2.gz VYQRGTYGTCVYPB-UHFFFAOYSA-N 1 1 363.458 2.538 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)C2)C1 ZINC000292892551 511761222 /nfs/dbraw/zinc/76/12/22/511761222.db2.gz VYZSUUSPDVQCKM-FQEVSTJZSA-N 1 1 372.469 2.753 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000365999258 511776938 /nfs/dbraw/zinc/77/69/38/511776938.db2.gz YKJZLMUWTGVRJD-CVEARBPZSA-N 1 1 355.394 2.782 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000293094079 511837885 /nfs/dbraw/zinc/83/78/85/511837885.db2.gz TUNDGJSFLXEOEG-IBGZPJMESA-N 1 1 360.458 2.655 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc1SC ZINC000274525139 511863521 /nfs/dbraw/zinc/86/35/21/511863521.db2.gz SSYLZSYKZVWBPL-LBPRGKRZSA-N 1 1 367.471 2.928 20 5 FFBDMO CCOc1cc(C[NH2+][C@]2(CO)CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000281589524 511900980 /nfs/dbraw/zinc/90/09/80/511900980.db2.gz DWZMYEGTTHWHMS-IBGZPJMESA-N 1 1 358.394 2.753 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCO[C@@H](C(C)C)C1 ZINC000293288106 511910012 /nfs/dbraw/zinc/91/00/12/511910012.db2.gz VVIYPLSKZUQEOW-QGZVFWFLSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N ZINC000373735142 512478323 /nfs/dbraw/zinc/47/83/23/512478323.db2.gz XVMHHLAGSQMQEN-OAHLLOKOSA-N 1 1 368.437 2.914 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375757477 512489622 /nfs/dbraw/zinc/48/96/22/512489622.db2.gz JRVCAMASPSGTIP-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000375757477 512489626 /nfs/dbraw/zinc/48/96/26/512489626.db2.gz JRVCAMASPSGTIP-KGLIPLIRSA-N 1 1 357.414 2.535 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000373777713 512500267 /nfs/dbraw/zinc/50/02/67/512500267.db2.gz ODGZGHRZCMLRSX-CQSZACIVSA-N 1 1 357.414 2.521 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000369692953 512557592 /nfs/dbraw/zinc/55/75/92/512557592.db2.gz LJLDIBOEZJQMAJ-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000411307769 512574033 /nfs/dbraw/zinc/57/40/33/512574033.db2.gz IADVOMKPGXZBPZ-UHFFFAOYSA-N 1 1 363.414 2.731 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCSC[C@@H]1C1CC1 ZINC000411782862 512809304 /nfs/dbraw/zinc/80/93/04/512809304.db2.gz FHBALWBYHGXTDX-OAHLLOKOSA-N 1 1 365.455 2.759 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCSC3(CCC3)CC2)c1 ZINC000411855034 512846087 /nfs/dbraw/zinc/84/60/87/512846087.db2.gz JUCJKCAMAYSEQG-HNNXBMFYSA-N 1 1 352.456 2.696 20 5 FFBDMO CCOc1cc(C[N@H+]2CC[C@@](C(N)=O)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000411975217 512898959 /nfs/dbraw/zinc/89/89/59/512898959.db2.gz ZVWYFRBRQJORBP-FQEVSTJZSA-N 1 1 369.421 2.623 20 5 FFBDMO COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1Cl ZINC000412041618 512925978 /nfs/dbraw/zinc/92/59/78/512925978.db2.gz NFVRBSINBOVMRE-UHFFFAOYSA-N 1 1 351.790 2.551 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000374821478 513021637 /nfs/dbraw/zinc/02/16/37/513021637.db2.gz CFRKMSDOLNUJGA-HNNXBMFYSA-N 1 1 357.414 2.964 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3C[C@@H]4CC[N@@H+](C)[C@@H]4C3)cc2[N+](=O)[O-])C1 ZINC000408461377 513070430 /nfs/dbraw/zinc/07/04/30/513070430.db2.gz AEHREJFHPHIYNI-URLQWDBASA-N 1 1 372.469 2.607 20 5 FFBDMO C[C@@H](CNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)C[NH+]1CCOCC1 ZINC000450349867 513153865 /nfs/dbraw/zinc/15/38/65/513153865.db2.gz VQTZAIPLNJTHHH-ZDUSSCGKSA-N 1 1 362.455 2.520 20 5 FFBDMO COC(=O)[C@]1(c2ccccc2)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000428773785 513187204 /nfs/dbraw/zinc/18/72/04/513187204.db2.gz RWPSTUDKABUTLM-HXUWFJFHSA-N 1 1 370.405 2.790 20 5 FFBDMO COC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000428793990 513193965 /nfs/dbraw/zinc/19/39/65/513193965.db2.gz MBYOZFIZVIKJTK-FQEVSTJZSA-N 1 1 370.405 2.920 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1C ZINC000440080061 513243507 /nfs/dbraw/zinc/24/35/07/513243507.db2.gz QJAMHRIVIRAFSB-OCCSQVGLSA-N 1 1 369.487 2.610 20 5 FFBDMO CO[C@H](Cc1ccccc1)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000450561483 513251561 /nfs/dbraw/zinc/25/15/61/513251561.db2.gz FWHODNXLEFAXHT-FUHWJXTLSA-N 1 1 356.426 2.734 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](CCCO)C2)c(Br)c1 ZINC000450609679 513271611 /nfs/dbraw/zinc/27/16/11/513271611.db2.gz FRWBXAABZHDSMI-LLVKDONJSA-N 1 1 358.236 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+](CCCO)C2)c(Br)c1 ZINC000450609679 513271620 /nfs/dbraw/zinc/27/16/20/513271620.db2.gz FRWBXAABZHDSMI-LLVKDONJSA-N 1 1 358.236 2.616 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000415507714 513301523 /nfs/dbraw/zinc/30/15/23/513301523.db2.gz TWGQOURBKFDEKL-MRXNPFEDSA-N 1 1 356.382 2.782 20 5 FFBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000434419754 513318991 /nfs/dbraw/zinc/31/89/91/513318991.db2.gz BJIRCDDVNLOVKX-INIZCTEOSA-N 1 1 369.425 2.527 20 5 FFBDMO CCc1nn(C)c(N2CC[N@@H+](Cc3ccccc3)C[C@@H](C)C2)c1[N+](=O)[O-] ZINC000450810651 513350538 /nfs/dbraw/zinc/35/05/38/513350538.db2.gz MTAMIPYWULCHSA-OAHLLOKOSA-N 1 1 357.458 2.849 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCC([N@@H+]2CCO[C@H](C)C2)CC1 ZINC000421772801 513418583 /nfs/dbraw/zinc/41/85/83/513418583.db2.gz ZXXDAWROXNTIRY-OAHLLOKOSA-N 1 1 361.442 2.537 20 5 FFBDMO NC(=O)c1cc([N+](=O)[O-])cnc1S[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000425285111 513490965 /nfs/dbraw/zinc/49/09/65/513490965.db2.gz SAYUJTPBZIACGS-HNNXBMFYSA-N 1 1 372.450 2.845 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000441186289 513508174 /nfs/dbraw/zinc/50/81/74/513508174.db2.gz WNDSXDZADQZSLF-CABCVRRESA-N 1 1 350.415 2.731 20 5 FFBDMO C[C@@H]1C[N@@H+](CCN(C)c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 ZINC000413264162 513556944 /nfs/dbraw/zinc/55/69/44/513556944.db2.gz JIAMFOLPSDSLKJ-PHIMTYICSA-N 1 1 362.352 2.554 20 5 FFBDMO C[C@@H]1C[N@H+](CCN(C)c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 ZINC000413264162 513556952 /nfs/dbraw/zinc/55/69/52/513556952.db2.gz JIAMFOLPSDSLKJ-PHIMTYICSA-N 1 1 362.352 2.554 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000447812385 513578136 /nfs/dbraw/zinc/57/81/36/513578136.db2.gz LMJSAHGLZVBCFB-ZDUSSCGKSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C(C)(C)C)C1 ZINC000447852205 513600901 /nfs/dbraw/zinc/60/09/01/513600901.db2.gz YTCISGNZMSOFII-INIZCTEOSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1)Nc1ccccc1[N+](=O)[O-] ZINC000425546304 513632308 /nfs/dbraw/zinc/63/23/08/513632308.db2.gz DPPUFJXESYRZBZ-SFHVURJKSA-N 1 1 359.426 2.814 20 5 FFBDMO O=C(C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1)Nc1ccccc1[N+](=O)[O-] ZINC000425546304 513632312 /nfs/dbraw/zinc/63/23/12/513632312.db2.gz DPPUFJXESYRZBZ-SFHVURJKSA-N 1 1 359.426 2.814 20 5 FFBDMO Cc1cc(OCC(=O)NC[C@@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000430537039 513678640 /nfs/dbraw/zinc/67/86/40/513678640.db2.gz KDCWSOJKGAZDRL-MRXNPFEDSA-N 1 1 371.437 2.919 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451349118 513694162 /nfs/dbraw/zinc/69/41/62/513694162.db2.gz WOZOJSTWEUACDM-PILAGYSTSA-N 1 1 361.442 2.937 20 5 FFBDMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000419005191 513714616 /nfs/dbraw/zinc/71/46/16/513714616.db2.gz RSRXEUPNVUIGBN-CHWSQXEVSA-N 1 1 362.455 2.610 20 5 FFBDMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000419007334 513714824 /nfs/dbraw/zinc/71/48/24/513714824.db2.gz RKRAMHWRQYQKQS-KBPBESRZSA-N 1 1 351.447 2.663 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418064 513737442 /nfs/dbraw/zinc/73/74/42/513737442.db2.gz LYKKDFWSQUACCP-DAXOMENPSA-N 1 1 367.833 2.812 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000451418064 513737444 /nfs/dbraw/zinc/73/74/44/513737444.db2.gz LYKKDFWSQUACCP-DAXOMENPSA-N 1 1 367.833 2.812 20 5 FFBDMO CC(C)Oc1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-] ZINC000413620310 513739428 /nfs/dbraw/zinc/73/94/28/513739428.db2.gz AASQFCLTQGYJIX-JKSUJKDBSA-N 1 1 361.442 2.938 20 5 FFBDMO CCO[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000451545455 513823133 /nfs/dbraw/zinc/82/31/33/513823133.db2.gz RBCWNEFVYIAMFH-DYVFJYSZSA-N 1 1 365.430 2.679 20 5 FFBDMO C[C@@H]1C[N@@H+](CCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCCO1 ZINC000436376324 513841096 /nfs/dbraw/zinc/84/10/96/513841096.db2.gz HHQQNZCJGLIBHY-LLVKDONJSA-N 1 1 362.352 2.921 20 5 FFBDMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1)[N@H+]1CCCC[C@H]1C ZINC000448699168 513852359 /nfs/dbraw/zinc/85/23/59/513852359.db2.gz SMHIYWVZXWZRMW-CABCVRRESA-N 1 1 371.441 2.773 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000448723770 513866623 /nfs/dbraw/zinc/86/66/23/513866623.db2.gz IVAJDXYFKRMOSJ-NEPJUHHUSA-N 1 1 357.332 2.970 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](CO)CC(C)(C)C ZINC000451785866 513979914 /nfs/dbraw/zinc/97/99/14/513979914.db2.gz VVYWDFOGOGEUFP-OAHLLOKOSA-N 1 1 351.447 2.961 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000431943344 514048071 /nfs/dbraw/zinc/04/80/71/514048071.db2.gz VRGJUDGJLHOTPZ-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@]2(CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451898180 514055171 /nfs/dbraw/zinc/05/51/71/514055171.db2.gz IVPSSJWJBVYQAD-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@]2(CCOC2)C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451898180 514055178 /nfs/dbraw/zinc/05/51/78/514055178.db2.gz IVPSSJWJBVYQAD-INIZCTEOSA-N 1 1 353.806 2.689 20 5 FFBDMO O=C(C[N@H+]1CCC[C@@]2(CCSC2)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000451963298 514098701 /nfs/dbraw/zinc/09/87/01/514098701.db2.gz HKIZTNDVVDPSCP-GOSISDBHSA-N 1 1 361.467 2.703 20 5 FFBDMO Cc1c(NC(=O)[C@H](C)N2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420344290 514101878 /nfs/dbraw/zinc/10/18/78/514101878.db2.gz SNZJELLNLMEZPY-JYJNAYRXSA-N 1 1 360.458 2.552 20 5 FFBDMO CC[N@@H+](CCNC(=O)c1ccc(F)cc1[N+](=O)[O-])CCC(F)(F)F ZINC000427217546 514151939 /nfs/dbraw/zinc/15/19/39/514151939.db2.gz JMFKLOBTWNDUDR-UHFFFAOYSA-N 1 1 351.300 2.738 20 5 FFBDMO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1c1ccc(O)cc1 ZINC000449351213 514177794 /nfs/dbraw/zinc/17/77/94/514177794.db2.gz ZRCVKIRAPDIYSJ-ZWKOTPCHSA-N 1 1 370.405 2.997 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000452112073 514199762 /nfs/dbraw/zinc/19/97/62/514199762.db2.gz FAURMWXSDMZMBH-ZDUSSCGKSA-N 1 1 354.838 2.601 20 5 FFBDMO Cc1cccnc1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449489256 514227034 /nfs/dbraw/zinc/22/70/34/514227034.db2.gz PUCMEHPKBHXGNK-GOSISDBHSA-N 1 1 351.410 2.953 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000449786756 514350759 /nfs/dbraw/zinc/35/07/59/514350759.db2.gz PYQIZIIOTQTOLK-GOSISDBHSA-N 1 1 357.458 2.910 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@H]1C ZINC000449968954 514447207 /nfs/dbraw/zinc/44/72/07/514447207.db2.gz CKIGKHBGWRNEDT-CZUORRHYSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@H]1C ZINC000449968954 514447214 /nfs/dbraw/zinc/44/72/14/514447214.db2.gz CKIGKHBGWRNEDT-CZUORRHYSA-N 1 1 371.441 2.930 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C[C@H]1C ZINC000449968954 514447223 /nfs/dbraw/zinc/44/72/23/514447223.db2.gz CKIGKHBGWRNEDT-CZUORRHYSA-N 1 1 371.441 2.930 20 5 FFBDMO C[C@H](CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)[N@H+]1CCCC[C@@H]1C ZINC000445487284 514486203 /nfs/dbraw/zinc/48/62/03/514486203.db2.gz FAHIPHXKPPWZOB-LSDHHAIUSA-N 1 1 360.458 2.925 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])cc3)n2C)C[C@@H](C)C1 ZINC000453427489 514630989 /nfs/dbraw/zinc/63/09/89/514630989.db2.gz PEOCDDLVCHOUNX-GRDNDAEWSA-N 1 1 370.457 2.557 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C[C@@H](C)C1 ZINC000453428740 514632742 /nfs/dbraw/zinc/63/27/42/514632742.db2.gz QMHSUGIWXHGTDG-JJRVBVJISA-N 1 1 370.457 2.557 20 5 FFBDMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470959289 514694331 /nfs/dbraw/zinc/69/43/31/514694331.db2.gz HRUBWGCKETZPAX-HOCLYGCPSA-N 1 1 360.458 2.586 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000461796990 514744948 /nfs/dbraw/zinc/74/49/48/514744948.db2.gz PUPSMTLGWCOOPX-HNNXBMFYSA-N 1 1 350.463 2.899 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc(F)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000489259823 514774539 /nfs/dbraw/zinc/77/45/39/514774539.db2.gz SOHANAKVNKKJHW-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc(F)cc2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000489259823 514774551 /nfs/dbraw/zinc/77/45/51/514774551.db2.gz SOHANAKVNKKJHW-UHFFFAOYSA-N 1 1 359.357 2.957 20 5 FFBDMO CC[N@H+](Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000475726083 514777418 /nfs/dbraw/zinc/77/74/18/514777418.db2.gz RDMUFKRUZBDELN-UHFFFAOYSA-N 1 1 359.382 2.564 20 5 FFBDMO CC[N@@H+](Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1)Cc1ccccn1 ZINC000475726083 514777427 /nfs/dbraw/zinc/77/74/27/514777427.db2.gz RDMUFKRUZBDELN-UHFFFAOYSA-N 1 1 359.382 2.564 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)NCCc1ccc([N+](=O)[O-])cc1 ZINC000471387363 514861264 /nfs/dbraw/zinc/86/12/64/514861264.db2.gz DKMHNVUXBWFSKX-UHFFFAOYSA-N 1 1 353.422 2.702 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](S(C)(=O)=O)CC1 ZINC000503074085 514908875 /nfs/dbraw/zinc/90/88/75/514908875.db2.gz KBPNVHAVFOKBNB-VWILAXROSA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](S(C)(=O)=O)CC1 ZINC000503074085 514908883 /nfs/dbraw/zinc/90/88/83/514908883.db2.gz KBPNVHAVFOKBNB-VWILAXROSA-N 1 1 352.456 2.897 20 5 FFBDMO Nc1c(F)c(N2CC[NH+](CCOc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000476099773 514915667 /nfs/dbraw/zinc/91/56/67/514915667.db2.gz AKGSKWFUSVBSPD-UHFFFAOYSA-N 1 1 360.389 2.517 20 5 FFBDMO CNc1nc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)ccc1[N+](=O)[O-] ZINC000456048205 514922500 /nfs/dbraw/zinc/92/25/00/514922500.db2.gz ZLMCFMVOIBVHFU-UHFFFAOYSA-N 1 1 363.805 2.999 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1 ZINC000462190956 514929902 /nfs/dbraw/zinc/92/99/02/514929902.db2.gz RNCWPDHHSNVFGO-ACJLOTCBSA-N 1 1 357.385 2.984 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498498783 514933009 /nfs/dbraw/zinc/93/30/09/514933009.db2.gz ZPWZEOFTAVKBGD-INIZCTEOSA-N 1 1 368.865 2.772 20 5 FFBDMO CC[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000480375676 514936358 /nfs/dbraw/zinc/93/63/58/514936358.db2.gz GTHGPYVTLIVLIW-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO CC[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000480375676 514936366 /nfs/dbraw/zinc/93/63/66/514936366.db2.gz GTHGPYVTLIVLIW-QGZVFWFLSA-N 1 1 369.421 2.867 20 5 FFBDMO COc1ccc(C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC2CC2)c(OC)c1 ZINC000503233022 514971644 /nfs/dbraw/zinc/97/16/44/514971644.db2.gz JEDGZRZOEXYTJR-UHFFFAOYSA-N 1 1 360.414 2.721 20 5 FFBDMO COC(=O)c1ccccc1CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000480496251 514978013 /nfs/dbraw/zinc/97/80/13/514978013.db2.gz DOBJTOGLRAOQRD-UHFFFAOYSA-N 1 1 369.421 2.746 20 5 FFBDMO C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000498723683 515040403 /nfs/dbraw/zinc/04/04/03/515040403.db2.gz YPFIOEYPQCKUPG-GFCCVEGCSA-N 1 1 360.439 2.885 20 5 FFBDMO Cc1ccc(C)c(S(=O)(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000480699838 515049770 /nfs/dbraw/zinc/04/97/70/515049770.db2.gz PJLIRYHJBRACAJ-SWLSCSKDSA-N 1 1 369.487 2.610 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1[N+](=O)[O-] ZINC000489977137 515053426 /nfs/dbraw/zinc/05/34/26/515053426.db2.gz DQZLDRMLMUXANS-NWDGAFQWSA-N 1 1 368.231 2.714 20 5 FFBDMO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)CC[N@H+]1C ZINC000462480375 515075413 /nfs/dbraw/zinc/07/54/13/515075413.db2.gz LUIANQHGYDWVFD-ZBFHGGJFSA-N 1 1 356.426 2.885 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000467709061 515088769 /nfs/dbraw/zinc/08/87/69/515088769.db2.gz PCGGWMPECNXEMH-UHIISALHSA-N 1 1 367.833 2.614 20 5 FFBDMO C[NH+](C)Cc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)ccc1Cl ZINC000467762177 515107818 /nfs/dbraw/zinc/10/78/18/515107818.db2.gz KIYXEWJQOQPMRV-UHFFFAOYSA-N 1 1 365.821 2.880 20 5 FFBDMO Cc1c(CNC(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000490198267 515137895 /nfs/dbraw/zinc/13/78/95/515137895.db2.gz CJGVYZBCRXWGJA-AWEZNQCLSA-N 1 1 360.458 2.919 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1C ZINC000480946222 515148499 /nfs/dbraw/zinc/14/84/99/515148499.db2.gz ANGOXYKWHRQZRB-OCCSQVGLSA-N 1 1 369.487 2.610 20 5 FFBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3cc([N+](=O)[O-])cnc3N)cc2)c1C ZINC000462765512 515230344 /nfs/dbraw/zinc/23/03/44/515230344.db2.gz TWFNSWQBOOFVOD-UHFFFAOYSA-N 1 1 352.354 2.627 20 5 FFBDMO CNc1c(C(=O)NC[C@H](C)[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000462907324 515292843 /nfs/dbraw/zinc/29/28/43/515292843.db2.gz FMXNUHPYERFUCM-AWEZNQCLSA-N 1 1 368.437 2.813 20 5 FFBDMO CC(C)c1cc(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)nc(N(C)C)[nH+]1 ZINC000486032637 515304663 /nfs/dbraw/zinc/30/46/63/515304663.db2.gz XLGPCSJVCKXOFU-UHFFFAOYSA-N 1 1 359.434 2.612 20 5 FFBDMO Cc1ccc(C[N@@H+](C)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000477087353 515322807 /nfs/dbraw/zinc/32/28/07/515322807.db2.gz WQAOVTJXRCDVAR-KRWDZBQOSA-N 1 1 353.378 2.667 20 5 FFBDMO Cc1ccc(C[N@H+](C)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000477087353 515322813 /nfs/dbraw/zinc/32/28/13/515322813.db2.gz WQAOVTJXRCDVAR-KRWDZBQOSA-N 1 1 353.378 2.667 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@@H+]1C ZINC000486145184 515351621 /nfs/dbraw/zinc/35/16/21/515351621.db2.gz NLRKKIXMDGLIFX-SFYZADRCSA-N 1 1 362.249 2.631 20 5 FFBDMO C[C@@H]1[C@@H](NC(=O)c2sc(Br)cc2[N+](=O)[O-])CCC[N@H+]1C ZINC000486145184 515351628 /nfs/dbraw/zinc/35/16/28/515351628.db2.gz NLRKKIXMDGLIFX-SFYZADRCSA-N 1 1 362.249 2.631 20 5 FFBDMO CS(=O)(=O)C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000463057020 515353526 /nfs/dbraw/zinc/35/35/26/515353526.db2.gz PYNMDZQWPWBYRV-CGICMKJESA-N 1 1 360.435 2.984 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519323 515358096 /nfs/dbraw/zinc/35/80/96/515358096.db2.gz LEYZRIFDSVTILG-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481519323 515358107 /nfs/dbraw/zinc/35/81/07/515358107.db2.gz LEYZRIFDSVTILG-BLLLJJGKSA-N 1 1 363.414 2.505 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nnnn1-c1ccccc1 ZINC000468636316 515448570 /nfs/dbraw/zinc/44/85/70/515448570.db2.gz ZKBDUSLTSGVLSL-UVTDQMKNSA-N 1 1 350.382 2.764 20 5 FFBDMO C[N@H+]1C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000481757048 515454386 /nfs/dbraw/zinc/45/43/86/515454386.db2.gz WQJCCCYRSJYVQQ-IAGOWNOFSA-N 1 1 369.421 2.578 20 5 FFBDMO COCC[N@@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Br ZINC000492123472 515503421 /nfs/dbraw/zinc/50/34/21/515503421.db2.gz ZRKQUMRCSIQXJS-LBPRGKRZSA-N 1 1 358.236 2.880 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Br ZINC000492123472 515503432 /nfs/dbraw/zinc/50/34/32/515503432.db2.gz ZRKQUMRCSIQXJS-LBPRGKRZSA-N 1 1 358.236 2.880 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])C[C@H]1C ZINC000500122174 515598471 /nfs/dbraw/zinc/59/84/71/515598471.db2.gz OALMKLUFYQOBMM-NEPJUHHUSA-N 1 1 367.471 2.880 20 5 FFBDMO COC(=O)[C@H]([N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528591 515622336 /nfs/dbraw/zinc/62/23/36/515622336.db2.gz ZNCZPOIXCQANBM-RDJZCZTQSA-N 1 1 362.426 2.885 20 5 FFBDMO COC(=O)[C@H]([N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)C1(OC)CCC1 ZINC000459528591 515622345 /nfs/dbraw/zinc/62/23/45/515622345.db2.gz ZNCZPOIXCQANBM-RDJZCZTQSA-N 1 1 362.426 2.885 20 5 FFBDMO CCCC[N@@H+](C)CCNC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1C ZINC000486879028 515669530 /nfs/dbraw/zinc/66/95/30/515669530.db2.gz HVDVXOKVSPUGFK-UHFFFAOYSA-N 1 1 366.418 2.543 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000486969528 515702353 /nfs/dbraw/zinc/70/23/53/515702353.db2.gz HSCOPJGGULXKIM-GFCCVEGCSA-N 1 1 356.854 2.820 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1c1c(F)cccc1F ZINC000478328222 515784049 /nfs/dbraw/zinc/78/40/49/515784049.db2.gz OYXKZVHBWKFPGX-NSHDSACASA-N 1 1 365.311 2.907 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(OCC(F)(F)F)cc1 ZINC000511120209 515792111 /nfs/dbraw/zinc/79/21/11/515792111.db2.gz BXRHRNITVXHNBS-UHFFFAOYSA-N 1 1 358.320 2.864 20 5 FFBDMO CCN(C(=O)c1c([N+](=O)[O-])cnn1C)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000500900117 515900645 /nfs/dbraw/zinc/90/06/45/515900645.db2.gz HYWGBDIMDWKDJE-GDBMZVCRSA-N 1 1 371.441 2.626 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000511429019 515901604 /nfs/dbraw/zinc/90/16/04/515901604.db2.gz PUFPKWHMZPMRKB-MRXNPFEDSA-N 1 1 360.458 2.796 20 5 FFBDMO CC[N@H+]1CC[C@H](CNC(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000501076275 515968082 /nfs/dbraw/zinc/96/80/82/515968082.db2.gz QVVBJDOBGUPZBJ-SNVBAGLBSA-N 1 1 371.235 2.821 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1(C)C ZINC000464819720 515973008 /nfs/dbraw/zinc/97/30/08/515973008.db2.gz BXKBGIFLSRBZND-APWZRJJASA-N 1 1 361.442 2.619 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000506755503 515975164 /nfs/dbraw/zinc/97/51/64/515975164.db2.gz VOFCBUNPYJPVMV-OAHLLOKOSA-N 1 1 354.838 2.603 20 5 FFBDMO COC(=O)COc1ccc(C[NH2+]Cc2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000474349537 516005222 /nfs/dbraw/zinc/00/52/22/516005222.db2.gz HJAMRCSIBTZKCU-UHFFFAOYSA-N 1 1 366.320 2.715 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000487925646 516035838 /nfs/dbraw/zinc/03/58/38/516035838.db2.gz WVQYQZZDGFOOKU-NHYWBVRUSA-N 1 1 366.849 2.573 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000469995792 516067761 /nfs/dbraw/zinc/06/77/61/516067761.db2.gz FUGALENZDMSWKT-MISXGVKJSA-N 1 1 360.370 2.589 20 5 FFBDMO CCn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1C[C@H](C)[N@@H+](CC)C[C@H]1C ZINC000460215058 516070456 /nfs/dbraw/zinc/07/04/56/516070456.db2.gz PXTNQDGXPKFQNH-UONOGXRCSA-N 1 1 358.446 2.792 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000470156393 516152050 /nfs/dbraw/zinc/15/20/50/516152050.db2.gz OCHBPYOYMJQIIJ-QBIMZIAESA-N 1 1 355.394 2.941 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])n2C)cc1 ZINC000465468692 516162240 /nfs/dbraw/zinc/16/22/40/516162240.db2.gz RQJVRWBKTCACDZ-GFCCVEGCSA-N 1 1 353.382 2.918 20 5 FFBDMO C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000507374012 516190390 /nfs/dbraw/zinc/19/03/90/516190390.db2.gz YGGSFLSXWZIHRY-GOEBONIOSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000507374012 516190399 /nfs/dbraw/zinc/19/03/99/516190399.db2.gz YGGSFLSXWZIHRY-GOEBONIOSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1CCC[C@H](C)[NH+]1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-] ZINC000497514059 516324881 /nfs/dbraw/zinc/32/48/81/516324881.db2.gz ABYLRJRBWHWRGG-STQMWFEESA-N 1 1 355.460 2.673 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1C ZINC000497544739 516325841 /nfs/dbraw/zinc/32/58/41/516325841.db2.gz ZVCCAVRVXZRPOZ-DOMZBBRYSA-N 1 1 369.487 2.610 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCCCNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000497544292 516325884 /nfs/dbraw/zinc/32/58/84/516325884.db2.gz WKEBOALATLKCGO-CQSZACIVSA-N 1 1 369.487 2.922 20 5 FFBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000517556485 516361854 /nfs/dbraw/zinc/36/18/54/516361854.db2.gz PZLCYQYCPURWNJ-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 ZINC000517556485 516361861 /nfs/dbraw/zinc/36/18/61/516361861.db2.gz PZLCYQYCPURWNJ-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512817293 516372169 /nfs/dbraw/zinc/37/21/69/516372169.db2.gz LJLCXGUNLHQRIW-LBPRGKRZSA-N 1 1 357.357 2.793 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815824 516372473 /nfs/dbraw/zinc/37/24/73/516372473.db2.gz DWQUWLJUTUHQPE-NEPJUHHUSA-N 1 1 357.357 2.791 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](COC(F)F)C2)cccc1[N+](=O)[O-] ZINC000512815824 516372481 /nfs/dbraw/zinc/37/24/81/516372481.db2.gz DWQUWLJUTUHQPE-NEPJUHHUSA-N 1 1 357.357 2.791 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@H](COC(F)F)C3)o2)cc1 ZINC000512841542 516381184 /nfs/dbraw/zinc/38/11/84/516381184.db2.gz UAOJUBBPFOSXOX-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](COC(F)F)C3)o2)cc1 ZINC000512841542 516381192 /nfs/dbraw/zinc/38/11/92/516381192.db2.gz UAOJUBBPFOSXOX-SNVBAGLBSA-N 1 1 354.313 2.706 20 5 FFBDMO Cc1cc(N2C[C@H]([NH+]3CCOCC3)C[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000557696347 516387322 /nfs/dbraw/zinc/38/73/22/516387322.db2.gz CLHCLOIWEPIRIO-LSDHHAIUSA-N 1 1 356.426 2.751 20 5 FFBDMO CCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1C[C@@H](OCC)C1(C)C ZINC000535583773 516411550 /nfs/dbraw/zinc/41/15/50/516411550.db2.gz WEBKUOHWMGCBRD-HZPDHXFCSA-N 1 1 351.447 2.672 20 5 FFBDMO Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cccc(CC[N@H+](C)C2CC2)c1 ZINC000540433495 516554565 /nfs/dbraw/zinc/55/45/65/516554565.db2.gz SJTWPJOZGKMBHO-UHFFFAOYSA-N 1 1 371.441 2.765 20 5 FFBDMO C[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C[N@H+]1C1CC1 ZINC000554699310 516592701 /nfs/dbraw/zinc/59/27/01/516592701.db2.gz BWJWVVBPLNDRLV-TZMCWYRMSA-N 1 1 371.441 2.543 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000513518356 516658789 /nfs/dbraw/zinc/65/87/89/516658789.db2.gz DLEIFQBENVFTLL-IBGZPJMESA-N 1 1 354.410 2.661 20 5 FFBDMO Cc1c(Br)c(N(C)C[C@@H]2CCC[N@@H+](C)C2)ncc1[N+](=O)[O-] ZINC000554847936 516661729 /nfs/dbraw/zinc/66/17/29/516661729.db2.gz CGUDGVQAYBAVLQ-LLVKDONJSA-N 1 1 357.252 2.839 20 5 FFBDMO C[N@H+]1CC[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000536193835 516671786 /nfs/dbraw/zinc/67/17/86/516671786.db2.gz ULNOVEBZFLGNOY-MOPGFXCFSA-N 1 1 368.437 2.882 20 5 FFBDMO CCc1ccc([C@@H](NC[C@H]2C[N@@H+](C)CCN2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544360840 516721639 /nfs/dbraw/zinc/72/16/39/516721639.db2.gz SDLPLYGWONDUJW-PXNSSMCTSA-N 1 1 372.469 2.675 20 5 FFBDMO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760311 516762107 /nfs/dbraw/zinc/76/21/07/516762107.db2.gz RPIFADDBMHLFRI-YJBOKZPZSA-N 1 1 373.457 2.952 20 5 FFBDMO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1NC[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000518760311 516762116 /nfs/dbraw/zinc/76/21/16/516762116.db2.gz RPIFADDBMHLFRI-YJBOKZPZSA-N 1 1 373.457 2.952 20 5 FFBDMO CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000518899064 516814160 /nfs/dbraw/zinc/81/41/60/516814160.db2.gz PPCUVIQZESFXFZ-QGZVFWFLSA-N 1 1 372.469 2.506 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000532169964 516838982 /nfs/dbraw/zinc/83/89/82/516838982.db2.gz YZQACRUNJQWGCD-NVXWUHKLSA-N 1 1 362.430 2.668 20 5 FFBDMO CC(C)[N@@H+](C)CC1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)CC1 ZINC000558679994 516881593 /nfs/dbraw/zinc/88/15/93/516881593.db2.gz COIZZWADECNMCJ-UHFFFAOYSA-N 1 1 372.473 2.947 20 5 FFBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514212108 516906187 /nfs/dbraw/zinc/90/61/87/516906187.db2.gz BFVYBZUIPCHYJY-JQWIXIFHSA-N 1 1 357.357 2.608 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514217502 516909847 /nfs/dbraw/zinc/90/98/47/516909847.db2.gz FIYMREVFMXHAPO-UHFFFAOYSA-N 1 1 368.340 2.911 20 5 FFBDMO O=C(NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-] ZINC000548410966 516966195 /nfs/dbraw/zinc/96/61/95/516966195.db2.gz YHNYVAAYXRSUFC-CQSZACIVSA-N 1 1 363.805 2.538 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])C1 ZINC000552039270 517045206 /nfs/dbraw/zinc/04/52/06/517045206.db2.gz YYSNEEOLRXUCIC-HNNXBMFYSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])C1 ZINC000552039270 517045217 /nfs/dbraw/zinc/04/52/17/517045217.db2.gz YYSNEEOLRXUCIC-HNNXBMFYSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](n3cc(CO)nn3)C2)cc1[N+](=O)[O-] ZINC000552110255 517086528 /nfs/dbraw/zinc/08/65/28/517086528.db2.gz DGMIITYDKYVJBZ-MRXNPFEDSA-N 1 1 359.430 2.639 20 5 FFBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](n3cc(CO)nn3)C2)cc1[N+](=O)[O-] ZINC000552110255 517086536 /nfs/dbraw/zinc/08/65/36/517086536.db2.gz DGMIITYDKYVJBZ-MRXNPFEDSA-N 1 1 359.430 2.639 20 5 FFBDMO CCc1ccc([C@H]([NH2+]CCNc2cnccn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545514 517107187 /nfs/dbraw/zinc/10/71/87/517107187.db2.gz INRPGBKPUIMDNY-LJQANCHMSA-N 1 1 367.409 2.753 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000514910616 517117770 /nfs/dbraw/zinc/11/77/70/517117770.db2.gz YDEAEKOUHKNZGV-GOSISDBHSA-N 1 1 360.414 2.882 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000514910616 517117777 /nfs/dbraw/zinc/11/77/77/517117777.db2.gz YDEAEKOUHKNZGV-GOSISDBHSA-N 1 1 360.414 2.882 20 5 FFBDMO CCOc1ccccc1OCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000525783021 517165173 /nfs/dbraw/zinc/16/51/73/517165173.db2.gz TYPNILIOVKZXOB-UHFFFAOYSA-N 1 1 372.425 2.590 20 5 FFBDMO Cc1cccc(CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)n1 ZINC000552265404 517169140 /nfs/dbraw/zinc/16/91/40/517169140.db2.gz XGPOEIVNGPORAF-SFHVURJKSA-N 1 1 351.410 2.953 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+][C@H]1CCO[C@@H](C2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000552282316 517177561 /nfs/dbraw/zinc/17/75/61/517177561.db2.gz AFVRJWJZRFPKQA-CGTJXYLNSA-N 1 1 356.426 2.965 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccccc3OC3CC3)CC2)cn1 ZINC000519866351 517228601 /nfs/dbraw/zinc/22/86/01/517228601.db2.gz JPCBSKWUGXBXJH-UHFFFAOYSA-N 1 1 354.410 2.853 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1C ZINC000537618196 517261591 /nfs/dbraw/zinc/26/15/91/517261591.db2.gz PSLKXCJVJROUFU-ZFWWWQNUSA-N 1 1 351.447 2.917 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCc3ccc(O)cc3C2)cccc1[N+](=O)[O-] ZINC000533071967 517280144 /nfs/dbraw/zinc/28/01/44/517280144.db2.gz JAAFEXMHTYUUKN-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCCCNc1ccc(C)cc1[N+](=O)[O-])CC2 ZINC000515304700 517290361 /nfs/dbraw/zinc/29/03/61/517290361.db2.gz UGKXUIWICSWRBV-HNNXBMFYSA-N 1 1 371.441 2.589 20 5 FFBDMO O=C(Nc1cc(F)cc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000526934450 517394334 /nfs/dbraw/zinc/39/43/34/517394334.db2.gz GCXULNMRBAOIHM-AWEZNQCLSA-N 1 1 358.373 2.980 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)COCc1cccs1 ZINC000549156547 517429104 /nfs/dbraw/zinc/42/91/04/517429104.db2.gz HUAJNMXFQUTXNV-MRXNPFEDSA-N 1 1 350.440 2.708 20 5 FFBDMO C[N@@H+](CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC000546016261 517492323 /nfs/dbraw/zinc/49/23/23/517492323.db2.gz IVZNPYLRXXSUOQ-UHFFFAOYSA-N 1 1 374.485 2.898 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000542351055 517516112 /nfs/dbraw/zinc/51/61/12/517516112.db2.gz DDIFBZCRSLTWIW-NSHDSACASA-N 1 1 357.863 2.798 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000516035809 517544119 /nfs/dbraw/zinc/54/41/19/517544119.db2.gz SITYXXVWXYVNKO-AWEZNQCLSA-N 1 1 357.476 2.610 20 5 FFBDMO CCc1oc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C(=O)OC ZINC000549406751 517550137 /nfs/dbraw/zinc/55/01/37/517550137.db2.gz NYMUNWWUDOUXTK-LBPRGKRZSA-N 1 1 374.397 2.618 20 5 FFBDMO CCc1oc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1C(=O)OC ZINC000549406751 517550143 /nfs/dbraw/zinc/55/01/43/517550143.db2.gz NYMUNWWUDOUXTK-LBPRGKRZSA-N 1 1 374.397 2.618 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000542506329 517600858 /nfs/dbraw/zinc/60/08/58/517600858.db2.gz JFYOXRDUONKYMS-LDYMZIIASA-N 1 1 355.236 2.955 20 5 FFBDMO Cc1c(Br)c(N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000542506329 517600865 /nfs/dbraw/zinc/60/08/65/517600865.db2.gz JFYOXRDUONKYMS-LDYMZIIASA-N 1 1 355.236 2.955 20 5 FFBDMO CC(C)(C)[C@@H]1CCC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000527284011 517615528 /nfs/dbraw/zinc/61/55/28/517615528.db2.gz VFHQADJVHYJKGF-CZUORRHYSA-N 1 1 359.426 2.985 20 5 FFBDMO CCCN(CC[NH+]1CCCCC1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000553294258 517627632 /nfs/dbraw/zinc/62/76/32/517627632.db2.gz HWYMMLYMUVSNCF-UHFFFAOYSA-N 1 1 369.487 2.701 20 5 FFBDMO CCc1nn(C)c(N2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1[N+](=O)[O-] ZINC000553337504 517653264 /nfs/dbraw/zinc/65/32/64/517653264.db2.gz LOTLBPDULMQNOE-HXUWFJFHSA-N 1 1 369.469 2.993 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563178520 517715650 /nfs/dbraw/zinc/71/56/50/517715650.db2.gz WCHIKPROORVLTA-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000563178520 517715657 /nfs/dbraw/zinc/71/56/57/517715657.db2.gz WCHIKPROORVLTA-NSHDSACASA-N 1 1 356.220 2.524 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000546574520 517734421 /nfs/dbraw/zinc/73/44/21/517734421.db2.gz DBYFXGDBQGDNEK-UHFFFAOYSA-N 1 1 368.231 2.739 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccco1)C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000553494533 517745614 /nfs/dbraw/zinc/74/56/14/517745614.db2.gz HNSYCMLJZJJGNG-UHFFFAOYSA-N 1 1 360.414 2.851 20 5 FFBDMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920914 517846346 /nfs/dbraw/zinc/84/63/46/517846346.db2.gz ZPBUZUKKNPTTHY-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000538920914 517846358 /nfs/dbraw/zinc/84/63/58/517846358.db2.gz ZPBUZUKKNPTTHY-VHSXEESVSA-N 1 1 356.220 2.522 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000530553312 517847571 /nfs/dbraw/zinc/84/75/71/517847571.db2.gz HOJRBXZEUTVKRS-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000530553312 517847582 /nfs/dbraw/zinc/84/75/82/517847582.db2.gz HOJRBXZEUTVKRS-MRXNPFEDSA-N 1 1 371.393 2.879 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]CC1(CCO)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000560528538 517875359 /nfs/dbraw/zinc/87/53/59/517875359.db2.gz HNSXWSJKKAVXLV-QGZVFWFLSA-N 1 1 358.442 2.950 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)C1 ZINC000522107262 517987283 /nfs/dbraw/zinc/98/72/83/517987283.db2.gz WNLFRMNXXWYGDQ-OAHLLOKOSA-N 1 1 360.458 2.973 20 5 FFBDMO COc1ccc(NC(=O)NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000539380982 518017948 /nfs/dbraw/zinc/01/79/48/518017948.db2.gz ASTDULHVDXZPBS-GFCCVEGCSA-N 1 1 372.381 2.602 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000543504730 518121182 /nfs/dbraw/zinc/12/11/82/518121182.db2.gz LJBVTGGCASIXBG-GFCCVEGCSA-N 1 1 361.402 2.670 20 5 FFBDMO C[C@H]1[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000564003668 518265914 /nfs/dbraw/zinc/26/59/14/518265914.db2.gz UFEAVOLNFZVPMV-DOTOQJQBSA-N 1 1 369.421 2.753 20 5 FFBDMO CN1CCO[C@@H]2CC[N@@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@H]21 ZINC000581479436 518306341 /nfs/dbraw/zinc/30/63/41/518306341.db2.gz ADLHUQMYTHZCRW-IEBWSBKVSA-N 1 1 357.410 2.760 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000581775689 518449641 /nfs/dbraw/zinc/44/96/41/518449641.db2.gz YIRIGPYYWSEVPD-UHFFFAOYSA-N 1 1 365.433 2.928 20 5 FFBDMO COC(=O)c1ccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000584799336 518483787 /nfs/dbraw/zinc/48/37/87/518483787.db2.gz CQGCMTJSZRENDL-UHFFFAOYSA-N 1 1 370.365 2.665 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C[C@H]1C ZINC000585701120 518566350 /nfs/dbraw/zinc/56/63/50/518566350.db2.gz GJENLNDYZQSYIK-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc(Br)c2C)C[C@H]1C ZINC000585701120 518566351 /nfs/dbraw/zinc/56/63/51/518566351.db2.gz GJENLNDYZQSYIK-SNVBAGLBSA-N 1 1 370.247 2.832 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)[C@H]2C1 ZINC000585783655 518596226 /nfs/dbraw/zinc/59/62/26/518596226.db2.gz ZLUVLQCGSKGCCF-DLBZAZTESA-N 1 1 354.410 2.566 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000579276177 518602938 /nfs/dbraw/zinc/60/29/38/518602938.db2.gz GEGUFJCFNQAHCG-HNNXBMFYSA-N 1 1 367.764 2.649 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000570538894 518656438 /nfs/dbraw/zinc/65/64/38/518656438.db2.gz RWIQQWLOHTZNFL-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000570538894 518656441 /nfs/dbraw/zinc/65/64/41/518656441.db2.gz RWIQQWLOHTZNFL-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CN(C(=O)C[NH2+][C@@H](CO)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000582260601 518665735 /nfs/dbraw/zinc/66/57/35/518665735.db2.gz GRJDROPMRWDIRZ-INIZCTEOSA-N 1 1 363.801 2.534 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)NCC1CCCCC1 ZINC000582270599 518670092 /nfs/dbraw/zinc/67/00/92/518670092.db2.gz KNRFZVUEBWDKEP-UHFFFAOYSA-N 1 1 361.442 2.876 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)NCC1CCCCC1 ZINC000582270599 518670097 /nfs/dbraw/zinc/67/00/97/518670097.db2.gz KNRFZVUEBWDKEP-UHFFFAOYSA-N 1 1 361.442 2.876 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000567771054 518702505 /nfs/dbraw/zinc/70/25/05/518702505.db2.gz OCRJMEHEABPQPG-ZFWWWQNUSA-N 1 1 369.487 2.651 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCc3c[nH+]cn3C2)nc1-c1ccc(F)cc1 ZINC000588067692 518715138 /nfs/dbraw/zinc/71/51/38/518715138.db2.gz JMJWXVGCGKJHQZ-CQSZACIVSA-N 1 1 353.357 2.841 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1 ZINC000582807918 518933042 /nfs/dbraw/zinc/93/30/42/518933042.db2.gz MGJINXAHSZODNP-MEDUHNTESA-N 1 1 355.385 2.604 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[NH2+]Cc3ccccc32)cc1OC ZINC000577171757 518948886 /nfs/dbraw/zinc/94/88/86/518948886.db2.gz DEPQQFNBSZVXOZ-UHFFFAOYSA-N 1 1 371.393 2.752 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000589749313 519075257 /nfs/dbraw/zinc/07/52/57/519075257.db2.gz HEMUECHEISISIC-HXUWFJFHSA-N 1 1 356.422 3.000 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1(C)C ZINC000565709454 519092780 /nfs/dbraw/zinc/09/27/80/519092780.db2.gz VSFVZOFNMJGALB-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1(C)C ZINC000565709454 519092783 /nfs/dbraw/zinc/09/27/83/519092783.db2.gz VSFVZOFNMJGALB-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO Cc1cc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc(N2CCCC2)[nH+]1 ZINC000583175497 519112724 /nfs/dbraw/zinc/11/27/24/519112724.db2.gz QHRJJKPPAUFXRM-UHFFFAOYSA-N 1 1 358.373 2.968 20 5 FFBDMO C[C@H](Cc1cnc[nH]1)C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000565786048 519132995 /nfs/dbraw/zinc/13/29/95/519132995.db2.gz ZKELKHONACLVLI-SECBINFHSA-N 1 1 356.304 2.832 20 5 FFBDMO CC1(C)C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000577591023 519156427 /nfs/dbraw/zinc/15/64/27/519156427.db2.gz DNMPZTIBBYRFKU-CVEARBPZSA-N 1 1 352.456 2.879 20 5 FFBDMO CC1(C)C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000577591023 519156430 /nfs/dbraw/zinc/15/64/30/519156430.db2.gz DNMPZTIBBYRFKU-CVEARBPZSA-N 1 1 352.456 2.879 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000580466090 519190556 /nfs/dbraw/zinc/19/05/56/519190556.db2.gz KISDDIGRYMOYRC-AWEZNQCLSA-N 1 1 361.442 2.615 20 5 FFBDMO C[N@H+]1C[C@H]2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 ZINC000590446471 519235463 /nfs/dbraw/zinc/23/54/63/519235463.db2.gz VOBVPFYNTLEUHX-MFKMUULPSA-N 1 1 355.847 2.503 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[C@@H]4C[N@@H+](C)C[C@H]43)cc2[N+](=O)[O-])C1 ZINC000590447600 519235481 /nfs/dbraw/zinc/23/54/81/519235481.db2.gz ZLQTZWLYMKXIPQ-IDHHARJASA-N 1 1 372.469 2.607 20 5 FFBDMO CC(C)c1ccc(C(=O)N2CCOC[C@@H]2[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590566390 519268141 /nfs/dbraw/zinc/26/81/41/519268141.db2.gz ZRKUXBIHXYTAME-SJLPKXTDSA-N 1 1 361.442 2.653 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1 ZINC000590656889 519303790 /nfs/dbraw/zinc/30/37/90/519303790.db2.gz FSEXDIZUDBNOHP-NXHRZFHOSA-N 1 1 362.426 2.897 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1F ZINC000590685968 519315710 /nfs/dbraw/zinc/31/57/10/519315710.db2.gz MRABCTFAFULCAM-HNNXBMFYSA-N 1 1 359.357 2.659 20 5 FFBDMO COc1cc(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])cc1F ZINC000590685968 519315715 /nfs/dbraw/zinc/31/57/15/519315715.db2.gz MRABCTFAFULCAM-HNNXBMFYSA-N 1 1 359.357 2.659 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](C[C@@H]4CCCC[C@@H]4O)CC3)nc2c1 ZINC000577956281 519340756 /nfs/dbraw/zinc/34/07/56/519340756.db2.gz XOJBFEKOJQWGHE-KSSFIOAISA-N 1 1 373.457 2.534 20 5 FFBDMO Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC000580875734 519402269 /nfs/dbraw/zinc/40/22/69/519402269.db2.gz SULYIYMZOXMSRL-UHFFFAOYSA-N 1 1 358.446 2.701 20 5 FFBDMO CO[C@H](CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000569249014 519454498 /nfs/dbraw/zinc/45/44/98/519454498.db2.gz FXGIAPOCGGPFBA-KGLIPLIRSA-N 1 1 372.347 2.975 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2ccc([N+](=O)[O-])cn2)CCC1 ZINC000580993724 519465570 /nfs/dbraw/zinc/46/55/70/519465570.db2.gz FOOQNMFPDSJAHZ-UHFFFAOYSA-N 1 1 354.410 2.774 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000583867607 519475725 /nfs/dbraw/zinc/47/57/25/519475725.db2.gz VDDULTSQHAFPNE-SECBINFHSA-N 1 1 374.290 2.681 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC000575319371 519587076 /nfs/dbraw/zinc/58/70/76/519587076.db2.gz FAHPZVCIWBCMPS-AWEZNQCLSA-N 1 1 354.410 2.728 20 5 FFBDMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2c(C)noc2C)c([N+](=O)[O-])c1 ZINC000612461701 519972961 /nfs/dbraw/zinc/97/29/61/519972961.db2.gz PTLSUECHYOCVMC-JTQLQIEISA-N 1 1 362.386 2.888 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1C ZINC000594484040 519992126 /nfs/dbraw/zinc/99/21/26/519992126.db2.gz QERPHDQMDQERJK-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO COc1cccc2c1OCC[C@H]2[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000594520683 520013952 /nfs/dbraw/zinc/01/39/52/520013952.db2.gz AWPGWTBBPTWZJZ-CQSZACIVSA-N 1 1 372.377 2.988 20 5 FFBDMO COc1ccc(-c2ccc(C[NH2+]C[C@@H](O)C(F)(F)F)o2)c([N+](=O)[O-])c1 ZINC000616487268 520036969 /nfs/dbraw/zinc/03/69/69/520036969.db2.gz JQQDRGQBMYCDKW-CQSZACIVSA-N 1 1 360.288 2.876 20 5 FFBDMO C[C@]1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)CCCS1 ZINC000600111800 520053962 /nfs/dbraw/zinc/05/39/62/520053962.db2.gz FSCGFLBYYKWAGE-OAHLLOKOSA-N 1 1 355.485 2.700 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c(C)cc1[N+](=O)[O-] ZINC000594787691 520158702 /nfs/dbraw/zinc/15/87/02/520158702.db2.gz CDPHQBBYBHOESV-CQSZACIVSA-N 1 1 369.487 2.610 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@@H]2CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000600298135 520188343 /nfs/dbraw/zinc/18/83/43/520188343.db2.gz GVNAZJSJWZYVMS-OAHLLOKOSA-N 1 1 373.384 2.747 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@@H]2CNC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000600298135 520188351 /nfs/dbraw/zinc/18/83/51/520188351.db2.gz GVNAZJSJWZYVMS-OAHLLOKOSA-N 1 1 373.384 2.747 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)C2 ZINC000597711916 520192126 /nfs/dbraw/zinc/19/21/26/520192126.db2.gz XMOFMDGRZANGEL-KRWDZBQOSA-N 1 1 369.368 2.754 20 5 FFBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000592154451 520231846 /nfs/dbraw/zinc/23/18/46/520231846.db2.gz RQJULCSYXGEFBE-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000592154451 520231855 /nfs/dbraw/zinc/23/18/55/520231855.db2.gz RQJULCSYXGEFBE-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO CC(C)N(CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000592154451 520231859 /nfs/dbraw/zinc/23/18/59/520231859.db2.gz RQJULCSYXGEFBE-GOSISDBHSA-N 1 1 357.458 2.776 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](CCO)c1ccccc1F ZINC000592162352 520236820 /nfs/dbraw/zinc/23/68/20/520236820.db2.gz XRLMIEYITBNRPF-OAHLLOKOSA-N 1 1 361.373 2.694 20 5 FFBDMO CCO[C@@H]1C[C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1SC ZINC000592168207 520241818 /nfs/dbraw/zinc/24/18/18/520241818.db2.gz GWXCEVKMUYXBQI-NFAWXSAZSA-N 1 1 364.427 2.643 20 5 FFBDMO C[C@@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000603399553 520248371 /nfs/dbraw/zinc/24/83/71/520248371.db2.gz CFJUYGBSCBMMCP-GFCCVEGCSA-N 1 1 371.384 2.886 20 5 FFBDMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000592183116 520250097 /nfs/dbraw/zinc/25/00/97/520250097.db2.gz CYFWGPRXDQOUMT-IAQYHMDHSA-N 1 1 359.348 2.965 20 5 FFBDMO O=C(C[N@@H+]1CCCc2sccc2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000609322740 520277101 /nfs/dbraw/zinc/27/71/01/520277101.db2.gz JPTJSWZOGRSCQU-UHFFFAOYSA-N 1 1 357.435 2.994 20 5 FFBDMO O=C(C[N@H+]1CCCc2sccc2C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000609322740 520277109 /nfs/dbraw/zinc/27/71/09/520277109.db2.gz JPTJSWZOGRSCQU-UHFFFAOYSA-N 1 1 357.435 2.994 20 5 FFBDMO Cc1cc(NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc(C)[nH+]1 ZINC000603490159 520280698 /nfs/dbraw/zinc/28/06/98/520280698.db2.gz IKGWEARKARKZKV-UHFFFAOYSA-N 1 1 355.320 2.966 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000597922685 520324264 /nfs/dbraw/zinc/32/42/64/520324264.db2.gz KVKHNSIHLGBGKR-JTQLQIEISA-N 1 1 370.247 2.960 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597922680 520324404 /nfs/dbraw/zinc/32/44/04/520324404.db2.gz KPVMRDWWAAAJRN-SNVBAGLBSA-N 1 1 357.357 2.799 20 5 FFBDMO CCN(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597945577 520344083 /nfs/dbraw/zinc/34/40/83/520344083.db2.gz ITDLLUNPUSVAKO-AAEUAGOBSA-N 1 1 355.822 2.568 20 5 FFBDMO C[N@H+]1CCCC[C@H]1C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609546638 520353201 /nfs/dbraw/zinc/35/32/01/520353201.db2.gz GPLPPBLIXZTAFC-ZDUSSCGKSA-N 1 1 374.363 2.626 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1cccs1 ZINC000609577949 520364199 /nfs/dbraw/zinc/36/41/99/520364199.db2.gz HHXQHXZCBYYVGP-UHFFFAOYSA-N 1 1 363.439 2.673 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCN(c3ccccc3)CC2)c1 ZINC000603844639 520374763 /nfs/dbraw/zinc/37/47/63/520374763.db2.gz WFKGBVQTTWDKGO-IBGZPJMESA-N 1 1 371.437 2.547 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294923 520392720 /nfs/dbraw/zinc/39/27/20/520392720.db2.gz UPZMZDSDCGQORJ-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294923 520392731 /nfs/dbraw/zinc/39/27/31/520392731.db2.gz UPZMZDSDCGQORJ-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000595294923 520392734 /nfs/dbraw/zinc/39/27/34/520392734.db2.gz UPZMZDSDCGQORJ-VBQJREDUSA-N 1 1 351.422 2.808 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592492828 520415441 /nfs/dbraw/zinc/41/54/41/520415441.db2.gz DJZLNBOLVZQACJ-PMPSAXMXSA-N 1 1 360.458 2.633 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCOc2ccccc2C1 ZINC000609766488 520425450 /nfs/dbraw/zinc/42/54/50/520425450.db2.gz VPJFMAPGQLBSRG-UHFFFAOYSA-N 1 1 369.377 2.787 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCOc2ccccc2C1 ZINC000609766488 520425459 /nfs/dbraw/zinc/42/54/59/520425459.db2.gz VPJFMAPGQLBSRG-UHFFFAOYSA-N 1 1 369.377 2.787 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC000617353047 520449994 /nfs/dbraw/zinc/44/99/94/520449994.db2.gz MYHLSYZSOBWGQL-KRWDZBQOSA-N 1 1 369.421 2.950 20 5 FFBDMO C[C@H]1C[NH+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2)C[C@H](C)O1 ZINC000609974878 520494833 /nfs/dbraw/zinc/49/48/33/520494833.db2.gz CFKMHINDMPAFIG-KBPBESRZSA-N 1 1 372.425 2.795 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000595522807 520527388 /nfs/dbraw/zinc/52/73/88/520527388.db2.gz OGSXXVMIRQYRFO-SFHVURJKSA-N 1 1 368.437 2.711 20 5 FFBDMO CCc1[nH+]ccn1[C@@H](C)CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000592745580 520555060 /nfs/dbraw/zinc/55/50/60/520555060.db2.gz APRAZROBNGKVOX-HNNXBMFYSA-N 1 1 371.441 2.654 20 5 FFBDMO O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595572625 520562309 /nfs/dbraw/zinc/56/23/09/520562309.db2.gz FUISRAWVLCYVME-INIZCTEOSA-N 1 1 360.458 2.844 20 5 FFBDMO Cn1ccnc1C(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000604473158 520571515 /nfs/dbraw/zinc/57/15/15/520571515.db2.gz ONDMLVHQYFYVCL-HUUCEWRRSA-N 1 1 369.425 2.598 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1 ZINC000610197836 520574625 /nfs/dbraw/zinc/57/46/25/520574625.db2.gz ANNYGBSWXJOTBI-CQSZACIVSA-N 1 1 365.430 2.606 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc([N+](=O)[O-])cn1C ZINC000610310603 520630976 /nfs/dbraw/zinc/63/09/76/520630976.db2.gz KTIMYSWOZQLUBT-MRXNPFEDSA-N 1 1 356.426 2.527 20 5 FFBDMO CCO[C@H]1C[C@H](O)C12CCN(c1cc[nH+]c3ccc([N+](=O)[O-])cc31)CC2 ZINC000601119433 520645198 /nfs/dbraw/zinc/64/51/98/520645198.db2.gz RRMYESFWHOPERH-ROUUACIJSA-N 1 1 357.410 2.899 20 5 FFBDMO CCCC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H](C)c1ccc(C)o1 ZINC000610368244 520653617 /nfs/dbraw/zinc/65/36/17/520653617.db2.gz PYDQZVDCNOYKHN-GOEBONIOSA-N 1 1 350.419 2.917 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@@H+]2Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000598508854 520668388 /nfs/dbraw/zinc/66/83/88/520668388.db2.gz IPFHKTAJFZMKLZ-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO COc1cc(C(=O)NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc([N+](=O)[O-])c1C ZINC000598508854 520668397 /nfs/dbraw/zinc/66/83/97/520668397.db2.gz IPFHKTAJFZMKLZ-KRWDZBQOSA-N 1 1 369.421 2.916 20 5 FFBDMO C[C@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+](C2CCC2)C1 ZINC000601167846 520671221 /nfs/dbraw/zinc/67/12/21/520671221.db2.gz GPPQLOCTCSSQOV-SNVBAGLBSA-N 1 1 361.368 2.658 20 5 FFBDMO COc1cc(C[NH+]2C[C@@H](C)C(O)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595749848 520697659 /nfs/dbraw/zinc/69/76/59/520697659.db2.gz MACWTIKKFAIEKO-NXEZZACHSA-N 1 1 360.357 2.654 20 5 FFBDMO COC(=O)c1ccnc(N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000598589287 520729531 /nfs/dbraw/zinc/72/95/31/520729531.db2.gz HQCRZAVVTBZFKD-MJBXVCDLSA-N 1 1 362.430 2.618 20 5 FFBDMO COC(=O)c1ccnc(N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000598589926 520730110 /nfs/dbraw/zinc/73/01/10/520730110.db2.gz VQQZAWLRSGNCNR-XQQFMLRXSA-N 1 1 350.419 2.555 20 5 FFBDMO C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593088513 520734816 /nfs/dbraw/zinc/73/48/16/520734816.db2.gz FYYVUUUFBKWYCT-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593088513 520734823 /nfs/dbraw/zinc/73/48/23/520734823.db2.gz FYYVUUUFBKWYCT-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CN1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](Cc2ccccc2)C1 ZINC000593088513 520734829 /nfs/dbraw/zinc/73/48/29/520734829.db2.gz FYYVUUUFBKWYCT-LJQANCHMSA-N 1 1 355.438 2.832 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2F)C[C@@H]1C ZINC000601355136 520751835 /nfs/dbraw/zinc/75/18/35/520751835.db2.gz KNLQFJJKOPTKFR-STQMWFEESA-N 1 1 373.450 2.536 20 5 FFBDMO O=C(N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601537542 520832075 /nfs/dbraw/zinc/83/20/75/520832075.db2.gz FOCMONVYCUGQFX-SJORKVTESA-N 1 1 361.417 2.661 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000601540287 520832422 /nfs/dbraw/zinc/83/24/22/520832422.db2.gz GYBKZUZGQYBSKD-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000601581386 520850188 /nfs/dbraw/zinc/85/01/88/520850188.db2.gz HSLDGRALFZSJDJ-UHFFFAOYSA-N 1 1 360.389 2.723 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3ccc([N+](=O)[O-])s3)CC2)c1 ZINC000610808781 520852591 /nfs/dbraw/zinc/85/25/91/520852591.db2.gz LKLXBQDAZZDYSC-UHFFFAOYSA-N 1 1 363.439 2.866 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C(C)(C)C(=O)Nc1ccccc1 ZINC000610844558 520867185 /nfs/dbraw/zinc/86/71/85/520867185.db2.gz XXLFOGQITOXCJZ-UHFFFAOYSA-N 1 1 370.409 2.849 20 5 FFBDMO C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)CCOC(C)(C)C ZINC000610859908 520877324 /nfs/dbraw/zinc/87/73/24/520877324.db2.gz UMPJIEFKMJRADD-UHFFFAOYSA-N 1 1 351.403 2.640 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593322019 520908325 /nfs/dbraw/zinc/90/83/25/520908325.db2.gz KUJKJWVWNLECSA-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000593322019 520908332 /nfs/dbraw/zinc/90/83/32/520908332.db2.gz KUJKJWVWNLECSA-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](Cc2ccccc2)C1 ZINC000593323584 520909616 /nfs/dbraw/zinc/90/96/16/520909616.db2.gz QKYMEIRSZGTGNC-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H](Cc2ccccc2)C1 ZINC000593323584 520909621 /nfs/dbraw/zinc/90/96/21/520909621.db2.gz QKYMEIRSZGTGNC-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@H+](C)[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596204322 520970394 /nfs/dbraw/zinc/97/03/94/520970394.db2.gz CHXXSKDCBOVWKM-CYBMUJFWSA-N 1 1 355.822 2.811 20 5 FFBDMO COC(=O)c1c(Cl)c(N2CC[N@@H+](C)[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596204322 520970405 /nfs/dbraw/zinc/97/04/05/520970405.db2.gz CHXXSKDCBOVWKM-CYBMUJFWSA-N 1 1 355.822 2.811 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000611087444 520976499 /nfs/dbraw/zinc/97/64/99/520976499.db2.gz HGXJAYQJLRIWEA-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000611087444 520976507 /nfs/dbraw/zinc/97/65/07/520976507.db2.gz HGXJAYQJLRIWEA-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1cc(CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)cc(N2CCCC2)[nH+]1 ZINC000596238123 520988684 /nfs/dbraw/zinc/98/86/84/520988684.db2.gz JDUXBMDZNSWCAR-UHFFFAOYSA-N 1 1 355.398 2.609 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596266055 521000593 /nfs/dbraw/zinc/00/05/93/521000593.db2.gz MZBGJTGFCUUMJY-NSHDSACASA-N 1 1 355.822 2.954 20 5 FFBDMO COC(=O)c1c(Cl)c(N(C)[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000596266053 521000695 /nfs/dbraw/zinc/00/06/95/521000695.db2.gz MZBGJTGFCUUMJY-LLVKDONJSA-N 1 1 355.822 2.954 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000601969705 521048450 /nfs/dbraw/zinc/04/84/50/521048450.db2.gz DWMAOAGNFYAJKZ-RDJZCZTQSA-N 1 1 352.337 2.774 20 5 FFBDMO CC(C)c1ccc(CN2CCN([C@@H]3CCC[N@@H+](C)C3)CC2)cc1[N+](=O)[O-] ZINC000611270998 521070498 /nfs/dbraw/zinc/07/04/98/521070498.db2.gz YYBHFCAGPFLOJH-GOSISDBHSA-N 1 1 360.502 2.930 20 5 FFBDMO Cn1nc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000611272526 521070906 /nfs/dbraw/zinc/07/09/06/521070906.db2.gz ZMCHGACPDCTNPH-ZDUSSCGKSA-N 1 1 352.398 2.563 20 5 FFBDMO Cn1nc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000611272526 521070917 /nfs/dbraw/zinc/07/09/17/521070917.db2.gz ZMCHGACPDCTNPH-ZDUSSCGKSA-N 1 1 352.398 2.563 20 5 FFBDMO C[N@@H+](CCN1CCN(c2sccc2[N+](=O)[O-])CC1)Cc1ccccc1 ZINC000611413255 521143661 /nfs/dbraw/zinc/14/36/61/521143661.db2.gz ZDMGFGJABRPXJB-UHFFFAOYSA-N 1 1 360.483 2.910 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000599391706 521193005 /nfs/dbraw/zinc/19/30/05/521193005.db2.gz QLYKBTLAIQAZMQ-OAHLLOKOSA-N 1 1 367.471 2.589 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000611578666 521231930 /nfs/dbraw/zinc/23/19/30/521231930.db2.gz QXULITQCXLQXFH-CYBMUJFWSA-N 1 1 357.357 2.935 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1C ZINC000599464245 521240746 /nfs/dbraw/zinc/24/07/46/521240746.db2.gz KRSUZHRUQGFWQH-OAHLLOKOSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c(C)c1[N+](=O)[O-] ZINC000599464169 521240987 /nfs/dbraw/zinc/24/09/87/521240987.db2.gz JQPMYYDJDXKWRE-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO COCCC1CC[NH+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000599506758 521266733 /nfs/dbraw/zinc/26/67/33/521266733.db2.gz HFBFIKOHGOMVTA-CYBMUJFWSA-N 1 1 365.430 2.679 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCc3noc4ccccc34)C2)nc1 ZINC000593966976 521320557 /nfs/dbraw/zinc/32/05/57/521320557.db2.gz XCJOUNATJHMSTD-ZDUSSCGKSA-N 1 1 353.382 2.860 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCc3noc4ccccc34)C2)nc1 ZINC000593966975 521320610 /nfs/dbraw/zinc/32/06/10/521320610.db2.gz XCJOUNATJHMSTD-CYBMUJFWSA-N 1 1 353.382 2.860 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2c(O)cccc2C1 ZINC000599647460 521355870 /nfs/dbraw/zinc/35/58/70/521355870.db2.gz OYWFPCDALUQIGC-UHFFFAOYSA-N 1 1 355.394 2.996 20 5 FFBDMO COC(=O)[C@](C)(NCCCCn1cc[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000599652929 521363272 /nfs/dbraw/zinc/36/32/72/521363272.db2.gz OAZFWKWGYXGXEV-GOSISDBHSA-N 1 1 360.414 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000594199237 521465419 /nfs/dbraw/zinc/46/54/19/521465419.db2.gz IGRAZEJQHLSKPD-ZWKOTPCHSA-N 1 1 369.425 2.527 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000599831169 521499056 /nfs/dbraw/zinc/49/90/56/521499056.db2.gz OXRQKZZJQGANMF-NVXWUHKLSA-N 1 1 355.398 2.891 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O ZINC000602825094 521554533 /nfs/dbraw/zinc/55/45/33/521554533.db2.gz JPMFTPOWCIFNDX-LLLHUVSDSA-N 1 1 350.463 2.751 20 5 FFBDMO COc1c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000619440573 521568184 /nfs/dbraw/zinc/56/81/84/521568184.db2.gz HPWOAFFYUJKXSC-BBRMVZONSA-N 1 1 359.426 2.692 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597232089 521587189 /nfs/dbraw/zinc/58/71/89/521587189.db2.gz PJXUXYCZAZQBNM-LBPRGKRZSA-N 1 1 371.384 2.933 20 5 FFBDMO CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000597232089 521587195 /nfs/dbraw/zinc/58/71/95/521587195.db2.gz PJXUXYCZAZQBNM-LBPRGKRZSA-N 1 1 371.384 2.933 20 5 FFBDMO Nc1cc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc(CO)c1[N+](=O)[O-] ZINC000619570346 521775094 /nfs/dbraw/zinc/77/50/94/521775094.db2.gz VIKQWKYBQVENMO-INIZCTEOSA-N 1 1 356.426 2.746 20 5 FFBDMO COc1ccc(-c2ccc(C[N@@H+]3CC[C@](F)(CO)C3)o2)c([N+](=O)[O-])c1 ZINC000619846848 521902310 /nfs/dbraw/zinc/90/23/10/521902310.db2.gz ANVFAIJMICNRPT-QGZVFWFLSA-N 1 1 350.346 2.770 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@](F)(CO)C3)o2)c([N+](=O)[O-])c1 ZINC000619846848 521902321 /nfs/dbraw/zinc/90/23/21/521902321.db2.gz ANVFAIJMICNRPT-QGZVFWFLSA-N 1 1 350.346 2.770 20 5 FFBDMO CC(C)[C@H](CNc1nc2ccccc2cc1[N+](=O)[O-])N1CC[NH+](C)CC1 ZINC000473512899 561051624 /nfs/dbraw/zinc/05/16/24/561051624.db2.gz JLGTUKYYRPFGHN-SFHVURJKSA-N 1 1 357.458 2.827 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000824656553 609314512 /nfs/dbraw/zinc/31/45/12/609314512.db2.gz LPPUMYCNBDWLQN-OLZOCXBDSA-N 1 1 371.445 2.840 20 5 FFBDMO Cc1ncc([N+](=O)[O-])c(N2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC001164626793 719073962 /nfs/dbraw/zinc/07/39/62/719073962.db2.gz PIORDQWIKYETBD-WMZOPIPTSA-N 1 1 353.426 2.794 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N1CCC[C@@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994018 722207055 /nfs/dbraw/zinc/20/70/55/722207055.db2.gz CRPDLWXCYDVQCO-LJQANCHMSA-N 1 1 371.416 2.956 20 5 FFBDMO Nc1cc([N+](=O)[O-])cnc1N1CCC[C@]2(CC[N@H+]2Cc2cccc(F)c2)C1 ZINC001164994017 722207133 /nfs/dbraw/zinc/20/71/33/722207133.db2.gz CRPDLWXCYDVQCO-IBGZPJMESA-N 1 1 371.416 2.956 20 5 FFBDMO CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000154001839 728793806 /nfs/dbraw/zinc/79/38/06/728793806.db2.gz HLFOPNZURPUIFM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000154001839 728793808 /nfs/dbraw/zinc/79/38/08/728793808.db2.gz HLFOPNZURPUIFM-AWEZNQCLSA-N 1 1 370.247 2.770 20 5 FFBDMO CCOC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000113939767 728558487 /nfs/dbraw/zinc/55/84/87/728558487.db2.gz YCBBGHKORCPRSM-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000113939767 728558490 /nfs/dbraw/zinc/55/84/90/728558490.db2.gz YCBBGHKORCPRSM-LBPRGKRZSA-N 1 1 355.822 2.935 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000119466195 728594798 /nfs/dbraw/zinc/59/47/98/728594798.db2.gz PHKWWQCEFUBRBM-UHFFFAOYSA-N 1 1 361.489 2.589 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174853031 729081613 /nfs/dbraw/zinc/08/16/13/729081613.db2.gz FZLZQYAIMGTUDS-KRWDZBQOSA-N 1 1 366.893 2.850 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[C@H](C[N@@H+](C)CC)C1 ZINC000177546266 729138727 /nfs/dbraw/zinc/13/87/27/729138727.db2.gz NDHVBEPCPBPXSE-GFCCVEGCSA-N 1 1 353.394 2.689 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000245431400 729570009 /nfs/dbraw/zinc/57/00/09/729570009.db2.gz ASEBSZALYGYAPA-CHWSQXEVSA-N 1 1 368.865 2.849 20 5 FFBDMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1Br ZINC000760822257 736671054 /nfs/dbraw/zinc/67/10/54/736671054.db2.gz VXESFDJJGBHJTI-NSHDSACASA-N 1 1 368.231 2.571 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccns1 ZINC000860055396 730474561 /nfs/dbraw/zinc/47/45/61/730474561.db2.gz XSPXYMDNIMAOFD-ZJUUUORDSA-N 1 1 350.400 2.738 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1COC(=O)c1cccc(SC)c1[N+](=O)[O-] ZINC000861036776 730569729 /nfs/dbraw/zinc/56/97/29/730569729.db2.gz ROARVWRYHRLASE-LBPRGKRZSA-N 1 1 354.428 2.584 20 5 FFBDMO NC(CCC(F)(F)F)=[NH+]O[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863489190 730785737 /nfs/dbraw/zinc/78/57/37/730785737.db2.gz BACUSJVKEMNFLB-LLVKDONJSA-N 1 1 360.292 2.541 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)N1CCN(C)CC1 ZINC000872021174 731721379 /nfs/dbraw/zinc/72/13/79/731721379.db2.gz NVJYADBRRIXSQP-CQSZACIVSA-N 1 1 366.531 2.993 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](CO)[C@H](CO)C3)o2)c(Cl)c1 ZINC000877764740 732424996 /nfs/dbraw/zinc/42/49/96/732424996.db2.gz NMWMROLJPGQAOJ-TXEJJXNPSA-N 1 1 366.801 2.541 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000879560711 732723077 /nfs/dbraw/zinc/72/30/77/732723077.db2.gz IFHZXQDTTFTUMD-CHWSQXEVSA-N 1 1 365.455 2.617 20 5 FFBDMO O=C(C[NH2+][C@@H](CO)c1cccc(F)c1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782060840 738684649 /nfs/dbraw/zinc/68/46/49/738684649.db2.gz GYTGKNDFLIKEML-AWEZNQCLSA-N 1 1 367.764 2.649 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095505 738821630 /nfs/dbraw/zinc/82/16/30/738821630.db2.gz KFHMFSBRIOOVSM-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000928095505 738821633 /nfs/dbraw/zinc/82/16/33/738821633.db2.gz KFHMFSBRIOOVSM-JSGCOSHPSA-N 1 1 355.847 2.558 20 5 FFBDMO CCc1[nH]nc(Cl)c1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078063 734512448 /nfs/dbraw/zinc/51/24/48/734512448.db2.gz FQWDAXANFFKXBJ-JTQLQIEISA-N 1 1 350.810 2.615 20 5 FFBDMO CCc1[nH]nc(Cl)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000892078063 734512452 /nfs/dbraw/zinc/51/24/52/734512452.db2.gz FQWDAXANFFKXBJ-JTQLQIEISA-N 1 1 350.810 2.615 20 5 FFBDMO COc1c(O)ccc(C[NH+]2CCC(OC)(C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000894951000 734942195 /nfs/dbraw/zinc/94/21/95/734942195.db2.gz GQEHTLSJUARSOW-UHFFFAOYSA-N 1 1 364.320 2.852 20 5 FFBDMO O=[N+]([O-])c1cc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)ccc1C(F)(F)F ZINC000897221082 735208121 /nfs/dbraw/zinc/20/81/21/735208121.db2.gz GZOLSJIETOVTFN-KGLIPLIRSA-N 1 1 359.348 2.649 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252896 735779015 /nfs/dbraw/zinc/77/90/15/735779015.db2.gz PKUKKXYVGVXWNF-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000750252896 735779017 /nfs/dbraw/zinc/77/90/17/735779017.db2.gz PKUKKXYVGVXWNF-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO Cn1cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c(Br)n1 ZINC000903187865 736051718 /nfs/dbraw/zinc/05/17/18/736051718.db2.gz JAJKPLNPRUQIJG-LBPRGKRZSA-N 1 1 351.204 2.868 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@H](C4OCCO4)C3)c2c1 ZINC000905693056 736383521 /nfs/dbraw/zinc/38/35/21/736383521.db2.gz GXTOUYDSQAYORW-JTQLQIEISA-N 1 1 351.384 2.524 20 5 FFBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@H](C4OCCO4)C3)c2c1 ZINC000905693056 736383525 /nfs/dbraw/zinc/38/35/25/736383525.db2.gz GXTOUYDSQAYORW-JTQLQIEISA-N 1 1 351.384 2.524 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906790861 736544079 /nfs/dbraw/zinc/54/40/79/736544079.db2.gz JTAALZSLRNHMLW-MLGOLLRUSA-N 1 1 353.850 2.979 20 5 FFBDMO COC(=O)C1=C(C)O[C@H](C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000759855120 736599424 /nfs/dbraw/zinc/59/94/24/736599424.db2.gz MPEGTWLVDVVZRI-ZDUSSCGKSA-N 1 1 354.790 2.916 20 5 FFBDMO COC(=O)C1=C(C)O[C@H](C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000759855120 736599426 /nfs/dbraw/zinc/59/94/26/736599426.db2.gz MPEGTWLVDVVZRI-ZDUSSCGKSA-N 1 1 354.790 2.916 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000763977325 736983199 /nfs/dbraw/zinc/98/31/99/736983199.db2.gz IANQIAVNAKHSMS-PBHICJAKSA-N 1 1 350.415 2.598 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769188033 737505085 /nfs/dbraw/zinc/50/50/85/737505085.db2.gz DZFQSYQWVRTCKK-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000769188033 737505090 /nfs/dbraw/zinc/50/50/90/737505090.db2.gz DZFQSYQWVRTCKK-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO O=[N+]([O-])c1cc2cnn(C[N@H+]3CC[C@H]([C@H]4CCOC4)C3)c2c(Cl)c1 ZINC000774637577 738008474 /nfs/dbraw/zinc/00/84/74/738008474.db2.gz BZFOMPMQEGUACJ-RYUDHWBXSA-N 1 1 350.806 2.914 20 5 FFBDMO CC[N@@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@H]1C(C)C ZINC000922394542 738136789 /nfs/dbraw/zinc/13/67/89/738136789.db2.gz XBJASLBKKKGERX-SRABZTEZSA-N 1 1 353.488 2.616 20 5 FFBDMO CC[N@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3csc([N+](=O)[O-])c3)C2)[C@H]1C(C)C ZINC000922394542 738136792 /nfs/dbraw/zinc/13/67/92/738136792.db2.gz XBJASLBKKKGERX-SRABZTEZSA-N 1 1 353.488 2.616 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000778262332 738367677 /nfs/dbraw/zinc/36/76/77/738367677.db2.gz UCUJKVILNFPAPX-PHIMTYICSA-N 1 1 363.443 2.592 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1CC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000785726331 738991177 /nfs/dbraw/zinc/99/11/77/738991177.db2.gz CKUBAVHBKMVGNZ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000785726331 738991180 /nfs/dbraw/zinc/99/11/80/738991180.db2.gz CKUBAVHBKMVGNZ-PHIMTYICSA-N 1 1 369.805 2.603 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000930346235 739091158 /nfs/dbraw/zinc/09/11/58/739091158.db2.gz ZUTLPJGWATVBQJ-UHFFFAOYSA-N 1 1 350.806 2.892 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000931125261 739215571 /nfs/dbraw/zinc/21/55/71/739215571.db2.gz YRSRGHRXUKPSFZ-UHFFFAOYSA-N 1 1 351.422 2.999 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CCc1c(Cl)cccc1[N+](=O)[O-] ZINC000934576254 739808677 /nfs/dbraw/zinc/80/86/77/739808677.db2.gz MDKZAALLJLVTHY-NHYWBVRUSA-N 1 1 351.834 2.780 20 5 FFBDMO CN(C)[S@](C)(=O)=NCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000934752311 739832577 /nfs/dbraw/zinc/83/25/77/739832577.db2.gz NWVHKTHKVNSEIL-RUZDIDTESA-N 1 1 372.466 2.520 20 5 FFBDMO O=C(C[N@@H+]1CCOC[C@@H](C2CCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000795288223 739997446 /nfs/dbraw/zinc/99/74/46/739997446.db2.gz HSBMFVYQRASZCD-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO O=C(C[N@H+]1CCOC[C@@H](C2CCC2)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000795288223 739997451 /nfs/dbraw/zinc/99/74/51/739997451.db2.gz HSBMFVYQRASZCD-ZDUSSCGKSA-N 1 1 367.833 2.935 20 5 FFBDMO CC(C)c1ccc(C(=O)OC[C@@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-] ZINC000802136360 740676486 /nfs/dbraw/zinc/67/64/86/740676486.db2.gz GPXQITUZEBZBED-HNNXBMFYSA-N 1 1 350.415 2.984 20 5 FFBDMO CCOc1cc(C[N@@H+]2CCCC[C@@H]2COC(=O)NC)ccc1[N+](=O)[O-] ZINC000805826040 741015316 /nfs/dbraw/zinc/01/53/16/741015316.db2.gz NQUBOIKEUMRUTA-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2COC(=O)NC)ccc1[N+](=O)[O-] ZINC000805826040 741015317 /nfs/dbraw/zinc/01/53/17/741015317.db2.gz NQUBOIKEUMRUTA-CQSZACIVSA-N 1 1 351.403 2.704 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC000985430964 741395170 /nfs/dbraw/zinc/39/51/70/741395170.db2.gz KHCZTKHGRZFJRF-IAGOWNOFSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430964 741395176 /nfs/dbraw/zinc/39/51/76/741395176.db2.gz KHCZTKHGRZFJRF-IAGOWNOFSA-N 1 1 365.861 2.736 20 5 FFBDMO Cc1cc(Cl)ccc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC000985430964 741395182 /nfs/dbraw/zinc/39/51/82/741395182.db2.gz KHCZTKHGRZFJRF-IAGOWNOFSA-N 1 1 365.861 2.736 20 5 FFBDMO CC(C)[C@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000815315358 741924387 /nfs/dbraw/zinc/92/43/87/741924387.db2.gz CDNQEAHYHBYXQQ-OAHLLOKOSA-N 1 1 355.822 2.934 20 5 FFBDMO CC(C)[C@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CCCO1 ZINC000815315358 741924390 /nfs/dbraw/zinc/92/43/90/741924390.db2.gz CDNQEAHYHBYXQQ-OAHLLOKOSA-N 1 1 355.822 2.934 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000817125691 742089875 /nfs/dbraw/zinc/08/98/75/742089875.db2.gz UKYZGZBKIDNLBI-UHFFFAOYSA-N 1 1 350.438 2.730 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(c3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000817125691 742089879 /nfs/dbraw/zinc/08/98/79/742089879.db2.gz UKYZGZBKIDNLBI-UHFFFAOYSA-N 1 1 350.438 2.730 20 5 FFBDMO C[C@@H]1CC2(CN1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000818340938 742265105 /nfs/dbraw/zinc/26/51/05/742265105.db2.gz SSDSKMAZBYPKSC-GFCCVEGCSA-N 1 1 366.849 2.651 20 5 FFBDMO C[N@H+](Cc1ccccc1)C[C@@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl ZINC000819151005 742343979 /nfs/dbraw/zinc/34/39/79/742343979.db2.gz VHEOTJGVJULXLM-KRWDZBQOSA-N 1 1 363.845 2.831 20 5 FFBDMO O=C(N[C@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001034643926 742928358 /nfs/dbraw/zinc/92/83/58/742928358.db2.gz VDRDNCZAFNEFLA-IXYNUQLISA-N 1 1 369.824 2.661 20 5 FFBDMO CCN(C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](CC)C1 ZINC000825018076 743195120 /nfs/dbraw/zinc/19/51/20/743195120.db2.gz GHDIYZMAAQJTFV-SECBINFHSA-N 1 1 358.801 2.526 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccccc2Cl)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050325763 743511340 /nfs/dbraw/zinc/51/13/40/743511340.db2.gz MDVSPBDYUOOLLL-DNNBLBMLSA-N 1 1 365.861 2.770 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000830019984 745295370 /nfs/dbraw/zinc/29/53/70/745295370.db2.gz AEFLQVVWDGXYRQ-KGLIPLIRSA-N 1 1 367.496 2.626 20 5 FFBDMO CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000830019984 745295372 /nfs/dbraw/zinc/29/53/72/745295372.db2.gz AEFLQVVWDGXYRQ-KGLIPLIRSA-N 1 1 367.496 2.626 20 5 FFBDMO CON1CCC([N@H+](C)Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000835076818 745946080 /nfs/dbraw/zinc/94/60/80/745946080.db2.gz WCWRLCXXRDWXTQ-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000835076818 745946082 /nfs/dbraw/zinc/94/60/82/745946082.db2.gz WCWRLCXXRDWXTQ-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO C[N@H+]1CCC[C@@H](CCNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000838513046 746655495 /nfs/dbraw/zinc/65/54/95/746655495.db2.gz LOTPZULBDQGYPU-LBPRGKRZSA-N 1 1 354.838 2.779 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839393241 746821267 /nfs/dbraw/zinc/82/12/67/746821267.db2.gz YNXOKGQWMPHNAN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1Br ZINC000839393241 746821273 /nfs/dbraw/zinc/82/12/73/746821273.db2.gz YNXOKGQWMPHNAN-SNVBAGLBSA-N 1 1 356.220 2.524 20 5 FFBDMO CON1CCC([N@H+](C)Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839618814 746873597 /nfs/dbraw/zinc/87/35/97/746873597.db2.gz MVUKWOVBLGTAKV-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CON1CCC([N@@H+](C)Cc2cccc([N+](=O)[O-])c2Br)CC1 ZINC000839618814 746873604 /nfs/dbraw/zinc/87/36/04/746873604.db2.gz MVUKWOVBLGTAKV-UHFFFAOYSA-N 1 1 358.236 2.815 20 5 FFBDMO CC[N@@H+](CC(=O)N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)C1CC1 ZINC000839864379 746946397 /nfs/dbraw/zinc/94/63/97/746946397.db2.gz RVFAKHZZXRPXPX-CQSZACIVSA-N 1 1 363.311 2.938 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H](C2CCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)C1 ZINC000841104796 747270927 /nfs/dbraw/zinc/27/09/27/747270927.db2.gz SQBLGKCSZNKNSC-RHSMWYFYSA-N 1 1 353.850 2.967 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000844643567 748062896 /nfs/dbraw/zinc/06/28/96/748062896.db2.gz UHWZZQIAFZEWHX-MXWKQRLJSA-N 1 1 370.247 2.910 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000846912884 748573403 /nfs/dbraw/zinc/57/34/03/748573403.db2.gz PJFJSWVJZKKKPZ-ZDUSSCGKSA-N 1 1 353.850 2.933 20 5 FFBDMO Cc1noc(C[N@H+]2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910503 749725303 /nfs/dbraw/zinc/72/53/03/749725303.db2.gz COGATNUTLLNXFQ-PWSUYJOCSA-N 1 1 354.407 2.626 20 5 FFBDMO Cc1noc(C[N@@H+]2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851910503 749725309 /nfs/dbraw/zinc/72/53/09/749725309.db2.gz COGATNUTLLNXFQ-PWSUYJOCSA-N 1 1 354.407 2.626 20 5 FFBDMO CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1C ZINC000852204664 749802490 /nfs/dbraw/zinc/80/24/90/749802490.db2.gz UVHCWENKUNGRBX-NSNWQYSKSA-N 1 1 350.415 2.680 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)NCc2c[nH+]c3n2CCCC3)c1F ZINC000854395428 750299176 /nfs/dbraw/zinc/29/91/76/750299176.db2.gz JABGKYHWMLEOGN-UHFFFAOYSA-N 1 1 350.325 2.644 20 5 FFBDMO COc1ccc(CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000895810968 970964888 /nfs/dbraw/zinc/96/48/88/970964888.db2.gz ANLOAFIRXSIQGM-VQIMIIECSA-N 1 1 369.421 2.913 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266640 971206825 /nfs/dbraw/zinc/20/68/25/971206825.db2.gz SDWBLSUVVNNLHX-WBVHZDCISA-N 1 1 357.410 2.844 20 5 FFBDMO COc1c(O)ccc(CN[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000893266640 971206832 /nfs/dbraw/zinc/20/68/32/971206832.db2.gz SDWBLSUVVNNLHX-WBVHZDCISA-N 1 1 357.410 2.844 20 5 FFBDMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1 ZINC000254980114 959726375 /nfs/dbraw/zinc/72/63/75/959726375.db2.gz JZLRHLTVKVXBFE-LEQAYGSTSA-N 1 1 361.442 2.612 20 5 FFBDMO CC(=O)Oc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000177774028 962873000 /nfs/dbraw/zinc/87/30/00/962873000.db2.gz FPHBMNXVYTZQCB-UHFFFAOYSA-N 1 1 355.394 2.842 20 5 FFBDMO COC[C@]1(C(=O)OC(C)(C)C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001175240212 1013421994 /nfs/dbraw/zinc/42/19/94/1013421994.db2.gz YCGZFJMTQHRSHA-SFHVURJKSA-N 1 1 368.405 2.914 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000126508862 963694089 /nfs/dbraw/zinc/69/40/89/963694089.db2.gz NGTIWDHIHAYULL-ZIAGYGMSSA-N 1 1 356.426 2.993 20 5 FFBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2Cc3cccnc3N3CCC[C@H]3C2)c1 ZINC001175559400 1013510806 /nfs/dbraw/zinc/51/08/06/1013510806.db2.gz CIXUHWVWQJEIJB-KRWDZBQOSA-N 1 1 354.410 2.853 20 5 FFBDMO CC[C@@H](c1ccc(F)cc1)[NH+]1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1 ZINC001175906273 1013586272 /nfs/dbraw/zinc/58/62/72/1013586272.db2.gz GYRWPLRTIXHNHW-KRWDZBQOSA-N 1 1 361.421 2.736 20 5 FFBDMO CC(C)[C@@H](CC[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001167525381 966070449 /nfs/dbraw/zinc/07/04/49/966070449.db2.gz DPXJWWONPPLTLW-CQSZACIVSA-N 1 1 369.466 2.700 20 5 FFBDMO CC(C)[C@@H](CC[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC001167525381 966070457 /nfs/dbraw/zinc/07/04/57/966070457.db2.gz DPXJWWONPPLTLW-CQSZACIVSA-N 1 1 369.466 2.700 20 5 FFBDMO Cc1cc(F)cc(C(=O)NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-] ZINC000176709427 966709019 /nfs/dbraw/zinc/70/90/19/966709019.db2.gz RCFLIZALDDYDMN-STQMWFEESA-N 1 1 367.421 2.660 20 5 FFBDMO COC(=O)CCC1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001167593847 966731076 /nfs/dbraw/zinc/73/10/76/966731076.db2.gz DWOGUMARSGYBGN-UHFFFAOYSA-N 1 1 374.397 2.810 20 5 FFBDMO O=[N+]([O-])c1cccnc1N1CC[NH+](Cc2cccc3c2NCCC3)CC1 ZINC000894962505 967131814 /nfs/dbraw/zinc/13/18/14/967131814.db2.gz IPFWCYOFHAQCBQ-UHFFFAOYSA-N 1 1 353.426 2.670 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@H]2C[C@H]2CCCO2)cc1 ZINC001176611806 1013736475 /nfs/dbraw/zinc/73/64/75/1013736475.db2.gz XIMLDYYTBOLCEU-SJLPKXTDSA-N 1 1 350.415 2.634 20 5 FFBDMO COc1ccc(C[N@H+](CCCO)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC001176828312 1013782513 /nfs/dbraw/zinc/78/25/13/1013782513.db2.gz RDWMNPKAYRFGHH-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO COc1ccc(C[N@@H+](CCCO)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC001176828312 1013782518 /nfs/dbraw/zinc/78/25/18/1013782518.db2.gz RDWMNPKAYRFGHH-UHFFFAOYSA-N 1 1 360.410 2.997 20 5 FFBDMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000874846341 1013917724 /nfs/dbraw/zinc/91/77/24/1013917724.db2.gz IRBPBBSGYZUSKX-ZWKOTPCHSA-N 1 1 358.442 2.504 20 5 FFBDMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1F ZINC000311819288 970172893 /nfs/dbraw/zinc/17/28/93/970172893.db2.gz PZUOWEBWAULPFT-OAHLLOKOSA-N 1 1 357.385 2.986 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278800 977375373 /nfs/dbraw/zinc/37/53/73/977375373.db2.gz RLZBXLPEOZMSMA-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278800 977375380 /nfs/dbraw/zinc/37/53/80/977375380.db2.gz RLZBXLPEOZMSMA-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1ccc(C)c(C[N@H+]2C[C@@]3(C)CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@@]3(C)C2)c1 ZINC000982278800 977375386 /nfs/dbraw/zinc/37/53/86/977375386.db2.gz RLZBXLPEOZMSMA-UKAVVXHISA-N 1 1 371.481 2.639 20 5 FFBDMO Cc1cccc(C)c1C[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001482043814 977956266 /nfs/dbraw/zinc/95/62/66/977956266.db2.gz XCEFLJQKZZDJLE-IEBWSBKVSA-N 1 1 359.470 2.687 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000178855251 978124458 /nfs/dbraw/zinc/12/44/58/978124458.db2.gz CKAJYHHWWBMEFZ-IRXDYDNUSA-N 1 1 358.394 2.790 20 5 FFBDMO C[N@@H+](CCN1CCN(c2ccc([N+](=O)[O-])cc2F)CC1)Cc1ccccc1 ZINC000729184608 978197709 /nfs/dbraw/zinc/19/77/09/978197709.db2.gz FQMWYPXXISVHPP-UHFFFAOYSA-N 1 1 372.444 2.988 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000108302197 978460401 /nfs/dbraw/zinc/46/04/01/978460401.db2.gz XSADLBKDTCXPCO-MRXNPFEDSA-N 1 1 372.469 2.799 20 5 FFBDMO COc1cc(CN2CC[C@@H](C[NH3+])[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000904411372 980270316 /nfs/dbraw/zinc/27/03/16/980270316.db2.gz UXAMTQGVUXTRKZ-NEPJUHHUSA-N 1 1 373.400 2.664 20 5 FFBDMO COc1cc(CN2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000877743306 1014705032 /nfs/dbraw/zinc/70/50/32/1014705032.db2.gz JNIOJSKHEXBNCV-AAEUAGOBSA-N 1 1 371.384 2.731 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000129309323 981904333 /nfs/dbraw/zinc/90/43/33/981904333.db2.gz HTUWXCSYZJYUMM-APWZRJJASA-N 1 1 355.442 2.832 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCO)[C@@H](C)c2ccccc2)c1 ZINC001168309429 982786723 /nfs/dbraw/zinc/78/67/23/982786723.db2.gz MQGAAADQHXJCFH-AWEZNQCLSA-N 1 1 358.394 2.937 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)[C@@H](C)c2ccccc2)c1 ZINC001168309429 982786724 /nfs/dbraw/zinc/78/67/24/982786724.db2.gz MQGAAADQHXJCFH-AWEZNQCLSA-N 1 1 358.394 2.937 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)CC[C@@H]21 ZINC000878198466 1014910564 /nfs/dbraw/zinc/91/05/64/1014910564.db2.gz WWELDKVQOINJIB-ZFWWWQNUSA-N 1 1 357.414 2.561 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1 ZINC000764021827 984102881 /nfs/dbraw/zinc/10/28/81/984102881.db2.gz JQDHMTIZTVPRTF-UHFFFAOYSA-N 1 1 368.397 2.530 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(CN3CCC[N@H+](C4CCCC4)CC3)n2)cc1 ZINC000172511998 985572746 /nfs/dbraw/zinc/57/27/46/985572746.db2.gz NMRZGUOZNYITKT-UHFFFAOYSA-N 1 1 370.457 2.761 20 5 FFBDMO Cc1[nH+]ccn1-c1ncccc1CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000761598886 987541014 /nfs/dbraw/zinc/54/10/14/987541014.db2.gz KRRCNVWEJALBPA-CYBMUJFWSA-N 1 1 365.393 2.904 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2[nH+]ccn2C)C1 ZINC000370061885 987985505 /nfs/dbraw/zinc/98/55/05/987985505.db2.gz IACAHHQJSKOHJR-UONOGXRCSA-N 1 1 357.414 2.535 20 5 FFBDMO C[C@@H](C[N@H+](C)CCC[NH+](C)C)Nc1c(Cl)cc([N+](=O)[O-])cc1C(=O)[O-] ZINC001599836306 988748256 /nfs/dbraw/zinc/74/82/56/988748256.db2.gz YEKUZASPURNBQH-NSHDSACASA-N 1 1 372.853 2.630 20 5 FFBDMO C[C@@H](C[N@@H+](C)CCC[NH+](C)C)Nc1c(Cl)cc([N+](=O)[O-])cc1C(=O)[O-] ZINC001599836306 988748263 /nfs/dbraw/zinc/74/82/63/988748263.db2.gz YEKUZASPURNBQH-NSHDSACASA-N 1 1 372.853 2.630 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]1[C@@H](O)c1ccccc1 ZINC000879244540 1015435660 /nfs/dbraw/zinc/43/56/60/1015435660.db2.gz QZKMEIVRRIXDRB-KPFFTGBYSA-N 1 1 372.421 2.533 20 5 FFBDMO Nc1ccc(C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000031566122 989474413 /nfs/dbraw/zinc/47/44/13/989474413.db2.gz NRAFPHGYJVZKDN-INIZCTEOSA-N 1 1 354.410 2.571 20 5 FFBDMO CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccc(C(F)F)cc2)CC1 ZINC001005383678 989741530 /nfs/dbraw/zinc/74/15/30/989741530.db2.gz VHHSDPQTYYJULF-HZPDHXFCSA-N 1 1 367.396 2.712 20 5 FFBDMO CC(C)c1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001034643098 990147486 /nfs/dbraw/zinc/14/74/86/990147486.db2.gz JUTKWKGJDJKEFS-NCXUSEDFSA-N 1 1 359.470 2.992 20 5 FFBDMO Cc1ccc(C[NH2+]Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)c(C)c1 ZINC001034816278 990276102 /nfs/dbraw/zinc/27/61/02/990276102.db2.gz KUNUNEOPEHPSFP-WOJBJXKFSA-N 1 1 367.449 2.875 20 5 FFBDMO CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000068964556 991554938 /nfs/dbraw/zinc/55/49/38/991554938.db2.gz PBCIAAFSNOMPBT-GJZGRUSLSA-N 1 1 373.457 2.919 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc3ccccc3c2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001484635149 991712947 /nfs/dbraw/zinc/71/29/47/991712947.db2.gz WPPSLFYNPKZFHK-QZTJIDSGSA-N 1 1 353.422 2.634 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](c2nccs2)C1 ZINC000880319454 1015806373 /nfs/dbraw/zinc/80/63/73/1015806373.db2.gz GWKGZGTZWXZIOD-GFCCVEGCSA-N 1 1 374.422 2.839 20 5 FFBDMO COc1cccc2c1CC[C@]2(CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000880383545 1015822938 /nfs/dbraw/zinc/82/29/38/1015822938.db2.gz GKXITGKFPWYEIM-LJQANCHMSA-N 1 1 358.394 2.536 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 ZINC000810614722 994839770 /nfs/dbraw/zinc/83/97/70/994839770.db2.gz HBGAFDQYFMHJPO-GFCCVEGCSA-N 1 1 355.354 2.531 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC000826752359 1016047791 /nfs/dbraw/zinc/04/77/91/1016047791.db2.gz ZAYJUYNUIWGHFT-KFKAGJAMSA-N 1 1 357.454 2.937 20 5 FFBDMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000826750585 1016059485 /nfs/dbraw/zinc/05/94/85/1016059485.db2.gz GZDFMFCAZUHCFE-OAHLLOKOSA-N 1 1 363.433 2.905 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccccc2C)C1 ZINC000825189206 997268059 /nfs/dbraw/zinc/26/80/59/997268059.db2.gz CFZWFRKRPFFYIH-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(C)c(F)ccc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000843844210 997440605 /nfs/dbraw/zinc/44/06/05/997440605.db2.gz PXXDATZWARFDBU-CQSZACIVSA-N 1 1 367.421 2.615 20 5 FFBDMO CCC[C@@H]1CN(C(=O)c2c(C)c(F)ccc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000843844210 997440611 /nfs/dbraw/zinc/44/06/11/997440611.db2.gz PXXDATZWARFDBU-CQSZACIVSA-N 1 1 367.421 2.615 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)[C@H](Cc2ccccc2)C1 ZINC000844924985 998234093 /nfs/dbraw/zinc/23/40/93/998234093.db2.gz OMZYTZUCBGKKQD-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)[C@H](Cc2ccccc2)C1 ZINC000844924985 998234102 /nfs/dbraw/zinc/23/41/02/998234102.db2.gz OMZYTZUCBGKKQD-MRXNPFEDSA-N 1 1 357.385 2.733 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)Nc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000731991284 998400799 /nfs/dbraw/zinc/40/07/99/998400799.db2.gz YBIRXWZKOCFSGG-UHFFFAOYSA-N 1 1 368.309 2.644 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1ccnc1 ZINC000845575464 998591210 /nfs/dbraw/zinc/59/12/10/998591210.db2.gz IBURCVZDBWIXJX-PBHICJAKSA-N 1 1 358.398 2.560 20 5 FFBDMO C[C@H](CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)n1ccnc1 ZINC000845575464 998591221 /nfs/dbraw/zinc/59/12/21/998591221.db2.gz IBURCVZDBWIXJX-PBHICJAKSA-N 1 1 358.398 2.560 20 5 FFBDMO O=C(NC1(C2CC[NH+](C/C=C\c3ccccc3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001000152901 1016247792 /nfs/dbraw/zinc/24/77/92/1016247792.db2.gz GUOQSPXTPOBMHC-ZSKSOVMSSA-N 1 1 369.465 2.726 20 5 FFBDMO Cc1cc(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)c(N)c([N+](=O)[O-])c1 ZINC000734178420 999222922 /nfs/dbraw/zinc/22/29/22/999222922.db2.gz XSJUHHLDMVWHGO-MRXNPFEDSA-N 1 1 368.437 2.880 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)[C@H](C)C1 ZINC000734401464 999284190 /nfs/dbraw/zinc/28/41/90/999284190.db2.gz HKJJHSHNKWYUTF-DYVFJYSZSA-N 1 1 367.421 2.601 20 5 FFBDMO CC[C@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000738255503 999623348 /nfs/dbraw/zinc/62/33/48/999623348.db2.gz QBXKQKVZRUCHHW-AWEZNQCLSA-N 1 1 360.414 2.833 20 5 FFBDMO CC[C@@H]1CCC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1 ZINC000738255505 999623389 /nfs/dbraw/zinc/62/33/89/999623389.db2.gz QBXKQKVZRUCHHW-CQSZACIVSA-N 1 1 360.414 2.833 20 5 FFBDMO C[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1[C@H](C)CC[C@H]1C ZINC000741017209 999702600 /nfs/dbraw/zinc/70/26/00/999702600.db2.gz MGEWFMGAZZJMTE-JHJVBQTASA-N 1 1 374.397 2.949 20 5 FFBDMO C[N@@H+]1CCc2c(NCCc3cn4ccccc4n3)ccc([N+](=O)[O-])c2C1 ZINC001169009612 1000015359 /nfs/dbraw/zinc/01/53/59/1000015359.db2.gz TWJORJVHALWMEQ-UHFFFAOYSA-N 1 1 351.410 2.885 20 5 FFBDMO C[N@H+]1CCc2c(NCCc3cn4ccccc4n3)ccc([N+](=O)[O-])c2C1 ZINC001169009612 1000015361 /nfs/dbraw/zinc/01/53/61/1000015361.db2.gz TWJORJVHALWMEQ-UHFFFAOYSA-N 1 1 351.410 2.885 20 5 FFBDMO CCN1CC[NH+](Cc2ccc(CNc3ccc(N)cc3[N+](=O)[O-])cc2)CC1 ZINC000804354937 1000115518 /nfs/dbraw/zinc/11/55/18/1000115518.db2.gz RYZQDOBADCGSEB-UHFFFAOYSA-N 1 1 369.469 2.927 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCCC4(CCOCC4)C3)n2)cc1 ZINC000742160668 1000141735 /nfs/dbraw/zinc/14/17/35/1000141735.db2.gz FDLXNCSMAMRJQQ-UHFFFAOYSA-N 1 1 357.414 2.703 20 5 FFBDMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001144839320 1000328051 /nfs/dbraw/zinc/32/80/51/1000328051.db2.gz HJAMFPKMRNDFIM-UHFFFAOYSA-N 1 1 359.430 2.693 20 5 FFBDMO C[N@@H+](CCOC(=O)COc1ccccc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000769048751 1000413971 /nfs/dbraw/zinc/41/39/71/1000413971.db2.gz KJNVISPDCKEYPN-UHFFFAOYSA-N 1 1 362.357 2.788 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147149 1000435125 /nfs/dbraw/zinc/43/51/25/1000435125.db2.gz VHBXBWSJZMVTOP-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000769147149 1000435128 /nfs/dbraw/zinc/43/51/28/1000435128.db2.gz VHBXBWSJZMVTOP-LSDHHAIUSA-N 1 1 360.458 2.750 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](c2ccncc2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000846908637 1000485102 /nfs/dbraw/zinc/48/51/02/1000485102.db2.gz WDHXKEFQUAWFLM-AWEZNQCLSA-N 1 1 358.373 2.947 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000846972042 1000489929 /nfs/dbraw/zinc/48/99/29/1000489929.db2.gz LMGZPSISSDAFIJ-CYBMUJFWSA-N 1 1 364.402 2.676 20 5 FFBDMO CC(C)Cc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001000675177 1016423522 /nfs/dbraw/zinc/42/35/22/1016423522.db2.gz SOMNMHPBAOWGDL-WOJBJXKFSA-N 1 1 371.481 2.799 20 5 FFBDMO CC(C)Cc1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000675177 1016423524 /nfs/dbraw/zinc/42/35/24/1016423524.db2.gz SOMNMHPBAOWGDL-WOJBJXKFSA-N 1 1 371.481 2.799 20 5 FFBDMO CC(C)Cc1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000675177 1016423527 /nfs/dbraw/zinc/42/35/27/1016423527.db2.gz SOMNMHPBAOWGDL-WOJBJXKFSA-N 1 1 371.481 2.799 20 5 FFBDMO C[N@H+](CCCNC(=O)OC(C)(C)C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000769730435 1000576912 /nfs/dbraw/zinc/57/69/12/1000576912.db2.gz UUKRYWVSUJHHHR-UHFFFAOYSA-N 1 1 363.418 2.818 20 5 FFBDMO C[N@@H+](CCCNC(=O)OC(C)(C)C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000769730435 1000576916 /nfs/dbraw/zinc/57/69/16/1000576916.db2.gz UUKRYWVSUJHHHR-UHFFFAOYSA-N 1 1 363.418 2.818 20 5 FFBDMO Cc1[nH+]ccn1CCOC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] ZINC000771919225 1001234450 /nfs/dbraw/zinc/23/44/50/1001234450.db2.gz UHVRTXAMXYFPSR-UHFFFAOYSA-N 1 1 373.287 2.898 20 5 FFBDMO COCC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H]1CC[C@H](C)C1 ZINC000790477748 1002387488 /nfs/dbraw/zinc/38/74/88/1002387488.db2.gz JHWAFSBIOYLKEK-HOCLYGCPSA-N 1 1 359.430 2.948 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001184840333 1002734055 /nfs/dbraw/zinc/73/40/55/1002734055.db2.gz YHBNJLYWSMAIOI-LBPRGKRZSA-N 1 1 359.386 2.617 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001184840332 1002734368 /nfs/dbraw/zinc/73/43/68/1002734368.db2.gz YHBNJLYWSMAIOI-GFCCVEGCSA-N 1 1 359.386 2.617 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001185338867 1002922113 /nfs/dbraw/zinc/92/21/13/1002922113.db2.gz MXHXNODWORBUSL-ZDUSSCGKSA-N 1 1 359.386 2.759 20 5 FFBDMO COC(=O)C[C@H]1CCC[N@H+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170352782 1003121457 /nfs/dbraw/zinc/12/14/57/1003121457.db2.gz QCYBNLMULHDCTR-ZIAGYGMSSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@]23CC(=O)N(C)C3)c([N+](=O)[O-])c1 ZINC001170340479 1003130262 /nfs/dbraw/zinc/13/02/62/1003130262.db2.gz MBPQAXMAKZZVGF-AUUYWEPGSA-N 1 1 361.442 2.621 20 5 FFBDMO CCN(C)C(=O)OC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805762630 1004136803 /nfs/dbraw/zinc/13/68/03/1004136803.db2.gz LSFOMMDFRVXPJJ-DLBZAZTESA-N 1 1 365.430 2.571 20 5 FFBDMO CCC[N@H+](Cn1nccc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 ZINC000101539253 1004859996 /nfs/dbraw/zinc/85/99/96/1004859996.db2.gz BHEJKEOBIIMWRW-UHFFFAOYSA-N 1 1 371.441 2.766 20 5 FFBDMO CCC[N@@H+](Cn1nccc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 ZINC000101539253 1004859998 /nfs/dbraw/zinc/85/99/98/1004859998.db2.gz BHEJKEOBIIMWRW-UHFFFAOYSA-N 1 1 371.441 2.766 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@H]3CN(c4ccccc4)C[C@H]3C2)cc1 ZINC000776279507 1005345718 /nfs/dbraw/zinc/34/57/18/1005345718.db2.gz XUVMBOVTWRNKKD-FUHIMQAGSA-N 1 1 353.422 2.696 20 5 FFBDMO O=C(N[C@H]1CC[C@H](C[NH2+]Cc2cc3ccccc3o2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001050326296 1016971563 /nfs/dbraw/zinc/97/15/63/1016971563.db2.gz WLCDBCAMLGREGA-MOIQIXESSA-N 1 1 371.437 2.863 20 5 FFBDMO CC[C@H](C)C[N@@H+](CC)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748263747 1017005707 /nfs/dbraw/zinc/00/57/07/1017005707.db2.gz XPSWQEBPCFPYAY-SCLBCKFNSA-N 1 1 362.430 2.687 20 5 FFBDMO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](c3nnc4ccccn43)C2)cc1 ZINC000776584280 1005954812 /nfs/dbraw/zinc/95/48/12/1005954812.db2.gz KAZOSAJAJKXDFE-RDJZCZTQSA-N 1 1 367.409 2.551 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776592671 1006008956 /nfs/dbraw/zinc/00/89/56/1006008956.db2.gz SFBRWOHOVBEPHH-PMACEKPBSA-N 1 1 355.438 2.835 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC(CC)([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000881626673 1006158631 /nfs/dbraw/zinc/15/86/31/1006158631.db2.gz QCDNELSOCKCACH-UHFFFAOYSA-N 1 1 363.462 2.751 20 5 FFBDMO CC(C)(C)OCCC[NH+]1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000882330183 1006360003 /nfs/dbraw/zinc/36/00/03/1006360003.db2.gz OMFRUJNGMQUDDT-UHFFFAOYSA-N 1 1 367.421 2.697 20 5 FFBDMO CC[N@@H+]1CCCC[C@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111392604 1006427346 /nfs/dbraw/zinc/42/73/46/1006427346.db2.gz FSSVGRGMWKJEJA-SFHVURJKSA-N 1 1 357.458 2.959 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000111392604 1006427354 /nfs/dbraw/zinc/42/73/54/1006427354.db2.gz FSSVGRGMWKJEJA-SFHVURJKSA-N 1 1 357.458 2.959 20 5 FFBDMO Cc1cc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cn2cc[nH+]c12 ZINC000818057670 1007870528 /nfs/dbraw/zinc/87/05/28/1007870528.db2.gz XAQJOEPLQJTBMY-INIZCTEOSA-N 1 1 365.349 2.683 20 5 FFBDMO CC[N@@H+](C)Cc1cc(O[C@H]2CCN(c3nc(C)ccc3[N+](=O)[O-])C2)ccn1 ZINC000856534344 1007872267 /nfs/dbraw/zinc/87/22/67/1007872267.db2.gz ZNMOOHBTIZSIME-KRWDZBQOSA-N 1 1 371.441 2.803 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)c1 ZINC000858012494 1008276957 /nfs/dbraw/zinc/27/69/57/1008276957.db2.gz IJISQSXRRLHLED-MRXNPFEDSA-N 1 1 371.393 2.738 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](Oc3ccc(C)cn3)C2)c1 ZINC000858012494 1008276960 /nfs/dbraw/zinc/27/69/60/1008276960.db2.gz IJISQSXRRLHLED-MRXNPFEDSA-N 1 1 371.393 2.738 20 5 FFBDMO O=C(Nc1ccc(F)cc1)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886060333 1008526784 /nfs/dbraw/zinc/52/67/84/1008526784.db2.gz ZYUUQTWEKIQNLE-UHFFFAOYSA-N 1 1 358.373 2.980 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC3(CCOCC3)CC[C@@H]2CO)cc1 ZINC000859519356 1008539686 /nfs/dbraw/zinc/53/96/86/1008539686.db2.gz MMEXGYNIWZOKOV-QGZVFWFLSA-N 1 1 364.442 2.617 20 5 FFBDMO COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000859955035 1008744345 /nfs/dbraw/zinc/74/43/45/1008744345.db2.gz RQOMFMINLJHDBN-RBSFLKMASA-N 1 1 363.370 2.667 20 5 FFBDMO COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000859955035 1008744357 /nfs/dbraw/zinc/74/43/57/1008744357.db2.gz RQOMFMINLJHDBN-RBSFLKMASA-N 1 1 363.370 2.667 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOc1cccnc1 ZINC001177870374 1008758608 /nfs/dbraw/zinc/75/86/08/1008758608.db2.gz KFNOEXCOCZCDHB-UHFFFAOYSA-N 1 1 352.188 2.921 20 5 FFBDMO O=C(NCCCCCC[NH2+]CCCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC001178464731 1008998777 /nfs/dbraw/zinc/99/87/77/1008998777.db2.gz ZSWCBHRSGWGQNO-RTBURBONSA-N 1 1 361.486 2.941 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCc1ccc2c(c1)OCO2 ZINC000887095505 1009017689 /nfs/dbraw/zinc/01/76/89/1009017689.db2.gz OCPSXXHJTICOQN-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCc1ccc2c(c1)OCO2 ZINC000887095505 1009017700 /nfs/dbraw/zinc/01/77/00/1009017700.db2.gz OCPSXXHJTICOQN-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482769 1009087509 /nfs/dbraw/zinc/08/75/09/1009087509.db2.gz XLAZLBZTUFOKAA-CEWLAPEOSA-N 1 1 367.449 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482769 1009087523 /nfs/dbraw/zinc/08/75/23/1009087523.db2.gz XLAZLBZTUFOKAA-CEWLAPEOSA-N 1 1 367.449 2.835 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1 ZINC000823482769 1009087531 /nfs/dbraw/zinc/08/75/31/1009087531.db2.gz XLAZLBZTUFOKAA-CEWLAPEOSA-N 1 1 367.449 2.835 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cc2ccc(F)cc2[nH]c1=O)c1cccc([N+](=O)[O-])c1 ZINC001179352706 1009313381 /nfs/dbraw/zinc/31/33/81/1009313381.db2.gz IAQMZOGZLKLRCK-IBGZPJMESA-N 1 1 371.368 2.985 20 5 FFBDMO C[C@](CO)([NH2+]Cc1cc2ccc(F)cc2[nH]c1=O)c1cccc([N+](=O)[O-])c1 ZINC001179352708 1009315571 /nfs/dbraw/zinc/31/55/71/1009315571.db2.gz IAQMZOGZLKLRCK-LJQANCHMSA-N 1 1 371.368 2.985 20 5 FFBDMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)C1 ZINC000861353160 1009371683 /nfs/dbraw/zinc/37/16/83/1009371683.db2.gz MIMAULZURQFLHR-KBXCAEBGSA-N 1 1 366.414 2.648 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000134871149 1009497148 /nfs/dbraw/zinc/49/71/48/1009497148.db2.gz GYGPZIODBMOILR-QMTMVMCOSA-N 1 1 372.469 2.871 20 5 FFBDMO O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000862631378 1009909327 /nfs/dbraw/zinc/90/93/27/1009909327.db2.gz OPHPGMQNPYKBMB-CQSZACIVSA-N 1 1 365.405 2.636 20 5 FFBDMO COC(=O)c1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1F ZINC001181267916 1010045522 /nfs/dbraw/zinc/04/55/22/1010045522.db2.gz WKKGEPNSKBHKNP-UHFFFAOYSA-N 1 1 358.329 2.687 20 5 FFBDMO O=C1COc2cc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3Cc3ccccc3)cc2N1 ZINC000715740702 1010405712 /nfs/dbraw/zinc/40/57/12/1010405712.db2.gz OTPJWXOKLDONJP-CQSZACIVSA-N 1 1 368.393 2.612 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+](CC1CC1)CC1CCC1 ZINC000794715602 1010563603 /nfs/dbraw/zinc/56/36/03/1010563603.db2.gz WCABSAMQSHFLSZ-UHFFFAOYSA-N 1 1 358.398 2.881 20 5 FFBDMO O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+](CC1CC1)CC1CCC1 ZINC000794715602 1010563607 /nfs/dbraw/zinc/56/36/07/1010563607.db2.gz WCABSAMQSHFLSZ-UHFFFAOYSA-N 1 1 358.398 2.881 20 5 FFBDMO Cn1ccnc1[C@@H](O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000865628645 1010830124 /nfs/dbraw/zinc/83/01/24/1010830124.db2.gz VNVYEKJZVTZKAK-SFHVURJKSA-N 1 1 367.409 2.827 20 5 FFBDMO Cn1nccc1[C@@H](O)C1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000865961664 1010896771 /nfs/dbraw/zinc/89/67/71/1010896771.db2.gz VBHRJDWFGFEEQY-IBGZPJMESA-N 1 1 367.409 2.827 20 5 FFBDMO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000866307113 1010973885 /nfs/dbraw/zinc/97/38/85/1010973885.db2.gz QYWXHECUQMJJTC-OMWUSAIZSA-N 1 1 365.449 2.632 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CC[C@@H](Oc3ncccn3)C1)CC2 ZINC001172914093 1012097676 /nfs/dbraw/zinc/09/76/76/1012097676.db2.gz ZBJPWDCENSRFSD-FUHWJXTLSA-N 1 1 354.410 2.786 20 5 FFBDMO COc1ncnc2c1CC[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172915467 1012099903 /nfs/dbraw/zinc/09/99/03/1012099903.db2.gz NBDCRMVSFBYTQT-OAHLLOKOSA-N 1 1 354.410 2.699 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1 ZINC000870121922 1012168639 /nfs/dbraw/zinc/16/86/39/1012168639.db2.gz FADQTYONIACBSI-ZDUSSCGKSA-N 1 1 372.400 2.835 20 5 FFBDMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1 ZINC000870121831 1012169102 /nfs/dbraw/zinc/16/91/02/1012169102.db2.gz HYSBECUWYYXNTK-AWEZNQCLSA-N 1 1 354.410 2.696 20 5 FFBDMO COC[C@@H]1CC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010038 1012180145 /nfs/dbraw/zinc/18/01/45/1012180145.db2.gz LJPQDPJMLKFMRY-GFCCVEGCSA-N 1 1 355.385 2.810 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3ccc(C)c([N+](=O)[O-])c3)CC[NH2+]2)cc1 ZINC000870139950 1012187710 /nfs/dbraw/zinc/18/77/10/1012187710.db2.gz ZFDURNFYWJICQG-QGZVFWFLSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@]1(O)CCC[N@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018660 1012189022 /nfs/dbraw/zinc/18/90/22/1012189022.db2.gz YQNBAINLPQADSM-KRWDZBQOSA-N 1 1 355.385 2.689 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@](O)(CF)CC2)c1F ZINC001173180159 1012324151 /nfs/dbraw/zinc/32/41/51/1012324151.db2.gz ITYXVFXDQMKBII-SJKOYZFVSA-N 1 1 358.385 2.860 20 5 FFBDMO COC(=O)[C@H]1CC[C@@H](C)[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173189575 1012332162 /nfs/dbraw/zinc/33/21/62/1012332162.db2.gz KZVXTUDAZFPCSF-AGIUHOORSA-N 1 1 368.405 2.947 20 5 FFBDMO COC(=O)CC[N@@H+]([C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])C1CC1 ZINC001173193148 1012336107 /nfs/dbraw/zinc/33/61/07/1012336107.db2.gz QTXIHPLUFTYQDF-LLVKDONJSA-N 1 1 354.378 2.701 20 5 FFBDMO CC[N@@H+]1C[C@H]2CN([C@H](C)Cc3c(F)c(OC)ccc3[N+](=O)[O-])C[C@H]2C1 ZINC001173193918 1012337367 /nfs/dbraw/zinc/33/73/67/1012337367.db2.gz SBGGLIQETRRLJM-MCIONIFRSA-N 1 1 351.422 2.557 20 5 FFBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2nccnc2Cl)CC1 ZINC001173221625 1012351398 /nfs/dbraw/zinc/35/13/98/1012351398.db2.gz KRQUNLXQTJZRRK-ZDUSSCGKSA-N 1 1 361.833 2.791 20 5 FFBDMO CC(C)C[C@H]1CCC[N@H+]1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748791880 1017653837 /nfs/dbraw/zinc/65/38/37/1017653837.db2.gz JNHUEIIWJJQIRR-APWZRJJASA-N 1 1 374.441 2.830 20 5 FFBDMO CC(C)C[C@H]1CCC[N@H+]1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000748791894 1017653959 /nfs/dbraw/zinc/65/39/59/1017653959.db2.gz JNHUEIIWJJQIRR-VQIMIIECSA-N 1 1 374.441 2.830 20 5 FFBDMO C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)CC[C@H]21 ZINC000827364122 1017772928 /nfs/dbraw/zinc/77/29/28/1017772928.db2.gz FSVDXLMXTDJSLZ-MAUKXSAKSA-N 1 1 372.469 2.751 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@](CO)(c3ccccc3)C2)cc1 ZINC000801580570 1019137589 /nfs/dbraw/zinc/13/75/89/1019137589.db2.gz MZRAKPHZTQPLOD-WOJBJXKFSA-N 1 1 356.422 2.654 20 5 FFBDMO O=C1C[C@H]([C@@H]2CCCO2)CN1C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291658 1020058244 /nfs/dbraw/zinc/05/82/44/1020058244.db2.gz XQTZAFBRWRSUJT-AOIWGVFYSA-N 1 1 373.453 2.759 20 5 FFBDMO O=C1C[C@H]([C@@H]2CCCO2)CN1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000902291658 1020058259 /nfs/dbraw/zinc/05/82/59/1020058259.db2.gz XQTZAFBRWRSUJT-AOIWGVFYSA-N 1 1 373.453 2.759 20 5 FFBDMO CCC1(C)CC[NH+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000725776768 1020255303 /nfs/dbraw/zinc/25/53/03/1020255303.db2.gz ANYKVCNYSFYNGF-LJQANCHMSA-N 1 1 374.441 2.831 20 5 FFBDMO CC(C)[C@H](C)NC(=O)C1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1 ZINC000725785091 1020257512 /nfs/dbraw/zinc/25/75/12/1020257512.db2.gz NGFMMCUPXLVSCZ-AWEZNQCLSA-N 1 1 373.457 2.775 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC000931057742 1020300307 /nfs/dbraw/zinc/30/03/07/1020300307.db2.gz QHZWMOFTVMAEDY-OAHLLOKOSA-N 1 1 362.430 2.586 20 5 FFBDMO Cc1ccccc1C[NH2+]C[C@H]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001048608095 1020351792 /nfs/dbraw/zinc/35/17/92/1020351792.db2.gz TXFXWWLQDBVSPP-PSBWJHGTSA-N 1 1 359.470 2.672 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@]2(C)C[NH+](C)C[C@]2(C)C1 ZINC000931308272 1020415606 /nfs/dbraw/zinc/41/56/06/1020415606.db2.gz SEVKWLDOVJRSBW-RTBURBONSA-N 1 1 360.458 2.505 20 5 FFBDMO COc1cc([C@@H](C)[NH2+]C[C@H](C(C)C)N2CCN(C)CC2)cc([N+](=O)[O-])c1 ZINC000903064939 1020659694 /nfs/dbraw/zinc/65/96/94/1020659694.db2.gz CBIGZESDGKLCQW-DNVCBOLYSA-N 1 1 364.490 2.526 20 5 FFBDMO COc1cc2c(cc1OC)C1(CCC1)[N@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000932086228 1020701234 /nfs/dbraw/zinc/70/12/34/1020701234.db2.gz YSJQRUSFWGTLAV-UHFFFAOYSA-N 1 1 372.425 2.746 20 5 FFBDMO COc1cc2c(cc1OC)C1(CCC1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000932086228 1020701241 /nfs/dbraw/zinc/70/12/41/1020701241.db2.gz YSJQRUSFWGTLAV-UHFFFAOYSA-N 1 1 372.425 2.746 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000932647170 1020862066 /nfs/dbraw/zinc/86/20/66/1020862066.db2.gz MYIKFHBKRXILMI-SNVBAGLBSA-N 1 1 374.340 2.590 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000932647170 1020862070 /nfs/dbraw/zinc/86/20/70/1020862070.db2.gz MYIKFHBKRXILMI-SNVBAGLBSA-N 1 1 374.340 2.590 20 5 FFBDMO COC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001116351252 1021174581 /nfs/dbraw/zinc/17/45/81/1021174581.db2.gz AMSHUCJAZQIJOF-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2C[C@H](O)COc2cccc([N+](=O)[O-])c2)nc1 ZINC000934344946 1021204771 /nfs/dbraw/zinc/20/47/71/1021204771.db2.gz IFFOIBUUSGZDKV-HNAYVOBHSA-N 1 1 373.409 2.575 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1 ZINC000158003504 1022469867 /nfs/dbraw/zinc/46/98/67/1022469867.db2.gz RHZKAPPCNKGVBE-KDOFPFPSSA-N 1 1 355.442 2.851 20 5 FFBDMO O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccsc3)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001020139819 1022563797 /nfs/dbraw/zinc/56/37/97/1022563797.db2.gz NQOMJCYTTZDBIS-BRSBDYLESA-N 1 1 371.462 2.817 20 5 FFBDMO Cc1ccc(N2CCC(C(=O)OCc3cccnc3[N+](=O)[O-])CC2)[nH+]c1 ZINC001119397475 1022739179 /nfs/dbraw/zinc/73/91/79/1022739179.db2.gz IBEHPIMCIXUYJA-UHFFFAOYSA-N 1 1 356.382 2.653 20 5 FFBDMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCCC1CCCC1)CC2 ZINC001040701250 1022954381 /nfs/dbraw/zinc/95/43/81/1022954381.db2.gz WYEKFZBAXUBRSV-QZTJIDSGSA-N 1 1 363.502 2.937 20 5 FFBDMO CN(Cc1cc(F)ccc1[N+](=O)[O-])C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000188288141 1023050544 /nfs/dbraw/zinc/05/05/44/1023050544.db2.gz VINSKQQLSMJPRL-FQEVSTJZSA-N 1 1 373.428 2.803 20 5 FFBDMO O=C1N(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752796904 1023205691 /nfs/dbraw/zinc/20/56/91/1023205691.db2.gz MSTLHQHSGDQVIK-JKSUJKDBSA-N 1 1 374.441 2.543 20 5 FFBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@@]1(O)CCc2ccccc21 ZINC000829377750 1033128313 /nfs/dbraw/zinc/12/83/13/1033128313.db2.gz VGLSPSISFRMYEL-IBGZPJMESA-N 1 1 352.394 2.737 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1C[N@@H+](C)CCN1C ZINC001120959332 1023544145 /nfs/dbraw/zinc/54/41/45/1023544145.db2.gz IHHWXLLDRPUTAB-CZUORRHYSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1CN(C)CC[N@@H+]1C ZINC001120959332 1023544147 /nfs/dbraw/zinc/54/41/47/1023544147.db2.gz IHHWXLLDRPUTAB-CZUORRHYSA-N 1 1 350.463 2.818 20 5 FFBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)[C@H]1CN(C)CC[N@H+]1C ZINC001120959332 1023544151 /nfs/dbraw/zinc/54/41/51/1023544151.db2.gz IHHWXLLDRPUTAB-CZUORRHYSA-N 1 1 350.463 2.818 20 5 FFBDMO Cc1c(-c2nnc(N3CCC[N@H+](C(C)C)CC3)n2C)cccc1[N+](=O)[O-] ZINC001121290514 1023690554 /nfs/dbraw/zinc/69/05/54/1023690554.db2.gz IGWKQNMRVNNDOH-UHFFFAOYSA-N 1 1 358.446 2.619 20 5 FFBDMO C[C@@H](c1nnc(N(C)[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1C)[N+](=O)[O-] ZINC001121296103 1023692655 /nfs/dbraw/zinc/69/26/55/1023692655.db2.gz DZBGQDPMLZFLOY-VYDXJSESSA-N 1 1 372.473 2.642 20 5 FFBDMO CCC[C@H]1CN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC[N@H+]1Cc1ccccc1 ZINC001121296130 1023692675 /nfs/dbraw/zinc/69/26/75/1023692675.db2.gz GBJYUWLQWPIVII-RDJZCZTQSA-N 1 1 372.473 2.644 20 5 FFBDMO C[C@H](c1nnc(N(C)[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)n1C)[N+](=O)[O-] ZINC001121296100 1023692950 /nfs/dbraw/zinc/69/29/50/1023692950.db2.gz DZBGQDPMLZFLOY-BFYDXBDKSA-N 1 1 372.473 2.642 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001123372156 1023765627 /nfs/dbraw/zinc/76/56/27/1023765627.db2.gz LYOJOGZQQIAYLC-OAHLLOKOSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000758998261 1024417350 /nfs/dbraw/zinc/41/73/50/1024417350.db2.gz AVMWGRSKXGWCEG-ZDUSSCGKSA-N 1 1 360.414 2.689 20 5 FFBDMO C[C@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1(C)C ZINC000758998261 1024417355 /nfs/dbraw/zinc/41/73/55/1024417355.db2.gz AVMWGRSKXGWCEG-ZDUSSCGKSA-N 1 1 360.414 2.689 20 5 FFBDMO CC(C)c1[nH+]ccn1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000759091095 1024461333 /nfs/dbraw/zinc/46/13/33/1024461333.db2.gz OTFKLFKOWBVOML-UHFFFAOYSA-N 1 1 355.398 2.755 20 5 FFBDMO C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C1CC1 ZINC000837225000 1025664415 /nfs/dbraw/zinc/66/44/15/1025664415.db2.gz IYJXCPMRLRJPOG-UHFFFAOYSA-N 1 1 360.458 2.799 20 5 FFBDMO CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000246353587 1026042948 /nfs/dbraw/zinc/04/29/48/1026042948.db2.gz WLHIISUKAAYEHW-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(c2ccccc2)C1=O ZINC000246353587 1026042967 /nfs/dbraw/zinc/04/29/67/1026042967.db2.gz WLHIISUKAAYEHW-OALUTQOASA-N 1 1 369.421 2.756 20 5 FFBDMO Cc1nn(CN2CCC[N@H+](Cc3ccccc3)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000247023135 1026632976 /nfs/dbraw/zinc/63/29/76/1026632976.db2.gz OTKFRWHUQOGDHF-OAHLLOKOSA-N 1 1 357.458 2.962 20 5 FFBDMO O=C1[C@@H]2CCC[C@H]2CN1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000840014454 1026912498 /nfs/dbraw/zinc/91/24/98/1026912498.db2.gz IFWLOOMINMDDQY-KBXCAEBGSA-N 1 1 359.426 2.654 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000840106275 1026957794 /nfs/dbraw/zinc/95/77/94/1026957794.db2.gz BZGRTDJEGLDBGQ-CQSZACIVSA-N 1 1 373.457 2.824 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144136 1026982909 /nfs/dbraw/zinc/98/29/09/1026982909.db2.gz YBMMCERSHIOICV-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO CO[C@@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C12CCC2 ZINC000840144136 1026982918 /nfs/dbraw/zinc/98/29/18/1026982918.db2.gz YBMMCERSHIOICV-HZPDHXFCSA-N 1 1 357.414 2.700 20 5 FFBDMO Cc1nn(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c2ncc([N+](=O)[O-])cc12 ZINC000795645914 1027392081 /nfs/dbraw/zinc/39/20/81/1027392081.db2.gz RUGBQDQFDMNXII-UHFFFAOYSA-N 1 1 370.369 2.688 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC001161759283 1028307474 /nfs/dbraw/zinc/30/74/74/1028307474.db2.gz APVCXXBTNAHARE-ZDUSSCGKSA-N 1 1 370.247 2.848 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N2CCc3nc(C4CC4)ncc3C2)ncc1[N+](=O)[O-] ZINC001154915781 1028510279 /nfs/dbraw/zinc/51/02/79/1028510279.db2.gz SXASAPLYFNFPFK-FNORWQNLSA-N 1 1 366.425 2.752 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])C1 ZINC001162818760 1028669343 /nfs/dbraw/zinc/66/93/43/1028669343.db2.gz KGDJCZROAOGSNN-AWEZNQCLSA-N 1 1 358.442 2.837 20 5 FFBDMO CC(C)Oc1nc(N[C@@H](C[NH+]2CCOCC2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC001162879955 1028691394 /nfs/dbraw/zinc/69/13/94/1028691394.db2.gz HPJIVGLJVVNIOB-HNNXBMFYSA-N 1 1 366.462 2.936 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001165089418 1029379464 /nfs/dbraw/zinc/37/94/64/1029379464.db2.gz UNOIPYHBRCXXLH-ZBFHGGJFSA-N 1 1 374.828 2.592 20 5 FFBDMO CC[N@@H+]([C@H]1CCOC1)C1CCN(c2cc([N+](=O)[O-])cc(Cl)n2)CC1 ZINC001165109346 1029396543 /nfs/dbraw/zinc/39/65/43/1029396543.db2.gz UIGUVDBWKGLHQT-ZDUSSCGKSA-N 1 1 354.838 2.723 20 5 FFBDMO CSCC[C@@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(C)(C)O ZINC001157430783 1029585329 /nfs/dbraw/zinc/58/53/29/1029585329.db2.gz KIMOILVDXFCYPG-IZPAUZPXSA-N 1 1 354.476 2.827 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@@H](Cc4ccncc4)C3)n2)c1 ZINC000782292499 1029645587 /nfs/dbraw/zinc/64/55/87/1029645587.db2.gz UULFREIVRQMLML-INIZCTEOSA-N 1 1 364.409 2.770 20 5 FFBDMO CCC[N@@H+]1C[C@H]2CN(c3cc4ncnc(Cl)c4cc3[N+](=O)[O-])C[C@H]2C1 ZINC001157689787 1029645947 /nfs/dbraw/zinc/64/59/47/1029645947.db2.gz JNOPTXXMPYLKPX-TXEJJXNPSA-N 1 1 361.833 2.969 20 5 FFBDMO CC(C)(C)C[C@@H]1CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)O1 ZINC000782861595 1029839943 /nfs/dbraw/zinc/83/99/43/1029839943.db2.gz XMTPXDPRYLJMBI-CQSZACIVSA-N 1 1 365.434 2.643 20 5 FFBDMO Cc1[nH+]cc2n1CCN(c1ccc(-c3ccc(F)c([N+](=O)[O-])c3)nn1)C2 ZINC001165386924 1029962352 /nfs/dbraw/zinc/96/23/52/1029962352.db2.gz FSIKXXFSTPKVID-UHFFFAOYSA-N 1 1 354.345 2.716 20 5 FFBDMO CN(C)C1=[NH+]OC2(C1)CCN(c1nccc3cc([N+](=O)[O-])ccc31)CC2 ZINC001166031231 1030212378 /nfs/dbraw/zinc/21/23/78/1030212378.db2.gz CVMSRFOYSWTPRK-UHFFFAOYSA-N 1 1 355.398 2.777 20 5 FFBDMO O=C(CC[N@H+]1CC[C@H](c2ccccn2)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000799191052 1031688213 /nfs/dbraw/zinc/68/82/13/1031688213.db2.gz HZKQZUNDPHDUNR-ZDUSSCGKSA-N 1 1 358.373 2.947 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799196288 1031690120 /nfs/dbraw/zinc/69/01/20/1031690120.db2.gz MCKYGFNYTTURTM-AWEZNQCLSA-N 1 1 370.409 2.817 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])c1 ZINC000799196290 1031691180 /nfs/dbraw/zinc/69/11/80/1031691180.db2.gz MCKYGFNYTTURTM-CQSZACIVSA-N 1 1 370.409 2.817 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@H]2CC[NH+]2CCC(C)CC2)c1[N+](=O)[O-] ZINC001151737586 1032018958 /nfs/dbraw/zinc/01/89/58/1032018958.db2.gz FBWBUWUCCGHQOT-AWEZNQCLSA-N 1 1 363.462 2.607 20 5 FFBDMO O=C1OCCN1C[C@@H]1CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000830125050 1033474838 /nfs/dbraw/zinc/47/48/38/1033474838.db2.gz TZMSWSAQHPLYOG-CYBMUJFWSA-N 1 1 372.381 2.524 20 5 FFBDMO O=C1OCCN1C[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000830125050 1033474845 /nfs/dbraw/zinc/47/48/45/1033474845.db2.gz TZMSWSAQHPLYOG-CYBMUJFWSA-N 1 1 372.381 2.524 20 5 FFBDMO COc1ncnc(N[C@@H]2CC[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]32)c1[N+](=O)[O-] ZINC000312976076 1033705292 /nfs/dbraw/zinc/70/52/92/1033705292.db2.gz KWCKSZVYKIQZBA-ARFHVFGLSA-N 1 1 369.425 2.716 20 5 FFBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1 ZINC000831563143 1034125653 /nfs/dbraw/zinc/12/56/53/1034125653.db2.gz KTBWLYMTUQILBV-MRVWCRGKSA-N 1 1 371.359 2.998 20 5 FFBDMO O=C1C[C@H]2C[C@@H](Oc3ccc([N+](=O)[O-])cn3)[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001225634751 1034346323 /nfs/dbraw/zinc/34/63/23/1034346323.db2.gz NXVUSHQIDZUPEF-CGTJXYLNSA-N 1 1 353.378 2.743 20 5 FFBDMO C[N@@H+]1[C@@H]2C[C@H](Oc3ccc(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225658309 1034353449 /nfs/dbraw/zinc/35/34/49/1034353449.db2.gz FAEIKPCBFNXATJ-PXWWUCIGSA-N 1 1 355.188 2.540 20 5 FFBDMO C[N@H+]1[C@@H]2C[C@H](Oc3ccc(Br)cc3[N+](=O)[O-])[C@H]1CC(=O)C2 ZINC001225658309 1034353463 /nfs/dbraw/zinc/35/34/63/1034353463.db2.gz FAEIKPCBFNXATJ-PXWWUCIGSA-N 1 1 355.188 2.540 20 5 FFBDMO CO[C@H]1C[C@H]([N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C12CCC2 ZINC000832208860 1034631816 /nfs/dbraw/zinc/63/18/16/1034631816.db2.gz DLDVAIHUFVGTLP-HOTGVXAUSA-N 1 1 365.405 2.952 20 5 FFBDMO COC(=O)c1cc(OC)c(O[C@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC001226365517 1034653473 /nfs/dbraw/zinc/65/34/73/1034653473.db2.gz ZLERIXIUZQSVKW-ZDUSSCGKSA-N 1 1 352.387 2.642 20 5 FFBDMO O=c1[nH]c(=O)c2c([nH]1)CC[N@@H+](Cc1ccc3ccc4cccnc4c3n1)C2 ZINC001232223634 1035504044 /nfs/dbraw/zinc/50/40/44/1035504044.db2.gz QUONRMIXHBALJZ-UHFFFAOYSA-N 1 1 359.389 2.543 20 5 FFBDMO c1cnc2c(c1)ccc1ccc(C[NH+]3CCN(c4cncnc4)CC3)nc12 ZINC001232224426 1035505995 /nfs/dbraw/zinc/50/59/95/1035505995.db2.gz ICLBSKYQXRDYFY-UHFFFAOYSA-N 1 1 356.433 2.895 20 5 FFBDMO CO[C@@H]1CC[N@@H+](CCOc2cc([N+](=O)[O-])c(Br)cc2F)C1 ZINC001228943096 1036421610 /nfs/dbraw/zinc/42/16/10/1036421610.db2.gz XQMGSYGMWGGBAM-SECBINFHSA-N 1 1 363.183 2.596 20 5 FFBDMO Cc1nc(O[C@H]2[C@@H]3CC[C@H]2C[N@@H+](Cc2ccccc2)C3)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381889 1036644712 /nfs/dbraw/zinc/64/47/12/1036644712.db2.gz PLFXMYVXERTAGS-QLPKVWCKSA-N 1 1 370.409 2.688 20 5 FFBDMO Cc1nc(O[C@H]2[C@@H]3CC[C@H]2C[N@H+](Cc2ccccc2)C3)c([N+](=O)[O-])c(=O)[nH]1 ZINC001229381889 1036644719 /nfs/dbraw/zinc/64/47/19/1036644719.db2.gz PLFXMYVXERTAGS-QLPKVWCKSA-N 1 1 370.409 2.688 20 5 FFBDMO C[N@H+]1CCC[C@@H](Oc2ccc(I)c([N+](=O)[O-])c2)C1 ZINC001229945647 1036991967 /nfs/dbraw/zinc/99/19/67/1036991967.db2.gz ALWQDMLMGWKMSV-SNVBAGLBSA-N 1 1 362.167 2.672 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H]3C(C)(C)O)CC2)ccc1[N+](=O)[O-] ZINC001256100772 1038385463 /nfs/dbraw/zinc/38/54/63/1038385463.db2.gz OSUWHNCMULXFKO-GOSISDBHSA-N 1 1 363.458 2.808 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346742 1038485854 /nfs/dbraw/zinc/48/58/54/1038485854.db2.gz KYXCKOTXOOSSSN-NVXWUHKLSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001256346742 1038485857 /nfs/dbraw/zinc/48/58/57/1038485857.db2.gz KYXCKOTXOOSSSN-NVXWUHKLSA-N 1 1 373.384 2.918 20 5 FFBDMO Cc1cc(-c2nnc(CC[N@H+]3C[C@@H](C)O[C@@H](C)C3)o2)cc(C)c1[N+](=O)[O-] ZINC001258019423 1039117434 /nfs/dbraw/zinc/11/74/34/1039117434.db2.gz NQKQDWFFKNOPEB-OKILXGFUSA-N 1 1 360.414 2.913 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)NC[C@@H]([NH3+])Cc2ccccc2)c1F ZINC001246299963 1039303380 /nfs/dbraw/zinc/30/33/80/1039303380.db2.gz NQOOFENYBWEOFD-ZFWWWQNUSA-N 1 1 361.417 2.833 20 5 FFBDMO [NH3+][C@H](Cc1c[nH]cn1)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247103542 1039609270 /nfs/dbraw/zinc/60/92/70/1039609270.db2.gz YCAUOGYCLMYADO-CQSZACIVSA-N 1 1 357.377 2.799 20 5 FFBDMO [NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccc3c(c2)OCO3)no1 ZINC001248208083 1040172205 /nfs/dbraw/zinc/17/22/05/1040172205.db2.gz HNDILSNMEKHQJN-CYBMUJFWSA-N 1 1 354.322 2.616 20 5 FFBDMO Cn1ncc2cc(-c3noc([C@@H]([NH3+])Cc4ccc([N+](=O)[O-])cc4)n3)ccc21 ZINC001248210977 1040174506 /nfs/dbraw/zinc/17/45/06/1040174506.db2.gz YLMIWLBUULISSY-HNNXBMFYSA-N 1 1 364.365 2.774 20 5 FFBDMO O=C(C[N@@H+]1CC[C@H]2CCCC[C@H]2C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001248442355 1040277818 /nfs/dbraw/zinc/27/78/18/1040277818.db2.gz XFJIMINYCICVAN-OLZOCXBDSA-N 1 1 361.398 2.774 20 5 FFBDMO O=C(C[N@H+]1CC[C@H]2CCCC[C@H]2C1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC001248442355 1040277839 /nfs/dbraw/zinc/27/78/39/1040277839.db2.gz XFJIMINYCICVAN-OLZOCXBDSA-N 1 1 361.398 2.774 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c([N+](=O)[O-])s1 ZINC001213164961 1040298603 /nfs/dbraw/zinc/29/86/03/1040298603.db2.gz HGZUVNFJOLMCLE-GFCCVEGCSA-N 1 1 373.500 2.650 20 5 FFBDMO O=[N+]([O-])c1cccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCCCC2)c1 ZINC001213444733 1040559673 /nfs/dbraw/zinc/55/96/73/1040559673.db2.gz QKFZAXYFKDIQLH-INIZCTEOSA-N 1 1 367.471 2.670 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1)C1CC1 ZINC001254483694 1040749561 /nfs/dbraw/zinc/74/95/61/1040749561.db2.gz WMOMRFCPGUZESB-MRXNPFEDSA-N 1 1 372.469 2.554 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001254557533 1040798008 /nfs/dbraw/zinc/79/80/08/1040798008.db2.gz QEHCZLKHAIHWRR-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCc2onc(Cn3cccn3)c2C1 ZINC001254557533 1040798019 /nfs/dbraw/zinc/79/80/19/1040798019.db2.gz QEHCZLKHAIHWRR-CQSZACIVSA-N 1 1 367.409 2.817 20 5 FFBDMO CC(C)N(C)Cc1nn([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)c2c1CC[NH2+]C2 ZINC001254598771 1040829924 /nfs/dbraw/zinc/82/99/24/1040829924.db2.gz XIYMGJHEUDEDQK-KRWDZBQOSA-N 1 1 369.469 2.617 20 5 FFBDMO Cc1cnc(O[C@@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)nc1 ZINC001254605325 1040834616 /nfs/dbraw/zinc/83/46/16/1040834616.db2.gz BERONEIKSAGBBT-QZTJIDSGSA-N 1 1 354.410 2.704 20 5 FFBDMO COC(=O)[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1c1ccccc1 ZINC001254608770 1040837296 /nfs/dbraw/zinc/83/72/96/1040837296.db2.gz BMOMYFNJIKNFGO-AQNXPRMDSA-N 1 1 366.417 2.951 20 5 FFBDMO COc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)c1 ZINC001254610262 1040840074 /nfs/dbraw/zinc/84/00/74/1040840074.db2.gz ISFVKYTZZQJOTJ-SJLPKXTDSA-N 1 1 355.394 2.619 20 5 FFBDMO CC(C)[N@H+]1CCc2c(c3ccccc3n2CC(=O)OC[C@@H](C)[N+](=O)[O-])C1 ZINC000813115786 1041109492 /nfs/dbraw/zinc/10/94/92/1041109492.db2.gz ZOQAHWLWQNFVSS-CQSZACIVSA-N 1 1 359.426 2.616 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@@H+]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC001320887275 1045488194 /nfs/dbraw/zinc/48/81/94/1045488194.db2.gz BOPSFMMYMNNIRX-CABCVRRESA-N 1 1 352.456 2.881 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[N@H+]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC001320887275 1045488198 /nfs/dbraw/zinc/48/81/98/1045488198.db2.gz BOPSFMMYMNNIRX-CABCVRRESA-N 1 1 352.456 2.881 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@@H+](C)Cc2ccccc2)C1 ZINC001323222532 1045511101 /nfs/dbraw/zinc/51/11/01/1045511101.db2.gz XYGUAJKYECGEFR-KRWDZBQOSA-N 1 1 368.437 2.983 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001321114601 1045551305 /nfs/dbraw/zinc/55/13/05/1045551305.db2.gz YFGYKTMTBQFIQY-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001321114601 1045551318 /nfs/dbraw/zinc/55/13/18/1045551318.db2.gz YFGYKTMTBQFIQY-FUHWJXTLSA-N 1 1 373.384 2.918 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001323033251 1046314932 /nfs/dbraw/zinc/31/49/32/1046314932.db2.gz LWVKBRHWMOVCFL-SFHVURJKSA-N 1 1 352.394 2.807 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001323033251 1046314943 /nfs/dbraw/zinc/31/49/43/1046314943.db2.gz LWVKBRHWMOVCFL-SFHVURJKSA-N 1 1 352.394 2.807 20 5 FFBDMO COc1ccc(CC[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC001331534129 1047988247 /nfs/dbraw/zinc/98/82/47/1047988247.db2.gz SJTKJZKXWOKRFA-GOSISDBHSA-N 1 1 367.409 2.654 20 5 FFBDMO O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c2ccccc21 ZINC001332182427 1048286597 /nfs/dbraw/zinc/28/65/97/1048286597.db2.gz BCKGASKTQUEZOC-OAHLLOKOSA-N 1 1 356.426 2.834 20 5 FFBDMO Cc1ccccc1C[N@@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2F)C1 ZINC001307190061 1049914777 /nfs/dbraw/zinc/91/47/77/1049914777.db2.gz OFGOISSSDNWHGC-MRXNPFEDSA-N 1 1 360.389 2.750 20 5 FFBDMO Cc1ccccc1C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2F)C1 ZINC001307190061 1049914781 /nfs/dbraw/zinc/91/47/81/1049914781.db2.gz OFGOISSSDNWHGC-MRXNPFEDSA-N 1 1 360.389 2.750 20 5 FFBDMO Cn1c([C@H]2CCC[N@@H+](C)C2)nnc1N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001340007459 1050419292 /nfs/dbraw/zinc/41/92/92/1050419292.db2.gz JGZNIDNFYZNZRO-HNNXBMFYSA-N 1 1 370.457 2.702 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC001342038241 1050635209 /nfs/dbraw/zinc/63/52/09/1050635209.db2.gz VDHMPWVIGQCOMJ-CQSZACIVSA-N 1 1 372.425 2.554 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CC[C@@H](SC)C2)c([N+](=O)[O-])c1 ZINC001340800039 1051145564 /nfs/dbraw/zinc/14/55/64/1051145564.db2.gz ALXNUBXNBZAHPO-WCQYABFASA-N 1 1 353.444 2.758 20 5 FFBDMO CCn1c(C[N+](=O)[O-])nnc1N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC001342650853 1051258122 /nfs/dbraw/zinc/25/81/22/1051258122.db2.gz HJTRLLSLXDGLOW-OAHLLOKOSA-N 1 1 364.494 2.556 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC001343003608 1051620436 /nfs/dbraw/zinc/62/04/36/1051620436.db2.gz XPZIXRHBRPDCEL-MSOLQXFVSA-N 1 1 360.458 2.796 20 5 FFBDMO CC[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1 ZINC001306660134 1052160315 /nfs/dbraw/zinc/16/03/15/1052160315.db2.gz LVMSGAKBRJKMJP-INIZCTEOSA-N 1 1 371.441 2.546 20 5 FFBDMO NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC001308111500 1052409656 /nfs/dbraw/zinc/40/96/56/1052409656.db2.gz VBKGDQNHOUVCJJ-NHYWBVRUSA-N 1 1 357.332 2.701 20 5 FFBDMO Cc1[nH+]ccn1CCn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCCC1 ZINC001542980858 1071350681 /nfs/dbraw/zinc/35/06/81/1071350681.db2.gz PWLNYRWBGOMIJB-UHFFFAOYSA-N 1 1 367.413 2.659 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001336294088 1053905393 /nfs/dbraw/zinc/90/53/93/1053905393.db2.gz DVAUKCCUQLOYGW-KDURUIRLSA-N 1 1 358.442 2.585 20 5 FFBDMO O=C(O[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 ZINC001348361235 1054653251 /nfs/dbraw/zinc/65/32/51/1054653251.db2.gz CDDMLAZHDRTAMF-WMZOPIPTSA-N 1 1 370.409 2.623 20 5 FFBDMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])[C@@H]2C1 ZINC001337834529 1055046154 /nfs/dbraw/zinc/04/61/54/1055046154.db2.gz PPBQMVYJPSBEAS-RLCGTCKNSA-N 1 1 358.225 2.972 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176520 1055183944 /nfs/dbraw/zinc/18/39/44/1055183944.db2.gz BXVLQIZKDDWJTR-DRXRFOTISA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176520 1055183951 /nfs/dbraw/zinc/18/39/51/1055183951.db2.gz BXVLQIZKDDWJTR-DRXRFOTISA-N 1 1 361.442 2.612 20 5 FFBDMO CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC001356351147 1055467723 /nfs/dbraw/zinc/46/77/23/1055467723.db2.gz IOHXSDSUZVOODC-NVXWUHKLSA-N 1 1 372.473 2.594 20 5 FFBDMO COc1ccc([C@H]2CN(C(=O)c3c(C)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001339114086 1056105972 /nfs/dbraw/zinc/10/59/72/1056105972.db2.gz BUMNBIJEOIWRAJ-MRXNPFEDSA-N 1 1 355.394 2.699 20 5 FFBDMO COCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C ZINC001339263506 1056267617 /nfs/dbraw/zinc/26/76/17/1056267617.db2.gz GTUHXCGXRPJCAE-AWEZNQCLSA-N 1 1 367.471 2.547 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1-c1nnc(N2CCC[N@H+](C(C)C)CC2)n1C ZINC001339270433 1056272729 /nfs/dbraw/zinc/27/27/29/1056272729.db2.gz AFEIBDXGYQOULD-UHFFFAOYSA-N 1 1 372.473 2.873 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@H+](C)CCO1 ZINC000619527315 1056555499 /nfs/dbraw/zinc/55/54/99/1056555499.db2.gz HHABEHLAVPCCIL-LRDDRELGSA-N 1 1 360.389 2.927 20 5 FFBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)[C@@H]1C[N@@H+](C)CCO1 ZINC000619527315 1056555511 /nfs/dbraw/zinc/55/55/11/1056555511.db2.gz HHABEHLAVPCCIL-LRDDRELGSA-N 1 1 360.389 2.927 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848476566 1060098443 /nfs/dbraw/zinc/09/84/43/1060098443.db2.gz AYDGYFSKRMFKIS-SFHVURJKSA-N 1 1 374.485 2.674 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000848481646 1060119312 /nfs/dbraw/zinc/11/93/12/1060119312.db2.gz BBVNPTUNUFXBNZ-SCTDSRPQSA-N 1 1 373.453 2.617 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000848490236 1060146196 /nfs/dbraw/zinc/14/61/96/1060146196.db2.gz XUXSHLQLLNQREB-DOTOQJQBSA-N 1 1 365.380 2.989 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000848490236 1060146210 /nfs/dbraw/zinc/14/62/10/1060146210.db2.gz XUXSHLQLLNQREB-DOTOQJQBSA-N 1 1 365.380 2.989 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1 ZINC000848587543 1060319511 /nfs/dbraw/zinc/31/95/11/1060319511.db2.gz JHXFRLKGRDFVCU-ZDUSSCGKSA-N 1 1 371.384 2.757 20 5 FFBDMO C[N@H+]1CCC[C@]2(CCN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000848591522 1060322516 /nfs/dbraw/zinc/32/25/16/1060322516.db2.gz VDIKUNAEBKPALE-INIZCTEOSA-N 1 1 369.368 2.511 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001475360108 1061062095 /nfs/dbraw/zinc/06/20/95/1061062095.db2.gz LZTJRNFJTZNSIT-AWEZNQCLSA-N 1 1 357.476 2.610 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])c2ncccc12)c1cnn(-c2cc[nH+]cc2)c1 ZINC001521954185 1061329513 /nfs/dbraw/zinc/32/95/13/1061329513.db2.gz PPUBZHCSVVNCAS-UHFFFAOYSA-N 1 1 360.333 2.976 20 5 FFBDMO C[C@H](Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N(C)C1CC1)[N@@H+](C)C1CC1 ZINC001360536354 1061980593 /nfs/dbraw/zinc/98/05/93/1061980593.db2.gz MBLLYSGTTBZRHQ-CYBMUJFWSA-N 1 1 370.457 2.935 20 5 FFBDMO C[C@H]1CC[N@@H+](CCNC(=O)N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001479476662 1062452637 /nfs/dbraw/zinc/45/26/37/1062452637.db2.gz NAPCDZOZGWIFTF-DOTOQJQBSA-N 1 1 360.458 2.826 20 5 FFBDMO C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777718 1064448889 /nfs/dbraw/zinc/44/88/89/1064448889.db2.gz MANFZIOZHUQHMR-IFXJQAMLSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC001470777718 1064448895 /nfs/dbraw/zinc/44/88/95/1064448895.db2.gz MANFZIOZHUQHMR-IFXJQAMLSA-N 1 1 369.421 2.941 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001472804344 1065148266 /nfs/dbraw/zinc/14/82/66/1065148266.db2.gz XVFIIWXVTZYJAJ-UHFFFAOYSA-N 1 1 359.386 2.759 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CCN(Cc2ccccc2)C1 ZINC001473416821 1065259766 /nfs/dbraw/zinc/25/97/66/1065259766.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@H+](Cc2ccccc2)C1 ZINC001473416821 1065259778 /nfs/dbraw/zinc/25/97/78/1065259778.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO CN(CCc1cccc([N+](=O)[O-])c1)C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC001473416821 1065259787 /nfs/dbraw/zinc/25/97/87/1065259787.db2.gz VIOLRXNMFWDQAT-OAQYLSRUSA-N 1 1 369.465 2.706 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]12COC[C@@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C2 ZINC001473630159 1065302560 /nfs/dbraw/zinc/30/25/60/1065302560.db2.gz TUNWESRZZKRTNJ-UGSOOPFHSA-N 1 1 366.389 2.524 20 5 FFBDMO CC(C)(C)OC(=O)[C@@]12COC[C@@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C2 ZINC001473630159 1065302568 /nfs/dbraw/zinc/30/25/68/1065302568.db2.gz TUNWESRZZKRTNJ-UGSOOPFHSA-N 1 1 366.389 2.524 20 5 FFBDMO O=C1NCCC2(CC[NH+](Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)O1 ZINC001473845941 1065388554 /nfs/dbraw/zinc/38/85/54/1065388554.db2.gz FKCPMELKIRDWTD-UHFFFAOYSA-N 1 1 372.381 2.714 20 5 FFBDMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NCc1c(Br)cccc1[N+](=O)[O-] ZINC001474060808 1065448948 /nfs/dbraw/zinc/44/89/48/1065448948.db2.gz BJPMDCKOBHMODW-IINYFYTJSA-N 1 1 354.248 2.930 20 5 FFBDMO CCCCOc1ccc(NC(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)cn1 ZINC001577471098 1078364962 /nfs/dbraw/zinc/36/49/62/1078364962.db2.gz NUQDOJMYXQBFPV-SFHVURJKSA-N 1 1 358.398 2.981 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1Cc2cccc(-c3nn[nH]n3)c2C1 ZINC001581213903 1078939540 /nfs/dbraw/zinc/93/95/40/1078939540.db2.gz QDUPBMVUOWZDPW-UHFFFAOYSA-N 1 1 350.382 2.908 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1Cc2cccc(-c3nn[nH]n3)c2C1 ZINC001581213903 1078939542 /nfs/dbraw/zinc/93/95/42/1078939542.db2.gz QDUPBMVUOWZDPW-UHFFFAOYSA-N 1 1 350.382 2.908 20 5 FFBDMO Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001557763978 1075886009 /nfs/dbraw/zinc/88/60/09/1075886009.db2.gz BIALMZSQAYCKAK-INIZCTEOSA-N 1 1 359.357 2.535 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](Cc3ccc(C)cc3)C2)cccc1[N+](=O)[O-] ZINC001558020631 1075929722 /nfs/dbraw/zinc/92/97/22/1075929722.db2.gz QOYRUQZJIMQHIX-INIZCTEOSA-N 1 1 368.437 2.949 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC001560736070 1076295092 /nfs/dbraw/zinc/29/50/92/1076295092.db2.gz GAQJCHCNANGZKR-YOEHRIQHSA-N 1 1 371.437 2.919 20 5 FFBDMO COc1c(O)ccc(CN[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC001560736070 1076295093 /nfs/dbraw/zinc/29/50/93/1076295093.db2.gz GAQJCHCNANGZKR-YOEHRIQHSA-N 1 1 371.437 2.919 20 5 FFBDMO C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C[N@H+]1Cc1ccccc1 ZINC001566338701 1076948022 /nfs/dbraw/zinc/94/80/22/1076948022.db2.gz QCLCYRVGQOFNFO-HIFRSBDPSA-N 1 1 354.410 2.570 20 5 FFBDMO Cc1cc(C)c(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c(C)c1 ZINC001568235615 1077079633 /nfs/dbraw/zinc/07/96/33/1077079633.db2.gz ROOXXTKWCGIDPG-SJLPKXTDSA-N 1 1 359.470 2.796 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]1C ZINC001586370762 1079613822 /nfs/dbraw/zinc/61/38/22/1079613822.db2.gz LHTHYIIXTJIVCQ-XQHKEYJVSA-N 1 1 369.849 2.955 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001586659858 1079664083 /nfs/dbraw/zinc/66/40/83/1079664083.db2.gz PSZLUXJPVCEPQD-IBGZPJMESA-N 1 1 367.449 2.831 20 5 FFBDMO Cc1c(CC(=O)N2CC[N@H+](C)C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC001586659858 1079664086 /nfs/dbraw/zinc/66/40/86/1079664086.db2.gz PSZLUXJPVCEPQD-IBGZPJMESA-N 1 1 367.449 2.831 20 5 FFBDMO C[C@@H](c1cccc(-c2nn[nH]n2)c1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001590043549 1080969872 /nfs/dbraw/zinc/96/98/72/1080969872.db2.gz OTQAGNNWJNGXFB-YVEFUNNKSA-N 1 1 368.397 2.501 20 5 FFBDMO C[C@@]1([NH2+]Cc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC001590148819 1081050644 /nfs/dbraw/zinc/05/06/44/1081050644.db2.gz UPROEDKVEGSGRK-GOSISDBHSA-N 1 1 366.381 2.562 20 5 FFBDMO Cc1cnc(COC(=O)[C@@]2(F)CC[N@H+](C(C)(C)C)C2)c(C)c1[N+](=O)[O-] ZINC000378050165 512563230 /nfs/dbraw/zinc/56/32/30/512563230.db2.gz SCJLXNFTQFFUSX-QGZVFWFLSA-N 1 1 353.394 2.862 20 5 FFBDMO C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000409637444 512113881 /nfs/dbraw/zinc/11/38/81/512113881.db2.gz HKBGBUZANYLXHH-OAHLLOKOSA-N 1 1 368.437 2.570 20 5 FFBDMO C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000409637444 512113885 /nfs/dbraw/zinc/11/38/85/512113885.db2.gz HKBGBUZANYLXHH-OAHLLOKOSA-N 1 1 368.437 2.570 20 5 FFBDMO CCOC(=O)[C@H]1CCC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000026218870 249341389 /nfs/dbraw/zinc/34/13/89/249341389.db2.gz ODJKTBUQEIRPCK-AWEZNQCLSA-N 1 1 363.414 2.507 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000097473663 250065463 /nfs/dbraw/zinc/06/54/63/250065463.db2.gz AZWPQZXLGCTHRH-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO O=C(c1ccccc1)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000097473663 250065467 /nfs/dbraw/zinc/06/54/67/250065467.db2.gz AZWPQZXLGCTHRH-UHFFFAOYSA-N 1 1 369.421 2.822 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1C ZINC000106891195 250295957 /nfs/dbraw/zinc/29/59/57/250295957.db2.gz JXMMKJSWBRFXBN-AWEZNQCLSA-N 1 1 367.471 2.507 20 5 FFBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000152952913 251085198 /nfs/dbraw/zinc/08/51/98/251085198.db2.gz PNKQJXYDRAMVGN-ZDUSSCGKSA-N 1 1 354.410 2.890 20 5 FFBDMO CC[C@H]1C[N@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])CCN1CC(F)F ZINC000153424550 251135833 /nfs/dbraw/zinc/13/58/33/251135833.db2.gz GIPACIOSLVHAQE-ZDUSSCGKSA-N 1 1 373.400 2.644 20 5 FFBDMO CC[C@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])CCN1CC(F)F ZINC000153424550 251135834 /nfs/dbraw/zinc/13/58/34/251135834.db2.gz GIPACIOSLVHAQE-ZDUSSCGKSA-N 1 1 373.400 2.644 20 5 FFBDMO Cn1cc(C[N@@H+](C)C[C@@H]2CCCC[C@@H]2O)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000181098989 251241456 /nfs/dbraw/zinc/24/14/56/251241456.db2.gz GWYQKHAXGFFSRA-YJBOKZPZSA-N 1 1 358.442 2.978 20 5 FFBDMO O=C(CC[N@H+]1CCSC2(CCOCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000186811752 251266909 /nfs/dbraw/zinc/26/69/09/251266909.db2.gz KVCLVESFSCERCP-UHFFFAOYSA-N 1 1 365.455 2.521 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[N@@H+]2CCO[C@@H](C)C2)c1 ZINC000192528859 251282641 /nfs/dbraw/zinc/28/26/41/251282641.db2.gz MMTDZTVRQMRHOC-AWEZNQCLSA-N 1 1 373.457 2.952 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[N@H+]2CCO[C@@H](C)C2)c1 ZINC000192528859 251282645 /nfs/dbraw/zinc/28/26/45/251282645.db2.gz MMTDZTVRQMRHOC-AWEZNQCLSA-N 1 1 373.457 2.952 20 5 FFBDMO CCC(CC)(C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(=O)OC ZINC000272544579 252065220 /nfs/dbraw/zinc/06/52/20/252065220.db2.gz PXXSDQMJDRDLSK-MRXNPFEDSA-N 1 1 374.441 2.987 20 5 FFBDMO C[N@H+]1CC[C@H]2CCN(C(=O)NCCCCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000272637981 252088423 /nfs/dbraw/zinc/08/84/23/252088423.db2.gz XXZFFXKZMQFLEP-FUHWJXTLSA-N 1 1 360.458 2.653 20 5 FFBDMO C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 ZINC000272677366 252097408 /nfs/dbraw/zinc/09/74/08/252097408.db2.gz MLWPHGYPEXNQPQ-CYBMUJFWSA-N 1 1 370.409 2.651 20 5 FFBDMO CCOc1cccc(N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000273150083 252233207 /nfs/dbraw/zinc/23/32/07/252233207.db2.gz HLPWRIPFSIJYEK-INIZCTEOSA-N 1 1 362.474 2.600 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000277749898 256234809 /nfs/dbraw/zinc/23/48/09/256234809.db2.gz IZFMWWBFQWHGJU-CYBMUJFWSA-N 1 1 374.445 2.535 20 5 FFBDMO COc1cc(NCCC[N@H+]2CCCO[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000278179556 256285122 /nfs/dbraw/zinc/28/51/22/256285122.db2.gz PNFZDZFDGUKKAT-CYBMUJFWSA-N 1 1 353.419 2.525 20 5 FFBDMO Cc1c(NC(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000278570365 256326746 /nfs/dbraw/zinc/32/67/46/256326746.db2.gz WSIKDRWYLGUEIK-ZDUSSCGKSA-N 1 1 362.430 2.620 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])c1 ZINC000278900835 256359929 /nfs/dbraw/zinc/35/99/29/256359929.db2.gz QYVDCTQBACVIFR-CYBMUJFWSA-N 1 1 372.385 2.878 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)c([N+](=O)[O-])c1 ZINC000278900835 256359931 /nfs/dbraw/zinc/35/99/31/256359931.db2.gz QYVDCTQBACVIFR-CYBMUJFWSA-N 1 1 372.385 2.878 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H](Oc3ncccc3F)C2)c1 ZINC000278905134 256361082 /nfs/dbraw/zinc/36/10/82/256361082.db2.gz SBIOXCNICBLMJF-NVXWUHKLSA-N 1 1 361.373 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](Oc3ncccc3F)C2)c1 ZINC000278905134 256361083 /nfs/dbraw/zinc/36/10/83/256361083.db2.gz SBIOXCNICBLMJF-NVXWUHKLSA-N 1 1 361.373 2.706 20 5 FFBDMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000286266427 257028304 /nfs/dbraw/zinc/02/83/04/257028304.db2.gz BLIZFBFGHRWWIY-CYBMUJFWSA-N 1 1 353.394 2.623 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1 ZINC000288680380 257217838 /nfs/dbraw/zinc/21/78/38/257217838.db2.gz CRJXSCPJMDHXTE-VQTJNVASSA-N 1 1 374.412 2.694 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](c2ccncc2)C1 ZINC000289346542 257275630 /nfs/dbraw/zinc/27/56/30/257275630.db2.gz MNSBGCTWCYPPMI-IRXDYDNUSA-N 1 1 357.410 2.609 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](CO)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000289055828 257252156 /nfs/dbraw/zinc/25/21/56/257252156.db2.gz QWLATAVFWMDGLJ-RYUDHWBXSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](CO)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000289055828 257252158 /nfs/dbraw/zinc/25/21/58/257252158.db2.gz QWLATAVFWMDGLJ-RYUDHWBXSA-N 1 1 374.384 2.840 20 5 FFBDMO CC1(C)C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]1[C@@H]1CCCO1 ZINC000289969475 257309359 /nfs/dbraw/zinc/30/93/59/257309359.db2.gz XELNISAFCGOFOM-RDJZCZTQSA-N 1 1 365.405 2.952 20 5 FFBDMO Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000289603754 257289559 /nfs/dbraw/zinc/28/95/59/257289559.db2.gz WTWCMMSQYUVOLB-UHFFFAOYSA-N 1 1 370.457 2.845 20 5 FFBDMO COCC[N@H+]1CCC[C@@H]1CNc1ccc(Br)cc1[N+](=O)[O-] ZINC000301160057 258030048 /nfs/dbraw/zinc/03/00/48/258030048.db2.gz OWJLRWZUJCSCLN-GFCCVEGCSA-N 1 1 358.236 2.880 20 5 FFBDMO Cc1cc(N[C@H](C)[C@H](C)[NH+]2CCOCC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000301187208 258032672 /nfs/dbraw/zinc/03/26/72/258032672.db2.gz KFNMUTZQGMYGDJ-CABCVRRESA-N 1 1 371.441 2.881 20 5 FFBDMO COc1cc2[nH+]c(NCc3cccc([N+](=O)[O-])c3)nc(N)c2cc1OC ZINC000301271316 258039048 /nfs/dbraw/zinc/03/90/48/258039048.db2.gz VIAUVGWCRUQIRS-UHFFFAOYSA-N 1 1 355.354 2.750 20 5 FFBDMO COC(=O)c1c(C)[nH]c(C(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000299734860 258021237 /nfs/dbraw/zinc/02/12/37/258021237.db2.gz ZZXJXHAICAZYJO-LLVKDONJSA-N 1 1 359.382 2.860 20 5 FFBDMO Cc1cnc(NCc2ccccc2C[N@H+]2CCC[C@H]2CO)c([N+](=O)[O-])c1 ZINC000302059727 258085458 /nfs/dbraw/zinc/08/54/58/258085458.db2.gz SJEWIUNJISEQIY-KRWDZBQOSA-N 1 1 356.426 2.867 20 5 FFBDMO Nc1nc(N[C@@H]2CCC[C@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)ncc1[N+](=O)[O-] ZINC000302200700 258094703 /nfs/dbraw/zinc/09/47/03/258094703.db2.gz ZDZNDCPBRWHGEL-HRCADAONSA-N 1 1 368.441 2.680 20 5 FFBDMO C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591162 258166329 /nfs/dbraw/zinc/16/63/29/258166329.db2.gz OFOIEFKJNMPXSK-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000330591162 258166330 /nfs/dbraw/zinc/16/63/30/258166330.db2.gz OFOIEFKJNMPXSK-VXGBXAGGSA-N 1 1 360.439 2.883 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)cccc1[N+](=O)[O-] ZINC000330703348 258168718 /nfs/dbraw/zinc/16/87/18/258168718.db2.gz JBJJVTWLFBESQT-WMLDXEAASA-N 1 1 363.458 2.961 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H]2CCCC[N@@H+]2C[C@H]1C ZINC000332007022 258209716 /nfs/dbraw/zinc/20/97/16/258209716.db2.gz JJQONTLPJIUVJF-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cn2c(n1)CCCC2 ZINC000373002192 512127233 /nfs/dbraw/zinc/12/72/33/512127233.db2.gz ZSNWETRHNWAAEX-UHFFFAOYSA-N 1 1 357.414 2.588 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cn2c(n1)CCCC2 ZINC000373002192 512127235 /nfs/dbraw/zinc/12/72/35/512127235.db2.gz ZSNWETRHNWAAEX-UHFFFAOYSA-N 1 1 357.414 2.588 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000227347195 509408237 /nfs/dbraw/zinc/40/82/37/509408237.db2.gz JRMUEUOWXNDUTD-CMPLNLGQSA-N 1 1 355.236 2.673 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000032766007 506291970 /nfs/dbraw/zinc/29/19/70/506291970.db2.gz PYJJHPNTKLPHRY-UHFFFAOYSA-N 1 1 367.409 2.723 20 5 FFBDMO C[N@H+](CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000032766007 506291973 /nfs/dbraw/zinc/29/19/73/506291973.db2.gz PYJJHPNTKLPHRY-UHFFFAOYSA-N 1 1 367.409 2.723 20 5 FFBDMO C[N@@H+](CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)Cc1ccccc1 ZINC000032766007 506291975 /nfs/dbraw/zinc/29/19/75/506291975.db2.gz PYJJHPNTKLPHRY-UHFFFAOYSA-N 1 1 367.409 2.723 20 5 FFBDMO COCC[C@H]1CCCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1 ZINC000375103323 512163806 /nfs/dbraw/zinc/16/38/06/512163806.db2.gz CCTHYSRELDNCTL-OAHLLOKOSA-N 1 1 361.442 2.623 20 5 FFBDMO C[C@H]1[C@H](NC(=O)c2cc([O-])ccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000377347245 512226172 /nfs/dbraw/zinc/22/61/72/512226172.db2.gz QVJKBELFWPQPOR-SUMWQHHRSA-N 1 1 355.394 2.693 20 5 FFBDMO CC(C)(C)CCC[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000410308486 512236738 /nfs/dbraw/zinc/23/67/38/512236738.db2.gz WPQSVHYLSSKJSD-UHFFFAOYSA-N 1 1 369.487 2.727 20 5 FFBDMO CCN1CC[NH+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)CC1 ZINC000041621017 506536932 /nfs/dbraw/zinc/53/69/32/506536932.db2.gz KBBXIEOLAPRWKG-UHFFFAOYSA-N 1 1 355.442 2.739 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000041904781 506567064 /nfs/dbraw/zinc/56/70/64/506567064.db2.gz YEHFSVLRVZUKKT-MRXNPFEDSA-N 1 1 362.817 2.984 20 5 FFBDMO CC(C)C[C@@H](CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)[NH+]1CCOCC1 ZINC000041935644 506570124 /nfs/dbraw/zinc/57/01/24/506570124.db2.gz HMTQLUAJSSZYRV-HNNXBMFYSA-N 1 1 374.441 2.553 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](Cc2cccs2)CC1 ZINC000007615399 506575296 /nfs/dbraw/zinc/57/52/96/506575296.db2.gz IBDPRPZBQWDULY-AWEZNQCLSA-N 1 1 374.466 2.801 20 5 FFBDMO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000054981054 506654867 /nfs/dbraw/zinc/65/48/67/506654867.db2.gz RPNVWZZJBIHVHB-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-] ZINC000054981054 506654874 /nfs/dbraw/zinc/65/48/74/506654874.db2.gz RPNVWZZJBIHVHB-CHWSQXEVSA-N 1 1 355.460 2.531 20 5 FFBDMO COc1cccc(C[N@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000067374693 506851060 /nfs/dbraw/zinc/85/10/60/506851060.db2.gz YJSXDPXGMXYFQI-GOSISDBHSA-N 1 1 355.394 2.841 20 5 FFBDMO COc1cccc(C[N@@H+](C)[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)c1 ZINC000067374693 506851070 /nfs/dbraw/zinc/85/10/70/506851070.db2.gz YJSXDPXGMXYFQI-GOSISDBHSA-N 1 1 355.394 2.841 20 5 FFBDMO CCC(CC)[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000045079929 506916635 /nfs/dbraw/zinc/91/66/35/506916635.db2.gz XLVNSGUCKCQKJM-AWEZNQCLSA-N 1 1 355.460 2.523 20 5 FFBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1 ZINC000056168278 506952885 /nfs/dbraw/zinc/95/28/85/506952885.db2.gz LMBOFUVLFJHPMG-DOMZBBRYSA-N 1 1 372.400 2.881 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000016561155 507095833 /nfs/dbraw/zinc/09/58/33/507095833.db2.gz JLABTSVOKFFXOD-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC000016561155 507095843 /nfs/dbraw/zinc/09/58/43/507095843.db2.gz JLABTSVOKFFXOD-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCOc1ccccc1 ZINC000016561169 507096487 /nfs/dbraw/zinc/09/64/87/507096487.db2.gz ISINOEAJDJQBSG-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCOc1ccccc1 ZINC000016561169 507096492 /nfs/dbraw/zinc/09/64/92/507096492.db2.gz ISINOEAJDJQBSG-UHFFFAOYSA-N 1 1 359.382 2.553 20 5 FFBDMO C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000068085442 507105232 /nfs/dbraw/zinc/10/52/32/507105232.db2.gz OXWAEQIICRSNFG-ZIAGYGMSSA-N 1 1 373.457 2.959 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1F ZINC000375424183 512319504 /nfs/dbraw/zinc/31/95/04/512319504.db2.gz GDHOTIZBXCXWEX-NSHDSACASA-N 1 1 362.361 2.992 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c([N+](=O)[O-])cc1F ZINC000375424183 512319509 /nfs/dbraw/zinc/31/95/09/512319509.db2.gz GDHOTIZBXCXWEX-NSHDSACASA-N 1 1 362.361 2.992 20 5 FFBDMO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC000018061476 507135556 /nfs/dbraw/zinc/13/55/56/507135556.db2.gz ZQCSVSHKICAYPE-UHFFFAOYSA-N 1 1 372.381 2.947 20 5 FFBDMO C[N@@H+](CCC(=O)NC(=O)Nc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000046599269 507156412 /nfs/dbraw/zinc/15/64/12/507156412.db2.gz QTVNOVHOWDUZDT-UHFFFAOYSA-N 1 1 356.382 2.765 20 5 FFBDMO CCOc1cc(C(=O)N2CCC[N@H+](C(C)C)CC2)c([N+](=O)[O-])cc1OC ZINC000068782655 507321242 /nfs/dbraw/zinc/32/12/42/507321242.db2.gz MGJNMOXOBKEMBH-UHFFFAOYSA-N 1 1 365.430 2.558 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2nnc3n2CCC3)CC1 ZINC000369282205 512332729 /nfs/dbraw/zinc/33/27/29/512332729.db2.gz ZCWXUQPCWOCQJX-UHFFFAOYSA-N 1 1 357.414 2.521 20 5 FFBDMO C[N@@H+](CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCCC1 ZINC000068900602 507355785 /nfs/dbraw/zinc/35/57/85/507355785.db2.gz YKGNANMRMQNRAV-UHFFFAOYSA-N 1 1 371.441 2.775 20 5 FFBDMO Cc1[nH+]ccn1-c1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cn1 ZINC000069006890 507380660 /nfs/dbraw/zinc/38/06/60/507380660.db2.gz DHHXEBGHSXWJPF-UHFFFAOYSA-N 1 1 371.328 2.641 20 5 FFBDMO CC(C)[N@H+]1CCCN(CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000069084150 507401580 /nfs/dbraw/zinc/40/15/80/507401580.db2.gz COFKZFJDOPDJBA-UHFFFAOYSA-N 1 1 354.838 2.603 20 5 FFBDMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000069530647 507511045 /nfs/dbraw/zinc/51/10/45/507511045.db2.gz NFDJTPRGYRKQKC-AWEZNQCLSA-N 1 1 363.439 2.650 20 5 FFBDMO Cc1cc([N+](=O)[O-])c(S(=O)(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)cc1C ZINC000060443100 507545158 /nfs/dbraw/zinc/54/51/58/507545158.db2.gz ZVCCAVRVXZRPOZ-WFASDCNBSA-N 1 1 369.487 2.610 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCO2 ZINC000026257807 507572690 /nfs/dbraw/zinc/57/26/90/507572690.db2.gz NXLCTSIFXOXKNX-UHFFFAOYSA-N 1 1 357.366 2.784 20 5 FFBDMO Cc1ccsc1C[N@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000061798828 507641385 /nfs/dbraw/zinc/64/13/85/507641385.db2.gz HTVTXPVKWFHAJU-UHFFFAOYSA-N 1 1 363.395 2.764 20 5 FFBDMO Cc1ccsc1C[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000061798828 507641391 /nfs/dbraw/zinc/64/13/91/507641391.db2.gz HTVTXPVKWFHAJU-UHFFFAOYSA-N 1 1 363.395 2.764 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccco1 ZINC000049944324 507644130 /nfs/dbraw/zinc/64/41/30/507644130.db2.gz JZMGEYSYWUPOOJ-KRWDZBQOSA-N 1 1 372.425 2.821 20 5 FFBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1 ZINC000063693216 507759801 /nfs/dbraw/zinc/75/98/01/507759801.db2.gz SKKFCLXXZLMTQP-OAHLLOKOSA-N 1 1 371.441 2.631 20 5 FFBDMO COc1ccccc1OCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000051374505 507765322 /nfs/dbraw/zinc/76/53/22/507765322.db2.gz CBOMKOLJMXTXGE-UHFFFAOYSA-N 1 1 357.410 2.804 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1 ZINC000064725725 507807408 /nfs/dbraw/zinc/80/74/08/507807408.db2.gz XEGSQJYZHYUEFA-HLLBOEOZSA-N 1 1 361.442 2.837 20 5 FFBDMO CCOCC[N@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000107678155 507862618 /nfs/dbraw/zinc/86/26/18/507862618.db2.gz QZDFWAGPWXSIOH-UHFFFAOYSA-N 1 1 374.235 2.654 20 5 FFBDMO CCOCC[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Br ZINC000107678155 507862619 /nfs/dbraw/zinc/86/26/19/507862619.db2.gz QZDFWAGPWXSIOH-UHFFFAOYSA-N 1 1 374.235 2.654 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H](O)c2nccn2C)CC1 ZINC000089924838 507884051 /nfs/dbraw/zinc/88/40/51/507884051.db2.gz OYYUTJQGHVVUGW-GOSISDBHSA-N 1 1 374.441 2.673 20 5 FFBDMO O=C(C[N@H+](C[C@H]1CCCO1)[C@@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000089952757 507890530 /nfs/dbraw/zinc/89/05/30/507890530.db2.gz OFIRMPVLTWCFDQ-ZIAGYGMSSA-N 1 1 365.455 2.520 20 5 FFBDMO O=C(C[N@@H+](C[C@H]1CCCO1)[C@@H]1CCSC1)Nc1ccccc1[N+](=O)[O-] ZINC000089952757 507890532 /nfs/dbraw/zinc/89/05/32/507890532.db2.gz OFIRMPVLTWCFDQ-ZIAGYGMSSA-N 1 1 365.455 2.520 20 5 FFBDMO CCCO[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000108391995 507892341 /nfs/dbraw/zinc/89/23/41/507892341.db2.gz PPTVIXQMGCUHAG-DLBZAZTESA-N 1 1 352.431 2.616 20 5 FFBDMO Cc1cnc(N[C@@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667430 507895236 /nfs/dbraw/zinc/89/52/36/507895236.db2.gz FRKPJFSYZDQZLS-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cnc(N[C@@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)c([N+](=O)[O-])c1 ZINC000078667430 507895239 /nfs/dbraw/zinc/89/52/39/507895239.db2.gz FRKPJFSYZDQZLS-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO C[C@@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000090091924 507908491 /nfs/dbraw/zinc/90/84/91/507908491.db2.gz LPBNXAGRTLMXIJ-HNNXBMFYSA-N 1 1 355.442 2.705 20 5 FFBDMO CCCOc1ccc2c(c1)CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2 ZINC000090564457 507928145 /nfs/dbraw/zinc/92/81/45/507928145.db2.gz NGIAOPPTIQMWAV-UHFFFAOYSA-N 1 1 357.410 2.604 20 5 FFBDMO CCCOc1ccc2c(c1)CC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2 ZINC000090564457 507928147 /nfs/dbraw/zinc/92/81/47/507928147.db2.gz NGIAOPPTIQMWAV-UHFFFAOYSA-N 1 1 357.410 2.604 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000079578272 507978082 /nfs/dbraw/zinc/97/80/82/507978082.db2.gz HGYNXSJUIYXFFZ-CHWSQXEVSA-N 1 1 357.332 2.970 20 5 FFBDMO CC1CCN(c2ccc(C(=O)NC[C@H]3CC[N@@H+](C)C3)cc2[N+](=O)[O-])CC1 ZINC000110653211 508039590 /nfs/dbraw/zinc/03/95/90/508039590.db2.gz WFQWCJTWIXITPV-OAHLLOKOSA-N 1 1 360.458 2.513 20 5 FFBDMO Cc1cc(N[C@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765695 508053075 /nfs/dbraw/zinc/05/30/75/508053075.db2.gz OUYRRRQTEHAZPF-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1cc(N[C@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ncc1[N+](=O)[O-] ZINC000074765695 508053077 /nfs/dbraw/zinc/05/30/77/508053077.db2.gz OUYRRRQTEHAZPF-QAPCUYQASA-N 1 1 356.426 3.000 20 5 FFBDMO CC[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1c1ccccc1 ZINC000074798419 508056281 /nfs/dbraw/zinc/05/62/81/508056281.db2.gz RMABLHTUTRQBLT-MNEFBYGVSA-N 1 1 358.442 2.668 20 5 FFBDMO CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1cc(Cl)c(C)c([N+](=O)[O-])c1 ZINC000111050079 508067186 /nfs/dbraw/zinc/06/71/86/508067186.db2.gz MLMFFSKUKUWACM-JTQLQIEISA-N 1 1 363.867 2.565 20 5 FFBDMO CCOc1cc(NC[C@@H](C)CN2CC[NH+](CC)CC2)ccc1[N+](=O)[O-] ZINC000092612735 508086877 /nfs/dbraw/zinc/08/68/77/508086877.db2.gz UHPAJISVBKMPFO-OAHLLOKOSA-N 1 1 350.463 2.679 20 5 FFBDMO O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCCCCC[NH+]1CCCCC1 ZINC000111357519 508093090 /nfs/dbraw/zinc/09/30/90/508093090.db2.gz DCDFIARQBBVZBP-UHFFFAOYSA-N 1 1 373.450 2.668 20 5 FFBDMO C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000111461198 508101571 /nfs/dbraw/zinc/10/15/71/508101571.db2.gz IHHFMERRNHIRLF-HNNXBMFYSA-N 1 1 356.426 2.915 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](CCc2ccccc2)C2CCCC2)c1 ZINC000075674737 508127071 /nfs/dbraw/zinc/12/70/71/508127071.db2.gz VQKDPSPZHRCIAJ-IBGZPJMESA-N 1 1 358.442 2.640 20 5 FFBDMO C[N@H+](Cc1ccccc1-c1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075681661 508128411 /nfs/dbraw/zinc/12/84/11/508128411.db2.gz ZWTXBPHRKJKQNE-LJQANCHMSA-N 1 1 366.421 2.951 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(OC)c1 ZINC000093534203 508147866 /nfs/dbraw/zinc/14/78/66/508147866.db2.gz MZDVABBPVPHMCF-AWEZNQCLSA-N 1 1 358.398 2.693 20 5 FFBDMO CC(C)c1ccc(C(=O)N[C@@H]2CC[N@@H+](C3CCN(C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534635 512381350 /nfs/dbraw/zinc/38/13/50/512381350.db2.gz QEGZIPKHAJGOGD-MRXNPFEDSA-N 1 1 374.485 2.617 20 5 FFBDMO CC(C)c1ccc(C(=O)N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)cc1[N+](=O)[O-] ZINC000375534635 512381352 /nfs/dbraw/zinc/38/13/52/512381352.db2.gz QEGZIPKHAJGOGD-MRXNPFEDSA-N 1 1 374.485 2.617 20 5 FFBDMO COc1ccccc1C[NH+]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000076343078 508190461 /nfs/dbraw/zinc/19/04/61/508190461.db2.gz QYEKQCWWFAZSFD-UHFFFAOYSA-N 1 1 371.437 2.930 20 5 FFBDMO CCC[N@H+](C)C[C@@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000081569863 508191590 /nfs/dbraw/zinc/19/15/90/508191590.db2.gz AXRHQBUURLCIJU-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000081569863 508191592 /nfs/dbraw/zinc/19/15/92/508191592.db2.gz AXRHQBUURLCIJU-INIZCTEOSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@H+](C)C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000081570825 508191710 /nfs/dbraw/zinc/19/17/10/508191710.db2.gz PTCDCWXPRKVSCW-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO CCC[N@@H+](C)C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000081570825 508191711 /nfs/dbraw/zinc/19/17/11/508191711.db2.gz PTCDCWXPRKVSCW-MRXNPFEDSA-N 1 1 362.474 2.896 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103555384 508317341 /nfs/dbraw/zinc/31/73/41/508317341.db2.gz XJGWKPHVEDEZFK-IYBDPMFKSA-N 1 1 364.465 2.724 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCc2ccccc2C1 ZINC000114488723 508321065 /nfs/dbraw/zinc/32/10/65/508321065.db2.gz PGGOIKVOWDEILF-GOSISDBHSA-N 1 1 365.433 2.973 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])[C@H](C)C1 ZINC000115271985 508379986 /nfs/dbraw/zinc/37/99/86/508379986.db2.gz FUXHSHZKBUDKAW-NVXWUHKLSA-N 1 1 363.458 2.770 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000127319105 508432260 /nfs/dbraw/zinc/43/22/60/508432260.db2.gz ZINRTXZBPSFAJB-QAPCUYQASA-N 1 1 362.474 2.976 20 5 FFBDMO CCC[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1CCOC ZINC000122011746 508466623 /nfs/dbraw/zinc/46/66/23/508466623.db2.gz SPBRAPWZEXDHJT-OAHLLOKOSA-N 1 1 362.430 2.669 20 5 FFBDMO Cc1c(CC(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cccc1[N+](=O)[O-] ZINC000134078348 508490014 /nfs/dbraw/zinc/49/00/14/508490014.db2.gz XWBPAHZHUKUXKQ-VQIMIIECSA-N 1 1 357.454 2.921 20 5 FFBDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)c1cccc([N+](=O)[O-])c1N ZINC000153080754 508546329 /nfs/dbraw/zinc/54/63/29/508546329.db2.gz KWOPLGVNBGEECO-UHFFFAOYSA-N 1 1 356.426 2.817 20 5 FFBDMO COc1ccc(OCC[N@@H+](C)CCc2ncc(C)s2)c([N+](=O)[O-])c1 ZINC000157307967 508550424 /nfs/dbraw/zinc/55/04/24/508550424.db2.gz LFYQFFWTDZHCCR-UHFFFAOYSA-N 1 1 351.428 2.922 20 5 FFBDMO O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCc2sccc2C1 ZINC000153392821 508578304 /nfs/dbraw/zinc/57/83/04/508578304.db2.gz QVHSHTWNLZMZHR-UHFFFAOYSA-N 1 1 371.462 2.989 20 5 FFBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCN(Cc3ccc(Cl)cc3)CC2)c1 ZINC000157543905 508578792 /nfs/dbraw/zinc/57/87/92/508578792.db2.gz OBJBMDBWDSTSFX-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)c1 ZINC000157543905 508578794 /nfs/dbraw/zinc/57/87/94/508578794.db2.gz OBJBMDBWDSTSFX-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO O=[N+]([O-])c1cnn(CCN2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)c1 ZINC000157543905 508578796 /nfs/dbraw/zinc/57/87/96/508578796.db2.gz OBJBMDBWDSTSFX-UHFFFAOYSA-N 1 1 363.849 2.653 20 5 FFBDMO C[NH+](C)[C@@H](CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000122991554 508619437 /nfs/dbraw/zinc/61/94/37/508619437.db2.gz FTPKLWBZWDUEAG-INIZCTEOSA-N 1 1 356.382 2.631 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153825291 508656914 /nfs/dbraw/zinc/65/69/14/508656914.db2.gz WTLIIOIYQAAPKG-KYJSFNMBSA-N 1 1 363.458 2.645 20 5 FFBDMO CC(=O)c1ccc(OC[C@H](O)C[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000153839517 508660165 /nfs/dbraw/zinc/66/01/65/508660165.db2.gz CHZQOXALHKFWKK-GOSISDBHSA-N 1 1 370.405 2.595 20 5 FFBDMO CC(=O)c1ccc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC000153839517 508660167 /nfs/dbraw/zinc/66/01/67/508660167.db2.gz CHZQOXALHKFWKK-GOSISDBHSA-N 1 1 370.405 2.595 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC ZINC000123350268 508673512 /nfs/dbraw/zinc/67/35/12/508673512.db2.gz ZCGNFKRNIRLLIY-CHWSQXEVSA-N 1 1 365.430 2.557 20 5 FFBDMO Cn1cc(C[N@@H+](CCO)Cc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000158289273 508683527 /nfs/dbraw/zinc/68/35/27/508683527.db2.gz BJLQLFGDWMARTA-UHFFFAOYSA-N 1 1 366.421 2.990 20 5 FFBDMO COC(=O)c1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(F)c1 ZINC000136402501 508692352 /nfs/dbraw/zinc/69/23/52/508692352.db2.gz JCHDRCGENNKDBF-AWEZNQCLSA-N 1 1 374.372 2.602 20 5 FFBDMO COC(=O)c1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(F)c1 ZINC000136402501 508692357 /nfs/dbraw/zinc/69/23/57/508692357.db2.gz JCHDRCGENNKDBF-AWEZNQCLSA-N 1 1 374.372 2.602 20 5 FFBDMO CN(CC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1)c1ccccc1[N+](=O)[O-] ZINC000154012349 508698936 /nfs/dbraw/zinc/69/89/36/508698936.db2.gz LQQNTLQXGWRPDS-NVXWUHKLSA-N 1 1 372.469 2.506 20 5 FFBDMO CSc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3cc(C)cc[nH+]3)CC2)c1 ZINC000158838628 508758368 /nfs/dbraw/zinc/75/83/68/508758368.db2.gz OJHNLAWZNKYZNO-UHFFFAOYSA-N 1 1 372.450 2.983 20 5 FFBDMO COc1ccc(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000119619976 508830513 /nfs/dbraw/zinc/83/05/13/508830513.db2.gz SXODRSZEHVVRLM-YOEHRIQHSA-N 1 1 369.421 2.854 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000130752830 508840994 /nfs/dbraw/zinc/84/09/94/508840994.db2.gz SKDUESOTXWXHLK-INIZCTEOSA-N 1 1 357.414 2.735 20 5 FFBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000130752830 508840997 /nfs/dbraw/zinc/84/09/97/508840997.db2.gz SKDUESOTXWXHLK-INIZCTEOSA-N 1 1 357.414 2.735 20 5 FFBDMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000159516985 508852172 /nfs/dbraw/zinc/85/21/72/508852172.db2.gz AGNSKMHBZJTQLV-YPMHNXCESA-N 1 1 360.439 2.804 20 5 FFBDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000159633238 508868819 /nfs/dbraw/zinc/86/88/19/508868819.db2.gz RGGQZHSIBIEFHR-UHFFFAOYSA-N 1 1 369.849 2.679 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000119841236 508874270 /nfs/dbraw/zinc/87/42/70/508874270.db2.gz RPWNZFGHIWXNIO-KSSFIOAISA-N 1 1 369.421 2.854 20 5 FFBDMO Cc1[nH+]ccn1CCCCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000124731615 508876598 /nfs/dbraw/zinc/87/65/98/508876598.db2.gz LENXMFFCYDRWSF-UHFFFAOYSA-N 1 1 357.414 2.648 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(OC(F)(F)F)cc1 ZINC000131028048 508878992 /nfs/dbraw/zinc/87/89/92/508878992.db2.gz BZNICJQTKLNXGH-UHFFFAOYSA-N 1 1 371.315 2.787 20 5 FFBDMO COc1ccc(CN2CC[NH+]([C@H](C)c3cccnc3)CC2)cc1[N+](=O)[O-] ZINC000120505138 509010065 /nfs/dbraw/zinc/01/00/65/509010065.db2.gz UWODXYPOENFCRK-OAHLLOKOSA-N 1 1 356.426 2.877 20 5 FFBDMO C[NH+](C)CCCC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000132578261 509047993 /nfs/dbraw/zinc/04/79/93/509047993.db2.gz SVWHQXRUVBKUSS-UHFFFAOYSA-N 1 1 359.430 2.665 20 5 FFBDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000120871431 509080181 /nfs/dbraw/zinc/08/01/81/509080181.db2.gz AGYJGDZJJFFLBK-KRWDZBQOSA-N 1 1 362.474 2.901 20 5 FFBDMO CCN1CCN(C[C@H](C)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121124388 509133188 /nfs/dbraw/zinc/13/31/88/509133188.db2.gz CMUHXOSNRLJQAL-YLJYHZDGSA-N 1 1 374.529 2.779 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1(O)CCCC1 ZINC000152061196 509138432 /nfs/dbraw/zinc/13/84/32/509138432.db2.gz FGSUSRUGBZVVQE-NSHDSACASA-N 1 1 355.822 2.812 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]C2(c3cccc(F)c3)CC2)cc1 ZINC000182430615 509235085 /nfs/dbraw/zinc/23/50/85/509235085.db2.gz RWVWAZPPMZUOCN-UHFFFAOYSA-N 1 1 364.398 2.787 20 5 FFBDMO CCC[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC ZINC000163242269 509355608 /nfs/dbraw/zinc/35/56/08/509355608.db2.gz BCPZUFWZEJUGEN-INIZCTEOSA-N 1 1 364.446 2.868 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000173039635 509363874 /nfs/dbraw/zinc/36/38/74/509363874.db2.gz OQJUMHSJCMDTKG-LJQANCHMSA-N 1 1 353.422 2.918 20 5 FFBDMO C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000176207773 509378417 /nfs/dbraw/zinc/37/84/17/509378417.db2.gz NXQKHHPYRQLGOP-DZGCQCFKSA-N 1 1 371.224 2.688 20 5 FFBDMO C[C@H]1C[C@H]([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CCN1Cc1ccccc1 ZINC000176251006 509402896 /nfs/dbraw/zinc/40/28/96/509402896.db2.gz KBFZPODSEAHQJZ-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@@H+]1Cc1ccccc1 ZINC000176251006 509402903 /nfs/dbraw/zinc/40/29/03/509402903.db2.gz KBFZPODSEAHQJZ-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H]1C[C@H](N(C)CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1Cc1ccccc1 ZINC000176251006 509402912 /nfs/dbraw/zinc/40/29/12/509402912.db2.gz KBFZPODSEAHQJZ-FUHWJXTLSA-N 1 1 357.458 2.776 20 5 FFBDMO C[C@H](NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831075 509446785 /nfs/dbraw/zinc/44/67/85/509446785.db2.gz GUIWDXQROKXZCK-QWHCGFSZSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000182831075 509446791 /nfs/dbraw/zinc/44/67/91/509446791.db2.gz GUIWDXQROKXZCK-QWHCGFSZSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182831075 509446799 /nfs/dbraw/zinc/44/67/99/509446799.db2.gz GUIWDXQROKXZCK-QWHCGFSZSA-N 1 1 371.441 2.854 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000267428319 509476447 /nfs/dbraw/zinc/47/64/47/509476447.db2.gz CCYFAPWRIXRXOA-PWSUYJOCSA-N 1 1 370.247 2.912 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CC[N@H+](CC)C[C@@H]1C ZINC000173256878 509484221 /nfs/dbraw/zinc/48/42/21/509484221.db2.gz GVPRHDCWBZJQQA-XJKSGUPXSA-N 1 1 369.487 2.508 20 5 FFBDMO O=[N+]([O-])c1ccc(CC[NH+]2CCC(CCCN3CCOCC3)CC2)cc1 ZINC000182979251 509528404 /nfs/dbraw/zinc/52/84/04/509528404.db2.gz CDPCQZVKORMMGB-UHFFFAOYSA-N 1 1 361.486 2.962 20 5 FFBDMO COC(=O)c1cnc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000189362961 509540084 /nfs/dbraw/zinc/54/00/84/509540084.db2.gz PXMLXKOHTIVWDT-CYBMUJFWSA-N 1 1 350.419 2.556 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000183015037 509549255 /nfs/dbraw/zinc/54/92/55/509549255.db2.gz LQRMGJATSBQXRF-KGLIPLIRSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000183029241 509556229 /nfs/dbraw/zinc/55/62/29/509556229.db2.gz CLVYCIKZBKRTBV-ZIAGYGMSSA-N 1 1 367.471 2.526 20 5 FFBDMO C[C@@H](NCc1cccc(C(=O)NCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173377989 509561487 /nfs/dbraw/zinc/56/14/87/509561487.db2.gz GOVCWHQQABPWKV-OAHLLOKOSA-N 1 1 370.453 2.737 20 5 FFBDMO COc1ccc(OC)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000173471915 509623260 /nfs/dbraw/zinc/62/32/60/509623260.db2.gz ZDZSFNNVODEQSB-CQSZACIVSA-N 1 1 358.398 2.693 20 5 FFBDMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000183148637 509626417 /nfs/dbraw/zinc/62/64/17/509626417.db2.gz VNGNHSFYCKZVFJ-RISCZKNCSA-N 1 1 369.368 2.753 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000249802594 509766955 /nfs/dbraw/zinc/76/69/55/509766955.db2.gz ZNYXUAWRUPAZGT-OLZOCXBDSA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1c([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cnn1C ZINC000183434351 509787503 /nfs/dbraw/zinc/78/75/03/509787503.db2.gz VXPQVPAOTQKRRU-SECBINFHSA-N 1 1 351.794 2.579 20 5 FFBDMO C[C@H](CCNC(=O)c1cccc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000177023686 509823651 /nfs/dbraw/zinc/82/36/51/509823651.db2.gz GJWWSKOHIABTSF-CQSZACIVSA-N 1 1 356.426 2.817 20 5 FFBDMO Cc1csc([C@H]([NH2+]CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C2CC2)n1 ZINC000183505074 509832118 /nfs/dbraw/zinc/83/21/18/509832118.db2.gz OCMVXZBEQZVVCE-QGZVFWFLSA-N 1 1 372.450 2.990 20 5 FFBDMO O=C(C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)NCC(F)(F)F ZINC000180290543 509852453 /nfs/dbraw/zinc/85/24/53/509852453.db2.gz DOINKHQEBLEIHO-INIZCTEOSA-N 1 1 367.327 2.952 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000245437697 509933909 /nfs/dbraw/zinc/93/39/09/509933909.db2.gz RRAUKAZGKSQIFP-XJKSGUPXSA-N 1 1 359.430 2.807 20 5 FFBDMO O=[N+]([O-])c1cc(Br)cnc1N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000268469301 509951646 /nfs/dbraw/zinc/95/16/46/509951646.db2.gz HMNOQMFDEAZXRQ-UHFFFAOYSA-N 1 1 352.192 2.859 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000193585196 509977957 /nfs/dbraw/zinc/97/79/57/509977957.db2.gz RKSIJNZFSDSPTI-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585196 509977962 /nfs/dbraw/zinc/97/79/62/509977962.db2.gz RKSIJNZFSDSPTI-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccn[nH]2)C1 ZINC000193585196 509977970 /nfs/dbraw/zinc/97/79/70/509977970.db2.gz RKSIJNZFSDSPTI-CQSZACIVSA-N 1 1 357.414 2.835 20 5 FFBDMO Cc1cc(NC(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000193624043 509994190 /nfs/dbraw/zinc/99/41/90/509994190.db2.gz SZDOUNGGFQLQCC-OKILXGFUSA-N 1 1 350.419 2.524 20 5 FFBDMO Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000180613404 510012745 /nfs/dbraw/zinc/01/27/45/510012745.db2.gz XSUYGGBYNSPSGV-UHFFFAOYSA-N 1 1 354.410 2.525 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)c([N+](=O)[O-])c1 ZINC000177391858 510033250 /nfs/dbraw/zinc/03/32/50/510033250.db2.gz KXWCRLIWGJVFGX-CQSZACIVSA-N 1 1 373.434 2.993 20 5 FFBDMO NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)c([N+](=O)[O-])c1 ZINC000177391858 510033255 /nfs/dbraw/zinc/03/32/55/510033255.db2.gz KXWCRLIWGJVFGX-CQSZACIVSA-N 1 1 373.434 2.993 20 5 FFBDMO CCOCCOCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000190292515 510047458 /nfs/dbraw/zinc/04/74/58/510047458.db2.gz XWXVDVPVTONUHQ-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO CCOCCOCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000190292515 510047465 /nfs/dbraw/zinc/04/74/65/510047465.db2.gz XWXVDVPVTONUHQ-LBPRGKRZSA-N 1 1 373.837 2.560 20 5 FFBDMO CC[C@H]1CN(c2ccccc2)CC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000184007795 510084352 /nfs/dbraw/zinc/08/43/52/510084352.db2.gz UQRICZVUYSYEGH-KRWDZBQOSA-N 1 1 368.437 2.795 20 5 FFBDMO CC[C@H]1CN(c2ccccc2)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000184007795 510084358 /nfs/dbraw/zinc/08/43/58/510084358.db2.gz UQRICZVUYSYEGH-KRWDZBQOSA-N 1 1 368.437 2.795 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCOCC2(CCOCC2)C1 ZINC000184117627 510142485 /nfs/dbraw/zinc/14/24/85/510142485.db2.gz IWYOHGIWHKYXDV-UHFFFAOYSA-N 1 1 350.415 2.623 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCOCC2(CCOCC2)C1 ZINC000184117627 510142491 /nfs/dbraw/zinc/14/24/91/510142491.db2.gz IWYOHGIWHKYXDV-UHFFFAOYSA-N 1 1 350.415 2.623 20 5 FFBDMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1C ZINC000262076225 510168366 /nfs/dbraw/zinc/16/83/66/510168366.db2.gz XFWPEUVVRKFPFH-KRWDZBQOSA-N 1 1 355.394 2.699 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000245874009 510180395 /nfs/dbraw/zinc/18/03/95/510180395.db2.gz AIGUOKOHBCUSGD-ZWNOBZJWSA-N 1 1 357.357 2.608 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)c1 ZINC000174655618 510234800 /nfs/dbraw/zinc/23/48/00/510234800.db2.gz WVWBFBZHIOAAMK-DZGCQCFKSA-N 1 1 373.438 2.599 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC000246079803 510279653 /nfs/dbraw/zinc/27/96/53/510279653.db2.gz FCCWKYZBYJTYPT-DJIMGWMZSA-N 1 1 352.456 2.695 20 5 FFBDMO CCOc1cc(OC[C@H](O)C[N@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000190691635 510287452 /nfs/dbraw/zinc/28/74/52/510287452.db2.gz GBUYECYXWOBFMH-QGZVFWFLSA-N 1 1 372.421 2.792 20 5 FFBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000246113277 510300746 /nfs/dbraw/zinc/30/07/46/510300746.db2.gz QEVNGRXUEHHRSN-RDTXWAMCSA-N 1 1 360.410 2.603 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000174811839 510323919 /nfs/dbraw/zinc/32/39/19/510323919.db2.gz QJGIXMMNIAZAFE-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO CCOc1cc2c(cc1OCC)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2 ZINC000174811839 510323925 /nfs/dbraw/zinc/32/39/25/510323925.db2.gz QJGIXMMNIAZAFE-UHFFFAOYSA-N 1 1 360.414 2.647 20 5 FFBDMO Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000194590000 510435301 /nfs/dbraw/zinc/43/53/01/510435301.db2.gz CWORRBGUFZICEU-CYBMUJFWSA-N 1 1 359.386 2.691 20 5 FFBDMO CCc1nc([C@@H](C)[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000184672094 510453364 /nfs/dbraw/zinc/45/33/64/510453364.db2.gz CITMZBWIAAJVEE-DGCLKSJQSA-N 1 1 351.428 2.704 20 5 FFBDMO CC(C)(C)OC(=O)C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000269635374 510490980 /nfs/dbraw/zinc/49/09/80/510490980.db2.gz HCRGLHJIDJFUSX-MRXNPFEDSA-N 1 1 350.415 2.682 20 5 FFBDMO Cc1cc(S(=O)(=O)NC[C@H](c2cccs2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000172015170 510500029 /nfs/dbraw/zinc/50/00/29/510500029.db2.gz YLAQUEQZYVRUNW-CQSZACIVSA-N 1 1 369.468 2.546 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)C1 ZINC000266304523 510508169 /nfs/dbraw/zinc/50/81/69/510508169.db2.gz LMWSGCDSRRBJNA-AWEZNQCLSA-N 1 1 351.472 2.877 20 5 FFBDMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000246483915 510513700 /nfs/dbraw/zinc/51/37/00/510513700.db2.gz LQLQVJSWUHLARN-DZGCQCFKSA-N 1 1 371.441 2.663 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246619369 510587707 /nfs/dbraw/zinc/58/77/07/510587707.db2.gz DXPAQWSPXZTRNV-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO Cc1c(NC(=O)CCN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000246619369 510587713 /nfs/dbraw/zinc/58/77/13/510587713.db2.gz DXPAQWSPXZTRNV-YJBOKZPZSA-N 1 1 360.458 2.648 20 5 FFBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000194915380 510588374 /nfs/dbraw/zinc/58/83/74/510588374.db2.gz BINUDWXSSOTEGB-ZDUSSCGKSA-N 1 1 374.466 2.631 20 5 FFBDMO C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000194915380 510588381 /nfs/dbraw/zinc/58/83/81/510588381.db2.gz BINUDWXSSOTEGB-ZDUSSCGKSA-N 1 1 374.466 2.631 20 5 FFBDMO CC[C@H]1CN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC[N@H+]1C[C@@H](C)O ZINC000191413104 510647680 /nfs/dbraw/zinc/64/76/80/510647680.db2.gz JYMLAMBSZSCVLZ-CABCVRRESA-N 1 1 364.446 2.521 20 5 FFBDMO CCC1(CC)C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000185240148 510766267 /nfs/dbraw/zinc/76/62/67/510766267.db2.gz AJWGGISHQHXCDM-VWLOTQADSA-N 1 1 367.471 2.547 20 5 FFBDMO CCC1(CC)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[S@@]1=O ZINC000185240148 510766274 /nfs/dbraw/zinc/76/62/74/510766274.db2.gz AJWGGISHQHXCDM-VWLOTQADSA-N 1 1 367.471 2.547 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000182145573 510780911 /nfs/dbraw/zinc/78/09/11/510780911.db2.gz NUYVKSTYOAGTOZ-SJORKVTESA-N 1 1 357.410 2.521 20 5 FFBDMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000247008489 510797290 /nfs/dbraw/zinc/79/72/90/510797290.db2.gz FRRPTJMWCHDFIZ-PBHICJAKSA-N 1 1 356.426 2.961 20 5 FFBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000247182394 510849584 /nfs/dbraw/zinc/84/95/84/510849584.db2.gz BEMANMQPGXHJIF-QMTHXVAHSA-N 1 1 370.247 2.770 20 5 FFBDMO COc1cccc(COC[C@@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285443998 510909476 /nfs/dbraw/zinc/90/94/76/510909476.db2.gz XTYUXTCAYRYLRQ-SFHVURJKSA-N 1 1 374.437 2.655 20 5 FFBDMO Cc1cc(N2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)nc(C)[nH+]1 ZINC000276157687 510929214 /nfs/dbraw/zinc/92/92/14/510929214.db2.gz QUOXOTPYBVAZJK-UHFFFAOYSA-N 1 1 367.413 2.595 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOCC12CCCC2 ZINC000270657094 510941795 /nfs/dbraw/zinc/94/17/95/510941795.db2.gz PTHWQYGOUMKBMM-UHFFFAOYSA-N 1 1 363.414 2.577 20 5 FFBDMO C[C@@H]1C[C@@H](N(C)C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000279408197 511072878 /nfs/dbraw/zinc/07/28/78/511072878.db2.gz XBLXCHDOPRWBKL-PWSUYJOCSA-N 1 1 357.813 2.871 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)[C@H](C)C1 ZINC000294946458 511230662 /nfs/dbraw/zinc/23/06/62/511230662.db2.gz LUVFCFLGNLFLRY-FZKQIMNGSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000294946458 511230665 /nfs/dbraw/zinc/23/06/65/511230665.db2.gz LUVFCFLGNLFLRY-FZKQIMNGSA-N 1 1 371.441 2.787 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)[C@H](C)C1 ZINC000294946458 511230670 /nfs/dbraw/zinc/23/06/70/511230670.db2.gz LUVFCFLGNLFLRY-FZKQIMNGSA-N 1 1 371.441 2.787 20 5 FFBDMO CCOC(=O)CC1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000298276306 511233422 /nfs/dbraw/zinc/23/34/22/511233422.db2.gz AOMZHCVICXBMKS-UHFFFAOYSA-N 1 1 364.398 2.627 20 5 FFBDMO CCNC(=O)c1cccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271669627 511283020 /nfs/dbraw/zinc/28/30/20/511283020.db2.gz ARULAAFVIPJGAZ-ZDUSSCGKSA-N 1 1 370.409 2.634 20 5 FFBDMO C[C@H]1Cc2[nH+]cn(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)c2C[C@@H]1C ZINC000295109397 511284634 /nfs/dbraw/zinc/28/46/34/511284634.db2.gz HJQYWLPNPBMZLR-QWRGUYRKSA-N 1 1 372.381 2.530 20 5 FFBDMO C[C@@H]1Cc2[nH+]cn(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCO4)c2C[C@H]1C ZINC000295109395 511285354 /nfs/dbraw/zinc/28/53/54/511285354.db2.gz HJQYWLPNPBMZLR-GHMZBOCLSA-N 1 1 372.381 2.530 20 5 FFBDMO COc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000271796602 511327472 /nfs/dbraw/zinc/32/74/72/511327472.db2.gz VUZXTNMLPWOXBG-LBPRGKRZSA-N 1 1 359.382 2.901 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1 ZINC000295233318 511331169 /nfs/dbraw/zinc/33/11/69/511331169.db2.gz BXNQYSBMYYRIFG-ZDUSSCGKSA-N 1 1 358.442 2.725 20 5 FFBDMO C[C@]1(CCCO)CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000271999016 511395599 /nfs/dbraw/zinc/39/55/99/511395599.db2.gz GYKDOYSOGHORDV-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO C[C@]1(CCCO)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000271999016 511395604 /nfs/dbraw/zinc/39/56/04/511395604.db2.gz GYKDOYSOGHORDV-MRXNPFEDSA-N 1 1 355.822 2.814 20 5 FFBDMO CC1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000291945523 511401373 /nfs/dbraw/zinc/40/13/73/511401373.db2.gz PYUVLBSXAIHDND-SJLPKXTDSA-N 1 1 357.410 2.813 20 5 FFBDMO CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 ZINC000291945523 511401378 /nfs/dbraw/zinc/40/13/78/511401378.db2.gz PYUVLBSXAIHDND-SJLPKXTDSA-N 1 1 357.410 2.813 20 5 FFBDMO CC[NH+](CC)C[C@H]1CCN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000295432969 511403960 /nfs/dbraw/zinc/40/39/60/511403960.db2.gz WTODFJJNQHNLBD-CQSZACIVSA-N 1 1 371.441 2.789 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1SC ZINC000334042580 511436103 /nfs/dbraw/zinc/43/61/03/511436103.db2.gz TXVGUWTTWBRVQL-QWRGUYRKSA-N 1 1 353.444 2.538 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2ccc(Br)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000334078886 511450403 /nfs/dbraw/zinc/45/04/03/511450403.db2.gz MMJKRWIVJOJQHL-ONGXEEELSA-N 1 1 356.220 2.570 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000298955846 511464038 /nfs/dbraw/zinc/46/40/38/511464038.db2.gz DJQYANWVLOXZCX-AEFFLSMTSA-N 1 1 358.442 2.552 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272250236 511479308 /nfs/dbraw/zinc/47/93/08/511479308.db2.gz YHBNMAYDDJLTNJ-STQMWFEESA-N 1 1 355.341 2.553 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000272250228 511480261 /nfs/dbraw/zinc/48/02/61/511480261.db2.gz YHBNMAYDDJLTNJ-OLZOCXBDSA-N 1 1 355.341 2.553 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3Br)C2)C1 ZINC000292236696 511516868 /nfs/dbraw/zinc/51/68/68/511516868.db2.gz NWVFHCXYZHMHAC-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H](c2ccco2)[NH+](C)C)c1 ZINC000299220968 511556026 /nfs/dbraw/zinc/55/60/26/511556026.db2.gz LXFVLMKNCOMMOF-OAHLLOKOSA-N 1 1 361.398 2.684 20 5 FFBDMO CN(C(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1 ZINC000280873800 511637440 /nfs/dbraw/zinc/63/74/40/511637440.db2.gz FKLWBRCQYLYORA-HNNXBMFYSA-N 1 1 354.410 2.823 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318210 511682026 /nfs/dbraw/zinc/68/20/26/511682026.db2.gz AXCHPEWEMUIPBT-DOTOQJQBSA-N 1 1 363.414 2.575 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000284318210 511682031 /nfs/dbraw/zinc/68/20/31/511682031.db2.gz AXCHPEWEMUIPBT-DOTOQJQBSA-N 1 1 363.414 2.575 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])C1 ZINC000301225021 511690417 /nfs/dbraw/zinc/69/04/17/511690417.db2.gz BEYOYBLCCJXFCP-CQSZACIVSA-N 1 1 371.441 2.703 20 5 FFBDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC000281025134 511694410 /nfs/dbraw/zinc/69/44/10/511694410.db2.gz UOVWYGYWXJTYBO-CQSZACIVSA-N 1 1 366.421 2.871 20 5 FFBDMO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3nc(-c4ccccc4)no3)CC2)n1 ZINC000365864030 511696407 /nfs/dbraw/zinc/69/64/07/511696407.db2.gz AHUKMVNULUMZRN-UHFFFAOYSA-N 1 1 354.370 2.678 20 5 FFBDMO CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000302968865 511722044 /nfs/dbraw/zinc/72/20/44/511722044.db2.gz HXERPBCZMAQJET-AWEZNQCLSA-N 1 1 367.427 2.549 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000312516901 511784758 /nfs/dbraw/zinc/78/47/58/511784758.db2.gz SWIRHADTCVOGKA-HNNXBMFYSA-N 1 1 370.409 2.710 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)[C@@H]2C1 ZINC000284734926 511844284 /nfs/dbraw/zinc/84/42/84/511844284.db2.gz WBRPACSDOKFBNM-IAGOWNOFSA-N 1 1 374.466 2.623 20 5 FFBDMO CN(CC[N@@H+](C)C1CC1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000274559932 511872933 /nfs/dbraw/zinc/87/29/33/511872933.db2.gz ZZSMDHFWOOQUTJ-UHFFFAOYSA-N 1 1 354.838 2.526 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000293185361 511873251 /nfs/dbraw/zinc/87/32/51/511873251.db2.gz WESCWDRIGROMSO-SFHVURJKSA-N 1 1 360.414 2.875 20 5 FFBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000293185361 511873258 /nfs/dbraw/zinc/87/32/58/511873258.db2.gz WESCWDRIGROMSO-SFHVURJKSA-N 1 1 360.414 2.875 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCO[C@H](C(C)C)C1 ZINC000293288103 511910023 /nfs/dbraw/zinc/91/00/23/511910023.db2.gz VVIYPLSKZUQEOW-KRWDZBQOSA-N 1 1 365.430 2.679 20 5 FFBDMO O=C(C[N@@H+]1CCC[C@H]1[C@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886356 511912617 /nfs/dbraw/zinc/91/26/17/511912617.db2.gz TZFNTOPNDAFDDW-DZGCQCFKSA-N 1 1 353.806 2.830 20 5 FFBDMO O=C(C[N@H+]1CCC[C@H]1[C@H]1CCCO1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000284886356 511912625 /nfs/dbraw/zinc/91/26/25/511912625.db2.gz TZFNTOPNDAFDDW-DZGCQCFKSA-N 1 1 353.806 2.830 20 5 FFBDMO C[C@@H](C1CC[NH+](C)CC1)N(C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000296881963 511935435 /nfs/dbraw/zinc/93/54/35/511935435.db2.gz XASFSLDDULKVQM-ZDUSSCGKSA-N 1 1 371.441 2.787 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000296919193 511950736 /nfs/dbraw/zinc/95/07/36/511950736.db2.gz YZSDZZBEXVXTPQ-SFHVURJKSA-N 1 1 362.430 2.943 20 5 FFBDMO CCOCCCN1CC[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839760 511959664 /nfs/dbraw/zinc/95/96/64/511959664.db2.gz LTVBUGPOCDQLMQ-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@@H+]1CC[C@@H](NCCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839760 511959670 /nfs/dbraw/zinc/95/96/70/511959670.db2.gz LTVBUGPOCDQLMQ-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO CCOCCC[N@H+]1CC[C@@H](NCCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000274839760 511959678 /nfs/dbraw/zinc/95/96/78/511959678.db2.gz LTVBUGPOCDQLMQ-VQIMIIECSA-N 1 1 365.474 2.700 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@H](O)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285140545 512014412 /nfs/dbraw/zinc/01/44/12/512014412.db2.gz LVNRDMPMENXDMS-KSSFIOAISA-N 1 1 370.453 2.594 20 5 FFBDMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2 ZINC000378051758 512565192 /nfs/dbraw/zinc/56/51/92/512565192.db2.gz UBPZXEGUOLAFJL-CQSZACIVSA-N 1 1 354.410 2.853 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3ccncn3)C2)c([N+](=O)[O-])c1 ZINC000371785417 512573539 /nfs/dbraw/zinc/57/35/39/512573539.db2.gz MYSMGTHLHUUFHX-CQSZACIVSA-N 1 1 358.398 2.652 20 5 FFBDMO C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000411419843 512626389 /nfs/dbraw/zinc/62/63/89/512626389.db2.gz PJVYOAXWXWGYDR-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO CN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000411419843 512626395 /nfs/dbraw/zinc/62/63/95/512626395.db2.gz PJVYOAXWXWGYDR-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000411419843 512626400 /nfs/dbraw/zinc/62/64/00/512626400.db2.gz PJVYOAXWXWGYDR-IBGZPJMESA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1CN(C[C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028059 512629920 /nfs/dbraw/zinc/62/99/20/512629920.db2.gz VYVMGPPATCRFJP-BBWFWOEESA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028059 512629925 /nfs/dbraw/zinc/62/99/25/512629925.db2.gz VYVMGPPATCRFJP-BBWFWOEESA-N 1 1 363.458 2.547 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2CCOc2ccccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000374028059 512629931 /nfs/dbraw/zinc/62/99/31/512629931.db2.gz VYVMGPPATCRFJP-BBWFWOEESA-N 1 1 363.458 2.547 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC([NH+]2CCN(C(C)C)CC2)CC1 ZINC000378324125 512695097 /nfs/dbraw/zinc/69/50/97/512695097.db2.gz RPCBSIVQYSECMS-UHFFFAOYSA-N 1 1 374.485 2.534 20 5 FFBDMO Cn1nccc1[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411671970 512748848 /nfs/dbraw/zinc/74/88/48/512748848.db2.gz MLCNHDQBYSOQKQ-KRWDZBQOSA-N 1 1 357.414 2.884 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(CC(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1F ZINC000411735119 512784854 /nfs/dbraw/zinc/78/48/54/512784854.db2.gz JDPHQQRDSDQMMM-ZDUSSCGKSA-N 1 1 367.421 2.522 20 5 FFBDMO O=[N+]([O-])c1ccccc1NCCc1noc([C@H]2CCc3[nH+]ccn3C2)n1 ZINC000376405557 512804580 /nfs/dbraw/zinc/80/45/80/512804580.db2.gz BELLNYLYLXDMQR-LBPRGKRZSA-N 1 1 354.370 2.559 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000372330092 512818918 /nfs/dbraw/zinc/81/89/18/512818918.db2.gz DRZXIVZSRBBWNB-QAPCUYQASA-N 1 1 358.442 2.896 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000374410673 512820267 /nfs/dbraw/zinc/82/02/67/512820267.db2.gz IJTMQHOQSSECKJ-FRRDWIJNSA-N 1 1 367.833 2.934 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CC[C@H]([C@@H]2CCOC2)C1 ZINC000374410673 512820268 /nfs/dbraw/zinc/82/02/68/512820268.db2.gz IJTMQHOQSSECKJ-FRRDWIJNSA-N 1 1 367.833 2.934 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+]2CCSC3(CCC3)CC2)c([N+](=O)[O-])c1 ZINC000411868003 512851884 /nfs/dbraw/zinc/85/18/84/512851884.db2.gz KEYIOXXEFYULBE-UHFFFAOYSA-N 1 1 365.455 2.904 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+]2CCSC3(CCC3)CC2)c([N+](=O)[O-])c1 ZINC000411868003 512851889 /nfs/dbraw/zinc/85/18/89/512851889.db2.gz KEYIOXXEFYULBE-UHFFFAOYSA-N 1 1 365.455 2.904 20 5 FFBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)CC2 ZINC000370341190 512884890 /nfs/dbraw/zinc/88/48/90/512884890.db2.gz GCYGDPUNHGTPAX-UHFFFAOYSA-N 1 1 369.368 2.897 20 5 FFBDMO Cc1ccnc(C2CC[NH+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000370375622 512900964 /nfs/dbraw/zinc/90/09/64/512900964.db2.gz WEPWEVNOAVTPON-CQSZACIVSA-N 1 1 369.425 2.900 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC([C@H]4CCOC4)CC3)n2)c1 ZINC000374624744 512923696 /nfs/dbraw/zinc/92/36/96/512923696.db2.gz QSHWKVVLLHYMRC-HNNXBMFYSA-N 1 1 358.398 2.893 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c([N+](=O)[O-])cc1OC(F)F ZINC000412048036 512929806 /nfs/dbraw/zinc/92/98/06/512929806.db2.gz PSUUBXTWXFQQLX-LOWVWBTDSA-N 1 1 372.368 2.798 20 5 FFBDMO C[N@H+](CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000392982952 512930645 /nfs/dbraw/zinc/93/06/45/512930645.db2.gz QZUFJMQPABNGCT-UHFFFAOYSA-N 1 1 373.450 2.667 20 5 FFBDMO C[N@@H+](CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000392982952 512930647 /nfs/dbraw/zinc/93/06/47/512930647.db2.gz QZUFJMQPABNGCT-UHFFFAOYSA-N 1 1 373.450 2.667 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H](C)[N@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075217 512994428 /nfs/dbraw/zinc/99/44/28/512994428.db2.gz YJUPZGBGZZHJJX-PMPSAXMXSA-N 1 1 374.485 2.996 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H](C)[N@@H+](C)C[C@@H]3C)cc2[N+](=O)[O-])C1 ZINC000408075217 512994432 /nfs/dbraw/zinc/99/44/32/512994432.db2.gz YJUPZGBGZZHJJX-PMPSAXMXSA-N 1 1 374.485 2.996 20 5 FFBDMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1 ZINC000374793960 513006766 /nfs/dbraw/zinc/00/67/66/513006766.db2.gz NBXYEAZDOHZIAD-CQSZACIVSA-N 1 1 372.400 2.663 20 5 FFBDMO C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000412371746 513056335 /nfs/dbraw/zinc/05/63/35/513056335.db2.gz YQOCRIFTQOZLOO-CJBAZIHXSA-N 1 1 357.454 2.887 20 5 FFBDMO C[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)[C@H](C)[NH+]1CCOCC1 ZINC000450313997 513137457 /nfs/dbraw/zinc/13/74/57/513137457.db2.gz SPHICFDTXLEGPV-OLZOCXBDSA-N 1 1 362.455 2.661 20 5 FFBDMO C[C@]12CC[N@@H+](CCCn3c(=O)oc4ccc([N+](=O)[O-])cc43)C[C@H]1C2(F)F ZINC000428735839 513177782 /nfs/dbraw/zinc/17/77/82/513177782.db2.gz XJLFMVOXKFAQMV-ZBFHGGJFSA-N 1 1 367.352 2.870 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C[C@@H]1C ZINC000450500784 513222880 /nfs/dbraw/zinc/22/28/80/513222880.db2.gz OEASKYBKAHKMOK-QWHCGFSZSA-N 1 1 357.414 2.540 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412697713 513230502 /nfs/dbraw/zinc/23/05/02/513230502.db2.gz MNBKHAZHJIFZAZ-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO COc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000412697713 513230509 /nfs/dbraw/zinc/23/05/09/513230509.db2.gz MNBKHAZHJIFZAZ-OAHLLOKOSA-N 1 1 369.421 2.950 20 5 FFBDMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000434418871 513318715 /nfs/dbraw/zinc/31/87/15/513318715.db2.gz GGWGZBXFBIBAOZ-GOSISDBHSA-N 1 1 360.458 2.920 20 5 FFBDMO Cc1c(C[N@@H+]2CC[C@@](C)(NCC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000440519195 513343375 /nfs/dbraw/zinc/34/33/75/513343375.db2.gz SSXBOTDOUXDKEN-LJQANCHMSA-N 1 1 363.458 2.799 20 5 FFBDMO Cc1c(C[N@H+]2CC[C@@](C)(NCC(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000440519195 513343380 /nfs/dbraw/zinc/34/33/80/513343380.db2.gz SSXBOTDOUXDKEN-LJQANCHMSA-N 1 1 363.458 2.799 20 5 FFBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[C@H](C)[N@@H+]1CCO ZINC000450791744 513343573 /nfs/dbraw/zinc/34/35/73/513343573.db2.gz IVRSWFSIOSZYGM-GASCZTMLSA-N 1 1 356.426 2.548 20 5 FFBDMO CCN1CC[NH+](CC(C)(C)Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000450921081 513405274 /nfs/dbraw/zinc/40/52/74/513405274.db2.gz DLQYCEDWGJTJNM-UHFFFAOYSA-N 1 1 357.458 2.971 20 5 FFBDMO CCn1nccc1C1CC[NH+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000434750868 513419543 /nfs/dbraw/zinc/41/95/43/513419543.db2.gz ZQWGJSJYFGWVJO-UHFFFAOYSA-N 1 1 371.441 2.938 20 5 FFBDMO C[C@@H]1CC[C@@H]([N@@H+](CCO)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000429755140 513457875 /nfs/dbraw/zinc/45/78/75/513457875.db2.gz ASQWJHWVEQKNSI-VXGBXAGGSA-N 1 1 355.822 2.670 20 5 FFBDMO C[C@H]1CN(c2cccc3cnccc32)CC[N@H+]1CCn1cc([N+](=O)[O-])cn1 ZINC000447390285 513463425 /nfs/dbraw/zinc/46/34/25/513463425.db2.gz FVDDJADYQFWFGI-HNNXBMFYSA-N 1 1 366.425 2.550 20 5 FFBDMO C[C@@H]1C[N@H+](CCCCNc2nccc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000413179974 513502654 /nfs/dbraw/zinc/50/26/54/513502654.db2.gz DCFCCUFNSSXUCN-GASCZTMLSA-N 1 1 358.442 2.866 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1 ZINC000441186290 513507973 /nfs/dbraw/zinc/50/79/73/513507973.db2.gz WNDSXDZADQZSLF-GJZGRUSLSA-N 1 1 350.415 2.731 20 5 FFBDMO Cc1ccccc1C1CC([N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)C1 ZINC000441461811 513574588 /nfs/dbraw/zinc/57/45/88/513574588.db2.gz HBEJJOCUQNWQBY-KVWWFHCMSA-N 1 1 370.453 2.871 20 5 FFBDMO COc1ccc(OCC[N@H+]2CCN(C)c3ccccc3C2)c([N+](=O)[O-])c1 ZINC000441486579 513580068 /nfs/dbraw/zinc/58/00/68/513580068.db2.gz CVFISTQWJZBGHZ-UHFFFAOYSA-N 1 1 357.410 2.934 20 5 FFBDMO CC(C)(C)OC(=O)CC[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000425474065 513586295 /nfs/dbraw/zinc/58/62/95/513586295.db2.gz KVTXFBFDLIJWJR-AWEZNQCLSA-N 1 1 352.435 2.768 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@@H](C)c2cccnc2)CC1 ZINC000430228613 513593278 /nfs/dbraw/zinc/59/32/78/513593278.db2.gz SNSGDEFWDOHSRY-HNNXBMFYSA-N 1 1 356.426 2.877 20 5 FFBDMO COc1cc(C[N@@H+]2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279257 513608967 /nfs/dbraw/zinc/60/89/67/513608967.db2.gz SODXYYMSIBFDDX-GLJUWKHASA-N 1 1 350.415 2.762 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)ccc1[N+](=O)[O-] ZINC000430279257 513608971 /nfs/dbraw/zinc/60/89/71/513608971.db2.gz SODXYYMSIBFDDX-GLJUWKHASA-N 1 1 350.415 2.762 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C ZINC000447911008 513621846 /nfs/dbraw/zinc/62/18/46/513621846.db2.gz GXHTXROMRYCVLA-HNNXBMFYSA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451341205 513688946 /nfs/dbraw/zinc/68/89/46/513688946.db2.gz KTIBYXRDXVPOMO-JQHSSLGASA-N 1 1 361.442 2.857 20 5 FFBDMO O=C(CCC(=O)N1CC[NH+](C2CCCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000448657243 513832644 /nfs/dbraw/zinc/83/26/44/513832644.db2.gz QGJNYBIGDNHECJ-UHFFFAOYSA-N 1 1 359.426 2.645 20 5 FFBDMO C[C@H](CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1 ZINC000448703569 513854290 /nfs/dbraw/zinc/85/42/90/513854290.db2.gz BYEXIWITJSVDGP-LSDHHAIUSA-N 1 1 361.442 2.794 20 5 FFBDMO C[C@H]1[C@H](NC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC[N@H+]1C ZINC000426209177 513872961 /nfs/dbraw/zinc/87/29/61/513872961.db2.gz HNBBBWYXCAPQAC-IINYFYTJSA-N 1 1 374.363 2.896 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](CO)CC(C)(C)C ZINC000451777224 513974828 /nfs/dbraw/zinc/97/48/28/513974828.db2.gz HZSFWSGFOLRYJG-OAHLLOKOSA-N 1 1 351.447 2.961 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+](C)[C@@H](CO)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC000451782765 513977383 /nfs/dbraw/zinc/97/73/83/513977383.db2.gz RLYNKJZXHIDZSF-CYBMUJFWSA-N 1 1 367.446 2.661 20 5 FFBDMO CCN1CCN(CC(C)(C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000451992738 514117249 /nfs/dbraw/zinc/11/72/49/514117249.db2.gz UNIZWFDZYKVMKR-UHFFFAOYSA-N 1 1 354.882 2.754 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000420592485 514194556 /nfs/dbraw/zinc/19/45/56/514194556.db2.gz ZSXPVXXYNMDFJL-INIZCTEOSA-N 1 1 368.437 2.670 20 5 FFBDMO NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000420635586 514210269 /nfs/dbraw/zinc/21/02/69/514210269.db2.gz ZSEQEAUUPAGQQX-ZDUSSCGKSA-N 1 1 369.425 2.611 20 5 FFBDMO Cn1ccnc1[C@@H]([NH2+]CC1(CF)CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449488145 514226561 /nfs/dbraw/zinc/22/65/61/514226561.db2.gz DANHLARJKXRFJB-INIZCTEOSA-N 1 1 362.405 2.774 20 5 FFBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c(c1)NC(=O)CO2 ZINC000444679311 514290935 /nfs/dbraw/zinc/29/09/35/514290935.db2.gz AHVVOOJLFJXCMR-SNVBAGLBSA-N 1 1 367.365 2.653 20 5 FFBDMO Cn1cc(C[N@H+]2CCC[C@]3(CCOC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449681879 514302515 /nfs/dbraw/zinc/30/25/15/514302515.db2.gz FJSWTTORWMNKFQ-IBGZPJMESA-N 1 1 356.426 2.998 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+](C)C[C@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000433056066 514364757 /nfs/dbraw/zinc/36/47/57/514364757.db2.gz CAAFEESPUBDJDP-QGZVFWFLSA-N 1 1 371.437 2.767 20 5 FFBDMO Cc1ccc([C@H](C)Nc2ccc3c(c2)C[N@@H+](CC(N)=O)CC3)cc1[N+](=O)[O-] ZINC000433075170 514371372 /nfs/dbraw/zinc/37/13/72/514371372.db2.gz JVSUUQZNARDETL-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO Cc1ccc([C@H](C)Nc2ccc3c(c2)C[N@H+](CC(N)=O)CC3)cc1[N+](=O)[O-] ZINC000433075170 514371378 /nfs/dbraw/zinc/37/13/78/514371378.db2.gz JVSUUQZNARDETL-AWEZNQCLSA-N 1 1 368.437 2.920 20 5 FFBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000420949385 514396942 /nfs/dbraw/zinc/39/69/42/514396942.db2.gz VLRCYHXPXMLUKI-RYUDHWBXSA-N 1 1 374.384 2.698 20 5 FFBDMO COc1cc(CN(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000421002744 514433025 /nfs/dbraw/zinc/43/30/25/514433025.db2.gz MPZHKYJFKYRTKG-LBPRGKRZSA-N 1 1 359.373 2.731 20 5 FFBDMO C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC(OC(C)(C)C)C1 ZINC000421008338 514436750 /nfs/dbraw/zinc/43/67/50/514436750.db2.gz MATSXYXJKINLNY-UHFFFAOYSA-N 1 1 361.442 2.762 20 5 FFBDMO C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC(OC(C)(C)C)C1 ZINC000421008338 514436754 /nfs/dbraw/zinc/43/67/54/514436754.db2.gz MATSXYXJKINLNY-UHFFFAOYSA-N 1 1 361.442 2.762 20 5 FFBDMO C[C@H]1CC2(CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000424286662 514446990 /nfs/dbraw/zinc/44/69/90/514446990.db2.gz HQNPXZGEEFMGME-LBPRGKRZSA-N 1 1 366.849 2.651 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000438865465 514454827 /nfs/dbraw/zinc/45/48/27/514454827.db2.gz GRJWTIQUYGFHFQ-SFHVURJKSA-N 1 1 362.474 2.947 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc(C[N@H+]2CC[C@@H](O)C2)c1 ZINC000428530325 514490080 /nfs/dbraw/zinc/49/00/80/514490080.db2.gz CXBRPQVUBAMUOD-MRXNPFEDSA-N 1 1 355.394 2.722 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1)Nc1cccc([N+](=O)[O-])c1 ZINC000461110001 514517128 /nfs/dbraw/zinc/51/71/28/514517128.db2.gz VFIWZRHLMGOBQN-QGZVFWFLSA-N 1 1 356.382 2.805 20 5 FFBDMO O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1 ZINC000461115393 514519247 /nfs/dbraw/zinc/51/92/47/514519247.db2.gz XDNCNQUNYSJNDX-KRWDZBQOSA-N 1 1 356.382 2.805 20 5 FFBDMO O=C(C[C@@H]1C[N@H+](Cc2ccccc2)CCO1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470705408 514580919 /nfs/dbraw/zinc/58/09/19/514580919.db2.gz YHJGKODKLKXEMR-GOSISDBHSA-N 1 1 373.384 2.964 20 5 FFBDMO O=C(C[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)Nc1cc(F)cc([N+](=O)[O-])c1 ZINC000470705408 514580925 /nfs/dbraw/zinc/58/09/25/514580925.db2.gz YHJGKODKLKXEMR-GOSISDBHSA-N 1 1 373.384 2.964 20 5 FFBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470977522 514703857 /nfs/dbraw/zinc/70/38/57/514703857.db2.gz WWDZHLGMIBQDLG-HOCLYGCPSA-N 1 1 360.458 2.586 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)Cc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000475545745 514711666 /nfs/dbraw/zinc/71/16/66/514711666.db2.gz BXBWQOARRSZXRE-UHFFFAOYSA-N 1 1 374.393 2.787 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000467018944 514864599 /nfs/dbraw/zinc/86/45/99/514864599.db2.gz QXCAQBIOZZFGKK-IAQYHMDHSA-N 1 1 372.450 2.931 20 5 FFBDMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498473895 514919669 /nfs/dbraw/zinc/91/96/69/514919669.db2.gz OKBYOVTWDLGGGI-CYBMUJFWSA-N 1 1 368.865 2.774 20 5 FFBDMO COc1ccc(C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC2CC2)c(OC)c1 ZINC000503208407 514960259 /nfs/dbraw/zinc/96/02/59/514960259.db2.gz KVYVDXJCOLVRMS-UHFFFAOYSA-N 1 1 360.414 2.721 20 5 FFBDMO O=C1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCN1Cc1ccc(F)cc1 ZINC000480473796 514970560 /nfs/dbraw/zinc/97/05/60/514970560.db2.gz SWMYGQBEWTUMGA-QGZVFWFLSA-N 1 1 361.348 2.764 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(Br)cc([N+](=O)[O-])c2)C[C@@H]1C ZINC000498568318 514977129 /nfs/dbraw/zinc/97/71/29/514977129.db2.gz AXRLZSSZVMWODX-QWRGUYRKSA-N 1 1 370.247 2.912 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C3CC3)C2)nc1OCc1ccccc1 ZINC000462484571 515077633 /nfs/dbraw/zinc/07/76/33/515077633.db2.gz AJOIDSJOYFVGMQ-HNNXBMFYSA-N 1 1 354.410 2.639 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1 ZINC000462491876 515082317 /nfs/dbraw/zinc/08/23/17/515082317.db2.gz SQHTYXHIMIPMHF-PBHICJAKSA-N 1 1 368.437 2.885 20 5 FFBDMO CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490085389 515097527 /nfs/dbraw/zinc/09/75/27/515097527.db2.gz ZQERWOZQKMZJFZ-HNNXBMFYSA-N 1 1 359.430 2.839 20 5 FFBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000485704020 515151955 /nfs/dbraw/zinc/15/19/55/515151955.db2.gz JNOGIJHHXOCDTL-BETUJISGSA-N 1 1 369.412 2.900 20 5 FFBDMO Cc1noc([C@@H]2CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)n1 ZINC000499005976 515163351 /nfs/dbraw/zinc/16/33/51/515163351.db2.gz NRSFJHMZBWRPFG-CQSZACIVSA-N 1 1 369.381 2.973 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C[N@@H+]1C ZINC000509653473 515274087 /nfs/dbraw/zinc/27/40/87/515274087.db2.gz ANIWQEDARCDFSL-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[C@@H]1CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)[C@@H](C)C[N@H+]1C ZINC000509653473 515274097 /nfs/dbraw/zinc/27/40/97/515274097.db2.gz ANIWQEDARCDFSL-NEPJUHHUSA-N 1 1 360.439 2.883 20 5 FFBDMO C[N@H+]1C[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)[C@H](c2ccccc2)C1 ZINC000481793544 515469722 /nfs/dbraw/zinc/46/97/22/515469722.db2.gz KKWMTEZKDDGUMM-HKUYNNGSSA-N 1 1 364.405 2.904 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCCC[N@@H+]1CCCC[C@@H]1C ZINC000481961358 515528426 /nfs/dbraw/zinc/52/84/26/515528426.db2.gz YTMOWCYZHXJSQH-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000473297680 515569773 /nfs/dbraw/zinc/56/97/73/515569773.db2.gz PQFBSQDQXUPWDP-HNNXBMFYSA-N 1 1 355.394 2.552 20 5 FFBDMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000473297680 515569780 /nfs/dbraw/zinc/56/97/80/515569780.db2.gz PQFBSQDQXUPWDP-HNNXBMFYSA-N 1 1 355.394 2.552 20 5 FFBDMO CC[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-] ZINC000500103104 515591635 /nfs/dbraw/zinc/59/16/35/515591635.db2.gz QMGUTZWQAWCWCI-OAHLLOKOSA-N 1 1 369.487 2.754 20 5 FFBDMO CC1(C)CCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000457062381 515618283 /nfs/dbraw/zinc/61/82/83/515618283.db2.gz UXJHMHAOGCQMCL-UHFFFAOYSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1ccc(C[N@@H+]2CC(C)(C)O[C@@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000482449895 515680225 /nfs/dbraw/zinc/68/02/25/515680225.db2.gz QBKPXFRDZUHYSC-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO COc1ccc(C[N@H+]2CC(C)(C)O[C@@]3(CCCOC3)C2)cc1[N+](=O)[O-] ZINC000482449895 515680229 /nfs/dbraw/zinc/68/02/29/515680229.db2.gz QBKPXFRDZUHYSC-SFHVURJKSA-N 1 1 350.415 2.763 20 5 FFBDMO Cn1cc(C(=O)NCCCC[N@@H+](C)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000457198661 515719482 /nfs/dbraw/zinc/71/94/82/515719482.db2.gz KDUNRMJMPDHZKA-UHFFFAOYSA-N 1 1 371.441 2.600 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ncc(C(=O)OC)cc1[N+](=O)[O-] ZINC000478260051 515756531 /nfs/dbraw/zinc/75/65/31/515756531.db2.gz QNUZCTSPVKTNGR-AWEZNQCLSA-N 1 1 350.419 2.843 20 5 FFBDMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(OCC(F)(F)F)cc1 ZINC000511071413 515766833 /nfs/dbraw/zinc/76/68/33/515766833.db2.gz DVFYOPGFADJSPZ-UHFFFAOYSA-N 1 1 358.320 2.864 20 5 FFBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CCc1nc2ccccc2c(=O)[nH]1 ZINC000511108353 515784089 /nfs/dbraw/zinc/78/40/89/515784089.db2.gz NBMIPESUHRUGCA-UHFFFAOYSA-N 1 1 352.394 2.961 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCN(c2cc(C)cc[nH+]2)CC1 ZINC000482756041 515793370 /nfs/dbraw/zinc/79/33/70/515793370.db2.gz DMANIAPTZNALTJ-UHFFFAOYSA-N 1 1 371.397 2.661 20 5 FFBDMO C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000494386538 515828139 /nfs/dbraw/zinc/82/81/39/515828139.db2.gz NRJHDLZJNSYKCA-HWWQOWPSSA-N 1 1 350.394 2.928 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@@H+]1Cc1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506475734 515893929 /nfs/dbraw/zinc/89/39/29/515893929.db2.gz YSLDHNOSCXBGMM-INIZCTEOSA-N 1 1 355.394 2.695 20 5 FFBDMO O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)c1cc(O)cc([N+](=O)[O-])c1 ZINC000506475734 515893939 /nfs/dbraw/zinc/89/39/39/515893939.db2.gz YSLDHNOSCXBGMM-INIZCTEOSA-N 1 1 355.394 2.695 20 5 FFBDMO COc1cc(C[NH+]2CCC(O[C@@H]3CCOC3)CC2)c([N+](=O)[O-])cc1F ZINC000464675958 515918568 /nfs/dbraw/zinc/91/85/68/515918568.db2.gz DIRDIPJEVALMQP-CQSZACIVSA-N 1 1 354.378 2.512 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000511553021 515942563 /nfs/dbraw/zinc/94/25/63/515942563.db2.gz ISJNHBUWBDLLBR-GFCCVEGCSA-N 1 1 373.400 2.773 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000488028078 516085050 /nfs/dbraw/zinc/08/50/50/516085050.db2.gz SGOHGLFXGBDLPN-DAYGRLMNSA-N 1 1 360.458 2.509 20 5 FFBDMO O=C(NCCc1ccc(Cl)cc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000488075357 516106163 /nfs/dbraw/zinc/10/61/63/516106163.db2.gz OKSGYIPEDQKAIL-LSDHHAIUSA-N 1 1 366.849 2.717 20 5 FFBDMO COc1cc(N2CC[NH+](C/C(C)=C/c3cccc([N+](=O)[O-])c3)CC2)ncn1 ZINC000470207182 516171994 /nfs/dbraw/zinc/17/19/94/516171994.db2.gz BUGRYXCLKXHPRQ-XNTDXEJSSA-N 1 1 369.425 2.619 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000470368115 516222718 /nfs/dbraw/zinc/22/27/18/516222718.db2.gz XJYWHCRBNWRYIM-MRXNPFEDSA-N 1 1 362.474 2.805 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](N2CCOCC2)C[C@H]1C ZINC000512439112 516279519 /nfs/dbraw/zinc/27/95/19/516279519.db2.gz NTIMEZYYMDBPQC-CRAIPNDOSA-N 1 1 363.458 2.677 20 5 FFBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](N2CCOCC2)C[C@H]1C ZINC000512439112 516279525 /nfs/dbraw/zinc/27/95/25/516279525.db2.gz NTIMEZYYMDBPQC-CRAIPNDOSA-N 1 1 363.458 2.677 20 5 FFBDMO CC[N@@H+]1CCO[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000497350957 516312702 /nfs/dbraw/zinc/31/27/02/516312702.db2.gz COKUUXAELXSPDF-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO CC[N@H+]1CCO[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000497350957 516312705 /nfs/dbraw/zinc/31/27/05/516312705.db2.gz COKUUXAELXSPDF-OALUTQOASA-N 1 1 369.421 2.787 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000543673261 516358007 /nfs/dbraw/zinc/35/80/07/516358007.db2.gz LSOKJFRBEWWGRU-UHFFFAOYSA-N 1 1 354.410 2.861 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000550653996 516370891 /nfs/dbraw/zinc/37/08/91/516370891.db2.gz YNKRFYFOJHPLQA-LLVKDONJSA-N 1 1 370.247 2.832 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](COC(F)F)C1 ZINC000512822378 516376326 /nfs/dbraw/zinc/37/63/26/516376326.db2.gz GJTNQEQZWPUNDJ-LBPRGKRZSA-N 1 1 357.357 2.793 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NCCCC[N@H+]2CCC[C@H](C)C2)n1 ZINC000561118444 516390448 /nfs/dbraw/zinc/39/04/48/516390448.db2.gz DQWJIKPTNZIZBK-ZDUSSCGKSA-N 1 1 350.419 2.700 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(Nc3ccccn3)CC2)c2c(c1)COCO2 ZINC000535577239 516409767 /nfs/dbraw/zinc/40/97/67/516409767.db2.gz ZZQNTUNGARYGTG-UHFFFAOYSA-N 1 1 370.409 2.933 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000543790708 516430198 /nfs/dbraw/zinc/43/01/98/516430198.db2.gz ZJLUYLLPIWDZCI-IBGZPJMESA-N 1 1 356.426 2.656 20 5 FFBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)CC1 ZINC000535718381 516465004 /nfs/dbraw/zinc/46/50/04/516465004.db2.gz IIRWBHQKWARIEE-UHFFFAOYSA-N 1 1 371.441 2.727 20 5 FFBDMO Cc1nc(N[C@@H](C)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599584 516547248 /nfs/dbraw/zinc/54/72/48/516547248.db2.gz WVXZVIZQGXZJDT-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO Cc1nc(N[C@@H](C)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)ccc1[N+](=O)[O-] ZINC000531599584 516547257 /nfs/dbraw/zinc/54/72/57/516547257.db2.gz WVXZVIZQGXZJDT-YJBOKZPZSA-N 1 1 356.426 3.000 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H](C1CC1)[N@@H+](C)Cc1ccccc1 ZINC000547855630 516599934 /nfs/dbraw/zinc/59/99/34/516599934.db2.gz VURHKAWDNJALDD-SFHVURJKSA-N 1 1 356.426 2.574 20 5 FFBDMO CC[C@@H](C(=O)OC)N1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000554869123 516673026 /nfs/dbraw/zinc/67/30/26/516673026.db2.gz PQBSOKWAXIDXEV-NZHZHZHDSA-N 1 1 361.442 2.567 20 5 FFBDMO Cc1c(Br)c(N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)ncc1[N+](=O)[O-] ZINC000544394996 516739701 /nfs/dbraw/zinc/73/97/01/516739701.db2.gz SXENLPYTDSYSAG-NEPJUHHUSA-N 1 1 369.263 2.981 20 5 FFBDMO O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000518799216 516779903 /nfs/dbraw/zinc/77/99/03/516779903.db2.gz ITJUXLWGNZHTPJ-UHFFFAOYSA-N 1 1 357.385 2.734 20 5 FFBDMO C[C@H](c1ccc(NC(=O)c2ccc([N+](=O)[O-])cn2)cc1)[NH+]1CCOCC1 ZINC000532138050 516821024 /nfs/dbraw/zinc/82/10/24/516821024.db2.gz FPUKWSLNGADTNK-CYBMUJFWSA-N 1 1 356.382 2.635 20 5 FFBDMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541064558 516853702 /nfs/dbraw/zinc/85/37/02/516853702.db2.gz KKWQIERATZCHMO-JSGCOSHPSA-N 1 1 369.849 2.611 20 5 FFBDMO CC(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C ZINC000558642080 516854847 /nfs/dbraw/zinc/85/48/47/516854847.db2.gz SJXDYIABSJLJTI-SFHVURJKSA-N 1 1 373.457 2.600 20 5 FFBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(C2CCC2)CC1 ZINC000532204728 516856341 /nfs/dbraw/zinc/85/63/41/516856341.db2.gz RPJOEDGNBAGAEJ-CQSZACIVSA-N 1 1 360.458 2.918 20 5 FFBDMO Cn1ccnc1[C@H](NC[C@H](c1ccco1)[NH+](C)C)c1cccc([N+](=O)[O-])c1 ZINC000552038051 517045684 /nfs/dbraw/zinc/04/56/84/517045684.db2.gz JKLJJGDKAVDASW-SJLPKXTDSA-N 1 1 369.425 2.903 20 5 FFBDMO CC[N@H+]1CCCC[C@H]1CN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000552044176 517049972 /nfs/dbraw/zinc/04/99/72/517049972.db2.gz SYQQNTPYUKSWAT-ZWKOTPCHSA-N 1 1 357.458 2.882 20 5 FFBDMO COc1ccc(C[N@@H+]2CC[C@H](OCc3c(C)noc3C)C2)cc1[N+](=O)[O-] ZINC000545172644 517085343 /nfs/dbraw/zinc/08/53/43/517085343.db2.gz NYJVTECAXJVTFY-HNNXBMFYSA-N 1 1 361.398 2.999 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@H](OCc3c(C)noc3C)C2)cc1[N+](=O)[O-] ZINC000545172644 517085347 /nfs/dbraw/zinc/08/53/47/517085347.db2.gz NYJVTECAXJVTFY-HNNXBMFYSA-N 1 1 361.398 2.999 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000541576013 517120274 /nfs/dbraw/zinc/12/02/74/517120274.db2.gz QAYXSRZTWLSKSP-NSHDSACASA-N 1 1 355.236 2.734 20 5 FFBDMO Cc1c(Br)c(N(C)[C@H]2CC[N@H+](C3CC3)C2)ncc1[N+](=O)[O-] ZINC000541576013 517120279 /nfs/dbraw/zinc/12/02/79/517120279.db2.gz QAYXSRZTWLSKSP-NSHDSACASA-N 1 1 355.236 2.734 20 5 FFBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H]1COC[C@H]1O ZINC000519720966 517145942 /nfs/dbraw/zinc/14/59/42/517145942.db2.gz GKGZPEVJMBPOJE-IAGOWNOFSA-N 1 1 362.357 2.718 20 5 FFBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H]1COC[C@H]1O ZINC000519720966 517145949 /nfs/dbraw/zinc/14/59/49/517145949.db2.gz GKGZPEVJMBPOJE-IAGOWNOFSA-N 1 1 362.357 2.718 20 5 FFBDMO CC(C)[C@H](O)C1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000552277739 517175131 /nfs/dbraw/zinc/17/51/31/517175131.db2.gz HLBIMTAAHRWJKA-SJORKVTESA-N 1 1 358.442 2.804 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000548736511 517180460 /nfs/dbraw/zinc/18/04/60/517180460.db2.gz UWMIKMVQXTWRAI-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000548736511 517180466 /nfs/dbraw/zinc/18/04/66/517180466.db2.gz UWMIKMVQXTWRAI-MRXNPFEDSA-N 1 1 356.382 2.912 20 5 FFBDMO CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000562598196 517224490 /nfs/dbraw/zinc/22/44/90/517224490.db2.gz SNSXHOQSHIKYFO-GOSISDBHSA-N 1 1 350.415 2.885 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000552513154 517290895 /nfs/dbraw/zinc/29/08/95/517290895.db2.gz ILTQCICOILRBLE-YJBOKZPZSA-N 1 1 360.385 2.963 20 5 FFBDMO COc1ccc(C[C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)cc1 ZINC000515469981 517366426 /nfs/dbraw/zinc/36/64/26/517366426.db2.gz HPTIXRXXTYOQJS-KRWDZBQOSA-N 1 1 371.437 2.720 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1Nc1cccc(C(N)=O)c1[N+](=O)[O-] ZINC000520441907 517395864 /nfs/dbraw/zinc/39/58/64/517395864.db2.gz BYUVFUPLCGZVRE-SUMWQHHRSA-N 1 1 354.410 2.626 20 5 FFBDMO Cc1c(Br)cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=CCC1 ZINC000556569351 517496739 /nfs/dbraw/zinc/49/67/39/517496739.db2.gz YSCTVFBEHUXUEL-UHFFFAOYSA-N 1 1 368.231 2.657 20 5 FFBDMO CC(=O)Nc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000538276757 517537013 /nfs/dbraw/zinc/53/70/13/517537013.db2.gz SKAFZDIEJIUVAC-LBPRGKRZSA-N 1 1 356.382 2.843 20 5 FFBDMO C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000538281010 517537597 /nfs/dbraw/zinc/53/75/97/517537597.db2.gz YPXYLJAJEGKXHN-OLZOCXBDSA-N 1 1 362.430 2.792 20 5 FFBDMO C[C@@H]([NH2+]CC(=O)NCCOc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000538279961 517538186 /nfs/dbraw/zinc/53/81/86/517538186.db2.gz RHUDYTCPFWQMEY-CYBMUJFWSA-N 1 1 361.373 2.580 20 5 FFBDMO O=C(NC[C@H]([NH2+]Cc1ccccc1)c1ccco1)c1ccc([N+](=O)[O-])cn1 ZINC000553212855 517577851 /nfs/dbraw/zinc/57/78/51/517577851.db2.gz YQEDEFPFXROMDL-KRWDZBQOSA-N 1 1 366.377 2.844 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000546176768 517582310 /nfs/dbraw/zinc/58/23/10/517582310.db2.gz QWUBAQNVVGQYDB-OAHLLOKOSA-N 1 1 355.460 2.528 20 5 FFBDMO Cc1cc(N[C@@H](C)C[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549488613 517586661 /nfs/dbraw/zinc/58/66/61/517586661.db2.gz AHGFDDGQTYARRY-LBPRGKRZSA-N 1 1 360.380 2.970 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]CCCS(C)(=O)=O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542495393 517592635 /nfs/dbraw/zinc/59/26/35/517592635.db2.gz YGNRKWONIDKVHM-KRWDZBQOSA-N 1 1 366.439 2.864 20 5 FFBDMO Cc1[nH+]ccn1CCCCNc1ncc([N+](=O)[O-])c(C)c1Br ZINC000542505384 517599375 /nfs/dbraw/zinc/59/93/75/517599375.db2.gz FMABUMYRRIHCDW-UHFFFAOYSA-N 1 1 368.235 2.880 20 5 FFBDMO C[N@H+]1Cc2ccccc2[C@@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000533821147 517628323 /nfs/dbraw/zinc/62/83/23/517628323.db2.gz XPTDVLKFGOKWCV-INIZCTEOSA-N 1 1 351.366 2.842 20 5 FFBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000533821147 517628333 /nfs/dbraw/zinc/62/83/33/517628333.db2.gz XPTDVLKFGOKWCV-INIZCTEOSA-N 1 1 351.366 2.842 20 5 FFBDMO O=C1NCCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1Cc1ccccc1 ZINC000549832891 517734239 /nfs/dbraw/zinc/73/42/39/517734239.db2.gz PDFGCAKTHJELNU-LJQANCHMSA-N 1 1 353.422 2.571 20 5 FFBDMO COc1cc(C(=O)N[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000563235264 517761036 /nfs/dbraw/zinc/76/10/36/517761036.db2.gz OXANEJJSTZHFMK-FQEVSTJZSA-N 1 1 369.421 2.998 20 5 FFBDMO COc1cc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000553528242 517765570 /nfs/dbraw/zinc/76/55/70/517765570.db2.gz SKVILRLOFOPQJT-ZDUSSCGKSA-N 1 1 361.442 2.858 20 5 FFBDMO C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000534643362 517978882 /nfs/dbraw/zinc/97/88/82/517978882.db2.gz SQGPAHNXQQTFEQ-XHSDSOJGSA-N 1 1 362.474 2.803 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)NC[C@H]3CCC[N@H+]3C)cc2[N+](=O)[O-])C1 ZINC000517087423 518018820 /nfs/dbraw/zinc/01/88/20/518018820.db2.gz QETXPKMIUFXJHA-GDBMZVCRSA-N 1 1 360.458 2.655 20 5 FFBDMO C[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000557522299 518051593 /nfs/dbraw/zinc/05/15/93/518051593.db2.gz ZMSUSJCIZSQDMV-ZDUSSCGKSA-N 1 1 354.410 2.552 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000522277914 518062797 /nfs/dbraw/zinc/06/27/97/518062797.db2.gz XJBQONCRSBIBJK-UHFFFAOYSA-N 1 1 370.453 2.714 20 5 FFBDMO CC[N@@H+](C)C[C@H]1CCN(c2ncc([N+](=O)[O-])c(C)c2Br)C1 ZINC000543437605 518091017 /nfs/dbraw/zinc/09/10/17/518091017.db2.gz YKBROTMTAFITJC-LLVKDONJSA-N 1 1 357.252 2.839 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000522386958 518094724 /nfs/dbraw/zinc/09/47/24/518094724.db2.gz QKRGINYGRBIKTN-QWHCGFSZSA-N 1 1 369.849 2.816 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000531057926 518119751 /nfs/dbraw/zinc/11/97/51/518119751.db2.gz MBHXRYKTFQBBHJ-CQSZACIVSA-N 1 1 356.426 2.880 20 5 FFBDMO Cc1[nH+]c2cc(Nc3cccc(S(C)(=O)=O)c3[N+](=O)[O-])ccc2n1C ZINC000535018171 518123467 /nfs/dbraw/zinc/12/34/67/518123467.db2.gz NHCRJGVDMRGYPK-UHFFFAOYSA-N 1 1 360.395 2.937 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000584248490 518245722 /nfs/dbraw/zinc/24/57/22/518245722.db2.gz QTSIJXKXPCGWFV-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000584248490 518245728 /nfs/dbraw/zinc/24/57/28/518245728.db2.gz QTSIJXKXPCGWFV-QGZVFWFLSA-N 1 1 353.422 2.902 20 5 FFBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(CC(F)(F)F)C1=O ZINC000567252595 518432010 /nfs/dbraw/zinc/43/20/10/518432010.db2.gz JQPWNGITUYXWJI-AWEZNQCLSA-N 1 1 359.348 2.622 20 5 FFBDMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000581856114 518469312 /nfs/dbraw/zinc/46/93/12/518469312.db2.gz CLKQURZDWUIURX-RYUDHWBXSA-N 1 1 357.838 2.860 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2cnc(CCN3CC[C@]4(C3)CCC[NH2+]C4)o2)c1 ZINC000579013504 518480336 /nfs/dbraw/zinc/48/03/36/518480336.db2.gz CQUZTDRSKRPVNX-LJQANCHMSA-N 1 1 356.426 2.868 20 5 FFBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000584869448 518516250 /nfs/dbraw/zinc/51/62/50/518516250.db2.gz HVSACGIIUOEUJR-USXIJHARSA-N 1 1 361.442 2.719 20 5 FFBDMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCCCC[C@@H]1CCO ZINC000585754836 518585746 /nfs/dbraw/zinc/58/57/46/518585746.db2.gz FESQZTSUBZNIBH-CQSZACIVSA-N 1 1 363.414 2.520 20 5 FFBDMO CN1CCO[C@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]21 ZINC000585767605 518590209 /nfs/dbraw/zinc/59/02/09/518590209.db2.gz LSACHTBDMXOVIG-HKUYNNGSSA-N 1 1 357.410 2.760 20 5 FFBDMO C[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(-c4ccccc4)n3)[C@@H]2C1 ZINC000585783656 518595445 /nfs/dbraw/zinc/59/54/45/518595445.db2.gz ZLUVLQCGSKGCCF-IAGOWNOFSA-N 1 1 354.410 2.566 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1 ZINC000582139251 518605878 /nfs/dbraw/zinc/60/58/78/518605878.db2.gz BAXPHMVZCHPHST-UHFFFAOYSA-N 1 1 365.393 2.564 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000570488316 518630478 /nfs/dbraw/zinc/63/04/78/518630478.db2.gz WAMDESFGADQQNW-CQSZACIVSA-N 1 1 357.476 2.610 20 5 FFBDMO O=C(C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000582270158 518670195 /nfs/dbraw/zinc/67/01/95/518670195.db2.gz LXRSENFGJPBURP-INIZCTEOSA-N 1 1 366.421 2.670 20 5 FFBDMO O=C(C[N@H+]1CCCN2c3ccccc3C[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000582270158 518670201 /nfs/dbraw/zinc/67/02/01/518670201.db2.gz LXRSENFGJPBURP-INIZCTEOSA-N 1 1 366.421 2.670 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+]2CC(C)C)n1 ZINC000567771604 518702082 /nfs/dbraw/zinc/70/20/82/518702082.db2.gz HKUVSFZTXLRTPI-ZDUSSCGKSA-N 1 1 350.419 2.699 20 5 FFBDMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000588023658 518704869 /nfs/dbraw/zinc/70/48/69/518704869.db2.gz UCTYLORSMAGPHS-IBGZPJMESA-N 1 1 359.401 2.807 20 5 FFBDMO CCn1c(C)nc([N+](=O)[O-])c1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000573639200 518761930 /nfs/dbraw/zinc/76/19/30/518761930.db2.gz XZHQKROWHHWYDY-UHFFFAOYSA-N 1 1 361.421 2.971 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-] ZINC000570889367 518826653 /nfs/dbraw/zinc/82/66/53/518826653.db2.gz WAMDESFGADQQNW-AWEZNQCLSA-N 1 1 357.476 2.610 20 5 FFBDMO C[NH+]1CCC([C@@H]2CCN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2)CC1 ZINC000589199409 518949306 /nfs/dbraw/zinc/94/93/06/518949306.db2.gz HYJWSAWPCLDAEO-OAHLLOKOSA-N 1 1 361.442 2.530 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000589494563 519016985 /nfs/dbraw/zinc/01/69/85/519016985.db2.gz ONUKLOJSGKBDSB-LJQANCHMSA-N 1 1 369.421 2.870 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000589494563 519016987 /nfs/dbraw/zinc/01/69/87/519016987.db2.gz ONUKLOJSGKBDSB-LJQANCHMSA-N 1 1 369.421 2.870 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000589509547 519021120 /nfs/dbraw/zinc/02/11/20/519021120.db2.gz YGVNQMXWQBBIGB-GOEBONIOSA-N 1 1 350.415 2.610 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(C)(C)C)[C@H](O)C2)c1 ZINC000589509547 519021125 /nfs/dbraw/zinc/02/11/25/519021125.db2.gz YGVNQMXWQBBIGB-GOEBONIOSA-N 1 1 350.415 2.610 20 5 FFBDMO Cc1cc(N(C)[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687925 519064485 /nfs/dbraw/zinc/06/44/85/519064485.db2.gz RPIYNPNLXPOFRY-OAHLLOKOSA-N 1 1 350.438 2.647 20 5 FFBDMO Cc1cc(N(C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-] ZINC000589687925 519064490 /nfs/dbraw/zinc/06/44/90/519064490.db2.gz RPIYNPNLXPOFRY-OAHLLOKOSA-N 1 1 350.438 2.647 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](c3cccnc3)C2)c([N+](=O)[O-])c1 ZINC000583141160 519097462 /nfs/dbraw/zinc/09/74/62/519097462.db2.gz ZMHBITYFKFGQEZ-OAHLLOKOSA-N 1 1 370.409 2.817 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cc1OC ZINC000590005817 519127083 /nfs/dbraw/zinc/12/70/83/519127083.db2.gz PUJBIXXLGZMAOZ-OJLVUWQFSA-N 1 1 364.442 2.698 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cc1OC ZINC000590005817 519127088 /nfs/dbraw/zinc/12/70/88/519127088.db2.gz PUJBIXXLGZMAOZ-OJLVUWQFSA-N 1 1 364.442 2.698 20 5 FFBDMO CC[N@@H+](CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-])C(C)C ZINC000565865066 519167782 /nfs/dbraw/zinc/16/77/82/519167782.db2.gz HTEMRUKYCVJBJQ-UHFFFAOYSA-N 1 1 350.463 2.569 20 5 FFBDMO O=C(CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCc2ccccc21 ZINC000580501008 519206116 /nfs/dbraw/zinc/20/61/16/519206116.db2.gz IPDIUXREZPUWBT-UHFFFAOYSA-N 1 1 367.405 2.769 20 5 FFBDMO O=C(CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1)N1CCc2ccccc21 ZINC000580501008 519206126 /nfs/dbraw/zinc/20/61/26/519206126.db2.gz IPDIUXREZPUWBT-UHFFFAOYSA-N 1 1 367.405 2.769 20 5 FFBDMO C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000590554535 519264790 /nfs/dbraw/zinc/26/47/90/519264790.db2.gz DIVUWCUSCLGKCP-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601503 519284515 /nfs/dbraw/zinc/28/45/15/519284515.db2.gz CZDBIMNIDVTUHO-CXAGYDPISA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601503 519284523 /nfs/dbraw/zinc/28/45/23/519284523.db2.gz CZDBIMNIDVTUHO-CXAGYDPISA-N 1 1 371.441 2.781 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(S(C)(=O)=O)c1 ZINC000590658767 519305335 /nfs/dbraw/zinc/30/53/35/519305335.db2.gz FDZYIVKGFQGQGS-UHFFFAOYSA-N 1 1 364.423 2.687 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000577884382 519305844 /nfs/dbraw/zinc/30/58/44/519305844.db2.gz KUAKRITWHUVUJO-HNNXBMFYSA-N 1 1 370.409 2.817 20 5 FFBDMO COc1cccc2c1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC2 ZINC000590759638 519354449 /nfs/dbraw/zinc/35/44/49/519354449.db2.gz CEPOEAAKLSUARP-UHFFFAOYSA-N 1 1 355.394 2.990 20 5 FFBDMO Cc1[nH+]cc2n1C[C@H](C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000569129801 519393485 /nfs/dbraw/zinc/39/34/85/519393485.db2.gz UONSPPOJOKMIPA-CYBMUJFWSA-N 1 1 362.817 2.674 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000572008232 519394849 /nfs/dbraw/zinc/39/48/49/519394849.db2.gz BYFZQXDNRXVCGM-LBPRGKRZSA-N 1 1 370.247 2.962 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H](n4c[nH+]c5c4CCCC5)C3)nc2c1 ZINC000578212777 519476643 /nfs/dbraw/zinc/47/66/43/519476643.db2.gz XKUQWNROOHHBDT-AWEZNQCLSA-N 1 1 366.425 2.993 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443825 519613119 /nfs/dbraw/zinc/61/31/19/519613119.db2.gz GIWQEUCZDUEEEP-GUYCJALGSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443825 519613125 /nfs/dbraw/zinc/61/31/25/519613125.db2.gz GIWQEUCZDUEEEP-GUYCJALGSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443824 519613792 /nfs/dbraw/zinc/61/37/92/519613792.db2.gz GIWQEUCZDUEEEP-DYVFJYSZSA-N 1 1 371.441 2.781 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000572443824 519613800 /nfs/dbraw/zinc/61/38/00/519613800.db2.gz GIWQEUCZDUEEEP-DYVFJYSZSA-N 1 1 371.441 2.781 20 5 FFBDMO Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c(C)cc1[N+](=O)[O-] ZINC000594483695 519992501 /nfs/dbraw/zinc/99/25/01/519992501.db2.gz NZNCHLLGFQMLII-CABCVRRESA-N 1 1 367.471 2.507 20 5 FFBDMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000600029495 520007731 /nfs/dbraw/zinc/00/77/31/520007731.db2.gz KRDUGGCFBINVAA-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO Cc1[nH+]cn(CCCCc2noc(CCn3cc([N+](=O)[O-])nc3C)n2)c1C ZINC000594535102 520016661 /nfs/dbraw/zinc/01/66/61/520016661.db2.gz SRYOGHHDUBBACJ-UHFFFAOYSA-N 1 1 373.417 2.562 20 5 FFBDMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](CCCF)CC1 ZINC000600077017 520031928 /nfs/dbraw/zinc/03/19/28/520031928.db2.gz UHBNTOXOERNIHW-MRXNPFEDSA-N 1 1 351.422 2.667 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cscc2Cl)cc1 ZINC000612591619 520039260 /nfs/dbraw/zinc/03/92/60/520039260.db2.gz HTMXLFYLBVTZMW-UHFFFAOYSA-N 1 1 360.844 2.873 20 5 FFBDMO CCCN(C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000592004878 520129768 /nfs/dbraw/zinc/12/97/68/520129768.db2.gz CAEAIWYSMICAEO-HNNXBMFYSA-N 1 1 368.865 2.916 20 5 FFBDMO COc1ccc(CC(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000600229424 520141053 /nfs/dbraw/zinc/14/10/53/520141053.db2.gz SEPYCHRYFRJCBM-MRXNPFEDSA-N 1 1 361.442 2.669 20 5 FFBDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000608854650 520145726 /nfs/dbraw/zinc/14/57/26/520145726.db2.gz WDENLVFYQLHPSD-LBPRGKRZSA-N 1 1 363.414 2.564 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1 ZINC000594854663 520190898 /nfs/dbraw/zinc/19/08/98/520190898.db2.gz VEACCJWGDYKADT-AWEZNQCLSA-N 1 1 367.471 2.589 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000600313174 520199092 /nfs/dbraw/zinc/19/90/92/520199092.db2.gz IIQCBUPARITMRQ-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)cc1SC ZINC000600314790 520201215 /nfs/dbraw/zinc/20/12/15/520201215.db2.gz POZFCMHXWNOVFZ-GFCCVEGCSA-N 1 1 367.471 2.787 20 5 FFBDMO C[C@@]1(Cc2ccccc2F)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000592143986 520221614 /nfs/dbraw/zinc/22/16/14/520221614.db2.gz WJGGJAHANKUNMU-IBGZPJMESA-N 1 1 359.401 2.993 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1C[N@@H+](CC(C)C)CCO1 ZINC000595003779 520252450 /nfs/dbraw/zinc/25/24/50/520252450.db2.gz JZUDNWCXPKGJLX-GOEBONIOSA-N 1 1 351.447 2.611 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CN(CC(C)C)CCO1 ZINC000595003779 520252458 /nfs/dbraw/zinc/25/24/58/520252458.db2.gz JZUDNWCXPKGJLX-GOEBONIOSA-N 1 1 351.447 2.611 20 5 FFBDMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000600469256 520279708 /nfs/dbraw/zinc/27/97/08/520279708.db2.gz IOCBOUOOXLWJTK-INIZCTEOSA-N 1 1 369.425 2.732 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1NCC1([N@H+]2CCOC(C)(C)C2)CCCCC1 ZINC000609417342 520307092 /nfs/dbraw/zinc/30/70/92/520307092.db2.gz ZCPUUCHNHWHGOY-UHFFFAOYSA-N 1 1 351.451 2.554 20 5 FFBDMO Cn1cc(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597925370 520326059 /nfs/dbraw/zinc/32/60/59/520326059.db2.gz NWKDXRSSBIXABB-AWEZNQCLSA-N 1 1 371.441 2.598 20 5 FFBDMO CN1CC[N@@H+](CCCNc2cccnc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000603849987 520376479 /nfs/dbraw/zinc/37/64/79/520376479.db2.gz QBMIFMBGXABQEE-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@@H+]1CCN(CCCNc2cccnc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000603849987 520376485 /nfs/dbraw/zinc/37/64/85/520376485.db2.gz QBMIFMBGXABQEE-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO C[N@H+]1CCN(CCCNc2cccnc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000603849987 520376495 /nfs/dbraw/zinc/37/64/95/520376495.db2.gz QBMIFMBGXABQEE-SFHVURJKSA-N 1 1 355.442 2.781 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@H](c3nnc4n3CCCCC4)C2)c1[N+](=O)[O-] ZINC000595297082 520391341 /nfs/dbraw/zinc/39/13/41/520391341.db2.gz JOCKQNLULLOPAG-ZDUSSCGKSA-N 1 1 360.418 2.589 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@H](c3nnc4n3CCCCC4)C2)c1[N+](=O)[O-] ZINC000595297082 520391348 /nfs/dbraw/zinc/39/13/48/520391348.db2.gz JOCKQNLULLOPAG-ZDUSSCGKSA-N 1 1 360.418 2.589 20 5 FFBDMO Cc1noc(C[NH+]2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000595408958 520451937 /nfs/dbraw/zinc/45/19/37/520451937.db2.gz GEADRISCKSQQEY-CQSZACIVSA-N 1 1 362.430 2.506 20 5 FFBDMO C[C@@H]1C[C@H](C)CN(c2ccc(C(=O)N[C@@H]3CCC[N@@H+](C)C3)cc2[N+](=O)[O-])C1 ZINC000604198967 520484003 /nfs/dbraw/zinc/48/40/03/520484003.db2.gz NCPBBWDWEGDPGM-HLLBOEOZSA-N 1 1 374.485 2.901 20 5 FFBDMO C[C@@H]1C[NH+](Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])n3C)c2)C[C@@H](C)O1 ZINC000609974880 520495015 /nfs/dbraw/zinc/49/50/15/520495015.db2.gz CFKMHINDMPAFIG-ZIAGYGMSSA-N 1 1 372.425 2.795 20 5 FFBDMO O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000595523525 520527511 /nfs/dbraw/zinc/52/75/11/520527511.db2.gz RTOXDOCHIWOZFN-MRXNPFEDSA-N 1 1 360.458 2.844 20 5 FFBDMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000610129635 520553022 /nfs/dbraw/zinc/55/30/22/520553022.db2.gz VOVCXNLGXULQHT-RYUDHWBXSA-N 1 1 351.378 2.949 20 5 FFBDMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610135247 520554131 /nfs/dbraw/zinc/55/41/31/520554131.db2.gz NLQKOJUTGKOLOF-LSDHHAIUSA-N 1 1 369.487 2.705 20 5 FFBDMO CCC[N@H+]1CC[C@@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000598341601 520564936 /nfs/dbraw/zinc/56/49/36/520564936.db2.gz DLQOANIIEYDNCN-WCQYABFASA-N 1 1 355.822 2.616 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1 ZINC000604445592 520565677 /nfs/dbraw/zinc/56/56/77/520565677.db2.gz KOBKAFGMPVOGFV-VNHYZAJKSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445592 520565686 /nfs/dbraw/zinc/56/56/86/520565686.db2.gz KOBKAFGMPVOGFV-VNHYZAJKSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1 ZINC000604445592 520565695 /nfs/dbraw/zinc/56/56/95/520565695.db2.gz KOBKAFGMPVOGFV-VNHYZAJKSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)c1 ZINC000595608733 520590807 /nfs/dbraw/zinc/59/08/07/520590807.db2.gz UWVVUKUDSXVREF-LLVKDONJSA-N 1 1 355.320 2.727 20 5 FFBDMO CCCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000592828294 520604860 /nfs/dbraw/zinc/60/48/60/520604860.db2.gz FTKGOMYYCHYDCN-AWEZNQCLSA-N 1 1 369.849 2.960 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000595665958 520633713 /nfs/dbraw/zinc/63/37/13/520633713.db2.gz ZBLOKADGQHDWLD-OAHLLOKOSA-N 1 1 373.457 2.791 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccnc(N3CCSCC3)c2)cs1 ZINC000601151738 520661885 /nfs/dbraw/zinc/66/18/85/520661885.db2.gz DFMNDVMDADQTRS-UHFFFAOYSA-N 1 1 350.469 2.894 20 5 FFBDMO Cc1c(CC(=O)NC[C@H]2CC[N@H+]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000598511933 520672871 /nfs/dbraw/zinc/67/28/71/520672871.db2.gz UZDYOAMJWDJUCQ-GOSISDBHSA-N 1 1 353.422 2.836 20 5 FFBDMO CC[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000593022784 520689841 /nfs/dbraw/zinc/68/98/41/520689841.db2.gz KSFAOIINHHCJJH-OAHLLOKOSA-N 1 1 360.414 2.973 20 5 FFBDMO O=C1[C@H]([NH+]2CCC([C@@H]3CCCCO3)CC2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595785201 520722532 /nfs/dbraw/zinc/72/25/32/520722532.db2.gz WWRXAKFVMXVSEU-MOPGFXCFSA-N 1 1 373.453 2.981 20 5 FFBDMO CN(C(=O)C[NH+]1CCC([C@@H]2CCCCO2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000595790825 520726952 /nfs/dbraw/zinc/72/69/52/520726952.db2.gz YKNUXRJZVCCGIG-SFHVURJKSA-N 1 1 361.442 2.839 20 5 FFBDMO COC(=O)c1ccnc(NC[C@@H](C)[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000598595248 520732734 /nfs/dbraw/zinc/73/27/34/520732734.db2.gz HGYSOLPWSYFZIK-CYBMUJFWSA-N 1 1 358.398 2.709 20 5 FFBDMO O=C1[C@H]([N@@H+]2CC[C@@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595831420 520755304 /nfs/dbraw/zinc/75/53/04/520755304.db2.gz NHLHEYXCQBIJCC-RTBURBONSA-N 1 1 367.405 2.853 20 5 FFBDMO O=C1[C@H]([N@H+]2CC[C@@H](Oc3ccccc3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000595831420 520755311 /nfs/dbraw/zinc/75/53/11/520755311.db2.gz NHLHEYXCQBIJCC-RTBURBONSA-N 1 1 367.405 2.853 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000598645782 520757981 /nfs/dbraw/zinc/75/79/81/520757981.db2.gz IBTUWDKYMAGNCT-YPMHNXCESA-N 1 1 374.384 2.698 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595836685 520758444 /nfs/dbraw/zinc/75/84/44/520758444.db2.gz YEEMWFUUHDQLHZ-AAEUAGOBSA-N 1 1 372.368 2.716 20 5 FFBDMO COc1cc(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000595869492 520778515 /nfs/dbraw/zinc/77/85/15/520778515.db2.gz DLKDUKGQIDYTCR-GTNSWQLSSA-N 1 1 374.384 2.698 20 5 FFBDMO CC[N@H+](CCOc1ccccc1OC)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595884561 520791951 /nfs/dbraw/zinc/79/19/51/520791951.db2.gz HYYKWNSNYDZMIT-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO CC[N@@H+](CCOc1ccccc1OC)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000595884561 520791961 /nfs/dbraw/zinc/79/19/61/520791961.db2.gz HYYKWNSNYDZMIT-UHFFFAOYSA-N 1 1 373.409 2.943 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c2c(c1)COCO2 ZINC000595905969 520812008 /nfs/dbraw/zinc/81/20/08/520812008.db2.gz YZJPWLAJTYWCCR-KDURUIRLSA-N 1 1 360.410 2.854 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC3CC2(c2ccccc2)C3)c1 ZINC000595909786 520815210 /nfs/dbraw/zinc/81/52/10/520815210.db2.gz DITIRONEOAJOCU-VDUSKEEQSA-N 1 1 354.406 2.956 20 5 FFBDMO O=C(Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000601589347 520853082 /nfs/dbraw/zinc/85/30/82/520853082.db2.gz BIUMZGQQPBHXCG-AWEZNQCLSA-N 1 1 359.357 2.553 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCC[N@@H+]2C2CC2)c(Cl)c1 ZINC000618068364 520864381 /nfs/dbraw/zinc/86/43/81/520864381.db2.gz WMIVEQNUCOBRIS-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1ccc(S(=O)(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c(Cl)c1 ZINC000618068364 520864388 /nfs/dbraw/zinc/86/43/88/520864388.db2.gz WMIVEQNUCOBRIS-ZDUSSCGKSA-N 1 1 373.862 2.543 20 5 FFBDMO O=[N+]([O-])c1cc2c(cc1CNC[C@H]1CCC[N@@H+](CC3CC3)C1)OCCO2 ZINC000596058780 520885543 /nfs/dbraw/zinc/88/55/43/520885543.db2.gz JDHOJLITJQQJEX-OAHLLOKOSA-N 1 1 361.442 2.578 20 5 FFBDMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000593316001 520903721 /nfs/dbraw/zinc/90/37/21/520903721.db2.gz OKTRDCMNEGDRMU-JJRVBVJISA-N 1 1 353.850 2.967 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945208 520912227 /nfs/dbraw/zinc/91/22/27/520912227.db2.gz SQLPIECGDSEDIQ-CABCVRRESA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](n3ccnc3)C2)cccc1[N+](=O)[O-] ZINC000610945208 520912234 /nfs/dbraw/zinc/91/22/34/520912234.db2.gz SQLPIECGDSEDIQ-CABCVRRESA-N 1 1 357.414 2.764 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000610995343 520935680 /nfs/dbraw/zinc/93/56/80/520935680.db2.gz VMHXCINQZRTMNV-DOTOQJQBSA-N 1 1 372.469 2.790 20 5 FFBDMO O=[N+]([O-])c1cccc(Br)c1N1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000596151394 520940006 /nfs/dbraw/zinc/94/00/06/520940006.db2.gz JRZVFWBNALEBOD-LBPRGKRZSA-N 1 1 370.247 2.516 20 5 FFBDMO NC(=O)c1cc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)ccc1[N+](=O)[O-] ZINC000596227095 520983457 /nfs/dbraw/zinc/98/34/57/520983457.db2.gz NGISSUFLYYMEPZ-CYBMUJFWSA-N 1 1 369.425 2.611 20 5 FFBDMO Nc1ccc(N2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)nc1[N+](=O)[O-] ZINC000596230532 520985149 /nfs/dbraw/zinc/98/51/49/520985149.db2.gz BOYQPKGDCWYMKZ-IBGZPJMESA-N 1 1 353.426 2.674 20 5 FFBDMO O=[N+]([O-])c1ccc2nc(N3CCC([N@H+]4CCCOCC4)CC3)ccc2c1 ZINC000596269715 521002510 /nfs/dbraw/zinc/00/25/10/521002510.db2.gz ZETNSJFDBAVAKJ-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO O=[N+]([O-])c1ccc2ccnc(N3CCC([N@H+]4CCCOCC4)CC3)c2c1 ZINC000596269006 521002649 /nfs/dbraw/zinc/00/26/49/521002649.db2.gz QFUKNYQQRMWXIE-UHFFFAOYSA-N 1 1 356.426 2.834 20 5 FFBDMO COc1ccc(C[N@H+]2CC[C@]3(C2)C(=O)Nc2ccccc23)cc1[N+](=O)[O-] ZINC000614584076 521035504 /nfs/dbraw/zinc/03/55/04/521035504.db2.gz YKVWZENQHJKYHV-LJQANCHMSA-N 1 1 353.378 2.699 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCO[C@@H](C(F)F)CC2)cccc1[N+](=O)[O-] ZINC000601971052 521049311 /nfs/dbraw/zinc/04/93/11/521049311.db2.gz ANPOJTBVVXRGSK-CQSZACIVSA-N 1 1 357.357 2.588 20 5 FFBDMO CC(=O)c1ccc(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000596423636 521063090 /nfs/dbraw/zinc/06/30/90/521063090.db2.gz MZTQXIZECOJUDZ-SFHVURJKSA-N 1 1 369.421 2.976 20 5 FFBDMO Cn1nc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000611272525 521071193 /nfs/dbraw/zinc/07/11/93/521071193.db2.gz ZMCHGACPDCTNPH-CYBMUJFWSA-N 1 1 352.398 2.563 20 5 FFBDMO Cn1nc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000611272525 521071203 /nfs/dbraw/zinc/07/12/03/521071203.db2.gz ZMCHGACPDCTNPH-CYBMUJFWSA-N 1 1 352.398 2.563 20 5 FFBDMO Cn1c2cc(N[C@H]3CC[N@H+](C4CCCCC4)C3)c([N+](=O)[O-])cc2n(C)c1=O ZINC000596481070 521092286 /nfs/dbraw/zinc/09/22/86/521092286.db2.gz WZDYOSHYNPPNAC-ZDUSSCGKSA-N 1 1 373.457 2.604 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350521 521114705 /nfs/dbraw/zinc/11/47/05/521114705.db2.gz PTCXACIVOZZPHX-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000611350521 521114711 /nfs/dbraw/zinc/11/47/11/521114711.db2.gz PTCXACIVOZZPHX-HOTGVXAUSA-N 1 1 361.442 2.980 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000596625203 521170937 /nfs/dbraw/zinc/17/09/37/521170937.db2.gz PNCJNEHTDMIIRI-INIZCTEOSA-N 1 1 370.409 2.999 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000611522442 521201606 /nfs/dbraw/zinc/20/16/06/521201606.db2.gz QTVOBPFXMHUMSA-OAHLLOKOSA-N 1 1 358.398 2.708 20 5 FFBDMO C[C@H]1C[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H](C)C1(F)F ZINC000599512317 521268268 /nfs/dbraw/zinc/26/82/68/521268268.db2.gz ICTZAWRPYWBJCV-RYUDHWBXSA-N 1 1 353.369 2.707 20 5 FFBDMO O=[N+]([O-])c1ccc2ncnc(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)c2c1 ZINC000611711657 521293718 /nfs/dbraw/zinc/29/37/18/521293718.db2.gz NMSYUIMKLUPZEA-ACJLOTCBSA-N 1 1 353.426 2.991 20 5 FFBDMO C[N@H+]1C[C@H](C(=O)NCCc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000599599363 521323541 /nfs/dbraw/zinc/32/35/41/521323541.db2.gz OJBYEMHOFGKJOW-MSOLQXFVSA-N 1 1 353.422 2.599 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCc3nc(C4CC4)ncc3C2)c2c(c1)COCO2 ZINC000599616499 521334100 /nfs/dbraw/zinc/33/41/00/521334100.db2.gz ACZNNEHXYXBDNF-UHFFFAOYSA-N 1 1 368.393 2.687 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2CCc3nc(C4CC4)ncc3C2)c2c(c1)COCO2 ZINC000599616499 521334116 /nfs/dbraw/zinc/33/41/16/521334116.db2.gz ACZNNEHXYXBDNF-UHFFFAOYSA-N 1 1 368.393 2.687 20 5 FFBDMO COC(=O)[C@](C)(NC[C@H]1CCCC[N@H+]1C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000599651140 521361141 /nfs/dbraw/zinc/36/11/41/521361141.db2.gz HGTMWXDGPBRPEN-IEBWSBKVSA-N 1 1 363.458 2.836 20 5 FFBDMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599664462 521377211 /nfs/dbraw/zinc/37/72/11/521377211.db2.gz NVPYQZDHSCTMJX-SKDRFNHKSA-N 1 1 368.231 2.570 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](CO)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000599675541 521389579 /nfs/dbraw/zinc/38/95/79/521389579.db2.gz QWLATAVFWMDGLJ-VXGBXAGGSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](CO)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000599675541 521389585 /nfs/dbraw/zinc/38/95/85/521389585.db2.gz QWLATAVFWMDGLJ-VXGBXAGGSA-N 1 1 374.384 2.840 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000599680379 521394432 /nfs/dbraw/zinc/39/44/32/521394432.db2.gz BLJVZULEWHBWOX-TURKWSHLSA-N 1 1 358.341 2.550 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2[C@H](C)C[C@@H](C(=O)OC)C[C@@H]2C)c1 ZINC000599692460 521405580 /nfs/dbraw/zinc/40/55/80/521405580.db2.gz SXLSXOPIZBRSGF-DABQJJPHSA-N 1 1 364.398 2.543 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)C[C@@H](C(=O)OC)C[C@@H]2C)c1 ZINC000599692460 521405584 /nfs/dbraw/zinc/40/55/84/521405584.db2.gz SXLSXOPIZBRSGF-DABQJJPHSA-N 1 1 364.398 2.543 20 5 FFBDMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731742 521434890 /nfs/dbraw/zinc/43/48/90/521434890.db2.gz RAHWKOXGYKGHMJ-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599731742 521434898 /nfs/dbraw/zinc/43/48/98/521434898.db2.gz RAHWKOXGYKGHMJ-UWVGGRQHSA-N 1 1 356.220 2.522 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000612030454 521446378 /nfs/dbraw/zinc/44/63/78/521446378.db2.gz KFUHOQDBKQJVJU-XLIONFOSSA-N 1 1 372.421 2.798 20 5 FFBDMO CC[N@H+]1C[C@@H](C)N(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C[C@H]1C ZINC000597100975 521506164 /nfs/dbraw/zinc/50/61/64/521506164.db2.gz NPBKMRPNJSWBLI-NXEZZACHSA-N 1 1 355.826 2.777 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+]([C@H]4CCOC4)CC3)o2)cc1 ZINC000597203339 521571768 /nfs/dbraw/zinc/57/17/68/521571768.db2.gz OFMAJWHAKDHPDX-KRWDZBQOSA-N 1 1 357.410 2.761 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN([C@H]4CCOC4)CC3)o2)cc1 ZINC000597203339 521571778 /nfs/dbraw/zinc/57/17/78/521571778.db2.gz OFMAJWHAKDHPDX-KRWDZBQOSA-N 1 1 357.410 2.761 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC(CO)(CO)C2)cc1[N+](=O)[O-] ZINC000597219491 521581115 /nfs/dbraw/zinc/58/11/15/521581115.db2.gz QVCACJRBSMCROL-UHFFFAOYSA-N 1 1 371.437 2.539 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C1 ZINC000619895827 521933084 /nfs/dbraw/zinc/93/30/84/521933084.db2.gz NWOGCCRCMHEULR-INIZCTEOSA-N 1 1 363.461 2.755 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000826028462 607967836 /nfs/dbraw/zinc/96/78/36/607967836.db2.gz APOUIAIRWJQIHV-NVXWUHKLSA-N 1 1 365.397 2.632 20 5 FFBDMO C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@@H]1c1ccccc1 ZINC000826028547 607967986 /nfs/dbraw/zinc/96/79/86/607967986.db2.gz CBLQFYPAKILVJE-SJORKVTESA-N 1 1 365.397 2.632 20 5 FFBDMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)n1 ZINC001164722052 720393776 /nfs/dbraw/zinc/39/37/76/720393776.db2.gz BTWYRVZYWUBDOB-SJORKVTESA-N 1 1 353.426 2.855 20 5 FFBDMO Cc1cc([N+](=O)[O-])cnc1N1CCn2c(C[N@H+](C)C(C)C)cnc2[C@@H]1C ZINC001164853522 720925166 /nfs/dbraw/zinc/92/51/66/720925166.db2.gz BMGVAFYMRLZDMM-AWEZNQCLSA-N 1 1 358.446 2.916 20 5 FFBDMO O=[N+]([O-])c1cc(Cl)c(Cl)nc1N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC001165038878 721905123 /nfs/dbraw/zinc/90/51/23/721905123.db2.gz QCLZVESIIHBNFZ-JTQLQIEISA-N 1 1 361.229 2.598 20 5 FFBDMO O=[N+]([O-])c1cnc(Cl)cc1N1CC[NH+](CCOc2ccccc2)CC1 ZINC001165044721 721954078 /nfs/dbraw/zinc/95/40/78/721954078.db2.gz PBHATILNVOAIQU-UHFFFAOYSA-N 1 1 362.817 2.844 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000746662691 735502486 /nfs/dbraw/zinc/50/24/86/735502486.db2.gz GCTGOXKVZJOOGE-CHWSQXEVSA-N 1 1 369.849 2.611 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2CCC2CCCCC2)c1 ZINC000135297546 728737251 /nfs/dbraw/zinc/73/72/51/728737251.db2.gz GHNBWRONIIIFGP-SJLPKXTDSA-N 1 1 350.463 2.977 20 5 FFBDMO COC(=O)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CCCO1 ZINC000172180793 729021148 /nfs/dbraw/zinc/02/11/48/729021148.db2.gz YCCBXQNIQNYFJT-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO COC(=O)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H]1CCCO1 ZINC000172180793 729021152 /nfs/dbraw/zinc/02/11/52/729021152.db2.gz YCCBXQNIQNYFJT-AWEZNQCLSA-N 1 1 356.806 2.792 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000174821732 729080706 /nfs/dbraw/zinc/08/07/06/729080706.db2.gz LEGJZWBKIHWIOK-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000174821732 729080709 /nfs/dbraw/zinc/08/07/09/729080709.db2.gz LEGJZWBKIHWIOK-ZDUSSCGKSA-N 1 1 351.834 2.986 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ncc1Br ZINC000752934783 736024222 /nfs/dbraw/zinc/02/42/22/736024222.db2.gz VFAWAGXEWUGKKC-JTQLQIEISA-N 1 1 373.251 2.603 20 5 FFBDMO O=C(C[N@H+](CCO)C1CCCCC1)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000778967205 738425118 /nfs/dbraw/zinc/42/51/18/738425118.db2.gz QCZHJOQWZBXQCB-UHFFFAOYSA-N 1 1 355.822 2.814 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000245423788 729569752 /nfs/dbraw/zinc/56/97/52/729569752.db2.gz JRAVLPFOIBHNAA-WFASDCNBSA-N 1 1 368.865 2.849 20 5 FFBDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1Br ZINC000760822255 736671118 /nfs/dbraw/zinc/67/11/18/736671118.db2.gz VXESFDJJGBHJTI-LLVKDONJSA-N 1 1 368.231 2.571 20 5 FFBDMO CC[N@@H+](CCNC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000859532938 730457928 /nfs/dbraw/zinc/45/79/28/730457928.db2.gz COPICSUQYAXWGT-UHFFFAOYSA-N 1 1 353.419 2.950 20 5 FFBDMO CC(C)[C@H](C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1F)[NH+]1CCCC1 ZINC000859567258 730459209 /nfs/dbraw/zinc/45/92/09/730459209.db2.gz QCLVNKYBQLFYPT-MRXNPFEDSA-N 1 1 352.362 2.580 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)ccc1Br ZINC000859925452 730469513 /nfs/dbraw/zinc/46/95/13/730469513.db2.gz JVTQBAWPTITMLM-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)ccc1Br ZINC000859925452 730469514 /nfs/dbraw/zinc/46/95/14/730469514.db2.gz JVTQBAWPTITMLM-SWLSCSKDSA-N 1 1 355.232 2.952 20 5 FFBDMO Cc1c(Br)c(N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)ncc1[N+](=O)[O-] ZINC000866209445 731040935 /nfs/dbraw/zinc/04/09/35/731040935.db2.gz SAILVMWUBUIYIN-GHMZBOCLSA-N 1 1 355.236 2.591 20 5 FFBDMO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1nn(C)cc1Br ZINC000866366700 731052444 /nfs/dbraw/zinc/05/24/44/731052444.db2.gz ADENCIKNEPKPLP-VIFPVBQESA-N 1 1 371.210 2.951 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000872720485 731819699 /nfs/dbraw/zinc/81/96/99/731819699.db2.gz QRPHTXXZHGRFHV-INMHGKMJSA-N 1 1 361.467 2.553 20 5 FFBDMO O=C1OCCN1[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877626913 732400633 /nfs/dbraw/zinc/40/06/33/732400633.db2.gz ZQKUCZGQGXOFJV-LBPRGKRZSA-N 1 1 359.304 2.640 20 5 FFBDMO O=C1OCCN1[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877626913 732400635 /nfs/dbraw/zinc/40/06/35/732400635.db2.gz ZQKUCZGQGXOFJV-LBPRGKRZSA-N 1 1 359.304 2.640 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320757 732888453 /nfs/dbraw/zinc/88/84/53/732888453.db2.gz XXJYISFUSCZOSO-DOMZBBRYSA-N 1 1 358.423 2.646 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@@H](c3nccs3)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000880320757 732888456 /nfs/dbraw/zinc/88/84/56/732888456.db2.gz XXJYISFUSCZOSO-DOMZBBRYSA-N 1 1 358.423 2.646 20 5 FFBDMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091429 738820174 /nfs/dbraw/zinc/82/01/74/738820174.db2.gz FAQDQJMOYAUUFX-UONOGXRCSA-N 1 1 361.423 2.651 20 5 FFBDMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000928091429 738820178 /nfs/dbraw/zinc/82/01/78/738820178.db2.gz FAQDQJMOYAUUFX-UONOGXRCSA-N 1 1 361.423 2.651 20 5 FFBDMO COc1c(O)ccc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1[N+](=O)[O-] ZINC000894484070 734866669 /nfs/dbraw/zinc/86/66/69/734866669.db2.gz BJDGXHNMVWFLDO-UONOGXRCSA-N 1 1 350.415 2.948 20 5 FFBDMO NC(=O)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000784069630 738859628 /nfs/dbraw/zinc/85/96/28/738859628.db2.gz NJUBTVUEDYXQBK-OAHLLOKOSA-N 1 1 351.765 2.574 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@H](COC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1 ZINC000735890827 734965366 /nfs/dbraw/zinc/96/53/66/734965366.db2.gz LNKGHAJFEHBGAU-HNNXBMFYSA-N 1 1 356.806 2.762 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CCO)c2cccs2)c2c(c1)COCO2 ZINC000740900065 735097526 /nfs/dbraw/zinc/09/75/26/735097526.db2.gz KSDNPCAIKBTNDP-CQSZACIVSA-N 1 1 350.396 2.736 20 5 FFBDMO COCCCN1CCC([NH2+][C@@H](C)c2cc(OC)cc([N+](=O)[O-])c2)CC1 ZINC000903086859 736028674 /nfs/dbraw/zinc/02/86/74/736028674.db2.gz BBOYPAYDFDFNRK-AWEZNQCLSA-N 1 1 351.447 2.755 20 5 FFBDMO COc1cc([C@H](C)NCCC[N@H+]2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160466 736045153 /nfs/dbraw/zinc/04/51/53/736045153.db2.gz MMOYSLOTQZGUPN-CABCVRRESA-N 1 1 351.447 2.755 20 5 FFBDMO COc1cc([C@H](C)[NH2+]CCCN2CCCO[C@H](C)C2)cc([N+](=O)[O-])c1 ZINC000903160466 736045157 /nfs/dbraw/zinc/04/51/57/736045157.db2.gz MMOYSLOTQZGUPN-CABCVRRESA-N 1 1 351.447 2.755 20 5 FFBDMO Cc1c(COC(=O)[C@@H]([NH2+]C2CCOCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000754510034 736166932 /nfs/dbraw/zinc/16/69/32/736166932.db2.gz MYUSUSZMAMIHQY-KRWDZBQOSA-N 1 1 350.415 2.740 20 5 FFBDMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C[C@H]1C ZINC000766557965 737242139 /nfs/dbraw/zinc/24/21/39/737242139.db2.gz XEXIGWVVAVIASH-MNOVXSKESA-N 1 1 370.247 2.912 20 5 FFBDMO CC(C)OC(=O)C[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000766910790 737274566 /nfs/dbraw/zinc/27/45/66/737274566.db2.gz RQFTZLKLWFMXRN-YOEHRIQHSA-N 1 1 350.415 2.682 20 5 FFBDMO C[C@H]1CCC[N@H+]1CCNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000770295605 737613332 /nfs/dbraw/zinc/61/33/32/737613332.db2.gz ATOLAICYPQGGOC-JTQLQIEISA-N 1 1 356.220 2.571 20 5 FFBDMO C[C@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000770687328 737653087 /nfs/dbraw/zinc/65/30/87/737653087.db2.gz IPKFQXRMKFNQKW-XPTSAGLGSA-N 1 1 369.830 2.960 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C ZINC000777996397 738340354 /nfs/dbraw/zinc/34/03/54/738340354.db2.gz AFLBGVHMCSIUNG-ZDUSSCGKSA-N 1 1 373.450 2.585 20 5 FFBDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000778031781 738345767 /nfs/dbraw/zinc/34/57/67/738345767.db2.gz HVQBRYSJTGCDSP-HIFRSBDPSA-N 1 1 353.369 2.772 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C[C@H]1C ZINC000778287357 738369701 /nfs/dbraw/zinc/36/97/01/738369701.db2.gz IGQJZEXAKMGWCH-PWSUYJOCSA-N 1 1 363.443 2.544 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929364763 738976341 /nfs/dbraw/zinc/97/63/41/738976341.db2.gz LRKDVVMMIXWROE-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO CC(=O)NC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929364763 738976338 /nfs/dbraw/zinc/97/63/38/738976338.db2.gz LRKDVVMMIXWROE-GFCCVEGCSA-N 1 1 370.247 2.705 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929486011 738991685 /nfs/dbraw/zinc/99/16/85/738991685.db2.gz SSEULNKVAZEPGD-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO NC(=O)CC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929486011 738991688 /nfs/dbraw/zinc/99/16/88/738991688.db2.gz SSEULNKVAZEPGD-LLVKDONJSA-N 1 1 370.247 2.835 20 5 FFBDMO COCCOC[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929733784 739015772 /nfs/dbraw/zinc/01/57/72/739015772.db2.gz YJFHFRMKOCGJDV-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO COCCOC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC000929733784 739015773 /nfs/dbraw/zinc/01/57/73/739015773.db2.gz YJFHFRMKOCGJDV-LBPRGKRZSA-N 1 1 373.247 2.842 20 5 FFBDMO CC(C)N1CC[NH+](CCCOC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000787577965 739148124 /nfs/dbraw/zinc/14/81/24/739148124.db2.gz DTZMGRUCGKOPBA-UHFFFAOYSA-N 1 1 369.849 2.821 20 5 FFBDMO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ncc(Br)cn1 ZINC000931869637 739344588 /nfs/dbraw/zinc/34/45/88/739344588.db2.gz RQPXOHMFIHXGMH-UHFFFAOYSA-N 1 1 351.204 2.822 20 5 FFBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ncc(Br)cn1 ZINC000931869637 739344589 /nfs/dbraw/zinc/34/45/89/739344589.db2.gz RQPXOHMFIHXGMH-UHFFFAOYSA-N 1 1 351.204 2.822 20 5 FFBDMO CC(C)(C)OC(=O)NCCC(N)=[NH+]OCc1c(F)cccc1[N+](=O)[O-] ZINC000789653330 739377592 /nfs/dbraw/zinc/37/75/92/739377592.db2.gz RBPZKDQPWAWCLP-UHFFFAOYSA-N 1 1 356.354 2.647 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2nc3c(s2)CCC3)C1 ZINC000932188050 739400763 /nfs/dbraw/zinc/40/07/63/739400763.db2.gz IKHFQGBEWJKCHE-ZDUSSCGKSA-N 1 1 361.471 2.925 20 5 FFBDMO CC(C)(C)[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1 ZINC000790431736 739453196 /nfs/dbraw/zinc/45/31/96/739453196.db2.gz QFLXVNRPCROALS-OAHLLOKOSA-N 1 1 353.394 2.809 20 5 FFBDMO Cn1cc(C[NH+]2CCC(Cc3nc4c(s3)CCC4)CC2)c([N+](=O)[O-])n1 ZINC000932622343 739480153 /nfs/dbraw/zinc/48/01/53/739480153.db2.gz GYJOZCNPOAOPJA-UHFFFAOYSA-N 1 1 361.471 2.728 20 5 FFBDMO CC(C)C[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000933247733 739588584 /nfs/dbraw/zinc/58/85/84/739588584.db2.gz IPCFSOKFCJTWSM-CQSZACIVSA-N 1 1 368.865 2.849 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000933368808 739611282 /nfs/dbraw/zinc/61/12/82/739611282.db2.gz LFUONBXSXPSPMP-BBRMVZONSA-N 1 1 351.422 2.998 20 5 FFBDMO Cn1cc([C@H]2CSCCC[N@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000933977136 739713360 /nfs/dbraw/zinc/71/33/60/739713360.db2.gz ZBLHOOCWULDPGF-SJORKVTESA-N 1 1 362.455 2.542 20 5 FFBDMO CSC[C@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000793795338 739814363 /nfs/dbraw/zinc/81/43/63/739814363.db2.gz HBUWMWZDNZHUSM-AWEZNQCLSA-N 1 1 364.471 2.869 20 5 FFBDMO CSC[C@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000793795338 739814370 /nfs/dbraw/zinc/81/43/70/739814370.db2.gz HBUWMWZDNZHUSM-AWEZNQCLSA-N 1 1 364.471 2.869 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000799199095 740399215 /nfs/dbraw/zinc/39/92/15/740399215.db2.gz PORLZKZZPAMOSL-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO CCOC(=O)[C@@]1(COC)CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000799199095 740399217 /nfs/dbraw/zinc/39/92/17/740399217.db2.gz PORLZKZZPAMOSL-KRWDZBQOSA-N 1 1 354.378 2.526 20 5 FFBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801507847 740625425 /nfs/dbraw/zinc/62/54/25/740625425.db2.gz JFTQCSGACJEKIB-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801507847 740625426 /nfs/dbraw/zinc/62/54/26/740625426.db2.gz JFTQCSGACJEKIB-NSHDSACASA-N 1 1 367.402 2.574 20 5 FFBDMO O=C(CCCC[NH+]1CCOCC1)OCc1ccc([N+](=O)[O-])cc1Cl ZINC000803512357 740806793 /nfs/dbraw/zinc/80/67/93/740806793.db2.gz HUCPTNFJKBDMOI-UHFFFAOYSA-N 1 1 356.806 2.794 20 5 FFBDMO CCCC[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000809859997 741357054 /nfs/dbraw/zinc/35/70/54/741357054.db2.gz GBHKAEWJUGJLQF-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000811478309 741527415 /nfs/dbraw/zinc/52/74/15/741527415.db2.gz FYXKGPCHZQTVMT-CHWSQXEVSA-N 1 1 360.241 2.854 20 5 FFBDMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCSCC1 ZINC000813173401 741684526 /nfs/dbraw/zinc/68/45/26/741684526.db2.gz BTVCPYASRZKTRL-INIZCTEOSA-N 1 1 350.440 2.856 20 5 FFBDMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCSCC1 ZINC000813173401 741684527 /nfs/dbraw/zinc/68/45/27/741684527.db2.gz BTVCPYASRZKTRL-INIZCTEOSA-N 1 1 350.440 2.856 20 5 FFBDMO Cc1ccc(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(Cl)c1 ZINC001001398434 742118883 /nfs/dbraw/zinc/11/88/83/742118883.db2.gz DWTAQQXWAIQFGA-NVXWUHKLSA-N 1 1 365.861 2.642 20 5 FFBDMO CCN(C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000822138859 742701825 /nfs/dbraw/zinc/70/18/25/742701825.db2.gz MJZOSJCKYLVOIF-NSHDSACASA-N 1 1 371.235 2.915 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[NH+](CCc2cccs2)CC1 ZINC000823363753 742892144 /nfs/dbraw/zinc/89/21/44/742892144.db2.gz LEDNENPEAQRNEQ-UHFFFAOYSA-N 1 1 363.414 2.796 20 5 FFBDMO CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCc2ccccc2Cl)CC1 ZINC001045437437 743275265 /nfs/dbraw/zinc/27/52/65/743275265.db2.gz RCKLDOHTNAFQAG-GDBMZVCRSA-N 1 1 365.861 2.518 20 5 FFBDMO Cc1nn(CCC(=O)OC[C@H]2CCCC[N@@H+]2C(C)C)c(C)c1[N+](=O)[O-] ZINC000837493811 746459239 /nfs/dbraw/zinc/45/92/39/746459239.db2.gz PNZVLXAHVNXTQU-OAHLLOKOSA-N 1 1 352.435 2.604 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000839440444 746828781 /nfs/dbraw/zinc/82/87/81/746828781.db2.gz SQPZAIWMWWHZDD-NSHDSACASA-N 1 1 370.247 2.912 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1c1ccccc1 ZINC000839640590 746878796 /nfs/dbraw/zinc/87/87/96/746878796.db2.gz KSCHMJIEHJLLKI-JKSUJKDBSA-N 1 1 359.813 2.949 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=S)NNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000840789647 747184160 /nfs/dbraw/zinc/18/41/60/747184160.db2.gz ICCXDEILYKDDBZ-NSHDSACASA-N 1 1 357.867 2.524 20 5 FFBDMO CO[C@H](CC(C)C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367037 747580441 /nfs/dbraw/zinc/58/04/41/747580441.db2.gz RYZHWXIUKZWXBJ-DLBZAZTESA-N 1 1 350.415 2.773 20 5 FFBDMO CO[C@H](CC(C)C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000842367037 747580445 /nfs/dbraw/zinc/58/04/45/747580445.db2.gz RYZHWXIUKZWXBJ-DLBZAZTESA-N 1 1 350.415 2.773 20 5 FFBDMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)c1cccc([N+](=O)[O-])c1Br ZINC000844643566 748062454 /nfs/dbraw/zinc/06/24/54/748062454.db2.gz UHWZZQIAFZEWHX-HBNTYKKESA-N 1 1 370.247 2.910 20 5 FFBDMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)C1 ZINC000844903119 748132540 /nfs/dbraw/zinc/13/25/40/748132540.db2.gz SRMUBSFWYXBIAS-CPUCHLNUSA-N 1 1 353.850 2.967 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000846989823 748592935 /nfs/dbraw/zinc/59/29/35/748592935.db2.gz VYTWIKHTDCSHPF-LBPRGKRZSA-N 1 1 357.813 2.873 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000848490227 748939490 /nfs/dbraw/zinc/93/94/90/748939490.db2.gz XQRJRXGDJFWJJD-GOEBONIOSA-N 1 1 351.353 2.599 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000848490227 748939495 /nfs/dbraw/zinc/93/94/95/748939495.db2.gz XQRJRXGDJFWJJD-GOEBONIOSA-N 1 1 351.353 2.599 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CN(C(=O)OC(C)(C)C)C1 ZINC000850439855 749365391 /nfs/dbraw/zinc/36/53/91/749365391.db2.gz PMRDLOPRCKYLOE-NSHDSACASA-N 1 1 351.403 2.873 20 5 FFBDMO Cc1noc(C[N@@H+]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851743635 749658693 /nfs/dbraw/zinc/65/86/93/749658693.db2.gz WBIRDBDGGDDUPC-LBPRGKRZSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[N@H+]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[N+](=O)[O-] ZINC000851743635 749658699 /nfs/dbraw/zinc/65/86/99/749658699.db2.gz WBIRDBDGGDDUPC-LBPRGKRZSA-N 1 1 354.407 2.628 20 5 FFBDMO Cc1noc(C[NH2+][C@](C)(CNC(=O)OC(C)(C)C)C2CC2)c1[N+](=O)[O-] ZINC000851853964 749704582 /nfs/dbraw/zinc/70/45/82/749704582.db2.gz NFISGKFVDSLYRG-MRXNPFEDSA-N 1 1 354.407 2.674 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(NS(C)(=O)=O)c1 ZINC000851921461 749727400 /nfs/dbraw/zinc/72/74/00/749727400.db2.gz ROPXCPUEHCPDAU-LLVKDONJSA-N 1 1 367.402 2.956 20 5 FFBDMO CC[N@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504542 750076036 /nfs/dbraw/zinc/07/60/36/750076036.db2.gz SYQXIZXPGJZZQL-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO CC[N@@H+](CCc1nccs1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853504542 750076041 /nfs/dbraw/zinc/07/60/41/750076041.db2.gz SYQXIZXPGJZZQL-UHFFFAOYSA-N 1 1 358.427 2.832 20 5 FFBDMO Cn1cc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000895843987 970993550 /nfs/dbraw/zinc/99/35/50/970993550.db2.gz KWTSVFZGLBPDMO-CRAIPNDOSA-N 1 1 356.426 2.996 20 5 FFBDMO Cc1cc(C[NH2+]CCC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)s1 ZINC001267908906 971607871 /nfs/dbraw/zinc/60/78/71/971607871.db2.gz VAXXCQAWXIPVMZ-IAGOWNOFSA-N 1 1 365.499 2.748 20 5 FFBDMO COC(=O)c1ncc([N+](=O)[O-])c(C)c1NCCC[N@H+]1CCCC[C@@H]1C ZINC001167751078 971699302 /nfs/dbraw/zinc/69/93/02/971699302.db2.gz FFVYWWHYZOOUPY-LBPRGKRZSA-N 1 1 350.419 2.761 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CC[C@@H](Oc4ccncc4)C3)c2)cc1 ZINC000121106568 961981933 /nfs/dbraw/zinc/98/19/33/961981933.db2.gz JBJUOUSWOWXJJA-LJQANCHMSA-N 1 1 365.393 2.964 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@@H](Oc4ccncc4)C3)c2)cc1 ZINC000121106568 961981949 /nfs/dbraw/zinc/98/19/49/961981949.db2.gz JBJUOUSWOWXJJA-LJQANCHMSA-N 1 1 365.393 2.964 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174965862 1013354804 /nfs/dbraw/zinc/35/48/04/1013354804.db2.gz UYJCULJDGQMKIJ-LLVKDONJSA-N 1 1 362.361 2.623 20 5 FFBDMO CCOC(=O)c1c[nH]nc1[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174965862 1013354814 /nfs/dbraw/zinc/35/48/14/1013354814.db2.gz UYJCULJDGQMKIJ-LLVKDONJSA-N 1 1 362.361 2.623 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226885 962758487 /nfs/dbraw/zinc/75/84/87/962758487.db2.gz CDSMSRAZFPCNML-KUHUBIRLSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226885 962758503 /nfs/dbraw/zinc/75/85/03/962758503.db2.gz CDSMSRAZFPCNML-KUHUBIRLSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226905 962762392 /nfs/dbraw/zinc/76/23/92/962762392.db2.gz CDSMSRAZFPCNML-IFXJQAMLSA-N 1 1 369.421 2.882 20 5 FFBDMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000134226905 962762406 /nfs/dbraw/zinc/76/24/06/962762406.db2.gz CDSMSRAZFPCNML-IFXJQAMLSA-N 1 1 369.421 2.882 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccnc(OCC[NH+](C)C)c1 ZINC000873097635 1013384127 /nfs/dbraw/zinc/38/41/27/1013384127.db2.gz UIUWLWXVZWJAFH-UHFFFAOYSA-N 1 1 358.442 2.837 20 5 FFBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2Cc3cccnc3N3CCC[C@@H]3C2)cc1 ZINC001175502630 1013496029 /nfs/dbraw/zinc/49/60/29/1013496029.db2.gz FCQNKGOTASOMJR-QGZVFWFLSA-N 1 1 354.410 2.853 20 5 FFBDMO COc1c(O)ccc(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c1[N+](=O)[O-] ZINC000895091331 967532541 /nfs/dbraw/zinc/53/25/41/967532541.db2.gz UTVJGXWZEJWALJ-LJQANCHMSA-N 1 1 358.394 2.575 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000050901256 968104333 /nfs/dbraw/zinc/10/43/33/968104333.db2.gz KIGRZDVNIPSQNU-HUUCEWRRSA-N 1 1 373.457 2.919 20 5 FFBDMO C[C@@]12CN(C(=O)c3ccc([N+](=O)[O-])cn3)C[C@@H]1C[N@@H+](Cc1ccccc1)C2 ZINC000874511416 1013845290 /nfs/dbraw/zinc/84/52/90/1013845290.db2.gz UOGWLCLRAXMIHM-OXJNMPFZSA-N 1 1 366.421 2.584 20 5 FFBDMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000874847387 1013917710 /nfs/dbraw/zinc/91/77/10/1013917710.db2.gz PBMBBLHGKQLCHA-OALUTQOASA-N 1 1 372.469 2.894 20 5 FFBDMO C[C@H](OC(=O)[C@H]1CC[N@@H+](C)C[C@@H]1c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000875160959 1013982320 /nfs/dbraw/zinc/98/23/20/1013982320.db2.gz DLDBPCYQHSMXPE-DOPJRALCSA-N 1 1 372.425 2.668 20 5 FFBDMO C[C@H](OC(=O)[C@@H]1CC[N@@H+](C)C[C@H]1c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000875160965 1013982352 /nfs/dbraw/zinc/98/23/52/1013982352.db2.gz DLDBPCYQHSMXPE-VHSSKADRSA-N 1 1 372.425 2.668 20 5 FFBDMO COC(=O)[C@H](C)C[N@@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000103458331 970398040 /nfs/dbraw/zinc/39/80/40/970398040.db2.gz ZXGLVDMTJNKPKS-CYBMUJFWSA-N 1 1 358.398 2.689 20 5 FFBDMO C[N@@H+](CC1CCCCC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000027080421 973029994 /nfs/dbraw/zinc/02/99/94/973029994.db2.gz JUMLELABIMBQGA-IBGZPJMESA-N 1 1 374.441 2.831 20 5 FFBDMO CCOc1ccccc1N1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178563241 977277294 /nfs/dbraw/zinc/27/72/94/977277294.db2.gz MOLCBRXQBSDBQJ-IBGZPJMESA-N 1 1 371.437 2.849 20 5 FFBDMO CC[C@@H](CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000236994725 978392930 /nfs/dbraw/zinc/39/29/30/978392930.db2.gz TYXKAJKRJFJRRE-KRWDZBQOSA-N 1 1 357.458 2.959 20 5 FFBDMO O=C(N[C@H]1C[C@@](C[NH2+]CC2CCCC2)(c2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001105423478 979430693 /nfs/dbraw/zinc/43/06/93/979430693.db2.gz XEDJKELAVVTDBK-XCJLJZCSSA-N 1 1 371.481 2.648 20 5 FFBDMO C[C@H]1CN(Cc2ccccc2)C[C@@H]1C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877665871 1014667779 /nfs/dbraw/zinc/66/77/79/1014667779.db2.gz MLCJIHVSHAORBM-FLODPWGTSA-N 1 1 369.469 2.853 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687740 1014679917 /nfs/dbraw/zinc/67/99/17/1014679917.db2.gz LLVDIZIDJPNMAV-ZWKOTPCHSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877687740 1014679923 /nfs/dbraw/zinc/67/99/23/1014679923.db2.gz LLVDIZIDJPNMAV-ZWKOTPCHSA-N 1 1 354.410 2.599 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688811 1014682849 /nfs/dbraw/zinc/68/28/49/1014682849.db2.gz VVSITRAYMJBBJG-ZWKOTPCHSA-N 1 1 368.437 2.908 20 5 FFBDMO CO[C@@H]1C[C@H]2C[N@@H+](Cc3ccc(C)c([N+](=O)[O-])c3)Cc3cccnc3N2C1 ZINC000877688811 1014682856 /nfs/dbraw/zinc/68/28/56/1014682856.db2.gz VVSITRAYMJBBJG-ZWKOTPCHSA-N 1 1 368.437 2.908 20 5 FFBDMO Cn1cc(CN2CC[C@H]3[C@H](CC[N@H+]3C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000877742597 1014704403 /nfs/dbraw/zinc/70/44/03/1014704403.db2.gz FMBCPXUUWJFOHF-QAPCUYQASA-N 1 1 355.442 2.521 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000878163346 1014893211 /nfs/dbraw/zinc/89/32/11/1014893211.db2.gz QJLAMHGXSSYYLS-KGLIPLIRSA-N 1 1 359.430 2.949 20 5 FFBDMO CC[N@@H+](CCc1ccccn1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000764313176 984423168 /nfs/dbraw/zinc/42/31/68/984423168.db2.gz DQSCNSYSPWTRQJ-GOSISDBHSA-N 1 1 354.410 2.660 20 5 FFBDMO CC(C)Cc1ccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001002786564 987475932 /nfs/dbraw/zinc/47/59/32/987475932.db2.gz BYOQRROYFPZYKG-RTBURBONSA-N 1 1 359.470 2.631 20 5 FFBDMO CC[N@@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@H]1C(C)C ZINC000922392708 988552122 /nfs/dbraw/zinc/55/21/22/988552122.db2.gz GOGRAJNCOPJJOR-MKXGPGLRSA-N 1 1 365.449 2.693 20 5 FFBDMO CC[N@H+]1C[C@]2(C[C@@H](O)[C@H](NCc3ccc([N+](=O)[O-])cc3F)C2)[C@H]1C(C)C ZINC000922392708 988552131 /nfs/dbraw/zinc/55/21/31/988552131.db2.gz GOGRAJNCOPJJOR-MKXGPGLRSA-N 1 1 365.449 2.693 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879237284 1015428890 /nfs/dbraw/zinc/42/88/90/1015428890.db2.gz XHKFFQISXLCLNV-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO CC(=O)Nc1cccc2c1C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000879237284 1015428898 /nfs/dbraw/zinc/42/88/98/1015428898.db2.gz XHKFFQISXLCLNV-LJQANCHMSA-N 1 1 355.394 2.645 20 5 FFBDMO CC(C)c1ccccc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001034644503 990148776 /nfs/dbraw/zinc/14/87/76/990148776.db2.gz IDRRVQVFWLYMOO-PSBWJHGTSA-N 1 1 359.470 2.992 20 5 FFBDMO COc1cc(C[NH+]2CCC(C(=O)NCC(C)C)CC2)c([N+](=O)[O-])cc1F ZINC000766109800 990174249 /nfs/dbraw/zinc/17/42/49/990174249.db2.gz XRSAZPAJSFJMLR-UHFFFAOYSA-N 1 1 367.421 2.727 20 5 FFBDMO CCOC[C@H]1CCC[N@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154748801 990418877 /nfs/dbraw/zinc/41/88/77/990418877.db2.gz DQXABESBQRJQCK-HNNXBMFYSA-N 1 1 362.430 2.543 20 5 FFBDMO CCOC[C@H]1CCC[N@@H+](CN2CCN(c3ccccc3[N+](=O)[O-])C2=O)C1 ZINC000154748801 990418880 /nfs/dbraw/zinc/41/88/80/990418880.db2.gz DQXABESBQRJQCK-HNNXBMFYSA-N 1 1 362.430 2.543 20 5 FFBDMO C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000918577714 990435978 /nfs/dbraw/zinc/43/59/78/990435978.db2.gz NWUVFSUMBNWUFZ-HNNXBMFYSA-N 1 1 360.458 2.657 20 5 FFBDMO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c1 ZINC000175252906 991180578 /nfs/dbraw/zinc/18/05/78/991180578.db2.gz HRRQGXBYIPDLJT-QGZVFWFLSA-N 1 1 360.414 2.562 20 5 FFBDMO C[C@@H]1CCCC[N@@H+]1CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237680919 991306514 /nfs/dbraw/zinc/30/65/14/991306514.db2.gz RIGALRDUMLAMBL-OAHLLOKOSA-N 1 1 357.458 2.959 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237680919 991306521 /nfs/dbraw/zinc/30/65/21/991306521.db2.gz RIGALRDUMLAMBL-OAHLLOKOSA-N 1 1 357.458 2.959 20 5 FFBDMO CCCCC[C@@H](C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664892 993255372 /nfs/dbraw/zinc/25/53/72/993255372.db2.gz ASLHPWAQFMSPIC-CABCVRRESA-N 1 1 363.462 2.561 20 5 FFBDMO CCCCC[C@@H](C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000072664892 993255379 /nfs/dbraw/zinc/25/53/79/993255379.db2.gz ASLHPWAQFMSPIC-CABCVRRESA-N 1 1 363.462 2.561 20 5 FFBDMO C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])c4ccncc34)CC[C@@H]21 ZINC000880164947 1015770597 /nfs/dbraw/zinc/77/05/97/1015770597.db2.gz HIQPWPPHTVNWFA-WBMJQRKESA-N 1 1 355.398 2.701 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C(N)=O)(N2CCCCC2)CC1 ZINC000880252585 1015791031 /nfs/dbraw/zinc/79/10/31/1015791031.db2.gz ARNXKAUGRBHJMA-INIZCTEOSA-N 1 1 374.485 2.770 20 5 FFBDMO NC(=O)c1ccc(C[N@@H+]2Cc3ccccc3N3CCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000880550760 1015869229 /nfs/dbraw/zinc/86/92/29/1015869229.db2.gz ATAUXVWLZNVXHA-QGZVFWFLSA-N 1 1 366.421 2.678 20 5 FFBDMO O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])O[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000810845909 994950864 /nfs/dbraw/zinc/95/08/64/994950864.db2.gz WBJPRYXIYDMPRV-UKRRQHHQSA-N 1 1 363.370 2.606 20 5 FFBDMO CC(C)(C)c1ccc([N+](=O)[O-])cc1NC(=O)NCCC[NH+]1CCOCC1 ZINC000880706940 1015952036 /nfs/dbraw/zinc/95/20/36/1015952036.db2.gz XWAROKFEJINCEJ-UHFFFAOYSA-N 1 1 364.446 2.736 20 5 FFBDMO O=C(/C=C\c1cccnc1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172018 995631913 /nfs/dbraw/zinc/63/19/13/995631913.db2.gz ZPWDHNSHCJJUKE-MJRGOJFPSA-N 1 1 353.378 2.821 20 5 FFBDMO O=C(/C=C\c1cccnc1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172018 995631916 /nfs/dbraw/zinc/63/19/16/995631916.db2.gz ZPWDHNSHCJJUKE-MJRGOJFPSA-N 1 1 353.378 2.821 20 5 FFBDMO CC[C@@H]1C[C@@H](C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173874 995633743 /nfs/dbraw/zinc/63/37/43/995633743.db2.gz LCKLJUSHWIALSG-JQHSSLGASA-N 1 1 362.426 2.918 20 5 FFBDMO CC[C@@H]1C[C@@H](C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CCO1 ZINC000813173874 995633745 /nfs/dbraw/zinc/63/37/45/995633745.db2.gz LCKLJUSHWIALSG-JQHSSLGASA-N 1 1 362.426 2.918 20 5 FFBDMO NC(=O)COc1ccc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000824820453 997101601 /nfs/dbraw/zinc/10/16/01/997101601.db2.gz FYYMNRVSOJZKQG-KRWDZBQOSA-N 1 1 369.421 2.839 20 5 FFBDMO C[N@@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000803731866 1016112737 /nfs/dbraw/zinc/11/27/37/1016112737.db2.gz SGTBEDXHWYBWKT-FNUUXAGOSA-N 1 1 365.433 2.993 20 5 FFBDMO C[N@H+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C[C@H]1Cc1ccccc1 ZINC000803731866 1016112742 /nfs/dbraw/zinc/11/27/42/1016112742.db2.gz SGTBEDXHWYBWKT-FNUUXAGOSA-N 1 1 365.433 2.993 20 5 FFBDMO Cc1c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000730786763 997481687 /nfs/dbraw/zinc/48/16/87/997481687.db2.gz RPXFWZCCAYYMKO-TXEJJXNPSA-N 1 1 364.402 2.804 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000731212815 997741831 /nfs/dbraw/zinc/74/18/31/997741831.db2.gz GBVBDSCDOSNTQE-IYBDPMFKSA-N 1 1 360.458 2.506 20 5 FFBDMO Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)OC[C@@H]2CC[N@@H+](C)[C@@H]2C)c1 ZINC000845822267 998667158 /nfs/dbraw/zinc/66/71/58/998667158.db2.gz URHBTCBUFGLYAE-PBHICJAKSA-N 1 1 372.425 2.645 20 5 FFBDMO C[C@H](OC(=O)CC[C@@H]1CCCC[N@H+]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000803855291 1016245902 /nfs/dbraw/zinc/24/59/02/1016245902.db2.gz FIFZPROCHFYMEO-ZFWWWQNUSA-N 1 1 363.414 2.730 20 5 FFBDMO Cc1cc(C)cc(C[NH+]2CCC(C3(NC(=O)[C@@H]4CC4[N+](=O)[O-])CC3)CC2)c1 ZINC001000149270 1016245035 /nfs/dbraw/zinc/24/50/35/1016245035.db2.gz KCOCZKDQROKUSV-RTBURBONSA-N 1 1 371.481 2.829 20 5 FFBDMO CCc1ccccc1C[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1 ZINC001000155628 1016249712 /nfs/dbraw/zinc/24/97/12/1016249712.db2.gz SVMBWOVASCGTOU-RTBURBONSA-N 1 1 371.481 2.775 20 5 FFBDMO COc1ccc(C(=O)N2C[C@@H]3C[C@H]2C[N@@H+]3Cc2ccccc2)cc1[N+](=O)[O-] ZINC000824742410 999258704 /nfs/dbraw/zinc/25/87/04/999258704.db2.gz QXELSBDYRMYXNO-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO COc1ccc(C(=O)N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)cc1[N+](=O)[O-] ZINC000824742410 999258707 /nfs/dbraw/zinc/25/87/07/999258707.db2.gz QXELSBDYRMYXNO-IRXDYDNUSA-N 1 1 367.405 2.702 20 5 FFBDMO CC(C)[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000741010508 999699856 /nfs/dbraw/zinc/69/98/56/999699856.db2.gz GNBPMMKJVSZFNW-KRWDZBQOSA-N 1 1 363.414 2.587 20 5 FFBDMO C[C@@H](C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[NH+]1CCCCCC1 ZINC000741031286 999701260 /nfs/dbraw/zinc/70/12/60/999701260.db2.gz OJTBGVFKPKYDGU-ZDUSSCGKSA-N 1 1 374.397 2.953 20 5 FFBDMO Cc1c(C(=O)NCC[N@H+](C)Cc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000065419352 999933450 /nfs/dbraw/zinc/93/34/50/999933450.db2.gz LUWACPROAZBIDU-UHFFFAOYSA-N 1 1 372.381 2.673 20 5 FFBDMO CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169011032 1000015238 /nfs/dbraw/zinc/01/52/38/1000015238.db2.gz HLXXRBZEVGUMBL-JTOWHCCKSA-N 1 1 353.463 2.811 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[C@@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC[C@H]21 ZINC001169010726 1000015290 /nfs/dbraw/zinc/01/52/90/1000015290.db2.gz FUIAMHHSKRWEKK-ZJIFWQFVSA-N 1 1 353.463 2.763 20 5 FFBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCN(c3c(Cl)cncc3Cl)CC2)C1 ZINC001169036691 1000016769 /nfs/dbraw/zinc/01/67/69/1000016769.db2.gz PPOHJXSFWSFZHA-NWDGAFQWSA-N 1 1 359.257 2.956 20 5 FFBDMO O=C(OCc1ccccc1)[C@H]1CCC[NH2+][C@@H](Nc2cccnc2[N+](=O)[O-])C1 ZINC001169519137 1000055921 /nfs/dbraw/zinc/05/59/21/1000055921.db2.gz MZRANCIAKAWZJJ-RDJZCZTQSA-N 1 1 370.409 2.861 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1 ZINC001000674100 1016422812 /nfs/dbraw/zinc/42/28/12/1016422812.db2.gz LRPIVVPCRJNALL-RTBURBONSA-N 1 1 371.481 2.898 20 5 FFBDMO CC(C)(C)c1ccc(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000674100 1016422820 /nfs/dbraw/zinc/42/28/20/1016422820.db2.gz LRPIVVPCRJNALL-RTBURBONSA-N 1 1 371.481 2.898 20 5 FFBDMO CC(C)(C)c1ccc(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001000674100 1016422830 /nfs/dbraw/zinc/42/28/30/1016422830.db2.gz LRPIVVPCRJNALL-RTBURBONSA-N 1 1 371.481 2.898 20 5 FFBDMO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)c1ccnnc1 ZINC001147201482 1000846285 /nfs/dbraw/zinc/84/62/85/1000846285.db2.gz NYKGAMJYJKOCRH-UHFFFAOYSA-N 1 1 359.389 2.733 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2C1)OCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000786814938 1001632234 /nfs/dbraw/zinc/63/22/34/1001632234.db2.gz DSTVBISEJMCGLB-UHFFFAOYSA-N 1 1 368.389 2.769 20 5 FFBDMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517605 1001964614 /nfs/dbraw/zinc/96/46/14/1001964614.db2.gz HRLSUBALQLBXDY-LZWOXQAQSA-N 1 1 360.458 2.796 20 5 FFBDMO O=[N+]([O-])c1cccc([C@@H](O)CN2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)c1 ZINC000791624121 1002748347 /nfs/dbraw/zinc/74/83/47/1002748347.db2.gz XVWJNIFWYZXCNS-ZVDOUQERSA-N 1 1 367.449 2.692 20 5 FFBDMO O=[N+]([O-])c1cc[n+]([O-])c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1F ZINC001170330724 1003116925 /nfs/dbraw/zinc/11/69/25/1003116925.db2.gz SLGDKLAAXFNRQI-PHZGNYQRSA-N 1 1 372.400 2.975 20 5 FFBDMO COc1ccc(C[C@@H](C)[NH+]2CCN(Cc3ccccn3)CC2)c([N+](=O)[O-])c1 ZINC001170336515 1003119195 /nfs/dbraw/zinc/11/91/95/1003119195.db2.gz YJLYBSDTHWBHKC-MRXNPFEDSA-N 1 1 370.453 2.747 20 5 FFBDMO COC(=O)C[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC001170352783 1003121317 /nfs/dbraw/zinc/12/13/17/1003121317.db2.gz QFTRNWOMYVQBPS-CYBMUJFWSA-N 1 1 350.415 2.952 20 5 FFBDMO COC(=O)C[N@@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C1CCCC1 ZINC001170352783 1003121324 /nfs/dbraw/zinc/12/13/24/1003121324.db2.gz QFTRNWOMYVQBPS-CYBMUJFWSA-N 1 1 350.415 2.952 20 5 FFBDMO COC(=O)[C@@H]1C[C@H]2C[C@@H](C1)[N@H+]([C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])C2 ZINC001170353109 1003121351 /nfs/dbraw/zinc/12/13/51/1003121351.db2.gz VXFZRYKWLWLLJO-CLWVCHIJSA-N 1 1 362.426 2.808 20 5 FFBDMO CCOC(=O)[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1 ZINC001170345814 1003131495 /nfs/dbraw/zinc/13/14/95/1003131495.db2.gz MBWXYLOHGZJFMV-DZGCQCFKSA-N 1 1 350.415 2.810 20 5 FFBDMO COc1ccc(C[C@H](C)[N@@H+]2CCN3CC(F)(F)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170351766 1003136974 /nfs/dbraw/zinc/13/69/74/1003136974.db2.gz IIPQWCNLNJQYPS-JSGCOSHPSA-N 1 1 355.385 2.560 20 5 FFBDMO COc1ccc(C[C@H](C)[N@H+]2CCN3CC(F)(F)C[C@H]3C2)c([N+](=O)[O-])c1 ZINC001170351766 1003136983 /nfs/dbraw/zinc/13/69/83/1003136983.db2.gz IIPQWCNLNJQYPS-JSGCOSHPSA-N 1 1 355.385 2.560 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C ZINC000804778443 1003829981 /nfs/dbraw/zinc/82/99/81/1003829981.db2.gz SXNKGWCBTSPSIJ-ZDUSSCGKSA-N 1 1 364.402 2.724 20 5 FFBDMO CCN(C)C(=O)OC[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805763147 1004138286 /nfs/dbraw/zinc/13/82/86/1004138286.db2.gz PUFOHAUYELQHDV-SJORKVTESA-N 1 1 365.430 2.571 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](CO)c1ccccc1C ZINC001197817248 1004387537 /nfs/dbraw/zinc/38/75/37/1004387537.db2.gz ATWDSPHXZLFNOU-QGZVFWFLSA-N 1 1 373.409 2.516 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](CO)c1ccccc1C ZINC001197817248 1004387546 /nfs/dbraw/zinc/38/75/46/1004387546.db2.gz ATWDSPHXZLFNOU-QGZVFWFLSA-N 1 1 373.409 2.516 20 5 FFBDMO CCOC(=O)C1=C(Nc2ncc(F)c3cc([N+](=O)[O-])ccc23)CC[NH2+]C1 ZINC001170514079 1004456477 /nfs/dbraw/zinc/45/64/77/1004456477.db2.gz PZIGIDJYJUZANQ-UHFFFAOYSA-N 1 1 360.345 2.505 20 5 FFBDMO CCOC(=O)C1=C(N=c2[nH]cc(F)c3cc([N+](=O)[O-])ccc32)CC[NH2+]C1 ZINC001170514079 1004456483 /nfs/dbraw/zinc/45/64/83/1004456483.db2.gz PZIGIDJYJUZANQ-UHFFFAOYSA-N 1 1 360.345 2.505 20 5 FFBDMO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1C ZINC001050326118 1016967979 /nfs/dbraw/zinc/96/79/79/1016967979.db2.gz RVWGJVYGQYPMMF-NXWXRZEISA-N 1 1 359.470 2.733 20 5 FFBDMO COC(=O)[C@H](C)C[N@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776583024 1005954473 /nfs/dbraw/zinc/95/44/73/1005954473.db2.gz YQCPWEIBFLBEKX-BEFAXECRSA-N 1 1 372.421 2.940 20 5 FFBDMO CC(C)(C)C(=O)NC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776582266 1005963176 /nfs/dbraw/zinc/96/31/76/1005963176.db2.gz NPGYJZFWJWALEB-WMLDXEAASA-N 1 1 363.458 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1 ZINC000776595893 1006038554 /nfs/dbraw/zinc/03/85/54/1006038554.db2.gz CEBRWAIZVCYMSC-GDBMZVCRSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595893 1006038568 /nfs/dbraw/zinc/03/85/68/1006038568.db2.gz CEBRWAIZVCYMSC-GDBMZVCRSA-N 1 1 357.414 2.503 20 5 FFBDMO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1 ZINC000776595893 1006038581 /nfs/dbraw/zinc/03/85/81/1006038581.db2.gz CEBRWAIZVCYMSC-GDBMZVCRSA-N 1 1 357.414 2.503 20 5 FFBDMO COc1ccccc1CC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853494581 1006412513 /nfs/dbraw/zinc/41/25/13/1006412513.db2.gz MQPPGGULOCLTFH-UHFFFAOYSA-N 1 1 367.409 2.994 20 5 FFBDMO COc1ccccc1CC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1 ZINC000853494581 1006412521 /nfs/dbraw/zinc/41/25/21/1006412521.db2.gz MQPPGGULOCLTFH-UHFFFAOYSA-N 1 1 367.409 2.994 20 5 FFBDMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000853794198 1006539699 /nfs/dbraw/zinc/53/96/99/1006539699.db2.gz FXRLUTFIBORJLY-OAHLLOKOSA-N 1 1 372.381 2.682 20 5 FFBDMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3 ZINC001135266107 1006829393 /nfs/dbraw/zinc/82/93/93/1006829393.db2.gz JVMNLFNFIPIDBW-BGYRXZFFSA-N 1 1 372.469 2.609 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)C1 ZINC000855287130 1007246971 /nfs/dbraw/zinc/24/69/71/1007246971.db2.gz IZGXUPFMIGQTBM-CQSZACIVSA-N 1 1 360.458 2.798 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000856356140 1007785795 /nfs/dbraw/zinc/78/57/95/1007785795.db2.gz YCYVFFZHWLNIBQ-BLRBJFNZSA-N 1 1 351.406 2.999 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000856478823 1007847610 /nfs/dbraw/zinc/84/76/10/1007847610.db2.gz GBVFCXJTFGWUAF-CQSZACIVSA-N 1 1 367.396 2.925 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ccc([N+](=O)[O-])nc3)C2)ccn1 ZINC000856535096 1007874780 /nfs/dbraw/zinc/87/47/80/1007874780.db2.gz NNVOACDOPSZRDQ-GOSISDBHSA-N 1 1 371.441 2.883 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(c3ncccc3[N+](=O)[O-])C2)ccn1 ZINC000856535235 1007875723 /nfs/dbraw/zinc/87/57/23/1007875723.db2.gz SFNHNXYSPMAIKH-QGZVFWFLSA-N 1 1 371.441 2.883 20 5 FFBDMO Cc1nn(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c2ncc([N+](=O)[O-])cc12 ZINC000819901717 1008246563 /nfs/dbraw/zinc/24/65/63/1008246563.db2.gz DUXRDLRSANEENS-QGZVFWFLSA-N 1 1 371.441 2.887 20 5 FFBDMO COCC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000859251624 1008493454 /nfs/dbraw/zinc/49/34/54/1008493454.db2.gz HIJBKCHBBNPRSB-HNNXBMFYSA-N 1 1 357.410 2.589 20 5 FFBDMO O=C([C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000822088786 1008518482 /nfs/dbraw/zinc/51/84/82/1008518482.db2.gz GBRVKLPPMBCUSP-OTWHNJEPSA-N 1 1 351.406 2.871 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[C@H]1C(=O)OC(C)(C)C ZINC000859611387 1008587012 /nfs/dbraw/zinc/58/70/12/1008587012.db2.gz CVIQYZPVHPUPLL-XYPHTWIQSA-N 1 1 364.442 2.928 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])O[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000117094514 1008757428 /nfs/dbraw/zinc/75/74/28/1008757428.db2.gz AGTFTAGUWRUSAJ-MRXNPFEDSA-N 1 1 356.378 2.791 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CCN1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000886648606 1008793770 /nfs/dbraw/zinc/79/37/70/1008793770.db2.gz YVIWQIGFDABVJL-RBUKOAKNSA-N 1 1 369.469 2.554 20 5 FFBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N3CCN(C)CC3)nc2)cc1[N+](=O)[O-] ZINC000130484379 1009339574 /nfs/dbraw/zinc/33/95/74/1009339574.db2.gz LHLRBZYCQYMGTO-INIZCTEOSA-N 1 1 369.469 2.901 20 5 FFBDMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1 ZINC000794589868 1010410213 /nfs/dbraw/zinc/41/02/13/1010410213.db2.gz BUKFSCJKFAHANU-AIADIJKESA-N 1 1 367.405 2.813 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261074 1010934773 /nfs/dbraw/zinc/93/47/73/1010934773.db2.gz MHIASBXITSYPTA-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)nc1-c1ccncc1 ZINC000773261074 1010934781 /nfs/dbraw/zinc/93/47/81/1010934781.db2.gz MHIASBXITSYPTA-CVEARBPZSA-N 1 1 371.441 2.949 20 5 FFBDMO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCN(C[C@H]2CCOC2)CC1 ZINC000866270176 1010966615 /nfs/dbraw/zinc/96/66/15/1010966615.db2.gz SOQOJBIFWLFPHK-LSDHHAIUSA-N 1 1 365.449 2.755 20 5 FFBDMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000867914687 1011118598 /nfs/dbraw/zinc/11/85/98/1011118598.db2.gz OUOKCXODBRQJCC-INIZCTEOSA-N 1 1 371.412 2.915 20 5 FFBDMO COC[C@@H]1Cn2nccc2C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909136 1012074731 /nfs/dbraw/zinc/07/47/31/1012074731.db2.gz GMOSGWVORWQREV-MAUKXSAKSA-N 1 1 370.453 2.817 20 5 FFBDMO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907653 1012080221 /nfs/dbraw/zinc/08/02/21/1012080221.db2.gz LERMWRGDNSGUHN-BPVAQJAMSA-N 1 1 369.465 2.929 20 5 FFBDMO CCOC(=O)C1([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172895969 1012097752 /nfs/dbraw/zinc/09/77/52/1012097752.db2.gz KDUISTVVFVPYRK-INIZCTEOSA-N 1 1 362.426 2.544 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCN(C3CCOCC3)CC1)CC2 ZINC001172916070 1012099151 /nfs/dbraw/zinc/09/91/51/1012099151.db2.gz QKNGLKGXQFCNSI-GOSISDBHSA-N 1 1 359.470 2.639 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@H]21 ZINC001172912617 1012124921 /nfs/dbraw/zinc/12/49/21/1012124921.db2.gz KTESXICHUNMFKP-ZHALLVOQSA-N 1 1 357.454 2.785 20 5 FFBDMO CN1C(=O)CC[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC[C@@H]21 ZINC001172912609 1012125481 /nfs/dbraw/zinc/12/54/81/1012125481.db2.gz KTESXICHUNMFKP-LMMKCTJWSA-N 1 1 357.454 2.785 20 5 FFBDMO O=[N+]([O-])c1cc(F)c(N2CCC([N@H+]3CCC4(COC4)C3)CC2)c(F)c1 ZINC001173009470 1012178728 /nfs/dbraw/zinc/17/87/28/1012178728.db2.gz CRQHWYGWTXDBPH-UHFFFAOYSA-N 1 1 353.369 2.564 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CCCC[C@@](O)(CF)C2)c1F ZINC001173180367 1012324517 /nfs/dbraw/zinc/32/45/17/1012324517.db2.gz KDXKJIGCXIUXKB-YVEFUNNKSA-N 1 1 358.385 2.860 20 5 FFBDMO CCOC(=O)[C@@H]1CC[N@H+]([C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173188135 1012329888 /nfs/dbraw/zinc/32/98/88/1012329888.db2.gz CRGUYOIDJLWRDB-NWDGAFQWSA-N 1 1 354.378 2.559 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2CC[N@H+]3CCCC[C@H]3C2)c1F ZINC001173189893 1012332311 /nfs/dbraw/zinc/33/23/11/1012332311.db2.gz OIEMHPVDASRDTC-KBPBESRZSA-N 1 1 351.422 2.844 20 5 FFBDMO COC(=O)[C@H](C(C)C)[N@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191279 1012332734 /nfs/dbraw/zinc/33/27/34/1012332734.db2.gz BJWWXKFZLQVBHA-BZNIZROVSA-N 1 1 356.394 2.803 20 5 FFBDMO COC(=O)[C@H](C(C)C)[N@@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173191279 1012332747 /nfs/dbraw/zinc/33/27/47/1012332747.db2.gz BJWWXKFZLQVBHA-BZNIZROVSA-N 1 1 356.394 2.803 20 5 FFBDMO O=C1O[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CCCCC1 ZINC000828197850 1032619264 /nfs/dbraw/zinc/61/92/64/1032619264.db2.gz AOHMQGWPMMQVBS-INIZCTEOSA-N 1 1 360.414 2.501 20 5 FFBDMO O=C1O[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CCCCC1 ZINC000828197850 1032619269 /nfs/dbraw/zinc/61/92/69/1032619269.db2.gz AOHMQGWPMMQVBS-INIZCTEOSA-N 1 1 360.414 2.501 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CCC[C@@]3(CCC(=O)O3)C2)c1F ZINC001173194132 1012338739 /nfs/dbraw/zinc/33/87/39/1012338739.db2.gz XSYAXCPQRMLIOF-KZULUSFZSA-N 1 1 366.389 2.845 20 5 FFBDMO COC(=O)[C@@H]1C[C@@H](C)C[N@H+]([C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])C1 ZINC001173197245 1012340127 /nfs/dbraw/zinc/34/01/27/1012340127.db2.gz RUPYHRRAZLPIBU-JHJVBQTASA-N 1 1 368.405 2.805 20 5 FFBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 ZINC001173228828 1012364168 /nfs/dbraw/zinc/36/41/68/1012364168.db2.gz ZDNQKYSFLQGVIP-ALKREAHSSA-N 1 1 366.421 2.516 20 5 FFBDMO C[N@@H+](CCc1nc(-c2ccccc2)no1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000796387510 1012585196 /nfs/dbraw/zinc/58/51/96/1012585196.db2.gz CXOMTJBLBIZAGP-KRWDZBQOSA-N 1 1 368.393 2.853 20 5 FFBDMO Cc1nn(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)c2ncc([N+](=O)[O-])cc12 ZINC000748449966 1017240762 /nfs/dbraw/zinc/24/07/62/1017240762.db2.gz PBGLYCSHCFWLMZ-GOSISDBHSA-N 1 1 366.425 2.594 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000928249250 1018909079 /nfs/dbraw/zinc/90/90/79/1018909079.db2.gz PSDXFMCOEZWWJA-KDOFPFPSSA-N 1 1 354.410 2.832 20 5 FFBDMO C[C@@H](NC(=O)[C@@H]1CCC[N@H+]1Cc1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000928249250 1018909091 /nfs/dbraw/zinc/90/90/91/1018909091.db2.gz PSDXFMCOEZWWJA-KDOFPFPSSA-N 1 1 354.410 2.832 20 5 FFBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc([C@@H]3CCC[N@H+]3C)[nH]n1)CC2 ZINC000901317806 1018949389 /nfs/dbraw/zinc/94/93/89/1018949389.db2.gz LPIDSYOTAIOTRD-HNNXBMFYSA-N 1 1 355.398 2.596 20 5 FFBDMO Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cc([C@@H]3CCC[N@@H+]3C)[nH]n1)CC2 ZINC000901317806 1018949399 /nfs/dbraw/zinc/94/93/99/1018949399.db2.gz LPIDSYOTAIOTRD-HNNXBMFYSA-N 1 1 355.398 2.596 20 5 FFBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@](CO)(c2ccccc2)C1 ZINC000801578482 1019133720 /nfs/dbraw/zinc/13/37/20/1019133720.db2.gz GXDUXKXILDJICP-FQEVSTJZSA-N 1 1 356.422 3.000 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777733335 1019202000 /nfs/dbraw/zinc/20/20/00/1019202000.db2.gz FVBJTMCWBXEECT-YJYMSZOUSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1 ZINC000777733335 1019202012 /nfs/dbraw/zinc/20/20/12/1019202012.db2.gz FVBJTMCWBXEECT-YJYMSZOUSA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000777735247 1019207763 /nfs/dbraw/zinc/20/77/63/1019207763.db2.gz XSGVUJYFWDBUIX-ORAYPTAESA-N 1 1 373.384 2.654 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1 ZINC000777735247 1019207773 /nfs/dbraw/zinc/20/77/73/1019207773.db2.gz XSGVUJYFWDBUIX-ORAYPTAESA-N 1 1 373.384 2.654 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1 ZINC001072724759 1020293366 /nfs/dbraw/zinc/29/33/66/1020293366.db2.gz DFBRMRQJVDNJSF-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO CC(C)c1ccccc1C[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001072724759 1020293372 /nfs/dbraw/zinc/29/33/72/1020293372.db2.gz DFBRMRQJVDNJSF-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO CC(C)c1ccccc1C[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1 ZINC001072724759 1020293377 /nfs/dbraw/zinc/29/33/77/1020293377.db2.gz DFBRMRQJVDNJSF-QZTJIDSGSA-N 1 1 357.454 2.510 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000931908365 1020629687 /nfs/dbraw/zinc/62/96/87/1020629687.db2.gz VZYISALSVTWYIS-APWZRJJASA-N 1 1 369.377 2.903 20 5 FFBDMO CCn1cnc2c1CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C2 ZINC000933258555 1020985287 /nfs/dbraw/zinc/98/52/87/1020985287.db2.gz OQFLWOREBVFMQB-UHFFFAOYSA-N 1 1 357.414 2.507 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000749602426 1021012313 /nfs/dbraw/zinc/01/23/13/1021012313.db2.gz OUGYYZPQKGIARM-QGZVFWFLSA-N 1 1 373.457 2.715 20 5 FFBDMO CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001116331448 1021169187 /nfs/dbraw/zinc/16/91/87/1021169187.db2.gz QDWCLFVZAMLKFT-ACJLOTCBSA-N 1 1 358.442 2.725 20 5 FFBDMO Cc1cc[nH+]c(N2CCN(C(=O)[C@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000934895540 1021452262 /nfs/dbraw/zinc/45/22/62/1021452262.db2.gz CDRQEPDKDIZKCI-ROUUACIJSA-N 1 1 366.421 2.751 20 5 FFBDMO O=C1N(C[N@@H+]2CC[C@H](c3ccco3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752791414 1023205180 /nfs/dbraw/zinc/20/51/80/1023205180.db2.gz FGIZDBMUVSZOHV-AWEZNQCLSA-N 1 1 356.382 2.877 20 5 FFBDMO O=C1N(C[N@H+]2CC[C@H](c3ccco3)C2)CCN1c1ccccc1[N+](=O)[O-] ZINC000752791414 1023205191 /nfs/dbraw/zinc/20/51/91/1023205191.db2.gz FGIZDBMUVSZOHV-AWEZNQCLSA-N 1 1 356.382 2.877 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@]1(O)CCc2ccccc21 ZINC000829358823 1033118254 /nfs/dbraw/zinc/11/82/54/1033118254.db2.gz NMASCTLBFSCVSS-FQEVSTJZSA-N 1 1 369.421 2.689 20 5 FFBDMO CC[NH+]1CCN(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CC1 ZINC000780329521 1023575437 /nfs/dbraw/zinc/57/54/37/1023575437.db2.gz OOQWFDILMADXET-UHFFFAOYSA-N 1 1 370.409 2.695 20 5 FFBDMO C[C@H]1CC[N@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999364 1024419714 /nfs/dbraw/zinc/41/97/14/1024419714.db2.gz HMMVLAAOWMBCEW-ORAYPTAESA-N 1 1 374.441 2.687 20 5 FFBDMO C[C@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)CC1(C)C ZINC000758999364 1024419721 /nfs/dbraw/zinc/41/97/21/1024419721.db2.gz HMMVLAAOWMBCEW-ORAYPTAESA-N 1 1 374.441 2.687 20 5 FFBDMO CC(C)([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] ZINC000795217203 1025358538 /nfs/dbraw/zinc/35/85/38/1025358538.db2.gz ADSHKUAGPYICEA-UHFFFAOYSA-N 1 1 358.354 2.966 20 5 FFBDMO Cc1cc(C)cc([C@H](O)C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245458952 1025435483 /nfs/dbraw/zinc/43/54/83/1025435483.db2.gz VCKYFGMYZQNWQK-SJLPKXTDSA-N 1 1 356.426 2.826 20 5 FFBDMO C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1ccnc1 ZINC000246635779 1026303967 /nfs/dbraw/zinc/30/39/67/1026303967.db2.gz OOZXQPLWAAWOJO-RHSMWYFYSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H]1n1ccnc1 ZINC000246635779 1026303981 /nfs/dbraw/zinc/30/39/81/1026303981.db2.gz OOZXQPLWAAWOJO-RHSMWYFYSA-N 1 1 367.413 2.590 20 5 FFBDMO C[C@@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1Cc1ccccc1 ZINC000839646348 1026774060 /nfs/dbraw/zinc/77/40/60/1026774060.db2.gz IGNVDPJUTZBBEK-OXQOHEQNSA-N 1 1 355.438 2.835 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)c2ccc([N+](=O)[O-])cc12 ZINC000840106273 1026957978 /nfs/dbraw/zinc/95/79/78/1026957978.db2.gz BZGRTDJEGLDBGQ-AWEZNQCLSA-N 1 1 373.457 2.824 20 5 FFBDMO C[NH+](C)/C=C/c1cc(N[C@H]2CCc3ccccc3[C@@H]2O)ncc1[N+](=O)[O-] ZINC001158684172 1027094462 /nfs/dbraw/zinc/09/44/62/1027094462.db2.gz NGSBZRDIKPFMPX-FCGLOEDJSA-N 1 1 354.410 2.982 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CCCCc2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001160097890 1027588855 /nfs/dbraw/zinc/58/88/55/1027588855.db2.gz OIFPALWDYOBQRT-WOJBJXKFSA-N 1 1 371.481 2.813 20 5 FFBDMO O=C(NCCC1=CC[N@H+](CCCCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097890 1027588864 /nfs/dbraw/zinc/58/88/64/1027588864.db2.gz OIFPALWDYOBQRT-WOJBJXKFSA-N 1 1 371.481 2.813 20 5 FFBDMO O=C(NCCC1=CC[N@@H+](CCCCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001160097890 1027588873 /nfs/dbraw/zinc/58/88/73/1027588873.db2.gz OIFPALWDYOBQRT-WOJBJXKFSA-N 1 1 371.481 2.813 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)CCCCC1 ZINC001154270476 1028212952 /nfs/dbraw/zinc/21/29/52/1028212952.db2.gz QYBKOTOILZWFFM-UHFFFAOYSA-N 1 1 371.441 2.883 20 5 FFBDMO Cc1c([N+](=O)[O-])cc(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000249741392 1028288952 /nfs/dbraw/zinc/28/89/52/1028288952.db2.gz IVKNXPIPFKTGFL-VXGBXAGGSA-N 1 1 364.402 2.662 20 5 FFBDMO CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1NC1C[NH+](C(C)(C)C)C1 ZINC001162220347 1028471646 /nfs/dbraw/zinc/47/16/46/1028471646.db2.gz QDWCPLTYWUXULR-UHFFFAOYSA-N 1 1 356.810 2.715 20 5 FFBDMO CC1(C)CCC[N@@H+](CCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001155884789 1028958419 /nfs/dbraw/zinc/95/84/19/1028958419.db2.gz AROUKZDMMPXCCN-UHFFFAOYSA-N 1 1 372.828 2.821 20 5 FFBDMO Cc1ccc(NCCNC(=O)c2ccc([N+](=O)[O-])c(OC(C)C)c2)[nH+]c1 ZINC001156470216 1029204832 /nfs/dbraw/zinc/20/48/32/1029204832.db2.gz MRELKVVKEVHJAZ-UHFFFAOYSA-N 1 1 358.398 2.927 20 5 FFBDMO Cc1cc(N2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001157270512 1029530509 /nfs/dbraw/zinc/53/05/09/1029530509.db2.gz FQNLTHLAWWVORS-DOTOQJQBSA-N 1 1 353.426 2.891 20 5 FFBDMO CCOc1cnc(NCc2ccc(C[NH+]3CCOCC3)cc2)c([N+](=O)[O-])c1 ZINC001165326041 1029946089 /nfs/dbraw/zinc/94/60/89/1029946089.db2.gz GTQBGAOYYNQOTR-UHFFFAOYSA-N 1 1 372.425 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[NH+]3CCC(OC4CCC4)CC3)n2)cc1 ZINC000841687923 1030406264 /nfs/dbraw/zinc/40/62/64/1030406264.db2.gz XCCGGRNPVFEJRE-UHFFFAOYSA-N 1 1 357.414 2.844 20 5 FFBDMO C[N@@H+](C[C@H]1CC=CCC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000784011333 1030413555 /nfs/dbraw/zinc/41/35/55/1030413555.db2.gz PNQAFAMAWFKVTE-IFXJQAMLSA-N 1 1 372.425 2.607 20 5 FFBDMO C/C(=C\C(=O)N1CCCC[C@@H]1C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784027117 1030426648 /nfs/dbraw/zinc/42/66/48/1030426648.db2.gz RSIDFSCDDZVJHH-JRJUITNWSA-N 1 1 373.453 2.711 20 5 FFBDMO CC(C)(C)[C@H]1CC[N@@H+](CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000784031119 1030430770 /nfs/dbraw/zinc/43/07/70/1030430770.db2.gz JWIXJHQIAGMSJX-IFXJQAMLSA-N 1 1 374.441 2.687 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000784032121 1030431223 /nfs/dbraw/zinc/43/12/23/1030431223.db2.gz UZNLBPWYBJTQKQ-CQSZACIVSA-N 1 1 360.414 2.685 20 5 FFBDMO CC1([C@H]2CCC[N@@H+](Cn3cc(-c4cccc([N+](=O)[O-])c4)cn3)C2)OCCO1 ZINC000784039033 1030435465 /nfs/dbraw/zinc/43/54/65/1030435465.db2.gz RRCGZOLUVDRNEE-KRWDZBQOSA-N 1 1 372.425 2.891 20 5 FFBDMO C/C(=C/C(=O)N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000784071840 1030452284 /nfs/dbraw/zinc/45/22/84/1030452284.db2.gz DLAXOVZQMWVKMT-LOBVBGPYSA-N 1 1 373.453 2.758 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]3[C@@H]3CCCOC3)n2)cc1 ZINC000842613233 1030822249 /nfs/dbraw/zinc/82/22/49/1030822249.db2.gz BEIIXWLQJIEDCH-WBVHZDCISA-N 1 1 357.414 2.702 20 5 FFBDMO CC(C)NC(=O)OC[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000796719260 1030893494 /nfs/dbraw/zinc/89/34/94/1030893494.db2.gz YMOGDEHYAHNBMT-IAGOWNOFSA-N 1 1 365.430 2.617 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1 ZINC000842835380 1030985590 /nfs/dbraw/zinc/98/55/90/1030985590.db2.gz GKTOEPJXMXOCKA-CYBMUJFWSA-N 1 1 364.398 2.643 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1OC(=O)Cn1cc([N+](=O)[O-])cn1 ZINC000797341833 1031075570 /nfs/dbraw/zinc/07/55/70/1031075570.db2.gz GZLIXSVRFRGIHP-QGZVFWFLSA-N 1 1 372.425 2.635 20 5 FFBDMO O=C(NCC1([NH2+]Cc2ccc(CF)cc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001115530603 1031786403 /nfs/dbraw/zinc/78/64/03/1031786403.db2.gz HBBKFDDNNSAHCS-IAGOWNOFSA-N 1 1 363.433 2.730 20 5 FFBDMO Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCCC2)cc1C ZINC001115530892 1031788600 /nfs/dbraw/zinc/78/86/00/1031788600.db2.gz XDACWZNAUVPSSB-QZTJIDSGSA-N 1 1 359.470 2.877 20 5 FFBDMO CC(C)(C)[N@H+]1CCN[C@@H](C(=O)Nc2cc3cccnc3c3ncccc23)C1 ZINC001218979911 1033440970 /nfs/dbraw/zinc/44/09/70/1033440970.db2.gz KZYABPZRYVMGQZ-QGZVFWFLSA-N 1 1 363.465 2.794 20 5 FFBDMO C[C@H]1CC2(C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CCOCC2 ZINC000830603656 1033705844 /nfs/dbraw/zinc/70/58/44/1033705844.db2.gz YYIRKTRZHUTGAH-ZDUSSCGKSA-N 1 1 365.405 2.954 20 5 FFBDMO O=[N+]([O-])c1ccc(OCCC[NH+]2CCN(c3cccc(F)n3)CC2)cc1 ZINC000831472570 1034093499 /nfs/dbraw/zinc/09/34/99/1034093499.db2.gz DPLWFXSYOGPDRG-UHFFFAOYSA-N 1 1 360.389 2.720 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@H](Oc3cccc([N+](=O)[O-])c3)C[C@H]2C1 ZINC001226763740 1034825538 /nfs/dbraw/zinc/82/55/38/1034825538.db2.gz BCTKCNWJRJUWFZ-GOEBONIOSA-N 1 1 363.414 2.667 20 5 FFBDMO COC(=O)C1=C[C@@H](Oc2cccc([N+](=O)[O-])c2)C[N@@H+](Cc2ccccc2)C1 ZINC001226768983 1034828514 /nfs/dbraw/zinc/82/85/14/1034828514.db2.gz UDAPOTMIAXIQFZ-LJQANCHMSA-N 1 1 368.389 2.957 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@@H+]2C[C@@H](Oc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001227482554 1035575022 /nfs/dbraw/zinc/57/50/22/1035575022.db2.gz JJSAGCXWKICGFL-KBPBESRZSA-N 1 1 363.414 2.667 20 5 FFBDMO CC(C)(C)OC(=O)N1CC[N@H+]2C[C@@H](Oc3ccccc3[N+](=O)[O-])C[C@H]2C1 ZINC001227482554 1035575039 /nfs/dbraw/zinc/57/50/39/1035575039.db2.gz JJSAGCXWKICGFL-KBPBESRZSA-N 1 1 363.414 2.667 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nccc1O[C@H]1COCC[N@H+](Cc2ccccc2)C1 ZINC001228056642 1035905958 /nfs/dbraw/zinc/90/59/58/1035905958.db2.gz FKHYZEBNFYSJTL-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO O=[N+]([O-])c1c(Cl)nccc1O[C@H]1COCC[N@@H+](Cc2ccccc2)C1 ZINC001228056642 1035905964 /nfs/dbraw/zinc/90/59/64/1035905964.db2.gz FKHYZEBNFYSJTL-CQSZACIVSA-N 1 1 363.801 2.923 20 5 FFBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1Oc1nc[nH]c(=O)c1[N+](=O)[O-] ZINC001228143383 1035958460 /nfs/dbraw/zinc/95/84/60/1035958460.db2.gz LTQITPLQVGZSRA-AWEZNQCLSA-N 1 1 358.398 2.770 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CC[C@@](C)(O)[C@@H](C)C3)CC2)ccc1[N+](=O)[O-] ZINC001256093510 1038380367 /nfs/dbraw/zinc/38/03/67/1038380367.db2.gz MWWYEWBFBSKCOM-IFXJQAMLSA-N 1 1 363.458 2.665 20 5 FFBDMO COc1cc(N2CCC([N@H+]3CCC[C@@H]4CN(C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100862 1038384747 /nfs/dbraw/zinc/38/47/47/1038384747.db2.gz RHHGCIFOZYNJAW-DNVCBOLYSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@H]4C[N@H+](C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100862 1038384756 /nfs/dbraw/zinc/38/47/56/1038384756.db2.gz RHHGCIFOZYNJAW-DNVCBOLYSA-N 1 1 374.485 2.598 20 5 FFBDMO COc1cc(N2CCC(N3CCC[C@@H]4C[N@@H+](C)C[C@H]43)CC2)ccc1[N+](=O)[O-] ZINC001256100862 1038384764 /nfs/dbraw/zinc/38/47/64/1038384764.db2.gz RHHGCIFOZYNJAW-DNVCBOLYSA-N 1 1 374.485 2.598 20 5 FFBDMO C[C@@H]1C[N@@H+](CCc2nnc(/C=C/c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC001258012721 1039112152 /nfs/dbraw/zinc/11/21/52/1039112152.db2.gz RRNZNROOFLFESM-RNBGUABESA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H]1C[N@H+](CCc2nnc(/C=C/c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC001258012721 1039112157 /nfs/dbraw/zinc/11/21/57/1039112157.db2.gz RRNZNROOFLFESM-RNBGUABESA-N 1 1 358.398 2.800 20 5 FFBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H]2C[NH2+]C[C@@]2(c2ccccc2)C1 ZINC001246879174 1039515877 /nfs/dbraw/zinc/51/58/77/1039515877.db2.gz MMEKKNMLUOQILX-SCWSEQNSSA-N 1 1 351.450 2.999 20 5 FFBDMO N[C@H](Cc1[nH]cc[nH+]1)c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001247344644 1039722995 /nfs/dbraw/zinc/72/29/95/1039722995.db2.gz HVTOIVRWJLTRKU-CYBMUJFWSA-N 1 1 357.377 2.799 20 5 FFBDMO Cn1ncc2cc(-c3noc([C@@H]([NH3+])Cc4ccccc4[N+](=O)[O-])n3)ccc21 ZINC001247667025 1039874100 /nfs/dbraw/zinc/87/41/00/1039874100.db2.gz RJFIBMXTSORSSR-AWEZNQCLSA-N 1 1 364.365 2.774 20 5 FFBDMO C[NH2+][C@H](c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)[C@@H](C)OC(C)(C)C ZINC001247976056 1040087999 /nfs/dbraw/zinc/08/79/99/1040087999.db2.gz YNPACHVQBYRHMO-KCJUWKMLSA-N 1 1 353.354 2.643 20 5 FFBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](NC(=O)c2ccccn2)C1 ZINC001254568424 1040804184 /nfs/dbraw/zinc/80/41/84/1040804184.db2.gz FRXBQXXMLJEDSE-NVXWUHKLSA-N 1 1 368.437 2.815 20 5 FFBDMO COc1cc(C)nc(O[C@H]2CC[N@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC001254568511 1040806174 /nfs/dbraw/zinc/80/61/74/1040806174.db2.gz GKHPSJPTXJXPQF-ZBFHGGJFSA-N 1 1 372.425 2.786 20 5 FFBDMO COCC[C@@H]1CO[C@@]2(C1)CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2 ZINC001254595267 1040825064 /nfs/dbraw/zinc/82/50/64/1040825064.db2.gz HZNKYTAZIFEJHK-RYGJVYDSSA-N 1 1 360.454 2.970 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(CCOc3ccccc3)CC1)C2 ZINC001254597416 1040828107 /nfs/dbraw/zinc/82/81/07/1040828107.db2.gz DHQVMNOPJCCEAJ-HXUWFJFHSA-N 1 1 367.449 2.759 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[NH+](CCOc3ccccc3)CC1)C2 ZINC001254597416 1040828121 /nfs/dbraw/zinc/82/81/21/1040828121.db2.gz DHQVMNOPJCCEAJ-HXUWFJFHSA-N 1 1 367.449 2.759 20 5 FFBDMO O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@]3(C[C@@H](OCC4CC4)CO3)C1)C2 ZINC001254599923 1040830509 /nfs/dbraw/zinc/83/05/09/1040830509.db2.gz MVANZBUKBBWDBR-AQNXPRMDSA-N 1 1 358.438 2.722 20 5 FFBDMO C[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1NC(=O)OC(C)(C)C ZINC001254608282 1040837326 /nfs/dbraw/zinc/83/73/26/1040837326.db2.gz QDSOAFDLRODBEM-JLZZUVOBSA-N 1 1 361.442 2.907 20 5 FFBDMO Cc1cc(O[C@@H]2CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)ncn1 ZINC001254610333 1040839025 /nfs/dbraw/zinc/83/90/25/1040839025.db2.gz JQOQRMZIKMLXIF-QZTJIDSGSA-N 1 1 354.410 2.704 20 5 FFBDMO COc1cc(-c2nc3ccc(N4CC[NH+](C)CC4)cc3[nH]2)cc([N+](=O)[O-])c1 ZINC001250620115 1041268339 /nfs/dbraw/zinc/26/83/39/1041268339.db2.gz LJGJQYIGQZLSAS-UHFFFAOYSA-N 1 1 367.409 2.899 20 5 FFBDMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2cc3ccccc3o2)CC1 ZINC001278607712 1041405093 /nfs/dbraw/zinc/40/50/93/1041405093.db2.gz PQYSZEGTXPDXKO-IAGOWNOFSA-N 1 1 371.437 2.816 20 5 FFBDMO CN(CCC[NH+]1CCN(C)CC1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001262554881 1041717300 /nfs/dbraw/zinc/71/73/00/1041717300.db2.gz VLOGEAULNQUWHS-UHFFFAOYSA-N 1 1 360.380 2.687 20 5 FFBDMO CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001538539483 1070449617 /nfs/dbraw/zinc/44/96/17/1070449617.db2.gz HPMCTZGEPGXKKT-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC001538539483 1070449622 /nfs/dbraw/zinc/44/96/22/1070449622.db2.gz HPMCTZGEPGXKKT-KRWDZBQOSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1ccc(NCCNC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[nH+]c1 ZINC001313332589 1044318064 /nfs/dbraw/zinc/31/80/64/1044318064.db2.gz QRDUCCYHUOCMFE-UHFFFAOYSA-N 1 1 357.414 2.945 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)COc2cccc([N+](=O)[O-])c2)[nH+]1 ZINC001318693080 1044811009 /nfs/dbraw/zinc/81/10/09/1044811009.db2.gz CFHWCJGNEYILDR-MRXNPFEDSA-N 1 1 370.409 2.780 20 5 FFBDMO CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001318786111 1044875250 /nfs/dbraw/zinc/87/52/50/1044875250.db2.gz XXZTYDHRZKVEHO-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CCC[N@H+]1CCCC[C@H]1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC001318786111 1044875258 /nfs/dbraw/zinc/87/52/58/1044875258.db2.gz XXZTYDHRZKVEHO-HNNXBMFYSA-N 1 1 374.397 2.953 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc2cc[nH]c2c1 ZINC001317686543 1045119382 /nfs/dbraw/zinc/11/93/82/1045119382.db2.gz QFHKFZUOVWMRBZ-SJLPKXTDSA-N 1 1 358.442 2.550 20 5 FFBDMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2cc[nH]c2c1 ZINC001317686543 1045119387 /nfs/dbraw/zinc/11/93/87/1045119387.db2.gz QFHKFZUOVWMRBZ-SJLPKXTDSA-N 1 1 358.442 2.550 20 5 FFBDMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc2cc[nH]c2c1 ZINC001317686543 1045119393 /nfs/dbraw/zinc/11/93/93/1045119393.db2.gz QFHKFZUOVWMRBZ-SJLPKXTDSA-N 1 1 358.442 2.550 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256843 1045376600 /nfs/dbraw/zinc/37/66/00/1045376600.db2.gz DBPUTWAEOATGSO-MAUKXSAKSA-N 1 1 372.400 2.951 20 5 FFBDMO CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC001320256843 1045376607 /nfs/dbraw/zinc/37/66/07/1045376607.db2.gz DBPUTWAEOATGSO-MAUKXSAKSA-N 1 1 372.400 2.951 20 5 FFBDMO O=C(NCC[N@@H+]1CCc2sccc2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001323362477 1045562189 /nfs/dbraw/zinc/56/21/89/1045562189.db2.gz GCOZTHUOGYGQKJ-UHFFFAOYSA-N 1 1 372.450 2.740 20 5 FFBDMO O=C(NCC[N@H+]1CCc2sccc2C1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001323362477 1045562196 /nfs/dbraw/zinc/56/21/96/1045562196.db2.gz GCOZTHUOGYGQKJ-UHFFFAOYSA-N 1 1 372.450 2.740 20 5 FFBDMO COCC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C[C@@H]1C ZINC001328423110 1048296382 /nfs/dbraw/zinc/29/63/82/1048296382.db2.gz QPIXNSZUUOSZAG-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO COCC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C[C@@H]1C ZINC001328423110 1048296394 /nfs/dbraw/zinc/29/63/94/1048296394.db2.gz QPIXNSZUUOSZAG-BETUJISGSA-N 1 1 369.849 2.738 20 5 FFBDMO O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCc4ccns4)CC3)nc2c1 ZINC001332872836 1048601451 /nfs/dbraw/zinc/60/14/51/1048601451.db2.gz WSLOLKXHVYZDHG-UHFFFAOYSA-N 1 1 372.454 2.682 20 5 FFBDMO Cc1nn(CN2C[C@@H]3CC[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1[N+](=O)[O-] ZINC001333845340 1049142301 /nfs/dbraw/zinc/14/23/01/1049142301.db2.gz UCOPLFNUNNCMAZ-ZWKOTPCHSA-N 1 1 355.442 2.511 20 5 FFBDMO CCO[C@H]1COCC[C@H]1[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001334095341 1049246223 /nfs/dbraw/zinc/24/62/23/1049246223.db2.gz XLEOZOZBSQQJKE-OCCSQVGLSA-N 1 1 359.220 2.641 20 5 FFBDMO C[C@@H](CNC(=O)[C@@H]1[NH2+]CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC001341429231 1051785417 /nfs/dbraw/zinc/78/54/17/1051785417.db2.gz QNTOVKUUYDZQKH-SCLBCKFNSA-N 1 1 355.394 2.538 20 5 FFBDMO COC(=O)[C@H]1C[C@@H](C(F)(F)F)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001307929656 1052367484 /nfs/dbraw/zinc/36/74/84/1052367484.db2.gz OQAXSHPXCOMRQK-QWHCGFSZSA-N 1 1 360.332 2.811 20 5 FFBDMO Cc1nn(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c2ncc([N+](=O)[O-])cc12 ZINC001347244899 1053753290 /nfs/dbraw/zinc/75/32/90/1053753290.db2.gz WPHNJLNRLUZLGG-PBHICJAKSA-N 1 1 359.430 2.887 20 5 FFBDMO CN(C(=O)C[N@@H+]1CCC[C@@](O)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001348233358 1054561877 /nfs/dbraw/zinc/56/18/77/1054561877.db2.gz BPEKOZWDQIDOEN-FQEVSTJZSA-N 1 1 369.421 2.541 20 5 FFBDMO CN(C(=O)C[N@H+]1CCC[C@@](O)(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001348233358 1054561887 /nfs/dbraw/zinc/56/18/87/1054561887.db2.gz BPEKOZWDQIDOEN-FQEVSTJZSA-N 1 1 369.421 2.541 20 5 FFBDMO CCOc1ccc2c(c1)CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)CC2 ZINC001348777760 1054921703 /nfs/dbraw/zinc/92/17/03/1054921703.db2.gz WZTUQTCAIBXVFU-FQEVSTJZSA-N 1 1 369.421 2.752 20 5 FFBDMO Cn1cc[nH+]c1C[C@H]1CCCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC001351779766 1054995589 /nfs/dbraw/zinc/99/55/89/1054995589.db2.gz CFDFWHQRZXFSNA-SNVBAGLBSA-N 1 1 372.351 2.540 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176524 1055184005 /nfs/dbraw/zinc/18/40/05/1055184005.db2.gz BXVLQIZKDDWJTR-MCZUYUKXSA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000847176524 1055184012 /nfs/dbraw/zinc/18/40/12/1055184012.db2.gz BXVLQIZKDDWJTR-MCZUYUKXSA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C\C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178624 1055186922 /nfs/dbraw/zinc/18/69/22/1055186922.db2.gz RCUCLXAVXKHRCA-QCJMNHFRSA-N 1 1 361.442 2.612 20 5 FFBDMO C/C(=C\C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000847178624 1055186931 /nfs/dbraw/zinc/18/69/31/1055186931.db2.gz RCUCLXAVXKHRCA-QCJMNHFRSA-N 1 1 361.442 2.612 20 5 FFBDMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)N1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000847445702 1055791902 /nfs/dbraw/zinc/79/19/02/1055791902.db2.gz DMJNCSPGKWHZEB-AEFFLSMTSA-N 1 1 358.442 2.679 20 5 FFBDMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC001358288590 1056233815 /nfs/dbraw/zinc/23/38/15/1056233815.db2.gz UMWSZDYIPIEZHX-HNNXBMFYSA-N 1 1 355.394 2.780 20 5 FFBDMO COc1cc(C(=O)OCC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000847828277 1058175081 /nfs/dbraw/zinc/17/50/81/1058175081.db2.gz PSCGJHQQRBCOJX-JTQLQIEISA-N 1 1 374.340 2.703 20 5 FFBDMO C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])c2ccccc12)[C@@H]1C[N@@H+](C)CCN1C ZINC001517886771 1058189319 /nfs/dbraw/zinc/18/93/19/1058189319.db2.gz BEPPJRRCCDGVEF-ACJLOTCBSA-N 1 1 371.441 2.504 20 5 FFBDMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC001444270495 1058290078 /nfs/dbraw/zinc/29/00/78/1058290078.db2.gz ZPBJCZHBZAOWGL-INIZCTEOSA-N 1 1 354.410 2.571 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)[C@@H](C)C[N@@H+]1Cc1ccccc1 ZINC001446175125 1058488543 /nfs/dbraw/zinc/48/85/43/1058488543.db2.gz MGWDXLNTBBRXBT-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC001446175125 1058488557 /nfs/dbraw/zinc/48/85/57/1058488557.db2.gz MGWDXLNTBBRXBT-CABCVRRESA-N 1 1 368.437 2.912 20 5 FFBDMO Cn1c(-c2csc([N+](=O)[O-])c2)nnc1N1CCC[N@H+](C(C)(C)C)CC1 ZINC001519415575 1058740499 /nfs/dbraw/zinc/74/04/99/1058740499.db2.gz FOBXAVDAJWJDSA-UHFFFAOYSA-N 1 1 364.475 2.762 20 5 FFBDMO CCC1([NH2+]CCCCC(F)(F)F)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001502494532 1058863334 /nfs/dbraw/zinc/86/33/34/1058863334.db2.gz HMNVGRWUJNOXHU-CHWSQXEVSA-N 1 1 365.396 2.745 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001453319509 1059357817 /nfs/dbraw/zinc/35/78/17/1059357817.db2.gz GZOZEGKECFDRLD-QMMMGPOBSA-N 1 1 358.801 2.572 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848478909 1060110541 /nfs/dbraw/zinc/11/05/41/1060110541.db2.gz OLBKVWSTNFFWAH-QAPCUYQASA-N 1 1 361.442 2.617 20 5 FFBDMO O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1C[NH+]1CCC(OC2CCC2)CC1 ZINC000848488054 1060135648 /nfs/dbraw/zinc/13/56/48/1060135648.db2.gz FKDUGIBXUYLUAI-LJQANCHMSA-N 1 1 373.453 2.902 20 5 FFBDMO O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1C[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000848490364 1060146685 /nfs/dbraw/zinc/14/66/85/1060146685.db2.gz ZZLOHHNZLUQQRG-NZSAHSFTSA-N 1 1 373.453 2.759 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(C(=O)C(F)(F)Oc3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000848584810 1060314224 /nfs/dbraw/zinc/31/42/24/1060314224.db2.gz ISXIXAZOMNXWMO-WFASDCNBSA-N 1 1 369.368 2.509 20 5 FFBDMO CCCn1cc[nH+]c1CCCN(C)c1ccc(CC(=O)OC)cc1[N+](=O)[O-] ZINC001458316755 1060564198 /nfs/dbraw/zinc/56/41/98/1060564198.db2.gz ZFXCCWIJCGJIPU-UHFFFAOYSA-N 1 1 374.441 2.986 20 5 FFBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC001460177584 1060915949 /nfs/dbraw/zinc/91/59/49/1060915949.db2.gz HQCFOQRIGLMHCD-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CN(C(=O)OC(C)(C)C)C1 ZINC001460177584 1060915932 /nfs/dbraw/zinc/91/59/32/1060915932.db2.gz HQCFOQRIGLMHCD-UHFFFAOYSA-N 1 1 351.403 2.525 20 5 FFBDMO O=C(NC[C@@]12CC[N@@H+](C1)CCC2)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC001521726368 1061095728 /nfs/dbraw/zinc/09/57/28/1061095728.db2.gz FPVCAKSOVLYFDJ-HXUWFJFHSA-N 1 1 372.469 2.801 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001460844356 1061125932 /nfs/dbraw/zinc/12/59/32/1061125932.db2.gz GYCGZOHPOUMIAG-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO CN(C)C(=O)[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC001460844356 1061125939 /nfs/dbraw/zinc/12/59/39/1061125939.db2.gz GYCGZOHPOUMIAG-LBPRGKRZSA-N 1 1 370.247 2.658 20 5 FFBDMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@@H](c2ccccc2)CC1 ZINC001460950412 1061163219 /nfs/dbraw/zinc/16/32/19/1061163219.db2.gz QJOYLRZOCFTFAW-IEBWSBKVSA-N 1 1 372.421 2.798 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC001466389166 1063419548 /nfs/dbraw/zinc/41/95/48/1063419548.db2.gz QGYUZBMVUBEFFF-MWLCHTKSSA-N 1 1 371.235 2.880 20 5 FFBDMO Cc1c(NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc(Br)cc1[N+](=O)[O-] ZINC001466389164 1063419801 /nfs/dbraw/zinc/41/98/01/1063419801.db2.gz QGYUZBMVUBEFFF-GXSJLCMTSA-N 1 1 371.235 2.880 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(-c2nn[nH]n2)ccc1[N+](=O)[O-] ZINC001575969126 1078182799 /nfs/dbraw/zinc/18/27/99/1078182799.db2.gz IZGUHVWIDGVQFT-FRRDWIJNSA-N 1 1 359.434 2.553 20 5 FFBDMO C[C@@H]1CN(c2cc[nH+]cc2)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001473809326 1065373438 /nfs/dbraw/zinc/37/34/38/1065373438.db2.gz NKLWZUCCRGKRRU-OAHLLOKOSA-N 1 1 369.425 2.529 20 5 FFBDMO Cc1cccc2c1C[NH2+]CCN2C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC001579780026 1078681458 /nfs/dbraw/zinc/68/14/58/1078681458.db2.gz YAKRIXUUYRKIMA-UHFFFAOYSA-N 1 1 355.394 2.809 20 5 FFBDMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cc2N)c1 ZINC001585504087 1079469577 /nfs/dbraw/zinc/46/95/77/1079469577.db2.gz ZOPRZLLNNRJBJY-UHFFFAOYSA-N 1 1 356.426 2.947 20 5 FFBDMO C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCc3cc([N+](=O)[O-])c(F)cc3F)C[N@H+]2C1 ZINC001557207949 1075822417 /nfs/dbraw/zinc/82/24/17/1075822417.db2.gz GLOGPCTUGLUVII-MDZLAQPJSA-N 1 1 353.369 2.610 20 5 FFBDMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2CCO)nc1-c1ccccc1 ZINC001559195473 1076134055 /nfs/dbraw/zinc/13/40/55/1076134055.db2.gz KGYNENXXMYYKAN-MRXNPFEDSA-N 1 1 356.426 2.916 20 5 FFBDMO COc1ccc(NC(=O)C[N@H+](CCO)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001559663645 1076181084 /nfs/dbraw/zinc/18/10/84/1076181084.db2.gz JSAFMUUNCJCFEB-CQSZACIVSA-N 1 1 373.409 2.597 20 5 FFBDMO COc1ccc(NC(=O)C[N@@H+](CCO)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001559663645 1076181085 /nfs/dbraw/zinc/18/10/85/1076181085.db2.gz JSAFMUUNCJCFEB-CQSZACIVSA-N 1 1 373.409 2.597 20 5 FFBDMO C[C@@H](c1ccccc1)[N@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001559665947 1076181245 /nfs/dbraw/zinc/18/12/45/1076181245.db2.gz UYGWIMGBGBSPQW-HNNXBMFYSA-N 1 1 357.410 2.613 20 5 FFBDMO C[C@@H](c1ccccc1)[N@@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001559665947 1076181247 /nfs/dbraw/zinc/18/12/47/1076181247.db2.gz UYGWIMGBGBSPQW-HNNXBMFYSA-N 1 1 357.410 2.613 20 5 FFBDMO Cc1cccc(C[C@@]2(C)CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1 ZINC001560040538 1076216873 /nfs/dbraw/zinc/21/68/73/1076216873.db2.gz SXXRILBUSUTIAY-RTBURBONSA-N 1 1 358.442 2.558 20 5 FFBDMO COc1cccc(C[NH+]2CCN(Cc3cc([N+](=O)[O-])ccc3OC)CC2)c1 ZINC001560081835 1076223618 /nfs/dbraw/zinc/22/36/18/1076223618.db2.gz OSNPMBLQOYRLQN-UHFFFAOYSA-N 1 1 371.437 2.930 20 5 FFBDMO C[S@](=O)Cc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC001560823995 1076302929 /nfs/dbraw/zinc/30/29/29/1076302929.db2.gz WYHZRVDIWBGURA-VWLOTQADSA-N 1 1 359.407 2.904 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CCCC[N@H+]1CCO ZINC001560841075 1076303572 /nfs/dbraw/zinc/30/35/72/1076303572.db2.gz IHSRIFZVUXUXHX-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC[C@@H]1CCCC[N@@H+]1CCO ZINC001560841075 1076303579 /nfs/dbraw/zinc/30/35/79/1076303579.db2.gz IHSRIFZVUXUXHX-AWEZNQCLSA-N 1 1 361.364 2.550 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCCNc1cccc(C)[nH+]1 ZINC001562721989 1076512903 /nfs/dbraw/zinc/51/29/03/1076512903.db2.gz QDBQCSQFBCKAHC-UHFFFAOYSA-N 1 1 359.386 2.931 20 5 FFBDMO CCc1ccc([C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[NH2+]2)cc1 ZINC001568140789 1077073609 /nfs/dbraw/zinc/07/36/09/1077073609.db2.gz XJSVOHKNLNVGJX-INIZCTEOSA-N 1 1 354.410 2.526 20 5 FFBDMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@H]1CCCC[N@H+]1C ZINC001585855717 1079506287 /nfs/dbraw/zinc/50/62/87/1079506287.db2.gz MKUDNGPTQJKGIS-DGCLKSJQSA-N 1 1 355.822 2.616 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001586485477 1079638336 /nfs/dbraw/zinc/63/83/36/1079638336.db2.gz VJSXACWYRJUOMP-AUUYWEPGSA-N 1 1 368.437 2.939 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@@H]2CCCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC001587149032 1079745769 /nfs/dbraw/zinc/74/57/69/1079745769.db2.gz HBMUHJWYHVGBCA-MRXNPFEDSA-N 1 1 371.441 2.801 20 5 FFBDMO C[C@@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876179 1080823388 /nfs/dbraw/zinc/82/33/88/1080823388.db2.gz PRYJXSYFIUPDEQ-ZDUSSCGKSA-N 1 1 367.413 2.707 20 5 FFBDMO C[C@H](CNc1c(-c2nn[nH]n2)cccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC001589876178 1080823524 /nfs/dbraw/zinc/82/35/24/1080823524.db2.gz PRYJXSYFIUPDEQ-CYBMUJFWSA-N 1 1 367.413 2.707 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226638 1081107404 /nfs/dbraw/zinc/10/74/04/1081107404.db2.gz RCWCTTZJTFYAEY-SKDRFNHKSA-N 1 1 370.335 2.938 20 5 FFBDMO C[C@@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-] ZINC001590226638 1081107406 /nfs/dbraw/zinc/10/74/06/1081107406.db2.gz RCWCTTZJTFYAEY-SKDRFNHKSA-N 1 1 370.335 2.938 20 5 FFBDMO Cc1c[nH+]cn1C1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000366618538 512110420 /nfs/dbraw/zinc/11/04/20/512110420.db2.gz GOINNNKLZRWOET-UHFFFAOYSA-N 1 1 358.398 2.651 20 5 FFBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000093646633 250039971 /nfs/dbraw/zinc/03/99/71/250039971.db2.gz OJTOOUOATZAZCU-DGEHHSODSA-N 1 1 352.456 2.896 20 5 FFBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000093646633 250039976 /nfs/dbraw/zinc/03/99/76/250039976.db2.gz OJTOOUOATZAZCU-DGEHHSODSA-N 1 1 352.456 2.896 20 5 FFBDMO CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] ZINC000103195068 250138036 /nfs/dbraw/zinc/13/80/36/250138036.db2.gz SWZQBUZBNQJJAQ-LLVKDONJSA-N 1 1 355.460 2.785 20 5 FFBDMO C[C@H]([NH2+]Cc1ccccc1S(=O)(=O)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000129971858 250873505 /nfs/dbraw/zinc/87/35/05/250873505.db2.gz ZKPBATUEZWGSNA-ZDUSSCGKSA-N 1 1 363.439 2.696 20 5 FFBDMO C[C@H](O)C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262840 251119150 /nfs/dbraw/zinc/11/91/50/251119150.db2.gz YJZGQSCPYWGRFP-SDDRHHMPSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H](O)C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153262840 251119152 /nfs/dbraw/zinc/11/91/52/251119152.db2.gz YJZGQSCPYWGRFP-SDDRHHMPSA-N 1 1 355.822 2.811 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1Cc1ccccc1 ZINC000181188334 251255607 /nfs/dbraw/zinc/25/56/07/251255607.db2.gz QOTVUNXNUTWXRY-DZGCQCFKSA-N 1 1 354.410 2.570 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398035 251345837 /nfs/dbraw/zinc/34/58/37/251345837.db2.gz FHHSJYSHPAQTLG-ZIAGYGMSSA-N 1 1 357.414 2.833 20 5 FFBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)cccc1[N+](=O)[O-] ZINC000267398035 251345841 /nfs/dbraw/zinc/34/58/41/251345841.db2.gz FHHSJYSHPAQTLG-ZIAGYGMSSA-N 1 1 357.414 2.833 20 5 FFBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC000272310184 252006213 /nfs/dbraw/zinc/00/62/13/252006213.db2.gz IEGRNBKNMPZHMF-ZDUSSCGKSA-N 1 1 355.385 2.781 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O ZINC000272283283 252000098 /nfs/dbraw/zinc/00/00/98/252000098.db2.gz DFVQPWLHNPQSPO-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O ZINC000272283283 252000102 /nfs/dbraw/zinc/00/01/02/252000102.db2.gz DFVQPWLHNPQSPO-HUUCEWRRSA-N 1 1 360.414 2.874 20 5 FFBDMO Cn1ccnc1[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000272524644 252060218 /nfs/dbraw/zinc/06/02/18/252060218.db2.gz LWWMBWKVONSHPY-ZHALLVOQSA-N 1 1 358.442 2.949 20 5 FFBDMO Cn1ccnc1[C@@H](NC[C@@H](c1ccco1)[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000272554370 252066609 /nfs/dbraw/zinc/06/66/09/252066609.db2.gz RURCKZDZIPMARV-WMZOPIPTSA-N 1 1 369.425 2.903 20 5 FFBDMO C[C@H](NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1=CC[N@@H+](C)CC1 ZINC000272621513 252082261 /nfs/dbraw/zinc/08/22/61/252082261.db2.gz ACMABCURDTYAEJ-JTQLQIEISA-N 1 1 357.332 2.994 20 5 FFBDMO COc1ccc(NC(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000272843894 252145137 /nfs/dbraw/zinc/14/51/37/252145137.db2.gz PDOBWHGUDKQKEK-ZDUSSCGKSA-N 1 1 350.419 2.703 20 5 FFBDMO O=C(CC[N@H+]1CCC2(C1)CCOCC2)Nc1cc([N+](=O)[O-])ccc1F ZINC000275533898 256021054 /nfs/dbraw/zinc/02/10/54/256021054.db2.gz XZAUFESQQCGOQM-UHFFFAOYSA-N 1 1 351.378 2.565 20 5 FFBDMO CCOCCOCC[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000276159815 256077628 /nfs/dbraw/zinc/07/76/28/256077628.db2.gz HNNYZSWIWMWANJ-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000276729223 256124843 /nfs/dbraw/zinc/12/48/43/256124843.db2.gz SYUZVADSOSRKAW-BETUJISGSA-N 1 1 369.849 2.786 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000277154376 256166355 /nfs/dbraw/zinc/16/63/55/256166355.db2.gz CTQAXQZVHGSMPR-HNNXBMFYSA-N 1 1 359.382 2.763 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000277615577 256217919 /nfs/dbraw/zinc/21/79/19/256217919.db2.gz QJNXZEXHPGOQDY-UONOGXRCSA-N 1 1 361.442 2.986 20 5 FFBDMO C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000278363605 256303734 /nfs/dbraw/zinc/30/37/34/256303734.db2.gz FPRVBLMGLINZAX-LBPRGKRZSA-N 1 1 367.833 2.574 20 5 FFBDMO O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCC[N@H+]1C1CC1 ZINC000279174343 256390036 /nfs/dbraw/zinc/39/00/36/256390036.db2.gz CZVDSAVEGZSMRS-AWEZNQCLSA-N 1 1 357.332 2.857 20 5 FFBDMO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1nc(C(F)(F)F)cs1 ZINC000278896751 256359783 /nfs/dbraw/zinc/35/97/83/256359783.db2.gz JLYHJJXUAUFJOC-QMMMGPOBSA-N 1 1 362.333 2.583 20 5 FFBDMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C2CCOCC2)C[C@@H]1C ZINC000278937572 256364410 /nfs/dbraw/zinc/36/44/10/256364410.db2.gz XEFBOBNBIPATSI-MDJJKAFGSA-N 1 1 373.453 2.710 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279108992 256382702 /nfs/dbraw/zinc/38/27/02/256382702.db2.gz VSZHUNMMZOMIRU-UHFFFAOYSA-N 1 1 372.347 2.675 20 5 FFBDMO O=C(C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651174 512124189 /nfs/dbraw/zinc/12/41/89/512124189.db2.gz HOXWLYBQXKNVKV-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO O=C(C[N@@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000366651174 512124182 /nfs/dbraw/zinc/12/41/82/512124182.db2.gz HOXWLYBQXKNVKV-VXGBXAGGSA-N 1 1 353.806 2.545 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](N2CCCC2)C[C@H]1C ZINC000285599117 256994748 /nfs/dbraw/zinc/99/47/48/256994748.db2.gz PLYPOAPZQIIPDX-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](N2CCCC2)C[C@H]1C ZINC000285599117 256994749 /nfs/dbraw/zinc/99/47/49/256994749.db2.gz PLYPOAPZQIIPDX-WBVHZDCISA-N 1 1 360.458 2.790 20 5 FFBDMO O=C([C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1)N1CCCC1 ZINC000287296252 257082255 /nfs/dbraw/zinc/08/22/55/257082255.db2.gz IUWGGORBYKBLQE-HNNXBMFYSA-N 1 1 370.409 2.694 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[C@@H]([NH+]2CCOCC2)[C@H]1C ZINC000290074885 257313974 /nfs/dbraw/zinc/31/39/74/257313974.db2.gz CORPAUSTPDRTNT-GDBMZVCRSA-N 1 1 362.430 2.539 20 5 FFBDMO COc1ncccc1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000290201688 257320050 /nfs/dbraw/zinc/32/00/50/257320050.db2.gz PCHNVJMBESMVGD-QGZVFWFLSA-N 1 1 367.409 2.654 20 5 FFBDMO C[C@@H]1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+](C2CCC2)C1 ZINC000292062254 257455551 /nfs/dbraw/zinc/45/55/51/257455551.db2.gz WSLYUOXICPTSGL-HNNXBMFYSA-N 1 1 360.458 2.653 20 5 FFBDMO COc1cccc([C@@H]2[C@H](Nc3ncc([N+](=O)[O-])cn3)CC[N@H+]2C2CC2)c1 ZINC000302236936 258097125 /nfs/dbraw/zinc/09/71/25/258097125.db2.gz WAFGPRSILACMEN-IAGOWNOFSA-N 1 1 355.398 2.783 20 5 FFBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC[N@H+]1CC(C)(C)O ZINC000302474730 258103230 /nfs/dbraw/zinc/10/32/30/258103230.db2.gz DQPDCHALEXMLFJ-NSHDSACASA-N 1 1 361.364 2.895 20 5 FFBDMO Cc1cc(N2C[C@H]3OCC[N@H+](Cc4ccccc4)[C@H]3C2)ccc1[N+](=O)[O-] ZINC000301616917 258059277 /nfs/dbraw/zinc/05/92/77/258059277.db2.gz CFRJPVCATVDKSW-VQTJNVASSA-N 1 1 353.422 2.993 20 5 FFBDMO Cc1cc(N2C[C@H]3OCC[N@@H+](Cc4ccccc4)[C@H]3C2)ccc1[N+](=O)[O-] ZINC000301616917 258059278 /nfs/dbraw/zinc/05/92/78/258059278.db2.gz CFRJPVCATVDKSW-VQTJNVASSA-N 1 1 353.422 2.993 20 5 FFBDMO CC(C)[N@H+]1CCC[C@@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1 ZINC000301856877 258071303 /nfs/dbraw/zinc/07/13/03/258071303.db2.gz CGMOCXMMSVMWRN-ZDUSSCGKSA-N 1 1 355.460 2.531 20 5 FFBDMO CC1CC[NH+](C[C@@H]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)CC1 ZINC000331393981 258184551 /nfs/dbraw/zinc/18/45/51/258184551.db2.gz BJMQXZWZVBICJK-HNNXBMFYSA-N 1 1 361.442 2.885 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000332263450 258222093 /nfs/dbraw/zinc/22/20/93/258222093.db2.gz DWEFOFFVOWHERZ-NEPJUHHUSA-N 1 1 355.341 2.553 20 5 FFBDMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000032169462 506233188 /nfs/dbraw/zinc/23/31/88/506233188.db2.gz PVUVIGMSZWENSU-MRXNPFEDSA-N 1 1 369.421 2.879 20 5 FFBDMO COc1ccc(NC(=O)CC[N@@H+](C)Cc2cnc(C)s2)c([N+](=O)[O-])c1 ZINC000053145765 506320370 /nfs/dbraw/zinc/32/03/70/506320370.db2.gz CMBOKLTVCQMQHY-UHFFFAOYSA-N 1 1 364.427 2.829 20 5 FFBDMO COc1cc(C[NH+]2CCC(C)(c3nc(C)no3)CC2)c([N+](=O)[O-])cc1F ZINC000375121715 512173084 /nfs/dbraw/zinc/17/30/84/512173084.db2.gz UVOQQGVTRFJRBT-UHFFFAOYSA-N 1 1 364.377 2.988 20 5 FFBDMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000054224895 506518509 /nfs/dbraw/zinc/51/85/09/506518509.db2.gz OJGRFUAPHZESPR-HOCLYGCPSA-N 1 1 354.410 2.864 20 5 FFBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1 ZINC000007782415 506589175 /nfs/dbraw/zinc/58/91/75/506589175.db2.gz GWACBXBTZLIGIM-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO C[N@@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000054645409 506594499 /nfs/dbraw/zinc/59/44/99/506594499.db2.gz VPZYSMFTHDJLMS-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO C[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)C1 ZINC000054645409 506594509 /nfs/dbraw/zinc/59/45/09/506594509.db2.gz VPZYSMFTHDJLMS-IBGZPJMESA-N 1 1 368.437 2.836 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000067052327 506738719 /nfs/dbraw/zinc/73/87/19/506738719.db2.gz DCOWOFMLTGGAPU-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000056122556 506940981 /nfs/dbraw/zinc/94/09/81/506940981.db2.gz HWDLMMOVVYPSGG-UHFFFAOYSA-N 1 1 357.414 2.520 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](c1ccccc1)N1CC[NH+](C)CC1 ZINC000057778207 507327614 /nfs/dbraw/zinc/32/76/14/507327614.db2.gz UYPWEFIXHIOUIX-LJQANCHMSA-N 1 1 368.437 2.830 20 5 FFBDMO O=C(CC[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000375465378 512343337 /nfs/dbraw/zinc/34/33/37/512343337.db2.gz IGJLCMBWTGEASU-CYBMUJFWSA-N 1 1 371.397 2.673 20 5 FFBDMO Cc1ccccc1OCC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027701482 507678726 /nfs/dbraw/zinc/67/87/26/507678726.db2.gz ONIAGIQYELUVIU-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000027701482 507678729 /nfs/dbraw/zinc/67/87/29/507678729.db2.gz ONIAGIQYELUVIU-UHFFFAOYSA-N 1 1 369.421 2.803 20 5 FFBDMO O=C(C[N@H+](CCO)C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000071080360 507692770 /nfs/dbraw/zinc/69/27/70/507692770.db2.gz BXBLLYZGMWVNCS-UHFFFAOYSA-N 1 1 355.822 2.814 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCCC[N@H+](C)C1CCCCC1 ZINC000028049708 507704816 /nfs/dbraw/zinc/70/48/16/507704816.db2.gz QFQJHWIVFZDMNQ-UHFFFAOYSA-N 1 1 369.487 2.836 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000051049556 507728080 /nfs/dbraw/zinc/72/80/80/507728080.db2.gz NQLVPFXVEBTJCG-HZPDHXFCSA-N 1 1 363.458 2.990 20 5 FFBDMO COCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccco1 ZINC000063496322 507738606 /nfs/dbraw/zinc/73/86/06/507738606.db2.gz ISBHBFBHHYQDML-UHFFFAOYSA-N 1 1 361.398 2.973 20 5 FFBDMO CCOC(=O)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000063550745 507744250 /nfs/dbraw/zinc/74/42/50/507744250.db2.gz FUVBSNSQQBDHCK-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO CCOC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(C)C ZINC000063550745 507744258 /nfs/dbraw/zinc/74/42/58/507744258.db2.gz FUVBSNSQQBDHCK-UHFFFAOYSA-N 1 1 351.403 2.505 20 5 FFBDMO Cc1ccccc1OCC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000029121529 507761870 /nfs/dbraw/zinc/76/18/70/507761870.db2.gz LJVCTANCMCOWSF-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO Cc1ccccc1OCC[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000029121529 507761874 /nfs/dbraw/zinc/76/18/74/507761874.db2.gz LJVCTANCMCOWSF-UHFFFAOYSA-N 1 1 357.410 2.877 20 5 FFBDMO CC[N@H+]1CCC[C@H]1CNC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000051341618 507763034 /nfs/dbraw/zinc/76/30/34/507763034.db2.gz HZNYDNYNSCJMFG-AWEZNQCLSA-N 1 1 360.439 2.932 20 5 FFBDMO CC[N@H+]1CCC[C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000063852071 507775899 /nfs/dbraw/zinc/77/58/99/507775899.db2.gz SFUPNMXZLDQFEO-OAHLLOKOSA-N 1 1 360.458 2.657 20 5 FFBDMO Cc1[nH+]ccn1CCNC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000052192631 507802238 /nfs/dbraw/zinc/80/22/38/507802238.db2.gz QDXQKASBNPKSKM-AWEZNQCLSA-N 1 1 371.441 2.766 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CN2CCCCC2=O)CC1 ZINC000072663795 507839490 /nfs/dbraw/zinc/83/94/90/507839490.db2.gz QGXUFSZIEBMDQJ-UHFFFAOYSA-N 1 1 361.442 2.828 20 5 FFBDMO Cn1c2ccc(Nc3ncc([N+](=O)[O-])cc3C(N)=O)cc2[nH+]c1C1CC1 ZINC000089649105 507853556 /nfs/dbraw/zinc/85/35/56/507853556.db2.gz AZWDQQCTLKIIHV-UHFFFAOYSA-N 1 1 352.354 2.596 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCN(C)c1ccccc1 ZINC000107682034 507862391 /nfs/dbraw/zinc/86/23/91/507862391.db2.gz LYIIPQUJVQNFHX-UHFFFAOYSA-N 1 1 372.425 2.610 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCN(C)c1ccccc1 ZINC000107682034 507862394 /nfs/dbraw/zinc/86/23/94/507862394.db2.gz LYIIPQUJVQNFHX-UHFFFAOYSA-N 1 1 372.425 2.610 20 5 FFBDMO CCOC[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000072975837 507879145 /nfs/dbraw/zinc/87/91/45/507879145.db2.gz ADGISWDLSLPMGN-CQSZACIVSA-N 1 1 365.430 2.681 20 5 FFBDMO C[N@@H+](CCCO)C1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000089901886 507881415 /nfs/dbraw/zinc/88/14/15/507881415.db2.gz QHPSGTWKTVKHGD-UHFFFAOYSA-N 1 1 374.441 2.528 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000078650314 507893406 /nfs/dbraw/zinc/89/34/06/507893406.db2.gz MLRSGEFOAGABNJ-CYBMUJFWSA-N 1 1 359.430 2.898 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@H+](C(C)(C)C)CC1 ZINC000109434355 507962658 /nfs/dbraw/zinc/96/26/58/507962658.db2.gz SRVAJWNRKSXIOP-UHFFFAOYSA-N 1 1 350.419 2.942 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000091856881 508019677 /nfs/dbraw/zinc/01/96/77/508019677.db2.gz DWEBMEDYAGHEMA-JSGCOSHPSA-N 1 1 360.382 2.903 20 5 FFBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1 ZINC000091856881 508019678 /nfs/dbraw/zinc/01/96/78/508019678.db2.gz DWEBMEDYAGHEMA-JSGCOSHPSA-N 1 1 360.382 2.903 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000110353431 508022964 /nfs/dbraw/zinc/02/29/64/508022964.db2.gz NZNVYASHWSGXEM-CQSZACIVSA-N 1 1 357.410 2.854 20 5 FFBDMO C[C@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000110351921 508023073 /nfs/dbraw/zinc/02/30/73/508023073.db2.gz PBBBQAADORGCAA-OAHLLOKOSA-N 1 1 357.410 2.610 20 5 FFBDMO COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000091960394 508027505 /nfs/dbraw/zinc/02/75/05/508027505.db2.gz AJYAHHVFNQUKTA-CJNGLKHVSA-N 1 1 360.414 2.892 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c([N+](=O)[O-])cc1OC ZINC000091960394 508027508 /nfs/dbraw/zinc/02/75/08/508027508.db2.gz AJYAHHVFNQUKTA-CJNGLKHVSA-N 1 1 360.414 2.892 20 5 FFBDMO COc1cc2c(cc1OC)C[N@H+](CCNc1cc(C)c([N+](=O)[O-])cn1)CC2 ZINC000074742299 508051597 /nfs/dbraw/zinc/05/15/97/508051597.db2.gz PFWGGVJOPBHTKB-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO COc1cc2c(cc1OC)C[N@@H+](CCNc1cc(C)c([N+](=O)[O-])cn1)CC2 ZINC000074742299 508051601 /nfs/dbraw/zinc/05/16/01/508051601.db2.gz PFWGGVJOPBHTKB-UHFFFAOYSA-N 1 1 372.425 2.786 20 5 FFBDMO CC[N@@H+](CCNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000101956829 508261774 /nfs/dbraw/zinc/26/17/74/508261774.db2.gz UDSAECPBUSEPIP-LLVKDONJSA-N 1 1 355.822 2.616 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187153 508298323 /nfs/dbraw/zinc/29/83/23/508298323.db2.gz CVHYOQCKZKKPMY-DZGCQCFKSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000114187153 508298324 /nfs/dbraw/zinc/29/83/24/508298324.db2.gz CVHYOQCKZKKPMY-DZGCQCFKSA-N 1 1 355.822 2.812 20 5 FFBDMO CC[NH+]1CCN(C(=O)CC2CCN(c3cc(C)ccc3[N+](=O)[O-])CC2)CC1 ZINC000088721608 508381819 /nfs/dbraw/zinc/38/18/19/508381819.db2.gz RVOZNSUSYAUEBL-UHFFFAOYSA-N 1 1 374.485 2.674 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000077938414 508394015 /nfs/dbraw/zinc/39/40/15/508394015.db2.gz AHQOEWVZIOPSFQ-ZDUSSCGKSA-N 1 1 350.419 2.699 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000106317527 508399125 /nfs/dbraw/zinc/39/91/25/508399125.db2.gz JODBIPFOZHJHBQ-STQMWFEESA-N 1 1 350.419 2.845 20 5 FFBDMO Cc1cc(C(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)cc([N+](=O)[O-])c1 ZINC000133511486 508409157 /nfs/dbraw/zinc/40/91/57/508409157.db2.gz IAPVLKXYSKZCCN-CALCHBBNSA-N 1 1 374.485 2.534 20 5 FFBDMO CC(=O)N1CC[C@@H](C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000156422037 508418822 /nfs/dbraw/zinc/41/88/22/508418822.db2.gz XPCJQVIKZKOTPM-OCCSQVGLSA-N 1 1 373.413 2.506 20 5 FFBDMO C[C@H]1C[C@H](N(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000121869750 508437051 /nfs/dbraw/zinc/43/70/51/508437051.db2.gz AXTBWXRWQFSWJJ-GXFFZTMASA-N 1 1 370.247 2.912 20 5 FFBDMO CC(=O)N1CC[C@H](C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000156643631 508455725 /nfs/dbraw/zinc/45/57/25/508455725.db2.gz FDTWIAJFEGFHTN-OAHLLOKOSA-N 1 1 372.425 2.593 20 5 FFBDMO COc1cc(C[N@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1O ZINC000156847223 508486209 /nfs/dbraw/zinc/48/62/09/508486209.db2.gz RXJMRNMFWRPPFC-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO COc1cc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1O ZINC000156847223 508486214 /nfs/dbraw/zinc/48/62/14/508486214.db2.gz RXJMRNMFWRPPFC-GFCCVEGCSA-N 1 1 359.382 2.768 20 5 FFBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CC[C@@H](C(N)=O)C2)cc1[N+](=O)[O-] ZINC000157071569 508518991 /nfs/dbraw/zinc/51/89/91/508518991.db2.gz DKAKDNPOTBOWCM-OAHLLOKOSA-N 1 1 354.410 2.670 20 5 FFBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3C(=O)N(C)C)o2)c([N+](=O)[O-])c1 ZINC000122684870 508572059 /nfs/dbraw/zinc/57/20/59/508572059.db2.gz LYBQIDKZMIVMGF-INIZCTEOSA-N 1 1 373.409 2.916 20 5 FFBDMO CCC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153825482 508657352 /nfs/dbraw/zinc/65/73/52/508657352.db2.gz WTLIIOIYQAAPKG-HFTRVMKXSA-N 1 1 363.458 2.645 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1CCN1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000153917461 508676744 /nfs/dbraw/zinc/67/67/44/508676744.db2.gz CBMZNTZLRSYNBF-GASCZTMLSA-N 1 1 352.504 2.647 20 5 FFBDMO C[C@H]1C[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)C[N@H+]1C1CC1 ZINC000123436372 508686635 /nfs/dbraw/zinc/68/66/35/508686635.db2.gz DCBZCEJZKQHZFA-DZGCQCFKSA-N 1 1 358.442 2.894 20 5 FFBDMO COc1cc(C[N@@H+]2CCC[C@@H](O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158766306 508750779 /nfs/dbraw/zinc/75/07/79/508750779.db2.gz OREVCKWDCRPQIU-LLVKDONJSA-N 1 1 364.320 2.501 20 5 FFBDMO COc1cc(C[N@H+]2CCC[C@@H](O)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000158766306 508750781 /nfs/dbraw/zinc/75/07/81/508750781.db2.gz OREVCKWDCRPQIU-LLVKDONJSA-N 1 1 364.320 2.501 20 5 FFBDMO CC(=O)Nc1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000159174326 508803267 /nfs/dbraw/zinc/80/32/67/508803267.db2.gz HVDSHSHLNLBYSO-UHFFFAOYSA-N 1 1 354.410 2.875 20 5 FFBDMO O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000142092761 508821130 /nfs/dbraw/zinc/82/11/30/508821130.db2.gz RQMWWRMDKNFFNZ-INIZCTEOSA-N 1 1 358.442 2.505 20 5 FFBDMO COc1cc(C[N@@H+](C)C[C@@H](C)O)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000130738032 508839126 /nfs/dbraw/zinc/83/91/26/508839126.db2.gz XMEUUXZJKJJXCK-CQSZACIVSA-N 1 1 360.410 2.995 20 5 FFBDMO O=C(NCc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000124541009 508849163 /nfs/dbraw/zinc/84/91/63/508849163.db2.gz NMEMTOSAXWTQHN-CRAIPNDOSA-N 1 1 358.442 2.753 20 5 FFBDMO COCC[N@@H+](CCO)Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000130882876 508860172 /nfs/dbraw/zinc/86/01/72/508860172.db2.gz YYSCIYPMTCVTDC-UHFFFAOYSA-N 1 1 359.426 2.803 20 5 FFBDMO C[C@@H](C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@@H+]1CCc2ccccc2C1 ZINC000119773664 508860182 /nfs/dbraw/zinc/86/01/82/508860182.db2.gz IPJWVOUXXWLFQA-HNNXBMFYSA-N 1 1 365.433 2.926 20 5 FFBDMO C[C@@H](C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)[N@H+]1CCc2ccccc2C1 ZINC000119773664 508860184 /nfs/dbraw/zinc/86/01/84/508860184.db2.gz IPJWVOUXXWLFQA-HNNXBMFYSA-N 1 1 365.433 2.926 20 5 FFBDMO CCc1nc(C)c([C@H](C)[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)s1 ZINC000159848515 508900403 /nfs/dbraw/zinc/90/04/03/508900403.db2.gz GNPGRUXZOCKSKR-LBPRGKRZSA-N 1 1 350.444 2.777 20 5 FFBDMO CC(=O)Nc1c[nH]nc1[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000369473700 512426601 /nfs/dbraw/zinc/42/66/01/512426601.db2.gz XGMNYSVRWYMINC-HNNXBMFYSA-N 1 1 357.414 2.698 20 5 FFBDMO COc1ccc([C@@H]2CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000155238942 508955509 /nfs/dbraw/zinc/95/55/09/508955509.db2.gz UFZISRMOIQPULF-AEFFLSMTSA-N 1 1 372.421 2.833 20 5 FFBDMO O=[N+]([O-])c1ccc(N2CCC[C@H]2C[NH+]2CCOCC2)nc1-c1ccccc1 ZINC000160385895 508979344 /nfs/dbraw/zinc/97/93/44/508979344.db2.gz WXGHIIGTDHRYAQ-KRWDZBQOSA-N 1 1 368.437 2.958 20 5 FFBDMO C[NH+]1CCC(N(CCO)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000155498328 509013437 /nfs/dbraw/zinc/01/34/37/509013437.db2.gz VXZYJOGFLBZWEO-UHFFFAOYSA-N 1 1 359.426 2.743 20 5 FFBDMO CCOC(=O)c1cc(N2CCC(Cc3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-] ZINC000160677744 509018450 /nfs/dbraw/zinc/01/84/50/509018450.db2.gz MADZBXKXNKTQBA-UHFFFAOYSA-N 1 1 372.425 2.964 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](Oc2ccncc2)C1 ZINC000156321246 509159655 /nfs/dbraw/zinc/15/96/55/509159655.db2.gz CSMOOTNPRSLFMV-KRWDZBQOSA-N 1 1 370.409 2.780 20 5 FFBDMO C[N@H+]1CCC[C@H]2CN(c3ncc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC000133449726 509161843 /nfs/dbraw/zinc/16/18/43/509161843.db2.gz UERVSHGBOMNJBX-GWCFXTLKSA-N 1 1 355.236 2.673 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[C@H]4[C@H](CCC[N@H+]4C4CC4)C3)cc2N1 ZINC000161899157 509163200 /nfs/dbraw/zinc/16/32/00/509163200.db2.gz QPWWKOWRRFKPAL-PBHICJAKSA-N 1 1 370.453 2.933 20 5 FFBDMO COC(=O)[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000191837912 509205708 /nfs/dbraw/zinc/20/57/08/509205708.db2.gz SMTIKIQJZILMKB-CJNGLKHVSA-N 1 1 373.409 2.923 20 5 FFBDMO COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](c3ncc[nH]3)C2)c([N+](=O)[O-])c1 ZINC000266944798 509270435 /nfs/dbraw/zinc/27/04/35/509270435.db2.gz SIDKHURHZWKAPR-ZDUSSCGKSA-N 1 1 373.413 2.535 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000248476490 509337532 /nfs/dbraw/zinc/33/75/32/509337532.db2.gz YHXLUNLNINXNMU-ZWKOTPCHSA-N 1 1 356.422 2.824 20 5 FFBDMO O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000173076829 509381391 /nfs/dbraw/zinc/38/13/91/509381391.db2.gz YAHSBLFIPXHWHH-SFHVURJKSA-N 1 1 353.422 2.918 20 5 FFBDMO CC[C@@H]1CN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC[N@H+]1C[C@H](C)O ZINC000248637095 509405877 /nfs/dbraw/zinc/40/58/77/509405877.db2.gz KWSVXHNLLKJAKJ-LSDHHAIUSA-N 1 1 364.446 2.521 20 5 FFBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](CCC(N)=O)C1 ZINC000229178659 509424913 /nfs/dbraw/zinc/42/49/13/509424913.db2.gz UACJYQOQOGUXQF-STQMWFEESA-N 1 1 373.413 2.683 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000248950491 509552186 /nfs/dbraw/zinc/55/21/86/509552186.db2.gz ZTLHAKWTCNYICR-MAUKXSAKSA-N 1 1 368.437 2.643 20 5 FFBDMO CCCc1n[nH]c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000179711832 509587017 /nfs/dbraw/zinc/58/70/17/509587017.db2.gz YJXPWCKUIGFVIK-CYBMUJFWSA-N 1 1 359.430 2.521 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cc(F)cc4c3OCOC4)C2)nc1 ZINC000173465869 509618029 /nfs/dbraw/zinc/61/80/29/509618029.db2.gz DMZKRNICHDCWOG-OAHLLOKOSA-N 1 1 374.372 2.682 20 5 FFBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cc(F)cc4c3OCOC4)C2)nc1 ZINC000173465869 509618032 /nfs/dbraw/zinc/61/80/32/509618032.db2.gz DMZKRNICHDCWOG-OAHLLOKOSA-N 1 1 374.372 2.682 20 5 FFBDMO O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)Nc1ccc(F)cc1 ZINC000173467645 509619612 /nfs/dbraw/zinc/61/96/12/509619612.db2.gz UKXGHSJTYRPTBT-OAHLLOKOSA-N 1 1 373.388 2.644 20 5 FFBDMO COc1ccc(F)cc1[C@@H](C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000179925511 509675517 /nfs/dbraw/zinc/67/55/17/509675517.db2.gz ABSNQGXYQNRNMQ-GFCCVEGCSA-N 1 1 373.384 2.982 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)c1cccc([N+](=O)[O-])c1N ZINC000176850997 509725103 /nfs/dbraw/zinc/72/51/03/509725103.db2.gz RIKKJQFQADYVOD-HNNXBMFYSA-N 1 1 368.437 2.914 20 5 FFBDMO CC[N@@H+](C)CCNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 ZINC000264914914 509772432 /nfs/dbraw/zinc/77/24/32/509772432.db2.gz OEHHPRSEJWFLOV-AWEZNQCLSA-N 1 1 371.441 2.844 20 5 FFBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)CCN2CCN(C)CC2)cc1[N+](=O)[O-] ZINC000186582729 509784337 /nfs/dbraw/zinc/78/43/37/509784337.db2.gz GTDPFUTXZYAOTC-HOTGVXAUSA-N 1 1 364.490 2.670 20 5 FFBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[N@H+](CC(C)(C)O)C[C@@H]1C ZINC000186691439 509856399 /nfs/dbraw/zinc/85/63/99/509856399.db2.gz CCNIKFBWPBPZTH-ZDUSSCGKSA-N 1 1 364.446 2.521 20 5 FFBDMO CCC[NH+]1CCN(C(=O)c2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000177101186 509873960 /nfs/dbraw/zinc/87/39/60/509873960.db2.gz MDFKDYXOBMLXKN-UHFFFAOYSA-N 1 1 356.220 2.525 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2CC)C1 ZINC000173949465 509870580 /nfs/dbraw/zinc/87/05/80/509870580.db2.gz CSXQFCQLLGMFTM-AWEZNQCLSA-N 1 1 369.487 2.510 20 5 FFBDMO C[C@H](C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000245203393 509884925 /nfs/dbraw/zinc/88/49/25/509884925.db2.gz QMVYGVSLYOPTKB-OWCLPIDISA-N 1 1 360.458 2.505 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3C[C@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000255939131 509939839 /nfs/dbraw/zinc/93/98/39/509939839.db2.gz GXJGZLVXXMBGEC-IYBDPMFKSA-N 1 1 374.485 2.855 20 5 FFBDMO CC[NH+]1CCN(C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)CC1 ZINC000255938902 509939862 /nfs/dbraw/zinc/93/98/62/509939862.db2.gz GXJGZLVXXMBGEC-HOTGVXAUSA-N 1 1 374.485 2.855 20 5 FFBDMO C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CC(C)(C)O ZINC000186944001 509966610 /nfs/dbraw/zinc/96/66/10/509966610.db2.gz XMUNDZUEZWTXQS-LLVKDONJSA-N 1 1 370.837 2.557 20 5 FFBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H]1CCCOC1 ZINC000245499864 509968704 /nfs/dbraw/zinc/96/87/04/509968704.db2.gz YZLQZYWBUYMXHB-NWDGAFQWSA-N 1 1 355.822 2.934 20 5 FFBDMO Cc1n[nH]c(C(=O)N[C@H]2[C@H](C)C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000268530334 509992493 /nfs/dbraw/zinc/99/24/93/509992493.db2.gz DARCQZLTGNXDEV-VIKVFOODSA-N 1 1 371.441 2.513 20 5 FFBDMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000261634993 510010345 /nfs/dbraw/zinc/01/03/45/510010345.db2.gz BEWUUIIKFSRBQL-GOSISDBHSA-N 1 1 369.421 2.709 20 5 FFBDMO CC1CCN(C(=O)C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000174244914 510021678 /nfs/dbraw/zinc/02/16/78/510021678.db2.gz NRBNUVJVVSMBFN-UHFFFAOYSA-N 1 1 361.442 2.697 20 5 FFBDMO C[C@H](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)Cc1ccccc1 ZINC000174411982 510102304 /nfs/dbraw/zinc/10/23/04/510102304.db2.gz WYSKSCKYXYMFIC-CYBMUJFWSA-N 1 1 374.416 2.957 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190459910 510144257 /nfs/dbraw/zinc/14/42/57/510144257.db2.gz KGFNLXQDDUSBIU-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO CCOc1ccc(NC(=O)C[N@H+]2CCSC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000190459910 510144261 /nfs/dbraw/zinc/14/42/61/510144261.db2.gz KGFNLXQDDUSBIU-LBPRGKRZSA-N 1 1 353.444 2.617 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCCO)Cc1ccccc1 ZINC000269007624 510189754 /nfs/dbraw/zinc/18/97/54/510189754.db2.gz SXCLVAVQAHYELZ-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCCO)Cc1ccccc1 ZINC000269007624 510189761 /nfs/dbraw/zinc/18/97/61/510189761.db2.gz SXCLVAVQAHYELZ-UHFFFAOYSA-N 1 1 357.410 2.726 20 5 FFBDMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)[NH2+]Cc2ccccc21 ZINC000262296016 510235079 /nfs/dbraw/zinc/23/50/79/510235079.db2.gz WUIUEWFUZPZLOK-LBPRGKRZSA-N 1 1 361.423 2.590 20 5 FFBDMO C[N@H+](Cc1cc(Cl)cc(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000174738148 510282980 /nfs/dbraw/zinc/28/29/80/510282980.db2.gz KOUBFQZGGRINIC-CQSZACIVSA-N 1 1 359.213 2.591 20 5 FFBDMO CCOc1cccc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-] ZINC000181212641 510304494 /nfs/dbraw/zinc/30/44/94/510304494.db2.gz YDYDICRSNPTZBD-MRXNPFEDSA-N 1 1 350.463 2.677 20 5 FFBDMO C[C@@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@@H+](C)Cc1ccccc1 ZINC000181228505 510310914 /nfs/dbraw/zinc/31/09/14/510310914.db2.gz MWEOAZPNIUBPAL-ZDUSSCGKSA-N 1 1 371.393 2.574 20 5 FFBDMO CCc1[nH]nc(C(=O)N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000171809407 510382923 /nfs/dbraw/zinc/38/29/23/510382923.db2.gz UXGAIFPXPDZMGQ-AWEZNQCLSA-N 1 1 363.462 2.609 20 5 FFBDMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000194750666 510510597 /nfs/dbraw/zinc/51/05/97/510510597.db2.gz BHEBLKOHOZYSBY-QGZVFWFLSA-N 1 1 368.437 2.645 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC000181703314 510547840 /nfs/dbraw/zinc/54/78/40/510547840.db2.gz YLQQNQCSSMYJOR-MRXNPFEDSA-N 1 1 359.382 2.519 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000246713284 510630829 /nfs/dbraw/zinc/63/08/29/510630829.db2.gz FUXHSHZKBUDKAW-RDJZCZTQSA-N 1 1 363.458 2.770 20 5 FFBDMO C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000266549319 510652454 /nfs/dbraw/zinc/65/24/54/510652454.db2.gz SVIGGZLYSGGMNA-ABAIWWIYSA-N 1 1 372.347 2.864 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(CC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]21 ZINC000246764788 510659612 /nfs/dbraw/zinc/65/96/12/510659612.db2.gz HWCALUSISDRHGN-IUODEOHRSA-N 1 1 366.849 2.603 20 5 FFBDMO O=C1CCc2cc([N+](=O)[O-])c(N3CCC[N@H+](C4CCCC4)CC3)cc2N1 ZINC000172373372 510696396 /nfs/dbraw/zinc/69/63/96/510696396.db2.gz YFCVSTKHECDITB-UHFFFAOYSA-N 1 1 358.442 2.934 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1 ZINC000246868044 510719524 /nfs/dbraw/zinc/71/95/24/510719524.db2.gz RZXXLUITEWCKIC-RDJZCZTQSA-N 1 1 363.458 2.770 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182166324 510790025 /nfs/dbraw/zinc/79/00/25/510790025.db2.gz DVPPQRMRQRQZJN-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CN3CCOCC3)C2)c(Cl)c1 ZINC000182166324 510790028 /nfs/dbraw/zinc/79/00/28/510790028.db2.gz DVPPQRMRQRQZJN-AWEZNQCLSA-N 1 1 353.850 2.792 20 5 FFBDMO O=[N+]([O-])c1cc(C[NH2+]CCS(=O)(=O)c2ccc(Cl)cc2)cs1 ZINC000195422640 510820661 /nfs/dbraw/zinc/82/06/61/510820661.db2.gz LQIDIJFWYKWCDS-UHFFFAOYSA-N 1 1 360.844 2.873 20 5 FFBDMO CC(=O)c1cccc(OC[C@@H](O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000285359437 510875917 /nfs/dbraw/zinc/87/59/17/510875917.db2.gz QFHQVBZGVWMLNW-SFHVURJKSA-N 1 1 372.421 2.712 20 5 FFBDMO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](c3ccnn3C)C2)cccc1[N+](=O)[O-] ZINC000360305682 510894356 /nfs/dbraw/zinc/89/43/56/510894356.db2.gz LSDPPFIOFGGIGM-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000360305649 510894398 /nfs/dbraw/zinc/89/43/98/510894398.db2.gz LBSMDANBLVZWNG-OAHLLOKOSA-N 1 1 371.441 2.845 20 5 FFBDMO C[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1c1ccccc1 ZINC000270607711 510922476 /nfs/dbraw/zinc/92/24/76/510922476.db2.gz DWFFNIBEBHYFFG-LPHOPBHVSA-N 1 1 373.384 2.674 20 5 FFBDMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000270801242 510988476 /nfs/dbraw/zinc/98/84/76/510988476.db2.gz MACWWXIRTDQYHH-ZWKOTPCHSA-N 1 1 358.442 2.896 20 5 FFBDMO C[N@@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC000270876600 511013051 /nfs/dbraw/zinc/01/30/51/511013051.db2.gz DCYZXCZIZYOVKP-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO C[N@H+]1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)C1 ZINC000270876600 511013054 /nfs/dbraw/zinc/01/30/54/511013054.db2.gz DCYZXCZIZYOVKP-UHFFFAOYSA-N 1 1 360.439 2.885 20 5 FFBDMO CN1C(=O)N[C@@H]2C[N@H+](Cc3cc(=O)oc4ccc5ccccc5c34)CC[C@@H]21 ZINC000285826092 511015472 /nfs/dbraw/zinc/01/54/72/511015472.db2.gz FPCVCXQZTBWUOA-SJORKVTESA-N 1 1 363.417 2.544 20 5 FFBDMO CC(C)[C@H]1CN(C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000332448497 511082755 /nfs/dbraw/zinc/08/27/55/511082755.db2.gz LTZVFHLFRQOXJO-GOSISDBHSA-N 1 1 360.458 2.607 20 5 FFBDMO C[C@@H](NCC1([NH+]2CCCCC2)CCOCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294611033 511119810 /nfs/dbraw/zinc/11/98/10/511119810.db2.gz DSGHYJMNLHSDKN-OAHLLOKOSA-N 1 1 362.474 2.863 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCc1cnccn1 ZINC000271287297 511150433 /nfs/dbraw/zinc/15/04/33/511150433.db2.gz BITPPQLGZDKEJP-LLVKDONJSA-N 1 1 363.805 2.540 20 5 FFBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCc1cnccn1 ZINC000271287297 511150441 /nfs/dbraw/zinc/15/04/41/511150441.db2.gz BITPPQLGZDKEJP-LLVKDONJSA-N 1 1 363.805 2.540 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(S(=O)(=O)N2CCCC2)CC1 ZINC000282898515 511153824 /nfs/dbraw/zinc/15/38/24/511153824.db2.gz WPZKEHYPGCIFFC-AWEZNQCLSA-N 1 1 367.471 2.546 20 5 FFBDMO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000362253498 511155176 /nfs/dbraw/zinc/15/51/76/511155176.db2.gz DWKGTYVKDFUMMQ-KRWDZBQOSA-N 1 1 366.893 2.849 20 5 FFBDMO Cc1n[nH]c(C(=O)N2CCC(n3c(C)nc4ccccc43)CC2)c1[N+](=O)[O-] ZINC000279859547 511243437 /nfs/dbraw/zinc/24/34/37/511243437.db2.gz UWNRVTBGGZYULH-UHFFFAOYSA-N 1 1 368.397 2.762 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000295196425 511316558 /nfs/dbraw/zinc/31/65/58/511316558.db2.gz BGAZWLUQVAANCG-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO CC1(C)C[C@@H](O)CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000295196425 511316565 /nfs/dbraw/zinc/31/65/65/511316565.db2.gz BGAZWLUQVAANCG-LBPRGKRZSA-N 1 1 355.822 2.670 20 5 FFBDMO COCc1cccc(CNC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000271790044 511325721 /nfs/dbraw/zinc/32/57/21/511325721.db2.gz ULMHFOJUKMUKQH-CQSZACIVSA-N 1 1 357.410 2.708 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)n[nH]3)CC[C@@H]21 ZINC000295429924 511403157 /nfs/dbraw/zinc/40/31/57/511403157.db2.gz MKPKVBNNMBXCLC-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@@H]21 ZINC000295429924 511403164 /nfs/dbraw/zinc/40/31/64/511403164.db2.gz MKPKVBNNMBXCLC-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(-c4ccc([N+](=O)[O-])cc4)[nH]n3)CC[C@@H]21 ZINC000295429924 511403170 /nfs/dbraw/zinc/40/31/70/511403170.db2.gz MKPKVBNNMBXCLC-KDOFPFPSSA-N 1 1 369.425 2.541 20 5 FFBDMO Cc1cc(Cl)c(C(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000295571654 511448990 /nfs/dbraw/zinc/44/89/90/511448990.db2.gz ZZTKXPUWWWWETK-BETUJISGSA-N 1 1 369.849 2.786 20 5 FFBDMO COc1cc(C[NH+]2CCC(OC)CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000272262547 511483803 /nfs/dbraw/zinc/48/38/03/511483803.db2.gz KHFJAQUESXRUCO-UHFFFAOYSA-N 1 1 360.357 2.858 20 5 FFBDMO COc1cccc(C2=CC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)c1 ZINC000363375404 511512104 /nfs/dbraw/zinc/51/21/04/511512104.db2.gz VRPGDVWQCJCUDF-UHFFFAOYSA-N 1 1 367.405 2.992 20 5 FFBDMO COc1cccc(C2=CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)c1 ZINC000363375404 511512108 /nfs/dbraw/zinc/51/21/08/511512108.db2.gz VRPGDVWQCJCUDF-UHFFFAOYSA-N 1 1 367.405 2.992 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194957 511547924 /nfs/dbraw/zinc/54/79/24/511547924.db2.gz MHHUBJVFHCIQHU-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO Cc1cc(C(=O)N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000299194957 511547931 /nfs/dbraw/zinc/54/79/31/511547931.db2.gz MHHUBJVFHCIQHU-UXLLHSPISA-N 1 1 361.442 2.617 20 5 FFBDMO CCC(=O)c1ccc(N2CCN(C[C@H]3CCCC[N@H+]3C)CC2)c([N+](=O)[O-])c1 ZINC000280698303 511566860 /nfs/dbraw/zinc/56/68/60/511566860.db2.gz KATKLELYHUUEQF-QGZVFWFLSA-N 1 1 374.485 2.794 20 5 FFBDMO COc1cc(C[NH2+]Cc2ccnc(OC(F)F)c2)c([N+](=O)[O-])cc1O ZINC000284127875 511615016 /nfs/dbraw/zinc/61/50/16/511615016.db2.gz UILHUBVGDOVKIP-UHFFFAOYSA-N 1 1 355.297 2.595 20 5 FFBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)COCC(F)(F)F ZINC000292509798 511623178 /nfs/dbraw/zinc/62/31/78/511623178.db2.gz TZYQHIQRXFNFEB-CQSZACIVSA-N 1 1 350.337 2.745 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CCC(OC)CC1 ZINC000299438154 511635675 /nfs/dbraw/zinc/63/56/75/511635675.db2.gz YCIJBMPBLPHHPT-UHFFFAOYSA-N 1 1 365.430 2.821 20 5 FFBDMO CC[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C ZINC000303511239 511739317 /nfs/dbraw/zinc/73/93/17/511739317.db2.gz BNIXTSVMSHLRBT-HNNXBMFYSA-N 1 1 369.487 2.754 20 5 FFBDMO CC(C)NC(=O)c1ccc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)c([N+](=O)[O-])c1 ZINC000292846698 511742924 /nfs/dbraw/zinc/74/29/24/511742924.db2.gz QXVHQQSURHINPK-LJQANCHMSA-N 1 1 360.458 2.655 20 5 FFBDMO Cn1cc(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000292897548 511764207 /nfs/dbraw/zinc/76/42/07/511764207.db2.gz ZOIJUBQXPRFAMC-IBGZPJMESA-N 1 1 355.442 2.523 20 5 FFBDMO O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000365999261 511775984 /nfs/dbraw/zinc/77/59/84/511775984.db2.gz YKJZLMUWTGVRJD-JKSUJKDBSA-N 1 1 355.394 2.782 20 5 FFBDMO CNc1ccc(-c2nc([C@@H]3C[N@H+]4CCC[C@]4(C)CO3)no2)cc1[N+](=O)[O-] ZINC000350390454 511799106 /nfs/dbraw/zinc/79/91/06/511799106.db2.gz MDCYXRGYSAKSPY-WMLDXEAASA-N 1 1 359.386 2.612 20 5 FFBDMO CC(C)[C@]1(CO)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000293084289 511835261 /nfs/dbraw/zinc/83/52/61/511835261.db2.gz OZXMFXJUWOITJL-GOSISDBHSA-N 1 1 367.421 2.793 20 5 FFBDMO CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc1OC ZINC000274460482 511842689 /nfs/dbraw/zinc/84/26/89/511842689.db2.gz JVDXWNQSEYREGW-CYBMUJFWSA-N 1 1 365.430 2.605 20 5 FFBDMO C[N@@H+]1CCc2c(cccc2NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000363980837 511886472 /nfs/dbraw/zinc/88/64/72/511886472.db2.gz XYIAKMIRSOZJJX-UHFFFAOYSA-N 1 1 361.423 2.525 20 5 FFBDMO C[N@H+]1CCc2c(cccc2NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1 ZINC000363980837 511886477 /nfs/dbraw/zinc/88/64/77/511886477.db2.gz XYIAKMIRSOZJJX-UHFFFAOYSA-N 1 1 361.423 2.525 20 5 FFBDMO C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1CC[C@@H](O)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000285140552 512014605 /nfs/dbraw/zinc/01/46/05/512014605.db2.gz LVNRDMPMENXDMS-RDTXWAMCSA-N 1 1 370.453 2.594 20 5 FFBDMO COc1ccccc1COC[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000285155759 512019689 /nfs/dbraw/zinc/01/96/89/512019689.db2.gz AETMCWGNSXKFTJ-GOSISDBHSA-N 1 1 374.437 2.655 20 5 FFBDMO C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3Br)C2)C1 ZINC000293605345 512024302 /nfs/dbraw/zinc/02/43/02/512024302.db2.gz CHQPPDYUJNTJLA-HNNXBMFYSA-N 1 1 368.231 2.525 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1Br ZINC000377776701 512444969 /nfs/dbraw/zinc/44/49/69/512444969.db2.gz HFWOULXORHIHEJ-GHMZBOCLSA-N 1 1 368.231 2.714 20 5 FFBDMO CC[N@H+]1CCCN([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000371732563 512547655 /nfs/dbraw/zinc/54/76/55/512547655.db2.gz NMIXSKWVPMPJFB-GFCCVEGCSA-N 1 1 354.838 2.603 20 5 FFBDMO O=C(CC[N@H+]1CCc2ccccc2[C@H]1CO)Nc1ccc([N+](=O)[O-])cc1 ZINC000411391523 512613733 /nfs/dbraw/zinc/61/37/33/512613733.db2.gz ORTXCJANUKAHGQ-GOSISDBHSA-N 1 1 355.394 2.515 20 5 FFBDMO CCc1n[nH]c(C(=O)NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000374164232 512686696 /nfs/dbraw/zinc/68/66/96/512686696.db2.gz RDZVXTPXTBMZGG-IBGZPJMESA-N 1 1 371.441 2.522 20 5 FFBDMO CCc1ccccc1NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000370061209 512747756 /nfs/dbraw/zinc/74/77/56/512747756.db2.gz SLLDDETVLQXPJA-UHFFFAOYSA-N 1 1 357.414 2.629 20 5 FFBDMO Cc1cccc(NC[C@H]2CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)[nH+]1 ZINC000370156656 512793951 /nfs/dbraw/zinc/79/39/51/512793951.db2.gz RTKMDLAEBQXRQH-CYBMUJFWSA-N 1 1 355.398 2.597 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@H](O)C[C@@H]3c3ccccc3)n2)cc1 ZINC000411933586 512879648 /nfs/dbraw/zinc/87/96/48/512879648.db2.gz GVEGQKPGNXTNNG-IAGOWNOFSA-N 1 1 366.377 2.953 20 5 FFBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@H](O)C[C@@H]3c3ccccc3)n2)cc1 ZINC000411933586 512879652 /nfs/dbraw/zinc/87/96/52/512879652.db2.gz GVEGQKPGNXTNNG-IAGOWNOFSA-N 1 1 366.377 2.953 20 5 FFBDMO CNc1c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000387602099 512892736 /nfs/dbraw/zinc/89/27/36/512892736.db2.gz KOEVRWPTMCZYBK-UHFFFAOYSA-N 1 1 356.426 2.888 20 5 FFBDMO NC(=O)[C@@H]1C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000411970738 512895953 /nfs/dbraw/zinc/89/59/53/512895953.db2.gz GTIABEQYUJLNCS-UONOGXRCSA-N 1 1 359.813 2.949 20 5 FFBDMO COC(=O)[C@]1(C)CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000412067141 512941755 /nfs/dbraw/zinc/94/17/55/512941755.db2.gz LXBJYEYLEMHALZ-GOSISDBHSA-N 1 1 363.414 2.507 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)CC3(C)C)cc2[N+](=O)[O-])C1 ZINC000408051462 512990289 /nfs/dbraw/zinc/99/02/89/512990289.db2.gz PERWUGNNXCUMNR-OAHLLOKOSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)CC3(C)C)cc2[N+](=O)[O-])C1 ZINC000408051462 512990291 /nfs/dbraw/zinc/99/02/91/512990291.db2.gz PERWUGNNXCUMNR-OAHLLOKOSA-N 1 1 374.485 2.997 20 5 FFBDMO Cc1cc(NC[C@H]2CSCC[N@H+]2Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000428666156 513157776 /nfs/dbraw/zinc/15/77/76/513157776.db2.gz GKTGDBHBXUSROZ-INIZCTEOSA-N 1 1 358.467 2.750 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000439697708 513167106 /nfs/dbraw/zinc/16/71/06/513167106.db2.gz QCHKVPYRPREYJL-CQSZACIVSA-N 1 1 359.430 2.711 20 5 FFBDMO CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000439697708 513167114 /nfs/dbraw/zinc/16/71/14/513167114.db2.gz QCHKVPYRPREYJL-CQSZACIVSA-N 1 1 359.430 2.711 20 5 FFBDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000439697708 513167119 /nfs/dbraw/zinc/16/71/19/513167119.db2.gz QCHKVPYRPREYJL-CQSZACIVSA-N 1 1 359.430 2.711 20 5 FFBDMO C[C@]12CC[N@@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C[C@H]1C2(F)F ZINC000428744732 513180452 /nfs/dbraw/zinc/18/04/52/513180452.db2.gz CCPRLNABVNMVOZ-LZWOXQAQSA-N 1 1 351.353 2.677 20 5 FFBDMO C[C@]12CC[N@H+]([C@H]3CCN(c4cccc([N+](=O)[O-])c4)C3=O)C[C@H]1C2(F)F ZINC000428744732 513180457 /nfs/dbraw/zinc/18/04/57/513180457.db2.gz CCPRLNABVNMVOZ-LZWOXQAQSA-N 1 1 351.353 2.677 20 5 FFBDMO CNC(=O)[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000421396792 513248215 /nfs/dbraw/zinc/24/82/15/513248215.db2.gz ZUKNAQAIQBEFMU-INIZCTEOSA-N 1 1 368.437 2.931 20 5 FFBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]([C@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429023179 513260227 /nfs/dbraw/zinc/26/02/27/513260227.db2.gz DOXPTPZECWZEIZ-FSZRXZPDSA-N 1 1 360.458 2.584 20 5 FFBDMO C[C@H]1CN(c2ccc(Cl)c(F)c2)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000429032021 513261590 /nfs/dbraw/zinc/26/15/90/513261590.db2.gz VYFOHKVWVQNMRJ-LBPRGKRZSA-N 1 1 367.812 2.795 20 5 FFBDMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@]3(CCCc4ccccc43)C2)c1 ZINC000440326297 513294003 /nfs/dbraw/zinc/29/40/03/513294003.db2.gz MGKIUGDNHLQJON-AZUAARDMSA-N 1 1 370.453 2.522 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)Cc2ccccc2O1 ZINC000429183461 513300931 /nfs/dbraw/zinc/30/09/31/513300931.db2.gz FLNWKIHXRKQASK-PBHICJAKSA-N 1 1 358.394 2.618 20 5 FFBDMO C[C@]1(c2ccccc2)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000446724219 513324357 /nfs/dbraw/zinc/32/43/57/513324357.db2.gz YOYRUSUELMFLGY-QUCCMNQESA-N 1 1 356.422 2.998 20 5 FFBDMO COCCOc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000446832922 513345209 /nfs/dbraw/zinc/34/52/09/513345209.db2.gz QUDYUOBGNVWLLR-UHFFFAOYSA-N 1 1 356.382 2.786 20 5 FFBDMO COCC(C)(C)[NH+]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000424994542 513357020 /nfs/dbraw/zinc/35/70/20/513357020.db2.gz YQLYUKHVEJXRQR-UHFFFAOYSA-N 1 1 363.458 2.901 20 5 FFBDMO C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C[N@H+]1CCO ZINC000418121602 513381378 /nfs/dbraw/zinc/38/13/78/513381378.db2.gz XGPFNDQHPGTYPX-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)CN1CCO ZINC000418121602 513381385 /nfs/dbraw/zinc/38/13/85/513381385.db2.gz XGPFNDQHPGTYPX-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)CN1CCO ZINC000418121602 513381388 /nfs/dbraw/zinc/38/13/88/513381388.db2.gz XGPFNDQHPGTYPX-CABCVRRESA-N 1 1 359.426 2.742 20 5 FFBDMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000425061070 513395593 /nfs/dbraw/zinc/39/55/93/513395593.db2.gz XVECMHRFXVLARR-IINYFYTJSA-N 1 1 368.231 2.524 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000434762374 513422135 /nfs/dbraw/zinc/42/21/35/513422135.db2.gz BGCSMKJMIQVBRU-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434762374 513422139 /nfs/dbraw/zinc/42/21/39/513422139.db2.gz BGCSMKJMIQVBRU-HNNXBMFYSA-N 1 1 367.471 2.507 20 5 FFBDMO C[C@@H]1Cc2c([nH+]cn2CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000451006132 513452869 /nfs/dbraw/zinc/45/28/69/513452869.db2.gz ZXTWUYXRJRMXSY-QWHCGFSZSA-N 1 1 354.410 2.751 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)n2)c1 ZINC000441197553 513510378 /nfs/dbraw/zinc/51/03/78/513510378.db2.gz AXLDZGXMWAWUJV-GJZGRUSLSA-N 1 1 358.398 2.893 20 5 FFBDMO CCC(C)(C)CC[NH+]1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000441269937 513524719 /nfs/dbraw/zinc/52/47/19/513524719.db2.gz TWOSGHPNDSHYAE-UHFFFAOYSA-N 1 1 369.487 2.727 20 5 FFBDMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000422033688 513536340 /nfs/dbraw/zinc/53/63/40/513536340.db2.gz HYUYOLKHGRGFSF-CYBMUJFWSA-N 1 1 367.424 2.987 20 5 FFBDMO Cn1cc[nH+]c1N1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413256314 513551164 /nfs/dbraw/zinc/55/11/64/513551164.db2.gz CKAJSEPNPXSRRB-UHFFFAOYSA-N 1 1 352.398 2.957 20 5 FFBDMO Cc1cc(OCC(=O)NCCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000430097152 513552001 /nfs/dbraw/zinc/55/20/01/513552001.db2.gz BBZIIGVOCMILBM-UHFFFAOYSA-N 1 1 371.437 2.920 20 5 FFBDMO Cc1ccccc1CC[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000451171866 513566482 /nfs/dbraw/zinc/56/64/82/513566482.db2.gz ULXDCYPZVOLREK-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO Cc1ccccc1CC[N@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000451171866 513566491 /nfs/dbraw/zinc/56/64/91/513566491.db2.gz ULXDCYPZVOLREK-UHFFFAOYSA-N 1 1 371.393 2.745 20 5 FFBDMO CCOC(=O)c1ccnc(NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-] ZINC000447812384 513578605 /nfs/dbraw/zinc/57/86/05/513578605.db2.gz LMJSAHGLZVBCFB-CYBMUJFWSA-N 1 1 350.419 2.699 20 5 FFBDMO COCCCOCC[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425463215 513579988 /nfs/dbraw/zinc/57/99/88/513579988.db2.gz VVOQARUHVJKNEZ-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COCCCOCC[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425463215 513579994 /nfs/dbraw/zinc/57/99/94/513579994.db2.gz VVOQARUHVJKNEZ-UHFFFAOYSA-N 1 1 361.236 2.842 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](CSC)C2)cc1[N+](=O)[O-] ZINC000430198544 513587408 /nfs/dbraw/zinc/58/74/08/513587408.db2.gz RUEJGLLWLWAZFJ-CQSZACIVSA-N 1 1 368.455 2.722 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1CNC(=O)CC[N@H+]1CCc2ccccc2C1 ZINC000416133498 513588576 /nfs/dbraw/zinc/58/85/76/513588576.db2.gz MWPCNVBBWIILQX-UHFFFAOYSA-N 1 1 369.421 2.668 20 5 FFBDMO COc1cccc(C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000435658129 513649479 /nfs/dbraw/zinc/64/94/79/513649479.db2.gz YKXQVHNZEZHWAA-HNNXBMFYSA-N 1 1 355.394 2.608 20 5 FFBDMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H](C)C[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000442093155 513666021 /nfs/dbraw/zinc/66/60/21/513666021.db2.gz GZTSQHUJQJBKFJ-VNHYZAJKSA-N 1 1 369.487 2.548 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451341204 513688042 /nfs/dbraw/zinc/68/80/42/513688042.db2.gz KTIBYXRDXVPOMO-CGTJXYLNSA-N 1 1 361.442 2.857 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCC[C@H]3O)n2)c1 ZINC000451420463 513739891 /nfs/dbraw/zinc/73/98/91/513739891.db2.gz PAHHYBSWNYBGRH-ARFHVFGLSA-N 1 1 358.398 2.770 20 5 FFBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000451430623 513747963 /nfs/dbraw/zinc/74/79/63/513747963.db2.gz YCBHJHSWOBHVIA-ZTFGCOKTSA-N 1 1 361.442 2.857 20 5 FFBDMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2cc(C)c([N+](=O)[O-])cc2C)C1 ZINC000416415093 513761257 /nfs/dbraw/zinc/76/12/57/513761257.db2.gz SSLCSPVOMAZJHQ-HNNXBMFYSA-N 1 1 369.487 2.564 20 5 FFBDMO CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1cccc2c(=O)c3cccc(F)c3[nH]c12 ZINC000436426709 513852028 /nfs/dbraw/zinc/85/20/28/513852028.db2.gz XXBOSNMGUVYIPU-CYBMUJFWSA-N 1 1 367.424 2.844 20 5 FFBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC000448934724 513979780 /nfs/dbraw/zinc/97/97/80/513979780.db2.gz WTXJZFZBESZQPJ-GASCZTMLSA-N 1 1 361.442 2.937 20 5 FFBDMO Cc1cc(OCC(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000431835954 514014984 /nfs/dbraw/zinc/01/49/84/514014984.db2.gz XIODRUFGUVKTQO-CQSZACIVSA-N 1 1 363.458 2.909 20 5 FFBDMO CCOC(=O)[C@@H]1C[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC12COC2 ZINC000449364323 514181230 /nfs/dbraw/zinc/18/12/30/514181230.db2.gz NSSKLQVIDNQGMD-VRXKTSEUSA-N 1 1 360.410 2.510 20 5 FFBDMO C[N@@H+]1CC=C(CNC(=O)c2cccc3c(=O)c4cccc(F)c4[nH]c23)CC1 ZINC000444292593 514184126 /nfs/dbraw/zinc/18/41/26/514184126.db2.gz RXQWHHNCPQVJQW-UHFFFAOYSA-N 1 1 365.408 2.812 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H]3CCC[N@H+]3CCCO)o2)c1 ZINC000449385087 514188996 /nfs/dbraw/zinc/18/89/96/514188996.db2.gz DPDOCVNVCRAUJX-KRWDZBQOSA-N 1 1 359.426 2.791 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H]3CCC[N@@H+]3CCCO)o2)c1 ZINC000449385087 514189001 /nfs/dbraw/zinc/18/90/01/514189001.db2.gz DPDOCVNVCRAUJX-KRWDZBQOSA-N 1 1 359.426 2.791 20 5 FFBDMO COC[C@H]1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000452106527 514195003 /nfs/dbraw/zinc/19/50/03/514195003.db2.gz QUOAIJDXBUKFFY-AWEZNQCLSA-N 1 1 365.430 2.681 20 5 FFBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC1 ZINC000420609325 514200341 /nfs/dbraw/zinc/20/03/41/514200341.db2.gz GTOTYNVMQCWOLT-GFCCVEGCSA-N 1 1 360.439 2.638 20 5 FFBDMO CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000452181763 514237050 /nfs/dbraw/zinc/23/70/50/514237050.db2.gz JPGIVEWQERUMPZ-BSXFFOKHSA-N 1 1 363.458 2.906 20 5 FFBDMO O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000437873681 514257431 /nfs/dbraw/zinc/25/74/31/514257431.db2.gz IYNXGZIYTURYDL-MRXNPFEDSA-N 1 1 361.442 2.887 20 5 FFBDMO O=C1[C@@H]([N@@H+]2CC[C@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714802 514300958 /nfs/dbraw/zinc/30/09/58/514300958.db2.gz FFOGYDJAUAXLSD-RISCZKNCSA-N 1 1 357.332 2.974 20 5 FFBDMO O=C1[C@@H]([N@H+]2CC[C@H](CC(F)(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000444714802 514300965 /nfs/dbraw/zinc/30/09/65/514300965.db2.gz FFOGYDJAUAXLSD-RISCZKNCSA-N 1 1 357.332 2.974 20 5 FFBDMO Cc1cc(N(C)CCN2CCOC(C)(C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000432937107 514328486 /nfs/dbraw/zinc/32/84/86/514328486.db2.gz JEKFEHCYWGNULG-UHFFFAOYSA-N 1 1 358.442 2.998 20 5 FFBDMO COCC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCSC1 ZINC000433182035 514409846 /nfs/dbraw/zinc/40/98/46/514409846.db2.gz LSRWJNFIYNOUFI-HNNXBMFYSA-N 1 1 367.471 2.686 20 5 FFBDMO COCC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCSC1 ZINC000433182035 514409852 /nfs/dbraw/zinc/40/98/52/514409852.db2.gz LSRWJNFIYNOUFI-HNNXBMFYSA-N 1 1 367.471 2.686 20 5 FFBDMO CCN1CCC([N@@H+]2CCCN(Cc3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000420980855 514419345 /nfs/dbraw/zinc/41/93/45/514419345.db2.gz MCEYHYKWJDZCTP-UHFFFAOYSA-N 1 1 360.502 2.895 20 5 FFBDMO CCN1CCC([N@H+]2CCCN(Cc3cccc([N+](=O)[O-])c3C)CC2)CC1 ZINC000420980855 514419349 /nfs/dbraw/zinc/41/93/49/514419349.db2.gz MCEYHYKWJDZCTP-UHFFFAOYSA-N 1 1 360.502 2.895 20 5 FFBDMO C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC(OC(C)(C)C)C1 ZINC000420997620 514430431 /nfs/dbraw/zinc/43/04/31/514430431.db2.gz ACXPAYQUMHXREH-SHARSMKWSA-N 1 1 352.431 2.612 20 5 FFBDMO C[C@@H]1CC2(CN1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC[NH2+]CC2 ZINC000424286660 514447428 /nfs/dbraw/zinc/44/74/28/514447428.db2.gz HQNPXZGEEFMGME-GFCCVEGCSA-N 1 1 366.849 2.651 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000475105393 514560324 /nfs/dbraw/zinc/56/03/24/514560324.db2.gz CCNQGFHDTFXGRP-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+](C)[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000475105393 514560327 /nfs/dbraw/zinc/56/03/27/514560327.db2.gz CCNQGFHDTFXGRP-ZDUSSCGKSA-N 1 1 359.382 2.735 20 5 FFBDMO C[C@@H]1C[N@H+](C2CCN(c3nccc4c3cccc4[N+](=O)[O-])CC2)CCO1 ZINC000450262628 514571234 /nfs/dbraw/zinc/57/12/34/514571234.db2.gz TXFAAPIBUHNOTE-CQSZACIVSA-N 1 1 356.426 2.833 20 5 FFBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1ncccn1 ZINC000470822257 514628492 /nfs/dbraw/zinc/62/84/92/514628492.db2.gz QHMKBXQOYMJJDN-ZVZYQTTQSA-N 1 1 373.432 2.990 20 5 FFBDMO C[C@H]1C[C@@H]1[N@H+]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2C)C[C@@H](C)C1 ZINC000453428745 514632643 /nfs/dbraw/zinc/63/26/43/514632643.db2.gz QMHSUGIWXHGTDG-ZQIUZPCESA-N 1 1 370.457 2.557 20 5 FFBDMO CCC[N@@H+](CC)C[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])c2cccnc12 ZINC000461544931 514651400 /nfs/dbraw/zinc/65/14/00/514651400.db2.gz RKRNHUAPUBYZMP-AWEZNQCLSA-N 1 1 374.441 2.758 20 5 FFBDMO CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000475546129 514711783 /nfs/dbraw/zinc/71/17/83/514711783.db2.gz GDPIUYZEDHPUPJ-KRWDZBQOSA-N 1 1 368.437 2.740 20 5 FFBDMO COC(=O)COc1ccc(C[N@@H+]2CCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000475578741 514720357 /nfs/dbraw/zinc/72/03/57/514720357.db2.gz CJKPCKBISJMOFD-INIZCTEOSA-N 1 1 373.409 2.822 20 5 FFBDMO COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000475578741 514720368 /nfs/dbraw/zinc/72/03/68/514720368.db2.gz CJKPCKBISJMOFD-INIZCTEOSA-N 1 1 373.409 2.822 20 5 FFBDMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000508763564 514888181 /nfs/dbraw/zinc/88/81/81/514888181.db2.gz IDRZQGIRUWMXME-OWCLPIDISA-N 1 1 362.474 2.879 20 5 FFBDMO C[C@@H](CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[N@@H+](C)Cc1ccccc1 ZINC000471463583 514895908 /nfs/dbraw/zinc/89/59/08/514895908.db2.gz ZDCGURAFQNWTJR-HNNXBMFYSA-N 1 1 373.457 2.553 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](S(C)(=O)=O)CC1 ZINC000503074083 514908160 /nfs/dbraw/zinc/90/81/60/514908160.db2.gz KBPNVHAVFOKBNB-GWKQRERASA-N 1 1 352.456 2.897 20 5 FFBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](S(C)(=O)=O)CC1 ZINC000503074083 514908168 /nfs/dbraw/zinc/90/81/68/514908168.db2.gz KBPNVHAVFOKBNB-GWKQRERASA-N 1 1 352.456 2.897 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000458645592 514985333 /nfs/dbraw/zinc/98/53/33/514985333.db2.gz XPLOMMGFAGOTSG-OAHLLOKOSA-N 1 1 368.865 2.915 20 5 FFBDMO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1OC(F)F)[NH+]1CCOCC1 ZINC000509040532 514997668 /nfs/dbraw/zinc/99/76/68/514997668.db2.gz OITTYCBFQVVQCE-CQSZACIVSA-N 1 1 359.373 2.965 20 5 FFBDMO Cc1c(Br)c(N[C@H]2CCn3cc[nH+]c3C2)ncc1[N+](=O)[O-] ZINC000489914300 515030440 /nfs/dbraw/zinc/03/04/40/515030440.db2.gz IYMNXKBQVIVGRY-VIFPVBQESA-N 1 1 352.192 2.684 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)[C@@H](C)C1 ZINC000485418757 515033907 /nfs/dbraw/zinc/03/39/07/515033907.db2.gz VQTYRDPKGVYNPA-KBPBESRZSA-N 1 1 374.416 2.687 20 5 FFBDMO CCC[N@H+]1CC[C@@H](CNc2cc(CN3CCOCC3)ccc2[N+](=O)[O-])C1 ZINC000472345129 515236355 /nfs/dbraw/zinc/23/63/55/515236355.db2.gz VJIMWFQAASOZAI-KRWDZBQOSA-N 1 1 362.474 2.571 20 5 FFBDMO CCN(CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000472440710 515271848 /nfs/dbraw/zinc/27/18/48/515271848.db2.gz RXUJBCSFGWFXKA-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000472440710 515271861 /nfs/dbraw/zinc/27/18/61/515271861.db2.gz RXUJBCSFGWFXKA-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000472440710 515271871 /nfs/dbraw/zinc/27/18/71/515271871.db2.gz RXUJBCSFGWFXKA-WMZOPIPTSA-N 1 1 357.458 2.949 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1OCC[N@H+](CC)[C@H]1c1ccccc1 ZINC000490722372 515291802 /nfs/dbraw/zinc/29/18/02/515291802.db2.gz LYEHMSVGIMEYFF-WMZOPIPTSA-N 1 1 373.457 2.994 20 5 FFBDMO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1OCC[N@@H+](CC)[C@H]1c1ccccc1 ZINC000490722372 515291809 /nfs/dbraw/zinc/29/18/09/515291809.db2.gz LYEHMSVGIMEYFF-WMZOPIPTSA-N 1 1 373.457 2.994 20 5 FFBDMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000463135236 515378137 /nfs/dbraw/zinc/37/81/37/515378137.db2.gz WBYQMCCWWMJFQQ-VXGBXAGGSA-N 1 1 357.332 2.970 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[NH+](C2CCC2)CC1 ZINC000499622310 515390582 /nfs/dbraw/zinc/39/05/82/515390582.db2.gz OMUIQLWYFAJQGG-LBPRGKRZSA-N 1 1 367.833 2.712 20 5 FFBDMO C[C@]1(c2ccccc2)CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1 ZINC000510089588 515431120 /nfs/dbraw/zinc/43/11/20/515431120.db2.gz WXABREHIBCKDLP-OALUTQOASA-N 1 1 358.442 2.596 20 5 FFBDMO CC(C)C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000486439927 515482841 /nfs/dbraw/zinc/48/28/41/515482841.db2.gz VIMMPLXQXQANTL-ZDUSSCGKSA-N 1 1 359.373 2.965 20 5 FFBDMO COc1cccc(OCC[NH+]2CCN(c3ncc(C)cc3[N+](=O)[O-])CC2)c1 ZINC000481847552 515486748 /nfs/dbraw/zinc/48/67/48/515486748.db2.gz VAJKJEUHBFAFPL-UHFFFAOYSA-N 1 1 372.425 2.508 20 5 FFBDMO CC(C)OC1CC([N@H+]2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)C1 ZINC000459397917 515523927 /nfs/dbraw/zinc/52/39/27/515523927.db2.gz IAARUFDJJONYQF-UHFFFAOYSA-N 1 1 373.457 2.939 20 5 FFBDMO CCOC(=O)c1cc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)ccc1[N+](=O)[O-] ZINC000481973131 515534205 /nfs/dbraw/zinc/53/42/05/515534205.db2.gz YXRQLOUXVKEZHA-AWEZNQCLSA-N 1 1 372.425 2.964 20 5 FFBDMO CCc1ccc([C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3OC)CC[NH2+]2)cc1 ZINC000505492284 515554943 /nfs/dbraw/zinc/55/49/43/515554943.db2.gz YEOXDZQOLXGMBV-QGZVFWFLSA-N 1 1 369.421 2.953 20 5 FFBDMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000486666928 515587857 /nfs/dbraw/zinc/58/78/57/515587857.db2.gz SKYFEXRPBQAGHR-ZDUSSCGKSA-N 1 1 369.412 2.900 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+]1CCCC[C@H]1CC ZINC000500110937 515594595 /nfs/dbraw/zinc/59/45/95/515594595.db2.gz LOOWREPLHNXWPM-OAHLLOKOSA-N 1 1 369.487 2.700 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+]1CCCC[C@@H]1CC ZINC000500110935 515595783 /nfs/dbraw/zinc/59/57/83/515595783.db2.gz LOOWREPLHNXWPM-HNNXBMFYSA-N 1 1 369.487 2.700 20 5 FFBDMO CCOc1cc(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000500122868 515599955 /nfs/dbraw/zinc/59/99/55/515599955.db2.gz QAYBRNPHBFVTLU-OLZOCXBDSA-N 1 1 365.430 2.557 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)n[nH]2)C1 ZINC000457090284 515640710 /nfs/dbraw/zinc/64/07/10/515640710.db2.gz LXPWSOODHUSGTN-OAHLLOKOSA-N 1 1 357.414 2.540 20 5 FFBDMO CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000457090284 515640719 /nfs/dbraw/zinc/64/07/19/515640719.db2.gz LXPWSOODHUSGTN-OAHLLOKOSA-N 1 1 357.414 2.540 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1 ZINC000457090284 515640728 /nfs/dbraw/zinc/64/07/28/515640728.db2.gz LXPWSOODHUSGTN-OAHLLOKOSA-N 1 1 357.414 2.540 20 5 FFBDMO C[NH+](C)Cc1ccc(NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1Cl ZINC000478038992 515678201 /nfs/dbraw/zinc/67/82/01/515678201.db2.gz GJJSYLPVFZWNHT-UHFFFAOYSA-N 1 1 351.794 2.535 20 5 FFBDMO CCOc1cc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])cc1OC ZINC000457135113 515679033 /nfs/dbraw/zinc/67/90/33/515679033.db2.gz VZOIJTNUSJTHPC-ZDUSSCGKSA-N 1 1 365.430 2.557 20 5 FFBDMO O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1[C@@H]1C[C@H]1c1ccccc1 ZINC000478255365 515755024 /nfs/dbraw/zinc/75/50/24/515755024.db2.gz OICYGHRRVWAOSP-VDZJLULYSA-N 1 1 369.396 2.981 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ncc(C(=O)OC)cc1[N+](=O)[O-] ZINC000478260053 515756706 /nfs/dbraw/zinc/75/67/06/515756706.db2.gz QNUZCTSPVKTNGR-CQSZACIVSA-N 1 1 350.419 2.843 20 5 FFBDMO COC(=O)c1cccc(OCC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511073210 515766607 /nfs/dbraw/zinc/76/66/07/515766607.db2.gz IXBCGQHXBKPTRN-UHFFFAOYSA-N 1 1 358.394 2.935 20 5 FFBDMO CO[C@@H]1C[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C12CCC2 ZINC000459730605 515776427 /nfs/dbraw/zinc/77/64/27/515776427.db2.gz DYHFFCNYEURXOC-BBWFWOEESA-N 1 1 356.426 2.965 20 5 FFBDMO COc1ccc(OCC[N@@H+](CCO)Cc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000494253247 515784868 /nfs/dbraw/zinc/78/48/68/515784868.db2.gz GJEFRWWGULUJJG-UHFFFAOYSA-N 1 1 364.373 2.616 20 5 FFBDMO CCN(C)C(=O)[C@@H](C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000473998097 515836842 /nfs/dbraw/zinc/83/68/42/515836842.db2.gz ZTXXEKXDCKLOOF-GFCCVEGCSA-N 1 1 361.398 2.820 20 5 FFBDMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])n1C ZINC000469508708 515845774 /nfs/dbraw/zinc/84/57/74/515845774.db2.gz OSEYIXGCGREOMR-INIZCTEOSA-N 1 1 358.442 2.820 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@H+]1CCc2ccccc2C1 ZINC000494606962 515895167 /nfs/dbraw/zinc/89/51/67/515895167.db2.gz CYZACJQFIXLXNX-CQSZACIVSA-N 1 1 369.421 2.780 20 5 FFBDMO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2CO)ncc1[N+](=O)[O-] ZINC000474152232 515908243 /nfs/dbraw/zinc/90/82/43/515908243.db2.gz TZWLQGASRSYUCW-DLBZAZTESA-N 1 1 356.426 2.593 20 5 FFBDMO Cn1cnc([N+](=O)[O-])c1N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000474168362 515914189 /nfs/dbraw/zinc/91/41/89/515914189.db2.gz JPHKWWLBTNWWOC-IBGZPJMESA-N 1 1 355.442 2.821 20 5 FFBDMO CCOC(=O)CC(C)(C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500986719 515929390 /nfs/dbraw/zinc/92/93/90/515929390.db2.gz YWYFQJGNDDOSFI-UHFFFAOYSA-N 1 1 351.403 2.587 20 5 FFBDMO CC[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1 ZINC000483168862 515966185 /nfs/dbraw/zinc/96/61/85/515966185.db2.gz NHVPDLSXSDLTAS-SJLPKXTDSA-N 1 1 350.415 2.634 20 5 FFBDMO CO[C@@]1(C)C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1(C)C ZINC000464820541 515972102 /nfs/dbraw/zinc/97/21/02/515972102.db2.gz FQBZTXYZDQUHEH-APWZRJJASA-N 1 1 361.442 2.619 20 5 FFBDMO C[C@@H](CNC(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[N@@H+](C)C1CC1 ZINC000494877565 515994971 /nfs/dbraw/zinc/99/49/71/515994971.db2.gz IFRCMLQRDKFDHS-JTQLQIEISA-N 1 1 374.363 2.896 20 5 FFBDMO C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000495083531 516059311 /nfs/dbraw/zinc/05/93/11/516059311.db2.gz COKBLEBRPOARMB-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 ZINC000495083531 516059316 /nfs/dbraw/zinc/05/93/16/516059316.db2.gz COKBLEBRPOARMB-HNNXBMFYSA-N 1 1 368.437 2.983 20 5 FFBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000501450763 516109147 /nfs/dbraw/zinc/10/91/47/516109147.db2.gz XFZSNUSJUBUSDO-CABCVRRESA-N 1 1 358.442 2.786 20 5 FFBDMO C[N@H+]1CCCC[C@H]1CN1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000488082122 516109310 /nfs/dbraw/zinc/10/93/10/516109310.db2.gz CTOYTRGXCKCBCN-INIZCTEOSA-N 1 1 369.469 2.749 20 5 FFBDMO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000470152524 516147372 /nfs/dbraw/zinc/14/73/72/516147372.db2.gz NJMZDIUJHQDUSU-DFHBCGBQSA-N 1 1 355.394 2.941 20 5 FFBDMO Cc1c(CNC(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)cccc1[N+](=O)[O-] ZINC000479325372 516150302 /nfs/dbraw/zinc/15/03/02/516150302.db2.gz SQTHZVHFRLBKDS-QGZVFWFLSA-N 1 1 360.458 2.967 20 5 FFBDMO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285501 516156804 /nfs/dbraw/zinc/15/68/04/516156804.db2.gz VDXAAVBWHNIRGJ-LIRRHRJNSA-N 1 1 369.421 2.941 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1 ZINC000507285501 516156812 /nfs/dbraw/zinc/15/68/12/516156812.db2.gz VDXAAVBWHNIRGJ-LIRRHRJNSA-N 1 1 369.421 2.941 20 5 FFBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2ncc(F)cn2)CC1 ZINC000470209042 516172893 /nfs/dbraw/zinc/17/28/93/516172893.db2.gz WYRPOOAXNMNUBI-ZROIWOOFSA-N 1 1 357.389 2.749 20 5 FFBDMO Cc1cccc(CN(CC[NH+](C)C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)c1 ZINC000507323254 516173159 /nfs/dbraw/zinc/17/31/59/516173159.db2.gz HEIDFVIZFOLHTD-UHFFFAOYSA-N 1 1 357.410 2.813 20 5 FFBDMO Cc1cc(C)c(S(N)(=O)=O)cc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000479398067 516180304 /nfs/dbraw/zinc/18/03/04/516180304.db2.gz YLPZZXWRMWLGDW-CYBMUJFWSA-N 1 1 363.439 2.710 20 5 FFBDMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000512415016 516270485 /nfs/dbraw/zinc/27/04/85/516270485.db2.gz IWDGVCZTXHPKFH-UHFFFAOYSA-N 1 1 353.422 2.870 20 5 FFBDMO C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1 ZINC000497402521 516319924 /nfs/dbraw/zinc/31/99/24/516319924.db2.gz UOBZKZQLIIBBQW-DOTOQJQBSA-N 1 1 364.405 2.904 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](COC(F)F)C3)n2)c1 ZINC000512811831 516369586 /nfs/dbraw/zinc/36/95/86/516369586.db2.gz LTHBXOLXXNEJNK-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](COC(F)F)C3)n2)c1 ZINC000512811831 516369597 /nfs/dbraw/zinc/36/95/97/516369597.db2.gz LTHBXOLXXNEJNK-JTQLQIEISA-N 1 1 354.313 2.706 20 5 FFBDMO COc1ccc(CC(=O)N2CC[N@@H+](C)CC23CCCCC3)cc1[N+](=O)[O-] ZINC000531389914 516445023 /nfs/dbraw/zinc/44/50/23/516445023.db2.gz XGFVDGOHGABJDJ-UHFFFAOYSA-N 1 1 361.442 2.623 20 5 FFBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000523354779 516447937 /nfs/dbraw/zinc/44/79/37/516447937.db2.gz IXEYQYFSBJUTSA-ZDUSSCGKSA-N 1 1 352.410 2.701 20 5 FFBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1 ZINC000535695189 516452504 /nfs/dbraw/zinc/45/25/04/516452504.db2.gz ZYHOSYGISKLYON-CQSZACIVSA-N 1 1 356.426 2.880 20 5 FFBDMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Br)C1 ZINC000523532476 516499236 /nfs/dbraw/zinc/49/92/36/516499236.db2.gz NYITXQWEYIYDDY-LLVKDONJSA-N 1 1 370.247 2.817 20 5 FFBDMO COc1ccc(NC(=O)[C@H]2CCC[N@@H+](Cc3cccnc3)C2)cc1[N+](=O)[O-] ZINC000543926665 516499765 /nfs/dbraw/zinc/49/97/65/516499765.db2.gz OOENRKRYPYCDPY-HNNXBMFYSA-N 1 1 370.409 2.849 20 5 FFBDMO COc1ccccc1C[C@@H](C)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000544147272 516614518 /nfs/dbraw/zinc/61/45/18/516614518.db2.gz YSRSHCDXRVZLEY-NVXWUHKLSA-N 1 1 374.437 2.906 20 5 FFBDMO Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000558596187 516828031 /nfs/dbraw/zinc/82/80/31/516828031.db2.gz JEGNBSLDVVCTBW-SJORKVTESA-N 1 1 368.437 2.527 20 5 FFBDMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541064562 516854569 /nfs/dbraw/zinc/85/45/69/516854569.db2.gz KKWQIERATZCHMO-TZMCWYRMSA-N 1 1 369.849 2.611 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)C[C@H]1C ZINC000544655994 516857231 /nfs/dbraw/zinc/85/72/31/516857231.db2.gz VGEJWRDABHVNSO-HIFRSBDPSA-N 1 1 369.487 2.705 20 5 FFBDMO Cn1ccnc1[C@H](N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000514098397 516861872 /nfs/dbraw/zinc/86/18/72/516861872.db2.gz GOWHRWNYJABYSY-LZLYRXPVSA-N 1 1 355.442 2.634 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000551781663 516867117 /nfs/dbraw/zinc/86/71/17/516867117.db2.gz IIKPTUFBXVINIY-IBGZPJMESA-N 1 1 353.422 2.902 20 5 FFBDMO Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](Cc3ccccc3)C2)cc([N+](=O)[O-])c1 ZINC000551781663 516867121 /nfs/dbraw/zinc/86/71/21/516867121.db2.gz IIKPTUFBXVINIY-IBGZPJMESA-N 1 1 353.422 2.902 20 5 FFBDMO COc1ccc(NC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000541106688 516879933 /nfs/dbraw/zinc/87/99/33/516879933.db2.gz UPAHZQKNWVBKJU-OLZOCXBDSA-N 1 1 350.419 2.845 20 5 FFBDMO C[C@H](O)C[N@H+]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000551821240 516890456 /nfs/dbraw/zinc/89/04/56/516890456.db2.gz JCEGMQHFOXBBRM-GJZGRUSLSA-N 1 1 359.426 2.742 20 5 FFBDMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000514225790 516912910 /nfs/dbraw/zinc/91/29/10/516912910.db2.gz DTPAVOAUVFGVIT-JTQLQIEISA-N 1 1 368.340 2.767 20 5 FFBDMO O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000514498712 516933960 /nfs/dbraw/zinc/93/39/60/516933960.db2.gz YTKXMOUMVLCQQO-GOSISDBHSA-N 1 1 353.422 2.918 20 5 FFBDMO COC(=O)c1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C)c([N+](=O)[O-])c1 ZINC000514752254 517037806 /nfs/dbraw/zinc/03/78/06/517037806.db2.gz QGEJOVSOYGFIOQ-CJNGLKHVSA-N 1 1 370.409 2.851 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])C1 ZINC000552039271 517044636 /nfs/dbraw/zinc/04/46/36/517044636.db2.gz YYSNEEOLRXUCIC-OAHLLOKOSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1CCCN(c2ccc(C(=O)N3CC[N@@H+](C)C(C)(C)C3)cc2[N+](=O)[O-])C1 ZINC000552039271 517044642 /nfs/dbraw/zinc/04/46/42/517044642.db2.gz YYSNEEOLRXUCIC-OAHLLOKOSA-N 1 1 374.485 2.997 20 5 FFBDMO CC1=CC[N@@H+](CCNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC1 ZINC000545162488 517081981 /nfs/dbraw/zinc/08/19/81/517081981.db2.gz HZSPKCCMLDRIFK-UHFFFAOYSA-N 1 1 355.341 2.578 20 5 FFBDMO CCc1ccc([C@@H]([NH2+]CCNC(=O)C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545492 517106878 /nfs/dbraw/zinc/10/68/78/517106878.db2.gz IARIKNJJMIAJMG-SFHVURJKSA-N 1 1 357.410 2.955 20 5 FFBDMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000545228458 517117689 /nfs/dbraw/zinc/11/76/89/517117689.db2.gz ZSGQSROALBUDHZ-LBPRGKRZSA-N 1 1 354.838 2.778 20 5 FFBDMO O=[N+]([O-])c1cccc2ncnc(NCCC[N@H+]3CCc4ccccc4C3)c21 ZINC000541578469 517122488 /nfs/dbraw/zinc/12/24/88/517122488.db2.gz NXPLFSQRSWPDID-UHFFFAOYSA-N 1 1 363.421 2.820 20 5 FFBDMO COCCCOC1CC[NH+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 ZINC000537617726 517262486 /nfs/dbraw/zinc/26/24/86/517262486.db2.gz YQESUDHSCOLVOI-UHFFFAOYSA-N 1 1 368.430 2.630 20 5 FFBDMO CCc1nn(C)c(N2CC[NH+](C/C=C\c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000537658728 517283668 /nfs/dbraw/zinc/28/36/68/517283668.db2.gz LMEPCTKCRICHKM-YFHOEESVSA-N 1 1 355.442 2.726 20 5 FFBDMO Cc1c(CC(=O)Nc2cccc(C[N@H+]3CC[C@H](O)C3)c2)cccc1[N+](=O)[O-] ZINC000552518253 517292801 /nfs/dbraw/zinc/29/28/01/517292801.db2.gz XRFYAHLLARCDMM-SFHVURJKSA-N 1 1 369.421 2.651 20 5 FFBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000541924621 517294382 /nfs/dbraw/zinc/29/43/82/517294382.db2.gz HYRXRJHSJBMNJW-GJZGRUSLSA-N 1 1 369.425 2.538 20 5 FFBDMO C[N@@H+](CCC(=O)Nc1ccc2c(c1)OCO2)CCc1cccc([N+](=O)[O-])c1 ZINC000548934234 517313290 /nfs/dbraw/zinc/31/32/90/517313290.db2.gz XHEIQNNWTXGDES-UHFFFAOYSA-N 1 1 371.393 2.827 20 5 FFBDMO Cc1nc(N2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)sc1C ZINC000533149083 517317603 /nfs/dbraw/zinc/31/76/03/517317603.db2.gz ZZVPKVDOCNYTMV-UHFFFAOYSA-N 1 1 362.455 2.869 20 5 FFBDMO COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H]1C ZINC000520274585 517326783 /nfs/dbraw/zinc/32/67/83/517326783.db2.gz MRKPMEXVRJFTEY-KSSFIOAISA-N 1 1 369.421 2.996 20 5 FFBDMO Cc1cccc(NCCCN2CCN(c3cc[nH+]cc3)CC2)c1[N+](=O)[O-] ZINC000549121928 517409977 /nfs/dbraw/zinc/40/99/77/517409977.db2.gz MTWPBLSHECQPHL-UHFFFAOYSA-N 1 1 355.442 2.922 20 5 FFBDMO CCC[N@H+]1CCC[C@H]1CNc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] ZINC000515686956 517447748 /nfs/dbraw/zinc/44/77/48/517447748.db2.gz VFZOOICOXXWIEU-HNNXBMFYSA-N 1 1 371.441 2.846 20 5 FFBDMO COc1ccc([C@@H](C)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1Br ZINC000538167229 517490143 /nfs/dbraw/zinc/49/01/43/517490143.db2.gz IUBVSTBEMUSCLJ-SECBINFHSA-N 1 1 369.219 2.950 20 5 FFBDMO C[C@H]([NH2+]CC(=O)N1CCC(c2ccccc2)=N1)c1cccc([N+](=O)[O-])c1 ZINC000538176824 517493874 /nfs/dbraw/zinc/49/38/74/517493874.db2.gz NMGUQLKJRAVVAA-AWEZNQCLSA-N 1 1 352.394 2.882 20 5 FFBDMO Cc1cc(NC(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-] ZINC000546036103 517504798 /nfs/dbraw/zinc/50/47/98/517504798.db2.gz YGSLIDRAXMOMRA-WBVHZDCISA-N 1 1 362.430 2.668 20 5 FFBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000515915051 517511404 /nfs/dbraw/zinc/51/14/04/517511404.db2.gz NTGLBXPOVQYNGM-CQSZACIVSA-N 1 1 366.437 2.857 20 5 FFBDMO COC[C@@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccc(F)cc1 ZINC000538275745 517537428 /nfs/dbraw/zinc/53/74/28/517537428.db2.gz JNCYVABZSGJPRA-QGZVFWFLSA-N 1 1 373.384 2.600 20 5 FFBDMO O=C(Cn1c[nH+]c2c1CCCC2)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000542707847 517697649 /nfs/dbraw/zinc/69/76/49/517697649.db2.gz IMFGEAKAOIEBNY-UHFFFAOYSA-N 1 1 356.426 2.809 20 5 FFBDMO C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@H](C)O1 ZINC000549784501 517707037 /nfs/dbraw/zinc/70/70/37/517707037.db2.gz CABLXUZKSXBJMT-QLFBSQMISA-N 1 1 360.410 2.597 20 5 FFBDMO C[C@@H]1C[N@H+](C[C@@H](O)COc2ccc([N+](=O)[O-])c3ccccc23)C[C@H](C)O1 ZINC000549784501 517707046 /nfs/dbraw/zinc/70/70/46/517707046.db2.gz CABLXUZKSXBJMT-QLFBSQMISA-N 1 1 360.410 2.597 20 5 FFBDMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1c[nH+]ccc1-n1cccn1 ZINC000534021515 517712949 /nfs/dbraw/zinc/71/29/49/517712949.db2.gz YUUYWGCDONPEGI-UHFFFAOYSA-N 1 1 362.349 2.838 20 5 FFBDMO C[C@@H]1CCC[N@@H+](CCNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000546578801 517736774 /nfs/dbraw/zinc/73/67/74/517736774.db2.gz VIQPFVYITUXWNJ-CYBMUJFWSA-N 1 1 351.422 2.860 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2CO)cc1OC ZINC000542916531 517815253 /nfs/dbraw/zinc/81/52/53/517815253.db2.gz XNVYETBKFRGALE-UKRRQHHQSA-N 1 1 352.431 2.985 20 5 FFBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2CO)cc1OC ZINC000542916531 517815259 /nfs/dbraw/zinc/81/52/59/517815259.db2.gz XNVYETBKFRGALE-UKRRQHHQSA-N 1 1 352.431 2.985 20 5 FFBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H]2NC(=O)C2(C)C)CC1 ZINC000563363938 517850150 /nfs/dbraw/zinc/85/01/50/517850150.db2.gz NLWJDAYTDDEESB-QGZVFWFLSA-N 1 1 361.442 2.730 20 5 FFBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])C1 ZINC000546801184 517864381 /nfs/dbraw/zinc/86/43/81/517864381.db2.gz BYUXXTADPYHLQU-ZNMIVQPWSA-N 1 1 367.471 2.621 20 5 FFBDMO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(S(N)(=O)=O)c1 ZINC000543059971 517888115 /nfs/dbraw/zinc/88/81/15/517888115.db2.gz OTAPAYWMRCDIOE-ZDUSSCGKSA-N 1 1 355.441 2.545 20 5 FFBDMO CN(C)CC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000546899233 517912390 /nfs/dbraw/zinc/91/23/90/517912390.db2.gz LNOLTWQULGVQRG-UHFFFAOYSA-N 1 1 358.389 2.634 20 5 FFBDMO C[C@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-] ZINC000543136554 517926850 /nfs/dbraw/zinc/92/68/50/517926850.db2.gz HNVZZXQKYIOJIL-IIMJZQEZSA-N 1 1 372.421 2.659 20 5 FFBDMO CCOc1cc(NC(=O)NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OCC ZINC000517115011 518031147 /nfs/dbraw/zinc/03/11/47/518031147.db2.gz ILDUOZCSBURRSB-LBPRGKRZSA-N 1 1 366.418 2.608 20 5 FFBDMO COC(=O)c1cc(C)nc(NCCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000557492706 518035439 /nfs/dbraw/zinc/03/54/39/518035439.db2.gz SHLROMKAOSLWDY-CQSZACIVSA-N 1 1 364.446 2.573 20 5 FFBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000534797003 518036180 /nfs/dbraw/zinc/03/61/80/518036180.db2.gz IWCBICILMYULKM-JKSUJKDBSA-N 1 1 357.410 2.651 20 5 FFBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C[NH+]2CCN(C)CC2)cc1 ZINC000522270909 518058884 /nfs/dbraw/zinc/05/88/84/518058884.db2.gz PDNMPPPWPSZHNH-UHFFFAOYSA-N 1 1 368.437 2.903 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557537026 518061742 /nfs/dbraw/zinc/06/17/42/518061742.db2.gz KXPRUUWQWLZFEQ-HZPDHXFCSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000557537026 518061753 /nfs/dbraw/zinc/06/17/53/518061753.db2.gz KXPRUUWQWLZFEQ-HZPDHXFCSA-N 1 1 374.485 2.997 20 5 FFBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)CCS3(=O)=O)c(Cl)c1 ZINC000543414813 518077427 /nfs/dbraw/zinc/07/74/27/518077427.db2.gz OYGPLPWQEHUVGD-UHFFFAOYSA-N 1 1 366.826 2.868 20 5 FFBDMO COc1cccc([C@H]2[C@@H](Nc3c([N+](=O)[O-])ncn3C)CC[N@H+]2C2CC2)c1 ZINC000539773762 518158405 /nfs/dbraw/zinc/15/84/05/518158405.db2.gz FQQHDPKXLWZVBG-HOTGVXAUSA-N 1 1 357.414 2.727 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[N@@H+]1CCOC(C)(C)C1 ZINC000575628659 518240973 /nfs/dbraw/zinc/24/09/73/518240973.db2.gz QOAZTRLESHGDCF-UHFFFAOYSA-N 1 1 364.446 2.732 20 5 FFBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[N@H+]1CCOC(C)(C)C1 ZINC000575628659 518240978 /nfs/dbraw/zinc/24/09/78/518240978.db2.gz QOAZTRLESHGDCF-UHFFFAOYSA-N 1 1 364.446 2.732 20 5 FFBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])cc1 ZINC000572627298 518283059 /nfs/dbraw/zinc/28/30/59/518283059.db2.gz DTLCFDLJOKQYHO-ZDUSSCGKSA-N 1 1 357.414 2.622 20 5 FFBDMO C[C@@]1(NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000581436305 518284677 /nfs/dbraw/zinc/28/46/77/518284677.db2.gz YGGDNNYVJSARLX-HXUWFJFHSA-N 1 1 368.437 2.788 20 5 FFBDMO Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)c3cc([N+](=O)[O-])c[nH]3)C2)s1 ZINC000584372674 518307702 /nfs/dbraw/zinc/30/77/02/518307702.db2.gz GIEQXMFBDUEKGH-CYBMUJFWSA-N 1 1 362.455 2.887 20 5 FFBDMO C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@@H](C)C1 ZINC000584547546 518393827 /nfs/dbraw/zinc/39/38/27/518393827.db2.gz HGLQJOMBIQMINR-JKDFXYPNSA-N 1 1 367.396 2.604 20 5 FFBDMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000572872379 518402030 /nfs/dbraw/zinc/40/20/30/518402030.db2.gz WCEGNYPLHFVHCG-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000572872379 518402036 /nfs/dbraw/zinc/40/20/36/518402036.db2.gz WCEGNYPLHFVHCG-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@H](C(=O)N[C@@H]1C[N@@H+](C)C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000573158582 518531229 /nfs/dbraw/zinc/53/12/29/518531229.db2.gz DTYWGWKNYPLSDT-GDIGMMSISA-N 1 1 353.422 2.912 20 5 FFBDMO CN1CCC(CCO)([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000576412875 518581468 /nfs/dbraw/zinc/58/14/68/518581468.db2.gz SYDQMWJKLKCQOQ-UHFFFAOYSA-N 1 1 359.426 2.791 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000585764654 518589513 /nfs/dbraw/zinc/58/95/13/518589513.db2.gz CWJPJRYSNCCIAL-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1 ZINC000585764654 518589520 /nfs/dbraw/zinc/58/95/20/518589520.db2.gz CWJPJRYSNCCIAL-QGZVFWFLSA-N 1 1 369.421 2.602 20 5 FFBDMO CN(C(=O)c1cnn(-c2cc[nH+]cc2)c1C(F)F)c1ccc([N+](=O)[O-])nc1 ZINC000582204916 518637347 /nfs/dbraw/zinc/63/73/47/518637347.db2.gz PJKMRDQMMZVUNX-UHFFFAOYSA-N 1 1 374.307 2.785 20 5 FFBDMO O=C(CC[NH2+]Cc1nccc(C(F)(F)F)n1)Nc1ccccc1[N+](=O)[O-] ZINC000567693422 518658480 /nfs/dbraw/zinc/65/84/80/518658480.db2.gz RRTQDGJQNGSIOP-UHFFFAOYSA-N 1 1 369.303 2.522 20 5 FFBDMO CCc1ccc(S(=O)(=O)N(C)[C@H]2CC[N@H+](CC)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000567771052 518702230 /nfs/dbraw/zinc/70/22/30/518702230.db2.gz OCRJMEHEABPQPG-HIFRSBDPSA-N 1 1 369.487 2.651 20 5 FFBDMO Cn1c2ccc(Nc3nccc(C(N)=O)c3[N+](=O)[O-])cc2[nH+]c1C1CC1 ZINC000570737899 518755790 /nfs/dbraw/zinc/75/57/90/518755790.db2.gz OPBQMCDFBCOTSO-UHFFFAOYSA-N 1 1 352.354 2.596 20 5 FFBDMO C[C@H]1CCCC[N@H+]1CCC(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000573752786 518818306 /nfs/dbraw/zinc/81/83/06/518818306.db2.gz ODEYWGPYLNZTRX-AWEZNQCLSA-N 1 1 358.442 2.999 20 5 FFBDMO C[C@@H](O)C[C@@H]1CCCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000573889414 518882686 /nfs/dbraw/zinc/88/26/86/518882686.db2.gz NKFMSPYWPOVYMF-KGLIPLIRSA-N 1 1 363.414 2.518 20 5 FFBDMO CN1CCC[N@@H+](CCCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309949 518893454 /nfs/dbraw/zinc/89/34/54/518893454.db2.gz PYTBIBVESZEQTC-INIZCTEOSA-N 1 1 374.407 2.815 20 5 FFBDMO C[N@@H+]1CCCN(CCCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309949 518893462 /nfs/dbraw/zinc/89/34/62/518893462.db2.gz PYTBIBVESZEQTC-INIZCTEOSA-N 1 1 374.407 2.815 20 5 FFBDMO C[N@H+]1CCCN(CCCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000565309949 518893468 /nfs/dbraw/zinc/89/34/68/518893468.db2.gz PYTBIBVESZEQTC-INIZCTEOSA-N 1 1 374.407 2.815 20 5 FFBDMO CC(C)[N@@H+](C)C[C@@H](C)Nc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F ZINC000565371742 518923669 /nfs/dbraw/zinc/92/36/69/518923669.db2.gz IUOMBCUYMYXKAU-CYBMUJFWSA-N 1 1 354.426 2.711 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000589510573 519022449 /nfs/dbraw/zinc/02/24/49/519022449.db2.gz LAJLCVKIIFUIFP-OAHLLOKOSA-N 1 1 355.394 2.841 20 5 FFBDMO C[C@H](C(=O)NCC[N@H+]1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000577340004 519028781 /nfs/dbraw/zinc/02/87/81/519028781.db2.gz DLJHSVPEQWMQNA-HNNXBMFYSA-N 1 1 353.422 2.873 20 5 FFBDMO Cc1[nH+]cc2n1C[C@@H](C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000574329645 519101422 /nfs/dbraw/zinc/10/14/22/519101422.db2.gz DWCNDCFYUYSDCT-INIZCTEOSA-N 1 1 356.426 2.801 20 5 FFBDMO CCCC[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000574335646 519106900 /nfs/dbraw/zinc/10/69/00/519106900.db2.gz ONJRBUBUAYKKEE-NSHDSACASA-N 1 1 363.867 2.647 20 5 FFBDMO CCC[N@@H+](CC)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000565742214 519108078 /nfs/dbraw/zinc/10/80/78/519108078.db2.gz APGPHQDZUHGLEZ-LLVKDONJSA-N 1 1 363.867 2.647 20 5 FFBDMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000577597249 519158888 /nfs/dbraw/zinc/15/88/88/519158888.db2.gz WFFCVRQBHNPYMQ-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000577597249 519158894 /nfs/dbraw/zinc/15/88/94/519158894.db2.gz WFFCVRQBHNPYMQ-GFCCVEGCSA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@@H+]1C[C@@H](C)N(C(=O)c2ccc(Br)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000568796166 519218624 /nfs/dbraw/zinc/21/86/24/519218624.db2.gz OSIJGCOYXDIOQQ-PHIMTYICSA-N 1 1 370.247 2.912 20 5 FFBDMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000590602693 519285270 /nfs/dbraw/zinc/28/52/70/519285270.db2.gz VTQMLTRXAQRLKZ-NVXWUHKLSA-N 1 1 357.410 2.609 20 5 FFBDMO CN1CCC([N@H+]2CC[C@H](Nc3nccc4c3cccc4[N+](=O)[O-])C2)CC1 ZINC000590690072 519318464 /nfs/dbraw/zinc/31/84/64/519318464.db2.gz MXOXQRMBHCKCEE-AWEZNQCLSA-N 1 1 355.442 2.723 20 5 FFBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000572022894 519403433 /nfs/dbraw/zinc/40/34/33/519403433.db2.gz ACAVIRGYTQTKEJ-GOSISDBHSA-N 1 1 357.410 2.775 20 5 FFBDMO O=C(NCc1c[nH+]c2n1CCCC2)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000572142974 519464500 /nfs/dbraw/zinc/46/45/00/519464500.db2.gz HGTUUPVQKZZCNG-UHFFFAOYSA-N 1 1 366.324 2.659 20 5 FFBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000566638468 519590066 /nfs/dbraw/zinc/59/00/66/519590066.db2.gz JJGYDRCRBYWJMJ-CYBMUJFWSA-N 1 1 363.414 2.708 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000599930533 519957112 /nfs/dbraw/zinc/95/71/12/519957112.db2.gz QCMIKESSQZMJTQ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2c(Br)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000599930533 519957122 /nfs/dbraw/zinc/95/71/22/519957122.db2.gz QCMIKESSQZMJTQ-JTQLQIEISA-N 1 1 356.220 2.524 20 5 FFBDMO C[C@@](CO)([NH2+]Cc1cncn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000602963743 519997265 /nfs/dbraw/zinc/99/72/65/519997265.db2.gz ZOHIRGZKTWMACB-FQEVSTJZSA-N 1 1 366.421 2.837 20 5 FFBDMO C[C@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594592746 520042905 /nfs/dbraw/zinc/04/29/05/520042905.db2.gz VJMZXDOOUXVGBV-MXWKQRLJSA-N 1 1 351.432 2.509 20 5 FFBDMO C[C@H](CNc1ncnc2sc([N+](=O)[O-])cc21)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594592746 520042910 /nfs/dbraw/zinc/04/29/10/520042910.db2.gz VJMZXDOOUXVGBV-MXWKQRLJSA-N 1 1 351.432 2.509 20 5 FFBDMO CCc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000594793933 520161121 /nfs/dbraw/zinc/16/11/21/520161121.db2.gz WPNGTOUOTVVYII-ZDUSSCGKSA-N 1 1 369.487 2.556 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)C2 ZINC000597709983 520189294 /nfs/dbraw/zinc/18/92/94/520189294.db2.gz FQCLIXFMUBGSCH-KRWDZBQOSA-N 1 1 369.368 2.754 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]c3ccc([N+](=O)[O-])cc13)C2 ZINC000597711584 520191952 /nfs/dbraw/zinc/19/19/52/520191952.db2.gz VHFCUAKZHPNQIC-IBGZPJMESA-N 1 1 356.426 2.563 20 5 FFBDMO C[N@H+]1CCCC[C@H](CNC(=O)c2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000600312374 520199354 /nfs/dbraw/zinc/19/93/54/520199354.db2.gz FXPQLCMTSOWNKD-LLVKDONJSA-N 1 1 370.247 2.819 20 5 FFBDMO COC(=O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131322 520207408 /nfs/dbraw/zinc/20/74/08/520207408.db2.gz XPRLLRDBHQKMON-WKILWMFISA-N 1 1 350.415 2.654 20 5 FFBDMO Cn1nccc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592133497 520210495 /nfs/dbraw/zinc/21/04/95/520210495.db2.gz WKCTWHGWOPJMQE-IYARVYRRSA-N 1 1 358.442 2.677 20 5 FFBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](CCO)c1ccccc1F ZINC000592162022 520237774 /nfs/dbraw/zinc/23/77/74/520237774.db2.gz UKMAPRKGXVDRNJ-INIZCTEOSA-N 1 1 361.373 2.694 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(=O)N(C)Cc1ccccc1 ZINC000595011475 520254049 /nfs/dbraw/zinc/25/40/49/520254049.db2.gz FLQUHBVVGUFUOS-AWEZNQCLSA-N 1 1 357.410 2.913 20 5 FFBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(S(C)(=O)=O)c1 ZINC000595042640 520266393 /nfs/dbraw/zinc/26/63/93/520266393.db2.gz UENRWCWVKDIANG-LBPRGKRZSA-N 1 1 364.423 2.858 20 5 FFBDMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)C1 ZINC000609357608 520295177 /nfs/dbraw/zinc/29/51/77/520295177.db2.gz OVQHRLLIASNIHG-CVEARBPZSA-N 1 1 374.485 2.903 20 5 FFBDMO Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1C ZINC000603659051 520337508 /nfs/dbraw/zinc/33/75/08/520337508.db2.gz UGOKHXACJLLPPF-TZMCWYRMSA-N 1 1 369.487 2.610 20 5 FFBDMO CCN(C(=O)CSc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597945623 520343713 /nfs/dbraw/zinc/34/37/13/520343713.db2.gz KDNGEUIOBCSDBU-GFCCVEGCSA-N 1 1 357.863 2.893 20 5 FFBDMO C[N@@H+](Cc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)sc2c1)C1CC1 ZINC000598027395 520384696 /nfs/dbraw/zinc/38/46/96/520384696.db2.gz HXYGDVNGSQEMOE-UHFFFAOYSA-N 1 1 372.410 2.774 20 5 FFBDMO CCN(C(=O)CCOc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000598040315 520389780 /nfs/dbraw/zinc/38/97/80/520389780.db2.gz OUUDFTOSPCUJAC-CQSZACIVSA-N 1 1 369.849 2.960 20 5 FFBDMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592492578 520416679 /nfs/dbraw/zinc/41/66/79/520416679.db2.gz AXYQFCXKWFQABD-OAGGEKHMSA-N 1 1 360.458 2.633 20 5 FFBDMO CCOCCC[N@H+]1CC[C@H](NCc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000595439691 520472237 /nfs/dbraw/zinc/47/22/37/520472237.db2.gz KCMCNHWRIFMGTP-YOEHRIQHSA-N 1 1 353.438 2.961 20 5 FFBDMO COC(=O)C[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)c1ccncc1 ZINC000595486455 520501926 /nfs/dbraw/zinc/50/19/26/520501926.db2.gz NJIGNUGYOFCQLP-GOSISDBHSA-N 1 1 359.382 2.567 20 5 FFBDMO C[N@H+]1CC[C@]2(C1)CCCN(Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595507979 520518859 /nfs/dbraw/zinc/51/88/59/520518859.db2.gz SNFIQDOUHLSTPP-SFHVURJKSA-N 1 1 357.414 2.563 20 5 FFBDMO CN(C(=O)NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000610104850 520539706 /nfs/dbraw/zinc/53/97/06/520539706.db2.gz YUNOXEBULLVPOX-GOSISDBHSA-N 1 1 360.458 2.796 20 5 FFBDMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C[C@H]1C ZINC000610135390 520554348 /nfs/dbraw/zinc/55/43/48/520554348.db2.gz RADXFTVMNWARDZ-HIFRSBDPSA-N 1 1 369.487 2.705 20 5 FFBDMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000604446364 520564899 /nfs/dbraw/zinc/56/48/99/520564899.db2.gz ZAWOIBHAQGLHCH-YUTCNCBUSA-N 1 1 367.833 2.759 20 5 FFBDMO CCC[N@H+]1CC[C@H](NC(=O)c2cc(Br)c(C)c([N+](=O)[O-])c2)C1 ZINC000598343923 520565639 /nfs/dbraw/zinc/56/56/39/520565639.db2.gz YNCBBYBQNKSDSL-LBPRGKRZSA-N 1 1 370.247 2.880 20 5 FFBDMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000595585130 520569910 /nfs/dbraw/zinc/56/99/10/520569910.db2.gz LPJGAHTYVKANKA-CQSZACIVSA-N 1 1 368.865 2.963 20 5 FFBDMO O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC[N@@H+](C[C@H]2CCCO2)CC1 ZINC000604489597 520577546 /nfs/dbraw/zinc/57/75/46/520577546.db2.gz OZNSSNXTLAZZDX-CQSZACIVSA-N 1 1 367.833 2.575 20 5 FFBDMO Cc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000604508527 520582473 /nfs/dbraw/zinc/58/24/73/520582473.db2.gz HMKQSHPLOWIPJF-AWEZNQCLSA-N 1 1 353.426 2.678 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N ZINC000604529729 520589816 /nfs/dbraw/zinc/58/98/16/520589816.db2.gz KIULXPPPBDIJJX-UHFFFAOYSA-N 1 1 369.356 2.740 20 5 FFBDMO Cc1[nH+]ccn1-c1ccccc1CNC(=O)CNc1ccccc1[N+](=O)[O-] ZINC000604529742 520589855 /nfs/dbraw/zinc/58/98/55/520589855.db2.gz MFJKMSXGKKGZLW-UHFFFAOYSA-N 1 1 365.393 2.817 20 5 FFBDMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000604535301 520593532 /nfs/dbraw/zinc/59/35/32/520593532.db2.gz VALISBMOVZYRIE-GOSISDBHSA-N 1 1 368.437 2.860 20 5 FFBDMO CCCN(C(=O)c1ccc([N+](=O)[O-])cc1Br)[C@H]1CC[N@@H+](C)C1 ZINC000592829604 520606399 /nfs/dbraw/zinc/60/63/99/520606399.db2.gz RWBRGTZUILYFBM-LBPRGKRZSA-N 1 1 370.247 2.914 20 5 FFBDMO COC(=O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000595668241 520635671 /nfs/dbraw/zinc/63/56/71/520635671.db2.gz KPPXDCLSSWUNLS-UHFFFAOYSA-N 1 1 363.414 2.731 20 5 FFBDMO COC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595682566 520646425 /nfs/dbraw/zinc/64/64/25/520646425.db2.gz BHYVBTZAWCCFDP-SFHVURJKSA-N 1 1 373.409 2.544 20 5 FFBDMO CC(C)N(C)c1ccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1 ZINC000601148895 520659301 /nfs/dbraw/zinc/65/93/01/520659301.db2.gz HJNAHXOBANUJDW-LJQANCHMSA-N 1 1 358.442 2.832 20 5 FFBDMO C[N@@H+](CC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCC1 ZINC000610392455 520663459 /nfs/dbraw/zinc/66/34/59/520663459.db2.gz PRJRCHUGMUWJIF-UHFFFAOYSA-N 1 1 374.363 2.626 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1 ZINC000593031407 520694688 /nfs/dbraw/zinc/69/46/88/520694688.db2.gz VZWVNRARLRIRBC-IEBWSBKVSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(CN[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1 ZINC000593031407 520694696 /nfs/dbraw/zinc/69/46/96/520694696.db2.gz VZWVNRARLRIRBC-IEBWSBKVSA-N 1 1 369.421 2.916 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c1 ZINC000593034661 520696683 /nfs/dbraw/zinc/69/66/83/520696683.db2.gz QTPIPGGLFRSXQI-SJLPKXTDSA-N 1 1 356.378 2.689 20 5 FFBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c1 ZINC000593034661 520696686 /nfs/dbraw/zinc/69/66/86/520696686.db2.gz QTPIPGGLFRSXQI-SJLPKXTDSA-N 1 1 356.378 2.689 20 5 FFBDMO COc1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1F ZINC000595754160 520699598 /nfs/dbraw/zinc/69/95/98/520699598.db2.gz VNQSEWIRIBXRDB-MRXNPFEDSA-N 1 1 361.373 2.741 20 5 FFBDMO O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000598562526 520707990 /nfs/dbraw/zinc/70/79/90/520707990.db2.gz VVYUUDFFOQRPOY-CQSZACIVSA-N 1 1 356.426 2.928 20 5 FFBDMO COc1ccc(C[C@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000593085568 520735145 /nfs/dbraw/zinc/73/51/45/520735145.db2.gz ZPEVWOQCZWUDNE-QGZVFWFLSA-N 1 1 371.437 2.862 20 5 FFBDMO Cc1ccc(S(=O)(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c(C)c1[N+](=O)[O-] ZINC000598613887 520743693 /nfs/dbraw/zinc/74/36/93/520743693.db2.gz ZIAWBVKWQWLJSW-HNNXBMFYSA-N 1 1 369.487 2.707 20 5 FFBDMO COC(=O)c1ccnc(NCc2cc(C)[nH+]c(N3CCCC3)c2)c1[N+](=O)[O-] ZINC000598627678 520749822 /nfs/dbraw/zinc/74/98/22/520749822.db2.gz WRAKESMXRAIETO-UHFFFAOYSA-N 1 1 371.397 2.692 20 5 FFBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595901289 520808761 /nfs/dbraw/zinc/80/87/61/520808761.db2.gz UUEAVHDNCMVHTI-GDBMZVCRSA-N 1 1 360.458 2.633 20 5 FFBDMO O=C(CC[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccc([N+](=O)[O-])cc1 ZINC000595910405 520814797 /nfs/dbraw/zinc/81/47/97/520814797.db2.gz PPVXZYQXZAUCPB-KDURUIRLSA-N 1 1 359.426 2.816 20 5 FFBDMO CC[NH+]1CCN(C[C@H](C)CNc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596083289 520903049 /nfs/dbraw/zinc/90/30/49/520903049.db2.gz ZPBIRIQJERWDAI-CYBMUJFWSA-N 1 1 370.881 2.942 20 5 FFBDMO CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596145625 520938705 /nfs/dbraw/zinc/93/87/05/520938705.db2.gz UWBJMEJNQVRMAP-MRXNPFEDSA-N 1 1 368.437 2.652 20 5 FFBDMO COC(=O)c1c(Cl)c(N[C@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000596160221 520944735 /nfs/dbraw/zinc/94/47/35/520944735.db2.gz BEXFBBZZSRQGTP-SKDRFNHKSA-N 1 1 353.806 2.929 20 5 FFBDMO CC[N@@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088104 520978781 /nfs/dbraw/zinc/97/87/81/520978781.db2.gz CSBDSTFLWPNUJF-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO CC[N@H+]1CCN(C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)C[C@H]1C ZINC000611088104 520978787 /nfs/dbraw/zinc/97/87/87/520978787.db2.gz CSBDSTFLWPNUJF-MRXNPFEDSA-N 1 1 374.485 2.997 20 5 FFBDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1c(Br)cccc1[N+](=O)[O-] ZINC000599074194 521016234 /nfs/dbraw/zinc/01/62/34/521016234.db2.gz UDNIHFPFJCGIAD-LLVKDONJSA-N 1 1 370.247 2.962 20 5 FFBDMO COc1ccccc1[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000611185151 521029800 /nfs/dbraw/zinc/02/98/00/521029800.db2.gz LZEMHSSFJQKBBZ-QGZVFWFLSA-N 1 1 357.410 2.992 20 5 FFBDMO COc1cc(C[N@H+]2CC[C@]3(C2)C(=O)Nc2ccccc23)ccc1[N+](=O)[O-] ZINC000614584055 521034336 /nfs/dbraw/zinc/03/43/36/521034336.db2.gz VKYXLBCDBIUNIF-LJQANCHMSA-N 1 1 353.378 2.699 20 5 FFBDMO O=C(C[NH+]1CCC(c2cccnc2)CC1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000611258953 521064098 /nfs/dbraw/zinc/06/40/98/521064098.db2.gz MTTWDVUKSRNEBI-UHFFFAOYSA-N 1 1 366.421 2.759 20 5 FFBDMO C[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC12CCC2 ZINC000611303372 521091067 /nfs/dbraw/zinc/09/10/67/521091067.db2.gz LIGMGMWEUKRZBT-GFCCVEGCSA-N 1 1 361.398 2.774 20 5 FFBDMO C[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)CC12CCC2 ZINC000611303372 521091074 /nfs/dbraw/zinc/09/10/74/521091074.db2.gz LIGMGMWEUKRZBT-GFCCVEGCSA-N 1 1 361.398 2.774 20 5 FFBDMO CCCCn1cc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)n1 ZINC000611346365 521110978 /nfs/dbraw/zinc/11/09/78/521110978.db2.gz SAFLPZHFXWYXGS-UHFFFAOYSA-N 1 1 360.414 2.961 20 5 FFBDMO CC[N@H+]1CCN(Cc2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000611518461 521197799 /nfs/dbraw/zinc/19/77/99/521197799.db2.gz AWWDKOQOWXWAOW-LBPRGKRZSA-N 1 1 373.400 2.773 20 5 FFBDMO CN(C(=O)c1c(Br)cccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000599442116 521226066 /nfs/dbraw/zinc/22/60/66/521226066.db2.gz QGCODQGTWMDPIP-LLVKDONJSA-N 1 1 368.231 2.666 20 5 FFBDMO COC(=O)[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000599668587 521381223 /nfs/dbraw/zinc/38/12/23/521381223.db2.gz LQFVFFFJAARYOZ-INIZCTEOSA-N 1 1 356.378 2.746 20 5 FFBDMO COC(=O)[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000599668587 521381227 /nfs/dbraw/zinc/38/12/27/521381227.db2.gz LQFVFFFJAARYOZ-INIZCTEOSA-N 1 1 356.378 2.746 20 5 FFBDMO Cc1cc(N2CCN(C[C@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611918569 521392413 /nfs/dbraw/zinc/39/24/13/521392413.db2.gz CUCDJBZUHWZFNX-MRXNPFEDSA-N 1 1 356.426 2.752 20 5 FFBDMO COC(=O)C1C[C@@H](C)[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000599711024 521419855 /nfs/dbraw/zinc/41/98/55/521419855.db2.gz TZARDPBBGUKEDX-VXGBXAGGSA-N 1 1 374.397 2.807 20 5 FFBDMO COC1CC[NH+](CCNCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602586470 521424423 /nfs/dbraw/zinc/42/44/23/521424423.db2.gz CFDULNOTSHSUSW-UHFFFAOYSA-N 1 1 361.364 2.814 20 5 FFBDMO COc1cccc(C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]2CCCO2)c1 ZINC000602762954 521518982 /nfs/dbraw/zinc/51/89/82/521518982.db2.gz ICMHJBYCDSRMSF-GOSISDBHSA-N 1 1 374.441 2.790 20 5 FFBDMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000602794604 521535795 /nfs/dbraw/zinc/53/57/95/521535795.db2.gz JJFZJMPRKUXEBX-OAHLLOKOSA-N 1 1 354.414 2.614 20 5 FFBDMO O=C1CC[C@H]2C[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC[C@H]2N1 ZINC000597204844 521572858 /nfs/dbraw/zinc/57/28/58/521572858.db2.gz GGAOTVBBYQQQIC-WMLDXEAASA-N 1 1 355.394 2.955 20 5 FFBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H](CC(N)=O)c1ccccc1 ZINC000619515865 521605072 /nfs/dbraw/zinc/60/50/72/521605072.db2.gz XEOREABVEBVZFC-GOSISDBHSA-N 1 1 357.410 2.912 20 5 FFBDMO Cc1cc(N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062104 521613743 /nfs/dbraw/zinc/61/37/43/521613743.db2.gz CIILWMXJJHPWRE-YGRLFVJLSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1cc(N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c(Br)cc1[N+](=O)[O-] ZINC000616062104 521613747 /nfs/dbraw/zinc/61/37/47/521613747.db2.gz CIILWMXJJHPWRE-YGRLFVJLSA-N 1 1 358.236 2.797 20 5 FFBDMO Cc1cc(OCC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ccc1[N+](=O)[O-] ZINC000619537113 521757266 /nfs/dbraw/zinc/75/72/66/521757266.db2.gz VKGVQBQTUPSNBJ-HNAYVOBHSA-N 1 1 373.453 2.757 20 5 FFBDMO COc1ccc(C(=O)NC[C@@H](c2ccco2)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000027334253 536742924 /nfs/dbraw/zinc/74/29/24/536742924.db2.gz KBXXTPWBVFGCQK-HNNXBMFYSA-N 1 1 359.382 2.763 20 5 FFBDMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2ccnc(NC)c2[N+](=O)[O-])C1 ZINC000517048163 562073318 /nfs/dbraw/zinc/07/33/18/562073318.db2.gz MAYIULCAXDVXHL-CYBMUJFWSA-N 1 1 363.462 2.662 20 5 FFBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1-c1nn[nH]n1)C1CC1 ZINC000826499924 607524993 /nfs/dbraw/zinc/52/49/93/607524993.db2.gz FAYVRZRVQGEDSE-UHFFFAOYSA-N 1 1 350.382 2.940 20 5 FFBDMO COc1cc(-c2nn[nH]n2)ccc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000826169967 608553399 /nfs/dbraw/zinc/55/33/99/608553399.db2.gz KRZFFRLMWJXCKO-GFCCVEGCSA-N 1 1 368.397 2.943 20 5 FFBDMO